,Unnamed: 0,SAMPLE_KEY,BROAD_ID,PLATE_ID,WELL_POSITION,SITE,SAMPLE_ID,CPD_NAME,CPD_NAME_TYPE,SMILES,INCHIKEY,IMG_ERSyto,IMG_ERSytoBleed,IMG_Hoechst,IMG_Mito,IMG_Ph_golgi,IMG_CNT_CELLS,ROW_NR_LABEL_MAT
0,24208.0,25581-B14-2,BRD-K09658832-001-06-2,25581,B14,2,SA1861489,BRD-K09658832,BROAD_CPD_ID,COc1ccc(cc1)C(=O)Cn1nnc(n1)-c1cccs1,AAGGUCRASUJPPN-UHFFFAOYSA-N,cdp2w11_b14_s2_w257943f3f-f052-48ab-b01c-2505a97591cc,cdp2w11_b14_s2_w36b341626-96d9-48c0-a116-0b4c3321c984,cdp2w11_b14_s2_w15d7fc073-3140-419f-8e0b-2cf3fd3219a8,cdp2w11_b14_s2_w5cc6168ce-70c3-4cf6-acbf-6359305ca4ee,cdp2w11_b14_s2_w4efe28780-5737-4d5b-8ef4-ded3fe8d7cd5,80,8998
1,10335.0,25376-O03-1,BRD-K14836228-001-05-1,25376,O03,1,SA1860534,BRD-K14836228,BROAD_CPD_ID,CN(C)C(=O)Oc1c(C)cc(cc1C)C(=O)CS(=O)(=O)c1ccccc1,AAHUMVOTCJGEFN-UHFFFAOYSA-N,cdp2w10_o03_s1_w20affe877-dfa1-4f42-8ad9-909ca7384c98,cdp2w10_o03_s1_w329c56bad-418f-4aca-9a52-3b8e444cf016,cdp2w10_o03_s1_w164aa7d8f-bb14-4681-ac8c-629dad17a004,cdp2w10_o03_s1_w55b6d684d-36e6-4504-b610-a8ed49795971,cdp2w10_o03_s1_w4e629a2ed-2d50-43db-bbec-2e656cc05420,51,7317
2,5425.0,24312-I13-2,BRD-K51215422-001-02-3,24312,I13,2,SA82162,A-3,common,NCCNS(=O)(=O)c1cccc2c(Cl)cccc12,ACIMRXKJKQGBGL-UHFFFAOYSA-N,cdp2bioactives_i13_s2_w25c86b312-94aa-4d9d-a105-5dbc13ece11d,cdp2bioactives_i13_s2_w3d367f700-699a-4f8d-a853-f1971054e8e1,cdp2bioactives_i13_s2_w1a14380e2-e832-496c-833b-d29bf36f61e7,cdp2bioactives_i13_s2_w5bf51f2ed-0394-440f-aca1-822f6ced3586,cdp2bioactives_i13_s2_w4f9a6a03e-964d-45f4-87a5-7a3d5cf07d8a,138,1004
3,18657.0,25492-L03-1,BRD-K86410548-001-05-1,25492,L03,1,SA1859902,BRD-K86410548,BROAD_CPD_ID,Clc1ccc(COc2ccc(cc2)-c2nc(C#N)c(o2)N2CCOCC2)cc1,ACLJMBVYCCDWSD-UHFFFAOYSA-N,cdp2w10-au00024360_l03_s1_w2f4339d5a-9e70-4468-ba64-b99204ebc9a9,cdp2w10-au00024360_l03_s1_w395fa5128-bf84-4696-9609-c2a9d90bf41a,cdp2w10-au00024360_l03_s1_w11bffd3a0-bcf7-4066-b628-a90441026367,cdp2w10-au00024360_l03_s1_w5fac0d576-84c2-4fcd-bba7-6126215fa2ba,cdp2w10-au00024360_l03_s1_w464ff5478-0faf-4784-9bd1-970491f1de92,51,4128
4,16706.0,25435-N15-6,BRD-K55763533-001-05-7,25435,N15,6,SA1854847,BRD-K55763533,BROAD_CPD_ID,Cc1cccc(NNC(=O)C2CCC2)c1,ACTRZKFUNCFTJE-UHFFFAOYSA-N,cdp2w10_n15_s6_w2c28d4ccf-0ce4-4256-b776-f92ea1a607cd,cdp2w10_n15_s6_w3276bb77d-2c68-4fb9-901f-4763798969e8,cdp2w10_n15_s6_w16fc3c0f9-464a-4c2e-91b7-977138d2d395,cdp2w10_n15_s6_w5b1dd2140-fb6c-4323-ac2b-6821cb34a488,cdp2w10_n15_s6_w4188e7799-2bf5-4266-8568-fef758552b4d,76,5349
5,12312.0,25406-E22-4,BRD-A50454755-001-05-1,25406,E22,4,SA1862275,BRD-A50454755,BROAD_CPD_ID,COC(=O)CC1N(CCNC1=O)C(=S)NC(=O)c1sc2ccccc2c1Cl,ADOLTVMTEATKJU-UHFFFAOYSA-N,cdp2w10_e22_s4_w2a497000c-46a2-4bbb-a668-429feb81c7f7,cdp2w10_e22_s4_w32d5cba03-3155-46f5-bac8-c6bd574e7001,cdp2w10_e22_s4_w1ac55d096-3ec8-487c-b575-dfc94cabbe75,cdp2w10_e22_s4_w5a5b8d2c5-e63c-41d6-8d56-e0170d97027c,cdp2w10_e22_s4_w4bac21d2e-c956-42e3-9df4-6ffaa38eef0a,65,8441
6,16513.0,25435-D14-5,BRD-K17859412-001-06-4,25435,D14,5,SA1857327,BRD-K17859412,BROAD_CPD_ID,Cn1c2[nH]c(CNc3ccc(cc3)C(O)=O)nc2c(=O)n(C)c1=O,ADUXQWIKSOSSDH-UHFFFAOYSA-N,cdp2w10_d14_s5_w2b0d14e97-4fb5-4833-8a63-6a8e8e9727fd,cdp2w10_d14_s5_w3fe046a35-fa3d-4924-8c15-bfe66f4bc78a,cdp2w10_d14_s5_w17edebcfc-09d6-4a25-8724-312be6ee0c1f,cdp2w10_d14_s5_w5cba53529-0a38-47cd-a051-1b6c9dcde024,cdp2w10_d14_s5_w46651878c-1262-4e45-947c-015304d696e5,45,5289
7,52934.0,26204-H07-6,BRD-A96603750-001-05-4,26204,H07,6,SA1859414,BRD-A96603750,BROAD_CPD_ID,CC1CCOC(O1)c1coc2ccccc2c1=O,ADXCKCOKWMDXRE-UHFFFAOYSA-N,cdp2w9x2-au00026617_h07_s6_w2ea69c05b-2e2b-4140-9182-a5684e6880bc,cdp2w9x2-au00026617_h07_s6_w36f589bbb-ca65-4ad2-8bc4-3b293768975a,cdp2w9x2-au00026617_h07_s6_w1a565037d-b928-4a3a-80ef-47d499f9bd8d,cdp2w9x2-au00026617_h07_s6_w5e7aa32c7-dcf5-4d1c-8590-7254bd551830,cdp2w9x2-au00026617_h07_s6_w466acc0dc-dd6d-4f7f-af4a-8d123a8bfc52,72,3123
8,22870.0,25575-N03-2,BRD-K57588631-001-05-7,25575,N03,2,SA1855413,BRD-K57588631,BROAD_CPD_ID,Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)NNC(=O)COc1ccccc1,AEPOHJYRCYPODV-UHFFFAOYSA-N,cdp2w11_n03_s2_w26e7aab17-4ddc-4596-8b1e-0dc92fb66dae,cdp2w11_n03_s2_w31e359fac-a5a2-48fb-a711-36933d9b05d6,cdp2w11_n03_s2_w1567ab595-7325-461a-b1e0-896a4baf83ef,cdp2w11_n03_s2_w542b156da-00d4-4a0f-beed-d9e4fdf56519,cdp2w11_n03_s2_w4d0ece1e9-c8a5-470b-8984-2a3faa3252a0,71,2552
9,12655.0,25408-G19-5,BRD-K85358503-001-05-6,25408,G19,5,SA1854022,BRD-K85358503,BROAD_CPD_ID,[O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccc(F)cc1,AEXQSORQCYRTJF-UHFFFAOYSA-N,cdp2w10_g19_s5_w2d795f15a-e684-456d-a318-3247b67cb93a,cdp2w10_g19_s5_w3c65a4a2a-5b73-4291-903f-f4e08c54fa5f,cdp2w10_g19_s5_w1426ce3a5-47e9-4550-b682-124cb2dab734,cdp2w10_g19_s5_w5e7278a17-877a-4f1b-a6fc-0de92d2a205b,cdp2w10_g19_s5_w42a7577bd-d0c5-4787-ae60-94a4c59fd812,52,4265
10,14712.0,25424-F21-4,BRD-K43401718-001-05-6,25424,F21,4,SA1861758,BRD-K43401718,BROAD_CPD_ID,CCc1ccccc1NS(=O)(=O)c1ccc2ncc(C(=O)NCc3ccco3)c(O)c2c1,AGDUKHOZICPDPX-UHFFFAOYSA-N,cdp2w10_f21_s4_w2ff2328e4-679d-43ae-9df2-ad96ddd5fd9d,cdp2w10_f21_s4_w3023100a5-b1df-4a8f-b820-f54d5ff09d0e,cdp2w10_f21_s4_w1d4c0be39-747e-4c68-834a-da932ca662cb,cdp2w10_f21_s4_w550d6ec30-9376-4a8a-9ea2-58f0dffc24dd,cdp2w10_f21_s4_w4d700ed29-b3b6-4ea9-9ce2-e1e4c2be8071,57,8610
11,18874.0,25503-E15-2,BRD-A89671349-001-04-1,25503,E15,2,SA1852189,BRD-A89671349,BROAD_CPD_ID,CCOC(=O)c1c(C)n(Cc2ccccc2)c2ccc(OCC(O)Cn3nc(C)nc3C)cc12,AGFWYRJIAJSVTE-UHFFFAOYSA-N,cdp2w11-au00029680_e15_s2_w2a63dc771-083f-4fd3-8419-91db9b1cf796,cdp2w11-au00029680_e15_s2_w3baee4d0c-8c75-477a-b6c6-bdc7c6d78334,cdp2w11-au00029680_e15_s2_w1169b94a3-8b42-4651-ad5a-fddf6ed627be,cdp2w11-au00029680_e15_s2_w5ba7abb6a-6d1d-4873-b0c9-e3c69d7fb4a2,cdp2w11-au00029680_e15_s2_w4665894df-0de3-4d67-8e42-179976f2deca,60,6771
12,16155.0,25434-C20-1,BRD-K44697642-001-05-9,25434,C20,1,SA1860699,BRD-K44697642,BROAD_CPD_ID,Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c3ccccc3[N+]([O-])=O)cc2)n1,AGHRYYKCIBSXOG-UHFFFAOYSA-N,cdp2w10_c20_s1_w20de6d0f0-c529-40a1-8c2b-65cc0bb2d6e9,cdp2w10_c20_s1_w34f9a2a3a-319d-4107-981e-9d76e6773d2e,cdp2w10_c20_s1_w1c58f1d03-40fb-4a53-bf5f-e96c767c45fd,cdp2w10_c20_s1_w5cd14638c-2e75-4e80-884b-44d723eaf1e8,cdp2w10_c20_s1_w45cb364e5-c419-4c41-a871-5041120860d6,66,4373
13,23072.0,25576-H06-6,BRD-A13280254-001-05-2,25576,H06,6,SA1859426,BRD-A13280254,BROAD_CPD_ID,CC(=O)Nc1ccc(cc1)S(=O)(=O)C(C#N)c1nc2ccccc2nc1NCCN1CCOCC1,AGLRVQFITFFTRR-UHFFFAOYSA-N,cdp2w11_h06_s6_w229148c88-8029-414f-9518-c64a0f16d865,cdp2w11_h06_s6_w347a88c03-ddd6-47aa-bb09-63aab4143c36,cdp2w11_h06_s6_w18d6446c8-d6e7-4423-89fa-990db495be55,cdp2w11_h06_s6_w507087f75-0d80-4ee4-961f-4db394370d08,cdp2w11_h06_s6_w484c61110-5c7a-4e32-8376-3621d7b941ed,61,7274
14,16394.0,25434-O12-6,BRD-K66660676-001-06-7,25434,O12,6,SA1855523,BRD-K66660676,BROAD_CPD_ID,N#Cc1cn(CCCOc2ccccc2)c2ccccc12,AGPINAKWCPQLMO-UHFFFAOYSA-N,cdp2w10_o12_s6_w2d32ff7cd-5603-4bf0-a989-bcb2a585bd20,cdp2w10_o12_s6_w398672891-cfb8-4b8f-af43-0e6f412a6e02,cdp2w10_o12_s6_w185cb3f6e-b2b0-480a-833a-7ed71d854d0f,cdp2w10_o12_s6_w52ef1efc7-58c3-40e6-9134-c98e237d2ab0,cdp2w10_o12_s6_w419795fbd-4781-4cc9-ba79-bcf4fcd50334,47,5180
15,16564.0,25435-H08-2,BRD-K94166726-001-05-3,25435,H08,2,SA1861592,BRD-K94166726,BROAD_CPD_ID,COc1ccc(cc1)-c1nsc2c(ncnc12)N1CCN(CC1)C(=O)c1ccco1,AGQAENFTCGWHKW-UHFFFAOYSA-N,cdp2w10_h08_s2_w2ceba0bc6-e745-44fd-b8b3-27e03cc6c886,cdp2w10_h08_s2_w30d2c4726-f614-44bf-b620-20928670917d,cdp2w10_h08_s2_w10fc5e254-f13f-44c0-9def-26b95f90e4aa,cdp2w10_h08_s2_w5ddd5d259-45c4-4c93-b87c-59804254051d,cdp2w10_h08_s2_w4735b1211-13e0-4746-877f-c3dc51a6bf12,53,4952
16,14038.0,25420-B08-2,BRD-K11710893-001-05-5,25420,B08,2,SA1859296,BRD-K11710893,BROAD_CPD_ID,Fc1cccc2sc(NNC(=O)COc3ccccc3)nc12,AHJFWPADOKSKIE-UHFFFAOYSA-N,cdp2w10_b08_s2_w2e7247a53-70e3-42a9-a16e-ce0c1e836867,cdp2w10_b08_s2_w34e967596-ba9d-4018-8da0-a8ac8e51abb9,cdp2w10_b08_s2_w148a6b2b6-7c99-458d-a720-22bc6f427bd5,cdp2w10_b08_s2_w5156a38c5-4a1e-4e36-b5a6-699a4d758892,cdp2w10_b08_s2_w44073c785-4b29-48eb-9672-36e46553ba5d,59,8643
17,6794.0,24352-H24-3,BRD-K09203354-001-02-4,24352,H24,3,SA58568,7-hydroxy-3-(2-methoxyphenyl)chromen-4-one,to-be-curated,COc1ccccc1-c1coc2cc(O)ccc2c1=O,AHLHZSCENKUUSF-UHFFFAOYSA-N,cdp2bioactives_h24_s3_w29775b3e2-841e-42c4-8cd5-3411e92cff09,cdp2bioactives_h24_s3_w3abe43e20-4b27-42be-8048-dde3235b7cff,cdp2bioactives_h24_s3_w1dcbc9558-b0d8-4ca0-8365-79558af20a8c,cdp2bioactives_h24_s3_w5aeec0a6a-5fb9-4fe6-99d3-2ba7f077aeaf,cdp2bioactives_h24_s3_w47de57e1f-9814-4149-b96e-8142f87f151a,165,1267
18,45796.0,26058-I08-2,BRD-A57982699-001-05-3,26058,I08,2,SA1855872,BRD-A57982699,BROAD_CPD_ID,CCN1CCCC1Cn1cnc2c(nc3cccc(Cl)c23)c1O,AHNGFMANMVPMLG-UHFFFAOYSA-N,cdp2w9x2_i08_s2_w2adc91058-84cb-4579-852c-28525f829f53,cdp2w9x2_i08_s2_w3ea41f769-64c0-4e16-abe6-aa4ee4d726f6,cdp2w9x2_i08_s2_w191d41376-4730-4ccd-88fd-3d2958ecbb7e,cdp2w9x2_i08_s2_w5fc44ec67-549d-4a5f-8a43-8901e89f4bfa,cdp2w9x2_i08_s2_w41438d644-8f3f-4639-8aa8-a5f2554b94a5,57,8522
20,45707.0,26058-D12-3,BRD-K63912037-001-05-1,26058,D12,3,SA1855730,BRD-K63912037,BROAD_CPD_ID,[O-][N+](=O)c1ccc(s1)N1CCCCC1,AHXNCGUEOCEZLI-UHFFFAOYSA-N,cdp2w9x2_d12_s3_w2377b5172-cc33-43e9-a431-d9bde2383bec,cdp2w9x2_d12_s3_w3799fe105-8a04-4f1a-8265-4cbf3cd4c7b8,cdp2w9x2_d12_s3_w191eba00b-2e69-450f-9484-dfb23b19167f,cdp2w9x2_d12_s3_w5cd87c92e-6a42-48f3-a531-7158ab66ce64,cdp2w9x2_d12_s3_w4615d93f5-f9ab-4de8-863f-fe537ea7b8f4,62,7125
21,14352.0,25422-B22-4,BRD-K28657502-001-05-2,25422,B22,4,SA1852388,BRD-K28657502,BROAD_CPD_ID,CCc1ccc(s1)S(=O)(=O)NCCc1csc(n1)-c1ccccc1,AIJBMSNYDXEQQX-UHFFFAOYSA-N,cdp2w10_b22_s4_w218894b3f-e24d-41f3-a972-e63b78d53e41,cdp2w10_b22_s4_w36630283d-f964-40a3-8e02-41fb25cb93c5,cdp2w10_b22_s4_w16046edd6-8940-4671-8abc-c3d47186e3b5,cdp2w10_b22_s4_w5c0f3115f-5562-4f43-b61f-9029cb884a9e,cdp2w10_b22_s4_w48d1a7249-0615-4607-94be-7295c8208f03,52,4327
22,19812.0,25565-C20-4,BRD-K98291134-001-05-1,25565,C20,4,SA1858828,BRD-K98291134,BROAD_CPD_ID,Cc1ccc(c(C)c1)-n1ncc2c(O)ncnc12,AIQYAGCWQZIFBM-UHFFFAOYSA-N,cdp2w11_c20_s4_w20f27a780-b5d4-47a2-b6a4-aa0457a71efd,cdp2w11_c20_s4_w3da2e2d45-b23c-4013-983e-92e3336b0f40,cdp2w11_c20_s4_w11ba0888b-1274-4fac-a51f-4de29291504f,cdp2w11_c20_s4_w5fb76d285-59d1-40ad-a50d-01436408129a,cdp2w11_c20_s4_w4512cb7b5-fb5f-4555-81fa-5a2ccfb3bc9b,71,4656
23,11355.0,25391-A09-1,BRD-K93331292-001-01-7,25391,A09,1,SA1856429,BRD-K93331292,BROAD_CPD_ID,Nc1nc2ccccc2n1S(=O)(=O)c1ccc(cc1)[N+]([O-])=O,AISUMVRDEXUUBA-UHFFFAOYSA-N,cdp2w10_a09_s1_w2a0383d29-8dbe-462f-95a0-9e960b3929fe,cdp2w10_a09_s1_w3c3fe917b-708e-4b36-9bf7-3fa2a7f6b82c,cdp2w10_a09_s1_w176079e2d-db2e-40de-9870-c64419620c92,cdp2w10_a09_s1_w5e55e0b0d-8078-4c98-9f56-0261ab5f3e3f,cdp2w10_a09_s1_w46b3eb0dc-2cc6-44c6-a020-d4120723ac20,45,4220
24,29804.0,25643-F11-6,BRD-K72500001-001-05-5,25643,F11,6,SA1853876,BRD-K72500001,BROAD_CPD_ID,Cc1nn(-c2ccccc2)c2sc(cc12)C(=O)NCCN1CCOCC1,AITKNUAVRFKATC-UHFFFAOYSA-N,cdp2w12_f11_s6_w28c8a42fd-ef17-4cff-8b9c-83782d77e27b,cdp2w12_f11_s6_w3622cd03f-4ca4-4e91-a649-94db422665af,cdp2w12_f11_s6_w178711628-b9a1-4a48-8f8f-93b40bda1dc8,cdp2w12_f11_s6_w559e7248a-a5fa-413b-8f79-461309e1068a,cdp2w12_f11_s6_w4e46f47cb-cd3c-43c4-83d8-31688e6c8b6e,53,8420
25,44476.0,25988-O22-2,BRD-K59419204-001-01-9,25988,O22,2,SA792344,AM 281,to-be-curated,Cc1c(nn(c1-c1ccc(I)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCOCC1,AJFFBPZYXRNAIC-UHFFFAOYSA-N,cdp2w8x2_o22_s2_w287b5fe6a-e9e5-41d2-8ab2-41e7b08be36c,cdp2w8x2_o22_s2_w3c62db2dd-ddf3-4ae8-be37-2cf368f534b6,cdp2w8x2_o22_s2_w1f44515d2-0ee4-4345-bd0d-065bc7bb1f6f,cdp2w8x2_o22_s2_w5efb25cfb-b703-4e09-98e2-3ecf08c9727e,cdp2w8x2_o22_s2_w4fa5cf794-15e9-46bb-953b-29bb118ccd23,29,1210
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36,43508.0,25985-F12-6,BRD-K47635719-001-03-9,25985,F12,6,SA82861,dexamethasone acetate,primary-common,C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O,AKUJBENLRBOFTD-RPRRAYFGSA-N,cdp2w8x2_f12_s6_w2d860a212-2ecc-468c-9c02-57981b3d4429,cdp2w8x2_f12_s6_w34a9813d4-4bfb-4587-839b-c864d9c80f50,cdp2w8x2_f12_s6_w1798a0c26-2b4c-4e1c-bd46-02b57726a3c4,cdp2w8x2_f12_s6_w5fb6aa41c-684b-4467-9087-a1bb978dff43,cdp2w8x2_f12_s6_w48f2b6634-caa2-48d3-82e5-02679a7f940b,87,7432
37,29844.0,25643-G17-4,BRD-K06856626-001-06-5,25643,G17,4,SA1860949,BRD-K06856626,BROAD_CPD_ID,COc1ccccc1N=C(S)NNC(=O)c1cc(C)n(C)n1,AKYGOEVGMSSOLO-UHFFFAOYSA-N,cdp2w12_g17_s4_w2efe0656d-497e-4da1-bcdf-c377ad524b62,cdp2w12_g17_s4_w36a8bea0f-2074-4b59-b953-9bb331f08c32,cdp2w12_g17_s4_w10730e091-3185-462b-b395-e351471a92e4,cdp2w12_g17_s4_w544c83db0-b596-49aa-b108-6e7afcbb3203,cdp2w12_g17_s4_w48aea6d37-6ef3-4e38-ad68-8e455d8c1ac5,41,2191
38,11722.0,25392-D15-2,BRD-K61919649-001-05-8,25392,D15,2,SA1855453,BRD-K61919649,BROAD_CPD_ID,Cc1cc(=O)oc(C)c1C(=O)NCc1c(F)cc(F)cc1F,ALIHKYQHSUEULO-UHFFFAOYSA-N,cdp2w10_d15_s2_w260b37afb-403c-4f10-8fb1-ace6939a10a3,cdp2w10_d15_s2_w34d6322b0-98ef-4cfc-9c1f-2876af3b3fc8,cdp2w10_d15_s2_w1296777fb-f3ec-4d5d-90bd-53b6bcf2fb19,cdp2w10_d15_s2_w5b74535d9-a95b-4c2d-bc01-ebce3aa1191a,cdp2w10_d15_s2_w4f82b2106-2802-497b-985f-5a15ccf14732,31,5673
39,18364.0,25490-N05-2,BRD-K61680257-001-07-5,25490,N05,2,SA1855976,BRD-K61680257,BROAD_CPD_ID,Brc1ccc(CSc2nnc(o2)-c2cccnc2)cc1,ALJZALDUCAILCZ-UHFFFAOYSA-N,cdp2w10-au00024359_n05_s2_w23226fb1b-1b64-4b97-aaf1-9d31b2277f2e,cdp2w10-au00024359_n05_s2_w3ff28b15a-19fb-4f39-b0c8-ddce0b45ffe7,cdp2w10-au00024359_n05_s2_w1d4c87c45-1f36-4f51-9fa1-294637e67495,cdp2w10-au00024359_n05_s2_w50e5e1fd8-4657-4bea-8d29-35b7eda917ef,cdp2w10-au00024359_n05_s2_w438e3a1e8-bd9e-441e-9672-ddefdfb95ba6,58,5256
40,21286.0,25569-M10-2,BRD-K35549037-001-06-4,25569,M10,2,SA1852286,BRD-K35549037,BROAD_CPD_ID,C(Sc1ccccc1)c1cc(no1)-c1ccccc1,ALOSNTJZINUQLV-UHFFFAOYSA-N,cdp2w11_m10_s2_w2a102002d-aa88-49c3-aab5-cb8b5942f5c8,cdp2w11_m10_s2_w31bd12e70-08f3-4637-be2c-a7109fd288bd,cdp2w11_m10_s2_w1fcf477e2-9593-4cb1-82c8-a73760f78fd8,cdp2w11_m10_s2_w592c431d9-b75f-4b9a-ac40-8651b0a37ca3,cdp2w11_m10_s2_w44be8e28e-0854-4d1c-afe4-0bd4dea7b30d,91,5932
41,15930.0,25432-G17-4,BRD-A37077777-001-05-2,25432,G17,4,SA1861496,BRD-A37077777,BROAD_CPD_ID,COc1cccc(C2Nc3ccccc3C(=O)N2O)c1O,ALSPBPOXXIUURS-UHFFFAOYSA-N,cdp2w10_g17_s4_w24f8fdadb-fe32-494e-b7a4-2ae7d8d792f7,cdp2w10_g17_s4_w34931b31b-510e-4d90-8562-2504bdd0cb8e,cdp2w10_g17_s4_w14f6a16ca-4c65-49ae-a952-79682014bc85,cdp2w10_g17_s4_w5ae8c4fb6-64ab-4596-a563-ebd8f4b41b37,cdp2w10_g17_s4_w44ddc8148-55c9-471b-a78e-b6825b3e5f6d,65,6376
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43,7183.0,24357-M19-2,BRD-K74186897-001-02-5,24357,M19,2,SA82844,cytisine,primary-common,O=c1cccc2[C@H]3CNC[C@H](C3)Cn12,ANJTVLIZGCUXLD-DTWKUNHWSA-N,cdp2bioactives_m19_s2_w2f6253a04-b680-41f7-a834-dac557c678ee,cdp2bioactives_m19_s2_w392fae97f-a339-4f61-ad91-19cf6ceda80a,cdp2bioactives_m19_s2_w134bce9f9-73c3-44e7-b536-62dd7930033e,cdp2bioactives_m19_s2_w5c3f9e5af-d85a-4feb-996a-ea887e707044,cdp2bioactives_m19_s2_w4e55f49dc-df1a-465c-9cb0-7c0d421dc960,79,1237
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47,13328.0,25414-I16-6,BRD-A70582390-001-05-6,25414,I16,6,SA1852392,BRD-A70582390,BROAD_CPD_ID,Cc1ccc(cc1)C(NC(=O)C1CCCCC1)c1c(O)ccc2ccccc12,AOJYUCODXLAKOU-UHFFFAOYSA-N,cdp2w10_i16_s6_w211f62958-d3a6-476f-94da-eb130e491f88,cdp2w10_i16_s6_w3cb12c3bb-1705-4cd7-b74f-5e4184226dfe,cdp2w10_i16_s6_w1cee9f6cd-7d6c-4e99-84b5-1c050c9c4f9c,cdp2w10_i16_s6_w51c74437c-e3f7-4e99-8ea5-65aded8efddb,cdp2w10_i16_s6_w411c7148e-5206-43c4-8ac0-a425a7d8b3c4,48,3579
48,32265.0,25677-G14-1,BRD-A42306277-001-05-3,25677,G14,1,SA1854361,BRD-A42306277,BROAD_CPD_ID,CCn1c(NCCCO)nc2-c3ccccc3CC(C)(CC)c2c1=O,AORQFQRMBKGVPL-UHFFFAOYSA-N,cdp2w12_g14_s1_w2af0fa60d-64fa-4318-bf2d-bfc6a26a68cb,cdp2w12_g14_s1_w3da0a94a1-a3dd-4c48-8cd3-c7fecd2e238d,cdp2w12_g14_s1_w137a01caf-a8f8-4fb8-ab28-4822e5f13ad4,cdp2w12_g14_s1_w50a6aafa2-2fcf-46a5-beb4-d2016a222fda,cdp2w12_g14_s1_w4c951b133-816d-420a-ada5-0f3fb1bf4fee,59,2024
49,48258.0,26115-K11-4,BRD-K34708533-001-06-6,26115,K11,4,SA1854515,BRD-K34708533,BROAD_CPD_ID,COc1ccc(cc1Br)\C=C\C(=O)N(C(C)C)C(C)C,APDMHZKESGQPPV-VQHVLOKHSA-N,cdp2w9x2_k11_s4_w26d358dce-4d2e-45a3-8464-2144f92c9cf3,cdp2w9x2_k11_s4_w368984cfd-93f4-478b-a5a9-a49f2845614a,cdp2w9x2_k11_s4_w1b4178de4-c0e8-4e62-8a4d-fa12f8348378,cdp2w9x2_k11_s4_w542f0f6ca-d015-47ee-9b88-718b63fb7f46,cdp2w9x2_k11_s4_w428c02d86-065c-4ae9-9b44-d06cd15537a7,77,3129
50,55868.0,26679-J23-6,BRD-K08031329-001-01-4,26679,J23,6,SA418467,BRD-K08031329,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)OCc2cn(CCCC1=O)nn2,APDMZOWNVCUUKT-BBTUJRGHSA-N,cdp2w13_j23_s6_w21cedb27a-ad7e-436c-a00b-f328c5e00891,cdp2w13_j23_s6_w3723a5176-eb4b-4a23-a06a-aaa11e982f91,cdp2w13_j23_s6_w1c9e3b0c4-a4f9-4017-86a6-943409127b16,cdp2w13_j23_s6_w5481aa731-504f-4636-9890-73e26d41c3d6,cdp2w13_j23_s6_w45cb27a24-8bc6-4526-bf3a-bc5f2fffd2e2,91,10015
51,53731.0,26216-D05-5,BRD-K29950543-001-05-1,26216,D05,5,SA1860549,BRD-K29950543,BROAD_CPD_ID,CN(Cc1ccccc1F)Cc1cc(=O)oc2cc(O)c(Cl)cc12,APEBDJMZLASLIL-UHFFFAOYSA-N,cdp2w9x2_d05_s5_w232278d04-fa6e-4356-9f0c-11ad9480cb11,cdp2w9x2_d05_s5_w3d608cd52-7e09-4548-8898-380a8c434e16,cdp2w9x2_d05_s5_w176c04440-b87e-425d-9bb2-af7ac5a647b9,cdp2w9x2_d05_s5_w553f0a512-d0ef-4c65-bad0-4c5da67664a1,cdp2w9x2_d05_s5_w44b281ad3-3bec-4a63-947d-9f57bb595346,51,7706
52,15599.0,25430-E17-3,BRD-K52437089-001-06-7,25430,E17,3,SA1854974,BRD-K52437089,BROAD_CPD_ID,CNC(=O)NC(=S)NC(=O)c1ccccc1Cl,APLGEAWUXWPDAF-UHFFFAOYSA-N,cdp2w10_e17_s3_w2648e052d-9da0-4fb2-ad82-472dc82303ba,cdp2w10_e17_s3_w33c5a42c7-65cf-49d3-a76e-68e1dfe82487,cdp2w10_e17_s3_w1987c3175-5294-4b06-b8ad-e244b9a5f1c0,cdp2w10_e17_s3_w58830c08c-4c89-4c4e-9a22-73d7a5b3e666,cdp2w10_e17_s3_w44414d1c4-a0fa-47a5-ae0c-7d9acc7b3652,47,5650
53,16354.0,25434-M08-2,BRD-K73143512-001-04-8,25434,M08,2,SA1856141,BRD-K73143512,BROAD_CPD_ID,CCc1cc(-c2n[nH]c(C)c2-c2nc3ccccc3n2C)c(O)cc1O,APQCBAKMOBMKMP-UHFFFAOYSA-N,cdp2w10_m08_s2_w25864f11b-abe8-4683-bfa6-3a7255cab95f,cdp2w10_m08_s2_w30b8fe8a3-0031-4d3f-905e-ab400bab9282,cdp2w10_m08_s2_w138bdaa80-2f80-459f-8ef0-093cab5cba59,cdp2w10_m08_s2_w52cb63d3e-d29f-4734-8153-d3c184062f7c,cdp2w10_m08_s2_w4913a86e4-093e-441e-940f-4ed756a47f9c,45,7795
54,56378.0,26765-C17-6,BRD-K37638153-001-01-2,26765,C17,6,SA1017531,BRD-K37638153,BROAD_CPD_ID,CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cccc(c1)C#N)C(=O)NCCN1CCCCC1,APUVMPYXYOEPCI-IPKWWJLYSA-N,cdp2w13_c17_s6_w2c2e49bfc-42b0-401c-a12f-55aa8a01a264,cdp2w13_c17_s6_w398651982-4666-4be3-8f22-d34b93857808,cdp2w13_c17_s6_w1a9db2c75-f8af-4524-a007-74349d2ab5ca,cdp2w13_c17_s6_w5c8ea9d26-94a2-45a7-95dc-5822c76e023d,cdp2w13_c17_s6_w4360f2576-a773-4776-baaa-743874abbab8,104,10519
55,33330.0,25680-K06-4,BRD-K52580889-001-06-6,25680,K06,4,SA1853181,BRD-K52580889,BROAD_CPD_ID,[O-][N+](=O)c1[nH]nc(C(=O)NCc2ccc(Cl)cc2)c1Cl,APWLSOMMVQHYQM-UHFFFAOYSA-N,cdp2w12_k06_s4_w23aedc58b-604e-4e33-a37f-4dd310047cc7,cdp2w12_k06_s4_w3ccbbafb7-9e7c-4280-a417-e16ec311cc04,cdp2w12_k06_s4_w195b3a788-6dc7-4af2-b7ea-d29b546e4791,cdp2w12_k06_s4_w5652ceb11-62a1-44ae-a7f9-bd820f7f02e0,cdp2w12_k06_s4_w427dea829-49af-4d96-8d9a-557ff650ee9c,87,2597
56,7023.0,24357-B10-4,BRD-K59339270-001-01-8,24357,B10,4,SA792088,AH-6809,to-be-curated,CC(C)Oc1ccc2c(c1)oc1ccc(cc1c2=O)C(O)=O,AQFFXPQJLZFABJ-UHFFFAOYSA-N,cdp2bioactives_b10_s4_w252ebd9e9-8b65-4524-8e59-efc51dccbaac,cdp2bioactives_b10_s4_w35ef44a1b-de26-4691-9120-a3df783abe48,cdp2bioactives_b10_s4_w1a2bd1882-67bf-4542-8761-8bc55565b22f,cdp2bioactives_b10_s4_w5e42c0ce9-2a61-4f52-accb-c25652a74375,cdp2bioactives_b10_s4_w4c183d3cb-2a4c-43f3-9baf-771c0363b432,88,1928
57,54984.0,26271-A20-4,BRD-K84794783-001-07-0,26271,A20,4,SA1854369,BRD-K84794783,BROAD_CPD_ID,Cc1cc(no1)-n1c(C)cc(C(=O)CCl)c1C,AQWWIOJBPOBUDQ-UHFFFAOYSA-N,cdp2w9x2-au00026606_a20_s4_w215fbc1d6-afbe-46c9-9946-e31a9c4ee5aa,cdp2w9x2-au00026606_a20_s4_w3f42cf0ac-857f-49c5-9acf-5041f4134dcd,cdp2w9x2-au00026606_a20_s4_w1403dcba9-7205-4436-9012-b41a85149530,cdp2w9x2-au00026606_a20_s4_w53076ee62-3d16-41a3-86bb-18fe66cf716b,cdp2w9x2-au00026606_a20_s4_w487e81305-def1-4767-a4fa-9056fde218f9,16,7844
58,55098.0,26271-F15-4,BRD-K41307363-001-05-5,26271,F15,4,SA1855732,BRD-K41307363,BROAD_CPD_ID,CCOc1ccc(NC(=O)c2ccccc2CO)cc1,ARAJZPPGAUPOAZ-UHFFFAOYSA-N,cdp2w9x2-au00026606_f15_s4_w2f4a048e8-ec36-49f2-83ea-f7f41dfc434e,cdp2w9x2-au00026606_f15_s4_w3a1d60046-42d4-4875-9693-1c760407315e,cdp2w9x2-au00026606_f15_s4_w18edbf978-c9bf-4398-b299-006a36b435c3,cdp2w9x2-au00026606_f15_s4_w5ad0be95c-d57a-4522-9d89-5fd2ccc89a73,cdp2w9x2-au00026606_f15_s4_w440f2b7f5-1712-4e59-ab79-604f3015bb07,72,2916
59,24460.0,25581-O03-2,BRD-A75588258-001-05-9,25581,O03,2,SA1860869,BRD-A75588258,BROAD_CPD_ID,CCOc1ccccc1NC(=O)C(OC(=O)c1cc(C)oc1C)c1ccccc1,ARFQPWBTZDLRGW-UHFFFAOYSA-N,cdp2w11_o03_s2_w25655be79-eb79-4e2f-be60-95a18d94cea8,cdp2w11_o03_s2_w3119ed52e-5378-41b3-a427-2856e3a53f28,cdp2w11_o03_s2_w1b0165d19-80b5-44b4-ba3f-eb2c0c507c83,cdp2w11_o03_s2_w5d70c19ec-f877-43a5-b7d5-96bcb9701751,cdp2w11_o03_s2_w45312d22b-1e88-46df-8f13-d5ea84753b54,94,6549
60,48601.0,26118-J03-5,BRD-K52527310-001-05-8,26118,J03,5,SA1852322,BRD-K52527310,BROAD_CPD_ID,Cn1c(SCc2c(Cl)cccc2Cl)nnc1-c1cccs1,ARJLOLQLNXHOOC-UHFFFAOYSA-N,cdp2w9x2_j03_s5_w201b3215a-e86c-48c4-8da8-5f566549389f,cdp2w9x2_j03_s5_w39ac32a7d-1a7b-4740-ae28-892704c32c99,cdp2w9x2_j03_s5_w110ba1a52-1a1d-44ab-a718-d64103d61cd3,cdp2w9x2_j03_s5_w5609302f2-88b7-4865-899f-bd177c2dbda4,cdp2w9x2_j03_s5_w485fbaefc-409f-4752-b501-32543a839e22,70,1429
61,29194.0,25641-F22-2,BRD-K28036658-001-04-4,25641,F22,2,SA1861938,BRD-K28036658,BROAD_CPD_ID,COc1cccc(c1)C(=O)Nc1c(oc2ccccc12)C(N)=O,ARLNYGOQDMCXLP-UHFFFAOYSA-N,cdp2w12_f22_s2_w2971690ed-8861-4083-b8d9-fad13b1a5afa,cdp2w12_f22_s2_w3a6fce679-f91a-4f54-97c2-c4ecd8fedece,cdp2w12_f22_s2_w101f09faf-83a7-4884-bc6e-e5afd8a877f2,cdp2w12_f22_s2_w56f39530b-8716-4768-9ed9-fb2be419901a,cdp2w12_f22_s2_w43fb5c64d-53b3-4c22-a0ff-9a9405eb6f6f,84,6121
62,32651.0,25678-J06-3,BRD-A65650908-001-05-3,25678,J06,3,SA1852096,BRD-A65650908,BROAD_CPD_ID,Cc1nn(-c2ccccc2)c2nc(O)c(CNCC3CCCO3)cc12,ARMAKTDXVGGRQV-UHFFFAOYSA-N,cdp2w12_j06_s3_w201d1583b-e811-4ae8-b5c2-11df2f39fba8,cdp2w12_j06_s3_w38d9bf219-7bbb-4b74-aabe-f5398f4972d6,cdp2w12_j06_s3_w1b184efa6-20fb-41d0-9597-160db1995417,cdp2w12_j06_s3_w54cdd93f5-5c17-44fb-83ef-b329be9b391e,cdp2w12_j06_s3_w4cf0710c4-5532-42d6-8f19-38a8ff05e060,67,3322
63,34722.0,25688-I21-4,BRD-K50914780-001-05-1,25688,I21,4,SA1861575,BRD-K50914780,BROAD_CPD_ID,CS(=O)(=O)Nc1ccc(OCc2ccccc2)cc1,ARUAGQGCXPFUOS-UHFFFAOYSA-N,cdp2w12_i21_s4_w29b4bdf15-3059-41e8-b5ce-f98a9c48782b,cdp2w12_i21_s4_w32bd2da19-9a5a-4537-882e-d909e440e3fc,cdp2w12_i21_s4_w1f023f5a3-9649-44b3-b314-5b0d63e9dc16,cdp2w12_i21_s4_w5b665549b-8b83-497e-a2bd-7e06f438fd4b,cdp2w12_i21_s4_w40afe8b5d-d8de-4806-b26d-014b4efab288,64,5746
64,12928.0,25410-D12-2,BRD-K02286723-001-06-1,25410,D12,2,SA1858903,BRD-K02286723,BROAD_CPD_ID,FC(F)(F)c1ccc(nc1)-c1nnc(SCC(=O)Nc2cccc(Cl)c2)o1,ARZITOZUTNWSOG-UHFFFAOYSA-N,cdp2w10_d12_s2_w273fea384-b37a-451c-a14e-3efad4566c09,cdp2w10_d12_s2_w3d5576940-836c-4664-9a83-6b59b793c88c,cdp2w10_d12_s2_w1a1c76f88-6dec-4478-a6a8-b0ae3f4aa10e,cdp2w10_d12_s2_w5d67f2876-f153-4ebb-a319-e8041a0fa54c,cdp2w10_d12_s2_w486931aa1-0039-46c3-9002-9ef8f8efbad4,55,1787
65,32436.0,25677-M19-4,BRD-A00650952-001-05-6,25677,M19,4,SA1852311,BRD-A00650952,BROAD_CPD_ID,Fc1cccc(c1)N(C(C(=O)NC1CCCC1)c1ccncc1)C(=O)CCC(=O)Nc1cccnc1,ARZXORPLIISFEG-UHFFFAOYSA-N,cdp2w12_m19_s4_w2f0b20b53-8ba0-4524-9003-13fcacebcd9e,cdp2w12_m19_s4_w3b40f8c77-843f-4363-8253-28387ab4ba21,cdp2w12_m19_s4_w19a95316f-fd3a-4dab-8c60-acfb78cf4565,cdp2w12_m19_s4_w54e7dc1b4-9437-4bc5-b403-6cce7b684991,cdp2w12_m19_s4_w44129d623-62f5-424e-a7dd-2db6d9d19661,74,7414
66,19728.0,25564-N22-4,BRD-K08882679-001-06-5,25564,N22,4,SA1861668,BRD-K08882679,BROAD_CPD_ID,[O-][N+](=O)c1cc(ccc1S(=O)(=O)Cc1ccccc1Cl)C(=O)N1CCN(CC1)c1ccccn1,ASWWIJZCKSFRRK-UHFFFAOYSA-N,cdp2w11_n22_s4_w272b3662b-8a9c-41e5-8f11-26d98c577193,cdp2w11_n22_s4_w32eb9be15-978d-4bf4-af09-6de6ec2a2e3d,cdp2w11_n22_s4_w1f2ca287c-58f9-4767-ad18-1ada764a74ea,cdp2w11_n22_s4_w5b6a1e63e-03bd-4ae7-a7d4-b46b030870ec,cdp2w11_n22_s4_w408b3db67-deef-48f5-a556-77abbaa1dce5,33,1444
67,34465.0,25686-N11-5,BRD-K00496561-001-07-1,25686,N11,5,SA1856711,BRD-K00496561,BROAD_CPD_ID,Clc1ccccc1\C=C\C(=O)Nc1ccncc1,ASZXVOGHNNBRPS-AATRIKPKSA-N,cdp2w12_n11_s5_w2fbe3f5b2-cb18-4508-aa7e-dcd3b3dcba28,cdp2w12_n11_s5_w321a6e379-cefc-4c1a-a086-f0ee6f5d54bc,cdp2w12_n11_s5_w12a3ed1a1-6dd8-4313-81c1-ad68415552b7,cdp2w12_n11_s5_w585f79cd6-c2b2-4f8e-b6bd-5ee1cfe57396,cdp2w12_n11_s5_w476732a19-9c97-4bfe-a4aa-febcc794bc4b,64,8474
68,37034.0,25707-F21-6,BRD-A24523504-001-05-0,25707,F21,6,SA1859126,BRD-A24523504,BROAD_CPD_ID,Cc1ccc(cc1F)C(NC(=O)N(Cc1ccccc1)Cc1ccccc1)C(Cl)Cl,ATDPQEPHNOQBOD-UHFFFAOYSA-N,cdp2w12_f21_s6_w201dfcc44-b07d-4675-b5dc-0e43130abef9,cdp2w12_f21_s6_w38da3b678-4750-4273-967f-4e4456479720,cdp2w12_f21_s6_w18c48fe68-1e44-45c6-ad7b-e186a6296c52,cdp2w12_f21_s6_w535f31d43-56cd-4206-9073-a085e20a3349,cdp2w12_f21_s6_w448647ff1-bd06-49f4-8ee2-f1b7e2f5db7e,64,8454
69,38297.0,25726-A19-3,BRD-A49950516-001-04-5,25726,A19,3,SA1855356,BRD-A49950516,BROAD_CPD_ID,COC(=O)C1(C)Nc2ccccc2C(=O)N1c1ccccc1OC,AUEJKAYMDPANCB-UHFFFAOYSA-N,cdp2w12_a19_s3_w25c3fa935-393f-4594-a2e9-9be1335b0097,cdp2w12_a19_s3_w3a2885dae-1e85-4224-bc85-2f66a5bad62b,cdp2w12_a19_s3_w1e33b95f1-e757-461c-b700-b65ce10cca3c,cdp2w12_a19_s3_w5ffee45ff-8ca4-4abb-bce8-b768b705dc0f,cdp2w12_a19_s3_w4f7ee6774-1cd6-4f0d-869f-6f6cd2e4724a,37,7654
70,32526.0,25678-D11-4,BRD-K19008962-001-05-2,25678,D11,4,SA1862171,BRD-K19008962,BROAD_CPD_ID,Cc1ccc2[nH]c(=O)c(cnc2c1)=NNc1ccccc1,AUGULEYODXXYMM-UHFFFAOYSA-N,cdp2w12_d11_s4_w20a50b07c-de92-4112-b081-c688b44ba17d,cdp2w12_d11_s4_w33cff4e82-e582-4acb-aab9-dd1b827d14e1,cdp2w12_d11_s4_w1c08cb49c-4bc6-4298-9021-add32e77f0a3,cdp2w12_d11_s4_w5804ef5d1-c2e4-4c1f-9b2b-c392d88023ec,cdp2w12_d11_s4_w4273db178-888b-40e5-a62a-baf72508ed73,58,2902
71,18332.0,25490-L18-6,BRD-K68379277-001-05-7,25490,L18,6,SA1852052,BRD-K68379277,BROAD_CPD_ID,CC(C)c1ccc(NC(=O)c2ccc(Br)o2)cc1,AUKGEVZMXPNOHI-UHFFFAOYSA-N,cdp2w10-au00024359_l18_s6_w255c01a50-a231-4900-abb4-9b328bfee7bf,cdp2w10-au00024359_l18_s6_w343464a8f-4078-44e0-8ee5-6961d82fb878,cdp2w10-au00024359_l18_s6_w1b75dcf21-d9d9-4c21-81ef-2247662d2d11,cdp2w10-au00024359_l18_s6_w5a3401bf7-8741-4d6f-a12b-f8c67527c5ef,cdp2w10-au00024359_l18_s6_w482afe956-93d6-48c5-9696-b52b301b7893,58,7739
72,45471.0,25992-J04-1,BRD-K70246307-001-02-5,25992,J04,1,SA58762,riboflavin,INN,Cc1cc2nc3c(nc(=O)[nH]c3=O)n(C[C@@H](O)[C@@H](O)[C@@H](O)CO)c2cc1C,AUNGANRZJHBGPY-MBNYWOFBSA-N,cdp2w8x2_j04_s1_w244c7df22-a4e7-4ac8-823a-e9b33af712c4,cdp2w8x2_j04_s1_w3aeb83b97-5f53-4010-87e2-0574b9f8d0e3,cdp2w8x2_j04_s1_w163464b38-f0a9-4841-b4f9-1ee971746ff3,cdp2w8x2_j04_s1_w5c4dad231-6e15-4477-bba5-931b1a823691,cdp2w8x2_j04_s1_w4dc9c7e5d-3977-4800-a8df-96b8ac28f0be,50,3963
73,54484.0,26239-B18-2,BRD-K80576679-001-03-1,26239,B18,2,SA82397,"2,3-dihydroxy-6,7-dichloroquinoxaline",primary-common,Oc1nc2cc(Cl)c(Cl)cc2nc1O,AVBSIKMUAFYZAV-UHFFFAOYSA-N,cdp2w9x2_b18_s2_w2c589be5b-bf0a-4ae9-ae51-f27f94399b3c,cdp2w9x2_b18_s2_w34cc7c2b8-0a62-439d-9265-380b51634a05,cdp2w9x2_b18_s2_w156460d26-86f8-41ba-b993-b8de0cb97094,cdp2w9x2_b18_s2_w57f84cb46-75ad-42bf-94a9-c7d10d03d565,cdp2w9x2_b18_s2_w47253e9cd-84fb-457d-9fb6-2745ebfa179e,66,317
74,23420.0,25578-I22-6,BRD-K71404746-001-05-1,25578,I22,6,SA1861378,BRD-K71404746,BROAD_CPD_ID,CC(C)CC(=O)NC(=S)Nc1ccccc1C(=O)Nc1ccccc1,AVEPIRUGHKMVQU-UHFFFAOYSA-N,cdp2w11_i22_s6_w2328e6b87-c4c3-40c3-bd71-0643febb894f,cdp2w11_i22_s6_w36ad1d353-0c9b-47d4-b512-e13bc103437a,cdp2w11_i22_s6_w1e9e6b893-2469-4f11-be33-bfd2aa307509,cdp2w11_i22_s6_w52479d982-41d5-48aa-b28b-cd0d751b06f1,cdp2w11_i22_s6_w400cbd89e-9809-46e2-b0ce-93936a5c8be4,55,7827
75,6185.0,24320-D18-6,BRD-K63630713-001-04-3,24320,D18,6,SA58305,etacrynic acid,INN,CCC(=C)C(=O)c1ccc(OCC(O)=O)c(Cl)c1Cl,AVOLMBLBETYQHX-UHFFFAOYSA-N,cdp2bioactives_d18_s6_w2bfac71f4-7fcf-4028-a86e-6c992f89f216,cdp2bioactives_d18_s6_w34f8a309b-b15e-450b-8adb-af220613bad3,cdp2bioactives_d18_s6_w1fad495be-32a2-49bc-b284-30e04c3f221f,cdp2bioactives_d18_s6_w5e4605538-39c4-4060-84da-15b8751791dc,cdp2bioactives_d18_s6_w45f37d4ba-f0a0-4b01-9672-52705ffd0172,84,71
76,48509.0,26118-F04-3,BRD-K35632260-001-05-8,26118,F04,3,SA1861384,BRD-K35632260,BROAD_CPD_ID,FC(F)(F)c1cc(nc(SCCC(=O)NCc2ccco2)n1)-c1ccc2OCOc2c1,AVRLWTHPEGLUJT-UHFFFAOYSA-N,cdp2w9x2_f04_s3_w2b2cab535-ebc8-4966-84d9-20534154cd9d,cdp2w9x2_f04_s3_w3e2ae1db5-1e2c-4781-a5f8-6911102e9a42,cdp2w9x2_f04_s3_w1428133e4-c8ed-4e0a-a035-b5c77bdb17c3,cdp2w9x2_f04_s3_w5dbb8aa33-2a43-4a1c-a555-ec367e02e02c,cdp2w9x2_f04_s3_w4eaa5347e-d1a4-475e-bd97-8e9fa2abbb4e,72,3166
77,7968.0,24596-M24-1,BRD-K43782664-001-01-2,24596,M24,1,SA850644,BRD-K43782664,BROAD_CPD_ID,COc1ccccc1C#Cc1ccc2c(O[C@@H](CN(C)Cc3cccnc3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1,AWBBMFXXCINDIY-SGQNLQFHSA-N,cdp2bioactives_m24_s1_w22b911484-588a-438f-b597-c9bfe0f31395,cdp2bioactives_m24_s1_w3b57cb4b2-bf7b-4586-8fca-bbfb61c1f368,cdp2bioactives_m24_s1_w1d8b55b78-c995-4399-9724-f69f748b7575,cdp2bioactives_m24_s1_w5c85ced2b-287e-448c-91ea-43b8be24f224,cdp2bioactives_m24_s1_w441829c5c-9001-4136-b587-ab0654f2beb0,97,10236
78,37995.0,25725-D10-1,BRD-A87928000-001-05-4,25725,D10,1,SA1857263,BRD-A87928000,BROAD_CPD_ID,CC(C)=CC1C(C(=O)Nc2ccc(Br)cn2)C1(C)C,AXIVSTHBJFCRNV-UHFFFAOYSA-N,cdp2w12_d10_s1_w238d1fd2d-ba65-4efd-867d-717011ef1fbe,cdp2w12_d10_s1_w3dea08384-9811-40ff-bd2e-91d42f15be7b,cdp2w12_d10_s1_w131a5362d-6b8b-4498-ace8-b48e72a5f6fc,cdp2w12_d10_s1_w5e541a82a-e601-41da-938d-c989adbb9d31,cdp2w12_d10_s1_w4efdc4e42-5693-4696-b7bd-a825ceb4bc64,49,5161
79,52852.0,26204-D08-2,BRD-A91149807-001-06-4,26204,D08,2,SA1856811,BRD-A91149807,BROAD_CPD_ID,C(C1COC2(CCCCCCCCCCC2)O1)N1CCOCC1,AXTKPHAKXVXLKW-UHFFFAOYSA-N,cdp2w9x2-au00026617_d08_s2_w20eeff19b-0f8d-46d8-9296-2b3c75775838,cdp2w9x2-au00026617_d08_s2_w3a6cd0f7e-46c5-41c3-a8a4-181a02897381,cdp2w9x2-au00026617_d08_s2_w11a756982-54a8-4f83-9564-61e7d6d5abb2,cdp2w9x2-au00026617_d08_s2_w5fd0e0869-271f-4e18-bde0-b9dbc56b0860,cdp2w9x2-au00026617_d08_s2_w42abb1be1-bbc5-42d7-862a-13743902b9fe,41,4609
80,13886.0,25418-H21-6,BRD-A71931372-001-06-4,25418,H21,6,SA1857908,BRD-A71931372,BROAD_CPD_ID,COc1ccc(cc1)C1=NN(C(C1)c1ccccc1O)C(=O)c1cccs1,AXTQBBDRNAYVKG-UHFFFAOYSA-N,cdp2w10_h21_s6_w24ccfadb9-cab9-486a-8d3d-7c552015a85b,cdp2w10_h21_s6_w3b473afc2-11bb-478f-a498-92e108bf0dc5,cdp2w10_h21_s6_w1d40c25df-24e1-4d21-8e22-def2cb913a66,cdp2w10_h21_s6_w57fb83338-4c1d-4d79-b7da-75772ad43dcf,cdp2w10_h21_s6_w4610ea4e2-933a-4a35-85f2-aa289d04a0d2,40,9092
81,48383.0,26118-A07-3,BRD-K48356852-001-05-3,26118,A07,3,SA1859819,BRD-K48356852,BROAD_CPD_ID,CCOc1cc(cc(OCC)c1OCC)-c1nn2cnnc2s1,AYDDWMFQUATJEM-UHFFFAOYSA-N,cdp2w9x2_a07_s3_w2de69e5a4-7dc8-47cd-8a46-e58405adfba8,cdp2w9x2_a07_s3_w38236f1cd-e31b-4216-ae6b-f8462a9aaba9,cdp2w9x2_a07_s3_w19848e775-3721-40ca-91bc-f046dd3121d6,cdp2w9x2_a07_s3_w50cc3db20-4fe2-4f19-8738-80703ac5929c,cdp2w9x2_a07_s3_w4f95b3632-e16e-47b0-b97b-4be2585eb095,51,9618
82,35254.0,25690-F10-2,BRD-K96189035-001-05-9,25690,F10,2,SA1860532,BRD-K96189035,BROAD_CPD_ID,O=C(CSc1nnc(NC2CCCCC2)s1)Nc1ccc2C(=O)c3ccccc3C(=O)c2c1,AYDYLYXVAHBVDG-UHFFFAOYSA-N,cdp2w12_f10_s2_w212a7771f-7057-4839-88e7-a3850b18c095,cdp2w12_f10_s2_w31b5c4b2a-a6f9-452c-80c5-9ab6f60e634d,cdp2w12_f10_s2_w1dd59d9f8-3b76-4274-9a29-a5c21309e957,cdp2w12_f10_s2_w5fc33bf45-a65a-493c-9b3d-31216852a077,cdp2w12_f10_s2_w49311babe-62aa-4b88-a895-eb2c74dd1bab,81,6139
83,37409.0,25708-G07-3,BRD-K68076329-001-05-7,25708,G07,3,SA1861207,BRD-K68076329,BROAD_CPD_ID,COc1ccc2nc(C)cc(SCC(=O)NNC(=O)COc3cccc4ccccc34)c2c1,AYRBRHAXEISWPQ-UHFFFAOYSA-N,cdp2w12_g07_s3_w2714b1a20-9e4b-4678-b4c3-ec2146c0848c,cdp2w12_g07_s3_w345f4159a-b636-4a42-a68d-e33121c2153f,cdp2w12_g07_s3_w1a59b96af-7737-43cb-8471-a9f73f7801bb,cdp2w12_g07_s3_w570b11915-0582-4bcd-915c-e36bb8d3a8fa,cdp2w12_g07_s3_w47139c47c-6e03-4f94-81c0-45cbd279dbf2,61,7988
84,8975.0,24732-A12-3,BRD-K14744524-001-02-5,24732,A12,3,SA666275,BRD-K14744524,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccccc2)OCc2cnnn2CCCC1=O,AYVSZOBZIZEFEA-KNKQGSTJSA-N,cdp2w5_a12_s3_w23295b2f4-c474-49d8-aeb0-e923ed374510,cdp2w5_a12_s3_w3ef0195fe-a0a0-415d-a1ea-5b487cd192a5,cdp2w5_a12_s3_w105542cfb-1799-4159-8798-e1b589582186,cdp2w5_a12_s3_w5276cb786-912d-4c10-90f8-c371a8395080,cdp2w5_a12_s3_w4534443f3-912b-4d33-84b5-f28e3ee3f9c8,55,9803
85,23462.0,25578-L16-6,BRD-K62822784-001-05-8,25578,L16,6,SA1854531,BRD-K62822784,BROAD_CPD_ID,Cc1ccc(cc1)-c1cc(C(O)=O)c2sc(nc2n1)N1CCCCC1,AZLNHYOVLUPYEJ-UHFFFAOYSA-N,cdp2w11_l16_s6_w23a48615e-9577-480e-ba5f-6553d9ab1484,cdp2w11_l16_s6_w30f7ba063-3d3c-45af-9e2c-7da680d90b46,cdp2w11_l16_s6_w1b3678ff7-5483-4fd4-bf30-161df54653b0,cdp2w11_l16_s6_w58e65dd38-8051-4565-b516-ebff5ebf938c,cdp2w11_l16_s6_w47b082f87-d171-495e-865a-5c3ab68a48f3,74,8347
86,48968.0,26124-J22-6,BRD-K62750255-001-05-1,26124,J22,6,SA1852923,BRD-K62750255,BROAD_CPD_ID,Clc1ccc(CC(=O)NNC(=O)Nc2cccc3ccccc23)cc1,AZYXKCMLQANZFV-UHFFFAOYSA-N,cdp2w9x2_j22_s6_w287e32259-4a0a-4818-ab1b-553b71c82d9d,cdp2w9x2_j22_s6_w3b950ed96-32df-4ae4-8f14-ba2c5d2d2bfd,cdp2w9x2_j22_s6_w1b56cc75b-e6bd-44b3-9c50-2ba663c54528,cdp2w9x2_j22_s6_w573314715-9767-462f-9f5a-6f05ffcc97cd,cdp2w9x2_j22_s6_w4201a5a97-b7f4-432b-a8ec-f7c4baddf375,62,9149
87,28253.0,25605-C15-3,BRD-A38582748-001-13-0,25605,C15,3,SA1855103,BRD-A38582748,BROAD_CPD_ID,CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n1cncn1,BAZVSMNPJJMILC-UHFFFAOYSA-N,cdp2w11-au00029692_c15_s3_w2debcee85-72bc-43f6-b200-63558d786922,cdp2w11-au00029692_c15_s3_w30c52f5f4-cdcc-479a-9096-1cfadaf9baef,cdp2w11-au00029692_c15_s3_w1c9d132a9-08c7-482e-b6b0-706c3638a256,cdp2w11-au00029692_c15_s3_w55a07c642-7257-437d-8443-f3ffc02acb14,cdp2w11-au00029692_c15_s3_w4a73ed179-4d7a-4147-8577-4bc489dce9ed,70,1185
88,11273.0,25387-L08-3,BRD-K34788422-001-05-4,25387,L08,3,SA1853060,BRD-K34788422,BROAD_CPD_ID,CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)CSc2cc(C)ccc2C)c1,BBECHTZOSJYMLD-UHFFFAOYSA-N,cdp2w10_l08_s3_w2cb81810a-2987-4128-8f9f-70def4e2375d,cdp2w10_l08_s3_w36cacf9ff-e982-4a86-8767-4226876b0f49,cdp2w10_l08_s3_w1395cc397-29ac-44d7-a80c-99c26d3ddd6b,cdp2w10_l08_s3_w546f7a8cb-cb9b-4ded-8ef5-59d90b10c9ff,cdp2w10_l08_s3_w46de13250-9235-43b5-8b6f-70dd37ba6457,53,6364
89,48629.0,26118-K18-3,BRD-K62246028-001-05-6,26118,K18,3,SA1853539,BRD-K62246028,BROAD_CPD_ID,N#CC(=CNc1cccnc1)C#N,BBGXNSAUVNOZEC-UHFFFAOYSA-N,cdp2w9x2_k18_s3_w2d05abd54-f722-4399-93e9-51de5ca5d595,cdp2w9x2_k18_s3_w30d0e1126-df0e-475c-9951-1e97e0d3b4e3,cdp2w9x2_k18_s3_w174209c65-ad1c-4d15-ac53-9bf2d4f1e5e8,cdp2w9x2_k18_s3_w5ba1d6c26-2313-4f4b-9566-00fa609550b0,cdp2w9x2_k18_s3_w410d6e3fd-1236-4545-af75-08187e17b9e6,67,4858
90,31026.0,25665-P14-4,BRD-K58499307-001-06-7,25665,P14,4,SA1856207,BRD-K58499307,BROAD_CPD_ID,OCc1ccc(CO[C@H]2C[C@H](C=C(O2)C(=O)NCc2nc3ccccc3[nH]2)c2ccc(cc2)C(F)(F)F)cc1,BBIRKSILZBXBGJ-KDYSTLNUSA-N,cdp2w12_p14_s4_w2890bcfa1-b23c-4c42-8f08-3c4b3b7d6c4f,cdp2w12_p14_s4_w30b4d069f-2ee5-48b4-ae92-8a98d4c24632,cdp2w12_p14_s4_w17f614682-2c0f-46db-a9c6-e92da6151fbc,cdp2w12_p14_s4_w56b2aeb86-3b38-4a32-82f7-69771ac2adee,cdp2w12_p14_s4_w4ec839b68-c178-465b-bd20-3e11f14d2928,66,4490
91,23290.0,25578-C18-2,BRD-A04753289-001-05-8,25578,C18,2,SA1854323,BRD-A04753289,BROAD_CPD_ID,CC(NC(=O)CC1Nc2ccccc2NC1=O)c1ccccc1,BBXMKLXKJDMVCH-UHFFFAOYSA-N,cdp2w11_c18_s2_w2b46e369f-1861-462a-8264-9c245ffe4fd1,cdp2w11_c18_s2_w39fbdb733-dc27-46c6-a906-ece5e13d871d,cdp2w11_c18_s2_w1ffdc165c-b5ef-40d6-a289-ffcbd2d51cc6,cdp2w11_c18_s2_w5c53a90cb-8c0b-4022-af6e-e567e8a124cd,cdp2w11_c18_s2_w4ecd8ea5d-4a51-4d1a-824c-0886dec7db7d,70,5647
92,48078.0,26115-C07-4,BRD-K98774963-001-05-2,26115,C07,4,SA1858920,BRD-K98774963,BROAD_CPD_ID,Cc1cc(NC(=O)CSc2ccc3ccccc3c2)no1,BBXRMYRMSRLARV-UHFFFAOYSA-N,cdp2w9x2_c07_s4_w295fc89ed-875c-4604-971f-94ed78162aa9,cdp2w9x2_c07_s4_w33fdf8357-1573-4f96-a832-b3afec08298d,cdp2w9x2_c07_s4_w1e7c0b96d-3f6f-4164-abdd-27238743c6fa,cdp2w9x2_c07_s4_w53f7484b0-f49e-4e97-a391-b417b20540b0,cdp2w9x2_c07_s4_w402115372-a31a-4f94-a1a0-a19637d6622f,51,1919
93,35209.0,25690-D03-5,BRD-K94695718-001-06-9,25690,D03,5,SA1857806,"5-(4-methylphenyl)-2H-1,2,3,4-tetraazole",to-be-curated,Cc1ccc(cc1)-c1nn[nH]n1,BCCJIAZPYBJASR-UHFFFAOYSA-N,cdp2w12_d03_s5_w277e3cd85-c2e0-4ef2-850c-fe0669eeaaab,cdp2w12_d03_s5_w3f9de7f88-6516-4235-8f1f-3c58adf08fbe,cdp2w12_d03_s5_w1b35c3765-2b9a-4e9c-b4e8-be32a1aed97f,cdp2w12_d03_s5_w52c5af68b-a1ba-4cc0-a57e-324d31041160,cdp2w12_d03_s5_w4b156bbe7-7510-4a8e-8b20-e13b4a94cf5e,41,8376
94,33403.0,25680-M18-5,BRD-K37576103-001-05-6,25680,M18,5,SA1858896,BRD-K37576103,BROAD_CPD_ID,Cc1occc1C(=O)Nc1ccc2ccccc2c1,BCQQHBSOPLVZGY-UHFFFAOYSA-N,cdp2w12_m18_s5_w2d69f772d-f534-4859-9c8f-09d6c9899df5,cdp2w12_m18_s5_w3a39462cb-7122-4dc9-863f-8308f27c64cf,cdp2w12_m18_s5_w198fa575c-9e9a-4e62-bca2-97b5015ee7b7,cdp2w12_m18_s5_w5bed9fdff-d01c-4654-b4da-2620ffccd2a3,cdp2w12_m18_s5_w47a0362d0-a43a-4275-92ae-daad90f7ae60,66,9328
95,35112.0,25689-M15-4,BRD-K63517890-001-05-4,25689,M15,4,SA1860579,BRD-K63517890,BROAD_CPD_ID,COC(=O)c1ccc(OCC(=O)c2ccccc2)cc1,BCQXPIIOARROPF-UHFFFAOYSA-N,cdp2w12_m15_s4_w2ed62b8db-c2fb-4479-97ac-935bd2e871a3,cdp2w12_m15_s4_w3bab310a3-8c60-4993-b557-13706eab60e9,cdp2w12_m15_s4_w122121f99-6f47-4be7-9781-970aee72a3dc,cdp2w12_m15_s4_w5d846bacb-6418-4d04-bc0f-ce9b5a54f8cd,cdp2w12_m15_s4_w4129c78c1-9780-490b-830d-74bc19e28039,77,3282
96,23379.0,25578-H12-1,BRD-K50326094-001-05-9,25578,H12,1,SA1854901,BRD-K50326094,BROAD_CPD_ID,Oc1ccccc1-c1n[nH]c(SCC(=O)N2CCOCC2)n1,BDJSVXDKRKVZEJ-UHFFFAOYSA-N,cdp2w11_h12_s1_w2d06f15ca-ac68-4762-af35-2c9e65e85f2a,cdp2w11_h12_s1_w3dada3bb1-06e2-4ba9-be1b-6ec19c8f07fe,cdp2w11_h12_s1_w166184a76-00aa-4187-bd33-fcdffd67aa87,cdp2w11_h12_s1_w5b8f7ca6c-bd97-47e1-989a-f7cbdf96431f,cdp2w11_h12_s1_w4bbac2334-7a93-4218-93d8-824351d21429,73,3353
97,38563.0,25726-O22-5,BRD-K75439260-001-05-9,25726,O22,5,SA1861179,BRD-K75439260,BROAD_CPD_ID,COc1cccc(c1)C(=O)NCCC(=O)NCc1cc(=O)n(C)c(=O)n1C,BDOBBVQFBBDHDZ-UHFFFAOYSA-N,cdp2w12_o22_s5_w2b50941ae-f769-4b99-b31f-1c01f6680bef,cdp2w12_o22_s5_w33d075f8a-4bfd-4052-9ee8-65538805bea7,cdp2w12_o22_s5_w1d18b4d9e-7515-4c24-8698-fdd462fe6f9f,cdp2w12_o22_s5_w5ed0f4784-0a58-446d-8b0c-7d4a69804b45,cdp2w12_o22_s5_w482c23fa8-0d26-44cb-aab0-b90590b4f550,92,1649
98,24535.0,25583-B17-5,BRD-K41914390-001-06-3,25583,B17,5,SA1861522,BRD-K41914390,BROAD_CPD_ID,Nc1n(-c2ccc(Br)cc2)c(SCC(=O)c2ccc(Br)cc2)nc2nncc12,BDSDAYGNIWJNKN-UHFFFAOYSA-N,cdp2w11_b17_s5_w2c20305f5-200c-41a6-a7fb-1a952e629d8b,cdp2w11_b17_s5_w3b3212c8a-3d9b-4020-846b-40f545813f01,cdp2w11_b17_s5_w1d1470d95-3a96-40c2-b376-d3ec2688a095,cdp2w11_b17_s5_w5fcdf1a9d-98a2-49a0-bc73-4edb0c4c8710,cdp2w11_b17_s5_w43b4341b8-6555-4b28-bc49-98592e665dca,76,6808
99,38846.0,25738-M03-6,BRD-A41550589-001-05-0,25738,M03,6,SA1854997,BRD-A41550589,BROAD_CPD_ID,Fc1ccc(cc1)N1C(=O)CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)C1=O,BDTZMOHFSHVYRE-UHFFFAOYSA-N,cdp2w12_m03_s6_w2e17647b0-4d67-4b43-a7bd-eabf83e739e9,cdp2w12_m03_s6_w328753aed-4bed-4268-8e91-4f1a93d90af7,cdp2w12_m03_s6_w1828002d8-013f-482d-9fdf-2ddf0b793348,cdp2w12_m03_s6_w50d9f7ac8-1561-4c80-a5bf-2c84a8b86879,cdp2w12_m03_s6_w42a696964-f064-4c1b-bdbb-812de6eca74e,72,2612
100,41077.0,25962-J13-5,BRD-K10974103-001-03-9,25962,J13,5,SA83707,diloxanide furoate,USP,CN(C(=O)C(Cl)Cl)c1ccc(OC(=O)c2ccco2)cc1,BDYYDXJSHYEDGB-UHFFFAOYSA-N,cdp2w8x2_j13_s5_w2e8ffb81c-ac5b-4de6-9dcd-19c5635939e4,cdp2w8x2_j13_s5_w30955cc35-6290-492e-af62-4e7056e6408a,cdp2w8x2_j13_s5_w18456798d-25dd-41e6-b80a-264fe4da1ecc,cdp2w8x2_j13_s5_w5f10dd11c-ffaf-4c3f-882f-bd56b74fb409,cdp2w8x2_j13_s5_w4beaf9102-b585-423a-84a1-4d5be20aff1d,81,2373
101,51747.0,26174-C08-1,BRD-K66960346-001-05-3,26174,C08,1,SA1854043,BRD-K66960346,BROAD_CPD_ID,CCOC(=O)c1ccc(CNC(=O)c2cc(oc2C)C(C)(C)C)o1,BEEZNWLPFBEOPP-UHFFFAOYSA-N,cdp2w9x2-au00026617_c08_s1_w221e3dfdf-e2ac-43d6-a5c1-f32edd090ead,cdp2w9x2-au00026617_c08_s1_w3f727d481-43b5-4f75-b4ae-202f557be7ea,cdp2w9x2-au00026617_c08_s1_w1529b8d5c-931e-42b9-a6fd-e9d08a1d730d,cdp2w9x2-au00026617_c08_s1_w50e2cd1ba-0a8a-450a-8b7e-bb942ed8eb31,cdp2w9x2-au00026617_c08_s1_w411c76a69-482f-45d0-b9ca-4f7719e00aea,39,9283
102,55110.0,26271-G04-4,BRD-K66434795-001-05-5,26271,G04,4,SA1856863,BRD-K66434795,BROAD_CPD_ID,Cc1ccc2[nH]c3c(CC\C(=C\c4ccccc4)C3=O)c2c1,BELRFZNMVLSEKG-QINSGFPZSA-N,cdp2w9x2-au00026606_g04_s4_w23057c68c-de1e-4983-93d7-65983e397757,cdp2w9x2-au00026606_g04_s4_w3b6860918-8457-4dde-8b37-583564ffd3ef,cdp2w9x2-au00026606_g04_s4_w172c48e29-0d53-4c91-bef8-867cef89f27f,cdp2w9x2-au00026606_g04_s4_w595559bc2-2a44-4f8c-be0e-08626750f06d,cdp2w9x2-au00026606_g04_s4_w405d2e63b-65fb-4ed7-81db-1c928a97eb79,62,3426
103,39211.0,25855-F20-5,BRD-K56483755-001-01-1,25855,F20,5,SA791368,BRD-K56483755,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Cc2ccccc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,BENJSVFNXVDSQO-QEGDFHJFSA-N,cdp2w6x2_f20_s5_w210b26fd9-5cb3-4914-ac38-5ecc5b0dd503,cdp2w6x2_f20_s5_w32e8bda1a-7c2b-46c4-af3e-14b33296715d,cdp2w6x2_f20_s5_w1ee3cf1e6-f904-4a8a-a118-f70e66d4e3b7,cdp2w6x2_f20_s5_w50db33541-0519-486a-96e8-ef321a5f11fc,cdp2w6x2_f20_s5_w47dc1658a-aef6-4eef-8e17-e2301d7064d3,99,10539
104,46705.0,26071-J22-5,BRD-K63119190-001-05-6,26071,J22,5,SA1859708,BRD-K63119190,BROAD_CPD_ID,NC(=NOC(=O)c1ccc2OCOc2c1)c1cccc(c1)[N+]([O-])=O,BEOZHZRIKWOEMV-UHFFFAOYSA-N,cdp2w9x2_j22_s5_w2c39fed39-d925-41f1-ac7f-963a44dcba3c,cdp2w9x2_j22_s5_w394426778-86f9-4aee-942c-16728cfc160e,cdp2w9x2_j22_s5_w1465a7eee-75e7-4f88-be7c-00f826b5e962,cdp2w9x2_j22_s5_w5247ebc8f-9b6e-4de2-aefb-7fefbf11b13a,cdp2w9x2_j22_s5_w41b070f7a-218f-4089-a8d9-f50454a3d877,62,7212
105,28193.0,25605-A16-3,BRD-K38106829-001-05-4,25605,A16,3,SA1857592,BRD-K38106829,BROAD_CPD_ID,CCCCN(C)CCn1c(=S)[nH]c2ccc(cc2c1=O)N1CCOCC1,BFAQHOKYGODPBW-UHFFFAOYSA-N,cdp2w11-au00029692_a16_s3_w29c5040a6-7954-4f1f-bc54-d67d378a6333,cdp2w11-au00029692_a16_s3_w3b10c0842-a8f3-4ef3-949d-bb0b3d83d0e1,cdp2w11-au00029692_a16_s3_w1c2dfb0de-53e2-4728-9ab9-94c24954f74b,cdp2w11-au00029692_a16_s3_w5373d6398-db5b-40dc-af21-6100610707ed,cdp2w11-au00029692_a16_s3_w4528ccf08-2ec6-48aa-87df-d19aa3e2a21e,61,2248
106,18772.0,25503-A10-2,BRD-A88022652-001-07-2,25503,A10,2,SA1855340,BRD-A88022652,BROAD_CPD_ID,COc1ccc(cc1)-c1[nH]nc2OC(N)=C(C#N)C(c3ccoc3)c12,BFSQCCRPEGKUFZ-UHFFFAOYSA-N,cdp2w11-au00029680_a10_s2_w253c6c99d-84e4-4745-85f1-b5536422ad81,cdp2w11-au00029680_a10_s2_w3f1a50be8-c5d1-46ba-8bbb-bec49d3f1e78,cdp2w11-au00029680_a10_s2_w1bc55ae5b-75e6-45ac-bfae-16ac77d16c6c,cdp2w11-au00029680_a10_s2_w544f1b4ba-6878-48c0-8c24-8c149e1e53b0,cdp2w11-au00029680_a10_s2_w446cc54d5-78d9-4fdf-a4a3-735af061e9ea,40,3615
107,3529.0,24306-K01-2,BRD-K11373525-003-01-3,24306,K01,2,SA792374,ZD 7155,to-be-curated,CCc1cc2N(Cc3ccc(cc3)-c3ccccc3-c3nnn[nH]3)C(=O)CCc2c(CC)n1,BFVNEYDCFJNLGN-UHFFFAOYSA-N,cdp2bioactives_k01_s2_w22fe492c9-4547-491c-8f39-89b3ca293215,cdp2bioactives_k01_s2_w3b0b2e154-8654-485e-ba35-0bddd7fe66ae,cdp2bioactives_k01_s2_w18ce439e7-4131-4473-9df3-01b3bb07a7ec,cdp2bioactives_k01_s2_w5b6cb74ef-3224-45bb-84c5-7c2cbe6f21e6,cdp2bioactives_k01_s2_w4930f1e94-beed-46d2-8df1-8084ec7a63c0,59,904
108,9459.0,24751-G08-1,BRD-K48813201-001-02-8,24751,G08,1,SA667176,BRD-K48813201,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cn(CCCC1=O)nn2,BGKHIKCFNCIYGU-IRFCIJBXSA-N,cdp2w5_g08_s1_w2c1200aa1-5949-4216-bb2e-f6be5299f4a2,cdp2w5_g08_s1_w3bbd441b2-1b16-4c0a-82ff-bddcbb92ad3e,cdp2w5_g08_s1_w1d492ac13-98f0-4623-84e1-2256ff17a9ea,cdp2w5_g08_s1_w5d1f3b741-fab8-4bfb-b4a1-972bd30aa474,cdp2w5_g08_s1_w46facc476-1b92-405f-81f7-d62b46c47f37,51,9914
109,38313.0,25726-B13-1,BRD-K00136517-001-06-0,25726,B13,1,SA1852757,BRD-K00136517,BROAD_CPD_ID,COc1ccc(OC)c2c(N)c(C#N)c(nc12)C(F)(F)C(F)(F)F,BGMUZNANPQUDEH-UHFFFAOYSA-N,cdp2w12_b13_s1_w2dee7c960-5d2c-4860-86b8-ecef76e3938b,cdp2w12_b13_s1_w340f36420-0e59-4181-a65c-adb6fce64bd3,cdp2w12_b13_s1_w18eb4c313-4abf-4ca0-8114-2050979a7042,cdp2w12_b13_s1_w552ca52ef-bc29-4f10-917e-87169cf53f32,cdp2w12_b13_s1_w4b3c84062-cfd9-485b-8067-2f45368a1e75,75,4581
110,36991.0,25707-D16-5,BRD-K37936726-001-05-9,25707,D16,5,SA1859931,BRD-K37936726,BROAD_CPD_ID,COCC(=O)Nc1nnc(s1)-c1cccs1,BGOHMAJTGWYSNO-UHFFFAOYSA-N,cdp2w12_d16_s5_w20c98a814-50ee-4cf6-bad6-9ed4fb369e5b,cdp2w12_d16_s5_w33454add9-fbf4-4321-bd5c-1eb64b3c1c9d,cdp2w12_d16_s5_w11a458517-6788-4a64-ba9f-fbcc699b8516,cdp2w12_d16_s5_w5c8d43f2c-7138-4ba4-bef6-abc3bfd31b3e,cdp2w12_d16_s5_w48469c7be-d353-4a1a-8754-b0a96f06f0b1,77,9189
111,24845.0,25584-A21-3,BRD-K08878345-001-05-9,25584,A21,3,SA1854496,BRD-K08878345,BROAD_CPD_ID,Oc1c(N=Nc2ccccc2O)c2ccccc2n1CC=C,BGWLQENWEYEDFQ-UHFFFAOYSA-N,cdp2w11_a21_s3_w22bea2394-e472-42c3-a055-79d9777f5120,cdp2w11_a21_s3_w38aa56946-2f08-4409-9c6d-78269411ac9a,cdp2w11_a21_s3_w1789d2dbd-1b7e-4fa9-9057-f54e0d0b92ed,cdp2w11_a21_s3_w5efcaa4bf-a77e-447d-ad7a-f0d9740fc70d,cdp2w11_a21_s3_w4ed36924f-6674-47ad-a506-efddfd5dc639,20,6022
112,29886.0,25643-I04-4,BRD-A14101427-001-05-1,25643,I04,4,SA1853862,BRD-A14101427,BROAD_CPD_ID,NC(=O)[C@H]1CC2(CN1C(=O)CC(c1ccccc1)c1ccccc1)CC(=NO2)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1,BGXZPXNTQICWOW-NQUIPPIDSA-N,cdp2w12_i04_s4_w236d3a8d7-2991-4ab9-af71-5b1780d0bcc3,cdp2w12_i04_s4_w3936b192d-860d-48bc-9027-399acd352da4,cdp2w12_i04_s4_w1e1526669-ff89-4616-8e71-efa97cbfc5ea,cdp2w12_i04_s4_w56490cc70-7034-4ef9-9eac-8b4432d73030,cdp2w12_i04_s4_w45970435a-578f-475f-8770-38f366af5568,78,4940
113,55493.0,26595-D19-3,BRD-K16306049-001-01-9,26595,D19,3,SA798085,BRD-K16306049,BROAD_CPD_ID,OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21,BHEWHBNGLCOXBN-DUWKQBIGSA-N,cdp2w7x2_d19_s3_w27cafcbff-79c2-445a-9eaf-211a98004128,cdp2w7x2_d19_s3_w36aec4ee1-560b-49db-ab59-ddafc20c2353,cdp2w7x2_d19_s3_w15db13e3d-e8e9-4bb1-b20b-a495e41a4dd4,cdp2w7x2_d19_s3_w56ac3f14a-c483-4f59-a616-a51a95ddd2a4,cdp2w7x2_d19_s3_w4d2723093-fe52-4c44-9b3e-35084c4caf0a,22,10228
114,55534.0,26598-D21-2,BRD-K35860134-001-01-8,26598,D21,2,SA799115,BRD-K35860134,BROAD_CPD_ID,OC[C@H]1O[C@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccc(F)cc3)cc21,BHEWHBNGLCOXBN-SWADQOEESA-N,cdp2w7x2_d21_s2_w26fde53e7-e7ff-48ee-9af8-ca81488b999d,cdp2w7x2_d21_s2_w357804d02-d965-4010-ac05-f63ae3aed5dc,cdp2w7x2_d21_s2_w1862d8063-a6c6-489f-8a8a-6214bb8e5b2a,cdp2w7x2_d21_s2_w5860ee023-b449-435b-8476-e3f4b63cf3ea,cdp2w7x2_d21_s2_w46b2abed3-0908-4900-ac34-3f9fce72b835,32,10158
115,35120.0,25689-N10-6,BRD-K76652136-001-06-6,25689,N10,6,SA1861904,BRD-K76652136,BROAD_CPD_ID,CC1CCC(CC1)NC(=O)C1CCN(CC1)c1cnccn1,BHLZLWCQTVYCJE-UHFFFAOYSA-N,cdp2w12_n10_s6_w249a9e886-cd44-4478-84bc-193d8b3c6f69,cdp2w12_n10_s6_w345a447a2-85ac-48aa-9827-1be836ab49c8,cdp2w12_n10_s6_w10f41fb7b-22fa-409e-9651-f028e8100b54,cdp2w12_n10_s6_w5f28d9378-2697-485e-b411-6405ceee75dc,cdp2w12_n10_s6_w46cf4ccd7-bbc5-4d65-acfe-eacfd3a9f33c,75,3489
116,10276.0,25376-K06-2,BRD-A76315007-001-05-0,25376,K06,2,SA1855082,BRD-A76315007,BROAD_CPD_ID,CC(CCc1ccccc1)NC(=O)COC(=O)C1=COCCO1,BHNVFJOWCQIQHP-UHFFFAOYSA-N,cdp2w10_k06_s2_w265bd4460-c868-4dee-9820-e6bf0ee35f08,cdp2w10_k06_s2_w3e0541028-3a78-4d9a-a7ed-1e382ab3cbf1,cdp2w10_k06_s2_w17f2d51ac-c4a8-40fc-bcd8-d3b06aced911,cdp2w10_k06_s2_w5db661c27-859b-4cfb-8ed7-b05b2fdf9715,cdp2w10_k06_s2_w479cba9a3-754b-431e-97d3-fd11894dba50,71,2908
117,25124.0,25584-P21-6,BRD-K11384830-001-05-5,25584,P21,6,SA1852717,BRD-K11384830,BROAD_CPD_ID,Cc1c(oc2ccc(C)cc12)C(=O)NCc1ccc2OCOc2c1,BHQANQKXHBAXHP-UHFFFAOYSA-N,cdp2w11_p21_s6_w2cc83484b-7697-42c6-a3c3-8db708fc8635,cdp2w11_p21_s6_w3e4fd2b88-4828-4597-a95e-34229bb2d287,cdp2w11_p21_s6_w11def827f-e441-40ed-bbc7-729c0bb5c865,cdp2w11_p21_s6_w5adb84635-cc90-4893-b8fa-dbea30b95895,cdp2w11_p21_s6_w496933767-615e-43ff-b088-3df3921bd4e4,74,5860
118,53393.0,26207-A04-3,BRD-A26173532-001-07-4,26207,A04,3,SA1861275,BRD-A26173532,BROAD_CPD_ID,CC(Nc1nc(nc2ccccc12)-c1ccccc1O)c1ccccc1,BHYGZDWYCCTSHC-UHFFFAOYSA-N,cdp2w9x2-au00026617_a04_s3_w2f97567e3-5274-45da-aaea-6a4caf7b2987,cdp2w9x2-au00026617_a04_s3_w3710b5937-138d-44df-b77c-b7c140f8ba00,cdp2w9x2-au00026617_a04_s3_w12b676a9c-e4d0-48c0-b823-c201f81f282c,cdp2w9x2-au00026617_a04_s3_w57ba51aa0-7b7a-47d5-872e-08bc8f2f5086,cdp2w9x2-au00026617_a04_s3_w4a5b49d43-3661-4444-aaa9-7551873f0512,76,9370
119,54995.0,26271-B05-3,BRD-K71296038-001-04-1,26271,B05,3,SA1857597,BRD-K71296038,BROAD_CPD_ID,COc1cccc(c1)-c1nnc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC(C)C)CC(C)C)o1,BHZUADXFFCJVJD-UHFFFAOYSA-N,cdp2w9x2-au00026606_b05_s3_w28c15180c-78a6-41bf-ba54-00f98f0f82ec,cdp2w9x2-au00026606_b05_s3_w3a0cfcc21-c094-4250-83b7-8dbac3a7c5e6,cdp2w9x2-au00026606_b05_s3_w1189c0e13-a0b5-407c-8567-2e0661c8a6ab,cdp2w9x2-au00026606_b05_s3_w558f80316-fd19-472f-b9c9-f9cb65160b0d,cdp2w9x2-au00026606_b05_s3_w4d608e0d3-609f-4b36-800a-fc9ed94eccaa,29,8031
120,33737.0,25681-N07-3,BRD-K30333141-001-05-3,25681,N07,3,SA1858361,BRD-K30333141,BROAD_CPD_ID,COc1cc(NC(=O)c2cccs2)cc(OC)c1,BIDIAQAIXYPRDY-UHFFFAOYSA-N,cdp2w12_n07_s3_w2b2a9353c-7a69-4e8d-bf33-79b1bbd056e4,cdp2w12_n07_s3_w334d8f3cc-ed04-429d-9ddd-9653ac6f24ba,cdp2w12_n07_s3_w14f7a5607-15db-44e6-9fea-734c7c4bc0c3,cdp2w12_n07_s3_w52a1abce5-01ac-461e-88e6-7b7d2a926702,cdp2w12_n07_s3_w44deed897-6c83-44e6-96d5-6e35765a21ad,79,5879
121,30350.0,25663-P08-6,BRD-K48550683-001-05-6,25663,P08,6,SA1853382,BRD-K48550683,BROAD_CPD_ID,CCOC(=O)c1ccc(cc1)N1CN(CCc2ccccc2)CN=C1S,BIHPEXBRJDRAAX-UHFFFAOYSA-N,cdp2w12_p08_s6_w2b02d0ff9-3955-410f-8750-ca13ea244912,cdp2w12_p08_s6_w37efaa3e2-12d9-4475-9594-be77ddbcfdb8,cdp2w12_p08_s6_w1f161eb4d-b075-4dc6-a6cd-3efd3cdd9946,cdp2w12_p08_s6_w5ebcad69a-f31f-46e7-834f-972919026471,cdp2w12_p08_s6_w4032d0c7b-faab-4a6e-914f-9f9669870735,42,2607
122,47403.0,26107-B06-1,BRD-K60839995-001-05-9,26107,B06,1,SA1859271,BRD-K60839995,BROAD_CPD_ID,COc1ccc(NC2=NC(N)=NC3(CCCCC3)N2)cc1,BIMFDXJOQBGSRY-UHFFFAOYSA-N,cdp2w9x2_b06_s1_w2d8679c90-f815-4fa2-af9b-5da116baf93a,cdp2w9x2_b06_s1_w3aad39bea-c896-47b2-8684-fe2b74b3e616,cdp2w9x2_b06_s1_w192e8c8ad-bc38-4789-8990-5b7a64c52f44,cdp2w9x2_b06_s1_w57be7a025-24cf-4c01-a19e-1338ebcf07f4,cdp2w9x2_b06_s1_w46c5c3f6a-3473-4205-8ffb-b69a98fcba40,56,5255
123,32012.0,25676-G11-6,BRD-K72294294-001-06-9,25676,G11,6,SA1861757,BRD-K72294294,BROAD_CPD_ID,OCCN1CCN(CC1)C(=S)c1ccc(cc1)-c1ccccc1,BIMYXEOPJWEXBJ-UHFFFAOYSA-N,cdp2w12_g11_s6_w22b2504c6-cfd7-4b92-8086-2c2c00688a15,cdp2w12_g11_s6_w32eca5e20-33e8-4f89-8533-e16405b21f26,cdp2w12_g11_s6_w111c703fd-241b-419f-9d3d-eaeb75f5318f,cdp2w12_g11_s6_w58cc7f9b3-8bef-489b-80d9-0ddaaa5ac4e2,cdp2w12_g11_s6_w4e11cf570-a24b-4762-a3a2-8dd0996c5f48,73,9428
124,168.0,24277-G09-1,BRD-K27871032-001-02-6,24277,G09,1,SA38493,lysergol,primary-common,CN1C[C@H](CO)C=C2[C@H]1Cc1c[nH]c3cccc2c13,BIXJFIJYBLJTMK-MEBBXXQBSA-N,cdp2bioactives_g09_s1_w2687dc3f6-e84b-443d-9f3f-243e5cb9fc59,cdp2bioactives_g09_s1_w39049a883-1513-4962-a7cd-b795c85255b2,cdp2bioactives_g09_s1_w1deb4c9ec-770e-4d91-8415-3247fe069eff,cdp2bioactives_g09_s1_w59f557c62-eea9-4e86-8c83-65ac63d5f79f,cdp2bioactives_g09_s1_w41f2d4832-e508-4615-aaac-5cbc3784e3fd,129,448
125,35886.0,25694-K04-4,BRD-K56221708-001-07-0,25694,K04,4,SA1859621,BRD-K56221708,BROAD_CPD_ID,Clc1ccc(cc1)-c1cc(-c2nnc3CCCCCn23)c2ccccc2n1,BIXSQXUNILNRJU-UHFFFAOYSA-N,cdp2w12_k04_s4_w290885fb7-8812-462a-95df-f5dedfa0b5da,cdp2w12_k04_s4_w312f0f416-50d9-4229-9fd3-0ac393ac50a4,cdp2w12_k04_s4_w1e57faa7b-a372-4aeb-a64e-d80abde27afe,cdp2w12_k04_s4_w5e9999c92-6d2f-4ca2-bbad-09da2a3c13c4,cdp2w12_k04_s4_w43720d352-023e-480e-a54f-f11abad91d82,63,9380
126,23985.0,25580-G18-1,BRD-K80164063-001-05-5,25580,G18,1,SA1853149,BRD-K80164063,BROAD_CPD_ID,Cc1ccc(NC(=O)CN2C(=O)N\C(=C/c3cccn3-c3cccc(c3)C(O)=O)C2=O)cc1,BJCKKLXERBMNHP-MOSHPQCFSA-N,cdp2w11_g18_s1_w20885ba9b-f1ac-433b-a7ae-b6046e79f06c,cdp2w11_g18_s1_w3e8fe65a5-f79b-45ea-9f05-6ee60e0aa733,cdp2w11_g18_s1_w15bbee127-799b-4bb5-87be-be9a16703e40,cdp2w11_g18_s1_w5562c2035-b2f2-4ed9-88f3-99c300ee71da,cdp2w11_g18_s1_w40ff1bedd-2539-4ed5-a574-b70b2f350316,99,991
127,18901.0,25503-F20-5,BRD-K84383600-001-05-7,25503,F20,5,SA1857419,BRD-K84383600,BROAD_CPD_ID,CCOc1ccc(C(=O)Cc2ccc3oc(cc3c2)C(O)=O)c(O)c1,BJEGHXIETXORPL-UHFFFAOYSA-N,cdp2w11-au00029680_f20_s5_w2d78479eb-590c-4288-baf2-bdeb80d50bf3,cdp2w11-au00029680_f20_s5_w3898118ff-8cd8-4f3b-b970-a880a564c242,cdp2w11-au00029680_f20_s5_w1462df269-c3d9-4f75-b86b-3720a2789513,cdp2w11-au00029680_f20_s5_w5c98705b7-74b8-4443-99e5-516656af8a6e,cdp2w11-au00029680_f20_s5_w4ba0ffafe-a140-4353-8fd7-40f52745f565,77,8378
128,47019.0,26081-K03-1,BRD-K46334103-001-04-2,26081,K03,1,SA1861183,BRD-K46334103,BROAD_CPD_ID,CC1CCC(CC1)OC(=O)c1[nH]c2CCCC(=O)c2c1C,BJFBZCMAPVQWEQ-UHFFFAOYSA-N,u00026613_k03_s1_w227fea986-b990-4de2-9d62-9450a95cb6c7,u00026613_k03_s1_w3d8521e75-3c8b-4a17-ab75-7eb817910aab,u00026613_k03_s1_w167281a26-bf13-40db-ad17-80d3632eb104,u00026613_k03_s1_w5ebfb1bf5-08d2-47f6-ab0e-510076270b7c,u00026613_k03_s1_w4d7dbeaa0-5ad8-4f6f-b281-e9ee5e7b7afd,37,6390
129,47821.0,26110-F22-5,BRD-K34277236-001-06-2,26110,F22,5,SA1854835,BRD-K34277236,BROAD_CPD_ID,C(Nc1nc(cs1)-c1cccnc1)c1ccccc1,BKJUOMQIAKMYAW-UHFFFAOYSA-N,cdp2w9x2_f22_s5_w29f632476-36eb-4880-9ca7-48e893199765,cdp2w9x2_f22_s5_w3196beffd-98ec-456f-845e-9c3823995961,cdp2w9x2_f22_s5_w18af18bbf-21e3-4471-8759-71b8b19aa175,cdp2w9x2_f22_s5_w502db2437-83c6-4913-a94e-427b2ea74343,cdp2w9x2_f22_s5_w4387043a5-d0a3-43e8-82d2-865191e54c4e,66,2240
130,15688.0,25430-K11-2,BRD-A64402082-001-05-8,25430,K11,2,SA1856690,BRD-A64402082,BROAD_CPD_ID,COc1cc2CCN(Cc2cc1OC)c1nc(CN2CCOCC2)nc2sc3CC(C)CCc3c12,BKWQTARJNMLXOC-UHFFFAOYSA-N,cdp2w10_k11_s2_w2d85ce796-52b8-4c6f-931d-1b22ff51bb9b,cdp2w10_k11_s2_w37d72cbcf-b36b-400c-8e2f-d381812c5251,cdp2w10_k11_s2_w124dda2b0-f3bb-4682-89d2-b2b29bd051dc,cdp2w10_k11_s2_w55ec1db7c-68e5-4e45-8b52-8e02b061774f,cdp2w10_k11_s2_w4643b8417-afd5-46a0-8395-00fe43129599,48,4578
131,40054.0,25944-B19-2,BRD-A51410489-001-01-4,25944,B19,2,SA37441,yohimbine hydrochloride,USP,COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC12,BLGXFZZNTVWLAY-UHFFFAOYSA-N,cdp2w8x2_b19_s2_w239280188-2de8-4e47-bc45-47f7e5ecc1d7,cdp2w8x2_b19_s2_w3a371c129-82b4-4261-8949-2b92b1ecb685,cdp2w8x2_b19_s2_w131edf2d7-8d82-43a6-8594-8abfb6e12b60,cdp2w8x2_b19_s2_w520e14100-a3fd-480a-9feb-de1d155a81e7,cdp2w8x2_b19_s2_w4285e7518-6e37-48f8-ae29-017a9c7df556,49,7457
132,1176.0,24293-F12-1,BRD-K86204871-001-02-2,24293,F12,1,SA83364,terconazole,INN,CC(C)N1CCN(CC1)c1ccc(OC[C@H]2CO[C@@](Cn3cncn3)(O2)c2ccc(Cl)cc2Cl)cc1,BLSQLHNBWJLIBQ-OZXSUGGESA-N,cdp2bioactives_f12_s1_w2c04062bf-8e8a-414f-9a57-73c4df418df9,cdp2bioactives_f12_s1_w39bff3de5-0cc4-4f67-b5a7-105750f50012,cdp2bioactives_f12_s1_w143dc4c90-93e0-4552-a67c-372b5898ac63,cdp2bioactives_f12_s1_w5599c0b05-a65d-4b2e-a855-974b353f6b40,cdp2bioactives_f12_s1_w4a66acef7-aa11-459b-b61b-9c694bb10a7a,148,900
133,23363.0,25578-G10-3,BRD-K42671663-001-05-0,25578,G10,3,SA1858994,BRD-K42671663,BROAD_CPD_ID,COc1ccccc1CN(Cc1nnnn1Cc1ccco1)Cc1cc2cc(C)ccc2nc1O,BMDSAZDIDMDPRU-UHFFFAOYSA-N,cdp2w11_g10_s3_w250201890-46dc-493e-91b5-6033b484401c,cdp2w11_g10_s3_w3b368f0d0-5ea6-414e-90e9-bce229bd01d0,cdp2w11_g10_s3_w180e383f8-8a72-48c7-ba36-6ceb9ba1a374,cdp2w11_g10_s3_w530311b52-ca7c-4552-848f-837dfd23a377,cdp2w11_g10_s3_w49ab3110d-db84-433b-879e-b5b6ebd97d02,58,9433
134,25553.0,25587-E07-3,BRD-A47427006-001-05-0,25587,E07,3,SA1858007,BRD-A47427006,BROAD_CPD_ID,CCc1ccc(o1)C(=O)NCC1COc2ccccc2O1,BMDUNLDUEMNPMW-UHFFFAOYSA-N,cdp2w11_e07_s3_w2fce65426-8762-4da7-b9e0-cd4293bb798d,cdp2w11_e07_s3_w340dc4646-267d-486d-bc8e-297cb088af07,cdp2w11_e07_s3_w1313906c3-7248-4afb-b49a-80aac73f804a,cdp2w11_e07_s3_w56bb32f2d-d33a-4388-a8c9-2cc7ae4d001a,cdp2w11_e07_s3_w4d1ac90cc-7957-4b10-bba3-ef1eb1a2988a,82,8022
135,125.0,24277-E22-6,BRD-K26373640-001-02-8,24277,E22,6,SA81897,SC-514,common,NC(=O)c1sc(cc1N)-c1ccsc1,BMUACLADCKCNKZ-UHFFFAOYSA-N,cdp2bioactives_e22_s6_w279118db8-1b85-4921-b03b-c813d61c3751,cdp2bioactives_e22_s6_w3cfb36357-c6c5-4c3a-8d64-1410f5070431,cdp2bioactives_e22_s6_w192cfa5ba-0ffc-4729-96f2-81c12446407f,cdp2bioactives_e22_s6_w5a2db6a87-3f57-41d1-8d4c-0d9482ae8a86,cdp2bioactives_e22_s6_w491edcad1-fc7f-4536-9e38-7c8227da0290,127,952
136,10148.0,25376-B11-6,BRD-K54394702-001-06-5,25376,B11,6,SA1857969,BRD-K54394702,BROAD_CPD_ID,O=C(CCCc1ccccc1)Nc1ccccn1,BNDUSXZNAHWOMA-UHFFFAOYSA-N,cdp2w10_b11_s6_w20c19cbce-7075-47e0-8422-2ff2b50c1dd1,cdp2w10_b11_s6_w340f9358c-d764-4e53-8460-a4cf48301da1,cdp2w10_b11_s6_w16565a1f1-4b66-4070-8a20-fc8de7f83b1d,cdp2w10_b11_s6_w571ca47e9-c417-400c-846e-ad26fc0511c4,cdp2w10_b11_s6_w410cd5cd3-a55b-4726-b976-7f640da7a4ed,60,6634
137,38050.0,25725-F22-2,BRD-K17680626-001-05-8,25725,F22,2,SA1857619,BRD-K17680626,BROAD_CPD_ID,Cc1ccc(Nc2cc(C)nc3ccc(C)cc23)cc1,BNEVHZDJSBSDRX-UHFFFAOYSA-N,cdp2w12_f22_s2_w2f0bf93ce-dc7d-4289-97c4-3ccc0e776ba9,cdp2w12_f22_s2_w3f030d58e-9264-470c-9286-799ee90a553d,cdp2w12_f22_s2_w16617f205-38f5-40ee-bf53-9fb0f5e93ebe,cdp2w12_f22_s2_w50cd98584-a860-4c5e-9bf5-c3cfa2076555,cdp2w12_f22_s2_w4d48216ee-a0eb-4b34-a145-8f5ef6818d5b,65,1470
138,53108.0,26205-A12-6,BRD-A60400887-001-05-3,26205,A12,6,SA1856976,BRD-A60400887,BROAD_CPD_ID,OC(=O)c1ccccc1N=C(S)NC(NC(=O)COc1ccccc1)C(Cl)(Cl)Cl,BNVBSMSTBHBPOG-UHFFFAOYSA-N,cdp2w9x2-au00026617_a12_s6_w2ab686bd7-7bcd-441f-942b-2cecc0401a80,cdp2w9x2-au00026617_a12_s6_w3c44f2181-0e74-4ef8-ab11-9ecb04759fdd,cdp2w9x2-au00026617_a12_s6_w15c1e6fab-42e2-4f7d-abfa-7e8c9cf743cb,cdp2w9x2-au00026617_a12_s6_w5a00fbca3-0acb-4819-aaf2-3dd11f9e7395,cdp2w9x2-au00026617_a12_s6_w4564f85a3-7ba2-4724-aa31-78c702fbcc8a,55,9014
139,41886.0,25966-P09-4,BRD-K17674993-001-03-1,25966,P09,4,SA83597,diflorasone diacetate,USAN,C[C@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(C)=O)C(=O)COC(C)=O,BOBLHFUVNSFZPJ-JOYXJVLSSA-N,cdp2w8x2_p09_s4_w29eb40cde-d191-4c4b-965a-0f8482b391ac,cdp2w8x2_p09_s4_w3470347c9-9ca3-4695-91d8-4b20de56e9a0,cdp2w8x2_p09_s4_w11b96ee86-9c56-4b76-9735-b4d361bcba60,cdp2w8x2_p09_s4_w56e1fc910-0b6e-4660-92b3-7d592eee85af,cdp2w8x2_p09_s4_w47cd4217c-d7d9-41d3-bd29-8124a2ade15a,25,1351
140,29985.0,25643-N22-1,BRD-K64400622-001-05-7,25643,N22,1,SA1859199,BRD-K64400622,BROAD_CPD_ID,Cc1ccc(F)c(NC(=O)CCc2ccccc2)c1,BOECBBJDMCTSAU-UHFFFAOYSA-N,cdp2w12_n22_s1_w2af5f83b0-0259-4e22-90ec-21c961f404d1,cdp2w12_n22_s1_w33d6bef3b-6c46-480c-8e0f-eeb990517c1a,cdp2w12_n22_s1_w15e5a43e4-1560-4b3d-adbb-c1e9ed2b0fb6,cdp2w12_n22_s1_w50e8bc73a-3066-4d55-8f21-949eda49202f,cdp2w12_n22_s1_w49ebbfd16-7f11-4123-bdf6-f4ebdf0e782b,57,9457
141,11891.0,25392-O14-3,BRD-A29485854-001-06-1,25392,O14,3,SA1857502,BRD-A29485854,BROAD_CPD_ID,CC(c1ccc(F)cc1)n1c(S)nnc1-c1cccs1,BONCYRDOUOIJMP-UHFFFAOYSA-N,cdp2w10_o14_s3_w283a57616-4e27-417b-ad93-9cafbdd25591,cdp2w10_o14_s3_w345d95d6e-bc70-4d7b-9831-56f12eaa31d3,cdp2w10_o14_s3_w1d52357c9-7232-4f28-9810-d37456db67af,cdp2w10_o14_s3_w5003e036f-6325-4251-9a9f-d01d2a26af4e,cdp2w10_o14_s3_w4ecb93df1-7161-4350-bf94-0334a8263767,43,6197
142,24117.0,25580-N16-1,BRD-A45498171-001-06-0,25580,N16,1,SA1856400,BRD-A45498171,BROAD_CPD_ID,COc1ccc(cc1)-n1c(C)cc(C(=O)CN2C(=O)NC3(CCCc4sccc34)C2=O)c1C,BOOAAVBIPNGXKJ-UHFFFAOYSA-N,cdp2w11_n16_s1_w284597ddb-4e15-4f74-ae3c-d0f7d23158a1,cdp2w11_n16_s1_w3cdfa7ef6-8aa0-4010-87c9-81ca289e3fb4,cdp2w11_n16_s1_w1736d0856-5b16-4b25-8e56-08317c5da39e,cdp2w11_n16_s1_w5e1184ba4-b5ec-4600-9026-73614af5b721,cdp2w11_n16_s1_w444a25391-9944-4970-bc16-25771685b8ec,81,6947
143,19884.0,25565-H11-4,BRD-K62497215-001-05-8,25565,H11,4,SA1855444,BRD-K62497215,BROAD_CPD_ID,CC(C)(C)c1ccc(cc1)C(=O)c1c[nH]c(c1)C(=O)NCCc1ccccn1,BOPGFRQPXYLMRT-UHFFFAOYSA-N,cdp2w11_h11_s4_w294fd874e-3bd2-4efd-8960-57972c41637d,cdp2w11_h11_s4_w39f401607-0846-49d4-85be-2c55da41ee97,cdp2w11_h11_s4_w1edc873b9-009e-44e6-bcc1-99964954dffa,cdp2w11_h11_s4_w596d5bbb7-e065-415e-844f-0867e3a0deb7,cdp2w11_h11_s4_w4e72ea69b-d52b-403d-b0cf-b74ab8b4be64,61,5554
144,31869.0,25675-P17-1,BRD-A21346136-001-05-5,25675,P17,1,SA1857013,BRD-A21346136,BROAD_CPD_ID,CC1=C(C#N)C(NC(=O)C2CC2)(C(=O)N1)C(F)(F)F,BPAVCFHQKIHUDI-UHFFFAOYSA-N,cdp2w12_p17_s1_w26120f1e2-e601-4214-adb3-622a8b634a20,cdp2w12_p17_s1_w30b9353ba-9a2a-4bc5-b43a-1424ef7188e2,cdp2w12_p17_s1_w169f20ba4-e39c-4682-850a-ad5f3b68e06d,cdp2w12_p17_s1_w5cebee048-1b30-434b-8d5f-19fca7e767cb,cdp2w12_p17_s1_w4b8eab977-aa5c-4a99-95a1-2c2c84244a28,63,6282
145,22597.0,25573-O13-5,BRD-A17940587-001-05-5,25573,O13,5,SA1855416,BRD-A17940587,BROAD_CPD_ID,COc1cc(ccc1OCC(O)=O)C1CC(=NN1c1ccccc1)c1ccccc1,BPERWKHCZSFQRP-UHFFFAOYSA-N,cdp2w11_o13_s5_w20b981260-fb89-4cc5-a089-0c9e3ea49feb,cdp2w11_o13_s5_w33933e9a7-28ce-4dec-9b94-5b38314664fa,cdp2w11_o13_s5_w1540508d1-160d-45b9-9512-464e122b9f8d,cdp2w11_o13_s5_w59887a150-829c-4898-adf3-1a06ed0a4447,cdp2w11_o13_s5_w416bd5e1f-d3fa-4da3-a380-7a60b080121c,55,7535
146,10864.0,25382-A20-2,BRD-K16354233-001-05-6,25382,A20,2,SA1859888,BRD-K16354233,BROAD_CPD_ID,Cc1cc(Cl)c(cc1OCC(=O)Nc1nncs1)S(=O)(=O)NC1CCCCC1,BPFRGYGBVQPCEH-UHFFFAOYSA-N,cdp2w10_a20_s2_w2325da8c8-d0c0-416a-9971-ac0ec63cb5db,cdp2w10_a20_s2_w3789430b3-7ff7-4324-8b2a-9386c1624f5f,cdp2w10_a20_s2_w13aaf9ef9-f89e-443b-8b24-20ad1341d5b7,cdp2w10_a20_s2_w58a01fa51-d31f-47c8-894d-56766aa55a90,cdp2w10_a20_s2_w449b461de-d8bd-4523-bc41-4ce9f7ed09ab,43,8473
147,14682.0,25424-E10-4,BRD-K69046399-001-05-4,25424,E10,4,SA1860873,BRD-K69046399,BROAD_CPD_ID,CCC(CC)C(=O)Nc1cccc(c1)C(=O)NCc1ccco1,BPKBIZIKUJPWKX-UHFFFAOYSA-N,cdp2w10_e10_s4_w294321834-8175-45af-a2d9-9091df821cfa,cdp2w10_e10_s4_w3bf601f21-3612-49e2-83f1-08d17fc3842c,cdp2w10_e10_s4_w1696e81ab-3205-466c-8653-1c06485d833b,cdp2w10_e10_s4_w5f8cce536-e7ac-486c-8f21-c6cb479b9adb,cdp2w10_e10_s4_w434e76015-8b8c-475b-ab59-e9409da0f80f,59,4056
148,52884.0,26204-E13-4,BRD-A34658965-001-05-4,26204,E13,4,SA1858116,BRD-A34658965,BROAD_CPD_ID,Clc1ccccc1NC(=S)NC(NC(=O)Cc1cccc2ccccc12)C(Cl)(Cl)Cl,BPKBLWFZGRSWLR-UHFFFAOYSA-N,cdp2w9x2-au00026617_e13_s4_w2539766de-a590-4b7f-8552-d21558032f5e,cdp2w9x2-au00026617_e13_s4_w32f898788-afe4-4cb4-8854-e07aceafbfcc,cdp2w9x2-au00026617_e13_s4_w1c81418eb-c7de-4988-919a-2efb6cd4c73a,cdp2w9x2-au00026617_e13_s4_w5fb886427-bbb1-4305-be0f-eb62432700c6,cdp2w9x2-au00026617_e13_s4_w41887f84b-ef1c-4b65-a446-fde6b0c066de,30,2843
149,43519.0,25985-F14-5,BRD-K47659338-003-01-0,25985,F14,5,SA792832,EMD 386088,to-be-curated,Cc1[nH]c2ccc(Cl)cc2c1C1=CCNCC1,BPPGPYJBCVXILI-UHFFFAOYSA-N,cdp2w8x2_f14_s5_w2d4f3060b-35c0-4fcf-bd0a-30a9abc8ff62,cdp2w8x2_f14_s5_w34c6ad624-3c64-48f5-a67f-b352b0a5932f,cdp2w8x2_f14_s5_w13456264d-c802-4c79-befd-b3008f932091,cdp2w8x2_f14_s5_w504507f90-583a-408a-8e16-a0af45508357,cdp2w8x2_f14_s5_w4a2f795d4-84cc-43ca-98f0-0e558f963666,70,963
150,29449.0,25642-C20-5,BRD-K14812927-001-06-4,25642,C20,5,SA1861909,BRD-K14812927,BROAD_CPD_ID,COc1nccc(c1C(=O)NC(=O)Nc1ccccc1)C(F)(F)F,BQDKVXFAQJWIKE-UHFFFAOYSA-N,cdp2w12_c20_s5_w29ea894ae-4989-439c-b9ca-3f2d4d903cad,cdp2w12_c20_s5_w391a8da91-e4cc-4000-b947-caac7c007ef8,cdp2w12_c20_s5_w12b228c5c-c7ab-4088-a4dc-405765097df8,cdp2w12_c20_s5_w5313c51e8-b537-47f5-ac92-f9245d24cc25,cdp2w12_c20_s5_w4421f44fa-4149-4944-ae8a-c68affb32be0,72,4728
151,34741.0,25688-J09-5,BRD-K95170281-001-05-1,25688,J09,5,SA1857954,BRD-K95170281,BROAD_CPD_ID,Cc1ccc(cc1)-c1csc2nc3cc(C(N)=O)ccc3c(=O)n12,BQHMKUHKKQPGKA-UHFFFAOYSA-N,cdp2w12_j09_s5_w2696565d9-42e1-40d8-b879-f2b7ade66f2c,cdp2w12_j09_s5_w37cc30f4b-48e5-45e2-8be7-d986e1f270b1,cdp2w12_j09_s5_w11e374a45-745c-4718-9b86-8be2eadffc7d,cdp2w12_j09_s5_w52029fe49-9623-4653-8a15-b514a9af8f42,cdp2w12_j09_s5_w47e2d9e50-ec47-4273-8d05-02ecced9c15f,72,5254
152,43015.0,25983-O16-5,BRD-K38055836-001-03-9,25983,O16,5,SA83449,etamivan,INN,CCN(CC)C(=O)c1ccc(O)c(OC)c1,BQJODPIMMWWMFC-UHFFFAOYSA-N,cdp2w8x2_o16_s5_w2cb477ff5-76ce-4a1c-bc1d-042f883d02b6,cdp2w8x2_o16_s5_w33cf16074-592f-4fcb-8266-d4502edbe087,cdp2w8x2_o16_s5_w17d30768e-8e5a-4482-93f1-156bf6483a89,cdp2w8x2_o16_s5_w5688639c4-ffb6-4f0c-a766-fe71964bd8e2,cdp2w8x2_o16_s5_w49b1be684-2f99-4595-8cfe-dc65344d9990,19,1389
153,38320.0,25726-B15-2,BRD-K37052916-001-07-1,25726,B15,2,SA1858736,BRD-K37052916,BROAD_CPD_ID,N#C\C(=C/N1CCN(Cc2ccc3OCOc3c2)CC1)c1nc2ccccc2s1,BQPBTSDVGARJHD-SAPNQHFASA-N,cdp2w12_b15_s2_w21f978f33-66fd-4e03-ae08-186a95910835,cdp2w12_b15_s2_w3b09b617c-fdde-4b54-9b2d-7d27ab0e3dfb,cdp2w12_b15_s2_w191474c91-82b0-4851-bda4-9a50e5fbf260,cdp2w12_b15_s2_w5b5e0ea38-8296-4e56-820d-9d13ff59ba98,cdp2w12_b15_s2_w47a5b7d79-9841-4798-a349-63a05994dac5,66,1722
154,32875.0,25679-E11-5,BRD-A19928752-001-05-7,25679,E11,5,SA1854477,BRD-A19928752,BROAD_CPD_ID,CC(Sc1ccc(C)cc1)C(=O)Nc1nc[nH]n1,BQPRBYLILBRUER-UHFFFAOYSA-N,cdp2w12_e11_s5_w2cb0d5cdf-7c59-47dd-b72f-e6ed3741c475,cdp2w12_e11_s5_w3fb53a2f4-aacd-4b1b-a732-51d0a8bdb462,cdp2w12_e11_s5_w1c955aab6-28fd-4cc5-9eae-94d4344aeefb,cdp2w12_e11_s5_w563a550f9-0a69-492e-ae1f-216d4c2cd89c,cdp2w12_e11_s5_w4daf6dd2f-4c2e-4732-9645-fbc52945731e,50,9175
155,56237.0,26739-O13-3,BRD-K15464148-004-02-9,26739,O13,3,SA1455557,BRD-K15464148,BROAD_CPD_ID,OC[C@H]1N[C@H](C#N)[C@H]1c1ccc(cc1)C#Cc1ccccc1F,BQRBXGWYUGGWQF-GUDVDZBRSA-N,cdp2w13_o13_s3_w28610b660-0baa-400f-bea2-d3dcff162c01,cdp2w13_o13_s3_w3c7b3a4af-65bb-421a-aa9d-1e1bd92bb88f,cdp2w13_o13_s3_w1e2d0d0c5-0f17-40fa-8f6c-c693421fe86c,cdp2w13_o13_s3_w5ce417bb9-7ff3-4017-af82-82bd4f027904,cdp2w13_o13_s3_w41e84b39d-63d8-4ebf-a684-8842b7c8c934,93,10377
156,27206.0,25594-C15-6,BRD-A43575461-001-06-6,25594,C15,6,SA1858739,BRD-A43575461,BROAD_CPD_ID,CN(C)N1C(N)=C(C#N)C(c2cccc3ccccc23)C2=C1CC(CC2=O)c1ccccc1,BRDWSRHFGGHGAV-UHFFFAOYSA-N,cdp2w11_c15_s6_w290961922-9f1e-4b71-b0e9-cb1b9381b480,cdp2w11_c15_s6_w39d849a10-e978-4e57-a94d-462c19d8c4d4,cdp2w11_c15_s6_w16420ecbc-1ad2-4a18-aaa1-2dfb9504c401,cdp2w11_c15_s6_w551f56f9a-bc28-4e76-978d-c70ec07b2d52,cdp2w11_c15_s6_w4d3156f9c-edc4-42ad-8f88-184ee0063937,46,5033
157,52059.0,26181-F07-1,BRD-K94945014-001-05-1,26181,F07,1,SA1855697,BRD-K94945014,BROAD_CPD_ID,O=C(N1CCN(CC1)S(=O)(=O)c1ccc(cc1)S(=O)(=O)NC1CCCC1)c1ccco1,BRHYGSWEPKBNQL-UHFFFAOYSA-N,cdp2w9x2-au00026617_f07_s1_w2442f8477-293d-4597-9a94-c7a90a26374c,cdp2w9x2-au00026617_f07_s1_w38f92d94c-64e0-43ab-84df-8a4bfe41992a,cdp2w9x2-au00026617_f07_s1_w1b83c2046-1a59-4cfb-8871-d537243ee403,cdp2w9x2-au00026617_f07_s1_w5a3ffce5d-b8fe-4960-9255-5ff5ac32a80d,cdp2w9x2-au00026617_f07_s1_w482a309a6-188d-4632-b115-77703d15fcd5,49,8681
158,47234.0,26092-G12-6,BRD-A46631350-001-06-8,26092,G12,6,SA1856370,BRD-A46631350,BROAD_CPD_ID,Cc1ccc(Cn2c3nc4ccccn4c(=O)c3cc(C(=O)NCC3CCCO3)c2=N)cc1,BRLHDBQJAXKNDL-UHFFFAOYSA-N,cdp2w9-au00026609_g12_s6_w21f7e4c9f-dba2-4d30-9ad7-46d8231d4d82,cdp2w9-au00026609_g12_s6_w3caec48cf-2ae8-4717-b5d5-e38fec8b2710,cdp2w9-au00026609_g12_s6_w1f501b5d7-4af4-4c8c-bfd7-2ca52b7f7a43,cdp2w9-au00026609_g12_s6_w52406c43b-37e3-4a6f-b2df-94b642e0fe9f,cdp2w9-au00026609_g12_s6_w41bd886ed-0c87-45ac-8c95-acde583ebc04,75,5445
159,25951.0,25588-N13-5,BRD-K11532823-001-05-8,25588,N13,5,SA1857484,BRD-K11532823,BROAD_CPD_ID,COc1ccccc1C(=O)Nc1ccccc1SC,BRQVDITYGYFMBF-UHFFFAOYSA-N,cdp2w11_n13_s5_w25e5ef751-3d0c-4605-a056-81fdb85164b8,cdp2w11_n13_s5_w383e77e7a-3b96-49d4-99e8-b7d199103ffe,cdp2w11_n13_s5_w1778387f4-5645-4142-bbff-bfadc65593fe,cdp2w11_n13_s5_w5e3f616b1-1e49-48fb-8df3-4414bbd7805d,cdp2w11_n13_s5_w4fa6ad9de-044b-4536-a970-b700c5e619b4,47,7340
160,56445.0,26771-P24-1,BRD-K31618614-001-01-3,26771,P24,1,SA1463559,BRD-K31618614,BROAD_CPD_ID,CN1[C@@H]2CC[C@@H](CC(=O)NCC3CCCCC3)O[C@@H]2COc2ccc(NC(=O)c3cccc(F)c3)cc2C1=O,BSKZHQCAOYVBFU-VXQMPNGUSA-N,cdp2w13_p24_s1_w2892b6d4a-d536-46e5-bbd4-b081bedeef92,cdp2w13_p24_s1_w3dab9cbc6-3ac5-48e0-b703-0c1b31d449e6,cdp2w13_p24_s1_w165fe6f11-871d-4614-a07e-2a61d0bde30e,cdp2w13_p24_s1_w533cca5e5-90ee-4efc-9ef2-1239035cedc0,cdp2w13_p24_s1_w42a486ba7-2b33-4a91-afdf-374bd08f3f8f,75,10461
161,18889.0,25503-F04-5,BRD-K93124351-001-05-5,25503,F04,5,SA1862144,BRD-K93124351,BROAD_CPD_ID,Clc1cccc(\C=C\C(=O)OCc2cn3cc(Cl)ccc3n2)c1,BSWFIUKXQUULRG-QPJJXVBHSA-N,cdp2w11-au00029680_f04_s5_w21ed49917-404b-41dd-87e1-22b39f707cad,cdp2w11-au00029680_f04_s5_w345a8a7b5-19bf-439c-9ff1-35047604e0f0,cdp2w11-au00029680_f04_s5_w14502565c-9be1-4e1f-b3c8-d58210862fdd,cdp2w11-au00029680_f04_s5_w501c9e593-1574-463f-9911-579b2ac00da7,cdp2w11-au00029680_f04_s5_w4d80c8896-d19c-4cfc-adb2-a2bbb19b6331,77,6853
162,39465.0,25915-A24-1,BRD-K09149805-001-01-6,25915,A24,1,SA929241,BRD-K09149805,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)N[C@H]1C=C[C@@H](CC(=O)N2CCC(Cc3ccccc3)CC2)O[C@H]1CO,BTASCBMIIFGVQJ-RNXOBYDBSA-N,cdp2w6x2_a24_s1_w25d9dda7c-bbce-4f0d-bfd5-2d3084aa2998,cdp2w6x2_a24_s1_w3ecd35bed-c688-4b20-b62d-2a3a943aa4bb,cdp2w6x2_a24_s1_w13ae52cc0-d99b-4865-b63f-624a0b079642,cdp2w6x2_a24_s1_w5b09847af-4123-402c-b942-0c0bebb79bca,cdp2w6x2_a24_s1_w4a92d0c72-4fb0-4bf8-8f21-e8f7c072aa9d,42,10253
163,33979.0,25683-H18-5,BRD-K28142751-001-04-6,25683,H18,5,SA1856645,BRD-K28142751,BROAD_CPD_ID,Cc1csc2c1nc(NC(=O)c1ccc(F)cc1)sc2=O,BTKQVTWFCFGYHS-UHFFFAOYSA-N,cdp2w12_h18_s5_w230775427-13fb-43cb-b27c-a19914570a2d,cdp2w12_h18_s5_w3f5605973-9220-4696-9006-6a1c32f6f23d,cdp2w12_h18_s5_w16762542b-28e1-4750-9b19-703a7b6b8cee,cdp2w12_h18_s5_w5b6080ed2-48db-499b-8213-788fa8c2519e,cdp2w12_h18_s5_w457bade47-428b-4843-9b52-aa72a5fc1835,60,6135
164,2354.0,24301-G12-3,BRD-A65440446-001-02-5,24301,G12,3,SA82212,cimaterol,INN,CC(C)NCC(O)c1ccc(N)c(c1)C#N,BUXRLJCGHZZYNE-UHFFFAOYSA-N,cdp2bioactives_g12_s3_w267ea67d8-4b0d-4260-aa8c-9dd431a65b8c,cdp2bioactives_g12_s3_w35dcf8a28-6a2b-47b9-a903-9c423d70d334,cdp2bioactives_g12_s3_w1b4d88ec0-afb1-4861-96c9-22fc05934ae8,cdp2bioactives_g12_s3_w50166c0c4-e3b5-4760-829b-555f79ac3c8b,cdp2bioactives_g12_s3_w475d3a9b6-d211-48f9-8ac3-c8e9d8895e1a,103,3406
165,19457.0,25564-A18-3,BRD-A62693435-001-05-8,25564,A18,3,SA1853295,BRD-A62693435,BROAD_CPD_ID,COc1ccc(cc1OC)-c1nc(CS(=O)CC(=O)NC2CCCc3ccccc23)c(C)o1,BUYHNGPKNHGENZ-UHFFFAOYSA-N,cdp2w11_a18_s3_w2a4549b5a-5bd0-4cf5-950d-5dfc0c2edd9c,cdp2w11_a18_s3_w3e11f1184-d816-410c-a8e9-c2df3cb36b6d,cdp2w11_a18_s3_w117d53434-1d79-4f8b-902c-7728f28130d7,cdp2w11_a18_s3_w5f187d528-d4c4-4a7f-9cea-f33dbe0200d0,cdp2w11_a18_s3_w4480e3ca6-563e-477d-9e2e-1fa42d59d722,57,8205
166,37213.0,25707-M13-5,BRD-K98220872-001-05-6,25707,M13,5,SA1860334,BRD-K98220872,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)CCC(=O)OCC(=O)Nc1ncc(Cl)cc1Cl,BUZMITYLYOZNNE-UHFFFAOYSA-N,cdp2w12_m13_s5_w28becc759-73a5-454c-b57b-55a6d8fa2041,cdp2w12_m13_s5_w347db9901-84e6-473b-a0fa-1849a9287fb6,cdp2w12_m13_s5_w1bb89c852-fe2a-4cce-965a-0f7464c00925,cdp2w12_m13_s5_w5e6f9905a-3867-41ae-9143-ea82625ff89b,cdp2w12_m13_s5_w4e6617968-ec3c-42ff-9727-89631d4c11c1,48,8877
167,19513.0,25564-D09-5,BRD-K54015635-001-05-0,25564,D09,5,SA1858971,BRD-K54015635,BROAD_CPD_ID,CC(C)OC(=O)c1ccc(cc1)N1N=C(C)\C(=C\C=C\c2ccco2)C1=O,BVASLSKDOFWFFT-AGASNCOBSA-N,cdp2w11_d09_s5_w243b78a62-d06f-4025-bd4b-824d4558a56e,cdp2w11_d09_s5_w342023078-4227-440c-a21a-6ef6d56e0e76,cdp2w11_d09_s5_w17c692b67-92ef-4179-8000-ba201e5f3080,cdp2w11_d09_s5_w59295dcbe-bc36-4fd6-be4b-20879fd571d0,cdp2w11_d09_s5_w4c79997ba-f17c-4142-b98f-5c65068203db,73,8333
168,33701.0,25681-L06-3,BRD-A53598982-001-05-7,25681,L06,3,SA1857248,BRD-A53598982,BROAD_CPD_ID,CCC(C)c1ccc(Nc2ncccc2C#N)cc1,BVFMRMYKLFNXLT-UHFFFAOYSA-N,cdp2w12_l06_s3_w2d8087423-ba36-4bf2-8c10-da0c98ed3b3e,cdp2w12_l06_s3_w3640b7a6c-9936-43ed-be6b-fce93b547f90,cdp2w12_l06_s3_w1b75f95b7-ba58-4cb8-bae6-5ccd6eea0655,cdp2w12_l06_s3_w5fa4c9f6f-2f7b-4e3e-b6b6-2253b471eb81,cdp2w12_l06_s3_w4f5424b12-5ca1-4597-9e13-06a820d20a4b,75,7429
169,56025.0,26680-M07-1,BRD-K35407043-001-01-8,26680,M07,1,SA418898,BRD-K35407043,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O,BVMGYWBUQYFDAA-LQWHRVPQSA-N,cdp2w13_m07_s1_w2a9ce7fed-6943-46bb-b130-c2369c9ad92b,cdp2w13_m07_s1_w3228edd5e-935f-44c6-9192-8fc0dfe63147,cdp2w13_m07_s1_w1dc300c90-c095-48b9-b7ea-cc4422e047a0,cdp2w13_m07_s1_w5c35e97a6-ae04-4e2b-9356-e56ffbcd53b3,cdp2w13_m07_s1_w48c2d1e23-9b29-42b5-87c7-42632f0544d0,116,10062
170,55883.0,26679-M05-3,BRD-K88362460-001-01-5,26679,M05,3,SA418836,BRD-K88362460,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2cccnc2)OCc2cnnn2CCCC1=O,BVMGYWBUQYFDAA-WAOWUJCRSA-N,cdp2w13_m05_s3_w2e184fc00-bf3b-4e49-a647-ed099e6c7c68,cdp2w13_m05_s3_w3da8a7bcc-aa22-4e00-b01d-05fc9006f2b3,cdp2w13_m05_s3_w1961a2b80-74e3-4c28-9427-3eb333f3fc7c,cdp2w13_m05_s3_w510e5fe3e-64d6-4dbf-ac84-f6d384aa6eb4,cdp2w13_m05_s3_w48331697c-0ed5-49c4-b5de-8d0ef96e45da,88,10344
171,50923.0,26140-I07-5,BRD-A96334094-001-11-9,26140,I07,5,SA1857833,BRD-A96334094,BROAD_CPD_ID,NC(=O)C1CCCNC1,BVOCPVIXARZNQN-UHFFFAOYSA-N,cdp2w9x2_i07_s5_w2d481c0fb-85ca-44f0-9931-9c4aee851988,cdp2w9x2_i07_s5_w3d683ce82-b231-4fa2-a443-9fe2d7472411,cdp2w9x2_i07_s5_w16207d595-24ef-4863-9d3b-16649c943088,cdp2w9x2_i07_s5_w5cc033b57-2a96-4524-ba28-fb7528cd7087,cdp2w9x2_i07_s5_w46c37d521-0106-4e0f-a8e6-c77769341d7f,62,7891
172,41874.0,25966-P03-4,BRD-K17294426-050-04-0,25966,P03,4,SA59877,clebopride,INN,COc1cc(N)c(Cl)cc1C(=O)NC1CCN(Cc2ccccc2)CC1,BVPWJMCABCPUQY-UHFFFAOYSA-N,cdp2w8x2_p03_s4_w218ed11cb-2e7c-480d-95fa-b1f4fc4b95a8,cdp2w8x2_p03_s4_w375364885-bb3a-4099-9999-a54dcbf896ca,cdp2w8x2_p03_s4_w1b6646bc9-ad42-441f-9b72-b551785d88df,cdp2w8x2_p03_s4_w5788b9ae4-933e-4d7c-b7d9-0a4da597eeca,cdp2w8x2_p03_s4_w40376fbe3-c80a-4c60-9377-dc69d1bba3e8,30,770
173,29061.0,25639-O03-1,BRD-K71615409-001-06-8,25639,O03,1,SA1860965,BRD-K71615409,BROAD_CPD_ID,CCn1cnc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc12,BWRLFAVXHFYLJO-UHFFFAOYSA-N,cdp2w12_o03_s1_w290023ca0-c234-4fdd-9a2b-835286698e5d,cdp2w12_o03_s1_w3bd9bbb8a-3a70-496c-b5be-946ff5aeb812,cdp2w12_o03_s1_w1ac7c7e4d-fe1c-47cf-bb82-8a9e11f9f9ee,cdp2w12_o03_s1_w51fac1aba-4b81-4e58-99e3-84f1d1e25a09,cdp2w12_o03_s1_w421ebc6a4-8774-4055-a6d3-9dc4802ce578,68,3851
174,41490.0,25965-M21-4,BRD-K14618467-003-01-8,25965,M21,4,SA792913,IKK inhibitor VII,common,O=C(N1CCC(CC1)N1CCCC1)c1ccc(Nc2nccc(n2)-c2cc3ccccc3s2)cc1,BWZJBXAPRCVCKQ-UHFFFAOYSA-N,cdp2w8x2_m21_s4_w2e35d18eb-ce03-4e9e-8252-f4d503e1ca02,cdp2w8x2_m21_s4_w3749ff649-1e3f-4e3c-81aa-f64376eee9c6,cdp2w8x2_m21_s4_w11ccd43b1-e01f-437e-baea-c7e1ac63228d,cdp2w8x2_m21_s4_w50d389f8b-c0d7-4dd2-b877-f7eefa5d6927,cdp2w8x2_m21_s4_w43a575a32-717b-4d60-a8c4-1b4941e675c5,45,972
175,30268.0,25663-L05-2,BRD-K32230012-001-05-5,25663,L05,2,SA1859451,BRD-K32230012,BROAD_CPD_ID,CC(=O)Nc1cccc(c1)C(=O)OCC(=O)c1ccccc1Cl,BXBOJSOQMGHPHX-UHFFFAOYSA-N,cdp2w12_l05_s2_w23114f05a-8722-4a8b-a9db-ccc09de661c5,cdp2w12_l05_s2_w3f789301d-0fcf-40db-93fd-d8ec3b07216e,cdp2w12_l05_s2_w13a208192-d281-49ac-bdc7-14cb8556a6c9,cdp2w12_l05_s2_w5661e8665-f54a-47bd-9824-f12799390aef,cdp2w12_l05_s2_w40754ae51-b4ff-46ee-b73a-534976789f05,59,6235
176,16548.0,25435-F19-4,BRD-K13591916-001-05-0,25435,F19,4,SA1854135,BRD-K13591916,BROAD_CPD_ID,COc1ccccc1-c1cc(no1)C(=O)N1CCCCC1,BXFYHKIKABSLND-UHFFFAOYSA-N,cdp2w10_f19_s4_w2ed6bc191-6ce9-44ee-9b19-0b3ac430efb3,cdp2w10_f19_s4_w3160ec9c3-4a6f-4370-8874-64aee6d3b99e,cdp2w10_f19_s4_w1a0ab9816-61b9-4e92-a3ea-74dd526aea09,cdp2w10_f19_s4_w59fe83a9a-c8a1-4e00-8389-7dab02b20728,cdp2w10_f19_s4_w44c38350a-c3d7-4207-a993-cd89f0704ee2,44,4466
177,46799.0,26071-P08-3,BRD-K03141963-001-05-8,26071,P08,3,SA1860823,BRD-K03141963,BROAD_CPD_ID,CCOc1cc(ccc1Br)S(=O)(=O)n1nc(C)cc1C,BYKJNRBBHJHNTG-UHFFFAOYSA-N,cdp2w9x2_p08_s3_w2edb9e8aa-a1ae-4876-847d-03a4753c036b,cdp2w9x2_p08_s3_w3ad0c1e9d-f31c-4b4e-9f1d-aadab1f75496,cdp2w9x2_p08_s3_w18aac1039-9b45-45c4-9eb2-6decdb5de395,cdp2w9x2_p08_s3_w55abb5a1e-c207-4c12-900f-31ee7ceeb854,cdp2w9x2_p08_s3_w439682914-e645-4ddf-8c52-6b852b9d8c51,72,2213
178,16462.0,25435-B12-2,BRD-K91195567-001-05-7,25435,B12,2,SA1854882,BRD-K91195567,BROAD_CPD_ID,COc1ccccc1C(=O)NCC(=O)Nc1ccccc1,BYMGLOKVVQNTEO-UHFFFAOYSA-N,cdp2w10_b12_s2_w242207131-be1b-485a-8abe-e50c96fc46c0,cdp2w10_b12_s2_w3a5ef531b-4719-4a20-94bc-04b43d33fff2,cdp2w10_b12_s2_w1467e56a4-ab1b-405f-b9a7-f2e0d2862870,cdp2w10_b12_s2_w50e4271fc-49bc-43f8-a797-d16fdd8ca73e,cdp2w10_b12_s2_w4b172ac33-63a9-461c-a2ea-76052dd59ae9,41,9098
179,36248.0,25695-M12-6,BRD-K64146385-001-05-3,25695,M12,6,SA1852344,BRD-K64146385,BROAD_CPD_ID,CCN1C(=O)c2cccc3cccc1c23,BYZKRKXJSNSHEE-UHFFFAOYSA-N,cdp2w12_m12_s6_w2948cfeaf-8ee9-4174-a90f-bccdb43400a3,cdp2w12_m12_s6_w3626c8741-cdbc-456f-ba9d-97f0360c3e34,cdp2w12_m12_s6_w1f33596a2-d415-40bd-82a9-13a8790d0d2e,cdp2w12_m12_s6_w5c9a731b9-30f4-411f-ba90-144fbf4b05af,cdp2w12_m12_s6_w4b08eef56-9f17-4b12-a63b-f8c2b0c93088,59,9344
180,5051.0,24311-C02-6,BRD-K43457670-001-04-7,24311,C02,6,SA58164,acetazolamide,INN,CC(=O)Nc1nnc(s1)S(N)(=O)=O,BZKPWHYZMXOIDC-UHFFFAOYSA-N,cdp2bioactives_c02_s6_w28ac7fe10-aab0-42ae-b351-40dff4eb7666,cdp2bioactives_c02_s6_w352c6fb91-15ed-4321-be2c-c821b36f9d75,cdp2bioactives_c02_s6_w1f0fac8d5-d2f6-4b61-86b0-5038b35d9621,cdp2bioactives_c02_s6_w52700e664-02d7-400f-87a1-85f42a315750,cdp2bioactives_c02_s6_w4f12bea36-0d50-4ea2-9934-7195ebc73696,51,30
181,37708.0,25724-E10-2,BRD-K53146207-001-05-2,25724,E10,2,SA1855202,BRD-K53146207,BROAD_CPD_ID,O=C(NC1CCCCC1)Nc1nc2ccccc2[nH]1,BZSIUMLEFGANJH-UHFFFAOYSA-N,cdp2w12_e10_s2_w2397aa99d-214d-4c44-a2c3-22064343446c,cdp2w12_e10_s2_w3ecdb61cc-12d3-41ea-ae27-439c4e9f5a1a,cdp2w12_e10_s2_w17d662318-87bb-4164-a720-bd7b5174ac2e,cdp2w12_e10_s2_w58877d3ab-c2e8-4a31-9a5f-c80fe1001084,cdp2w12_e10_s2_w4dac246cb-2bb5-4fd5-aa69-efe11f0a01c2,56,8586
182,37445.0,25708-H08-3,BRD-K22606571-001-05-1,25708,H08,3,SA1852801,BRD-K22606571,BROAD_CPD_ID,CCSc1nnc(NC(=O)C(C)(C(F)(F)F)C(F)(F)F)s1,CACIMFREAFKQBY-UHFFFAOYSA-N,cdp2w12_h08_s3_w2845be453-2574-45c1-bf35-550ea1a5dd01,cdp2w12_h08_s3_w31530d1b2-dde7-4cc8-97f5-bf4439e666bb,cdp2w12_h08_s3_w15da81561-384d-4245-8b97-3366f345a3a3,cdp2w12_h08_s3_w5b236896a-b751-472b-9abd-ae9b5590974a,cdp2w12_h08_s3_w477a1b350-c824-41d0-bc10-0779b2f8cdd6,67,7944
183,14715.0,25424-F22-1,BRD-A04956113-001-05-9,25424,F22,1,SA1852315,BRD-A04956113,BROAD_CPD_ID,CC(C)c1ccc(NC(=O)C(N2CC(=O)Nc3ccccc23)c2ccccc2)cc1,CBOBFTJZIOZMDZ-UHFFFAOYSA-N,cdp2w10_f22_s1_w28198248c-6915-4940-a2de-7c6594bccfa7,cdp2w10_f22_s1_w3d30b7731-812f-4486-8b5b-a48340567f49,cdp2w10_f22_s1_w15903dfa4-1f67-43cb-9b31-20f287733052,cdp2w10_f22_s1_w5de0357a8-2005-4382-aad2-8450ca776d88,cdp2w10_f22_s1_w4efe21d4d-2ef4-4ae9-8ed2-a2555ed3d534,41,7310
184,28242.0,25605-C11-4,BRD-K37654346-001-06-6,25605,C11,4,SA1856849,BRD-K37654346,BROAD_CPD_ID,Fc1ccc(cc1)-c1nnc(NC(=O)c2cc(Cl)sc2Cl)o1,CBPHONAGSPFBCY-UHFFFAOYSA-N,cdp2w11-au00029692_c11_s4_w2a2666d27-5690-48f5-8dd2-d2a09bb5d1b5,cdp2w11-au00029692_c11_s4_w36bfaac00-68e9-42a4-a73d-06967d877a2b,cdp2w11-au00029692_c11_s4_w197e4460f-00ba-4270-af52-10c2d97bfea8,cdp2w11-au00029692_c11_s4_w523fbaa5b-df7e-440a-bb6e-a0127873d010,cdp2w11-au00029692_c11_s4_w4b2252a2b-d374-4da2-9f5c-88aec9f21e99,41,2291
185,44786.0,25990-A15-6,BRD-A47633927-001-01-8,25990,A15,6,SA792089,NPC 15199,to-be-curated,CC(C)CC(NC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O,CBPJQFCAFFNICX-UHFFFAOYSA-N,cdp2w8x2_a15_s6_w2d35941f2-54fd-4bc4-b8ac-95b8d98fc6ab,cdp2w8x2_a15_s6_w3df4d2d60-703b-49ce-9510-c652da4aa712,cdp2w8x2_a15_s6_w1ce785f51-46b0-4858-a489-7d7e2c20e4e1,cdp2w8x2_a15_s6_w552961d37-fbb6-44cb-8183-6c164b129a1c,cdp2w8x2_a15_s6_w4027090e8-cfc7-4921-a436-342c625225e1,31,501
186,52567.0,26203-B20-5,BRD-K17199516-001-06-0,26203,B20,5,SA1858618,BRD-K17199516,BROAD_CPD_ID,CC(=O)c1ccc(cc1)-c1ccc([C@H]2[C@@H]3C=CCC[C@@]3(C)C(=O)N2Cc2ccccc2)c(F)c1,CBSFIPZNVMHQDA-BTIIJPOSSA-N,cdp2w9x2-au00026617_b20_s5_w2ba19459a-e935-4a56-b6d1-71e9b9f851a5,cdp2w9x2-au00026617_b20_s5_w3f23096a8-82a1-48aa-86b3-c474d169a50a,cdp2w9x2-au00026617_b20_s5_w1e70c9181-e45c-4b7e-b5d9-aa85dab14490,cdp2w9x2-au00026617_b20_s5_w58b77eb98-5120-42c2-b232-3fb3f7ed15af,cdp2w9x2-au00026617_b20_s5_w4519f63f6-ba6a-4861-8ef1-5d425ad42125,39,6817
187,30579.0,25664-K07-1,BRD-A18392827-001-11-6,25664,K07,1,SA1858579,BRD-A18392827,BROAD_CPD_ID,COC1CCCCC1Nc1ccc(C)c(C)c1,CCKVKDWMBPBQII-UHFFFAOYSA-N,cdp2w12_k07_s1_w27ecf9218-3622-43b0-8628-e4ad373fd9a6,cdp2w12_k07_s1_w39d0187ed-8b33-4270-bc07-54751aa4c9c9,cdp2w12_k07_s1_w172f238ca-5afc-43d7-b304-77943574812e,cdp2w12_k07_s1_w532e7faf3-1097-4b9a-832e-c96c5ece5b1a,cdp2w12_k07_s1_w44b93ec8f-fc3b-4f88-95c5-ed59bd9dc614,61,1512
188,32568.0,25678-E21-4,BRD-K44158345-001-05-2,25678,E21,4,SA1852713,BRD-K44158345,BROAD_CPD_ID,CCOC(=O)C1CCN(CC1)C(=O)c1cc2c(nc3ccccn3c2=O)s1,CCLUIZVVCMQXLS-UHFFFAOYSA-N,cdp2w12_e21_s4_w29c1cb9a2-f563-4ccf-a9f6-50bc2517e215,cdp2w12_e21_s4_w3753f40b6-480c-4454-b741-0bb3599c0e49,cdp2w12_e21_s4_w1c9dcb63b-60f3-42a2-9583-d9ff7a76fe98,cdp2w12_e21_s4_w57c1f0e3e-4c2b-4316-ad67-1119fbeb6e54,cdp2w12_e21_s4_w4637c73e7-024d-48e5-ba10-ab093a694c11,44,7333
189,35459.0,25692-A04-3,BRD-K19003947-001-05-3,25692,A04,3,SA1862246,BRD-K19003947,BROAD_CPD_ID,[O-][N+](=O)c1ccccc1-c1ccc(o1)C(=O)Nc1nccs1,CDBGUOPKWNXZDX-UHFFFAOYSA-N,cdp2w12_a04_s3_w2df09beb2-ce4b-413e-a41c-f6d3dc215de0,cdp2w12_a04_s3_w3dcf195c2-dd91-43cc-863f-8337def797a9,cdp2w12_a04_s3_w1162ddf5c-61af-4830-a722-f2e34dc370a4,cdp2w12_a04_s3_w5bb333cdc-66fb-47d2-ad45-45dc0b66cfdf,cdp2w12_a04_s3_w4db97d08f-3867-42d4-a1a4-3fefb436d210,28,6910
190,33846.0,25683-C08-4,BRD-K65567793-001-06-3,25683,C08,4,SA1860756,BRD-K65567793,BROAD_CPD_ID,Cc1cc(C)n(n1)-c1nncc(n1)-c1ccccc1,CDEZKXULGHHICE-UHFFFAOYSA-N,cdp2w12_c08_s4_w212150e04-e0d9-4571-a718-0eab1a9a5707,cdp2w12_c08_s4_w320d39b52-e708-4365-b29b-1d2ce5589837,cdp2w12_c08_s4_w1ce842e9b-57b6-413d-829a-be72059bb598,cdp2w12_c08_s4_w5946eb835-caa6-425a-a982-482d8355cdd3,cdp2w12_c08_s4_w42b0316aa-6eb0-4182-afa2-5bb6e3b7b0ac,54,4347
191,34509.0,25686-P14-1,BRD-K91939093-001-05-1,25686,P14,1,SA1853669,BRD-K91939093,BROAD_CPD_ID,COc1ccc(NC(S)=NNC(=O)c2cccs2)cc1,CDMJIFSWLUXAQT-UHFFFAOYSA-N,cdp2w12_p14_s1_w29b63a6b0-af4e-4e0a-8db3-5b7fce66b31d,cdp2w12_p14_s1_w34f9b63c4-2e7c-47b8-8f69-e8c56d155193,cdp2w12_p14_s1_w1303e1af4-7cbb-4565-9a43-004eaabd93af,cdp2w12_p14_s1_w5db6e8cdc-953b-4f1e-b6db-ae71a59997f6,cdp2w12_p14_s1_w43bc99b9e-d715-481e-a60d-277db39889fb,37,2054
192,28313.0,25605-F03-3,BRD-K69485483-001-06-9,25605,F03,3,SA1854524,BRD-K69485483,BROAD_CPD_ID,Clc1cc(Br)ccc1OCCOCCN1CCOCC1,CDNYXPCEFPPPAW-UHFFFAOYSA-N,cdp2w11-au00029692_f03_s3_w23167e606-9148-4fc7-875d-3bd2be7e1d29,cdp2w11-au00029692_f03_s3_w3ff5fc570-429f-4800-adaf-6928d74a2c5c,cdp2w11-au00029692_f03_s3_w1374f59bc-d350-429f-b0bd-811f71b91c53,cdp2w11-au00029692_f03_s3_w502447ac6-c65e-4635-a116-b12bec9f155c,cdp2w11-au00029692_f03_s3_w4b77c9357-cf44-4793-9780-ef62362a6250,75,8592
193,36120.0,25695-G11-4,BRD-K51739279-001-05-9,25695,G11,4,SA1856306,BRD-K51739279,BROAD_CPD_ID,Cc1cc(cs1)C(=O)NN=C(S)Nc1cccc(C)c1,CDVVPAZWOVIUFY-UHFFFAOYSA-N,cdp2w12_g11_s4_w2cbd7730b-5a37-4468-8e23-fc1998ccd9af,cdp2w12_g11_s4_w39302344d-4e96-428a-a3cd-4a6de83db690,cdp2w12_g11_s4_w1dd6d8532-3a00-4705-b27b-7c9df2cbf758,cdp2w12_g11_s4_w5ade7c30b-a044-402c-858d-f283b8bd724f,cdp2w12_g11_s4_w43de7b098-6a72-4ae2-bd98-c7e0238989b5,45,4403
194,54917.0,26247-O13-3,BRD-K96720755-001-01-8,26247,O13,3,SA792808,relcovaptan,primary-common,COc1ccc(cc1OC)S(=O)(=O)N1[C@@H](C(=O)N2CCC[C@H]2C(N)=O)[C@](O)(c2cc(Cl)ccc12)c1ccccc1Cl,CEBYCSRFKCEUSW-NAYZPBBASA-N,cdp2w9x2_o13_s3_w21a4b9766-eec1-42b8-ac88-a9382f7ba6d6,cdp2w9x2_o13_s3_w3a9423fe8-fb8d-470d-9040-a1e57beee13d,cdp2w9x2_o13_s3_w163bbd3a7-401c-4a4f-9666-0552d2a9fa25,cdp2w9x2_o13_s3_w5b9536656-4fd3-46fe-87a3-48c31d895f68,cdp2w9x2_o13_s3_w4f93d55f4-83d6-4950-802a-d54fd9b9b6bf,85,703
195,47951.0,26110-L06-3,BRD-K39597125-001-11-2,26110,L06,3,SA1852174,BRD-K39597125,BROAD_CPD_ID,CCn1c(\C=C\c2ccccc2)nc2ccccc2c1=O,CEGAREJKMWDAQN-OUKQBFOZSA-N,cdp2w9x2_l06_s3_w297f2a67a-9221-4fd0-aa18-b085a17b8793,cdp2w9x2_l06_s3_w3d8e56516-d6b7-4f4b-bfc1-dc82b696377b,cdp2w9x2_l06_s3_w112a993b4-d706-40bf-95b5-32674e4f7fb5,cdp2w9x2_l06_s3_w50d0abe07-c63e-4b47-b83f-4fa9dc0005ca,cdp2w9x2_l06_s3_w46313634e-0bd0-460c-b689-c586b0200a8c,57,7778
196,54594.0,26239-J01-4,BRD-K90524085-001-05-2,26239,J01,4,SA82161,MY-5445,primary-common,Clc1cccc(Nc2nnc(-c3ccccc3)c3ccccc23)c1,CEHQLKSLMFIHBF-UHFFFAOYSA-N,cdp2w9x2_j01_s4_w2a7ff4dce-6a1c-4e05-9bb4-fd7d322e6fbf,cdp2w9x2_j01_s4_w353a11455-db78-4007-89c8-b57f72bdef14,cdp2w9x2_j01_s4_w1140d653d-c6b0-490e-9117-eb7acc38204f,cdp2w9x2_j01_s4_w5bc08e000-d9ec-44b0-8300-abbc3a50d450,cdp2w9x2_j01_s4_w43ed5d983-dd41-48a1-a2af-aa3fa0b11c6a,45,796
197,9427.0,24750-M24-5,BRD-K85532298-001-02-2,24750,M24,5,SA666284,BRD-K85532298,BROAD_CPD_ID,COc1cccc(NC(=O)N(C)C[C@@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)c1,CFCAPIQLQJKCRL-SVMVAKDDSA-N,cdp2w5_m24_s5_w2bb4f47ac-c2b3-475b-bccd-944ed04a2905,cdp2w5_m24_s5_w31f17ae43-39eb-4aac-bf12-174b22d2e7fc,cdp2w5_m24_s5_w1b2fa09a0-8a7b-4688-8320-ddfd7340ecb8,cdp2w5_m24_s5_w578c40b90-7e09-417a-9ac6-cb2ece3157c6,cdp2w5_m24_s5_w4da6258cb-d536-4814-aa01-235dfef69e49,50,10075
198,37750.0,25724-G16-2,BRD-K29328661-001-05-6,25724,G16,2,SA1861897,BRD-K29328661,BROAD_CPD_ID,Cn1cc(cc1P(=S)(N1CCOCC1)N1CCOCC1)P(=O)(N1CCOCC1)N1CCOCC1,CFHWAVVAKZUYKT-UHFFFAOYSA-N,cdp2w12_g16_s2_w2037e4993-54f7-45ea-baa9-07b492568aeb,cdp2w12_g16_s2_w3d480a2bb-4769-4563-a6ae-d220afbf4763,cdp2w12_g16_s2_w19a49f947-1393-4b2e-a4ad-c66ec0be0e61,cdp2w12_g16_s2_w52df8dc9b-ae91-4886-b54c-bf049d4a2ac4,cdp2w12_g16_s2_w46cefbf9d-0422-497d-992b-c23aedc0bbe6,62,3578
199,40622.0,25955-F11-6,BRD-K06181161-048-07-8,25955,F11,6,SA791981,pentoxyverine,INN,CCN(CC)CCOCCOC(=O)C1(CCCC1)c1ccccc1,CFJMRBQWBDQYMK-UHFFFAOYSA-N,cdp2w8x2_f11_s6_w2abcb958a-f6f7-42d9-b0c4-ead5c941837f,cdp2w8x2_f11_s6_w33cedeeb2-32ac-4305-9a52-2b6ac0db955f,cdp2w8x2_f11_s6_w146cbbfc1-0886-487c-be62-32eb405feb85,cdp2w8x2_f11_s6_w55142eeeb-e4ca-4505-a466-e7059ae35da0,cdp2w8x2_f11_s6_w41d4304ab-8bdf-4af6-a231-2fb0dd911fda,42,655
200,46272.0,26061-D22-4,BRD-K62102480-001-05-2,26061,D22,4,SA1856201,BRD-K62102480,BROAD_CPD_ID,COc1ccc(NC(=O)Nc2ccc3oc(C)nc3c2)cc1,CHSUNINMMIQXAL-UHFFFAOYSA-N,cdp2w9x2_d22_s4_w276d89ddd-2a02-4a82-997f-ab55f05eb734,cdp2w9x2_d22_s4_w3570fb4b3-3e38-4924-ba82-3f1ea9c0c2c5,cdp2w9x2_d22_s4_w15601b220-6a47-4077-9de1-ddde9fea00c0,cdp2w9x2_d22_s4_w5426a10ec-27b1-4cae-a098-c121a30a9f3b,cdp2w9x2_d22_s4_w4115bb3f9-a645-46d2-996f-700ddffc78fc,46,8438
201,10043.0,25374-L06-3,BRD-K89372669-001-05-3,25374,L06,3,SA1853069,BRD-K89372669,BROAD_CPD_ID,COc1ccc(cc1)-c1ccnc2nc(nn12)-n1cccc1,CIVZTKAQLNKZRZ-UHFFFAOYSA-N,cdp2w10_l06_s3_w2d6bfd27a-5ad4-4546-81e7-7ca5027d6a59,cdp2w10_l06_s3_w31bf6c15f-794e-4ccc-b7be-44217492b009,cdp2w10_l06_s3_w12b061572-fabd-4930-935a-933d8e5c0e56,cdp2w10_l06_s3_w56c3cb4d4-9fd8-4c2d-9f9f-e25baa516ceb,cdp2w10_l06_s3_w40ad06100-4d00-442c-8690-2394ae1059e2,73,5935
202,56101.0,26688-A01-5,BRD-K86577310-001-02-0,26688,A01,5,SA796582,BRD-K86577310,BROAD_CPD_ID,OC[C@@H]1O[C@@H](CC(=O)N2CCOCC2)C[C@H]2[C@@H]1Oc1ccc(NS(=O)(=O)c3ccccc3)cc21,CJNJMLGGDUQPOS-OITMPTDNSA-N,cdp2w13_a01_s5_w20f056bc3-f1a6-45d2-9ebe-8687b1180434,cdp2w13_a01_s5_w3eda9baa4-6b9a-4881-ada5-7a364adb1b13,cdp2w13_a01_s5_w1542f1b87-b8bb-4310-8a5f-0e4a3ae3b1c4,cdp2w13_a01_s5_w51f2643cd-b72f-4fe3-ad06-32a4832233c1,cdp2w13_a01_s5_w4970d3c41-4d63-4485-b1b0-3929c160fe5e,96,9843
203,24903.0,25584-D05-1,BRD-K42370867-001-06-1,25584,D05,1,SA1861314,BRD-K42370867,BROAD_CPD_ID,CCC(C)(C)c1ccc(Oc2ccc(NC(=O)COC(=O)C3=COCCO3)cc2)cc1,CKTLEGBRDQGLJY-UHFFFAOYSA-N,cdp2w11_d05_s1_w2b2eef856-bdfd-4abf-80cd-51d6deab822d,cdp2w11_d05_s1_w3fd469f47-759f-4e76-b131-153d84359e28,cdp2w11_d05_s1_w157e996c8-bb5f-4d2f-bf0a-afdbd2d22af5,cdp2w11_d05_s1_w5fe6f9b5b-6bd1-4e90-85cc-b2f0b3c30d85,cdp2w11_d05_s1_w40b8efcb1-099f-49b4-a3bd-591cdde20050,54,9527
204,31777.0,25675-I15-5,BRD-K87163849-001-05-1,25675,I15,5,SA1852330,BRD-K87163849,BROAD_CPD_ID,O=C(\C=C/c1ccccc1OC(=O)c1ccccc1)c1cc2ccccc2o1,CLDRRCVYIHWHOC-PFONDFGASA-N,cdp2w12_i15_s5_w29b66ad59-6df6-4bb3-8be4-0cb21f6eadac,cdp2w12_i15_s5_w3d4649cc8-6feb-43db-a3c6-f2d9e0a45a5a,cdp2w12_i15_s5_w1f9b174ef-90d3-46f3-9370-430bb39a2d48,cdp2w12_i15_s5_w57fd68a46-237b-4d15-8de2-72e94a5430ed,cdp2w12_i15_s5_w45a6fe651-57ae-4bd3-a248-57cc6574e50a,9,4114
205,11099.0,25382-P05-3,BRD-K40000853-001-06-2,25382,P05,3,SA1858700,BRD-K40000853,BROAD_CPD_ID,CCOC(=O)c1cc(C#N)c(nc1O)N1CCN(CC1)c1ccc(OC)cc1,CLELQUUCWLPTPN-UHFFFAOYSA-N,cdp2w10_p05_s3_w2aa27347c-5ca8-4bbe-98cd-bec865f0896a,cdp2w10_p05_s3_w31dcba61f-0301-402c-80b2-c337764a8d9d,cdp2w10_p05_s3_w1d8b5089c-f574-430a-83d8-9ffc71cac601,cdp2w10_p05_s3_w58afeb565-ffcf-42b4-8417-07690524621b,cdp2w10_p05_s3_w42c307a3e-9cd5-4b94-85a6-dc30e5d340d3,57,4752
206,13279.0,25414-F12-5,BRD-K46102431-001-08-7,25414,F12,5,SA1853338,BRD-K46102431,BROAD_CPD_ID,Cc1ccc(CCC(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)o1,CLEYUUPWDKQMML-UHFFFAOYSA-N,cdp2w10_f12_s5_w27861b7f0-c32d-4581-8677-5459684b826c,cdp2w10_f12_s5_w3bf9f1d08-d0ec-433b-a11b-1628a1e07ea3,cdp2w10_f12_s5_w14fb0071c-c9f1-4957-8f9e-915beb67bda5,cdp2w10_f12_s5_w5efa8cb15-4c91-4e1c-89ac-f6fa9895623f,cdp2w10_f12_s5_w420005ef0-2d04-433a-9c62-dc2e22a7ca8b,5,1256
207,19953.0,25565-K20-1,BRD-K77321821-001-05-9,25565,K20,1,SA1856587,BRD-K77321821,BROAD_CPD_ID,OC(=O)CCC(=O)N(Cc1cccnc1)Cc1cccc(F)c1,CLTYJNKBJYAQSI-UHFFFAOYSA-N,cdp2w11_k20_s1_w22c05d78c-e899-4fcd-9e5a-7439acdc273a,cdp2w11_k20_s1_w34288b89a-3fc4-4f48-b29a-6f05e984aacc,cdp2w11_k20_s1_w1e3c08405-1d37-4483-96fb-2248c40b9349,cdp2w11_k20_s1_w5b1cf2ad8-1b42-40c8-8d95-ea66982c16d8,cdp2w11_k20_s1_w4b79649dd-8246-4f55-a19f-86b4ed48970b,95,3919
208,29631.0,25642-M12-1,BRD-K55972185-001-05-5,25642,M12,1,SA1859992,BRD-K55972185,BROAD_CPD_ID,Cc1cccc(Cn2cnc3ccccc23)c1,CLVZYYZRLSFTTE-UHFFFAOYSA-N,cdp2w12_m12_s1_w27b2c940a-a772-431f-8cff-11f3c1571a45,cdp2w12_m12_s1_w351fecda6-78c1-4d71-be6d-b5025fdded6b,cdp2w12_m12_s1_w1774b3912-5345-4776-b0bd-df504457d6ef,cdp2w12_m12_s1_w505269997-6577-4616-bd31-af9eecd76da9,cdp2w12_m12_s1_w48aa3976e-7e42-4ae5-904e-b59a7bebca68,67,5351
209,40931.0,25962-E03-3,BRD-K04185004-003-03-6,25962,E03,3,SA83439,oxybuprocaine,INN,CCCCOc1cc(ccc1N)C(=O)OCCN(CC)CC,CMHHMUWAYWTMGS-UHFFFAOYSA-N,cdp2w8x2_e03_s3_w21d9409c1-a48c-486d-84ee-440d30a354e6,cdp2w8x2_e03_s3_w30eb1bb76-aa1f-433e-a5f1-85193b3401f1,cdp2w8x2_e03_s3_w1d42d6fc3-7966-4edb-8d36-17e177e0d06d,cdp2w8x2_e03_s3_w5a132f9a7-ddf2-4765-98e2-f775ae802a06,cdp2w8x2_e03_s3_w41b45f7af-1520-48f4-9fe6-8da9d5cf1200,82,823
210,2786.0,24303-N08-3,BRD-A87719232-001-02-4,24303,N08,3,SA83018,naproxen,INN,COc1ccc2cc(ccc2c1)C(C)C(O)=O,CMWTZPSULFXXJA-UHFFFAOYSA-N,cdp2bioactives_n08_s3_w2b590fb8a-e715-47be-a5fb-95d2c170dc0f,cdp2bioactives_n08_s3_w375e6667e-6e09-4a53-a4b7-b4f5ad925973,cdp2bioactives_n08_s3_w14651444e-b736-4052-adf0-eac9ec611f28,cdp2bioactives_n08_s3_w5f4255077-afa4-4f6b-bc0b-1ee59fe1fdd6,cdp2bioactives_n08_s3_w4bc39e0fe-6476-429d-b5e8-378dd518186d,128,180
211,52901.0,26204-F06-3,BRD-K82815045-001-05-3,26204,F06,3,SA1856642,BRD-K82815045,BROAD_CPD_ID,COc1ccc(OC)c(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccccc1,CNBICDBLEIWBIO-UHFFFAOYSA-N,cdp2w9x2-au00026617_f06_s3_w24f4adbbd-66f9-439a-9f7c-2b161faff082,cdp2w9x2-au00026617_f06_s3_w33584b628-8709-4a7e-abdc-25d7aff02d77,cdp2w9x2-au00026617_f06_s3_w112e0094d-4ac1-4cc2-a4c8-bc3534a23fb7,cdp2w9x2-au00026617_f06_s3_w5db863937-7be3-4bf8-b0db-a9524ee59b63,cdp2w9x2-au00026617_f06_s3_w4557a3dcb-6c2c-454a-81be-39fc7dbb2a82,51,1917
212,35078.0,25689-K06-6,BRD-K04498580-001-05-4,25689,K06,6,SA1856332,BRD-K04498580,BROAD_CPD_ID,Cc1nn(CC(=O)NCc2cc(C)nc3ccccc23)c(C)c1[N+]([O-])=O,CNDCJFZFIJPIIM-UHFFFAOYSA-N,cdp2w12_k06_s6_w20e22ec9f-07c2-4642-b918-8acb45743e52,cdp2w12_k06_s6_w361c3a7bd-f877-4009-b920-54e0f3cd570e,cdp2w12_k06_s6_w11f1e08e8-a44d-4a5c-a3cc-5656068162e7,cdp2w12_k06_s6_w51b6f60ae-49a0-4664-8f39-a9f5498e3023,cdp2w12_k06_s6_w47b4217ed-bf64-49c5-acde-3ca61a0c0a93,25,1949
213,36935.0,25707-A20-3,BRD-A93259806-001-03-7,25707,A20,3,SA1860266,BRD-A93259806,BROAD_CPD_ID,Oc1cc2OCOc2cc1C(N1CCCC1)c1ccc(Br)cc1,CNHAVYWPOCSGHE-UHFFFAOYSA-N,cdp2w12_a20_s3_w2bad85bdf-89d1-488f-a1cc-0b861d6d7fd9,cdp2w12_a20_s3_w31d7a286c-2ed1-4c10-a89a-2bdaf562df7a,cdp2w12_a20_s3_w17597551e-59bd-44fb-897d-ebf8fee2c96c,cdp2w12_a20_s3_w52ff24acb-fc53-4661-bf8c-12d92d8e64b6,cdp2w12_a20_s3_w4f303daa8-e5c8-41eb-9d1d-efaaf2016b7a,53,5709
214,17408.0,25438-P03-6,BRD-K30893989-001-06-9,25438,P03,6,SA1856378,BRD-K30893989,BROAD_CPD_ID,Cc1ccc(cc1)-n1cc(CN2CCC(CO)(Cc3cccc(c3)C(F)(F)F)CC2)cn1,COAAYBIQAIPPNU-UHFFFAOYSA-N,cdp2w10_p03_s6_w2c2c55248-efcc-4e50-a137-6efaead79170,cdp2w10_p03_s6_w3cf68d13c-85b2-4326-968d-ca989444838b,cdp2w10_p03_s6_w146843a20-75bc-43e1-a857-c914072843e8,cdp2w10_p03_s6_w5cfc153fc-7088-4ed4-bb7b-445fda8d40b0,cdp2w10_p03_s6_w4974d95ca-cac5-469f-a265-1e10bf045c45,1,4434
215,49609.0,26128-J17-5,BRD-K05122615-001-05-8,26128,J17,5,SA1856196,BRD-K05122615,BROAD_CPD_ID,C[C@@H](CO)NC(=O)c1ccc2c3OCc4cc(C)ccc4-n3nc2c1,COSCCPQWPLNIIT-LBPRGKRZSA-N,cdp2w9x2_j17_s5_w2f9dc3cf1-b84a-4fd9-b5a3-1034e8c1bc9e,cdp2w9x2_j17_s5_w3b34710df-0d90-4a2f-85f0-4c6766a353a9,cdp2w9x2_j17_s5_w1f5378297-abee-4888-845e-072bec807be9,cdp2w9x2_j17_s5_w5d4b0a738-b32a-48bf-964a-0a4c9f393866,cdp2w9x2_j17_s5_w4a1ee59e1-528d-4d44-8784-33ed640477ff,92,3664
216,12869.0,25410-B08-3,BRD-K39170655-001-05-8,25410,B08,3,SA1857254,BRD-K39170655,BROAD_CPD_ID,Cc1nnc(SCc2nc3ccccc3s2)n1-c1ccccc1,COSOCBHZJUMMSL-UHFFFAOYSA-N,cdp2w10_b08_s3_w251d3c73a-b7bd-495f-ae08-9c0940655940,cdp2w10_b08_s3_w33ab10cac-0e79-4aa6-9d2d-5b875e0f370a,cdp2w10_b08_s3_w12fb9c594-534d-4c6c-b020-105ee8680c07,cdp2w10_b08_s3_w57971c570-91db-4f22-b55c-c6770c1d2050,cdp2w10_b08_s3_w4f9c0d474-6697-4e18-8fb6-9b40d6d76640,47,8994
217,16414.0,25434-P17-2,BRD-K81917690-001-06-4,25434,P17,2,SA1860968,BRD-K81917690,BROAD_CPD_ID,COc1ccccc1-c1nc(no1)-c1ccc(C)nc1OC,COTBDPHBVPAEOX-UHFFFAOYSA-N,cdp2w10_p17_s2_w20ba6b481-a29d-46b3-811a-191ba6a059b5,cdp2w10_p17_s2_w31cae4889-d558-4a66-a992-79acc0328964,cdp2w10_p17_s2_w104b81265-0c78-4998-8d81-24737b5c0596,cdp2w10_p17_s2_w5382e9298-b8ef-4b3e-8be0-d91ffc7e6fd4,cdp2w10_p17_s2_w464c465a0-cdcd-43d2-8b22-544600f7b4e4,57,7464
218,7673.0,24523-F11-6,BRD-K06168695-001-02-0,24523,F11,6,SA91230,BRD-K06168695,BROAD_CPD_ID,CNC[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO,COTDYGDWXSSLGS-OGHNNQOOSA-N,cdp2bioactives-au00026391_f11_s6_w2ecbf924a-df8c-4dd6-bee4-d95446c50f8e,cdp2bioactives-au00026391_f11_s6_w3c7d361d1-697e-44a2-ba5e-29923c4b738e,cdp2bioactives-au00026391_f11_s6_w164a91488-c610-4b64-aa8f-fe78fae6c3b8,cdp2bioactives-au00026391_f11_s6_w594ef5a03-f7a1-4623-a7e1-0a2948830773,cdp2bioactives-au00026391_f11_s6_w48d0fa73e-6f94-499a-b98b-d98b7419966a,121,9824
219,7526.0,24512-N11-3,BRD-K38082795-001-05-7,24512,N11,3,SA1860241,BRD-K38082795,BROAD_CPD_ID,CCOC(=O)c1sc2nc(N3CCOCC3)c3CCCCc3c2c1N,CPLHVPAYUQAHAW-UHFFFAOYSA-N,cdp2w10_n11_s3_w2c85a985c-3cb5-4a41-b47d-e99cbf38163e,cdp2w10_n11_s3_w3f5f4c3b0-b3e1-42d5-9d18-f021c88edb38,cdp2w10_n11_s3_w1e9309170-fb63-483b-b073-01d6dbedba5c,cdp2w10_n11_s3_w56c486be7-dced-4071-999c-05f6e8626114,cdp2w10_n11_s3_w46b1206bc-1c6f-479f-8906-7a3c6c654a24,57,2411
220,28436.0,25605-L08-6,BRD-K78049473-001-06-4,25605,L08,6,SA1855642,BRD-K78049473,BROAD_CPD_ID,Clc1c(sc2ccccc12)C(=O)OCC(=O)c1ccc2OCC(=O)Nc2c1,CQFMERDFIJAWPC-UHFFFAOYSA-N,cdp2w11-au00029692_l08_s6_w2910777c8-3921-416d-bded-4298c9bc8d5e,cdp2w11-au00029692_l08_s6_w3bcddae4a-7990-4d83-8c93-7fcacefe98f1,cdp2w11-au00029692_l08_s6_w140c0b9f3-27d8-4f04-9c67-aa8f991d01ee,cdp2w11-au00029692_l08_s6_w5c10643f7-0ab3-4453-9f45-9d293b6c7be6,cdp2w11-au00029692_l08_s6_w4dd875b4b-e2aa-4907-ba1f-b176d5d40956,87,7930
221,23936.0,25580-D15-6,BRD-K64471376-001-05-6,25580,D15,6,SA1853449,BRD-K64471376,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)N1CCC(CC1)=NOC(=O)c1ccccc1,CQIDFIGQOYTEDL-UHFFFAOYSA-N,cdp2w11_d15_s6_w2469e96fd-d43a-4cf7-9875-adfed2c0adf3,cdp2w11_d15_s6_w365c7dc05-ff68-43fc-a2b0-86d06697b943,cdp2w11_d15_s6_w13f067a45-f08c-4f36-bf72-05ae07da20f2,cdp2w11_d15_s6_w587098a47-ce50-4fad-959f-b241e752cd3e,cdp2w11_d15_s6_w4ffbfd5f0-911c-4126-875f-cb195562bc2b,73,3987
222,26939.0,25593-F21-3,BRD-K39858575-001-05-5,25593,F21,3,SA1854077,BRD-K39858575,BROAD_CPD_ID,Cc1cc(Cl)ccc1Nc1ncccc1C(N)=O,CQLNDXQKFYZEER-UHFFFAOYSA-N,cdp2w11_f21_s3_w2f4c57a97-bf31-47e1-81eb-d2baf8bcd3c2,cdp2w11_f21_s3_w358f530d0-5581-49ee-b3d7-ff2148e09304,cdp2w11_f21_s3_w1017c0288-d672-4d29-9d55-bd4528292a0e,cdp2w11_f21_s3_w5f64cdc0a-4d4c-4b6e-b806-1b15ecc61d59,cdp2w11_f21_s3_w49e200422-27b6-4bb8-8ddc-fd8ee2ff50ed,46,1438
223,26530.0,25591-O09-2,BRD-K07956450-001-05-5,25591,O09,2,SA1858073,BRD-K07956450,BROAD_CPD_ID,COc1ccc(cc1)-c1c(C)nc(N)nc1-c1ccc(OCC(C)=C)cc1O,CQMISAYYTJGGAA-UHFFFAOYSA-N,cdp2w11_o09_s2_w208c5e3ed-2d91-49b2-acc9-70d346ee2fec,cdp2w11_o09_s2_w3df425291-0e18-4b57-b055-0a4b31569f41,cdp2w11_o09_s2_w166089644-8ee6-48bb-8b47-809aedccb50b,cdp2w11_o09_s2_w59a701653-2309-49c8-a434-05de8b745a17,cdp2w11_o09_s2_w40a598783-8f29-49d7-9437-5d62cbc225e4,77,8282
224,41564.0,25965-P19-6,BRD-K17894950-001-04-4,25965,P19,6,SA82336,indirubin,primary-common,O=C1Nc2ccccc2\C1=C1\Nc2ccccc2C1=O,CRDNMYFJWFXOCH-YPKPFQOOSA-N,cdp2w8x2_p19_s6_w2c75fcace-280a-4041-b3cc-6e2bfac25335,cdp2w8x2_p19_s6_w379367d60-d1a2-4380-85b8-c74924e0af4e,cdp2w8x2_p19_s6_w101902d17-734a-42cf-b24b-36eb2869025d,cdp2w8x2_p19_s6_w5a38410a5-f3d2-4c92-b264-297d82d2743a,cdp2w8x2_p19_s6_w4199b487f-4acf-43b3-be17-6ed9bcf4d77f,43,1422
225,56243.0,26748-A23-3,BRD-K67514995-001-02-8,26748,A23,3,SA1455571,BRD-K67514995,BROAD_CPD_ID,C\C=C\c1ccc(cc1)[C@H]1[C@@H](CO)N([C@@H]1C#N)S(=O)(=O)c1cccc(F)c1,CRECGCTYSBAAAJ-GVJSHHSGSA-N,cdp2w13_a23_s3_w2f2ca1cef-aed1-4c8c-9b8d-cd3bca4720d7,cdp2w13_a23_s3_w34ad5870f-877d-470e-88a1-8db9053833cc,cdp2w13_a23_s3_w192974374-db56-444d-ae16-1091280b58ee,cdp2w13_a23_s3_w53c6d7628-f915-4a02-ae4a-00457dd185b1,cdp2w13_a23_s3_w46511dd28-35e7-4eb0-b945-a43751d589a8,81,10197
226,35569.0,25692-H04-5,BRD-K54658376-001-05-0,25692,H04,5,SA1859922,BRD-K54658376,BROAD_CPD_ID,COc1cc(ccc1C=C1C(=O)NC(=O)NC1=O)N1CCOCC1,CRYWJHOHJMFHGX-UHFFFAOYSA-N,cdp2w12_h04_s5_w25baea3c5-21ef-4db5-a030-afa68c63a6b9,cdp2w12_h04_s5_w3e9c5ae13-b945-4323-afc9-cbd0bdf7aea5,cdp2w12_h04_s5_w15969c3fa-742f-4c0e-b514-38cd23865505,cdp2w12_h04_s5_w54d9f930a-10e1-4bab-b19b-8e3b5f13b0a8,cdp2w12_h04_s5_w4ef1c1d73-816a-43e3-ba23-4925bc507fb2,53,7126
227,19879.0,25565-G09-5,BRD-A83736414-001-05-5,25565,G09,5,SA1853860,BRD-A83736414,BROAD_CPD_ID,COc1ccccc1N1CCN(CC1)C(C(C)NS(=O)(=O)c1ccccc1)c1cccs1,CSEFYVKZPKHWJA-UHFFFAOYSA-N,cdp2w11_g09_s5_w2f7bf8957-1b77-4e23-9979-dd1673f5072a,cdp2w11_g09_s5_w3b1aeadb2-86ac-4c57-addd-67732e132969,cdp2w11_g09_s5_w1d23eee2e-4389-415a-a28d-7496d9cef7ce,cdp2w11_g09_s5_w5cf3f1c56-b4cb-4201-abd6-f90ae3d0059c,cdp2w11_g09_s5_w406a975fd-2cbe-468e-84e3-5bd6bff15c2b,70,4860
228,50844.0,26140-F18-4,BRD-A13210451-001-07-6,26140,F18,4,SA1853719,BRD-A13210451,BROAD_CPD_ID,COc1cc(ccc1O)C1Nn2c(S1)nnc2-c1ccccc1OC,CSEQQWVZCXOADR-UHFFFAOYSA-N,cdp2w9x2_f18_s4_w2c1e27e20-e290-44d6-b0fa-804c802880e8,cdp2w9x2_f18_s4_w3c79cfca5-f2ae-4388-a566-8b63fd687ac1,cdp2w9x2_f18_s4_w16f39843c-0094-450f-872f-96bb3f63a0f0,cdp2w9x2_f18_s4_w53d8e70bb-0d35-4493-9281-b361d91c02c9,cdp2w9x2_f18_s4_w46599559c-8bab-46f5-86b4-2dcd79a0b6ec,86,8561
229,4521.0,24309-F11-4,BRD-K26954192-001-03-5,24309,F11,4,SA83618,3-acetyl-coumarin,to-be-curated,CC(=O)c1cc2ccccc2oc1=O,CSPIFKKOBWYOEX-UHFFFAOYSA-N,cdp2bioactives_f11_s4_w2326aed7b-88ab-4e64-b0b6-5dc0af33d9c2,cdp2bioactives_f11_s4_w37cbfeea9-86e5-4c82-a3e5-7b9ff96b58bf,cdp2bioactives_f11_s4_w100302e6c-15ad-4499-8d97-29256dcb3d96,cdp2bioactives_f11_s4_w56d941f9c-6109-4f1f-881d-475862235c9f,cdp2bioactives_f11_s4_w42a720fca-2a53-4bf4-852d-387dce1a9d07,116,876
230,48464.0,26118-D06-6,BRD-A21093023-001-05-9,26118,D06,6,SA1859244,BRD-A21093023,BROAD_CPD_ID,NC1=C(C#N)C(C2CCCC=C2)c2c(O1)[nH]nc2-c1cccs1,CSUSGCVWHUAESF-UHFFFAOYSA-N,cdp2w9x2_d06_s6_w2d0230dab-0998-4d18-9d2d-89b6fc1ad9d7,cdp2w9x2_d06_s6_w3491426e8-73f4-45b7-bcf6-3579ccc21ab8,cdp2w9x2_d06_s6_w10636317d-901c-48be-bdb2-a241babbfe04,cdp2w9x2_d06_s6_w5af692e36-081d-4b9b-bec9-ed87f1f83a34,cdp2w9x2_d06_s6_w48c936f7a-9d50-4121-9be2-cb419701aed5,50,3827
231,16324.0,25434-L11-2,BRD-K59215605-001-05-7,25434,L11,2,SA1862018,BRD-K59215605,BROAD_CPD_ID,COc1ccc2ccccc2c1CN1CCSCC1,CTANMUUMVKQBQS-UHFFFAOYSA-N,cdp2w10_l11_s2_w26558553a-2e68-4c52-9cc6-99b96e704205,cdp2w10_l11_s2_w3ff756fee-4d6b-4c32-900e-893e8cca8b6f,cdp2w10_l11_s2_w19067f998-4e0b-4a38-abdb-6d82dc33d93b,cdp2w10_l11_s2_w52a794a6d-5e3d-4589-82be-30b6f9dfaf6f,cdp2w10_l11_s2_w47d6e914a-9d5b-4d47-bdcc-b2b6bd1acd30,60,8015
232,38125.0,25725-I08-5,BRD-K96390140-001-04-8,25725,I08,5,SA1859872,BRD-K96390140,BROAD_CPD_ID,Cc1cccc(c1)-n1ncc2c(Nc3ccc(F)cc3)ncnc12,CTQVDIVACCDMGM-UHFFFAOYSA-N,cdp2w12_i08_s5_w29c3a24a7-0c8e-4877-8ceb-89defa887a73,cdp2w12_i08_s5_w3320516d3-b88f-4d0a-a2d1-90dccbbaab18,cdp2w12_i08_s5_w18bc54948-ad22-4794-b3a4-0e3c12e0ab25,cdp2w12_i08_s5_w58f76012b-231d-495f-b2e6-abb87c3e19fa,cdp2w12_i08_s5_w4afc27f54-c280-43f9-98f3-f34ec9ec2639,59,4336
233,49499.0,26128-D20-3,BRD-K27909962-001-05-1,26128,D20,3,SA1860176,BRD-K27909962,BROAD_CPD_ID,Cc1ccc(o1)-c1c2CCCCc2nc(N)c1C#N,CTSKFMRSRFSGHX-UHFFFAOYSA-N,cdp2w9x2_d20_s3_w210fc59f7-f062-4236-8e76-833ca2b67a99,cdp2w9x2_d20_s3_w36c1ccab9-692f-4363-a15e-bc74890e8d63,cdp2w9x2_d20_s3_w1a68ea8ff-9af9-4394-b796-40348ac2f789,cdp2w9x2_d20_s3_w571b61523-181a-4f68-8ca6-9a6de64d5593,cdp2w9x2_d20_s3_w455ec4b63-a0f9-4352-84cf-04fc8bbd2f86,55,7618
234,55000.0,26271-B07-2,BRD-A57457448-001-05-0,26271,B07,2,SA1856815,BRD-A57457448,BROAD_CPD_ID,CCOc1ccc(cc1)C(=O)Nc1nnc(SCC(=O)NCC2CCCO2)s1,CTYJCTRYAPVVBZ-UHFFFAOYSA-N,cdp2w9x2-au00026606_b07_s2_w20499aac3-a3ed-499c-8b77-dc2d6fcdbeb1,cdp2w9x2-au00026606_b07_s2_w325f15fc3-d070-4f3f-9e4e-b9b095c6e2de,cdp2w9x2-au00026606_b07_s2_w1509e3488-53de-4d00-8c59-440f476aa886,cdp2w9x2-au00026606_b07_s2_w5e688cdaf-0086-484a-97d4-90d0b220ffd5,cdp2w9x2-au00026606_b07_s2_w4ebce34e7-659d-43d5-913a-40f9b90e9319,74,2626
235,53218.0,26205-G18-2,BRD-K58181846-001-11-9,26205,G18,2,SA1854101,BRD-K58181846,BROAD_CPD_ID,COc1ccc2nc(O)c(CN(C(C)C)C(=O)c3ccco3)cc2c1,CUDOUIAIWJGDDV-UHFFFAOYSA-N,cdp2w9x2-au00026617_g18_s2_w263585877-9af8-4972-8672-281eae7be47c,cdp2w9x2-au00026617_g18_s2_w3e58e4930-d10d-4e9f-94d8-f67d52188bf9,cdp2w9x2-au00026617_g18_s2_w1836c8520-daf8-4c4a-b2df-66789d0cc38a,cdp2w9x2-au00026617_g18_s2_w580300b4d-25cd-4285-b07b-ec6561259fd0,cdp2w9x2-au00026617_g18_s2_w4b3e86f97-13ff-4981-b7f7-b8d55b9c6758,41,8042
236,56564.0,26794-F14-6,BRD-K34444942-001-01-4,26794,F14,6,SA419140,BRD-K34444942,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)OCc2cnnn2CCCC1=O,CUSMSBFNEHNGNQ-UXWDXCIHSA-N,cdp2w13_f14_s6_w2e651917d-e648-4d9e-977c-bfab99b780dd,cdp2w13_f14_s6_w32572f230-2359-4743-9237-5c6478e74ed6,cdp2w13_f14_s6_w116890afa-0200-4415-94f0-8913b7b8106c,cdp2w13_f14_s6_w5400f14bf-34b1-401c-b0e5-263972d7c2a1,cdp2w13_f14_s6_w447091fcc-9c5d-423f-bf9d-336c60db78f2,90,10061
237,20220.0,25566-I15-4,BRD-K90077791-001-05-6,25566,I15,4,SA1859516,BRD-K90077791,BROAD_CPD_ID,COc1ccc(NC(=O)CCN2CCOCC2)c(OC)c1,CUTHMKQBRIUQAD-UHFFFAOYSA-N,cdp2w11_i15_s4_w20d4f9e2c-1b0c-45f7-a450-4538418efb2e,cdp2w11_i15_s4_w390c04ce6-29af-49e2-9a0d-9c63d0af98bf,cdp2w11_i15_s4_w135cf70ad-c9bf-4c3d-8eb3-618adfb378a9,cdp2w11_i15_s4_w5f3718e29-eb0f-49e2-aba3-627bb43fdaee,cdp2w11_i15_s4_w42a940b9a-ccc2-4594-9b32-c0163aa34cb9,55,8340
238,38815.0,25738-L03-5,BRD-K83317599-001-05-9,25738,L03,5,SA1858155,BRD-K83317599,BROAD_CPD_ID,CCOC(=O)C(=C/c1ccc(OCC(=O)Nc2ccc(C)cc2C)c(OC)c1)\C#N,CUTUECHMSUWIPQ-WQRHYEAKSA-N,cdp2w12_l03_s5_w2a06c3126-6b7a-47a4-a74d-d4e9ebf601fd,cdp2w12_l03_s5_w357040d1c-cfcf-4934-9b9d-0508386a93bc,cdp2w12_l03_s5_w19a66f1b6-f0dc-4509-9f3b-2855af5cf037,cdp2w12_l03_s5_w5948f2c06-ba54-4da6-96f5-be8b01a445a1,cdp2w12_l03_s5_w4f6209d15-2804-4624-a290-b57d92d28880,28,2594
239,27556.0,25598-D06-2,BRD-K32124229-001-06-7,25598,D06,2,SA1853673,BRD-K32124229,BROAD_CPD_ID,CC(C)(C)NC(=O)c1ccc2CCc3cccc1c23,CVCQIYCLJVSKOA-UHFFFAOYSA-N,cdp2w11_d06_s2_w25eb9bd68-ffba-4e85-ade6-6a568e1e8f86,cdp2w11_d06_s2_w3a3381c6c-fcc0-4781-a8ad-7cb2bcca9214,cdp2w11_d06_s2_w1e572a67e-6a5a-467c-b990-d6b2e8353f70,cdp2w11_d06_s2_w5542b7686-4d83-401a-9374-ee21078718fa,cdp2w11_d06_s2_w43d6f49d7-933d-49a2-a857-e3abea682bc8,84,6842
240,16766.0,25436-A06-6,BRD-K74143231-001-06-2,25436,A06,6,SA1862263,BRD-K74143231,BROAD_CPD_ID,CCSc1nc2ccccc2n1CC(=O)N1CCCCC1,CVCVTBPAWRMOHF-UHFFFAOYSA-N,cdp2w10_a06_s6_w2325be4fb-ddec-4bed-903b-c680a28d25e2,cdp2w10_a06_s6_w32b8210e8-1c47-4d7a-bee8-3ca8619e6672,cdp2w10_a06_s6_w1c33d40ee-15ef-44c6-ae4d-dd4f73b441e2,cdp2w10_a06_s6_w58aee2b73-7958-4641-8f4f-37c9c43a283c,cdp2w10_a06_s6_w4fd11fce2-2542-4b58-a662-7ce2dedd25de,64,9512
241,39036.0,25849-M21-4,BRD-K70358157-001-01-1,25849,M21,4,SA791653,BRD-K70358157,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2ccccc2C1=O,CWLJLYLZQZUHCH-VPYPWEPUSA-N,cdp2w6x2_m21_s4_w293b2888b-7b4b-4798-ad97-f393f43a7773,cdp2w6x2_m21_s4_w36fac364f-ef81-4c8a-a20f-09ec79434bbb,cdp2w6x2_m21_s4_w1c4bd0dcd-bad8-46c9-9a32-3783135667ed,cdp2w6x2_m21_s4_w56d263661-38ab-4f97-9b8c-f11bebbe2175,cdp2w6x2_m21_s4_w4fa61f2cf-1d73-4e28-a074-85cb2ecab8f2,109,10225
242,17665.0,25485-L16-5,BRD-K35969228-001-06-3,25485,L16,5,SA1857541,BRD-K35969228,BROAD_CPD_ID,Brc1ccc(cc1)-n1nnc2ccccc2c1=O,CXBNGMLYZXDWOG-UHFFFAOYSA-N,cdp2w10-au00024355_l16_s5_w271acec1b-b611-4838-89bb-325f12d26a53,cdp2w10-au00024355_l16_s5_w359b946e7-44bd-4b32-904b-4d744f0b91e6,cdp2w10-au00024355_l16_s5_w12d35ec3c-e00c-4e1c-a957-605d76c8b043,cdp2w10-au00024355_l16_s5_w59545bf61-dac1-4cbf-93b4-72932e5f4373,cdp2w10-au00024355_l16_s5_w44d36d256-4203-4366-9d5e-28891e2ec33f,52,7420
244,45916.0,26058-O21-2,BRD-K97682096-001-08-2,26058,O21,2,SA1857064,BRD-K97682096,BROAD_CPD_ID,CCOc1ccccc1NC(=O)Cn1nnc(C(=O)NCc2ccco2)c1N,CXNFECFBSYNUCV-UHFFFAOYSA-N,cdp2w9x2_o21_s2_w211c2edfc-d3de-4069-8957-42068a091e7b,cdp2w9x2_o21_s2_w383fcc74f-30c3-44e7-ba04-ddfdbc468526,cdp2w9x2_o21_s2_w143d3107d-3484-45e1-b117-7de14d28fc6e,cdp2w9x2_o21_s2_w5598b61b2-7432-401f-81b8-18ad851cebd2,cdp2w9x2_o21_s2_w4db0c2615-8245-4968-992e-63842393b764,4,9560
245,37159.0,25707-J17-5,BRD-A01918084-001-05-7,25707,J17,5,SA1856065,BRD-A01918084,BROAD_CPD_ID,ON(C1CC(=O)N(C1=O)c1cc(Cl)cc(Cl)c1)c1ccccc1,CXUMIBXWRDNFEW-UHFFFAOYSA-N,cdp2w12_j17_s5_w23ae3b0df-e30f-4ec8-af28-ee9b2749b259,cdp2w12_j17_s5_w3e2430096-8daf-4401-a824-d42b1a43a183,cdp2w12_j17_s5_w1a6d04eac-393b-4e2d-ad3e-6590f74b339a,cdp2w12_j17_s5_w589c106f5-c575-4534-bdca-fea6db7b6114,cdp2w12_j17_s5_w4f5db5e39-c2c7-4b88-bbf4-7ef71a3693a3,34,3624
246,16581.0,25435-H13-1,BRD-K06821538-001-05-8,25435,H13,1,SA1859044,BRD-K06821538,BROAD_CPD_ID,Sc1nc(cs1)-c1ccccc1,CYCKHTAVNBPQDB-UHFFFAOYSA-N,cdp2w10_h13_s1_w2ab47bd91-04af-4391-9b33-a5bbe21088bc,cdp2w10_h13_s1_w3ec82e4ef-5dd2-4304-8fed-cebdeeed7142,cdp2w10_h13_s1_w162f554cb-68a7-4181-8f73-77d703e65497,cdp2w10_h13_s1_w523ddeb53-f534-4a06-ab0c-e5b852762357,cdp2w10_h13_s1_w46d0c7cca-12c7-485d-b6a6-45344961bbaf,52,1274
247,21083.0,25569-C21-3,BRD-A31907989-001-05-0,25569,C21,3,SA1853153,BRD-A31907989,BROAD_CPD_ID,Oc1c(sc2ncnn12)C(N1CCN(CC1)c1ccccc1)c1cccs1,CYRXMHKMPVFLBA-UHFFFAOYSA-N,cdp2w11_c21_s3_w2edbd5881-d587-457f-b858-440d27581d93,cdp2w11_c21_s3_w38f7fdb4f-b42f-4fec-af15-8b70868ea024,cdp2w11_c21_s3_w1cfdc392d-bc95-4829-87bc-cae8818bf676,cdp2w11_c21_s3_w5a72b1f98-3340-4720-8223-b65927039467,cdp2w11_c21_s3_w49acd1740-99b8-4ce0-a5bb-8bd3082c45f1,78,1739
248,31168.0,25667-G14-2,BRD-K87005324-001-05-8,25667,G14,2,SA1854603,BRD-K87005324,BROAD_CPD_ID,Cc1cccc2nc(CSCc3ccco3)cn12,CYWMXGBFAQKKHN-UHFFFAOYSA-N,cdp2w12_g14_s2_w22912102a-9dc8-4f5b-8c3f-ce32034f0eb8,cdp2w12_g14_s2_w3f471a3bb-ad9f-457b-99db-7ac576796b19,cdp2w12_g14_s2_w1680a1b9b-3235-447f-9e23-3894738d09f5,cdp2w12_g14_s2_w5520cbe7c-f395-4bef-93cb-4c7e05d9e2fd,cdp2w12_g14_s2_w434270905-18d3-4526-9ff6-02a243ec038e,67,5171
249,54616.0,26239-K10-2,BRD-K92577649-001-01-6,26239,K10,2,SA82645,GBR 13069,to-be-curated,Fc1ccc(cc1)C(OCCN1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1,DASHZBBQOARCMQ-QPJJXVBHSA-N,cdp2w9x2_k10_s2_w200843773-9718-4cc4-b1cd-4efd87ca5532,cdp2w9x2_k10_s2_w3525983c7-8651-443e-be0b-4bd6e8cadeb5,cdp2w9x2_k10_s2_w18366f616-8bc6-4145-8281-a9ae93d48608,cdp2w9x2_k10_s2_w539e34521-d98f-4f97-a9ac-1455db9b9037,cdp2w9x2_k10_s2_w480696568-7e92-4bfb-9d65-4607995c1f61,69,390
250,50692.0,26138-P16-2,BRD-K57457519-001-05-2,26138,P16,2,SA1856401,BRD-K57457519,BROAD_CPD_ID,Cc1cccc(CNc2ncnc3ccc(cc23)-c2ccoc2)c1,DBTWZLIQIQEKBB-UHFFFAOYSA-N,cdp2w9x2_p16_s2_w25480913e-87dd-4952-8ffd-ef077760bda6,cdp2w9x2_p16_s2_w3db9d798a-efa7-4323-9065-4300128e4b22,cdp2w9x2_p16_s2_w111ce0e83-fd8e-47b1-9902-08eadb0b3ffb,cdp2w9x2_p16_s2_w5830ba018-593b-4063-b406-427ac97d64c6,cdp2w9x2_p16_s2_w45ad410f2-b197-4cba-b172-6a73937612b9,65,3257
251,7458.0,24512-J15-1,BRD-K81983958-001-06-3,24512,J15,1,SA1857923,BRD-K81983958,BROAD_CPD_ID,CCOC(=O)N1N(C(=O)OCC)[C@@](C(C)C)(C1=O)c1ccc(Cl)cc1,DCJJAVZZIGQNSD-QGZVFWFLSA-N,cdp2w10_j15_s1_w26282e212-921b-40be-8f96-ce4e8bdfe9ea,cdp2w10_j15_s1_w32d051c6e-5d13-40c9-8458-aa396735e7ca,cdp2w10_j15_s1_w1b1a4571a-1a8b-49b4-9766-2a0a49abbe45,cdp2w10_j15_s1_w50e1f7701-a6ab-4274-aa1b-64ad91c50da2,cdp2w10_j15_s1_w488fe2ac2-d8e3-4149-ba27-95d0cbf8e446,15,6435
252,33282.0,25680-I12-4,BRD-K47310416-001-05-0,25680,I12,4,SA1859178,BRD-K47310416,BROAD_CPD_ID,CCCCCCNCC(=O)N1CCC(Cc2ccccc2)CC1,DCQWIQZESRZBCZ-UHFFFAOYSA-N,cdp2w12_i12_s4_w29accc392-6e5f-46f4-912f-6eb62a66afca,cdp2w12_i12_s4_w3cbca97d5-09bd-4825-9cdb-2155c1eca740,cdp2w12_i12_s4_w107856986-f370-4b3f-b496-633a06535145,cdp2w12_i12_s4_w59da74bc3-8f02-4903-86a3-bb7bea37f6aa,cdp2w12_i12_s4_w438da198b-c8bd-47e9-9d7b-1e3eb12f1950,70,5760
253,19755.0,25565-A15-1,BRD-K55722508-001-05-4,25565,A15,1,SA1854742,BRD-K55722508,BROAD_CPD_ID,CCOC(=O)NCC(C)(C)CNC(=O)OCC,DCSHCWQETQJKPE-UHFFFAOYSA-N,cdp2w11_a15_s1_w2818210d5-85f2-4cb0-8455-fd40b7ce6597,cdp2w11_a15_s1_w348320eaa-9e5e-4e1d-8b95-0708fd71c2b2,cdp2w11_a15_s1_w11661d3f7-ee1e-4e3b-8e51-4e77eb68ddb7,cdp2w11_a15_s1_w5718ee28c-5d80-4661-a8ea-f0f20aa53bf8,cdp2w11_a15_s1_w4c750cf81-7d7d-4cb0-b035-6c1c9f3a54d3,75,1902
254,24513.0,25583-A20-1,BRD-K39125958-001-06-4,25583,A20,1,SA1860178,BRD-K39125958,BROAD_CPD_ID,COc1ccc(Oc2cnc(N)nc2-c2ccc(OCC(C)=C)cc2O)cc1,DCWVJNHRWVAOOD-UHFFFAOYSA-N,cdp2w11_a20_s1_w293b76b19-fb4a-4d53-a4b7-d73ec81a8084,cdp2w11_a20_s1_w3bc28f85a-dba0-431c-b907-1af425df9122,cdp2w11_a20_s1_w195138807-81ce-4f03-b38b-64a3b8c8b691,cdp2w11_a20_s1_w5c95fe1ce-19b2-43ae-8126-6fb9b4ac5065,cdp2w11_a20_s1_w413292222-3c97-446b-a0fa-78c4e79ac552,73,3981
255,10426.0,25378-F06-2,BRD-K86681028-001-05-6,25378,F06,2,SA1859213,BRD-K86681028,BROAD_CPD_ID,COc1cc(NC(=O)c2ccco2)c(cc1OC)C(=O)OCC(=O)Nc1ncc(Cl)cc1Cl,DDBCUKBFZYQEJK-UHFFFAOYSA-N,cdp2w10_f06_s2_w2791dd20d-f3f9-4df1-b2db-988583263867,cdp2w10_f06_s2_w3fa6a6376-3ff2-4ee5-900b-ec12ff171c93,cdp2w10_f06_s2_w14fec8fe1-1715-44b0-85d6-303647fbfcee,cdp2w10_f06_s2_w52461d90f-d1ab-4274-93bf-a1de436eab53,cdp2w10_f06_s2_w4eb211e5f-3329-423d-b0c6-9c10f868eaae,72,4113
256,30342.0,25663-P07-4,BRD-K14898660-001-05-6,25663,P07,4,SA1852266,BRD-K14898660,BROAD_CPD_ID,Cc1cc(NC(=O)CCC(=O)N(CC(=O)NC2CCCC2)Cc2ccc3OCOc3c2)no1,DDJRNJGPHNFEIV-UHFFFAOYSA-N,cdp2w12_p07_s4_w21d447dcc-3392-466f-b379-777857228b9a,cdp2w12_p07_s4_w3820a8e9d-9404-495c-960a-f2798ed3997e,cdp2w12_p07_s4_w161e4ee72-d0fb-4f6d-a13b-2ed17a603fbb,cdp2w12_p07_s4_w5463d5122-5c7a-4371-8484-2f3b3b7f4b7a,cdp2w12_p07_s4_w436a9df08-62b7-44af-8f61-594f21b3fbda,32,6710
257,49943.0,26133-L07-3,BRD-K92806245-001-05-8,26133,L07,3,SA1861962,BRD-K92806245,BROAD_CPD_ID,Cn1c(NCc2cc(Cl)ccc2O)ncc1-c1ccccc1,DDKNQLXCEDHYBP-UHFFFAOYSA-N,cdp2w9x2_l07_s3_w2a4b70e30-1ab5-4e04-8cd8-523960470650,cdp2w9x2_l07_s3_w34f78b5e3-e210-45eb-8592-16404375d681,cdp2w9x2_l07_s3_w14a6b3ef8-d1b5-4f7c-b5a1-7e2886e1c043,cdp2w9x2_l07_s3_w509da5324-cc79-469c-bf77-c813743cb5ab,cdp2w9x2_l07_s3_w46f80d789-963d-4206-afba-cd462463eba1,33,9531
258,37440.0,25708-H07-4,BRD-K50701665-001-02-9,25708,H07,4,SA1852217,BRD-K50701665,BROAD_CPD_ID,C(CNc1nc2ccccc2n2cnnc12)CN1CCc2ccccc2C1,DDNCFJVDHUFTSI-UHFFFAOYSA-N,cdp2w12_h07_s4_w25e11cbb8-3682-4a22-8d14-9f7c84d7a463,cdp2w12_h07_s4_w31c0bd05d-8eb5-4819-8c8f-207628b39e2a,cdp2w12_h07_s4_w17ea10ab5-f8b1-43ce-b2ed-77ff7b170c0e,cdp2w12_h07_s4_w59f673320-e5f5-426e-a77c-df25706a0a61,cdp2w12_h07_s4_w40eeb3612-850e-49c8-9787-b8befd27072b,61,1848
259,29025.0,25639-M16-1,BRD-K94090114-001-05-5,25639,M16,1,SA1855774,BRD-K94090114,BROAD_CPD_ID,COc1ccc(cc1OC)-c1cc(nc(SCC(=O)Nc2cc(C)on2)n1)C(F)(F)F,DDSAPUCNAANPSY-UHFFFAOYSA-N,cdp2w12_m16_s1_w2b4e0fb7b-d16c-4d73-ab39-50e70aa0a5d9,cdp2w12_m16_s1_w3a7196c28-4b41-4788-a2da-4e2a29bf6a64,cdp2w12_m16_s1_w12b8ee044-b565-47ab-988e-a003a53def1f,cdp2w12_m16_s1_w5bb50e8a8-41f5-4224-884f-25ae30459b84,cdp2w12_m16_s1_w4dc425a3f-487c-4c6e-806a-cd3e4c4f6ec4,53,3413
260,7518.0,24512-N09-1,BRD-K21614065-001-04-2,24512,N09,1,SA1854478,BRD-K21614065,BROAD_CPD_ID,Cc1cc(OCC(=O)Nc2nnc[nH]2)ccc1Cl,DDSVUTNMKCJKGE-UHFFFAOYSA-N,cdp2w10_n09_s1_w2fa697b08-1fcd-47b7-a263-3fe07058aa83,cdp2w10_n09_s1_w3c18f4d26-a8a5-4c8e-a09b-dfee077a2b0e,cdp2w10_n09_s1_w18ad8183e-b1c9-4dc1-90c2-1622143b7541,cdp2w10_n09_s1_w5407e25c5-dec3-42fe-940e-4010e5852abb,cdp2w10_n09_s1_w4eadfe8c3-5444-4fdf-8caf-18a9f2ad48ce,34,2128
261,48353.0,26115-P14-3,BRD-K16877735-001-05-9,26115,P14,3,SA1858484,BRD-K16877735,BROAD_CPD_ID,CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)Nc1ccccc1,DECAYRMSMUUPRB-UHFFFAOYSA-N,cdp2w9x2_p14_s3_w23fe23daf-05d3-4c6a-9476-37238ba1538d,cdp2w9x2_p14_s3_w315991426-25d0-4ae4-be95-b6c35499da6b,cdp2w9x2_p14_s3_w12c0d98df-c8c9-442e-919e-4f94594dd5e9,cdp2w9x2_p14_s3_w50db5a827-99ce-4ac3-9e61-d251e27a9724,cdp2w9x2_p14_s3_w4cbc53577-6faa-445c-8513-1bb3a060ec96,48,3598
262,32495.0,25678-A22-3,BRD-K12881705-001-06-9,25678,A22,3,SA1855866,BRD-K12881705,BROAD_CPD_ID,CCOC(=O)N1CCC(CC1)NC(=O)c1cc2c(nn(C)c2s1)-c1ccccc1F,DENJRKKPNKSZDF-UHFFFAOYSA-N,cdp2w12_a22_s3_w265df35c2-4566-4875-a2c9-123b996ca30b,cdp2w12_a22_s3_w333af3193-dc54-45fe-a894-fd6cc1f66c3c,cdp2w12_a22_s3_w13746a5e0-81f6-4ced-ae08-0d4e716bc7f7,cdp2w12_a22_s3_w5b348e3bb-11cf-4d65-bb62-5fdd68d6b302,cdp2w12_a22_s3_w440a9e557-77bf-45b5-9b1c-56debec42f05,71,5657
263,41341.0,25965-G07-5,BRD-K07220430-001-03-6,25965,G07,5,SA82819,cinnarizine,INN,C(\C=C\c1ccccc1)N1CCN(CC1)C(c1ccccc1)c1ccccc1,DERZBLKQOCDDDZ-JLHYYAGUSA-N,cdp2w8x2_g07_s5_w21398fd03-6017-45f2-9158-a9918e43e84f,cdp2w8x2_g07_s5_w3bee62597-386a-4bcf-9422-cd7cda3c27e9,cdp2w8x2_g07_s5_w111b4ab61-bf05-4c1c-9948-34d06deb52f9,cdp2w8x2_g07_s5_w5e81d05f4-4f98-468d-9b57-ab33634fc452,cdp2w8x2_g07_s5_w4dd4217f2-0c5f-4fc6-936d-bed0e21a88dd,76,504
264,37431.0,25708-H06-1,BRD-K01370799-001-05-5,25708,H06,1,SA1856407,BRD-K01370799,BROAD_CPD_ID,CC(C)(C)NC(=O)NC(=O)CN1CCN(CC1)c1cccc(Cl)c1,DFEKTQJALPKHPK-UHFFFAOYSA-N,cdp2w12_h06_s1_w284841d32-1601-4a0b-a80b-9d86a975c4fc,cdp2w12_h06_s1_w3ef2cb6c6-1a6d-4211-878d-2466ad50bdb2,cdp2w12_h06_s1_w15b1ca8c8-3c37-4136-88ab-e93fa4f30ebf,cdp2w12_h06_s1_w555348918-277b-4601-92e3-0aa54f4561e0,cdp2w12_h06_s1_w4bad386e5-ae39-483e-bb77-724b46eafd3c,67,5359
265,14978.0,25426-D22-6,BRD-K55078657-001-06-8,25426,D22,6,SA1858395,BRD-K55078657,BROAD_CPD_ID,COC(=O)c1ccc(NN=Nc2ccc(cc2)C(=O)OC)cc1,DFOAQDYVNHMJTD-UHFFFAOYSA-N,cdp2w10_d22_s6_w2180c25dc-2739-41e7-bf50-fdc1fc435aca,cdp2w10_d22_s6_w3632c4080-f856-4e5e-8a1f-38cf93c1eef9,cdp2w10_d22_s6_w166cfa360-d849-466f-85a1-49968f94801f,cdp2w10_d22_s6_w53eec697b-ab23-4543-86da-8080f4a0ee70,cdp2w10_d22_s6_w4633bd330-8f65-4a6c-99bf-3bb65f33451c,46,5983
266,16294.0,25434-K21-2,BRD-K17658096-001-05-5,25434,K21,2,SA1859354,BRD-K17658096,BROAD_CPD_ID,C(Sc1ccc(nn1)-c1cccs1)c1cccnc1,DFPYKZRJDUFPCN-UHFFFAOYSA-N,cdp2w10_k21_s2_w22b8635de-3ac9-4e20-b70f-083a8dba5477,cdp2w10_k21_s2_w377320f0a-3f64-4086-94aa-d54cfd8285a2,cdp2w10_k21_s2_w1ddee1a01-022f-4cdb-b389-3012e1d53f54,cdp2w10_k21_s2_w5cf1ffab5-71c3-4ee1-bc39-de16969f4dd6,cdp2w10_k21_s2_w42b2e44dc-0253-440b-b9a3-5f04f38fe50f,48,8138
267,24603.0,25583-F22-1,BRD-K49512803-001-05-0,25583,F22,1,SA1853492,BRD-K49512803,BROAD_CPD_ID,COP(=O)(OC)c1nc(oc1N1CCOCC1)-c1cccc2ccccc12,DFQDOAMXEXGRJY-UHFFFAOYSA-N,cdp2w11_f22_s1_w25577f308-f114-41f5-b9d7-6a33bfd15286,cdp2w11_f22_s1_w3a94bd407-a574-4df7-8f2f-37ba4c03f026,cdp2w11_f22_s1_w16e76cd5c-9695-450e-b60f-a6e69d62c95f,cdp2w11_f22_s1_w5188e2e71-3a92-4e5f-bfb1-bd4e6b8e47d5,cdp2w11_f22_s1_w4e3e2c465-9ff3-4162-b6f9-e2995c61e22c,79,3409
268,55614.0,26612-E20-4,BRD-K68953461-001-01-4,26612,E20,4,SA1432222,BRD-K68953461,BROAD_CPD_ID,OC[C@H]1O[C@@H](CCn2cc(nn2)-c2ccccc2F)CC[C@@H]1NC(=O)Nc1ccc(Cl)cc1,DFXHLBQSDWHRLL-PIPMEXSNSA-N,cdp2w7x2_e20_s4_w2a50d9147-a256-4f85-8e0a-f7ad4ac4e008,cdp2w7x2_e20_s4_w3138c118c-3547-4304-8fec-bdca38e03db6,cdp2w7x2_e20_s4_w128ff5fef-f789-48ba-bf87-e5df44e7b496,cdp2w7x2_e20_s4_w58b7c2046-b373-446c-8328-8a28044b4c37,cdp2w7x2_e20_s4_w4231c2cf0-541b-4558-a766-bbe58c112fd4,88,9945
269,2300.0,24300-P24-3,BRD-A44863528-001-04-1,24300,P24,3,SA59324,proglumide,INN,CCCN(CCC)C(=O)C(CCC(O)=O)NC(=O)c1ccccc1,DGMKFQYCZXERLX-UHFFFAOYSA-N,cdp2bioactives_p24_s3_w21db9b68a-3855-4b99-b637-350255e37f45,cdp2bioactives_p24_s3_w39e8b23ef-1a98-4082-a58f-e938d32e90b4,cdp2bioactives_p24_s3_w1cd93d183-644d-4731-9acb-25faae75b66e,cdp2bioactives_p24_s3_w50dd7ff26-be6f-4209-8ca0-f8ee4942f2c0,cdp2bioactives_p24_s3_w44d7fb4cb-cc58-42ad-931c-223e050cddee,125,728
270,12527.0,25408-A17-3,BRD-K86074537-001-05-8,25408,A17,3,SA1859601,BRD-K86074537,BROAD_CPD_ID,Clc1ccc(cc1)-c1nnc(nn1)N1CCCC1,DHASBLMRLCYQMW-UHFFFAOYSA-N,cdp2w10_a17_s3_w2776083fb-edd5-40f8-8cd2-d3a7b141388d,cdp2w10_a17_s3_w3e7564afa-96cd-48ae-a10c-7329372b99b2,cdp2w10_a17_s3_w1f25cf2a9-710e-4539-8d2d-9fb0e6bd644e,cdp2w10_a17_s3_w568fb135e-9821-4ee0-9c14-b9f32c46ee4c,cdp2w10_a17_s3_w462bfdeea-b6a7-449b-9393-0f41c81db696,48,7861
271,15077.0,25426-J12-3,BRD-K31388867-001-05-8,25426,J12,3,SA1860494,BRD-K31388867,BROAD_CPD_ID,Cc1nn(CCc2nn[nH]n2)c2nc(cc(c12)C(F)(F)F)-c1ccc(Br)cc1,DIDCTDHQEYBHHD-UHFFFAOYSA-N,cdp2w10_j12_s3_w2466e1cad-6f52-4bb4-b7a7-3d59cbad56d4,cdp2w10_j12_s3_w3daebc458-1600-4f6b-90d7-e111bdf23506,cdp2w10_j12_s3_w12d2e0802-b720-4580-9d91-d05abb5f06b8,cdp2w10_j12_s3_w532867002-99f6-40d3-a262-de416e23b628,cdp2w10_j12_s3_w460590e68-1843-4c6c-94df-9bbc72be326d,62,6807
272,17593.0,25485-J06-5,BRD-K37853756-001-05-9,25485,J06,5,SA1861033,BRD-K37853756,BROAD_CPD_ID,CCOc1ccccc1N1Cc2cc(C)c(C)cc2C1,DIHHLRLLBQWWDB-UHFFFAOYSA-N,cdp2w10-au00024355_j06_s5_w2105e55aa-09c5-4556-ae5d-0ddeeea1dc69,cdp2w10-au00024355_j06_s5_w38da1b757-a36a-47c0-af5e-6a639118fe03,cdp2w10-au00024355_j06_s5_w13f530cd1-da18-4ed1-bc1d-2399fa3e0069,cdp2w10-au00024355_j06_s5_w59693de8f-f475-4c5b-9226-ebf017c31f39,cdp2w10-au00024355_j06_s5_w4c2681d18-d975-45da-bd76-1ee30c7dbed3,54,8631
273,47810.0,26110-F09-6,BRD-K57724551-001-06-2,26110,F09,6,SA1857224,BRD-K57724551,BROAD_CPD_ID,CN(C)c1ccnc(Oc2ccc(Cl)cc2)c1C#N,DIKNWBKZSAJDIQ-UHFFFAOYSA-N,cdp2w9x2_f09_s6_w244ccc634-f5e3-4474-9933-73b24f6acac4,cdp2w9x2_f09_s6_w308e8bcc0-4cfa-4ae1-b6ff-a3bdc137c74a,cdp2w9x2_f09_s6_w13e4d36b0-dd94-4658-a434-55cff3fa7250,cdp2w9x2_f09_s6_w55a78eb02-055e-4492-a90f-cf18cfa4a407,cdp2w9x2_f09_s6_w4f0a07673-03a1-447e-aedc-194dacf03659,79,4902
274,27831.0,25598-P22-1,BRD-K56562541-001-05-2,25598,P22,1,SA1858231,BRD-K56562541,BROAD_CPD_ID,COc1ccc(cc1)-c1cc(C(=O)OCC(=O)NC(C)C)c2ccccc2n1,DIRRMYFWNDLMPA-UHFFFAOYSA-N,cdp2w11_p22_s1_w2735b7e6c-d906-4078-8175-56fdb1cc2324,cdp2w11_p22_s1_w35f728139-7069-49dd-bf7c-5605151c80c3,cdp2w11_p22_s1_w1f3c14fed-da6a-4472-8b54-ebbbfcd7bc0c,cdp2w11_p22_s1_w5e5b4df15-5182-4497-aaa9-4d59155da043,cdp2w11_p22_s1_w44c4f609e-bf3a-4b0a-8a6d-7735dcff7643,68,4065
275,24946.0,25584-E17-2,BRD-K18595892-001-07-0,25584,E17,2,SA1853410,ML052,common,CCCN(CCC)CCNC(=O)C1CCN(Cc2nc(oc2C)-c2ccc(Cl)cc2)CC1,DJAFUYUUNCOPGL-UHFFFAOYSA-N,cdp2w11_e17_s2_w246c57c37-5cc2-430d-9aaa-8d775b239d97,cdp2w11_e17_s2_w352318602-1229-4254-a683-51c3564ea0d3,cdp2w11_e17_s2_w187686a20-720a-47bf-bf9a-f7c2094af09d,cdp2w11_e17_s2_w561ace972-0cc7-4fab-b5aa-dd5b5d49c18b,cdp2w11_e17_s2_w4b8997bc3-a7fa-4fcc-b571-842f943f2b59,48,9202
276,7632.0,24517-A17-1,BRD-K74150320-001-02-8,24517,A17,1,SA91530,BRD-K74150320,BROAD_CPD_ID,CC(C)NC(=O)N(C)C[C@H]1Oc2c(NC(=O)C3CC3)cccc2C(=O)N(C[C@@H]1C)[C@H](C)CO,DJIXJENXBPUHIX-RZQQEMMASA-N,cdp2bioactives_a17_s1_w2109fcab2-b4dc-4969-a0bb-0d9b4e1a07e7,cdp2bioactives_a17_s1_w373a7e881-8e3f-4952-8d1a-fa74c5588c75,cdp2bioactives_a17_s1_w1766e1b1e-ff86-41eb-abc3-f3e91ae0ac6d,cdp2bioactives_a17_s1_w56fda3afd-a34b-4e1f-b42a-1df75d506de3,cdp2bioactives_a17_s1_w448704c4b-bfc9-4a40-850e-996873cd2cab,87,9684
277,17658.0,25485-L12-4,BRD-K78496697-001-05-9,25485,L12,4,SA1853983,BRD-K78496697,BROAD_CPD_ID,COc1ccc(c(OC)c1)-n1c(=S)[nH]c2sc(cc2c1=O)-c1ccccc1,DJMPOERCABAULR-UHFFFAOYSA-N,cdp2w10-au00024355_l12_s4_w2233e23e2-faff-43bc-afe1-afb85ba46bff,cdp2w10-au00024355_l12_s4_w35a389765-6928-49d9-8600-c114b03d1abf,cdp2w10-au00024355_l12_s4_w1fcaab489-513b-4edb-867d-a751eca0eba0,cdp2w10-au00024355_l12_s4_w544ca9f8a-1e8e-4632-8954-ae131095e700,cdp2w10-au00024355_l12_s4_w4abf9cbbc-f0b4-497e-9646-8821d58e0c7a,59,4126
278,52298.0,26202-C07-6,BRD-K17975404-001-05-0,26202,C07,6,SA1854212,BRD-K17975404,BROAD_CPD_ID,COC(=O)c1ccccc1NC(=O)COc1ccccc1,DJNDEMVSWNRGSC-UHFFFAOYSA-N,cdp2w9x2-au00026617_c07_s6_w2a4bb386c-5e99-4a81-b89a-2687dee8cb16,cdp2w9x2-au00026617_c07_s6_w3cfa30852-ae3d-4df9-bb11-3e20365e04e2,cdp2w9x2-au00026617_c07_s6_w1975e025b-4543-4f52-947a-32cfdaeb01ef,cdp2w9x2-au00026617_c07_s6_w5363d8a14-c06c-4067-b83e-ade1860f5423,cdp2w9x2-au00026617_c07_s6_w474fa9e3f-b001-4ad0-b710-6d927945737f,37,2426
279,40307.0,25945-L09-3,BRD-A81392774-001-01-2,25945,L09,3,SA792754,S-Trityl-L-cysteine,common,NC(CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(O)=O,DLMYFMLKORXJPO-UHFFFAOYSA-N,cdp2w8x2_l09_s3_w2fdca4ada-28c0-4ce5-aea1-a7bbb5cc7b91,cdp2w8x2_l09_s3_w33ed48ed7-0df5-40d8-b3a3-2d76084e32c4,cdp2w8x2_l09_s3_w1640aea6c-57c2-40b6-badf-d7c90ffd1f64,cdp2w8x2_l09_s3_w579457807-6644-457a-8f9f-d16ae6a8d79a,cdp2w8x2_l09_s3_w4ed225a90-1704-40ca-9e4b-03b026b9867c,41,9628
280,25997.0,25588-O19-3,BRD-K39705272-001-05-4,25588,O19,3,SA1861748,BRD-K39705272,BROAD_CPD_ID,COc1ccc2c(c1)cc(C)c1nnc(SCC(=O)N(C)c3nc(cs3)-c3ccccc3)n21,DLPNYXAJRXKNEW-UHFFFAOYSA-N,cdp2w11_o19_s3_w2a877b796-84b7-40bf-ad02-1bed1b72cd88,cdp2w11_o19_s3_w3627ab72c-af0c-49e1-933d-81a3ebb8aa5b,cdp2w11_o19_s3_w1b6120f28-ce9a-45fc-ad53-28790ed5e5f5,cdp2w11_o19_s3_w57607b9b7-14d2-47ad-a914-955fcf284f2e,cdp2w11_o19_s3_w4cdfd7525-3eff-466d-bb04-703b6958c5ed,38,5601
281,38909.0,25738-P18-3,BRD-K62883304-001-06-9,25738,P18,3,SA1852334,BRD-K62883304,BROAD_CPD_ID,CC(C)N1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O,DLPVSEABAWKYJX-JYRVWZFOSA-N,cdp2w12_p18_s3_w24bc33f85-80e1-4cc2-824b-0891a00bf71f,cdp2w12_p18_s3_w3df0432c7-d530-4a8d-a7c9-80a68dc6c33c,cdp2w12_p18_s3_w1ababfd7f-7f76-4182-be4d-12d974dff87c,cdp2w12_p18_s3_w50a8a972b-c0a4-4029-8c03-80770fb7ee2f,cdp2w12_p18_s3_w4801bda29-c628-4742-8525-b8608eb5f567,43,6548
282,8728.0,24664-A23-2,BRD-K72360839-001-01-1,24664,A23,2,SA1440015,BRD-K72360839,BROAD_CPD_ID,CCC(=O)Nc1ccc2c(OC[C@H](C)N(C[C@@H](C)[C@H](CN(C)C2=O)OC)C(=O)c2ccc(F)cc2)c1,DLQPGZNWCDDUSB-YTZAWJCFSA-N,cdp2w3_a23_s2_w2e35542a9-c21c-4fb0-a761-75fc8bf27dcc,cdp2w3_a23_s2_w3d76f15b0-7aa5-4dfe-8079-748682fcbbe8,cdp2w3_a23_s2_w11dba292d-6ce6-44cf-940b-dfb7e3bd93c7,cdp2w3_a23_s2_w5c06995b5-3196-4255-9038-70ca3d535451,cdp2w3_a23_s2_w40e723018-5737-42d3-83b8-eadf6a57f95e,41,10108
283,8869.0,24726-K22-5,BRD-K60002680-001-02-1,24726,K22,5,SA667127,BRD-K60002680,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O,DLYGSNKXPRYVCA-DXIQSLLYSA-N,cdp2w5_k22_s5_w2adeb61d3-4645-41c8-8e28-a1f869f9e3f2,cdp2w5_k22_s5_w3ab8b8203-6ede-43c8-8960-b6958fe810d2,cdp2w5_k22_s5_w1cc167c0a-28bc-4dd8-8a80-93b45c517f53,cdp2w5_k22_s5_w59d0ad9d9-9765-4933-b69a-9ba60a9a88a8,cdp2w5_k22_s5_w4df231a9a-c233-4acf-90be-83cb02ae36d6,74,9786
284,9380.0,24750-D10-6,BRD-K31584969-001-02-6,24750,D10,6,SA667071,BRD-K31584969,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)OCc2ccccc2)OCc2cnnn2CCCC1=O,DLYGSNKXPRYVCA-XQBPLPMBSA-N,cdp2w5_d10_s6_w2d9a1f998-8d7d-45ac-b45c-699ea85c446c,cdp2w5_d10_s6_w3a4e51178-da5f-4f2f-bc77-7e34fa465554,cdp2w5_d10_s6_w13c76c97e-3dfb-4746-9b97-ebc03a7f568d,cdp2w5_d10_s6_w5d7428291-9af5-4010-9b7c-c8ee4ecbc295,cdp2w5_d10_s6_w4354d12a1-a808-4fb8-b5f6-0eaad4b1d402,52,9898
285,34412.0,25686-K20-6,BRD-A87991868-001-06-1,25686,K20,6,SA1861296,BRD-A87991868,BROAD_CPD_ID,CC1CN(CC(C)O1)c1cc(=O)n(-c2cc(Cl)ccc2C)c(=O)[nH]1,DMFFTJYOPSSREU-UHFFFAOYSA-N,cdp2w12_k20_s6_w28c37aef5-cbee-4e0f-9fc7-e57ceb641544,cdp2w12_k20_s6_w3b62d3e16-6492-471a-a19f-748bae777726,cdp2w12_k20_s6_w13631f068-36dd-4ae8-b112-b6967e1ecba3,cdp2w12_k20_s6_w5cbc07bfb-98fa-4472-a8cd-ea671f0c8351,cdp2w12_k20_s6_w4e60366e6-0eec-43a3-916e-1b38f66ace4e,106,7239
286,26474.0,25591-L17-6,BRD-K30680302-001-04-5,25591,L17,6,SA1857656,BRD-K30680302,BROAD_CPD_ID,Cc1cc(nc(n1)-n1cccc1)-c1ccc(Br)s1,DMIQCCQPGJOZFK-UHFFFAOYSA-N,cdp2w11_l17_s6_w20c9a4ff6-9d71-495e-8409-d370939bc702,cdp2w11_l17_s6_w3106ec6d3-2b73-4c54-ba43-d7a757e0aae4,cdp2w11_l17_s6_w192a230b7-00ae-4ddd-b4c5-22a8028b3ea6,cdp2w11_l17_s6_w5ba6ce4f0-aef4-479b-9eae-8dcc90a381bd,cdp2w11_l17_s6_w49de08ea9-5186-4808-8d41-9accf1ed0752,44,6531
287,54892.0,26247-M04-2,BRD-K94270326-004-01-0,26247,M04,2,SA792802,ecopipam,primary-common,CN1CCc2cc(Cl)c(O)cc2[C@@H]2[C@@H]1CCc1ccccc21,DMJWENQHWZZWDF-PKOBYXMFSA-N,cdp2w9x2_m04_s2_w24e8723c0-212e-4b2e-9325-69653fbdced5,cdp2w9x2_m04_s2_w34f9aea92-c2b5-4ef1-b302-d91a9d720ba6,cdp2w9x2_m04_s2_w1cf3b4b57-6c6a-4596-952c-4cde1e293178,cdp2w9x2_m04_s2_w501f9e95a-46af-4f58-8571-277ffe5cddb3,cdp2w9x2_m04_s2_w43daa65fd-8303-4839-9554-d5b69cf98cc8,29,576
288,36939.0,25707-B06-1,BRD-K03708099-001-05-1,25707,B06,1,SA1857586,BRD-K03708099,BROAD_CPD_ID,CCOc1cc2[nH]c(=S)n(CCCN3CCCC3=O)c(=O)c2cc1OCC,DMRBOZKOYDEYEY-UHFFFAOYSA-N,cdp2w12_b06_s1_w2309b511d-6f5e-4d32-a661-8f91bae6f57d,cdp2w12_b06_s1_w3b9578f37-48b3-4ab2-bf3c-4a6bf8b605a4,cdp2w12_b06_s1_w12b743513-f628-4f8a-924d-6b505afdd7fc,cdp2w12_b06_s1_w50770f1a3-89af-43e5-b659-ce1cab25a19e,cdp2w12_b06_s1_w4a60046fd-9143-4015-a294-5b61dfef40c7,48,4101
289,10347.0,25376-P03-1,BRD-K65363520-001-04-2,25376,P03,1,SA1855726,BRD-K65363520,BROAD_CPD_ID,Cc1ccc(CNC(=O)c2ccc(cc2)-n2cccc2)cc1,DMUZAJJOMHMRSO-UHFFFAOYSA-N,cdp2w10_p03_s1_w21289cd3c-6cb9-44ac-9151-3164e5e7396d,cdp2w10_p03_s1_w38dd4b69b-dc96-42b9-ad5b-31a82a31eebb,cdp2w10_p03_s1_w18e7c6fcb-1f08-48b4-91b5-1a675d033962,cdp2w10_p03_s1_w58906ec83-5bd3-40f1-95ba-1bc34f01a678,cdp2w10_p03_s1_w49c135e67-07c7-409f-8c4f-abda9d0fcffd,32,3061
290,11589.0,25391-N12-1,BRD-A90048458-001-05-3,25391,N12,1,SA1859327,BRD-A90048458,BROAD_CPD_ID,Oc1ccccc1-c1[nH]nc2C(=O)N(Cc3ccco3)C(c12)c1ccccc1F,DMWKCTYPPKGTNM-UHFFFAOYSA-N,cdp2w10_n12_s1_w27576c114-f131-42ed-a13b-b73ab95663cf,cdp2w10_n12_s1_w3d3b80757-6c48-49fe-bf8c-c34746ea435f,cdp2w10_n12_s1_w1e0c91b5b-e30f-4ab3-8587-ad57fe826b39,cdp2w10_n12_s1_w52fc5255b-db6d-4b9f-990e-d57b1446f8bf,cdp2w10_n12_s1_w4a46d3dc6-7e1e-4e3c-9501-7ccaa6c4093b,41,3729
291,55267.0,26271-N11-5,BRD-A73590800-001-05-0,26271,N11,5,SA1857406,BRD-A73590800,BROAD_CPD_ID,CC1(CCc2ccccc2)NC(=O)N(CC(=O)Nc2ccc3OCCOc3c2)C1=O,DMYQWAOHPQSQJD-UHFFFAOYSA-N,cdp2w9x2-au00026606_n11_s5_w2605d8a06-9673-4492-9311-59b7534d70cf,cdp2w9x2-au00026606_n11_s5_w390d0d583-7919-484c-ab4f-5fb7abe5bb63,cdp2w9x2-au00026606_n11_s5_w1cabf9c28-a36c-4b4f-821a-c40e52e22818,cdp2w9x2-au00026606_n11_s5_w52a31def7-9a59-4216-ad60-cf6fb185a12f,cdp2w9x2-au00026606_n11_s5_w4bc8ee959-f658-4cc3-bcb8-42f8fab7b76b,63,3487
292,38893.0,25738-O19-5,BRD-K82692617-001-05-4,25738,O19,5,SA1859975,BRD-K82692617,BROAD_CPD_ID,COC(=O)CSc1ncccc1-c1nc2ccccc2[nH]1,DNANXWGYBGVEIX-UHFFFAOYSA-N,cdp2w12_o19_s5_w254b4e260-fd9f-4713-89fe-8f0b28a4abd9,cdp2w12_o19_s5_w328c39d6e-72b9-419d-821a-ea0342bdf519,cdp2w12_o19_s5_w154243c08-d661-4b86-a8eb-79e8df5ff875,cdp2w12_o19_s5_w5a41b5117-7093-4d3f-a5ad-689d67c919de,cdp2w12_o19_s5_w43a002827-b33d-4f64-935a-91fb64056ed7,77,8156
293,11417.0,25391-C22-3,BRD-K31755025-001-06-5,25391,C22,3,SA1859240,BRD-K31755025,BROAD_CPD_ID,C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(F)c(c1)-c1ccc(cc1)C(C)=O,DNDVOBNXWAHKHM-WFGXUNSGSA-N,cdp2w10_c22_s3_w2ee4fc855-b51b-41c4-83d0-470a93085d45,cdp2w10_c22_s3_w3d09bcd22-4cee-4e1c-965f-49cb7b87a34f,cdp2w10_c22_s3_w1630fc4c7-aa87-46fe-8f05-9a29bebed4ce,cdp2w10_c22_s3_w56d15f8de-9a8a-4754-9afd-5aebe3e0cec7,cdp2w10_c22_s3_w497fa16b4-0b8f-42d8-bc76-9b84a5ec4040,72,4878
294,27037.0,25593-K15-5,BRD-K12035825-001-05-9,25593,K15,5,SA1855942,BRD-K12035825,BROAD_CPD_ID,[O-][N+](=O)c1ccccc1C(=O)Nc1nc2ccccc2[nH]1,DNRKFXPSJOWKDL-UHFFFAOYSA-N,cdp2w11_k15_s5_w2dbafbf0b-7857-4a16-8ee6-0d42d0223335,cdp2w11_k15_s5_w38c43ab27-4e36-43b8-a8c3-1b02d7aa6402,cdp2w11_k15_s5_w173905aab-ecb8-4c16-afdd-e0ebb8a36220,cdp2w11_k15_s5_w550e3b0e4-7e54-421d-8cfd-868a145c66a3,cdp2w11_k15_s5_w4d312aec6-a99a-40f4-957c-537ef264523a,89,8111
295,47830.0,26110-G04-2,BRD-K35852282-001-05-6,26110,G04,2,SA1852517,BRD-K35852282,BROAD_CPD_ID,CC(=O)OCC(=O)NCc1ccc2OCOc2c1,DPBCQZKMQQPPFF-UHFFFAOYSA-N,cdp2w9x2_g04_s2_w23218d13f-431e-4c60-81bb-f3dd3a13d6fa,cdp2w9x2_g04_s2_w38ea42298-1c57-41aa-9fa7-9217c5ef21a1,cdp2w9x2_g04_s2_w1f34aa6fd-f7fd-4e48-a769-d8282e94ce7b,cdp2w9x2_g04_s2_w5f7e17774-9044-4dd4-940b-0a198a26351f,cdp2w9x2_g04_s2_w4b2846501-1e91-46a5-bdd3-b1dafc808cd5,84,8822
296,19196.0,25553-D18-6,BRD-K86764418-001-05-8,25553,D18,6,SA1858777,BRD-K86764418,BROAD_CPD_ID,CCOc1ccc(OCC)c(NC(=O)CSc2nc3cccnc3n2C)c1,DPFRLQUOOVXBLR-UHFFFAOYSA-N,cdp2w11-au00029679_d18_s6_w28fea8602-92fa-4b3b-819c-361fdd864a5e,cdp2w11-au00029679_d18_s6_w3cf721254-c7fd-49e5-b369-45a3eed4b4ec,cdp2w11-au00029679_d18_s6_w138c66d59-96bf-498b-8d22-75684d26151c,cdp2w11-au00029679_d18_s6_w5ec4d2bc6-6474-41ab-aa3a-4f326a218a32,cdp2w11-au00029679_d18_s6_w463228fe2-9688-41b8-9972-8890a23330e4,57,3090
297,19722.0,25564-N15-4,BRD-A22333896-001-06-0,25564,N15,4,SA1852851,BRD-A22333896,BROAD_CPD_ID,Cn1c(SCc2cnc(s2)-c2ccccc2)nnc1C1COc2ccccc2O1,DPJAHZOGWFLFRF-UHFFFAOYSA-N,cdp2w11_n15_s4_w21b9e09b6-ae02-4b70-b8d6-d19a186ea53b,cdp2w11_n15_s4_w3135584c2-7238-4ca1-b028-5e537e9fad9a,cdp2w11_n15_s4_w1835d0b95-0d2a-4c0f-8235-ad4d0fced54b,cdp2w11_n15_s4_w5f1bb3688-9eb5-4fa8-891f-35f19107d335,cdp2w11_n15_s4_w4f6f0e1b6-9017-4e69-bf47-63b497c48e6e,82,9171
298,26118.0,25590-G11-4,BRD-A63120617-001-05-1,25590,G11,4,SA1861859,BRD-A63120617,BROAD_CPD_ID,CCC1CCc2sc(cc2C1)-c1nnc(S)n1CC=C,DPLPWLUXCYLNCG-UHFFFAOYSA-N,cdp2w11_g11_s4_w2f4853a66-0c74-49d3-98a9-44af63efe188,cdp2w11_g11_s4_w3ca5be80b-e1ff-433c-844a-b27043896acd,cdp2w11_g11_s4_w1e57c4f7d-2da5-4a4c-ae7c-b9387aa9b142,cdp2w11_g11_s4_w569e0de08-a5f1-48d5-8a8b-fff5debbf38a,cdp2w11_g11_s4_w47d273be9-57f5-46b9-ae18-50e4e9a69dfa,94,8137
299,2871.0,24304-H17-4,BRD-A69777949-001-04-4,24304,H17,4,SA59297,flumequine,INN,CC1CCc2cc(F)cc3c2n1cc(C(O)=O)c3=O,DPSPPJIUMHPXMA-UHFFFAOYSA-N,cdp2bioactives_h17_s4_w28bc6eb3c-cc33-48a2-b8f7-c91699577cb3,cdp2bioactives_h17_s4_w38fca518d-6d7e-4f8d-a0fc-46e734b9e83d,cdp2bioactives_h17_s4_w171a737b8-2541-4011-a7c9-f01a14289777,cdp2bioactives_h17_s4_w59ac33f34-7f0b-4414-9e17-1356bdb1f1bf,cdp2bioactives_h17_s4_w403266e31-2776-43a7-9adb-476d4b602b0e,86,957
300,36149.0,25695-J03-3,BRD-A86962683-001-06-6,25695,J03,3,SA1856351,BRD-A86962683,BROAD_CPD_ID,COCC(=O)Nc1nc2NC(CC(c3ccccc3Cl)n2n1)c1ccc(OC)cc1,DPVMPIVJZJFLDH-UHFFFAOYSA-N,cdp2w12_j03_s3_w2ef28d1ae-85a4-4161-9c58-3663ffd05eef,cdp2w12_j03_s3_w307546739-f55b-4768-b534-4bc8e11c7c78,cdp2w12_j03_s3_w17b0de6cb-c5d4-4742-aa93-3ac4a5ea3bff,cdp2w12_j03_s3_w5d5d6e7d2-f730-49ad-9117-7ecae5eae286,cdp2w12_j03_s3_w463739e60-3c59-4811-8a69-5af85ee1fdd5,41,4500
301,18715.0,25492-N15-5,BRD-K78038322-001-06-0,25492,N15,5,SA1859994,BRD-K78038322,BROAD_CPD_ID,COc1cc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)ccc1NC(=O)c1cccs1,DPWSSTXIHXLAII-UHFFFAOYSA-N,cdp2w10-au00024360_n15_s5_w2f8325084-6ed0-483c-a86d-4c6a251f7699,cdp2w10-au00024360_n15_s5_w33fea4ee5-a9ba-469f-bcdb-dec7047a1d96,cdp2w10-au00024360_n15_s5_w197ad210b-df9f-4104-b926-aca2b63f01eb,cdp2w10-au00024360_n15_s5_w52f371347-8d64-49aa-9a21-ece6b12331bc,cdp2w10-au00024360_n15_s5_w4dd8c2783-b1df-4d12-a476-e84c75f4f574,33,1873
302,47450.0,26107-D13-6,BRD-K10178088-001-04-4,26107,D13,6,SA1859887,BRD-K10178088,BROAD_CPD_ID,COc1ccc(cc1OC)-c1c(C)nn2c(cc(C)nc12)N1CCN(Cc2ccccc2)CC1,DQBIMMDGCPNLKL-UHFFFAOYSA-N,cdp2w9x2_d13_s6_w2ec37764e-77f0-4b1e-8168-bfff780f0111,cdp2w9x2_d13_s6_w3ad134db9-d63a-4221-88e7-1bb18c21853f,cdp2w9x2_d13_s6_w16ec92c04-301a-415b-a7ea-5e7dad4eec14,cdp2w9x2_d13_s6_w57a0fc2f0-db2f-4abe-ad8e-2fd5194ebc5f,cdp2w9x2_d13_s6_w47dfc5cef-c631-454f-817f-310a54dcaf81,77,2169
303,52317.0,26202-E11-1,BRD-K54406300-001-05-5,26202,E11,1,SA1860481,BRD-K54406300,BROAD_CPD_ID,CC1(C)Cc2ccccc2-c2nnc(SCC(=O)N3CCc4ccccc34)n12,DQFOPYSEAVPWQL-UHFFFAOYSA-N,cdp2w9x2-au00026617_e11_s1_w280ac9ae7-dea6-4bfa-8db1-2387e014f3fc,cdp2w9x2-au00026617_e11_s1_w355f6a1aa-3789-4e91-86e7-8bb488b45928,cdp2w9x2-au00026617_e11_s1_w115f2f2b1-7d52-4d5f-8189-f7cf6c2a9929,cdp2w9x2-au00026617_e11_s1_w5acb1a010-4cb0-41c6-80c0-31f18899845a,cdp2w9x2-au00026617_e11_s1_w4d010fae2-7b07-4c15-acb6-c9a1e042880a,41,2551
304,31616.0,25675-A21-6,BRD-K46915789-001-05-6,25675,A21,6,SA1855045,BRD-K46915789,BROAD_CPD_ID,COc1ccc(cc1NC(=O)Nc1ccc(OC)c(OC)c1)[N+]([O-])=O,DQPSJZHROBMDGZ-UHFFFAOYSA-N,cdp2w12_a21_s6_w2efe3c81b-0b4d-4de9-a2af-d1c1fdf3cff6,cdp2w12_a21_s6_w387d6ca3b-62ba-44cf-a258-11dcfaa8f868,cdp2w12_a21_s6_w1265b147e-f6c2-4cb0-88b4-1e12c78fbf72,cdp2w12_a21_s6_w5fea862e3-bef6-43e6-b8c3-6fde06bcfb03,cdp2w12_a21_s6_w4fe98fb8b-d7cf-446e-9e23-d512acf874ca,51,1891
305,16833.0,25436-D12-1,BRD-K84058877-001-05-1,25436,D12,1,SA1853201,BRD-K84058877,BROAD_CPD_ID,CC(=O)\C=C(/C)Nc1ccccc1O,DQRCPPWVTPMGHV-BQYQJAHWSA-N,cdp2w10_d12_s1_w248dcb053-c047-4aeb-9b39-dc557d88e275,cdp2w10_d12_s1_w3b466df98-abf0-48e4-a395-656e5d3b6410,cdp2w10_d12_s1_w1b2d87011-df26-4042-b199-61b1e0426f42,cdp2w10_d12_s1_w526391fa2-b2b0-4945-9da5-681fea5a846f,cdp2w10_d12_s1_w46239f0de-8756-466a-9bf2-dd17600f5f30,40,10410
307,36893.0,25704-P09-3,BRD-A28370127-001-05-9,25704,P09,3,SA1854488,BRD-A28370127,BROAD_CPD_ID,CC(C)C(=O)N1CCC2(CC1)Oc1ccc(F)cc1C(=O)C21CC(=NO1)c1ccc(Cl)cc1,DRFRKBFXLIYSKF-UHFFFAOYSA-N,cdp2w12_p09_s3_w2d9d0a348-3662-4c80-9671-28ed1bdfd708,cdp2w12_p09_s3_w3db53864b-7524-46cf-abe5-4428ac2e8d68,cdp2w12_p09_s3_w1551bd438-b892-445e-83e5-479698c8c62d,cdp2w12_p09_s3_w5b6442261-ba98-44ec-b320-5b868494c65e,cdp2w12_p09_s3_w46291b8ab-d36d-489b-95df-66bde93190d9,44,2797
308,12017.0,25403-D16-3,BRD-K16735946-001-05-4,25403,D16,3,SA1852092,BRD-K16735946,BROAD_CPD_ID,COc1ccc(NC(=O)CSc2c3CCCCc3nc3ccccc23)c(OC)c1,DRIQFJRYNBHOPR-UHFFFAOYSA-N,cdp2w10_d16_s3_w2529bd717-6304-4501-a3e4-c237aff3a234,cdp2w10_d16_s3_w31f46fe47-e5aa-4fa3-a730-84b99065928f,cdp2w10_d16_s3_w1b033e612-b419-441b-9299-9e47ec8af398,cdp2w10_d16_s3_w5456582ae-ce73-4e46-9f00-77fd8991adea,cdp2w10_d16_s3_w4f24c7b41-762f-4de7-812e-9fcb56735970,3,6607
309,16619.0,25435-K18-3,BRD-K74754846-001-05-5,25435,K18,3,SA1855844,BRD-K74754846,BROAD_CPD_ID,c1cnn(c1)-c1cncc(n1)-n1cccn1,DRODYRLLEVCLTL-UHFFFAOYSA-N,cdp2w10_k18_s3_w221955ece-3e92-4fd8-9da3-9e64eefcd1da,cdp2w10_k18_s3_w3ca795e44-1eea-4529-9d1b-0b2d10a04ac6,cdp2w10_k18_s3_w19f9ebc98-e927-4da4-89d5-536bc03a9163,cdp2w10_k18_s3_w57cef6106-2c70-47bf-9a30-ed8819129170,cdp2w10_k18_s3_w4fb28702a-dd81-4f17-8e7e-1d506b2748b6,54,5594
310,35200.0,25690-C08-2,BRD-K53291358-001-05-3,25690,C08,2,SA1857940,BRD-K53291358,BROAD_CPD_ID,CCCC(=O)Nc1ccc2oc(nc2c1)-c1ccncc1,DRSCWSKFWPKNNR-UHFFFAOYSA-N,cdp2w12_c08_s2_w297a1f8b4-67f1-4148-b8bf-64df23111bfd,cdp2w12_c08_s2_w31c3d5b4d-cb63-4ce6-9891-839d4f827956,cdp2w12_c08_s2_w16b88d68c-bc0e-41ba-8d4f-bf380ceeb9d3,cdp2w12_c08_s2_w54e69de08-9360-431f-bf9f-2c8139b1b1a7,cdp2w12_c08_s2_w49f0d1908-23ea-4c34-b491-603e504fbb0d,65,2567
311,8182.0,24619-L13-5,BRD-K06361641-001-01-8,24619,L13,5,SA852068,BRD-K06361641,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C1=CCCCC1,DSAVDXHQQHIKAO-ISJBWFOZSA-N,cdp2w3_l13_s5_w280d2e172-3c4d-4dcf-87ce-7eeac9e72523,cdp2w3_l13_s5_w3b2e96035-d276-44ff-bfc5-622c1fbd24b1,cdp2w3_l13_s5_w14afe6a59-4b78-407e-8011-fd6f45d9e16b,cdp2w3_l13_s5_w5deac067e-ce10-42b3-aa6d-7d978ba2179f,cdp2w3_l13_s5_w49e660290-07c4-41e1-b401-d79544fb6710,140,10531
312,42585.0,25968-M21-1,BRD-K36009368-001-01-8,25968,M21,1,SA792629,NNC 63-0532,to-be-curated,COC(=O)CN1CN(c2ccccc2)C2(CCN(Cc3ccc4ccccc4c3)CC2)C1=O,DSEIKQVUTKGLGT-UHFFFAOYSA-N,cdp2w8x2_m21_s1_w21ff753d4-d88f-4da2-a061-925e4f791130,cdp2w8x2_m21_s1_w3bc4f3311-a278-487b-8b65-027ebccf5091,cdp2w8x2_m21_s1_w1fd93510d-113c-4a31-93e8-f61afb0fd5fb,cdp2w8x2_m21_s1_w5c4b95e96-3e23-4fe1-b65a-cc43252c0e14,cdp2w8x2_m21_s1_w46a0f7b61-d9f8-43a9-b3f9-872c9241fbad,50,3958
313,36479.0,25700-K07-3,BRD-K03756240-001-06-6,25700,K07,3,SA1853195,BRD-K03756240,BROAD_CPD_ID,NC(=O)C(=C/c1ccc(Br)o1)\C#N,DSPQMKOMBMQWDD-HYXAFXHYSA-N,cdp2w12_k07_s3_w28b487abf-fc78-450b-b85f-2694ca5b666c,cdp2w12_k07_s3_w3d7a9999a-3afe-4514-be1f-3e7bc4d26f83,cdp2w12_k07_s3_w1abaadea6-ed3f-4ad5-96df-5b78cca330e5,cdp2w12_k07_s3_w57c7e9b37-2a56-4aa9-91ac-d7c02f799a26,cdp2w12_k07_s3_w4eeec9334-33c7-4e63-8f15-28769158835a,53,8025
314,49722.0,26128-O18-4,BRD-A94420133-001-05-3,26128,O18,4,SA1856210,BRD-A94420133,BROAD_CPD_ID,N=C1OC23CCCCCC2C1(C#N)C(C#N)(C#N)C(O3)c1ccccc1,DSWYUGSSEJEZIF-UHFFFAOYSA-N,cdp2w9x2_o18_s4_w2aba74e8f-8242-49bf-9d53-953dcf16740c,cdp2w9x2_o18_s4_w3371d2163-7322-4de5-b969-aa48b2ba91fa,cdp2w9x2_o18_s4_w120f47542-b6f2-430c-8b62-b46e5f2949b9,cdp2w9x2_o18_s4_w5929f4a23-e396-4d47-98b3-261019aa1405,cdp2w9x2_o18_s4_w4ef288152-9ec3-4d94-b86f-017744b76d0a,57,8632
315,53556.0,26207-J10-4,BRD-K51239991-001-06-5,26207,J10,4,SA1855696,BRD-K51239991,BROAD_CPD_ID,N(c1nc(cs1)-c1ccncc1)c1ccccc1,DTAVDUKDVHWDGI-UHFFFAOYSA-N,cdp2w9x2-au00026617_j10_s4_w207ca3fc9-da92-419a-bd7a-fbbc8b812ffd,cdp2w9x2-au00026617_j10_s4_w3089c8de9-767e-459f-bf60-b94d73a6c3fe,cdp2w9x2-au00026617_j10_s4_w1fd40614a-9f96-47e5-945c-ba91e05a72ef,cdp2w9x2-au00026617_j10_s4_w50f49be96-646b-44f5-a362-e6390e277d9d,cdp2w9x2-au00026617_j10_s4_w43699bc6c-2cf4-4cd8-94f9-8cbe41dfa84b,71,1269
316,53777.0,26216-F03-3,BRD-K10140880-001-05-1,26216,F03,3,SA1857123,BRD-K10140880,BROAD_CPD_ID,Cc1ccc(cc1C)N(CC(=O)NC1CCCC1)C(=O)CCCC(=O)Nc1ccccn1,DTRXTLSLMZNMDD-UHFFFAOYSA-N,cdp2w9x2_f03_s3_w241ed19c8-14f2-4247-b2c8-4270ba1107d6,cdp2w9x2_f03_s3_w3e831ba19-b0b4-4db3-820a-6c51e0199857,cdp2w9x2_f03_s3_w182e29d6f-ee51-4f0f-8664-09a3d01db556,cdp2w9x2_f03_s3_w57cdadb3b-9feb-45b8-be2a-3cd2e1820964,cdp2w9x2_f03_s3_w4e508516a-3bc1-4636-ba02-926c7ef97280,77,1561
317,42736.0,25983-C23-2,BRD-K23335153-300-01-7,25983,C23,2,SA792833,AMN 082 dihydrochloride,to-be-curated,C(CNC(c1ccccc1)c1ccccc1)NC(c1ccccc1)c1ccccc1,DTZDSNQYNPNCPK-UHFFFAOYSA-N,cdp2w8x2_c23_s2_w2bafccaeb-925b-4f6d-83e9-2290c2b12e17,cdp2w8x2_c23_s2_w30286475a-5b97-450f-8033-1621114cc48e,cdp2w8x2_c23_s2_w15a9ccc48-99be-43e2-ba8f-f2ccb1943606,cdp2w8x2_c23_s2_w5badf39c9-0420-4a0b-b57b-4386ac8218ed,cdp2w8x2_c23_s2_w40cb05553-fcaa-45dd-a770-f89d8b53972c,22,3773
318,18196.0,25490-E22-2,BRD-A12604874-001-05-4,25490,E22,2,SA1854854,BRD-A12604874,BROAD_CPD_ID,CCOc1ccccc1C1C(C#N)=C(N)Oc2cc(C)n(C)c(=O)c12,DUHYBUYIOGEWLH-UHFFFAOYSA-N,cdp2w10-au00024359_e22_s2_w2373bd43b-5df3-4956-9fc3-3ecdc5843f09,cdp2w10-au00024359_e22_s2_w3e86492a0-1325-41ad-9bbc-2b06a4e43cd7,cdp2w10-au00024359_e22_s2_w1ca3f3ef6-02b4-4bee-a5f1-70baf9d7446e,cdp2w10-au00024359_e22_s2_w5e9e3bf9a-b9a7-49e5-b2ad-16fd81b13d97,cdp2w10-au00024359_e22_s2_w4a7c1df84-2532-4d28-84d1-f5505b7a42b8,48,3058
319,18605.0,25492-H14-3,BRD-K65087041-001-05-4,25492,H14,3,SA1854884,BRD-K65087041,BROAD_CPD_ID,FC(F)(F)c1cccc(NC(S)=NNC(=O)c2ccccc2Cl)c1,DUNLTDLRKRNYCT-UHFFFAOYSA-N,cdp2w10-au00024360_h14_s3_w28ecb397a-f467-4ebe-a117-f2ccb741995b,cdp2w10-au00024360_h14_s3_w3b8fe6ce8-a116-46bc-96e0-cfc8acf05d6f,cdp2w10-au00024360_h14_s3_w12c195465-a891-42f8-8c3a-a93d1e81ae6e,cdp2w10-au00024360_h14_s3_w5394bd891-32a3-49c6-ae54-19b788dd3988,cdp2w10-au00024360_h14_s3_w424cb06bf-57d8-40b8-8fdf-56373ccf8b55,69,5489
320,35478.0,25692-C07-4,BRD-K16442062-001-05-5,25692,C07,4,SA1853347,BRD-K16442062,BROAD_CPD_ID,COc1ccc(NC(=O)c2sccc2C)cn1,DVJRBENVECQQBY-UHFFFAOYSA-N,cdp2w12_c07_s4_w25b194ed0-b71f-4ba5-992f-4667b72a1318,cdp2w12_c07_s4_w3cdca6e6b-f7ad-45f5-b256-a0929b5b59b4,cdp2w12_c07_s4_w1e0de1635-ab00-4d5d-b1f3-69b98b3f9985,cdp2w12_c07_s4_w560659951-8936-4da7-8dea-01ad2e3af516,cdp2w12_c07_s4_w4fe1ae5c8-f0e5-4a06-9b53-c75745ebe36d,82,8616
321,37255.0,25707-O10-5,BRD-A19166163-001-05-7,25707,O10,5,SA1857255,BRD-A19166163,BROAD_CPD_ID,SC1=C(C#N)C(=O)NC(N1c1ccccc1)c1cccs1,DVOZOHPFZNCFDJ-UHFFFAOYSA-N,cdp2w12_o10_s5_w2b66fd848-63b2-4f02-a9da-6a1002f84de4,cdp2w12_o10_s5_w3a94bef12-b7cc-4661-8eef-9d9b41b76f05,cdp2w12_o10_s5_w15531cad4-5380-4fd9-8960-214bec62309b,cdp2w12_o10_s5_w5e51439f9-1418-43cd-a1b6-972db5c9ba5d,cdp2w12_o10_s5_w42ae52681-bd14-4570-bf1d-2ef278d64c69,63,6422
322,11574.0,25391-M10-4,BRD-K02864397-001-05-2,25391,M10,4,SA1854828,BRD-K02864397,BROAD_CPD_ID,COc1ccc(cc1)-c1cc(n2nc(nc2n1)C(O)=O)C(F)(F)F,DVSYKPQCIYNPSG-UHFFFAOYSA-N,cdp2w10_m10_s4_w296a811ca-1e1a-4667-9805-be55dca0d53b,cdp2w10_m10_s4_w3d2618a69-f7cc-46db-9d61-c5bd6db0cdfb,cdp2w10_m10_s4_w1278b041f-3d78-4ddc-9f83-ef85471dc6fa,cdp2w10_m10_s4_w5f6c063c6-bdab-496b-b2f5-28002099d093,cdp2w10_m10_s4_w48b2d963d-3841-4f26-a72e-d11573596672,75,4828
323,28394.0,25605-I12-6,BRD-K32162177-001-06-9,25605,I12,6,SA1858513,BRD-K32162177,BROAD_CPD_ID,COc1cc(NC(=O)COC(=O)CCc2cc(OC)c(OC)c(OC)c2)cc(OC)c1,DVYYGZOSLREYPL-UHFFFAOYSA-N,cdp2w11-au00029692_i12_s6_w2ccfcd1e2-eea4-463c-8704-fb82f546f0c5,cdp2w11-au00029692_i12_s6_w34061362d-40bd-411e-a059-f45125251cd9,cdp2w11-au00029692_i12_s6_w19d5c0a64-f61b-46ab-83d2-a128135b907c,cdp2w11-au00029692_i12_s6_w5c5fa9e3d-33e3-4f73-9227-e102bb1faeb3,cdp2w11-au00029692_i12_s6_w4afaa757b-b4e7-48b6-b1f7-b604d4be3480,76,6432
324,37517.0,25708-J16-3,BRD-K50776152-001-10-4,25708,J16,3,SA1857625,ML160,common,Cc1ccc(cc1)-n1c(N)c(C#N)c(-c2ccccc2)c(C#N)c1=O,DWDWEGGEKMILES-UHFFFAOYSA-N,cdp2w12_j16_s3_w29b181162-7dba-4d7a-84a5-019524422c4c,cdp2w12_j16_s3_w3106cbc70-3716-467f-9a29-c7b4b945021f,cdp2w12_j16_s3_w1fc48c22b-d831-4931-9886-ac4ab5e53563,cdp2w12_j16_s3_w5508d0528-46d7-4c2d-8ce7-d1d5b3f82fc7,cdp2w12_j16_s3_w43f09255c-4c71-4fc0-908a-c637c011c2b6,51,6350
325,44522.0,25989-B03-6,BRD-K41160163-001-01-9,25989,B03,6,SA792834,fenobam,to-be-curated,CN1CC(=O)N=C1NC(=O)Nc1cccc(Cl)c1,DWPQODZAOSWNHB-UHFFFAOYSA-N,cdp2w8x2_b03_s6_w2d9e18c98-a0f0-4950-bb0d-a8cc5cc6bc78,cdp2w8x2_b03_s6_w37691ef17-2424-4020-a66a-1a68e04dd269,cdp2w8x2_b03_s6_w19d8792e4-5f76-4edb-aa92-3af1e37c92b0,cdp2w8x2_b03_s6_w59ce04ce5-5e5f-424e-94b6-c3ac99f415a5,cdp2w8x2_b03_s6_w4d97dc8fc-df75-4ec8-9210-0f6b30292755,76,1065
327,10354.0,25376-P16-2,BRD-K09475368-001-06-3,25376,P16,2,SA1861588,BRD-K09475368,BROAD_CPD_ID,CC1CCN(CC1)c1ccccc1NC(=O)COc1ccccc1C,DXEUTISKCHHBOU-UHFFFAOYSA-N,cdp2w10_p16_s2_w212a3eda9-c9e3-4408-98d9-610a1e288bf5,cdp2w10_p16_s2_w39a74de6a-b9d3-4b84-b982-37c936ca8bb5,cdp2w10_p16_s2_w11e52fa61-8bbe-40d4-b1fb-2bfd31c34a14,cdp2w10_p16_s2_w52ccef9cc-02a0-46d9-8128-c6078f5131fc,cdp2w10_p16_s2_w46f9751db-c238-4240-9d28-bf1dba3c76d8,54,3769
328,43679.0,25985-O10-3,BRD-K59037100-001-04-8,25985,O10,3,SA58418,oxybenzone,INN,COc1ccc(C(=O)c2ccccc2)c(O)c1,DXGLGDHPHMLXJC-UHFFFAOYSA-N,cdp2w8x2_o10_s3_w2de42dd8d-d847-4773-b8e0-6f4620e2fe02,cdp2w8x2_o10_s3_w3afe20dce-2221-4124-b879-bb14f0bffd1d,cdp2w8x2_o10_s3_w1680dd32f-33d1-4d55-853d-cf776e3bab68,cdp2w8x2_o10_s3_w51b95e6eb-78ea-4516-9a94-8e1e2aa076c5,cdp2w8x2_o10_s3_w4e685a5b5-f160-4bea-be67-4bcb9687e398,57,1189
329,32092.0,25676-K10-2,BRD-K48576794-001-07-3,25676,K10,2,SA1852697,BRD-K48576794,BROAD_CPD_ID,Cc1cc(NC(=O)CCl)no1,DXJICGSIRAJIDN-UHFFFAOYSA-N,cdp2w12_k10_s2_w2b9967750-6ffe-49a8-96e2-0bb513d870f7,cdp2w12_k10_s2_w30dec89f5-a40b-4f42-9dd5-72980ab87c74,cdp2w12_k10_s2_w1865a1bf3-a783-492e-9392-757d963904e1,cdp2w12_k10_s2_w5be16842e-26f1-48e0-85a3-ef84cea2abaa,cdp2w12_k10_s2_w42f125a37-529a-4201-aae8-cc14e3483d22,19,7869
330,30411.0,25664-D10-1,BRD-K73337972-001-05-6,25664,D10,1,SA1852325,BRD-K73337972,BROAD_CPD_ID,NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(NC(=O)C3CC3)cc2)cc1,DXJUOOVEFBLCTM-UHFFFAOYSA-N,cdp2w12_d10_s1_w217c48526-8c8a-4464-ae23-58af3aff68c6,cdp2w12_d10_s1_w3bcf408b2-2012-4569-b942-86168985342c,cdp2w12_d10_s1_w154eb4463-ae59-43f6-8cba-8c05c4a18d57,cdp2w12_d10_s1_w551493ddf-3adb-4d49-96e5-eb07e4024a07,cdp2w12_d10_s1_w40c947db0-bb44-4037-9e82-cddb6ee5bdb8,73,4755
331,53572.0,26207-K07-2,BRD-K42295110-001-06-5,26207,K07,2,SA1858512,BRD-K42295110,BROAD_CPD_ID,CC(C)NC(=O)NC(=O)COc1ccc(Br)cc1Br,DXUSESKZVPFYSV-UHFFFAOYSA-N,cdp2w9x2-au00026617_k07_s2_w22f0d9f3b-746d-40f6-8983-a4b4cceeb499,cdp2w9x2-au00026617_k07_s2_w313ca1243-53e2-466e-a0af-ab6dd875c9ba,cdp2w9x2-au00026617_k07_s2_w1487dda3c-d183-480b-aaf7-8809b80ee4fb,cdp2w9x2-au00026617_k07_s2_w593034f24-0d05-42ba-a043-65a961732ccf,cdp2w9x2-au00026617_k07_s2_w4df049699-50cc-4ce0-99f4-ad2734828b18,20,4732
332,45602.0,26007-E08-6,BRD-K02788568-001-01-5,26007,E08,6,SA798782,BRD-K02788568,BROAD_CPD_ID,CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1,DXWDIHWCVARGHC-AJWNWGNMSA-N,cdp2w8x2_e08_s6_w2e619b2b5-ac83-4ef4-b699-cb909c53ddc0,cdp2w8x2_e08_s6_w370dddf1b-f058-45d7-bd82-3c508b08dcdd,cdp2w8x2_e08_s6_w1a2cc80af-20ac-40c3-9bdd-98867ef4e1a2,cdp2w8x2_e08_s6_w5e3642e60-c9a1-4b72-a4fb-fdf86a4702a0,cdp2w8x2_e08_s6_w47e32ab48-2dd2-420a-a968-e8649100cd6f,22,10260
333,45653.0,26009-E12-3,BRD-K15236933-001-01-8,26009,E12,3,SA799665,BRD-K15236933,BROAD_CPD_ID,CS(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)NCc4ccc(Oc5ccccc5)cc4)O[C@H]3CO)c2c1,DXWDIHWCVARGHC-PWKYGKGFSA-N,cdp2w8x2_e12_s3_w2a6794a87-d21e-4434-b81a-b8f5b66a2159,cdp2w8x2_e12_s3_w32f2dceb4-8b6c-40af-bef2-89cffa22db79,cdp2w8x2_e12_s3_w19178ea5f-f4ec-4560-8bb2-b9766c7e5d2f,cdp2w8x2_e12_s3_w554a6d7e3-7a31-45b7-b963-fe9e9e9e7dc9,cdp2w8x2_e12_s3_w4a37f74aa-f11d-47cc-8fd9-7c986b348450,20,10111
334,52506.0,26202-P04-4,BRD-K21269532-001-05-7,26202,P04,4,SA1858532,BRD-K21269532,BROAD_CPD_ID,ClC(Cl)(Cl)C(=O)Nc1ccc(Nc2ccccc2)cc1,DXWLHYHAGCVSIA-UHFFFAOYSA-N,cdp2w9x2-au00026617_p04_s4_w26760f365-0212-47c1-b945-d6d46cd1512d,cdp2w9x2-au00026617_p04_s4_w319b01501-663f-4b09-b9f1-bb49e0e588b1,cdp2w9x2-au00026617_p04_s4_w1df562124-da1d-4666-8cbf-defdf2739301,cdp2w9x2-au00026617_p04_s4_w53f593462-396c-4af7-a46f-579ef40d396a,cdp2w9x2-au00026617_p04_s4_w4fed5510b-34eb-408f-aefe-8ddf04d4979b,53,3858
335,49310.0,26126-H21-6,BRD-A84024491-001-05-1,26126,H21,6,SA1858084,BRD-A84024491,BROAD_CPD_ID,OC1CCCN(C1)c1c2CCCc2nc2cc(nn12)-c1cccc(Cl)c1,DXXJMHKBQYKSBP-UHFFFAOYSA-N,cdp2w9x2_h21_s6_w2ff754ebc-c44e-4966-b2c3-a1dd726080a4,cdp2w9x2_h21_s6_w30f268483-7d03-4bff-b8af-1fa9ccbd592a,cdp2w9x2_h21_s6_w1287e866f-f778-4ea6-af2c-9a9a48bbc3ec,cdp2w9x2_h21_s6_w5e3a5a7e3-5282-4cd7-a2fa-f9322ce67068,cdp2w9x2_h21_s6_w45a08dcdc-feac-403e-8f07-af3d25d25682,89,1947
336,4575.0,24309-H13-4,BRD-K29359156-001-04-6,24309,H13,4,SA58679,ebselen,INN,O=c1n([se]c2ccccc12)-c1ccccc1,DYEFUKCXAQOFHX-UHFFFAOYSA-N,cdp2bioactives_h13_s4_w2a9adb762-7861-44d3-8f56-f1b1839d74d1,cdp2bioactives_h13_s4_w359e9f123-e89d-40d2-b9cc-69d51915a4ba,cdp2bioactives_h13_s4_w1db4e4cff-15a3-4400-abde-e6c03b87d366,cdp2bioactives_h13_s4_w58872f36b-e5af-46c6-a836-2c0e79484bc4,cdp2bioactives_h13_s4_w481d64525-5bfb-459f-aad0-c8950c6e9d81,126,530
337,19596.0,25564-I06-4,BRD-K48319737-001-05-2,25564,I06,4,SA1861955,BRD-K48319737,BROAD_CPD_ID,CC(C)(C)NC(=O)CSc1nc(cs1)-c1ccc(F)cc1,DYGLRIZMSKMDGS-UHFFFAOYSA-N,cdp2w11_i06_s4_w20a89ecd2-e3e3-43b1-baef-1ce145df9b5d,cdp2w11_i06_s4_w34d610b61-433d-48f9-be92-b63b0c369cf5,cdp2w11_i06_s4_w1c41d112e-05dd-443e-a7c3-bf5b363b14aa,cdp2w11_i06_s4_w596b61618-0222-41bc-833b-9fb3d42f9e31,cdp2w11_i06_s4_w4d0b040f9-f1dc-44da-9350-53823f9ba39b,64,3662
338,34358.0,25686-I19-6,BRD-K01199426-001-05-9,25686,I19,6,SA1856225,BRD-K01199426,BROAD_CPD_ID,COc1ccc(OC)c(NC(S)=Nc2ccccc2)c1,DYIPNXQBWVUFEX-UHFFFAOYSA-N,cdp2w12_i19_s6_w2aa59c319-69c5-4bfc-933f-0b8a9e623f6b,cdp2w12_i19_s6_w34a913094-bc3c-4d58-86c5-babff7ed6bb9,cdp2w12_i19_s6_w19f0ede78-3192-4a62-aeb7-f45bf1afb5b0,cdp2w12_i19_s6_w58cc5297a-e86d-4e93-a8bb-d07e8e978348,cdp2w12_i19_s6_w46cf05345-8a13-4706-ba84-df8fa16fca75,74,2360
339,17696.0,25485-N08-6,BRD-A05166186-001-05-6,25485,N08,6,SA1856677,BRD-A05166186,BROAD_CPD_ID,CC1(NC(=O)N(CC(=O)N2CCOCC2)C1=O)c1ccccc1,DYJAIDXXLDHNLI-UHFFFAOYSA-N,cdp2w10-au00024355_n08_s6_w2fcd1a837-e5ca-453f-bc2d-095ce38faa4f,cdp2w10-au00024355_n08_s6_w37b18f053-b426-4111-88b6-8842e30643f8,cdp2w10-au00024355_n08_s6_w1b19fb2b6-9458-45a3-a61d-0590899dadbb,cdp2w10-au00024355_n08_s6_w5a9612b2e-dcd8-4503-8998-8217fe76c0fb,cdp2w10-au00024355_n08_s6_w474b0a931-7502-4b9f-8857-dd02d45ef21e,49,4092
340,49592.0,26128-J09-6,BRD-A47428621-001-07-9,26128,J09,6,SA1860669,BRD-A47428621,BROAD_CPD_ID,COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)C(CC(N)=O)NC(=O)c2ccc(Br)cc2)cc1,DYNKWWYXPRMXOF-UHFFFAOYSA-N,cdp2w9x2_j09_s6_w2bed28008-f733-47ab-9ac7-a49e64adce90,cdp2w9x2_j09_s6_w328aa58b2-2d4d-4fb7-b335-ea2a1fe8651b,cdp2w9x2_j09_s6_w1d8f1963c-add1-4178-8d87-be7b05e48c97,cdp2w9x2_j09_s6_w5650a9c01-4287-4d7e-93c6-b151e893d930,cdp2w9x2_j09_s6_w448407186-546d-41c3-8e73-6702bd0d5862,42,3085
341,17098.0,25438-B03-2,BRD-K07522305-001-06-0,25438,B03,2,SA1855888,BRD-K07522305,BROAD_CPD_ID,FC(F)(F)C(=O)NC1=NN(C(=O)C1)c1ccccc1,DYYFSIIUWVSNMG-UHFFFAOYSA-N,cdp2w10_b03_s2_w2b7fec10c-ac39-4064-9569-b7848e9d7b76,cdp2w10_b03_s2_w36e70707d-4929-45af-81d2-faf41fab2086,cdp2w10_b03_s2_w189074892-bd77-4ec8-9fa3-1ea493efa981,cdp2w10_b03_s2_w5679fde4b-e3f6-410e-ae52-166d29f7383a,cdp2w10_b03_s2_w473ea65f2-cb53-42df-92e7-ef4de0c31d94,66,7452
342,9469.0,24751-H22-5,BRD-K88662980-001-02-7,24751,H22,5,SA666745,BRD-K88662980,BROAD_CPD_ID,COc1ccc(OC(=O)N(C)C[C@H]2OCc3cnnn3CCCC(=O)N(C[C@@H]2C)[C@H](C)CO)cc1,DYYSINDAYMXOAQ-NJNPRVFISA-N,cdp2w5_h22_s5_w2c86aa6c7-d317-44b6-a994-6f4133c68077,cdp2w5_h22_s5_w31d34ad4a-5a66-43e9-8eda-a86867c62317,cdp2w5_h22_s5_w13fc2257f-c01d-4f49-b80a-20bdcab69ce0,cdp2w5_h22_s5_w5b31c4c21-b045-438f-bfb9-05014e7611bb,cdp2w5_h22_s5_w4abcf1382-1066-4a18-9b93-1d90340882fb,39,10007
343,55933.0,26680-C09-5,BRD-K22897367-001-01-3,26680,C09,5,SA418043,BRD-K22897367,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O,DZRIWTKXHLXUTO-IMWIBFENSA-N,cdp2w13_c09_s5_w290ba14ef-1774-40b7-8c8c-5589bd5182d0,cdp2w13_c09_s5_w3742b6912-96a8-421a-9e32-4b2876711ede,cdp2w13_c09_s5_w1b949a060-f714-4476-aff5-40d7a47c370b,cdp2w13_c09_s5_w5f9a07126-1582-4852-b827-a5279b8f2b8e,cdp2w13_c09_s5_w41ebb60a9-0e9a-4fed-8b41-d949f0196021,87,10024
344,8887.0,24726-P10-5,BRD-K46370825-001-02-7,24726,P10,5,SA666653,BRD-K46370825,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)c2cc(on2)-c2ccccc2)OCc2cnnn2CCCC1=O,DZRIWTKXHLXUTO-XLNZFTOWSA-N,cdp2w5_p10_s5_w2c009b4fe-29f0-49bb-9ac9-839d39d01e86,cdp2w5_p10_s5_w3cfa58dd4-a8e6-4b14-940b-d129131f4b0b,cdp2w5_p10_s5_w195203623-69c9-4230-b230-3fb36df3d448,cdp2w5_p10_s5_w5df86442f-ec1a-4e66-a798-26280cceefe2,cdp2w5_p10_s5_w4d70741a9-3841-4760-be87-ada9d2cb3171,65,9906
345,38795.0,25738-K15-3,BRD-K19831573-001-05-8,25738,K15,3,SA1854281,BRD-K19831573,BROAD_CPD_ID,CCOc1c(Cl)cc(cc1Cl)C(=O)Nc1cccc(c1)C(O)=O,DZVLONPTRXOCBT-UHFFFAOYSA-N,cdp2w12_k15_s3_w2c0b2b4cf-d7b7-48fd-8870-7064ffca35f4,cdp2w12_k15_s3_w313883243-9e4e-4e5f-9106-42c2c279200f,cdp2w12_k15_s3_w1b1864286-5f57-45cb-b33e-66a0ff4757d2,cdp2w12_k15_s3_w5b654f879-a3c9-4bce-a042-8a07c78b6c4d,cdp2w12_k15_s3_w451049348-d4dc-4e53-8a2d-7ce2e4fede6d,57,3225
346,22297.0,25572-O17-5,BRD-K29515366-001-05-6,25572,O17,5,SA1855086,BRD-K29515366,BROAD_CPD_ID,CCCCC(=O)NNC(=S)NC(=O)c1cccc(c1)[N+]([O-])=O,FAJDETCVQBTNNR-UHFFFAOYSA-N,cdp2w11_o17_s5_w205e558a4-9e8a-4d1c-9630-06e5e46e7907,cdp2w11_o17_s5_w344bc16c6-f1b2-44b7-849c-6de8c5704bcf,cdp2w11_o17_s5_w10785ed7a-c83f-467e-992f-839c90f3a33f,cdp2w11_o17_s5_w58d230c51-a450-465a-a08c-9a3f3a65735e,cdp2w11_o17_s5_w4e1a103ba-51ba-4a83-a499-af0b2c39d7ce,33,6673
347,32132.0,25676-N18-6,BRD-K48788686-001-05-9,25676,N18,6,SA1860813,BRD-K48788686,BROAD_CPD_ID,COc1ccccc1N(CC=C)S(=O)(=O)c1cccc(c1)C(=O)OCC(=O)c1c[nH]c2ccccc12,FALPZHDUKBLXOH-UHFFFAOYSA-N,cdp2w12_n18_s6_w2f925e3c2-5748-4b70-ac91-db7c4e686d40,cdp2w12_n18_s6_w3f231fef1-4235-454c-a4ae-2ccf5e6860e6,cdp2w12_n18_s6_w16a0c2721-47b6-4aef-8c13-435eac1f5a14,cdp2w12_n18_s6_w517dfd9dd-4c8d-4c0f-b121-f346b2279abc,cdp2w12_n18_s6_w460cdceaa-05ad-4be4-a5db-fa265069a851,72,2919
348,6192.0,24320-F04-1,BRD-K64862097-001-03-9,24320,F04,1,SA82930,fluorometholone,INN,C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(C)=O)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]2(C)C=CC(=O)C=C12,FAOZLTXFLGPHNG-KNAQIMQKSA-N,cdp2bioactives_f04_s1_w28ac70fd1-2900-4428-a614-6fdb0274052b,cdp2bioactives_f04_s1_w347005ec4-8905-464d-b470-c4e2011155f0,cdp2bioactives_f04_s1_w125a34280-1fde-4a20-ae09-b4519d084e48,cdp2bioactives_f04_s1_w5a3ac3201-fc43-42f8-af64-a8e06f7a3c9a,cdp2bioactives_f04_s1_w4c8932e32-a4f3-42fa-a0d6-95320f9dd893,109,1352
349,11142.0,25387-E06-4,BRD-K12675127-001-06-5,25387,E06,4,SA1855581,BRD-K12675127,BROAD_CPD_ID,CC(C)C[C@H](NC(=O)c1[nH]cnc1C(=O)NCc1ccccc1)C(=O)OCc1ccccc1,FBBKSODBIBNBSX-FQEVSTJZSA-N,cdp2w10_e06_s4_w25ba80456-153e-42f6-a711-307b993898b8,cdp2w10_e06_s4_w31a92a9df-bfd5-4aff-a2ff-1e8379917d8f,cdp2w10_e06_s4_w13cc78391-ee7b-4029-a8b5-4c451c6bea6c,cdp2w10_e06_s4_w5dd949a58-3935-42c5-82d9-8dbb78dd3f2c,cdp2w10_e06_s4_w4e7bb9e99-dc2e-46ff-9f48-75e438d75d2f,30,8760
350,13784.0,25418-B03-6,BRD-K43430961-001-05-9,25418,B03,6,SA1860630,BRD-K43430961,BROAD_CPD_ID,OC(=O)c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1,FBJIOGOXHPDBIJ-UHFFFAOYSA-N,cdp2w10_b03_s6_w290d422ad-9a61-412d-8cd4-9fde979bb9de,cdp2w10_b03_s6_w376bbcd0c-5fa4-4ebb-b785-f20422d94194,cdp2w10_b03_s6_w14b44922f-f5bb-447f-9d1b-4cc59c0348d5,cdp2w10_b03_s6_w5a7599207-cd8d-4a1f-93c3-c4f0a5076568,cdp2w10_b03_s6_w488d2ac15-022f-45dc-8c23-a7566aa7fae8,55,3507
351,47903.0,26110-J17-3,BRD-K17412949-001-04-9,26110,J17,3,SA1857059,BRD-K17412949,BROAD_CPD_ID,COc1ccccc1-c1c(C)nn2c(cc(C)nc12)N1CCN(Cc2ccccc2)CC1,FBTWJBDSPSQIHU-UHFFFAOYSA-N,cdp2w9x2_j17_s3_w26ad82f18-10eb-496a-9f6a-c6e6b7bea405,cdp2w9x2_j17_s3_w32a5cdefe-3510-4628-a6cd-b248499fe2ac,cdp2w9x2_j17_s3_w1f3f53566-b6b3-4d12-ac08-a2a2ce8b9820,cdp2w9x2_j17_s3_w5045d163b-471d-4161-a3c8-0679f3b6567b,cdp2w9x2_j17_s3_w469f9a2dd-6f8a-4519-a246-6f977736dee6,73,3628
352,352.0,24277-O23-5,BRD-K38449220-001-03-8,24277,O23,5,SA83070,seneciphylline,primary-common,C\C=C1\CC(=C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23,FCEVNJIUIMLVML-QPSVUOIXSA-N,cdp2bioactives_o23_s5_w2861f3e10-b9d2-4864-893b-3dc95a3c8500,cdp2bioactives_o23_s5_w3a1fa0d10-5092-4698-9aa9-9b924fac31e1,cdp2bioactives_o23_s5_w151ff63c0-e7b0-45e5-81de-8a23f6976279,cdp2bioactives_o23_s5_w5d5d7bb19-523f-4bf4-8851-48cf5d86bee5,cdp2bioactives_o23_s5_w47477a635-93a5-464c-89fe-bf6583e77418,102,1236
353,53349.0,26205-M15-1,BRD-K44240630-001-05-2,26205,M15,1,SA1852604,BRD-K44240630,BROAD_CPD_ID,CN(CC(=O)Nc1nc2ccc(C)cc2s1)S(=O)(=O)c1ccc(Br)s1,FCQUWWDXGSTWHJ-UHFFFAOYSA-N,cdp2w9x2-au00026617_m15_s1_w2d1bcd70d-c3c6-4162-9611-d42c386ae9c9,cdp2w9x2-au00026617_m15_s1_w3d189a121-e0ba-409f-8b65-52a18bca7efb,cdp2w9x2-au00026617_m15_s1_w101a3d029-451e-43df-90db-549383a02c56,cdp2w9x2-au00026617_m15_s1_w579fe7ca1-71b9-4c69-b5ed-29c1ae7b50de,cdp2w9x2-au00026617_m15_s1_w4190b547b-1260-473b-8517-480633e7e96b,69,3722
354,18430.0,25492-A18-2,BRD-K68122544-001-06-6,25492,A18,2,SA1858688,BRD-K68122544,BROAD_CPD_ID,Clc1cccc(c1)-c1cc(C(=O)N2CCN(CC2)c2ccccn2)c2ccccc2n1,FDCALDHWTLPEDY-UHFFFAOYSA-N,cdp2w10-au00024360_a18_s2_w2565a74a5-32ee-431f-ad62-0215573f1522,cdp2w10-au00024360_a18_s2_w3d70d8ef3-1581-4a65-a267-48b8ecbcb9cd,cdp2w10-au00024360_a18_s2_w1fe0918b5-215f-4373-8cdd-4dd7957caa12,cdp2w10-au00024360_a18_s2_w5d060f92d-2b76-4419-b001-4f1fbb275c2c,cdp2w10-au00024360_a18_s2_w4bb0fb99f-0114-4e87-aa77-32f8fed9dcf9,51,1738
355,35574.0,25692-H05-4,BRD-K54573667-001-05-9,25692,H05,4,SA1859180,BRD-K54573667,BROAD_CPD_ID,Cc1ccc(cc1)-c1cc(no1)C(=O)Nc1c(cnn1C)C#N,FDDYPOTWBCFJKR-UHFFFAOYSA-N,cdp2w12_h05_s4_w2f16c5153-6b0a-49d8-ab70-4b4ffba4d9c7,cdp2w12_h05_s4_w379589ed8-7ac7-4009-992c-d6bf107fa0e3,cdp2w12_h05_s4_w113c18560-48be-43d6-a77d-c19c418bac43,cdp2w12_h05_s4_w5c254e227-a857-438d-843a-1f1c0d3d7140,cdp2w12_h05_s4_w4e2d83872-0d95-4221-a831-2658d39d810b,75,9123
356,10064.0,25374-M05-6,BRD-A41910737-001-05-7,25374,M05,6,SA1857102,BRD-A41910737,BROAD_CPD_ID,Fc1ccc(Br)cc1C1C=C(Nc2ncnn12)c1ccc(Br)cc1,FEAZABUGTHFEJX-UHFFFAOYSA-N,cdp2w10_m05_s6_w280949db4-de76-4830-9845-acb2a4fe9b1d,cdp2w10_m05_s6_w3b2576d86-fa06-4d41-b177-9db5e1d033ae,cdp2w10_m05_s6_w193253867-d461-4dd7-bea1-dfd95d33aa3b,cdp2w10_m05_s6_w569a68700-6e2e-480c-a9b8-a55ea683084f,cdp2w10_m05_s6_w493d9661e-0601-4e5b-b8af-42dc0a1f600e,23,5540
357,1126.0,24293-B01-5,BRD-K79425933-001-03-6,24293,B01,5,SA83335,benperidol,INN,Fc1ccc(cc1)C(=O)CCCN1CCC(CC1)n1c2ccccc2[nH]c1=O,FEBOTPHFXYHVPL-UHFFFAOYSA-N,cdp2bioactives_b01_s5_w24ee0e5d0-f963-4db6-a0b1-cd75371061e3,cdp2bioactives_b01_s5_w38adb9b18-ad09-4ed4-9ab6-4c3285843be6,cdp2bioactives_b01_s5_w1c9abada6-3983-4861-883e-1b49fb5fc098,cdp2bioactives_b01_s5_w506796b30-0aac-426e-b0db-060a76ac3143,cdp2bioactives_b01_s5_w445d4ef87-49c7-4ce9-893b-6fa63302434d,57,490
358,47978.0,26110-L20-6,BRD-K55286508-001-06-8,26110,L20,6,SA1854462,BRD-K55286508,BROAD_CPD_ID,[O-][N+](=O)c1cc(\C=C(/C#N)c2nc3ccccc3[nH]2)c(cc1N1CCOCC1)N1CCOCC1,FENLBYHKIDETIU-QGOAFFKASA-N,cdp2w9x2_l20_s6_w2046f741d-7c90-4ef6-9640-0775604ff934,cdp2w9x2_l20_s6_w3c240d7a8-5291-4f45-9412-260844cbfd47,cdp2w9x2_l20_s6_w142d668c0-2813-4b7e-b22a-38d5a269138f,cdp2w9x2_l20_s6_w56da1518e-c051-4bb1-96cb-f7efcf7f5e8e,cdp2w9x2_l20_s6_w4976ba738-8902-4348-b028-38b994f76ff5,80,1946
359,32884.0,25679-E20-2,BRD-K05133532-001-04-8,25679,E20,2,SA1853514,BRD-K05133532,BROAD_CPD_ID,COc1cccc(c1)N1CCN(CC1)C(=O)c1ccc2nc(sc2c1)N1CCCCC1,FFFRXIWAOZKWPF-UHFFFAOYSA-N,cdp2w12_e20_s2_w24f9fa6ba-9963-4844-acac-1d65c1c1833f,cdp2w12_e20_s2_w3f1ee169e-4f5a-43ef-bf91-8cd7416b5f38,cdp2w12_e20_s2_w1f80edaf2-12d1-4b5e-bbcd-29b16e5af5b1,cdp2w12_e20_s2_w5cc399b0a-27ac-4f96-9576-1d6ec441b696,cdp2w12_e20_s2_w4346d9326-b41b-4473-a933-f0fd885c35aa,53,6182
360,38876.0,25738-N15-6,BRD-K06905748-001-06-3,25738,N15,6,SA1854086,BRD-K06905748,BROAD_CPD_ID,Brc1ccc(cc1)-c1ccc(o1)C(=O)Nc1cccc(NC(=O)c2ccco2)c1,FFHBXQHBMMHCGZ-UHFFFAOYSA-N,cdp2w12_n15_s6_w2b0a8e77e-2966-4d50-822f-a4c75cc0403f,cdp2w12_n15_s6_w3ec7defca-0175-4a8f-bfff-169972e49a1b,cdp2w12_n15_s6_w1b147d644-8563-4a9a-bb4e-b853aea15c6e,cdp2w12_n15_s6_w50582b21c-fddd-46c1-a460-5e169f8a5749,cdp2w12_n15_s6_w4f717652b-a0b1-4f8f-a5ab-18a3e4d16ace,80,8241
361,13112.0,25410-O14-6,BRD-K59554004-001-05-6,25410,O14,6,SA1861970,BRD-K59554004,BROAD_CPD_ID,CC(=O)Nc1ccc(OC(=O)c2cccs2)cc1,FGNYPSLGEUCLPH-UHFFFAOYSA-N,cdp2w10_o14_s6_w29907aa43-0ee1-4ae0-b040-6e8b0b3a64cb,cdp2w10_o14_s6_w3c6febf3c-f67a-48b3-99f4-6b0ce637940f,cdp2w10_o14_s6_w1f4c10068-2b6d-4df8-8f9f-74e5164e04fb,cdp2w10_o14_s6_w54831c4c6-929c-4dfc-9d49-b65efedd74ef,cdp2w10_o14_s6_w45d781873-f7a2-4092-b55f-b553e4aa1f55,37,3250
362,16130.0,25434-B09-6,BRD-K60079337-001-05-9,25434,B09,6,SA1853388,BRD-K60079337,BROAD_CPD_ID,Cc1ccc(cc1)N1C(=O)c2ccc(N)cc2C1=O,FHABPHDBZIXDNX-UHFFFAOYSA-N,cdp2w10_b09_s6_w2bdece999-4333-4a4c-90b9-d0d0990c5947,cdp2w10_b09_s6_w36576b904-389c-48b7-a149-9f7078601de4,cdp2w10_b09_s6_w1d8d20c5e-695c-4f5d-a005-e79e5356edff,cdp2w10_b09_s6_w5b01e0bb8-5b6c-4262-a153-32c86eee8673,cdp2w10_b09_s6_w4002a73d8-8030-400c-8d06-cd137e53493d,83,8344
363,36055.0,25695-C08-5,BRD-K71233464-001-05-4,25695,C08,5,SA1859359,BRD-K71233464,BROAD_CPD_ID,Cc1ccc(cc1C)C(=O)Nc1ccc(Oc2ccc(C(O)=O)c(c2)C(O)=O)cc1,FHIYBDUACNKHBF-UHFFFAOYSA-N,cdp2w12_c08_s5_w294555d8f-41bb-4bda-8ed4-5e737c50152f,cdp2w12_c08_s5_w36a260cdf-07f0-4008-a212-de1d205b6d11,cdp2w12_c08_s5_w120aee39b-1090-4f72-b98d-bb0111f689f9,cdp2w12_c08_s5_w533341ed6-9052-4a41-835f-ebc4be76a266,cdp2w12_c08_s5_w45652c70d-ecd2-4243-90a0-9164fe3473e2,40,6750
364,33446.0,25680-P16-6,BRD-K90839997-001-06-9,25680,P16,6,SA1852544,BRD-K90839997,BROAD_CPD_ID,Fc1ccc(\C=C\C(=O)NCc2cccs2)cc1,FHMIMWWQRYDTRF-VMPITWQZSA-N,cdp2w12_p16_s6_w24319f5a5-b84c-46b9-8056-e7a8c556ec0c,cdp2w12_p16_s6_w3cf484f48-6dc2-41fb-aa6c-bdf2884d68ad,cdp2w12_p16_s6_w155d49ed1-5f36-4bf3-9835-343a2d3b8fb4,cdp2w12_p16_s6_w57d705f8f-60ef-49ef-af8a-a75ee7e280c5,cdp2w12_p16_s6_w414bb747a-e16c-48b0-8784-87bc6208b8c3,43,1644
365,28522.0,25638-C19-2,BRD-K17233342-001-05-9,25638,C19,2,SA1856107,BRD-K17233342,BROAD_CPD_ID,Cc1ccc(cc1C)S(=O)(=O)c1cc2c(nc3ccccn3c2=O)n(CC=C)c1=N,FHRJSUUAGIDHJY-UHFFFAOYSA-N,cdp2w12_c19_s2_w28ec71749-f58b-44a3-a541-43a0b7423a5f,cdp2w12_c19_s2_w38a16c768-cae7-4137-8336-2e68070fbc54,cdp2w12_c19_s2_w10fefab9f-1f59-466d-8ad9-370540048a01,cdp2w12_c19_s2_w590096b98-cff2-4035-9e42-6fed0988cae8,cdp2w12_c19_s2_w4fb086056-b66d-4483-97cc-8264166eef89,41,1780
366,7107.0,24357-H01-4,BRD-K67298865-001-02-5,24357,H01,4,SA82323,SB-431542,primary-common,NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccccn1)-c1ccc2OCOc2c1,FHYUGAJXYORMHI-UHFFFAOYSA-N,cdp2bioactives_h01_s4_w239702739-89bd-4343-9cd0-9bfe1b870128,cdp2bioactives_h01_s4_w36564f703-58ee-4767-ac36-2fb99dcfbc69,cdp2bioactives_h01_s4_w1999903ac-9756-4772-b547-d4c6a5727a91,cdp2bioactives_h01_s4_w5110afd98-f2d4-4f62-87c6-7a0e8a5e117a,cdp2bioactives_h01_s4_w45227f604-1f1a-4bfd-a265-7b9dba0d2084,73,8
367,35544.0,25692-G04-4,BRD-A11869386-001-05-5,25692,G04,4,SA1853764,BRD-A11869386,BROAD_CPD_ID,FC(F)(F)c1cccc(c1)N1CCN(CC2CC3CC2C=C3)CC1,FIAOAIAXJRLEKI-UHFFFAOYSA-N,cdp2w12_g04_s4_w2663037ce-931f-4ab1-9377-23ff4edd8e7d,cdp2w12_g04_s4_w3f98e404d-79a1-4d87-8356-c3bee60b9e28,cdp2w12_g04_s4_w1c6129406-7fb0-4a56-9f49-ba0eccb08c11,cdp2w12_g04_s4_w588ae8232-f2cc-4d5d-b40e-80b96535e362,cdp2w12_g04_s4_w4c516e445-913e-4fa0-9702-452478670000,68,5022
368,25116.0,25584-P14-4,BRD-K47259384-001-05-7,25584,P14,4,SA1853131,BRD-K47259384,BROAD_CPD_ID,Fc1ccccc1N1CCN(CC1)C(=O)c1cn(NC(=O)c2cnccn2)c(=O)c2ccccc12,FIJGPYYANFEKGF-UHFFFAOYSA-N,cdp2w11_p14_s4_w25d08be45-1892-4508-a55d-2e51ee87360d,cdp2w11_p14_s4_w34ad1e851-8d28-4845-86fd-8245b412c687,cdp2w11_p14_s4_w16f0d04e6-e805-43cc-b59a-7adc59891f87,cdp2w11_p14_s4_w5dece1287-a330-4a18-beda-584bf9473c18,cdp2w11_p14_s4_w4875844d8-bc0a-4fcd-86c4-69714202cb1b,38,6288
369,37103.0,25707-I05-3,BRD-A65313838-001-05-3,25707,I05,3,SA1857040,BRD-A65313838,BROAD_CPD_ID,COc1ccc(cc1)C(=O)NCC12OC(C=C1)C1C2C(=O)N(Cc2ccccc2)C1=O,FIWVFKGPAZUXEL-UHFFFAOYSA-N,cdp2w12_i05_s3_w2aff91777-998e-440c-a76e-c0092092a453,cdp2w12_i05_s3_w3a3c96ec9-4008-401b-a6f0-ac0f7e8dabae,cdp2w12_i05_s3_w1dde58967-781e-4a9a-8868-015f4fa6ef65,cdp2w12_i05_s3_w57c411333-8159-4bf7-a8a4-1653c8cb6fe0,cdp2w12_i05_s3_w48eadcc87-4761-4a75-b2f7-145ba03b790c,69,8173
370,25412.0,25585-M10-6,BRD-K05472148-001-05-3,25585,M10,6,SA1855871,BRD-K05472148,BROAD_CPD_ID,CCCc1cc2c(cc1O)oc(C)c(-c1ccccn1)c2=O,FJAZHJWLZLBNNC-UHFFFAOYSA-N,cdp2w11_m10_s6_w243746b15-caad-451b-85e3-794739a56dcf,cdp2w11_m10_s6_w3939baa9a-e7cd-445a-96ae-9ed1cb7ec6b5,cdp2w11_m10_s6_w15a49841f-28ea-4e71-a061-79a4ea3fa6a3,cdp2w11_m10_s6_w5192e8536-d699-48f6-9868-4be42038101b,cdp2w11_m10_s6_w4fbc75bd3-b272-4b5a-ae1b-cd6c068f0c42,76,5917
371,4495.0,24309-E12-2,BRD-K25649279-001-01-2,24309,E12,2,SA792121,2-Iodomelatonin,to-be-curated,COc1ccc2[nH]c(I)c(CCNC(C)=O)c2c1,FJDDSMSDZHURBJ-UHFFFAOYSA-N,cdp2bioactives_e12_s2_w2a2b3bdba-16bd-4e6d-b908-eba5be70839e,cdp2bioactives_e12_s2_w371ccacc1-adff-4c26-a975-07314744bae0,cdp2bioactives_e12_s2_w11db13a65-e84a-4ff6-8ec0-9d36b0ece12f,cdp2bioactives_e12_s2_w596899188-12ae-496e-a203-1eee6d89591d,cdp2bioactives_e12_s2_w4e86203ff-a80d-409d-ac2d-d1909a66992e,116,407
372,3019.0,24305-D14-2,BRD-K03602135-236-02-1,24305,D14,2,SA83532,fluvastatin,INN,CC(C)n1c(\C=C\[C@H](O)C[C@H](O)CC(O)=O)c(-c2ccc(F)cc2)c2ccccc12,FJLGEFLZQAZZCD-JUFISIKESA-N,cdp2bioactives_d14_s2_w20e40a52c-64e4-4a23-9d7a-bb343f7c9aef,cdp2bioactives_d14_s2_w30984bfdb-495e-4184-99c2-c0e983150fb5,cdp2bioactives_d14_s2_w1976e4934-e59f-47e6-aafb-f138dc4d2f98,cdp2bioactives_d14_s2_w566e76817-c39c-4948-9d50-2280e0dbfe95,cdp2bioactives_d14_s2_w4aec4e8ce-2f03-45b7-b9ec-96757dec90e1,109,903
373,21844.0,25571-J16-2,BRD-K52531428-001-05-9,25571,J16,2,SA1853888,BRD-K52531428,BROAD_CPD_ID,COC(=O)c1ccc(NC(S)=NCCc2cccc(C)c2)cc1,FJPXNNYOMPXQFR-UHFFFAOYSA-N,cdp2w11_j16_s2_w24c5cefc8-49a9-40b0-8feb-922deef16061,cdp2w11_j16_s2_w317cb9043-86b0-4328-8b0c-84096be47315,cdp2w11_j16_s2_w130adfe23-3c0f-4637-b5b9-f9d0d5586371,cdp2w11_j16_s2_w5a50c991d-d7f7-4c4f-8432-0eefe058c87b,cdp2w11_j16_s2_w49c65bc10-495a-43df-a40a-918fed6dec30,89,1857
374,31750.0,25675-H08-2,BRD-K76210886-001-07-3,25675,H08,2,SA1853192,BRD-K76210886,BROAD_CPD_ID,CCNc1ccc(cc1NCC(=O)Nc1ccccc1Br)S(=O)(=O)N(C)C,FJQOFAPRFVRUND-UHFFFAOYSA-N,cdp2w12_h08_s2_w260540c5f-306f-4260-93a4-7cc71ac26da2,cdp2w12_h08_s2_w331bc61b7-1c26-4585-8523-db5e89613d0b,cdp2w12_h08_s2_w1c7611178-8638-4c94-a1f6-a656e4df5ae7,cdp2w12_h08_s2_w5e856527d-e780-4559-8baa-05cc21abbf98,cdp2w12_h08_s2_w41c79ab1b-e8d4-4e25-9790-37c332447787,65,1761
375,21865.0,25571-K09-5,BRD-A28936006-001-04-6,25571,K09,5,SA1858924,BRD-A28936006,BROAD_CPD_ID,CC(N1C(=S)S\C(=C/c2cccn2C)C1=O)C(O)=O,FKAZWCQRSJHSCC-TWGQIWQCSA-N,cdp2w11_k09_s5_w245d291c2-4697-452b-877c-62a51bb6cfb3,cdp2w11_k09_s5_w30130da2b-da87-403c-b715-22fbf047f3c7,cdp2w11_k09_s5_w168f4b71e-a850-4f95-8646-01314753d8ed,cdp2w11_k09_s5_w565852353-69c2-40e6-a747-3709276b7234,cdp2w11_k09_s5_w47eb2d2e6-64a4-48da-a059-bd3e61df1dd7,59,8287
376,20198.0,25566-G06-6,BRD-K31061166-001-05-9,25566,G06,6,SA1859680,BRD-K31061166,BROAD_CPD_ID,COC(=O)CCC(=O)c1oc2ccc(Br)cc2c1N,FKMIASWZTUXLNT-UHFFFAOYSA-N,cdp2w11_g06_s6_w2005b88a8-c23a-4bf4-8986-b8c577771e9f,cdp2w11_g06_s6_w32b1491d7-2d4b-418b-a282-eaace6dd4f5d,cdp2w11_g06_s6_w101938b4e-cb65-4d59-a53e-5b1f19d44757,cdp2w11_g06_s6_w5c52f8abd-18b1-43b5-9cd3-3044efff1221,cdp2w11_g06_s6_w45783ca0f-d839-43e6-8e04-f1a8c05d94e7,42,5342
377,31357.0,25674-C12-5,BRD-K97931214-001-05-6,25674,C12,5,SA1855428,BRD-K97931214,BROAD_CPD_ID,Cn1c(CCNC(=O)c2ccccc2)nc2cc(NC(=O)c3ccco3)ccc12,FKQWQGLKQBUXGW-UHFFFAOYSA-N,cdp2w12_c12_s5_w229de517e-c44f-4b63-8857-8a49345be3cc,cdp2w12_c12_s5_w38df80b92-a8e3-4a9b-a44b-412907a52dea,cdp2w12_c12_s5_w1dba070ac-7622-4cb4-bbc4-22ef1c07ca4f,cdp2w12_c12_s5_w5c6c76ce8-950a-4671-96d2-f265e7d974fc,cdp2w12_c12_s5_w42965b132-59bb-4eac-ac00-77b9da483c96,44,7950
378,13144.0,25410-P08-2,BRD-A97361070-001-05-1,25410,P08,2,SA1854220,BRD-A97361070,BROAD_CPD_ID,COC(=O)C1(NOC2C1C(=O)N(C2=O)c1ccc(Cl)cc1Cl)C(=O)OC,FKSFAHWMBVHZTP-UHFFFAOYSA-N,cdp2w10_p08_s2_w24d67ba31-30ce-49fb-8af1-bbf041c348fb,cdp2w10_p08_s2_w340e56060-c433-4b35-9566-c3165cbd06d6,cdp2w10_p08_s2_w158cf92c0-6953-4d42-9274-5427b7ff5e69,cdp2w10_p08_s2_w51342964a-2142-49be-896f-a4512e69f861,cdp2w10_p08_s2_w415a12572-1bb8-457c-a6cc-186c28b55d58,52,2522
379,46086.0,26060-I17-4,BRD-K59232896-001-06-8,26060,I17,4,SA1858562,BRD-K59232896,BROAD_CPD_ID,NC1=NC[C@H](Cc2ccc(O)cc2)N1CCC12CC3CC(CC(C3)C1)C2,FLQJADCPCJPEIP-ONUXSRJRSA-N,cdp2w9x2_i17_s4_w2faf082be-5df9-49fe-8b98-f67f52c585d8,cdp2w9x2_i17_s4_w369edd87a-1d38-4026-bf4f-a2e15b098659,cdp2w9x2_i17_s4_w103c5f1aa-321a-4f9b-bb2c-8cbc2549c421,cdp2w9x2_i17_s4_w5d3a20d97-d7a3-4e82-bdcd-0dacdba3529f,cdp2w9x2_i17_s4_w40485525b-a2e4-4a52-a544-a36eac4d2f02,38,1781
380,53802.0,26216-G15-4,BRD-K73196671-001-05-0,26216,G15,4,SA1859424,BRD-K73196671,BROAD_CPD_ID,Fc1ccc(cc1)C(=O)NCCC1=CCCCC1,FLUJDWNFMMMLFN-UHFFFAOYSA-N,cdp2w9x2_g15_s4_w225fda418-d74d-40b5-95ec-f29ec4613166,cdp2w9x2_g15_s4_w36d45731b-8045-4320-ba35-7c0ebfc0ab9a,cdp2w9x2_g15_s4_w1aea4136e-6e2d-4a7a-8abe-09b24698fc3d,cdp2w9x2_g15_s4_w5445a5602-5ca8-4f74-b501-68c9b14a5cda,cdp2w9x2_g15_s4_w44bb2b72c-6c54-451e-86fd-8bd8631766a5,48,4098
381,41707.0,25966-G16-5,BRD-K08109516-001-01-1,25966,G16,5,SA82422,"L-701,324",to-be-curated,Oc1c(-c2cccc(Oc3ccccc3)c2)c(=O)[nH]c2cc(Cl)ccc12,FLVRDMUHUXVRET-UHFFFAOYSA-N,cdp2w8x2_g16_s5_w2de164ed6-375a-4195-a0e1-4984d0b2d4da,cdp2w8x2_g16_s5_w3a68056e5-8372-41e2-be78-694f756d20ac,cdp2w8x2_g16_s5_w1f1f0631e-2a44-489f-aa6f-d478d693a09c,cdp2w8x2_g16_s5_w5b65a779a-6da1-441b-88f4-6af2ae96cf38,cdp2w8x2_g16_s5_w448c63f56-656e-4002-9a47-7a015a4cd46b,65,396
382,12263.0,25406-C14-3,BRD-K25774147-001-02-6,25406,C14,3,SA1853730,BRD-K25774147,BROAD_CPD_ID,COc1ccc(C)cc1-n1nnnc1SCc1nc(N)nc(n1)N(C)C,FMDRCKLGDXLGKP-UHFFFAOYSA-N,cdp2w10_c14_s3_w28badd2e3-a2f8-4de1-8c94-1e975ab55111,cdp2w10_c14_s3_w313f41398-f81f-49ba-88b3-38a72dd91b33,cdp2w10_c14_s3_w132d2599d-2381-4b4c-8745-29d340612960,cdp2w10_c14_s3_w54c9d3525-f149-41f0-a46a-c31472f87725,cdp2w10_c14_s3_w49c5cc971-e595-4930-9c62-0a2d6f77dbd4,60,3960
383,43266.0,25984-H24-4,BRD-K30199352-001-02-9,25984,H24,4,SA81969,"anandamide(22:4,n-6)",primary-common,CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCC(=O)NCCO,FMVHVRYFQIXOAF-DOFZRALJSA-N,cdp2w8x2_h24_s4_w2cae31ef8-d9ca-42eb-8560-befee4b778de,cdp2w8x2_h24_s4_w3ea04d412-11d4-4dcb-8b42-f2b1d71bb96d,cdp2w8x2_h24_s4_w19a0eb69e-93cc-44ea-a8e5-193b619c72e5,cdp2w8x2_h24_s4_w5d3f1dbd0-a989-4042-a14f-c0fa2acc4234,cdp2w8x2_h24_s4_w4edc1974d-f047-4d37-9913-983ad211a962,78,749
384,55371.0,26577-H06-1,BRD-K29474997-001-01-2,26577,H06,1,SA798858,BRD-K29474997,BROAD_CPD_ID,CN(C)c1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NC4CCCCC4)O[C@H]3CO)c2c1,FNFGUCPTYHKNGE-JXYHXMIBSA-N,cdp2w7x2_h06_s1_w2e0cf74d0-5304-40e7-8e01-c67db2cdb70c,cdp2w7x2_h06_s1_w3c45f2b66-8d97-4d73-9e9f-695688014dc7,cdp2w7x2_h06_s1_w1fb769779-49a2-4c43-bd7a-f0f8682b4dc5,cdp2w7x2_h06_s1_w59c07c438-19c2-4ccc-89d2-b3078147c71d,cdp2w7x2_h06_s1_w4f520f15b-3b34-408c-a83d-46cf7f229f46,75,10532
385,25807.0,25588-C22-5,BRD-K35177360-001-07-9,25588,C22,5,SA1859014,BRD-K35177360,BROAD_CPD_ID,COc1ccc(OC)c(Nc2ccc(Nc3cc(OC)ccc3OC)nn2)c1,FNIFMQONEBLCKJ-UHFFFAOYSA-N,cdp2w11_c22_s5_w2a3585111-a8d9-4d56-804f-2cc19f24558b,cdp2w11_c22_s5_w34bb77925-1326-49c9-9ef6-d99abc717959,cdp2w11_c22_s5_w118ecd132-2cf1-4fa8-86c3-0b7c0c3cc522,cdp2w11_c22_s5_w54c7bb098-284c-439b-b426-914dcbeb7442,cdp2w11_c22_s5_w41eea3232-e1fd-4bd6-9491-3c41c4f8b471,34,6542
386,18340.0,25490-M10-2,BRD-K78496035-001-05-0,25490,M10,2,SA1859379,BRD-K78496035,BROAD_CPD_ID,CNc1oc(nc1C#N)-c1ccc(Cl)cc1,FOBQPWQGVDGQBL-UHFFFAOYSA-N,cdp2w10-au00024359_m10_s2_w24b177e51-614c-4410-9a5d-b7e0e86a6574,cdp2w10-au00024359_m10_s2_w3a109a4ed-b4ef-4a09-bfde-36711da61fa9,cdp2w10-au00024359_m10_s2_w1ca536732-19bd-405e-8b64-5fa83b5fa86e,cdp2w10-au00024359_m10_s2_w5c64a2375-a879-4db5-9da5-667b2bd67f37,cdp2w10-au00024359_m10_s2_w4f3786117-ec60-4c0d-ab49-bcfb8103face,32,7933
387,12175.0,25403-O13-5,BRD-K56378267-001-05-5,25403,O13,5,SA1859910,BRD-K56378267,BROAD_CPD_ID,O=C(NC(=S)Nc1cccc(NC(=O)c2ccccc2)c1)c1cccs1,FOHIIVAKMDSIAO-UHFFFAOYSA-N,cdp2w10_o13_s5_w23cd42d6b-1342-4b18-a622-fd52db40741f,cdp2w10_o13_s5_w32f974464-f321-4176-a3ab-604ee879f48b,cdp2w10_o13_s5_w16302655e-8a5a-4590-8bc3-b03049742ba9,cdp2w10_o13_s5_w5ee3e1847-ab1a-455e-914e-83a6a656d523,cdp2w10_o13_s5_w4d3934a13-bf80-484d-862d-6ed784458c3e,50,3226
388,33887.0,25683-D09-3,BRD-K21965571-001-05-2,25683,D09,3,SA1859710,BRD-K21965571,BROAD_CPD_ID,Cc1ccc(cc1NC(=S)NC(=O)c1ccco1)-c1nc2ncccc2o1,FONMYXFCXOYTLI-UHFFFAOYSA-N,cdp2w12_d09_s3_w25f8e6157-d603-4e65-bf9e-52ad518c69dd,cdp2w12_d09_s3_w36bc3228f-3b0b-4213-8119-aeb647fd4b27,cdp2w12_d09_s3_w1d59b18a3-9a34-429d-91f8-6a39e7f9fd59,cdp2w12_d09_s3_w5f8d62a56-86a3-43e3-ac5a-90d155e4dceb,cdp2w12_d09_s3_w4179aa64e-0d4e-42da-90c2-9684984f4895,59,8535
389,15399.0,25428-K13-1,BRD-A44957030-001-05-9,25428,K13,1,SA1854594,BRD-A44957030,BROAD_CPD_ID,Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C1CCCN(C1)C(=O)Cc1cccs1,FOVKLWYIDJLBDW-UHFFFAOYSA-N,cdp2w10_k13_s1_w25650f067-788f-4b61-9c62-197e474d36c0,cdp2w10_k13_s1_w3f0117eb0-e51a-44cb-966d-e80559d148e8,cdp2w10_k13_s1_w170808748-658a-4400-97d8-db11fed11f1f,cdp2w10_k13_s1_w51b1149c1-2437-4396-b7cd-3bfc6ead5d2b,cdp2w10_k13_s1_w4791b5f70-251f-40f2-bc77-a04d5a33161e,54,9136
390,18893.0,25503-F15-3,BRD-A07764704-001-04-2,25503,F15,3,SA1855165,BRD-A07764704,BROAD_CPD_ID,CCOC(=O)C1Cn2c(S1)nc1-c3ccccc3CC3(CCCC3)c1c2=O,FPALGZOTQIOPFX-UHFFFAOYSA-N,cdp2w11-au00029680_f15_s3_w2dd06397a-a880-4225-8773-96837ba4259b,cdp2w11-au00029680_f15_s3_w3e83b74b9-635f-4960-a8d3-fdc252027bb2,cdp2w11-au00029680_f15_s3_w1aaae224b-12a3-4202-92b0-4c6698e605c1,cdp2w11-au00029680_f15_s3_w5f7435d55-ec2e-4a53-b26f-44f6a1de5254,cdp2w11-au00029680_f15_s3_w44d5e8bc9-97cf-4dc2-b46e-f22134404885,51,7060
391,25182.0,25585-B16-4,BRD-K07846767-001-05-6,25585,B16,4,SA1852868,BRD-K07846767,BROAD_CPD_ID,CCC(CC)c1ncc[nH]1,FPLOWPOUHNRUMN-UHFFFAOYSA-N,cdp2w11_b16_s4_w290adf45a-d263-4d9c-953c-6009c1cd7ebd,cdp2w11_b16_s4_w36e956d86-bfb2-47eb-831d-2a517dd68562,cdp2w11_b16_s4_w18ebf101e-035a-484f-b94d-3d5de0115ef0,cdp2w11_b16_s4_w5ee96099c-2e11-4bb6-9533-649c139fe903,cdp2w11_b16_s4_w4d865aa3e-ad6b-45ea-beca-cdfec0ba025b,89,8367
392,34775.0,25688-L05-3,BRD-A61314904-001-05-4,25688,L05,3,SA1861497,BRD-A61314904,BROAD_CPD_ID,Cc1cc2OC(N)=C(C#N)C(c3ccc(o3)[N+]([O-])=O)c2c(=O)o1,FPLQLGSWZHRSPC-UHFFFAOYSA-N,cdp2w12_l05_s3_w29d2a3ea6-0f3b-4950-b445-6f8d28c59ab9,cdp2w12_l05_s3_w3a518049d-da56-450a-98b5-62997c5991a1,cdp2w12_l05_s3_w10e0f48ab-d311-4a62-867e-c1fc3858125d,cdp2w12_l05_s3_w581253fb7-459b-4689-9678-b15214412839,cdp2w12_l05_s3_w452ac8b65-98a0-484a-9b28-025e5a0bea7f,56,2509
393,12063.0,25403-G05-1,BRD-A43459761-001-06-0,25403,G05,1,SA1856162,BRD-A43459761,BROAD_CPD_ID,CCC1CCCCN1C(=O)CSc1nc2c(nc3ccccc23)c(O)n1C,FPOSQCUJYPDCLB-UHFFFAOYSA-N,cdp2w10_g05_s1_w2a0b00f85-f7c7-4a12-a9b2-553a676cbbc2,cdp2w10_g05_s1_w35e63c2a2-e4ab-4593-b9fe-53fd5c25834a,cdp2w10_g05_s1_w1dc1e7bff-5c3e-42cc-b3b1-aa985d3ebccd,cdp2w10_g05_s1_w5a325996f-7aae-47b8-9f58-f8993659ea68,cdp2w10_g05_s1_w4284878ff-4468-4fdb-99fc-10d231df2271,45,6964
394,26670.0,25592-H05-4,BRD-K01751980-001-05-5,25592,H05,4,SA1861458,BRD-K01751980,BROAD_CPD_ID,Brc1ccccc1S(=O)(=O)NCc1ccccc1,FPQGRYUENBBEOH-UHFFFAOYSA-N,cdp2w11_h05_s4_w2eed2d1de-eb6b-45cb-9921-b4c4ac104bb1,cdp2w11_h05_s4_w30cb940d4-f3c7-4ede-8aec-5669c57ad155,cdp2w11_h05_s4_w1d853dfd9-2e8c-4aad-8bc9-1f59f6d49455,cdp2w11_h05_s4_w501fdb5d3-ea76-4427-bd58-6d6c6b9bff93,cdp2w11_h05_s4_w459b00b6e-137f-4d21-80a8-f2a9143e89ad,79,9782
395,49998.0,26133-N18-4,BRD-K95500860-001-05-8,26133,N18,4,SA1857017,BRD-K95500860,BROAD_CPD_ID,Cc1cc(C)n2[nH]c(=O)c(N=Nc3cccc(c3)C(F)(F)F)c2n1,FQVAFGRKZUFQLS-UHFFFAOYSA-N,cdp2w9x2_n18_s4_w22b7d25f9-721d-44c3-99d4-66bb02141ffc,cdp2w9x2_n18_s4_w351a13137-b63f-4302-82a3-24176c2d1469,cdp2w9x2_n18_s4_w1ec9c9307-9314-4bfb-80eb-1a6eb0e76b06,cdp2w9x2_n18_s4_w504753c4d-4c79-442d-9b3a-4c997e36182e,cdp2w9x2_n18_s4_w436a3a6b7-baf4-4508-a628-21cd28ce896d,47,4780
396,18384.0,25490-N19-4,BRD-K61135001-001-07-9,25490,N19,4,SA1854961,BRD-K61135001,BROAD_CPD_ID,CCNC(=O)c1c(NC(=O)c2cc([nH]n2)-c2cc(C)ccc2O)sc2CCCCc12,FROCDKXVIGKGFN-UHFFFAOYSA-N,cdp2w10-au00024359_n19_s4_w27459b02c-b7ed-4be4-839e-5e264d1b1b1d,cdp2w10-au00024359_n19_s4_w37e3e789f-6c83-40a7-855f-0d65edae2078,cdp2w10-au00024359_n19_s4_w1ed1ae61f-d942-4673-9a43-77df697ec01b,cdp2w10-au00024359_n19_s4_w549c04d6c-f132-4f23-8a06-9ce843ec4aee,cdp2w10-au00024359_n19_s4_w49e05ea44-08d6-4a72-9ca8-88c0a7189419,0,4706
397,26754.0,25592-N08-4,BRD-K45077223-001-07-6,25592,N08,4,SA1858456,BRD-K45077223,BROAD_CPD_ID,Cc1ccc(OCC(=O)Nc2ccc3OCOc3c2)c(C)c1,FSGKMSJYQKDZPE-UHFFFAOYSA-N,cdp2w11_n08_s4_w2d709fdaf-8928-43e0-8711-3c95a9e0be43,cdp2w11_n08_s4_w32f75a577-a958-4777-bd84-a5322b421b03,cdp2w11_n08_s4_w1b59c62cf-dd37-402c-8898-8cd3225a17a5,cdp2w11_n08_s4_w500baa42a-0690-4001-aac6-404a76292bc8,cdp2w11_n08_s4_w45b36e1aa-7c1b-4f2a-a2c0-ad584c8b07a0,65,6246
398,53846.0,26216-J09-6,BRD-K66959386-001-06-4,26216,J09,6,SA1853563,BRD-K66959386,BROAD_CPD_ID,COc1ccc(cc1)-c1nc(C#N)c(NCc2ccco2)o1,FSLQMTMAJRMVOR-UHFFFAOYSA-N,cdp2w9x2_j09_s6_w2e3781783-5050-463b-9306-ddf1c3ad3d45,cdp2w9x2_j09_s6_w372965407-89a1-44f6-a5f1-22b960232c02,cdp2w9x2_j09_s6_w1f74ee0b4-b1a6-4679-a81e-8a7b6c354629,cdp2w9x2_j09_s6_w53f7d587c-2d06-4fbd-a62c-e2bfc183eb78,cdp2w9x2_j09_s6_w44e2ad221-1e3e-4959-990b-e93c1cca3ab3,46,5368
399,50043.0,26133-P14-1,BRD-K30863464-001-05-8,26133,P14,1,SA1861804,N-(4-chlorophenyl)-N-ethyl-6-(isopropylamino)-4-(trifluoromethyl)nicotinamide,to-be-curated,CCN(C(=O)c1cnc(NC(C)C)cc1C(F)(F)F)c1ccc(Cl)cc1,FSMWWOWLPLWAIA-UHFFFAOYSA-N,cdp2w9x2_p14_s1_w2a6f762c3-af80-4ff9-8741-9d3f330dca48,cdp2w9x2_p14_s1_w3dc99b7ba-d07c-42e6-a6b6-7fed11013d1f,cdp2w9x2_p14_s1_w108e67a08-11f5-4ece-a423-ad86ddf3c2a0,cdp2w9x2_p14_s1_w54cacf138-5577-4974-b225-aae78d917f9a,cdp2w9x2_p14_s1_w4cea74ce9-4fac-43e9-862c-d967441e0180,55,8345
400,31120.0,25667-E17-2,BRD-K32577024-001-05-5,25667,E17,2,SA1854180,BRD-K32577024,BROAD_CPD_ID,CCOc1cccc(c1)C(=O)Nc1nccs1,FSVDGFBFHIAZHT-UHFFFAOYSA-N,cdp2w12_e17_s2_w20238a0b9-5ca6-403b-bfc8-a7719ccb6dbb,cdp2w12_e17_s2_w342364022-b3c9-4204-9088-26677716f032,cdp2w12_e17_s2_w1fbda156f-eba4-4986-aa05-be7ca00e389d,cdp2w12_e17_s2_w5144a9ff1-1369-4a20-a2f9-86d2c4cded2e,cdp2w12_e17_s2_w442280f57-e339-4ac5-a66d-480f10039763,68,5238
401,44282.0,25988-F04-6,BRD-K47337578-034-01-7,25988,F04,6,SA792015,4-(4-Fluorobenzoyl)-1-(4-phenylbutyl)-piperidine oxalate,to-be-curated,Fc1ccc(cc1)C(=O)C1CCN(CCCCc2ccccc2)CC1,FTJXZACAQRDRNT-UHFFFAOYSA-N,cdp2w8x2_f04_s6_w242ab53cf-c1bc-47ac-891e-7e21ac6755a5,cdp2w8x2_f04_s6_w3cfb53040-ccc6-436b-8637-c2f669804a5c,cdp2w8x2_f04_s6_w1b473bb85-c059-44f0-b830-876ea31ba865,cdp2w8x2_f04_s6_w5deac80c8-1df7-47ec-8863-6e3a88276879,cdp2w8x2_f04_s6_w439646b9e-f8f4-4046-bd70-5978e51cd34b,75,276
402,17644.0,25485-L10-2,BRD-K94052032-001-05-4,25485,L10,2,SA1860070,BRD-K94052032,BROAD_CPD_ID,CC(C)Nc1c2CCCc2nc2c(c(C)nn12)-c1ccccc1,FTKGGDDYJKDDDL-UHFFFAOYSA-N,cdp2w10-au00024355_l10_s2_w21ef4b083-3d5d-4d6b-8b99-09839276e3c8,cdp2w10-au00024355_l10_s2_w39e7c76fd-0618-4a74-b232-49ef219c6dda,cdp2w10-au00024355_l10_s2_w14783fe7c-6e12-409a-917e-6b1c272f46bb,cdp2w10-au00024355_l10_s2_w514809dd4-d136-4a7a-ba21-650a322a5ead,cdp2w10-au00024355_l10_s2_w45d8f03fa-eb3d-40df-a893-46ae55f4b020,49,5842
403,15965.0,25432-J17-3,BRD-K89917778-001-05-3,25432,J17,3,SA1852169,BRD-K89917778,BROAD_CPD_ID,Cc1onc(c1CNC(=O)Nc1ccc(F)cc1F)-c1ccccc1,FTWYUWCJVZUUIE-UHFFFAOYSA-N,cdp2w10_j17_s3_w290cd666a-5934-4efb-9e90-f44d7c14c5cb,cdp2w10_j17_s3_w339cd804b-e6eb-4435-8dea-820ed8ffecc9,cdp2w10_j17_s3_w14869adc1-7731-42fa-b145-1ab1166e263f,cdp2w10_j17_s3_w5fab23ae3-ae89-4669-8d6f-09c6479c3309,cdp2w10_j17_s3_w4fcb58fd7-fc36-494e-a840-a1e16f13df00,74,7072
404,39419.0,25891-C01-3,BRD-K13529284-001-01-3,25891,C01,3,SA1430248,BRD-K13529284,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@H](CCN)O[C@H]1CO,FUQFZQORNFVFMN-DFBGVHRSSA-N,cdp2w6x2_c01_s3_w2211fe369-e965-4f7b-ab63-a6bea504cb72,cdp2w6x2_c01_s3_w3293507b7-7f5b-407e-bdb5-c30fb68e8a2a,cdp2w6x2_c01_s3_w1df75548c-76e2-4264-bc38-5b3bac095e13,cdp2w6x2_c01_s3_w56ff325d7-dd6e-4f7b-9499-1c5a326e1ca1,cdp2w6x2_c01_s3_w444a2e29d-0be9-4de0-8a3f-45efabd482a4,128,10235
405,29852.0,25643-H04-6,BRD-K50757825-001-05-1,25643,H04,6,SA1852276,BRD-K50757825,BROAD_CPD_ID,Cc1cc(NC(=O)CN2CCN(CC2)c2ccccc2O)no1,FUSFHSUJSQCXOU-UHFFFAOYSA-N,cdp2w12_h04_s6_w27d05f596-0a9e-4ab7-aabe-660c217e3e61,cdp2w12_h04_s6_w3108f7e1b-567a-4595-8406-960c7cdb0d57,cdp2w12_h04_s6_w1644f7c94-4db4-4f85-bfed-2040a407efbf,cdp2w12_h04_s6_w5a6bf840f-39cb-44b1-8cbc-f22a10dc6d65,cdp2w12_h04_s6_w448239bae-71a6-473d-9b59-284f63eeacf5,47,9541
406,31486.0,25674-I14-2,BRD-K50229096-001-06-1,25674,I14,2,SA1858720,BRD-K50229096,BROAD_CPD_ID,O=C(N1C(=O)c2ccccc2S1(=O)=O)c1cc2CCCc2s1,FVIFHSHIDLMOJH-UHFFFAOYSA-N,cdp2w12_i14_s2_w21f314923-bc68-463c-a556-f8c515cfb87f,cdp2w12_i14_s2_w3d48c4c1c-1e1b-431c-bdcf-5fc32a4a6225,cdp2w12_i14_s2_w15db24ba0-b2cb-4611-80d8-72996179e2dc,cdp2w12_i14_s2_w51b4084cc-4899-4cef-8ced-195a89f00fba,cdp2w12_i14_s2_w4ed74f3c4-67f6-445d-951b-d209db84edd1,52,7491
407,5566.0,24313-A23-5,BRD-K41868777-003-02-9,24313,A23,5,SA791940,W-5,primary-common,NCCCCCCNS(=O)(=O)c1cccc2ccccc12,FVJRBJIENDRNBE-UHFFFAOYSA-N,cdp2bioactives_a23_s5_w2f8aee0d4-98c6-466d-a70a-aef459b31d8f,cdp2bioactives_a23_s5_w3bee73112-4ee0-4781-acff-316522cf80fb,cdp2bioactives_a23_s5_w1ce3bfe15-8d76-4ab3-b03b-c6990c3e6531,cdp2bioactives_a23_s5_w55acb2388-8b16-4ce2-b207-1091d8097a6b,cdp2bioactives_a23_s5_w4340f7c08-f89e-47e4-aef8-05e5e8ac2d58,81,1338
408,22799.0,25575-I15-3,BRD-K38331236-001-06-3,25575,I15,3,SA1859378,BRD-K38331236,BROAD_CPD_ID,CCOc1ccc(cc1)S(=O)(=O)N(C(=O)c1ccco1)c1cc2sc(=O)oc2c2ccccc12,FVXSWPYGLOZBBR-UHFFFAOYSA-N,cdp2w11_i15_s3_w297073423-4503-418b-8ce2-92fc7f1609a1,cdp2w11_i15_s3_w31705dae9-eba6-4a63-90d9-85422406ee81,cdp2w11_i15_s3_w19bb543d0-030f-44ee-875d-940769f7c618,cdp2w11_i15_s3_w58688eac6-042e-49b4-8dee-5f71c08e0755,cdp2w11_i15_s3_w4388f0ba0-f99c-4457-97b8-e541072ad877,58,3944
409,31674.0,25675-E03-4,BRD-K75175199-001-05-5,25675,E03,4,SA1858687,BRD-K75175199,BROAD_CPD_ID,CN(C)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)-c1ccco1,FVZYVMXFUJYLAW-UHFFFAOYSA-N,cdp2w12_e03_s4_w28f317e25-cba2-4471-b4bd-864b781f5e6c,cdp2w12_e03_s4_w383b68202-353c-4de2-bbf7-9faabdead0ab,cdp2w12_e03_s4_w17e2542f9-80d5-4da5-a123-7b803a0e4e89,cdp2w12_e03_s4_w5817b5c37-e629-4de5-aa2e-c0890c57b028,cdp2w12_e03_s4_w4e1d21c94-371d-4fcc-aaa0-8e0e7c950f7d,44,5416
410,17842.0,25488-E15-2,BRD-K29901384-001-05-6,25488,E15,2,SA1858715,BRD-K29901384,BROAD_CPD_ID,CCC(=O)c1ccc(N2CCCCCC2)c(F)c1,FWEPWVLEYFZGBQ-UHFFFAOYSA-N,cdp2w10-au00024357_e15_s2_w27bf25a0c-e338-4885-bc5a-ecc097e295c1,cdp2w10-au00024357_e15_s2_w367681bf3-0eaa-4b83-b0ba-d1497106c461,cdp2w10-au00024357_e15_s2_w1ae112570-8d82-4fef-8ff8-6a630ae6cf42,cdp2w10-au00024357_e15_s2_w544cbd68d-b7ba-458e-b04f-499555df4413,cdp2w10-au00024357_e15_s2_w4ccd473bc-0b27-439f-9297-17a3fb16c3b8,55,9281
411,30684.0,25664-P09-4,BRD-K08562725-001-04-2,25664,P09,4,SA1854596,BRD-K08562725,BROAD_CPD_ID,Cc1cccc(CSC2=NCCN2C(=O)c2ccc(Br)o2)c1,FWGXAIFIZCHPCH-UHFFFAOYSA-N,cdp2w12_p09_s4_w203309159-23e9-42dc-83aa-4968c870a733,cdp2w12_p09_s4_w336e6e3de-414a-422e-ae2c-fd84e41df38a,cdp2w12_p09_s4_w1966a41ba-792f-465c-b9f8-4893caedf6e6,cdp2w12_p09_s4_w51d2d4562-bb08-43e7-b701-7c94b271066e,cdp2w12_p09_s4_w449a7e129-7326-4576-976d-9bf3d7cb62d4,56,8728
412,22558.0,25573-M21-2,BRD-K03371476-001-05-1,25573,M21,2,SA1853623,BRD-K03371476,BROAD_CPD_ID,COC(=O)C1=CN(Cc2ccc(F)cc2)C=C(C1c1cc(OC)c(OC)c(OC)c1)C(=O)OC,FWLARKPWDNSLGG-UHFFFAOYSA-N,cdp2w11_m21_s2_w2103bfba4-a987-4f39-b986-86452489b610,cdp2w11_m21_s2_w3671c331c-d0fc-488f-ba0d-2fbfc698d16f,cdp2w11_m21_s2_w169e8a064-2eba-4c72-b809-e86442a6089b,cdp2w11_m21_s2_w5d02fa3ec-8b17-4975-8985-a4d4a07298ab,cdp2w11_m21_s2_w4f67cc706-f49b-43ac-a3cc-11677237fd7a,82,4125
413,50600.0,26138-J17-6,BRD-K83898111-001-05-7,26138,J17,6,SA1856402,BRD-K83898111,BROAD_CPD_ID,NC(=S)N=Nc1c(O)[nH]c2c(Br)cc(Br)cc12,FWZLGEMXULQBBJ-UHFFFAOYSA-N,cdp2w9x2_j17_s6_w212da160b-fa08-44d1-a770-fa7fef69aa1a,cdp2w9x2_j17_s6_w3b37d795a-96f8-4ba6-97ec-cc7835a50d65,cdp2w9x2_j17_s6_w14dccba9c-b177-420a-a4e9-f89208a11aa5,cdp2w9x2_j17_s6_w597d7bd41-83d3-4cb8-9eb8-1c11b8adb8fd,cdp2w9x2_j17_s6_w473006819-e9b2-4da0-8259-199ac15d9cea,54,8168
414,38589.0,25732-D10-1,BRD-K43977780-001-05-8,25732,D10,1,SA1858732,BRD-K43977780,BROAD_CPD_ID,COc1ccc(Cl)c(c1)N1CCN(CCCNC(=O)Nc2ccc(C)cc2)CC1,FXEQPMSYJAWBQO-UHFFFAOYSA-N,cdp2w12_d10_s1_w289232b81-1670-4607-9967-caa2423f16e3,cdp2w12_d10_s1_w3e2e4726b-512c-4946-8117-2029aba3f232,cdp2w12_d10_s1_w1ce94a97b-da80-4917-999f-c0cae1153aaa,cdp2w12_d10_s1_w5e785cdb8-d49c-4d81-a9d1-840d9c21d50b,cdp2w12_d10_s1_w4b289d742-0d08-47f0-be38-cfeeab6be09b,65,2728
415,38756.0,25738-H13-6,BRD-A53396890-001-05-7,25738,H13,6,SA1854158,BRD-A53396890,BROAD_CPD_ID,COc1ccc(cc1)N1CCC(CN=C(S)Nc2c(C)cc(C)cc2C)C1,FXHGJVWNQLIDGU-UHFFFAOYSA-N,cdp2w12_h13_s6_w27471600b-8842-493b-a89b-27c6b920b93c,cdp2w12_h13_s6_w3dc6cbd5d-67b9-460a-93ea-31b822561008,cdp2w12_h13_s6_w182f9b880-7e36-4006-a170-dd281ef37d75,cdp2w12_h13_s6_w53eb53944-58ff-4700-adc3-8a0879761c25,cdp2w12_h13_s6_w438cb8428-f289-48ca-be14-d00f4435a9cd,56,8000
416,12746.0,25408-M07-6,BRD-K46216175-001-06-9,25408,M07,6,SA1859801,BRD-K46216175,BROAD_CPD_ID,CCSc1nnc(-c2cccc(c2)S(=O)(=O)N(CC)CC)n1Cc1ccccc1,FXTCNLXWYWXFPA-UHFFFAOYSA-N,cdp2w10_m07_s6_w23667f2b7-79ab-449e-869b-f0ea50a6dfba,cdp2w10_m07_s6_w3c26586e7-ed35-4abc-ba9a-1def06995b71,cdp2w10_m07_s6_w1cf38d887-319d-40ab-acc4-a395f089beb0,cdp2w10_m07_s6_w5acfa92c4-51c9-4b17-8896-45b65e86b5eb,cdp2w10_m07_s6_w4d9e24be8-0fd2-4e89-8831-72c5aa5d4952,59,4505
417,18394.0,25490-O11-2,BRD-K24997804-001-05-1,25490,O11,2,SA1852955,naphthol AS-VL,primary-common,CCOc1ccc(NC(=O)c2cc3ccccc3cc2O)cc1,FYJKEJZGNQVNLC-UHFFFAOYSA-N,cdp2w10-au00024359_o11_s2_w2e40395ba-8984-4f95-b35b-2bcdaded0b9c,cdp2w10-au00024359_o11_s2_w379e706b9-b0ff-464a-bb0e-7b823831d021,cdp2w10-au00024359_o11_s2_w1e661b392-fc22-48fc-8a95-5cfd54d033a9,cdp2w10-au00024359_o11_s2_w530364794-ef13-48ce-a79b-fd71ed2b3ef1,cdp2w10-au00024359_o11_s2_w42700007c-92b2-4267-a02e-58ec8adba325,90,3795
418,27436.0,25594-N18-2,BRD-K24382357-001-05-7,25594,N18,2,SA1860429,BRD-K24382357,BROAD_CPD_ID,Cn1cccc1C(=O)NC(=O)COC(=O)c1ccccc1O,FYKKUFZSXSJFQW-UHFFFAOYSA-N,cdp2w11_n18_s2_w28f1c5cd2-dd93-421c-bddf-a91604816e63,cdp2w11_n18_s2_w35b064d69-31db-4fd8-87ed-2529e2ddf078,cdp2w11_n18_s2_w13d8c2465-9e28-4a43-bde7-c26069c66c5b,cdp2w11_n18_s2_w54822b36f-127e-4b92-94a4-d1d16ab498cf,cdp2w11_n18_s2_w45ca9869f-1232-4ad3-8d17-b3184290c043,101,7300
419,15797.0,25430-P19-3,BRD-K83691254-001-05-3,25430,P19,3,SA1857103,BRD-K83691254,BROAD_CPD_ID,Cn1c2nc(nc(SCC(=O)Nc3ccccc3F)c2c(=O)n(C)c1=O)-c1ccccc1F,FYPQJYNLIRLFPZ-UHFFFAOYSA-N,cdp2w10_p19_s3_w29b4b456b-0b6c-4860-9383-1f510f0d667a,cdp2w10_p19_s3_w38284267a-2852-4388-bc83-37d6bb14b57a,cdp2w10_p19_s3_w1b70634e6-e287-4fa0-a376-74251159fa79,cdp2w10_p19_s3_w55c73ae69-df35-479f-94e8-f2eb188b4d7d,cdp2w10_p19_s3_w4ef3b0b90-89e6-4f6e-bf5a-82446c90cd11,3,1854
420,29533.0,25642-I09-5,BRD-K19534880-001-06-4,25642,I09,5,SA1861298,BRD-K19534880,BROAD_CPD_ID,COC(=O)CCn1c(C)cc(C(=O)COc2ccccc2C(N)=O)c1C,FYYVKBJGCYJVKE-UHFFFAOYSA-N,cdp2w12_i09_s5_w293ae68a8-5a11-4691-a1eb-8eb7e5ffcb97,cdp2w12_i09_s5_w386f3f8cf-55f5-4b2f-a477-6cb311783ca2,cdp2w12_i09_s5_w1edda62ea-e7dc-44d6-acce-291d38019a2c,cdp2w12_i09_s5_w501fc137b-a1b4-4183-9ce6-8df404d83627,cdp2w12_i09_s5_w455462bc7-155c-4fd6-b5b0-e7b89a1e39cb,44,6837
421,28894.0,25639-G04-2,BRD-K12826618-001-05-2,25639,G04,2,SA1859675,BRD-K12826618,BROAD_CPD_ID,OC(=O)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O,FZEBPJBRDFXKIH-HNNXBMFYSA-N,cdp2w12_g04_s2_w2bd7691de-716f-4a41-8653-e25159652aab,cdp2w12_g04_s2_w3db18c6fc-dcec-4a75-b04a-fb5d9f07316e,cdp2w12_g04_s2_w162e99862-171d-4686-ab08-cd65240654ca,cdp2w12_g04_s2_w54886cfa0-38ff-4201-a0b6-750ca9fff2de,cdp2w12_g04_s2_w40bebcbc0-f693-49cf-98bf-dcccdf998d50,68,487
422,38158.0,25725-J07-2,BRD-K78222443-001-05-6,25725,J07,2,SA1852073,BRD-K78222443,BROAD_CPD_ID,COc1cccc(OC)c1NC(=O)Cc1nn(C)c(=O)c2ccccc12,FZWRTZXNJDXKLV-UHFFFAOYSA-N,cdp2w12_j07_s2_w26f551e32-8b77-4ab3-9208-aad45eb67454,cdp2w12_j07_s2_w3895e4045-6981-4262-b3b6-d1d008c7e67c,cdp2w12_j07_s2_w1768f18cc-84b2-4718-a664-45585e26f0fa,cdp2w12_j07_s2_w5dbbcf9ba-27bf-4726-ad14-35b2a33adaee,cdp2w12_j07_s2_w4ed9388eb-5558-42f1-8270-0baae89ca08f,43,5787
423,6893.0,24352-M16-6,BRD-K14282469-001-01-5,24352,M16,6,SA82523,PAPP,primary-common,Nc1ccc(CCN2CCN(CC2)c2cccc(c2)C(F)(F)F)cc1,GAAKALASJNGQKD-UHFFFAOYSA-N,cdp2bioactives_m16_s6_w22851a6de-89bd-449f-bc85-6effdc6282cc,cdp2bioactives_m16_s6_w39104ec17-054e-4bd9-8f3a-8ecc798b8265,cdp2bioactives_m16_s6_w1d7404083-d9dc-437e-8bbd-90d98c22464b,cdp2bioactives_m16_s6_w5412a8f99-c65a-44d5-a943-a26f15d013fb,cdp2bioactives_m16_s6_w4da4ba9f0-7adf-468d-8787-9afdf878c36c,101,1413
424,37630.0,25708-O13-2,BRD-K51694032-001-07-0,25708,O13,2,SA1859455,BRD-K51694032,BROAD_CPD_ID,COC(=O)c1ccc(NC(=O)c2cn(nc2-c2ccncc2)-c2ccccc2)cc1,GAMGAUOEAAYTOE-UHFFFAOYSA-N,cdp2w12_o13_s2_w2c61cc96b-35d6-4c37-96d1-ff2a3371ffc6,cdp2w12_o13_s2_w34abbaed8-5f9f-4be9-a473-7e81df732468,cdp2w12_o13_s2_w15fc94d35-fbe2-4732-85c8-9f0cf67717bd,cdp2w12_o13_s2_w59cd8433f-0735-438b-a951-e01944a26188,cdp2w12_o13_s2_w426a0eee1-8650-4e06-ae98-8e06770aa40f,32,4439
425,53322.0,26205-L13-4,BRD-K21841112-001-05-1,26205,L13,4,SA1854177,BRD-K21841112,BROAD_CPD_ID,Cc1nn(CC#N)c(=O)n1-c1cccc(F)c1,GAZRBGPPBOYNRU-UHFFFAOYSA-N,cdp2w9x2-au00026617_l13_s4_w2f7b8231d-c579-45e0-b219-ac9b94cf8659,cdp2w9x2-au00026617_l13_s4_w35b8855f5-b331-4c16-8491-4ecf238dbcd2,cdp2w9x2-au00026617_l13_s4_w1e69bbad1-ad6f-4585-bf3f-c4ebd07bea88,cdp2w9x2-au00026617_l13_s4_w551e30e10-74fb-4896-96ea-be471eb35c9b,cdp2w9x2-au00026617_l13_s4_w40dcd9565-4567-41a0-b2bd-eb382b5525b4,64,9757
426,29074.0,25639-O22-2,BRD-K06020071-001-04-3,25639,O22,2,SA1858315,BRD-K06020071,BROAD_CPD_ID,Clc1ccccc1-c1nnc(SCC(=O)N2CCCCC2)o1,GBPZFEGFFOATMH-UHFFFAOYSA-N,cdp2w12_o22_s2_w2eec895cc-59b1-44b0-8ea8-39750bc53826,cdp2w12_o22_s2_w3af231b9f-62d6-4dfd-a3b4-d79d6a3e9b54,cdp2w12_o22_s2_w1b497fed1-b187-48e6-8d78-a67bc7e8c411,cdp2w12_o22_s2_w507ffc67b-a124-4472-8c1e-cceebfe65583,cdp2w12_o22_s2_w4a8cf26fc-f147-4f51-8c7a-adb77d780e79,66,4591
427,49705.0,26128-O06-5,BRD-K18178356-001-05-8,26128,O06,5,SA1854090,BRD-K18178356,BROAD_CPD_ID,Cc1cccc(NC2=NN=C(CS2)c2ccccc2F)c1C,GCYLOSBHOCQBTH-UHFFFAOYSA-N,cdp2w9x2_o06_s5_w2762d357c-062d-43c7-8d6b-48b6353ac344,cdp2w9x2_o06_s5_w3903b3f28-5af5-4094-a6e8-5eab8d7268dc,cdp2w9x2_o06_s5_w125f8eb9f-a3f3-4eba-9dbe-5f018f8abc34,cdp2w9x2_o06_s5_w5d174d1af-6ebc-42f4-bc50-424988e91bba,cdp2w9x2_o06_s5_w4c6ca20ef-68a4-4dc4-b0bd-18ae1c83779b,51,5083
428,14101.0,25420-E17-5,BRD-K44084227-001-05-3,25420,E17,5,SA1853315,BRD-K44084227,BROAD_CPD_ID,OC1(CCN(CC1)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccc2OCOc2c1,GDRFYXHETWABFZ-UHFFFAOYSA-N,cdp2w10_e17_s5_w24b169c08-2bc1-4d20-bee4-295713b9f45d,cdp2w10_e17_s5_w3ddf8973d-4566-48c6-8f6d-7f0b408afe63,cdp2w10_e17_s5_w1828a0807-b9ef-4b75-bcf1-1aab753a325e,cdp2w10_e17_s5_w5d33b8751-92d3-470a-9dde-5d2445a11f9c,cdp2w10_e17_s5_w4aeac0ff6-9ff2-45ae-922c-97f75c54bfe2,45,2769
429,6107.0,24320-A11-6,BRD-K93201660-001-05-7,24320,A11,6,SA753165,ML-7,primary-common,Ic1cccc2c(cccc12)S(=O)(=O)N1CCCNCC1,GEHJIACZUFWBTK-UHFFFAOYSA-N,cdp2bioactives_a11_s6_w28a72c606-b0fd-4715-8668-e7c4ae9013c2,cdp2bioactives_a11_s6_w3767faf85-173f-4547-bdb5-e127e1254ebf,cdp2bioactives_a11_s6_w1dd16e8e3-4e66-4c7c-9b07-acb9e6c92153,cdp2bioactives_a11_s6_w5719687db-438f-4166-9b11-da0a9864fffc,cdp2bioactives_a11_s6_w4f968ecd4-6a9b-4626-a140-8744ae2ca43a,45,1073
430,30622.0,25664-M13-2,BRD-K58123928-001-05-4,25664,M13,2,SA1857759,BRD-K58123928,BROAD_CPD_ID,C(Sc1ncnc2sccc12)c1ccccc1,GEIHZHQRXYKYAE-UHFFFAOYSA-N,cdp2w12_m13_s2_w204326e58-ec69-49c3-87ea-a50a852ee60a,cdp2w12_m13_s2_w35425b3e5-2185-4f69-9028-10d57aca8435,cdp2w12_m13_s2_w16e05240d-2177-49ef-bbda-91e5d8ead5b9,cdp2w12_m13_s2_w51dbc2759-156e-4e90-acc5-2aae9186f609,cdp2w12_m13_s2_w4df67ed04-a1ec-4e8f-8a20-8c987c60dcd8,87,4512
431,52674.0,26203-J20-4,BRD-K60743244-001-05-2,26203,J20,4,SA1859479,BRD-K60743244,BROAD_CPD_ID,CCCCCCN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O,GEMOAMFASTVPGD-VBKFSLOCSA-N,cdp2w9x2-au00026617_j20_s4_w20ccab4ac-55ac-42b3-a7db-0ae3eca4606d,cdp2w9x2-au00026617_j20_s4_w3426e0828-c20d-45de-ae22-2322edf45162,cdp2w9x2-au00026617_j20_s4_w17bb5d0f6-b8fd-43ae-b029-064820aa18d3,cdp2w9x2-au00026617_j20_s4_w59f965d1d-4bee-428b-8e5f-29b15582176c,cdp2w9x2-au00026617_j20_s4_w473a3de1a-8d88-4aa4-850e-e916692d6b60,35,5909
432,24669.0,25583-J21-1,BRD-K72154771-001-05-9,25583,J21,1,SA1857855,BRD-K72154771,BROAD_CPD_ID,COc1ccc(OC)c(NC(=O)NC2(Oc3ccccc3O2)C(F)(F)F)c1,GESUEFWZCPKEMI-UHFFFAOYSA-N,cdp2w11_j21_s1_w287fcc2f7-2d58-4435-b718-3670df9b16c4,cdp2w11_j21_s1_w3f99981d3-2fb5-4e44-84ac-dc0d551438f0,cdp2w11_j21_s1_w16e84a8dd-5547-4459-ab90-95f7d5812ba0,cdp2w11_j21_s1_w53a3421a1-9a0a-409c-8d21-97da3db5d1e6,cdp2w11_j21_s1_w4438c895c-116d-4609-baa7-b7bf90ba48ae,59,9362
433,17554.0,25485-H03-2,BRD-K61910461-001-06-0,25485,H03,2,SA1856542,BRD-K61910461,BROAD_CPD_ID,C[C@H]([C@H]1C[C@]1(C)[C@H](NC(=O)c1cc(C)on1)c1ccccc1)C(=O)Nc1ccc2ccccc2c1,GEZMALYAXNUEJF-JUCUOUSCSA-N,cdp2w10-au00024355_h03_s2_w21c099a20-87a7-468f-a0bf-f5792318abdf,cdp2w10-au00024355_h03_s2_w390225219-f557-48ed-8442-463a055126df,cdp2w10-au00024355_h03_s2_w1985878cb-bba3-4ac1-bb81-c7e74a48154e,cdp2w10-au00024355_h03_s2_w5ddd22d0e-48ef-4307-b9c9-e23895ed3ed9,cdp2w10-au00024355_h03_s2_w4cfaab756-9735-46ca-99fc-a68626a1d3b5,75,4228
434,40164.0,25944-M17-4,BRD-A84913188-001-02-0,25944,M17,4,SA58566,dehydrorotenone,primary-common,COc1cc2OCc3oc4c5CC(Oc5ccc4c(=O)c3-c2cc1OC)C(C)=C,GFERNZCCTZEIET-UHFFFAOYSA-N,cdp2w8x2_m17_s4_w2d1b1edec-dffb-457d-aaed-28e2818ba513,cdp2w8x2_m17_s4_w305fb0b07-c10f-48b6-b8f2-0d4289468756,cdp2w8x2_m17_s4_w1ac11cefa-70c5-41c2-af61-10c733954649,cdp2w8x2_m17_s4_w5d3968021-f3e2-4ed3-b134-48fd08462444,cdp2w8x2_m17_s4_w4cc8ef760-b023-4c49-aea1-121b8f131ef7,58,10315
435,12766.0,25408-N20-2,BRD-K95206601-001-07-2,25408,N20,2,SA1860740,BRD-K95206601,BROAD_CPD_ID,CCOC(=O)c1cn2nc(cc2nc1C1CCN(CC1)C(=O)OC(C)(C)C)-c1ccc(OC)cc1,GGBFBHKVPYQVAS-UHFFFAOYSA-N,cdp2w10_n20_s2_w27fe727ca-76d0-46f8-9341-b379642ab32f,cdp2w10_n20_s2_w328041c8f-2053-4b2f-9dcb-4a0bec7d550f,cdp2w10_n20_s2_w13494c6c1-6b0f-4b2b-a2e7-9716c911d9dd,cdp2w10_n20_s2_w5d226a255-973b-4103-bc66-f1845e9035ba,cdp2w10_n20_s2_w4860698ec-f472-4cd1-87d8-8771c585b003,42,7700
436,35898.0,25694-K14-4,BRD-K71793847-001-05-5,25694,K14,4,SA1862248,BRD-K71793847,BROAD_CPD_ID,COc1ccc(OCC(=O)Nc2cc3oc4ccccc4c3cc2OC)cc1,GGJTWUAZBRROEN-UHFFFAOYSA-N,cdp2w12_k14_s4_w27d59b3b1-218b-435d-ba41-9d1b4e7a4379,cdp2w12_k14_s4_w312f88467-8b95-40fc-9725-55de7cd7b0eb,cdp2w12_k14_s4_w1bc6966e5-b3d4-4803-82d7-b976932676b2,cdp2w12_k14_s4_w5255d784c-72f4-44f4-a5cb-e33f405e25d8,cdp2w12_k14_s4_w491bddc80-02cb-4d7e-8e71-b4363b9e34cf,12,9340
437,29602.0,25642-K18-2,BRD-K67458784-001-05-6,25642,K18,2,SA1859385,BRD-K67458784,BROAD_CPD_ID,COc1ccc(C)cc1-n1nnnc1SCc1nc2ccccc2s1,GGOXXPDZGAXDBB-UHFFFAOYSA-N,cdp2w12_k18_s2_w24e1b325e-6fe7-4f6e-a39f-235205e57de8,cdp2w12_k18_s2_w3f896fdee-b352-4dd1-bf07-50648cb85c75,cdp2w12_k18_s2_w1fd835d3d-4426-4461-b221-2af3ffcb8c3e,cdp2w12_k18_s2_w549a77c7c-dbab-40ab-8232-02248a6572ce,cdp2w12_k18_s2_w4311e26f3-1a37-4d47-ace3-48ba8a8ce7d8,86,4487
438,39409.0,25885-I03-5,BRD-K46985581-001-01-8,25885,I03,5,SA787232,BRD-K46985581,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@@H](C)CO)n(C)c1ccccc21,GGYLTZASASDOIP-DUELTEGESA-N,cdp2w6x2_i03_s5_w20f04e8a8-7cba-4b80-b2c5-b93160b353d4,cdp2w6x2_i03_s5_w3d0ddd96e-5cff-4ca3-8bdc-4c744c6f3808,cdp2w6x2_i03_s5_w18ce3f664-d08b-4e8d-8ded-7bfaa45365fe,cdp2w6x2_i03_s5_w53e03b383-c1f3-432d-b459-e234d8880f73,cdp2w6x2_i03_s5_w4d7af71b3-66c5-4e04-969a-9d2f5f745c33,55,10521
439,39349.0,25858-I01-5,BRD-K40112492-001-01-3,25858,I01,5,SA786749,BRD-K40112492,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@H]1C)[C@H](C)CO)n(C)c1ccccc21,GGYLTZASASDOIP-JWUQWVJQSA-N,cdp2w6x2_i01_s5_w2d74e6d82-cc5f-44f5-98d7-77ba22b62d1b,cdp2w6x2_i01_s5_w3f7da6b45-7815-4e6c-8263-ea6f36860fae,cdp2w6x2_i01_s5_w1cd914412-a290-46df-b45a-c8c7c6a25d0e,cdp2w6x2_i01_s5_w5ce73fd98-b278-4f14-8859-490b508bd299,cdp2w6x2_i01_s5_w464a387bd-460b-457a-a834-35ada95285f9,77,10520
440,2551.0,24302-H24-2,BRD-A70268693-103-01-9,24302,H24,2,SA792128,PG-9,to-be-curated,CC(C(=O)OC1CC2CCC(C1)N2C)c1ccc(Br)cc1,GHDWIFTUSXQYGK-UHFFFAOYSA-N,cdp2bioactives_h24_s2_w28fcc2357-8d33-44ca-80dc-ae0ed37502ff,cdp2bioactives_h24_s2_w3234f7ca8-f81b-4ca5-9d73-d55e3977ae0d,cdp2bioactives_h24_s2_w1282c6623-896f-491d-aaa0-35908ea70c48,cdp2bioactives_h24_s2_w5a2c932e4-a63c-4068-a049-46bf1980da52,cdp2bioactives_h24_s2_w459d6e8e4-e7cb-4705-8135-f5bb892fc709,100,1345
441,9418.0,24750-K13-2,BRD-K46726368-001-02-3,24750,K13,2,SA666339,BRD-K46726368,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(Oc3ccccn3)c2)OCc2cnnn2CCCC1=O,GHLJLHKVBJDFKH-CZSZKKDXSA-N,cdp2w5_k13_s2_w2bcd8557a-3b21-43ee-a816-f1793f1ecac3,cdp2w5_k13_s2_w3a1877201-e272-4589-a92b-ca849e752f98,cdp2w5_k13_s2_w166b1648f-80b4-4162-91bb-5697bf5bc735,cdp2w5_k13_s2_w5cf8acf14-77ba-4226-9590-b7ea3a799770,cdp2w5_k13_s2_w483a71732-d6ec-4c7f-8432-37d6b81660d6,73,9714
442,11917.0,25392-P18-5,BRD-K55165131-001-08-5,25392,P18,5,SA1861062,BRD-K55165131,BROAD_CPD_ID,Cc1nn2c(NCc3ccccn3)cc(nc2c1-c1ccccc1)C(C)(C)C,GHODFTLMWOCFDA-UHFFFAOYSA-N,cdp2w10_p18_s5_w254f07e77-db72-47b1-9248-ca32b9be129c,cdp2w10_p18_s5_w3b639f96d-9bcc-4d55-913a-2de960ae5d06,cdp2w10_p18_s5_w171c46547-23c1-49dc-a836-c5af25004aef,cdp2w10_p18_s5_w5ef5906ef-d697-429e-8abf-b3de7f0a040d,cdp2w10_p18_s5_w438e14868-a2d0-443e-9a33-71b6e284e554,23,3636
443,53750.0,26216-D21-6,BRD-K90362969-001-08-2,26216,D21,6,SA1856679,BRD-K90362969,BROAD_CPD_ID,CC(C)(C)C(=O)Nc1ccc(NC(=O)c2ccco2)nc1,GHRFBZFIFYIEKN-UHFFFAOYSA-N,cdp2w9x2_d21_s6_w2fc44c963-5905-4849-a74f-b5df76c2a510,cdp2w9x2_d21_s6_w35d8770ca-2683-41f5-9cd7-943e0e94a7f6,cdp2w9x2_d21_s6_w184af6cd5-c851-465b-856f-8d6556a3dbc2,cdp2w9x2_d21_s6_w579f0284b-bec6-41a4-b503-49d071f9a091,cdp2w9x2_d21_s6_w4d1780f23-8f18-4deb-93ff-5b0523b4a112,107,5682
444,10841.0,25380-O16-3,BRD-K21166090-001-06-7,25380,O16,3,SA1861122,BRD-K21166090,BROAD_CPD_ID,Brc1ccc(CSc2ccc(nn2)-c2ccco2)cc1,GHTDIOSUORRDJH-UHFFFAOYSA-N,cdp2w10_o16_s3_w2ac14b447-61c9-409a-9e2d-b4f8646f57a3,cdp2w10_o16_s3_w3440a35df-5568-4f9a-8aee-325fda0e352f,cdp2w10_o16_s3_w1346bbd84-0ed6-467a-8c22-369180697b36,cdp2w10_o16_s3_w575b8f31c-6bce-4b62-b6fc-dde300e868f1,cdp2w10_o16_s3_w47907c848-d6ff-4f62-b622-77f787bd019a,52,8512
445,22217.0,25572-L18-3,BRD-K52871910-001-05-4,25572,L18,3,SA1852198,BRD-K52871910,BROAD_CPD_ID,CCOC(=O)CN(Cc1sccc1C)C(=O)Nc1cccc(OC)c1,GHYGOOADYJZDTK-UHFFFAOYSA-N,cdp2w11_l18_s3_w25a163a03-5f90-434a-9316-bfb4d8110f85,cdp2w11_l18_s3_w31454a1f2-139a-4556-a449-972e166d7163,cdp2w11_l18_s3_w13b1a8720-b001-44d2-bf5a-48c668cc8ef6,cdp2w11_l18_s3_w54e9f568d-8a45-4e30-907d-9021aea4aa6c,cdp2w11_l18_s3_w4efceb716-d890-4f53-9de2-2fd4f6997a9d,85,2556
446,16608.0,25435-J08-4,BRD-K69289993-001-05-0,25435,J08,4,SA1852683,BRD-K69289993,BROAD_CPD_ID,Oc1cc(CC(=O)NCCN2CCOCC2)nc(O)n1,GICVUYWOEGQCFG-UHFFFAOYSA-N,cdp2w10_j08_s4_w2929b4bb4-9260-4956-a286-37c24d92f7d3,cdp2w10_j08_s4_w3efb82509-65c1-4aaf-a60b-a7b978dbc0e4,cdp2w10_j08_s4_w11a972b10-af9c-4687-b305-500fce478f3e,cdp2w10_j08_s4_w54efa821b-f08a-44ae-853a-a8437c858f80,cdp2w10_j08_s4_w49c1ce546-5a5a-4aff-8a68-1a65361c0f50,70,2244
447,46204.0,26060-P05-2,BRD-K67980271-001-06-7,26060,P05,2,SA1859957,BRD-K67980271,BROAD_CPD_ID,Cc1ccc2nc(sc2c1)-c1ccc(NC(=O)CCS(=O)(=O)c2ccccc2)cc1,GIFAHHVUDCKIJC-UHFFFAOYSA-N,cdp2w9x2_p05_s2_w2b8fa47d9-fe64-4a4b-88b7-12c57eb1add7,cdp2w9x2_p05_s2_w37632eee1-1550-4404-9a90-0ba013a60c62,cdp2w9x2_p05_s2_w1a5bada6f-0cd4-4572-a8e4-6efa5aea4a13,cdp2w9x2_p05_s2_w51c48dca6-1517-4cb8-af52-1b6a92908b1d,cdp2w9x2_p05_s2_w42db862d3-6b36-4347-9bf5-af9dcc673935,25,9249
448,33162.0,25680-C19-4,BRD-K54589752-001-09-3,25680,C19,4,SA1859469,BRD-K54589752,BROAD_CPD_ID,Cc1cc(C)c2nc(cc(C(=O)N3CCN(Cc4ccccc4Cl)CC3)c2c1)-c1ccncc1,GIFWDRNCIBUXRZ-UHFFFAOYSA-N,cdp2w12_c19_s4_w282203621-d456-4b79-992d-e0060c1d58d6,cdp2w12_c19_s4_w365c77406-2707-4420-a175-c867b10ad7c7,cdp2w12_c19_s4_w16749a4a8-6132-4f7d-af9d-60212e06bc27,cdp2w12_c19_s4_w52c7adfab-3ebc-4254-a5dc-8092be52aa3b,cdp2w12_c19_s4_w441bd180f-3bc3-4018-84c7-ff197753ec72,27,4409
449,2038.0,24297-A09-5,BRD-A01320529-001-05-9,24297,A09,5,SA792580,salmeterol,INN,OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1,GIIZNNXWQWCKIB-UHFFFAOYSA-N,cdp2bioactives_a09_s5_w29eeb20c3-fe9c-497e-b843-65b10a1e01e8,cdp2bioactives_a09_s5_w3fd2cedaf-80f5-4483-8c21-b2bc265aff77,cdp2bioactives_a09_s5_w147de3bb1-c4ab-4bb5-9e9c-0e209b0fa7a6,cdp2bioactives_a09_s5_w5ef1c3b68-d26b-444f-a216-f3f217c2e477,cdp2bioactives_a09_s5_w432e6a0bf-b2c8-4ca4-b681-84cb710ca7e5,96,868
450,22603.0,25573-O14-5,BRD-K79199064-001-05-3,25573,O14,5,SA1856333,BRD-K79199064,BROAD_CPD_ID,CCOc1cc(cc2Oc3ccccc3NC(=O)c12)[N+]([O-])=O,GIJFMVRFLAXIGY-UHFFFAOYSA-N,cdp2w11_o14_s5_w2c4cd24fc-7d50-43e8-ba5b-6a3fcc867e4b,cdp2w11_o14_s5_w378a94e27-ab41-473e-beed-ed0a362ae925,cdp2w11_o14_s5_w182ad2f0e-0310-41e2-a29f-646904532bae,cdp2w11_o14_s5_w535533a87-5ec1-427c-80fb-58573ff12baa,cdp2w11_o14_s5_w47658ece7-b5e3-42ec-8c77-1210d4d7e32e,64,8017
451,49000.0,26124-M04-2,BRD-K17708248-001-05-5,26124,M04,2,SA1852332,BRD-K17708248,BROAD_CPD_ID,CCOC(=O)c1c(NC(=O)CN2CCOCC2)scc1-c1ccc(C)o1,GIKHIJAMYRIXKY-UHFFFAOYSA-N,cdp2w9x2_m04_s2_w2b771bc32-6920-4815-a741-2e7accf04f3b,cdp2w9x2_m04_s2_w3ae7c479a-c202-499f-ae95-1d33fc0ec050,cdp2w9x2_m04_s2_w1974b3a19-458f-4d5b-b4e0-9f13ac516710,cdp2w9x2_m04_s2_w51250c0ff-d6c0-4332-a48e-a0dff5afbf69,cdp2w9x2_m04_s2_w4494ae7e0-82a3-4e73-bf18-2bec6e716a04,66,5716
452,56396.0,26765-G10-6,BRD-K36313546-001-01-9,26765,G10,6,SA1017339,BRD-K36313546,BROAD_CPD_ID,COc1cccc(CNC(=O)c2cc3CN([C@H](CCO)c3c(n2)-c2cccc(c2)-c2ccncc2)[S@](=O)C(C)(C)C)c1,GIUILNXHKTVBSA-LIIBOVGXSA-N,cdp2w13_g10_s6_w25a395956-8b2b-4aff-8f0f-76adc12cbe64,cdp2w13_g10_s6_w325272ff8-c05c-4fd3-a4f8-025682ac27dc,cdp2w13_g10_s6_w11a422c91-1c64-4995-9c1b-c82f72aad977,cdp2w13_g10_s6_w5d7a0a92c-4768-4e31-a60d-c161c413a0f7,cdp2w13_g10_s6_w4cc102c44-56a2-4677-97a3-72b56d7b1c58,81,10552
453,31512.0,25674-J15-4,BRD-K65130752-001-05-1,25674,J15,4,SA1857411,BRD-K65130752,BROAD_CPD_ID,Sc1nc(nc2ccccc12)-c1ccccc1,GJELWRJKAIJFJN-UHFFFAOYSA-N,cdp2w12_j15_s4_w2b3365fd5-e94d-4f45-98f1-65fd6a6dd7d8,cdp2w12_j15_s4_w3b79f858a-66a4-450a-83d5-a9523645ea33,cdp2w12_j15_s4_w11c993c9d-0b2f-4c02-b5cd-9f633c17d45a,cdp2w12_j15_s4_w5e10382f2-44e0-4436-9f9e-2b5b11c0f1de,cdp2w12_j15_s4_w4f607a1f3-d1f1-41d3-8a63-2a5694ecae20,84,8020
454,17610.0,25485-K16-4,BRD-A77016449-001-05-9,25485,K16,4,SA1853766,BRD-A77016449,BROAD_CPD_ID,O=C(CSc1nc2ccc(cc2c(=O)n1CCc1ccccc1)N1CCOCC1)NCC1CCCO1,GJKRCJKXXVVAMV-UHFFFAOYSA-N,cdp2w10-au00024355_k16_s4_w2a81cfd60-2c60-4020-9c78-f1e3d0d65ee3,cdp2w10-au00024355_k16_s4_w3b9b9aad6-bd9e-4b9a-968d-2bb40de62494,cdp2w10-au00024355_k16_s4_w1404687b8-bc6b-4d0d-ac64-57b33d89c2ed,cdp2w10-au00024355_k16_s4_w5739ab5a7-7f9c-4eae-9f93-1f7eca1ca612,cdp2w10-au00024355_k16_s4_w4d3423226-2490-4b21-a8b4-f65f23e5a7a4,54,1553
455,10912.0,25382-F05-2,BRD-K68206619-001-05-9,25382,F05,2,SA1861412,BRD-K68206619,BROAD_CPD_ID,CCc1ccnc(NC(=O)NS(=O)(=O)c2ccc(C)cc2)c1,GJTRUSPGDTVEHA-UHFFFAOYSA-N,cdp2w10_f05_s2_w290489fab-e09f-46c3-9236-7a6525edfc65,cdp2w10_f05_s2_w3a3bf56cb-0564-4112-a10a-d6a1dffef8c7,cdp2w10_f05_s2_w1fa988766-fce1-4100-af08-01f090cd473a,cdp2w10_f05_s2_w51d6a8465-017c-426a-9131-2d77edd9c8ba,cdp2w10_f05_s2_w436760321-5df5-44b3-9a17-3d62fbff6b04,50,3444
456,34086.0,25683-M12-4,BRD-K50359549-001-05-1,25683,M12,4,SA1856525,BRD-K50359549,BROAD_CPD_ID,CCOc1ccc(c(C)c1C)S(=O)(=O)Nc1ccc(F)cc1,GJUCAVHSIPEIGQ-UHFFFAOYSA-N,cdp2w12_m12_s4_w2e71e9210-4c52-46b2-9986-13c1de22a232,cdp2w12_m12_s4_w340cc4aa7-fc60-42c6-ac2f-a1738b9275bf,cdp2w12_m12_s4_w123c1074b-9197-4e57-a401-0209b5bf58c0,cdp2w12_m12_s4_w59cf9848c-15d1-4e01-86bb-cc415ca05550,cdp2w12_m12_s4_w4199b5e07-533a-4720-892c-08da0caa1c70,54,4553
458,21366.0,25570-A07-4,BRD-K13937727-001-05-4,25570,A07,4,SA1856439,BRD-K13937727,BROAD_CPD_ID,CNC1=NN=C(CS1)c1cc(C)n(c1C)-c1ccc(Cl)cc1,GKGQQMGABWPFEZ-UHFFFAOYSA-N,cdp2w11_a07_s4_w24e1c25b5-36e0-4157-8273-ff3724d081a0,cdp2w11_a07_s4_w39c3dd780-708b-49af-a7ac-1009909688b0,cdp2w11_a07_s4_w15b3706e4-9a75-4bba-bc6e-8fe37482dffd,cdp2w11_a07_s4_w5d239cdf0-927a-493f-9303-bb027cc1aaa1,cdp2w11_a07_s4_w4ecf5d5d9-9a8b-4486-bf16-b7070a563956,65,9501
459,11761.0,25392-F13-5,BRD-A29265374-001-07-6,25392,F13,5,SA1856292,BRD-A29265374,BROAD_CPD_ID,CC(C)Oc1ccc(CNC(=O)CC(c2ccccc2)c2cc(Cl)ccc2O)cc1,GKTLATIRVIDXLX-UHFFFAOYSA-N,cdp2w10_f13_s5_w2798ab553-255b-40bd-9810-046ff2b6b916,cdp2w10_f13_s5_w30c52e945-e3b3-4423-8a30-a5a7f4b25c70,cdp2w10_f13_s5_w174b7e21c-c9f0-4e10-821b-b90c55fa76f2,cdp2w10_f13_s5_w57868b10f-2a6c-4ced-97f7-c18224a775d2,cdp2w10_f13_s5_w42f0fa1f7-6edb-45ab-8f67-3751aec5edda,50,6099
460,15299.0,25428-E10-3,BRD-K53769830-001-05-6,25428,E10,3,SA1853081,BRD-K53769830,BROAD_CPD_ID,Nc1c(cnn1-c1ccc(cc1)C(O)=O)-c1ccccc1,GMBHXFKGJRDYAD-UHFFFAOYSA-N,cdp2w10_e10_s3_w2758d97ae-504e-4df1-95de-d5f7f849455e,cdp2w10_e10_s3_w36db3ade2-5924-48c4-8807-ee55fb5cc3ff,cdp2w10_e10_s3_w12f9b06e0-1a06-4aa6-a120-742337a12341,cdp2w10_e10_s3_w5fd409d34-097f-4bd4-b014-aaccefb22a18,cdp2w10_e10_s3_w45d3d6ffb-aad8-413b-bbe4-b3db02e3addd,42,7583
461,8788.0,24685-H05-2,BRD-K93677460-001-01-9,24685,H05,2,SA1435976,BRD-K93677460,BROAD_CPD_ID,COCC(=O)Nc1ccc2OC[C@@H](C)N(C)C[C@H](C)[C@@H](CN(C)C(=O)c2c1)OC,GMHRVVGQOPSCBZ-QMTMVMCOSA-N,cdp2w3_h05_s2_w2e9c0909c-5031-4260-b938-4a9664c27cd3,cdp2w3_h05_s2_w303acaa2a-f62d-4b0b-8c44-5a7871334829,cdp2w3_h05_s2_w1158027e1-1aaa-474a-ac27-89701be82e6c,cdp2w3_h05_s2_w5a79aa299-4169-4199-afe9-2c83f040c9f9,cdp2w3_h05_s2_w46f5fa91a-1038-46a1-be61-3cfdb2378d7f,57,10143
462,35969.0,25694-M17-3,BRD-K42448167-001-06-2,25694,M17,3,SA1856553,BRD-K42448167,BROAD_CPD_ID,CCOc1ccccc1-c1nc(no1)-c1ccc(C)nc1OC,GMNZZFOHRVUORQ-UHFFFAOYSA-N,cdp2w12_m17_s3_w2760dc724-f0c9-45c2-a98e-737221ee89fc,cdp2w12_m17_s3_w3d7b38ff3-7059-4fd0-aeb1-df3bcf4d76fb,cdp2w12_m17_s3_w1ed00f1ac-36a3-496e-a0e4-afb7b37b849e,cdp2w12_m17_s3_w5cf6c3093-8f55-487d-b778-090122df91fc,cdp2w12_m17_s3_w43ddb9f2f-7317-437b-a7f0-45bc1820ee29,73,5526
463,15609.0,25430-F08-1,BRD-A51705537-001-05-0,25430,F08,1,SA1858452,BRD-A51705537,BROAD_CPD_ID,Cc1cc(C)c(N=C(S)NC(NC(=O)c2ccccc2)C(Cl)(Cl)Cl)c(C)c1,GMUWTCFDEBOQKF-UHFFFAOYSA-N,cdp2w10_f08_s1_w2c2d82300-7664-41eb-b791-b1cb4e10efea,cdp2w10_f08_s1_w35038b99f-69e2-4b3e-96d0-211210a41200,cdp2w10_f08_s1_w147ad5b53-7d89-4518-9eb9-c85668d51dc3,cdp2w10_f08_s1_w5f9c6fe07-48f8-48be-af15-33aa0c61eab4,cdp2w10_f08_s1_w4baf23704-7665-40af-b8d5-7f6d798958b9,12,7373
464,50983.0,26140-L07-5,BRD-K59975583-001-05-2,26140,L07,5,SA1860963,BRD-K59975583,BROAD_CPD_ID,Cc1cc(OC(=O)c2ccco2)c2c3CCCc3c(=O)oc2c1,GNVMAYLULBCWMI-UHFFFAOYSA-N,cdp2w9x2_l07_s5_w27bb47a63-b54f-465d-b28a-c104faae00ae,cdp2w9x2_l07_s5_w3b7c716d9-ee72-4ccf-b4bb-a324752f5917,cdp2w9x2_l07_s5_w11fed10ef-23d5-4e92-b981-8253290c1728,cdp2w9x2_l07_s5_w51a27475a-90af-4815-ad68-bab3d3c4710c,cdp2w9x2_l07_s5_w45e0a9c8f-2cb2-4b94-b30d-bd779445e3d1,62,3998
465,16639.0,25435-L04-5,BRD-K31427456-001-06-9,25435,L04,5,SA1857026,BRD-K31427456,BROAD_CPD_ID,CCn1nc(NC(=O)Cc2ccc(OC)cc2)c2cc3cc(C)ccc3nc12,GOECNYYIXGRBNW-UHFFFAOYSA-N,cdp2w10_l04_s5_w2a8f0e617-51cb-42f6-bf87-265fc0ab9bf8,cdp2w10_l04_s5_w3c53c1f31-0adb-4c62-b183-62d9df7b4630,cdp2w10_l04_s5_w111b79dbd-28e3-4b13-9c29-f488481d7d9c,cdp2w10_l04_s5_w5c0beb862-36b7-4202-a007-d574b1b7b41f,cdp2w10_l04_s5_w411b38ecc-f5cf-448a-a424-388b06e530c6,62,3221
466,14499.0,25422-K13-1,BRD-A99565171-001-05-3,25422,K13,1,SA1860809,BRD-A99565171,BROAD_CPD_ID,COc1cccc(c1)C1=NOC(C1)C(=O)NC1CCCCC1,GOKNYOHQPLPAOF-UHFFFAOYSA-N,cdp2w10_k13_s1_w235906cc0-71b1-476c-81f6-d23a5644858b,cdp2w10_k13_s1_w3291fb59f-dc67-4c8a-98b0-5157c88c5ec6,cdp2w10_k13_s1_w1b30a6646-853a-47ba-a471-fba34b7bbe04,cdp2w10_k13_s1_w511866e15-732c-4bd5-93e0-03e24227d177,cdp2w10_k13_s1_w428cdc605-cbf3-49e8-8ed5-f33a3e2c19e4,84,1616
467,45972.0,26060-C06-4,BRD-A55153871-001-05-3,26060,C06,4,SA1853232,BRD-A55153871,BROAD_CPD_ID,O=C1C(N2C(NC(=O)c3ccccc23)=C1C#N)c1ccccc1,GPJAFDRFLJPTNU-UHFFFAOYSA-N,cdp2w9x2_c06_s4_w2a7591546-ccfc-46a3-a719-3b3777fadd78,cdp2w9x2_c06_s4_w315764a74-db19-4067-8c4a-005530e72060,cdp2w9x2_c06_s4_w1c5713e17-66cb-44c2-8e60-3f27f8e12de9,cdp2w9x2_c06_s4_w567d6a4e8-bff6-4765-9bad-eeadeef7b21c,cdp2w9x2_c06_s4_w43e47deaf-0c79-4098-9728-75515df42dac,50,6626
468,21809.0,25571-H16-3,BRD-K62776744-001-06-3,25571,H16,3,SA1855936,BRD-K62776744,BROAD_CPD_ID,CCOC(=O)C1=C2NC(=O)c3ccccc3N2C(=O)C1,GPSSHZBXZDTIGY-UHFFFAOYSA-N,cdp2w11_h16_s3_w220ed52b7-32d0-4d3e-9740-aa5b484ac502,cdp2w11_h16_s3_w32348b8b8-0478-4c6f-8094-918fb43b936e,cdp2w11_h16_s3_w13606e827-bb87-459f-9580-905dcc0e7eb4,cdp2w11_h16_s3_w5aea980f4-cb34-45e3-bf08-093da6f9dd97,cdp2w11_h16_s3_w42c26fb5f-fcf0-488a-9736-1e9bb28b5e3b,59,9557
469,54056.0,26224-G07-6,BRD-K87492696-001-04-1,26224,G07,6,SA59343,sulfametoxydiazine,INN,COc1cnc(NS(=O)(=O)c2ccc(N)cc2)nc1,GPTONYMQFTZPKC-UHFFFAOYSA-N,cdp2w9x2_g07_s6_w2ce2e506a-bda7-4845-978d-2d64afbf0364,cdp2w9x2_g07_s6_w366fa8de0-b4b7-4f80-9c54-ae93c8b6c8b3,cdp2w9x2_g07_s6_w117ef6051-c1b0-49dd-ad89-f0a74d0666ed,cdp2w9x2_g07_s6_w573afebb3-4f26-46d7-93d1-c02dffec01dc,cdp2w9x2_g07_s6_w4718e3075-802d-40eb-a6a2-ff3f37d4e3b4,79,1347
470,30798.0,25665-F12-4,BRD-K68457497-001-06-3,25665,F12,4,SA1856090,BRD-K68457497,BROAD_CPD_ID,CC1=NN(C(S)=N)C(C)(C)C1,GQAFTAYUUOBTRK-UHFFFAOYSA-N,cdp2w12_f12_s4_w2a79ef502-90d4-483f-9d8e-7d2affd2d6f5,cdp2w12_f12_s4_w3825fbf01-7de0-4d17-8ae9-37f0d41b4eab,cdp2w12_f12_s4_w1d57391f6-fc78-40b5-aecd-d0307f1320a0,cdp2w12_f12_s4_w56cd2f845-9211-42ae-8fea-3499bb4100f8,cdp2w12_f12_s4_w446bdc8fe-884b-4e84-bf53-a18544a987c8,83,4740
471,38029.0,25725-F07-5,BRD-K34876632-001-05-3,25725,F07,5,SA1861509,BRD-K34876632,BROAD_CPD_ID,Brc1ccc(cc1)-c1csc(n1)-c1c[nH]c2ccccc12,GQVATYVJIBWCMZ-UHFFFAOYSA-N,cdp2w12_f07_s5_w2dc0e4925-893a-4678-815e-f0e87ac846cc,cdp2w12_f07_s5_w3950404b6-26fa-4f8a-ba5c-037ad132d5b5,cdp2w12_f07_s5_w1692a46dc-c0c7-43d2-9c74-f1a03c6aa882,cdp2w12_f07_s5_w5a5f7c62b-ce6c-4624-9d13-424475b1bcf6,cdp2w12_f07_s5_w4bae86a11-86bc-469f-bf7c-a2d86fb80e1a,51,3548
472,22393.0,25573-D21-5,BRD-K82554441-001-05-8,25573,D21,5,SA1859007,BRD-K82554441,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)C(=O)NCCc1ccc(F)cc1,GQZVPMBSRUIIJV-UHFFFAOYSA-N,cdp2w11_d21_s5_w207598019-232c-4aa9-a982-2295ee7dcec0,cdp2w11_d21_s5_w3b88d9669-5e6d-4318-985d-9e87ad0b1887,cdp2w11_d21_s5_w18f6e631e-de6f-4d2b-a495-74548ce5ca8a,cdp2w11_d21_s5_w5421a8948-9fe7-4e60-a163-90e1cf848418,cdp2w11_d21_s5_w474a1fc34-aade-4a6e-8608-37cddc2c3901,74,7380
473,9612.0,24759-I04-4,BRD-K86937728-001-01-4,24759,I04,4,SA1437112,BRD-K86937728,BROAD_CPD_ID,CO[C@H]1CN(C)C(=O)c2cc(NS(=O)(=O)c3ccccc3)ccc2OC[C@@H](C)N(Cc2ccccn2)C[C@@H]1C,GRFOSLOREGQSPJ-TYPXCFOJSA-N,cdp2w5_i04_s4_w2e25f6b0c-759f-495a-b40e-fa790a2f968c,cdp2w5_i04_s4_w3a4d1ef12-5311-464d-860a-4b9325ddec1a,cdp2w5_i04_s4_w10d78cf2f-219e-411e-acba-8d4d081473d9,cdp2w5_i04_s4_w5cf54a801-3bfb-4ffd-adbd-0f87bb5f3ecf,cdp2w5_i04_s4_w48bdcd947-bfbf-44cc-9982-039f2275d3d2,56,10381
474,51139.0,26159-G09-5,BRD-K47631316-001-06-8,26159,G09,5,SA1859662,BRD-K47631316,BROAD_CPD_ID,COc1ccc2nc(NC(=O)c3cccc(c3)S(=O)(=O)N3CCOCC3)sc2c1,GRPFFRUWJFDTTI-UHFFFAOYSA-N,cdp2w9x2-au00026617_g09_s5_w2c2fd1b3d-ffe4-4dc2-b3bc-6fa480178f7b,cdp2w9x2-au00026617_g09_s5_w36376c012-39a4-4254-a599-e5fa320b44ed,cdp2w9x2-au00026617_g09_s5_w1fab9662a-a194-4fe8-999b-1bd1c740bed1,cdp2w9x2-au00026617_g09_s5_w573f95aba-d0e7-4d59-be5d-eb7fd63fb75c,cdp2w9x2-au00026617_g09_s5_w4b7a5ff4e-3615-4279-aade-29569b1ec39c,65,7876
475,49388.0,26126-N09-6,BRD-K98073502-001-06-5,26126,N09,6,SA1852170,BRD-K98073502,BROAD_CPD_ID,CCC(=O)N(C)\C=C1/Sc2ccccc2C1=O,GRUBXNOZRDXRIR-FLIBITNWSA-N,cdp2w9x2_n09_s6_w293443fe5-fa08-468c-8044-851d07db8f61,cdp2w9x2_n09_s6_w3f62491d5-36d9-456f-9d27-07befe23c697,cdp2w9x2_n09_s6_w154d72494-012a-4a54-ba5a-e92cb04f3185,cdp2w9x2_n09_s6_w5776b00fa-862a-47dd-9346-bae1695de7b1,cdp2w9x2_n09_s6_w416a1b116-69ca-42d6-98a0-671290c2f610,80,3928
476,9676.0,25372-D10-2,BRD-K69838300-001-05-2,25372,D10,2,SA1860531,BRD-K69838300,BROAD_CPD_ID,FC(F)(F)c1cc(nc2cc(nn12)C(=O)NCc1ccco1)-c1ccc2OCOc2c1,GRVOHZQLIZJKLW-UHFFFAOYSA-N,cdp2w10_d10_s2_w29a31f539-5103-48f7-bd63-ac89bb66d130,cdp2w10_d10_s2_w31fe77db4-b699-4080-b619-d6c98096dc08,cdp2w10_d10_s2_w14560af76-f37f-4ebe-bc87-bdd89f1c9d3b,cdp2w10_d10_s2_w5b306412d-162b-425e-8d9f-5b3cb474dc4a,cdp2w10_d10_s2_w4222cdf40-6293-4d12-aee6-e719c5ae2b41,70,7329
477,49599.0,26128-J14-1,BRD-K15343767-001-06-2,26128,J14,1,SA1856718,BRD-K15343767,BROAD_CPD_ID,Oc1ccc(NC(=O)C(=C/c2ccc3OCOc3c2)\C#N)cc1,GRVPLNXGNWRXNH-GHXNOFRVSA-N,cdp2w9x2_j14_s1_w212222b3b-8baf-4a36-b025-ecc732306dfe,cdp2w9x2_j14_s1_w3289767c5-ccb4-40ca-84cd-cf6efd2e6080,cdp2w9x2_j14_s1_w17e852187-2265-4b59-a27f-7dc57be5b7c5,cdp2w9x2_j14_s1_w58f0b904b-79a3-4ef0-b97c-24bbea7c8396,cdp2w9x2_j14_s1_w4d7375c46-1685-487b-b8ea-ed242ebdc16e,33,3081
478,21333.0,25569-O09-1,BRD-K89517490-001-05-8,25569,O09,1,SA1857069,BRD-K89517490,BROAD_CPD_ID,CCn1cc(C(O)=O)c(=O)c2cc(F)c(cc12)N1CCN(CC1)C(=S)NC(=O)c1ccc(Br)cc1,GSFVYQNRFITLTB-UHFFFAOYSA-N,cdp2w11_o09_s1_w22a4075eb-9b20-452d-b50a-97028d459f7e,cdp2w11_o09_s1_w3b1afee68-c434-4edd-8a61-cf6142cae9d6,cdp2w11_o09_s1_w1abb28c8f-6953-418b-8434-1e1bff2fb52c,cdp2w11_o09_s1_w5102b4328-c2c4-4128-8ba5-60853c3021ef,cdp2w11_o09_s1_w4b75c9d76-48fb-449b-aac8-d6c28452052b,89,6068
479,8843.0,24726-F11-3,BRD-K62980388-001-02-1,24726,F11,3,SA666970,BRD-K62980388,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(C)c2)OCc2cnnn2CCCC1=O,GSLUEEWCAUTOBV-XQBPLPMBSA-N,cdp2w5_f11_s3_w2b71e60d9-8196-4082-9cb3-9566324c00c2,cdp2w5_f11_s3_w356e4af98-c2dc-49a7-b9a5-8ac03b26ee51,cdp2w5_f11_s3_w157498115-3db1-44b2-ad82-3d9e61c7c5b1,cdp2w5_f11_s3_w5bc5e0054-b362-45d1-a639-ec0810c48383,cdp2w5_f11_s3_w48d42bb6f-d251-4a20-a3ac-23266192e2b5,46,9726
480,48039.0,26115-A13-1,BRD-K00882769-001-05-6,26115,A13,1,SA1855595,BRD-K00882769,BROAD_CPD_ID,Clc1ccc(\C=C\C(=O)c2cccnc2)c(Cl)c1,GSUZIMIJGDPDAB-GQCTYLIASA-N,cdp2w9x2_a13_s1_w222647c05-64f2-4ff6-8d31-934ec8accf62,cdp2w9x2_a13_s1_w372b7518b-3ed1-43e0-81b6-f57403a3ccc9,cdp2w9x2_a13_s1_w11846f497-b00e-4ebc-8878-c4d87bbb2b8d,cdp2w9x2_a13_s1_w59a00abbc-8951-4bea-b1ee-4555b1dbe8ca,cdp2w9x2_a13_s1_w413ed9f58-089a-4ee8-b193-a03901072496,0,3452
481,35789.0,25694-E11-3,BRD-K86963651-001-05-2,25694,E11,3,SA1861411,BRD-K86963651,BROAD_CPD_ID,CN1c2ccccc2C(C)(C)\C1=C\C(=O)c1oc2ccccc2c1N,GTGGBHFTZAOINR-PDGQHHTCSA-N,cdp2w12_e11_s3_w263d41176-f612-4b3a-ab20-dfa5a6db65c5,cdp2w12_e11_s3_w320a8dbd8-2ccd-47cb-a673-625d60eee8f3,cdp2w12_e11_s3_w1209507a9-27ee-4e0c-b1fa-8c89e730a752,cdp2w12_e11_s3_w5787d2d79-6915-4184-af57-54dd91420449,cdp2w12_e11_s3_w42c43f878-9500-423b-9298-998a02fdfb9b,76,3940
482,34585.0,25688-C17-5,BRD-K01583113-001-05-2,25688,C17,5,SA1852234,BRD-K01583113,BROAD_CPD_ID,CC1(C)Cc2c(CO1)sc1n(CC(=O)Nc3ccc(Cl)cc3)c(=O)n(Cc3ccco3)c(=N)c21,GTMNRQVYUQDJKF-UHFFFAOYSA-N,cdp2w12_c17_s5_w267cef526-4d63-4d6f-a80e-5e51fd4b1ae9,cdp2w12_c17_s5_w3b25b7d36-4d99-4e02-ba68-8511b0413c7c,cdp2w12_c17_s5_w1f2377c16-b3fa-42e4-8f77-12b3aa42add9,cdp2w12_c17_s5_w569128141-8565-44cc-8aa5-b475e54b15a1,cdp2w12_c17_s5_w4b42edd01-7ced-4786-a2f4-a589bd66c215,78,2906
483,50014.0,26133-O17-2,BRD-K94476572-001-05-1,26133,O17,2,SA1859074,BRD-K94476572,BROAD_CPD_ID,CSc1n[nH]c(n1)-c1ccc(cc1)C(F)(F)F,GTRWSTBFARSWCZ-UHFFFAOYSA-N,cdp2w9x2_o17_s2_w27992c62a-6fa6-4ece-94f3-81449b422d95,cdp2w9x2_o17_s2_w363746cdf-413c-48ab-8175-8126a7325900,cdp2w9x2_o17_s2_w1e547a396-5dff-43c8-804a-5e5c4cd93890,cdp2w9x2_o17_s2_w53edae2ec-8450-4fa5-a7a9-207483c6624b,cdp2w9x2_o17_s2_w489eb18d3-23f6-44b3-a729-ea218761dbe6,50,5628
484,47599.0,26107-J19-5,BRD-K04443775-001-05-5,26107,J19,5,SA1862145,BRD-K04443775,BROAD_CPD_ID,CCS(=O)(=O)N1CCC(CC1)C(=O)NCCCN1CCCCCC1,GTUGDLCELKWUBX-UHFFFAOYSA-N,cdp2w9x2_j19_s5_w2ab5eaebc-5654-42d1-80b0-6ee3e2fb2009,cdp2w9x2_j19_s5_w3a4b6d28d-5327-4ad0-bae6-db65176f48f7,cdp2w9x2_j19_s5_w19a4312f8-db66-4e3e-b5ec-ecad556ed762,cdp2w9x2_j19_s5_w504cf074e-c343-4b93-a665-7891468423f6,cdp2w9x2_j19_s5_w4c3c419b6-9e55-40a2-9f5e-71599487aca5,70,7265
485,54758.0,26247-D08-6,BRD-K82731415-001-04-7,26247,D08,6,SA82306,olomoucine,common,Cn1cnc2c(NCc3ccccc3)nc(NCCO)nc12,GTVPOLSIJWJJNY-UHFFFAOYSA-N,cdp2w9x2_d08_s6_w27f6011d9-72be-4820-8e0d-abfb7f5e2f05,cdp2w9x2_d08_s6_w347536085-f76b-4e66-9f58-a2dc04ea15a2,cdp2w9x2_d08_s6_w1f87cb0f4-f789-4a2f-8fa6-20687356093a,cdp2w9x2_d08_s6_w5682b7452-2304-4312-b104-ed9cdb47a90d,cdp2w9x2_d08_s6_w4d63afead-4e37-4a9b-8872-423eda4250a7,49,199
486,49100.0,26126-A05-6,BRD-K31520182-001-05-4,26126,A05,6,SA1855729,BRD-K31520182,BROAD_CPD_ID,Brc1ccc2[nH]cc(\C=C3/SC(=O)N(CC(=O)N4CCCC4)C3=O)c2c1,GUBVZTSCOCHZJU-CHHVJCJISA-N,cdp2w9x2_a05_s6_w29d24841c-e9de-4a8d-852c-27edaef457f6,cdp2w9x2_a05_s6_w3650b676a-e5cd-4572-907e-e27c4fd8f675,cdp2w9x2_a05_s6_w1d0b110bd-0278-40e8-8ece-06c0bed26416,cdp2w9x2_a05_s6_w57d0f3c99-12a4-4159-84e0-cc074a3586e4,cdp2w9x2_a05_s6_w4b3e40f9f-7c45-46a9-a8cd-31235580aaa5,48,4984
487,53934.0,26216-M09-4,BRD-K56911865-001-05-9,26216,M09,4,SA1861865,BRD-K56911865,BROAD_CPD_ID,COc1cccc(c1)C(=O)NC(=S)Nc1ccc2oc(=O)ccc2c1,GUHOUQQXGYIIHZ-UHFFFAOYSA-N,cdp2w9x2_m09_s4_w2461c0ce9-315b-4d04-9fde-388a1922b81d,cdp2w9x2_m09_s4_w39fc77e78-7cd0-463b-84d8-2b3468a04229,cdp2w9x2_m09_s4_w166856619-d5d3-438c-a7af-8cd1044619b4,cdp2w9x2_m09_s4_w553eb08d4-9127-442a-accf-acd10406656c,cdp2w9x2_m09_s4_w4627beebc-f59d-4f22-9715-151e06cb669d,95,8717
488,41233.0,25965-B05-5,BRD-K00662280-001-01-1,25965,B05,5,SA82562,"CL-218,872",primary-common,Cc1nnc2ccc(nn12)-c1cccc(c1)C(F)(F)F,GUOQUXNJZHGPQF-UHFFFAOYSA-N,cdp2w8x2_b05_s5_w271e525a8-6f8f-40bb-b256-cbaf7bb499aa,cdp2w8x2_b05_s5_w309e194c6-d9ae-407c-abf2-fc4730efe2e5,cdp2w8x2_b05_s5_w14a87b342-d8fb-4c10-b73e-95b35e760dac,cdp2w8x2_b05_s5_w5172fcd63-838f-4430-90d9-2ebe6adf6e00,cdp2w8x2_b05_s5_w4c8a7e4a1-173f-4cbe-9a1e-2b2217c738b4,28,192
489,25600.0,25587-F19-2,BRD-A50048201-001-05-1,25587,F19,2,SA1858368,BRD-A50048201,BROAD_CPD_ID,CCOC(=O)C1=C(OC(N)=C(C#N)C1c1ccc(Cl)s1)c1ccccc1,GUPQZTILNQCEQJ-UHFFFAOYSA-N,cdp2w11_f19_s2_w2082d2aa7-68d2-4c4c-8412-966731122f39,cdp2w11_f19_s2_w3bdc97526-8d25-4492-9066-2e8267f2f4dc,cdp2w11_f19_s2_w1c325ba94-3f8a-482d-8e50-bcbf8085b454,cdp2w11_f19_s2_w5b0d235b1-cbef-4be2-a442-1a6986fe63e7,cdp2w11_f19_s2_w48aca5028-bad0-495c-ab1e-486bf9b7cf35,60,3622
490,10630.0,25380-B21-2,BRD-K82035305-001-05-3,25380,B21,2,SA1852400,BRD-K82035305,BROAD_CPD_ID,COCCCNC(=O)CSc1c2CCCCc2nc2ccc(Cl)cc12,GUQKTNXMYXOIIZ-UHFFFAOYSA-N,cdp2w10_b21_s2_w22099a73a-d812-4240-98c0-1fc1ca58e503,cdp2w10_b21_s2_w39c4acb9a-2234-4f29-9af7-2c47d4c36da0,cdp2w10_b21_s2_w11334e3a4-d9bc-4fd0-8fe7-90c1171ba030,cdp2w10_b21_s2_w56df319a1-dbb6-46fa-8bd1-82c951d5bbfe,cdp2w10_b21_s2_w4975c11fa-9eaa-4ba3-bb1d-439f1aff8616,7,5273
491,13836.0,25418-E13-4,BRD-K30316653-001-05-8,25418,E13,4,SA1854060,BRD-K30316653,BROAD_CPD_ID,COc1ccc2-c3nc(NC(=O)c4ccco4)sc3CCc2c1,GVOMJEIYRXTYCN-UHFFFAOYSA-N,cdp2w10_e13_s4_w233bfd5ba-1dcb-4760-804b-d5d0f37db9f5,cdp2w10_e13_s4_w3bb7ddc77-a0d3-4e33-bf96-fad89ff73e60,cdp2w10_e13_s4_w190161e45-537c-4fe8-9ae7-16f08da29365,cdp2w10_e13_s4_w5bc4cb361-6890-4e58-bab8-758342e8b597,cdp2w10_e13_s4_w476b19c51-5761-45db-ad92-96e9255356fb,58,6125
492,16679.0,25435-M05-3,BRD-K36814366-001-05-4,25435,M05,3,SA1853995,BRD-K36814366,BROAD_CPD_ID,CCOC(=O)c1oc2nc3CC(C)(C)OCc3cc2c1N,GVONFQICPIJSDU-UHFFFAOYSA-N,cdp2w10_m05_s3_w2682f79fa-361f-4947-a2ce-1ac23437bedd,cdp2w10_m05_s3_w3d99f1379-031c-4b72-8c99-2839498bda9a,cdp2w10_m05_s3_w1e04c5372-196f-49c2-95ce-60d3262b81c3,cdp2w10_m05_s3_w530e8b9c7-e1f3-4fa3-8aba-6da5a2229636,cdp2w10_m05_s3_w46c754cf2-4cf8-4aa5-a5aa-beff4ddb1e11,58,8541
493,48139.0,26115-E15-5,BRD-K52186758-001-05-2,26115,E15,5,SA1853503,BRD-K52186758,BROAD_CPD_ID,CN(Cc1ccccc1)C(=O)COC(=O)\C=C\c1ccco1,GVQCLYXAXQEALH-MDZDMXLPSA-N,cdp2w9x2_e15_s5_w2d0fb21e8-468f-4af4-a3a5-7964b5943ed0,cdp2w9x2_e15_s5_w3f3ae8e9d-a722-4004-9a4f-e8caec009c9d,cdp2w9x2_e15_s5_w11827f92a-a802-4724-aa94-0ca35b48bf09,cdp2w9x2_e15_s5_w540587977-e379-4985-ab5b-757afe49f7b9,cdp2w9x2_e15_s5_w4349e543e-ba1f-4064-9f71-143296a8bd9b,68,7858
494,45276.0,25991-O21-4,BRD-K76845197-001-01-3,25991,O21,4,SA59635,sulfanitran,INN,CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)[N+]([O-])=O,GWBPFRGXNGPPMF-UHFFFAOYSA-N,cdp2w8x2_o21_s4_w2164f2eaf-f62c-46cd-b97c-30887ff9464f,cdp2w8x2_o21_s4_w315bb2ff7-4183-4b8e-8947-516d49c9a1e4,cdp2w8x2_o21_s4_w1b55a5cf8-c815-4a4c-9157-380afb57e84a,cdp2w8x2_o21_s4_w511d9292d-e4ab-4689-adad-5cb1d3f0e6ab,cdp2w8x2_o21_s4_w412a8ac8b-cb98-4606-92f2-3388bb56d7d1,32,1202
495,18692.0,25492-M19-6,BRD-A09645129-001-05-5,25492,M19,6,SA1860115,BRD-A09645129,BROAD_CPD_ID,Cn1c2NC3(Nc2c(=O)n(C)c1=O)C(=O)Nc1ccccc31,GWLRDSXEAJOUHI-UHFFFAOYSA-N,cdp2w10-au00024360_m19_s6_w2108c9c52-4d48-4708-a23b-66241586eb09,cdp2w10-au00024360_m19_s6_w30538824a-c7ab-4ae7-9a0a-361d17cae26c,cdp2w10-au00024360_m19_s6_w17c1dcb62-ee06-41c8-bb4a-14f30e830db0,cdp2w10-au00024360_m19_s6_w5f623c2b6-7df7-40ab-b593-c5474c31a122,cdp2w10-au00024360_m19_s6_w45407ee0b-aa81-492c-a9c8-c97f680da39c,63,7324
496,56464.0,26785-B24-2,BRD-K75012089-001-03-8,26785,B24,2,SA1323635,BRD-K75012089,BROAD_CPD_ID,CCOC(=O)c1cc2CN([C@H](CCO)c2c(n1)-c1cccc(c1)C#CCN(C)C)S(=O)C(C)(C)C,GWVPGXSETGAAGJ-MMHRDOBHSA-N,cdp2w13_b24_s2_w26becdca9-8a01-44fe-a0eb-6fb707529d58,cdp2w13_b24_s2_w3057c0904-6bff-4acf-af0b-ae4490624aac,cdp2w13_b24_s2_w12a2813e4-96c5-454b-bd78-158e1437fcf0,cdp2w13_b24_s2_w5a0d5f0a8-53b0-41c8-90c3-34559dbb15e1,cdp2w13_b24_s2_w49adca37c-c159-40dd-b8b1-4dfcdda31aa1,24,10333
497,43384.0,25984-N18-2,BRD-K37249724-001-04-2,25984,N18,2,SA58952,astemizole,INN,COc1ccc(CCN2CCC(CC2)Nc2nc3ccccc3n2Cc2ccc(F)cc2)cc1,GXDALQBWZGODGZ-UHFFFAOYSA-N,cdp2w8x2_n18_s2_w2af47f93e-984b-49ed-af1c-274b0aaf4333,cdp2w8x2_n18_s2_w312ccf9e0-c13e-48bd-a2b7-14cf9b43bcdd,cdp2w8x2_n18_s2_w141a2dbdf-6f36-4d18-8f03-f6a2ca8d07fa,cdp2w8x2_n18_s2_w5335cb7ff-a9ac-4dbf-99a3-526ae2dfa359,cdp2w8x2_n18_s2_w48ab5eb0c-7927-4c62-80bc-0c60c1290ab5,43,495
498,50682.0,26138-P06-4,BRD-K81124412-001-06-4,26138,P06,4,SA1855949,BRD-K81124412,BROAD_CPD_ID,COc1ccccc1-n1cc(cn1)[C@@H]1C[C@H]2CN(C(=O)[C@]22CCCN12)c1ccccc1,GXTDMBWAWOCPGD-JTJYXVOQSA-N,cdp2w9x2_p06_s4_w26d1d0758-4462-435b-a146-5f0edc422061,cdp2w9x2_p06_s4_w31684e184-f3a2-420d-aaac-2993079afb40,cdp2w9x2_p06_s4_w17a218272-9bea-4807-9ce0-e1c5b47f0b75,cdp2w9x2_p06_s4_w5616fd2fe-9a4f-4340-8497-6efe43d4910a,cdp2w9x2_p06_s4_w480628873-a4da-4205-86d4-3c200a97c476,33,7003
499,16058.0,25432-N06-6,BRD-A86322787-001-06-8,25432,N06,6,SA1860747,BRD-A86322787,BROAD_CPD_ID,CCCC1OC23CCCCC2C(C#N)(C#N)C1(C#N)C(=N)O3,GXTWAXDCKTXFAL-UHFFFAOYSA-N,cdp2w10_n06_s6_w270425b6a-7ad4-4a6b-9556-79f4ad97fb8d,cdp2w10_n06_s6_w3073f8c41-d0a6-4464-8d6e-a226bc58d4b8,cdp2w10_n06_s6_w18500acfd-53e8-4c36-818a-ebd5ab0a80f2,cdp2w10_n06_s6_w5ad8204df-bc28-4417-922d-e6e61b7da98b,cdp2w10_n06_s6_w43195087f-1215-4c2a-9ad2-8e63ac945104,43,6661
500,36887.0,25704-P07-3,BRD-A47636648-001-05-0,25704,P07,3,SA1857996,BRD-A47636648,BROAD_CPD_ID,COc1ccccc1NC(=O)C(Sc1ccccc1)c1ccccc1,GYICFNXDEQEEFQ-UHFFFAOYSA-N,cdp2w12_p07_s3_w260fa97f5-6f7e-435e-87bc-7cc899b01569,cdp2w12_p07_s3_w3cb5e65ae-6eef-4aa6-ae50-805bbb1a29dc,cdp2w12_p07_s3_w1b7d771b0-e771-44a5-a5f1-c2b004c6ed17,cdp2w12_p07_s3_w5601998c6-5fec-4cef-8ce9-34f6556de851,cdp2w12_p07_s3_w407e387c9-b633-46c3-b2cf-0624cb77026d,49,5811
501,23337.0,25578-F19-1,BRD-K49134164-001-05-6,25578,F19,1,SA1858094,BRD-K49134164,BROAD_CPD_ID,Fc1ccc(CN2C(=O)NC(=O)\C(=C/c3cccs3)C2=O)cc1,GYIGZACWAPWURC-MDWZMJQESA-N,cdp2w11_f19_s1_w205857460-2376-4b8a-99ea-ad3f10573ec1,cdp2w11_f19_s1_w35193809b-4e7a-4c6b-b622-d02679d590ce,cdp2w11_f19_s1_w1a2b42232-8cad-45a2-9f7a-b9c31cbabede,cdp2w11_f19_s1_w5803b6659-5682-4012-bdb8-bbd7c2a083d2,cdp2w11_f19_s1_w4df47e7f4-4dc4-49e3-9c2e-6f5cea57d013,70,2651
502,27755.0,25598-N03-3,BRD-K11342801-001-06-6,25598,N03,3,SA1852081,BRD-K11342801,BROAD_CPD_ID,O=C(Nc1ccc(cc1)N1CCCC1)c1ccc2ccccc2c1,GYSRXOOQGROMHA-UHFFFAOYSA-N,cdp2w11_n03_s3_w20dc97ad5-718e-4b52-b7db-0e8c0f42f309,cdp2w11_n03_s3_w37d8fe68f-f153-41de-9ec7-8d7e5d49b9a6,cdp2w11_n03_s3_w12ae3896d-770a-4eab-8917-7e0a711f9dee,cdp2w11_n03_s3_w55bb77eb5-c113-406f-8820-3235c32e4c3f,cdp2w11_n03_s3_w47947cdca-d244-4065-9d2e-e457cc07edde,72,4020
503,24510.0,25583-A17-4,BRD-K32364382-001-05-4,25583,A17,4,SA1861365,BRD-K32364382,BROAD_CPD_ID,Clc1ccc(OCCCC(=O)N2CCCCC2)cc1,GZCZNGWMCRHVAA-UHFFFAOYSA-N,cdp2w11_a17_s4_w2f7678b90-e0f2-46a5-85db-6707ea627d33,cdp2w11_a17_s4_w338f31eed-f5f4-4373-a9f8-5a7136d9baf0,cdp2w11_a17_s4_w122f5fa3d-f459-4327-be84-b9a7a75d0a0d,cdp2w11_a17_s4_w52dd63e62-e3a2-4b64-bb81-0c1cbec1a1b0,cdp2w11_a17_s4_w41bf6bb42-0d99-4a28-b6cf-30780d4082c2,60,2656
504,19317.0,25553-K18-1,BRD-K28295277-001-06-2,25553,K18,1,SA1861386,BRD-K28295277,BROAD_CPD_ID,Cn1nc(c2cc(NC(=O)OCc3ccc(F)cc3)sc12)C(F)(F)F,GZHBVHDXEFDKJL-UHFFFAOYSA-N,cdp2w11-au00029679_k18_s1_w297b0bd13-1f95-431b-a946-b2475525d10c,cdp2w11-au00029679_k18_s1_w38a581a4f-2667-4191-a0f3-addabce6ef01,cdp2w11-au00029679_k18_s1_w10cfd6c37-6075-4e06-b7e1-ea64156cb5a3,cdp2w11-au00029679_k18_s1_w5f1fead89-6b49-458b-aa68-6000e5b14375,cdp2w11-au00029679_k18_s1_w48da221aa-3a74-47b5-b9b1-c14d754fb64e,72,8837
505,28162.0,25599-P19-2,BRD-K05471809-001-06-3,25599,P19,2,SA1860158,BRD-K05471809,BROAD_CPD_ID,Cc1nn(c(C)c1CCC(=O)Nc1cccc(F)c1)-c1ccc(nn1)N1CCCCC1,HAIPZRHDHJTYCR-UHFFFAOYSA-N,cdp2w11_p19_s2_w234d8a57f-ace3-4cfd-90f8-24a557962af6,cdp2w11_p19_s2_w3d03f2d31-f04c-4674-bdd1-434da72d0a3d,cdp2w11_p19_s2_w15f47992e-40d7-4d75-82e4-2a8c46213dc0,cdp2w11_p19_s2_w5a31434f3-a074-4465-9977-ad736b77f6aa,cdp2w11_p19_s2_w40f8294ae-0295-4657-8337-0e70d5a18d7a,54,4561
506,8704.0,24661-O08-2,BRD-K69441986-001-01-5,24661,O08,2,SA1440338,BRD-K69441986,BROAD_CPD_ID,CO[C@H]1CN(C)C(=O)c2ccc(NC(=O)c3ccc(cc3)-c3ccccc3)cc2OC[C@H](C)NC[C@H]1C,HAJBOXZNCGYLAF-GGJMMHKRSA-N,cdp2w3_o08_s2_w24fd15cca-8762-485e-a77f-a5057951399f,cdp2w3_o08_s2_w3dd6f2671-b54a-47ae-a000-73e5e8dae057,cdp2w3_o08_s2_w196e94598-d673-43dd-947c-4947ad75bc2c,cdp2w3_o08_s2_w5e2d2c026-83fa-410f-bdf5-f126dc0c1798,cdp2w3_o08_s2_w4c380706d-1616-49ec-9ed8-891bf8cb8c4c,26,10257
507,18216.0,25490-F11-4,BRD-K63190417-001-06-2,25490,F11,4,SA1860561,BRD-K63190417,BROAD_CPD_ID,COc1ccc(cc1Br)C(=O)NC(=S)NC(C)(C)C,HAKCQNFJULULCS-UHFFFAOYSA-N,cdp2w10-au00024359_f11_s4_w2f11f2c50-0875-455d-a0d2-2cecaaf01c06,cdp2w10-au00024359_f11_s4_w38c1b343c-f568-4e34-9626-8e22d74b6d74,cdp2w10-au00024359_f11_s4_w1da2eb91c-fc14-4cf0-bfa1-8e2dd50efe45,cdp2w10-au00024359_f11_s4_w59be7ef5a-3f52-4d97-82e8-e7af1cf22500,cdp2w10-au00024359_f11_s4_w4c879f477-61ed-4417-9409-4b594ad5e87a,63,5551
508,35922.0,25694-L14-4,BRD-A23259903-001-05-9,25694,L14,4,SA1862266,BRD-A23259903,BROAD_CPD_ID,CCOC(=O)C(C1N=C(N)N=C2Oc3ccccc3N12)C(=O)OCC,HAVTXXLROYGERX-UHFFFAOYSA-N,cdp2w12_l14_s4_w285f3dc62-a84b-4b50-861c-253a6a93fc20,cdp2w12_l14_s4_w3467f9fe1-b4c9-4c08-944c-f07d76f01edf,cdp2w12_l14_s4_w1b91be306-5bd1-4da5-bb48-aab4dbfead9f,cdp2w12_l14_s4_w5cacf72c7-adc2-4d2d-91d4-5e986832d647,cdp2w12_l14_s4_w40607c10e-72dd-4fde-a23a-cf9c3a2904a6,67,5201
509,19519.0,25564-D12-5,BRD-K86307212-001-05-4,25564,D12,5,SA1853759,BRD-K86307212,BROAD_CPD_ID,CCn1c(CSc2nc3ccccc3n2C)nc2ccccc12,HBEOXHJIXRVGHQ-UHFFFAOYSA-N,cdp2w11_d12_s5_w228fa027f-8514-4728-900e-76abec862b3d,cdp2w11_d12_s5_w3e2d02d2f-48f5-49ab-b5ba-08f11251f1e9,cdp2w11_d12_s5_w110bb884e-b7fc-4eb5-a79a-fe660fd7b323,cdp2w11_d12_s5_w5dc85caa7-7002-48dc-b9cc-136aafc0dce0,cdp2w11_d12_s5_w4bf777d0a-f067-4b62-b0e1-e779835e78b3,71,6085
510,51158.0,26159-H06-6,BRD-K27221973-001-06-6,26159,H06,6,SA1855360,BRD-K27221973,BROAD_CPD_ID,COc1cc(\C=C\C(=O)OCC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)ccc1O,HBRNOSWZLULCKS-NTUHNPAUSA-N,cdp2w9x2-au00026617_h06_s6_w2b18a0140-0b09-4ec3-8e5e-e7f800646967,cdp2w9x2-au00026617_h06_s6_w3b08d77db-d30b-4239-b16e-d4ba1667f462,cdp2w9x2-au00026617_h06_s6_w1795463c8-8e60-4b23-9b73-bba0f36cdd01,cdp2w9x2-au00026617_h06_s6_w5de4d6d67-ef8f-4c52-9db3-d1bb51ae4ffc,cdp2w9x2-au00026617_h06_s6_w4d2a6ebb5-7da3-4313-9625-fb15c25cbe59,81,3114
511,37328.0,25708-C04-6,BRD-K64738596-001-05-2,25708,C04,6,SA1857435,BRD-K64738596,BROAD_CPD_ID,[O-][N+](=O)c1ccc2c(Cl)c(sc2c1)C(=O)NCCCN1CCOCC1,HCFCGILXICFWLF-UHFFFAOYSA-N,cdp2w12_c04_s6_w245ed3a16-e54b-44fb-9695-c8b56f7bd145,cdp2w12_c04_s6_w3e96b13f7-8f5f-4fdd-97cd-64f8ead3f661,cdp2w12_c04_s6_w1a5f86064-6e20-45b0-b60e-1783f8e9ec8c,cdp2w12_c04_s6_w52f656d3e-66b2-41f1-b45b-5bd4d1a56ca2,cdp2w12_c04_s6_w461cb5fb8-35bd-4672-8bde-bb225f4ff761,29,4771
512,1629.0,24295-P19-4,BRD-A44008656-036-04-3,24295,P19,4,SA58289,doxylamine,INN,CN(C)CCOC(C)(c1ccccc1)c1ccccn1,HCFDWZZGGLSKEP-UHFFFAOYSA-N,cdp2bioactives_p19_s4_w2e74f9b31-c964-43eb-ba3c-a6abe85531ab,cdp2bioactives_p19_s4_w3c0baadae-d234-4c01-9429-fd99242ad605,cdp2bioactives_p19_s4_w1963a38ad-7dd1-4ecf-87f7-cfc6270d00f2,cdp2bioactives_p19_s4_w559f9a8d3-866f-44ff-8e9a-7f9ffc2b5e72,cdp2bioactives_p19_s4_w4193a89a9-d4af-404e-b5d4-46c47639b185,66,641
513,6585.0,24321-N03-4,BRD-K74913225-001-03-3,24321,N03,4,SA83583,brinzolamide,INN,CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(cc12)S(N)(=O)=O,HCRKCZRJWPKOAR-JTQLQIEISA-N,cdp2bioactives_n03_s4_w216c7372b-9514-4462-bc77-9a64cbdacda7,cdp2bioactives_n03_s4_w32476a88a-266d-4f9b-93f5-57d52c475ff2,cdp2bioactives_n03_s4_w160718b26-c99d-4f82-a06c-849dc84fb44b,cdp2bioactives_n03_s4_w57cb85dd2-98b1-416c-8e5b-cdb19eaf5915,cdp2bioactives_n03_s4_w4cb23b58f-996b-4502-ac51-af3b36423359,134,1005
514,9525.0,24753-K02-1,BRD-K07009788-001-01-5,24753,K02,1,SA1439795,BRD-K07009788,BROAD_CPD_ID,CO[C@@H]1CN(C)C(=O)c2ccc(NC(=O)c3nc4ccccc4s3)cc2OC[C@H](C)N(Cc2cccnc2)C[C@@H]1C,HCXQDEKJJPGAJR-NOMHHCBYSA-N,cdp2w5_k02_s1_w2fdda1ee0-ce24-4af7-85a4-fe992a22af77,cdp2w5_k02_s1_w3a3d355aa-f7b3-4ee0-bf80-84a053821a7f,cdp2w5_k02_s1_w14b8814d3-f29b-4348-b91c-f37ec966707f,cdp2w5_k02_s1_w52e6204a7-1da2-417a-9f01-33867d84b78f,cdp2w5_k02_s1_w4bb9938dd-e61b-4b52-b0dc-d5b6977a03bf,42,10499
515,2863.0,24304-G16-2,BRD-A65739223-001-03-7,24304,G16,2,SA82935,ramipril,INN,CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1[C@H]2CCC[C@H]2CC1C(O)=O,HDACQVRGBOVJII-QJUJLUFUSA-N,cdp2bioactives_g16_s2_w243b30a51-7329-4452-8a05-f39f4d0abe3c,cdp2bioactives_g16_s2_w3d5bacf79-6818-4f0c-a965-b3f28c006a65,cdp2bioactives_g16_s2_w171e63281-685d-430f-9077-384f74872022,cdp2bioactives_g16_s2_w58d52cadb-7ade-4658-8ae1-60fe42d9fa22,cdp2bioactives_g16_s2_w4e4ee06f0-001a-464b-a825-b772d0ab928c,105,4471
517,3599.0,24306-N07-6,BRD-K14965640-001-03-3,24306,N07,6,SA83677,S-(+)-ibuprofen,primary-common,CC(C)Cc1ccc(cc1)[C@H](C)C(O)=O,HEFNNWSXXWATRW-JTQLQIEISA-N,cdp2bioactives_n07_s6_w2ecefd2c3-d271-4bb1-9999-2473c993806a,cdp2bioactives_n07_s6_w35799cfa7-bea2-4aff-91c8-4aadd7c4becc,cdp2bioactives_n07_s6_w1f41166fd-cbd8-4ddc-8c62-30fb60637719,cdp2bioactives_n07_s6_w5bbf0d9ba-1dbc-4bc5-9d93-41726454f692,cdp2bioactives_n07_s6_w4bb72cb9b-1427-4362-aa6d-2efa7343c8c0,113,950
518,24291.0,25581-G05-1,BRD-K67649668-001-05-1,25581,G05,1,SA1857943,BRD-K67649668,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)C(\NC(=O)c1ccccc1)=C\Cl,HEHYAHMUZJUXCA-RVDMUPIBSA-N,cdp2w11_g05_s1_w246c25786-cc3b-4807-8db5-1a2e62578175,cdp2w11_g05_s1_w3d6e4da9a-e6ef-41b4-9088-0108e7d86012,cdp2w11_g05_s1_w18eb0e17f-cdf0-493b-b3a0-302414714f35,cdp2w11_g05_s1_w5f5ceb77c-70f0-43ab-af67-5b2039f10d26,cdp2w11_g05_s1_w42d248c16-d977-416d-a294-95a194221071,21,8060
519,7043.0,24357-C20-6,BRD-K62537556-001-01-7,24357,C20,6,SA792127,4-IBP,to-be-curated,Ic1ccc(cc1)C(=O)NC1CCN(Cc2ccccc2)CC1,HELCSESNNDZLFM-UHFFFAOYSA-N,cdp2bioactives_c20_s6_w2ad7618f1-9408-45bb-addc-a48427f2569d,cdp2bioactives_c20_s6_w3dcdca7cf-7b15-4cfa-b49a-f39d7ad0fb47,cdp2bioactives_c20_s6_w1a7423acc-f736-4225-887e-2ecd3df88ce2,cdp2bioactives_c20_s6_w5d6b6f39e-36bf-484c-96ed-b757a0f3a5c0,cdp2bioactives_c20_s6_w4c834ea56-f704-42a2-8387-0c2b71a6effd,123,525
520,3179.0,24305-J17-6,BRD-K11129031-001-04-4,24305,J17,6,SA58320,gemfibrozil,INN,Cc1ccc(C)c(OCCCC(C)(C)C(O)=O)c1,HEMJJKBWTPKOJG-UHFFFAOYSA-N,cdp2bioactives_j17_s6_w23101ceb6-c879-4685-8ef3-6ebd6678fa9b,cdp2bioactives_j17_s6_w37c977f84-a974-4390-855d-f1a730654d25,cdp2bioactives_j17_s6_w1c44efce1-8682-47ba-9f1b-d81fa3891f2f,cdp2bioactives_j17_s6_w579216cc8-2038-4c75-bfd2-d2e785bb2a9b,cdp2bioactives_j17_s6_w4e3157017-328d-4143-9fdc-ce14347b3346,138,76
521,7218.0,24357-P04-1,BRD-K77578964-001-02-8,24357,P04,1,SA58042,lecanoric acid,primary-common,Cc1cc(O)cc(O)c1C(=O)Oc1cc(C)c(C(O)=O)c(O)c1,HEMSJKZDHNSSEW-UHFFFAOYSA-N,cdp2bioactives_p04_s1_w20fd148b1-7083-47b0-98f1-70d2cc6d6867,cdp2bioactives_p04_s1_w3833a9563-46d1-4b23-8ef5-dd7adabdc7d7,cdp2bioactives_p04_s1_w19d4305d6-e56e-4b0d-adcd-5878b115c93e,cdp2bioactives_p04_s1_w54df9bd0f-31aa-4ce6-a7ac-6ac6ec42597c,cdp2bioactives_p04_s1_w4cbeeed42-03c8-4fb4-9bff-7a48e0f92afe,74,5401
522,52999.0,26204-K16-5,BRD-A78139342-001-05-6,26204,K16,5,SA1861406,BRD-A78139342,BROAD_CPD_ID,O=C(NC1CCCCC1)C(N(Cc1ccco1)C(=O)c1ccco1)c1ccco1,HEXMJJGHWGOAEY-UHFFFAOYSA-N,cdp2w9x2-au00026617_k16_s5_w2d69b4d90-59a6-4a76-bc0d-6b2f2f84d78f,cdp2w9x2-au00026617_k16_s5_w371d4b378-4016-450c-ba37-950317b6cc19,cdp2w9x2-au00026617_k16_s5_w195636066-f9f7-4ac0-acb5-afb1461750ea,cdp2w9x2-au00026617_k16_s5_w52f8eebab-8b57-4184-a216-5c063be12f3a,cdp2w9x2-au00026617_k16_s5_w4f1fc2d05-44e8-48f0-be41-2362edada093,56,6647
523,17968.0,25488-J20-2,BRD-K06351180-001-05-7,25488,J20,2,SA1852399,BRD-K06351180,BROAD_CPD_ID,COc1ccc(cc1)-c1oc(NC(C)=O)c(C#N)c1-c1ccc(OC)cc1,HEYMAWOJWMPZLF-UHFFFAOYSA-N,cdp2w10-au00024357_j20_s2_w2d22831bb-e923-4c18-a0be-b502ed4824c7,cdp2w10-au00024357_j20_s2_w34fc066c1-c571-450e-bc27-d78ab1df8179,cdp2w10-au00024357_j20_s2_w1017bb04a-c773-460d-8648-0d2f5c03358b,cdp2w10-au00024357_j20_s2_w5a90a010a-b697-4cbb-abc9-ce72840d2d2a,cdp2w10-au00024357_j20_s2_w49eb06be3-c356-4e45-bd3b-0e3894128edf,49,3618
524,12584.0,25408-D03-6,BRD-K50842549-001-06-4,25408,D03,6,SA1859618,BRD-K50842549,BROAD_CPD_ID,Cc1cccc(C)c1OCC(=O)Nc1ccccc1N1CCCCC1,HFMAHKZHWMDPFO-UHFFFAOYSA-N,cdp2w10_d03_s6_w2633a1458-407b-432d-8676-510e7811ecdc,cdp2w10_d03_s6_w323493a4c-6944-430d-a313-1d399878d049,cdp2w10_d03_s6_w1f9c2b8e5-ff62-4ab7-a0a7-307a2e9350e2,cdp2w10_d03_s6_w53cd7ac2a-d9ed-438a-aefb-c65824a4081c,cdp2w10_d03_s6_w4d345c5d9-1711-4c9c-aca4-a9b9260b2349,69,5310
525,14796.0,25424-K11-4,BRD-K08050560-001-05-3,25424,K11,4,SA1861074,BRD-K08050560,BROAD_CPD_ID,CCSc1ccc(nn1)-c1ccco1,HFNCCYWPVYMNGA-UHFFFAOYSA-N,cdp2w10_k11_s4_w22fffae00-6dba-42ab-9be9-fbbc2614b115,cdp2w10_k11_s4_w320bc35a2-cfc4-4077-9507-c146544b3681,cdp2w10_k11_s4_w1e7988efe-fa0d-406d-b0ce-52d7361865ae,cdp2w10_k11_s4_w5db5b2fd3-3899-4c62-8e28-7a6103b7ea84,cdp2w10_k11_s4_w4678b09d4-829f-4310-8a68-8d323e188414,60,1689
526,965.0,24280-H18-6,BRD-K89046952-001-03-4,24280,H18,6,SA83595,ciclacillin,INN,CC1(C)S[C@@H]2[C@H](NC(=O)C3(N)CCCCC3)C(=O)N2[C@H]1C(O)=O,HGBLNBBNRORJKI-WCABBAIRSA-N,cdp2bioactives_h18_s6_w259e0fea7-77d3-4623-bdf6-a7b9b85853bc,cdp2bioactives_h18_s6_w3a0a1a728-30db-4520-b0cc-6ec412a1009d,cdp2bioactives_h18_s6_w18139c34e-d05a-46e6-8245-867fc89f8561,cdp2bioactives_h18_s6_w56b687f4f-ea1a-41b7-9af7-51dc73e6249b,cdp2bioactives_h18_s6_w4eb06c3c5-fe9d-417e-bed0-c6595c71d5da,142,1346
527,24128.0,25580-N20-6,BRD-K73967057-001-05-8,25580,N20,6,SA1860036,BRD-K73967057,BROAD_CPD_ID,Oc1ccc(Br)cc1-c1cc([nH]n1)-c1ccccc1F,HGLIQONJYMUJHT-UHFFFAOYSA-N,cdp2w11_n20_s6_w270d82159-af4d-42f4-9597-eba0fa5e693a,cdp2w11_n20_s6_w31023ef85-dbdf-411c-9271-11779510dbeb,cdp2w11_n20_s6_w14aa028fe-6f8e-4592-9b76-59d7d92274f5,cdp2w11_n20_s6_w5e8336eae-d8ee-43cf-844b-ae84c9a2ad2c,cdp2w11_n20_s6_w4e36d83de-53e2-4524-9bd0-31ff162b4782,74,5101
528,15836.0,25432-C05-6,BRD-A74094281-001-05-0,25432,C05,6,SA1859732,BRD-A74094281,BROAD_CPD_ID,CCCCC1(CC(CN2CCOCC2)OC1=O)C(=O)OCC,HHJCITZXPVTSHY-UHFFFAOYSA-N,cdp2w10_c05_s6_w203704ca9-f04b-4402-8090-06262d7bfe19,cdp2w10_c05_s6_w31ec336f6-9aa8-497d-9cfb-69b3abc51cc7,cdp2w10_c05_s6_w15f9e7078-c630-443e-8136-633ea533cf27,cdp2w10_c05_s6_w5cb7c618a-4872-40e0-b311-a2aae378d5a9,cdp2w10_c05_s6_w4265552ce-0840-4f35-9ee1-e005ac92ea64,68,5456
529,47749.0,26110-D08-5,BRD-K34954550-001-05-6,26110,D08,5,SA1855929,BRD-K34954550,BROAD_CPD_ID,CN1CCc2nc(NC(=O)COc3ccc4ccccc4c3)sc2C1,HHLJKQAHDAJERX-UHFFFAOYSA-N,cdp2w9x2_d08_s5_w215acdab2-d31f-45b9-8563-215f5aec00b8,cdp2w9x2_d08_s5_w316906f09-5d28-4dfb-833b-0c58c706dc52,cdp2w9x2_d08_s5_w1b0b9337c-38aa-4c74-9749-bc38231a670e,cdp2w9x2_d08_s5_w530619ed1-390c-4dbc-b645-dd3e96c5bec1,cdp2w9x2_d08_s5_w4c9e5bd4b-f8ec-4b8f-8fcc-115c49a2d324,18,1978
530,55393.0,26577-P13-5,BRD-K73500089-001-01-8,26577,P13,5,SA798954,BRD-K73500089,BROAD_CPD_ID,OC[C@H]1O[C@H](CC(=O)N2CCc3ccccc3C2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21,HHNPVBFCYHNCMG-ZVFGGPEJSA-N,cdp2w7x2_p13_s5_w260d01515-c01e-4bc1-9b5c-48e9a70a0069,cdp2w7x2_p13_s5_w3001506c0-9acb-48fa-a253-cf845f79eae8,cdp2w7x2_p13_s5_w1b16e3488-32bb-4b27-9436-79f0e23c4402,cdp2w7x2_p13_s5_w5d4c7dae8-9cb9-456a-bd53-b86202effed2,cdp2w7x2_p13_s5_w4c0d6edba-1934-4f12-9cef-2e9e5570a623,72,10265
531,25395.0,25585-L16-1,BRD-K54583722-001-05-1,25585,L16,1,SA1860883,BRD-K54583722,BROAD_CPD_ID,CC(=O)c1cccc(NC(=O)c2ccc3ccccc3c2)c1,HHZNWFMAOMBCMP-UHFFFAOYSA-N,cdp2w11_l16_s1_w27dd22c03-413e-4eec-87e8-72ea99d553d2,cdp2w11_l16_s1_w3c5bdf0e2-6643-4402-a784-975899783d5d,cdp2w11_l16_s1_w17039123b-d0e3-4f27-89c3-86c3e64493e9,cdp2w11_l16_s1_w58e1267d0-c24b-4a13-83c9-87faf76011e9,cdp2w11_l16_s1_w41c7c908f-05a5-4872-a1d4-2048c69e7529,65,9416
532,26833.0,25593-A09-5,BRD-K29726765-001-05-6,25593,A09,5,SA1860864,BRD-K29726765,BROAD_CPD_ID,CCCCCCN1C(=O)NC(=O)\C(=C/Nc2c(C)n(C)n(-c3ccccc3)c2=O)C1=O,HICDEVOITSXOSY-SAPNQHFASA-N,cdp2w11_a09_s5_w2bccb6bbc-38d3-4dc4-adcb-2cab95f22251,cdp2w11_a09_s5_w3630d85d2-756f-49fc-82ac-79cdc7b6b033,cdp2w11_a09_s5_w13759efa2-2416-4f7a-91a5-065af88580f4,cdp2w11_a09_s5_w573fa61c5-fa10-453f-ac76-e452bb6a9669,cdp2w11_a09_s5_w43cb95e16-de38-4436-a1fb-1078f588a489,55,3130
533,12499.0,25406-P12-5,BRD-K90412405-001-05-3,25406,P12,5,SA1852119,BRD-K90412405,BROAD_CPD_ID,FC(F)(F)c1ccccc1N=C(S)NN=C1CCCCCC1,HICDIXCPXTXYDT-UHFFFAOYSA-N,cdp2w10_p12_s5_w2b5d8c669-10b3-4f6f-85e9-de765b590499,cdp2w10_p12_s5_w3264a5627-a80e-4afb-bf9b-edce7954bdb5,cdp2w10_p12_s5_w1990a8b71-e50d-4dcf-8ad8-d68dd782a4c9,cdp2w10_p12_s5_w5a3a4772f-2707-4fe5-ba74-0672436e38db,cdp2w10_p12_s5_w45e6ff885-fa4a-4c00-afc4-90fec6ecc44d,24,1876
534,34669.0,25688-G03-5,BRD-K75275735-001-05-4,25688,G03,5,SA1855632,BRD-K75275735,BROAD_CPD_ID,CCS(=O)(=O)c1ccc(Sc2nncn2C)c(c1)[N+]([O-])=O,HIKQHKVDDXOZHS-UHFFFAOYSA-N,cdp2w12_g03_s5_w2f7985891-5446-4cf7-bb57-10bce4f3ffda,cdp2w12_g03_s5_w364fe82e6-b863-4573-8b68-870423ad6b92,cdp2w12_g03_s5_w1c5e7ee5f-a313-4340-b0f9-384a54bc9648,cdp2w12_g03_s5_w583bcc1ae-2136-42c2-9a81-28678b4e0c58,cdp2w12_g03_s5_w4e7faeb1e-b67c-47f3-b55f-9681b83e5d11,61,6231
535,39216.0,25855-G18-4,BRD-K44752364-001-01-7,25855,G18,4,SA791100,BRD-K44752364,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(F)cc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,HIWUQZOVKTUVHW-DKGMKSHISA-N,cdp2w6x2_g18_s4_w2ffc43ee5-0551-4a1f-a95f-269c66d8eacc,cdp2w6x2_g18_s4_w3836c9d9c-b805-4321-865d-df322ba92252,cdp2w6x2_g18_s4_w130d9ebdd-8833-49d5-9cc7-7245ea297d77,cdp2w6x2_g18_s4_w54e67e2e6-f437-45b9-9410-a8bb0f9846b6,cdp2w6x2_g18_s4_w4c568664a-7e64-461c-8937-cbf73f01dc7b,47,10205
536,39537.0,25937-G16-1,BRD-A19134330-001-03-8,25937,G16,1,SA82059,A-23187,common,CNc1ccc2oc(C[C@@H]3OC4(CC[C@@H]3C)O[C@H](C(C)C(=O)c3ccc[nH]3)[C@H](C)C[C@H]4C)nc2c1C(O)=O,HIYAVKIYRIFSCZ-CVXKHCKVSA-N,cdp2w8x2_g16_s1_w2cef12baf-3cfe-4696-9307-60ec9fee47e2,cdp2w8x2_g16_s1_w35cfaaa2b-f026-4ec3-8f10-6395d90e9eaf,cdp2w8x2_g16_s1_w18221dd87-d16b-4dc3-8aad-251a101f0be7,cdp2w8x2_g16_s1_w58ccee3f6-bc5f-45ce-bff8-a84bf7d75a8a,cdp2w8x2_g16_s1_w466227523-d008-477b-914b-063ff4825da8,17,5006
537,35741.0,25694-A10-3,BRD-K22375870-001-04-4,25694,A10,3,SA1858782,BRD-K22375870,BROAD_CPD_ID,Cn1nnnc1SCC(=O)N1c2ccccc2Sc2ccc(Cl)cc12,HJCBMYWBOPHAGQ-UHFFFAOYSA-N,cdp2w12_a10_s3_w2b0fb3d0d-a630-4498-9f28-3187ab45fefe,cdp2w12_a10_s3_w3024e651e-e9ab-4d0f-bf83-7cd355d38f04,cdp2w12_a10_s3_w1b5f2ee10-a928-43c6-94e9-4b44e59018f8,cdp2w12_a10_s3_w5754349c6-66dc-4c7d-862a-bcce13bb9d02,cdp2w12_a10_s3_w4d03f6560-9971-413d-a276-433f6726098a,75,6061
538,43005.0,25983-N24-1,BRD-K37561857-001-04-9,25983,N24,1,SA82154,zardaverine,INN,COc1cc(ccc1OC(F)F)-c1ccc(=O)[nH]n1,HJMQDJPMQIHLPB-UHFFFAOYSA-N,cdp2w8x2_n24_s1_w20a3e2b9c-0c52-47fc-8bff-d28246ec4d95,cdp2w8x2_n24_s1_w3f3f68cfd-c5f8-491e-8230-8d35c283a75f,cdp2w8x2_n24_s1_w1d8e637c9-eb6f-4ecb-88c2-89f624cae8b2,cdp2w8x2_n24_s1_w503a76f51-ae04-4a06-afa9-df2c574796a2,cdp2w8x2_n24_s1_w442149358-9a37-42ff-a62e-77f012a5acdd,56,688
539,10847.0,25380-P04-3,BRD-K21380052-001-05-2,25380,P04,3,SA1860515,BRD-K21380052,BROAD_CPD_ID,CN1C(=O)N(C)C(=O)C(=Cc2ccccc2OCCOc2ccc(cc2)[N+]([O-])=O)C1=O,HKLPLZNWZKJBJP-UHFFFAOYSA-N,cdp2w10_p04_s3_w213ed268a-b9e3-4e7b-b9ee-6d77afac3f90,cdp2w10_p04_s3_w3235f3fd3-83f8-4165-aafa-ee9112d4f856,cdp2w10_p04_s3_w187125991-eed6-4328-81b7-af9828130159,cdp2w10_p04_s3_w5a67ac7d6-9908-4284-8878-ea37181931d3,cdp2w10_p04_s3_w4da756859-bd6e-4138-9de9-f78f54a5982d,63,7097
540,41914.0,25967-A12-2,BRD-K18816859-001-01-4,25967,A12,2,SA792145,"2-[5-[3-(4-methylsulphonylamino)benzyl-1,2,4-oxadiazol-5-yl]-1H-indole-3-yl]ethylamine",to-be-curated,CS(=O)(=O)Nc1ccc(Cc2noc(n2)-c2ccc3[nH]cc(CCN)c3c2)cc1,HKXMQLISPYELRD-UHFFFAOYSA-N,cdp2w8x2_a12_s2_w2286c0fa8-d90f-42cd-a190-ecd0e367e0d7,cdp2w8x2_a12_s2_w37405c04e-3534-4109-a7e4-193d7563860c,cdp2w8x2_a12_s2_w1447c89ac-6617-48c9-bb6a-2da5714ef607,cdp2w8x2_a12_s2_w53d476120-58e4-4bfe-996c-1c4ea6d39464,cdp2w8x2_a12_s2_w4e09a5fce-a27d-45b3-8123-84145462aaa5,69,452
541,7827.0,24583-C24-4,BRD-K43287163-001-01-8,24583,C24,4,SA103134,BRD-K43287163,BROAD_CPD_ID,COc1ccc(CN(C)C[C@@H]2OCCCC[C@@H](C)Oc3ccc(cc3C(=O)N(C[C@@H]2C)[C@H](C)CO)N(C)C)cc1,HLAXWBUNQRUQJP-UMDYSXRGSA-N,cdp2bioactives-au00026722_c24_s4_w216583abd-4bde-4d79-aae7-0bba5ea82cd7,cdp2bioactives-au00026722_c24_s4_w397fb6895-9737-4e38-9ac3-760dc24a5e80,cdp2bioactives-au00026722_c24_s4_w18332365b-3bba-4ed9-a555-ebca22dbd9c9,cdp2bioactives-au00026722_c24_s4_w5d352070b-60c2-44bf-ac9c-7f9702d16d00,cdp2bioactives-au00026722_c24_s4_w4c20f81e2-79a5-4754-a7ca-42579607553f,82,9938
542,49214.0,26126-E14-6,BRD-K98303556-001-05-3,26126,E14,6,SA1862112,BRD-K98303556,BROAD_CPD_ID,CCCOc1ccc(CCc2nnc(S)n2Cc2ccccc2)cc1,HLLISCVDCWRUHT-UHFFFAOYSA-N,cdp2w9x2_e14_s6_w2b2ba5b13-145d-4341-9368-dec34066fac8,cdp2w9x2_e14_s6_w3344ed96d-d0ca-4ac4-a2ae-4d46dd515957,cdp2w9x2_e14_s6_w13a37fcc8-e520-437c-a6dd-97c8052e4fec,cdp2w9x2_e14_s6_w5e6a1c8f4-9db6-4ccb-b54d-498b2e5c016c,cdp2w9x2_e14_s6_w4fed56546-8a58-4a8c-9612-f8849eb6d9f8,63,4382
543,29742.0,25643-C18-4,BRD-K91999431-001-05-6,25643,C18,4,SA1853289,"N2-(3-pyridyl)-4-phenyl-1,3-thiazol-2-amine",to-be-curated,N(c1nc(cs1)-c1ccccc1)c1cccnc1,HNBKFOKGRVAMQI-UHFFFAOYSA-N,cdp2w12_c18_s4_w2692ae432-3165-4b08-93e7-523121c052f6,cdp2w12_c18_s4_w315c77273-46b7-405d-bfc0-047c8b0388fd,cdp2w12_c18_s4_w1b8713288-aefc-4c11-96a8-abfe7a6ab83f,cdp2w12_c18_s4_w529791a56-59dc-47ed-82ce-83f1467ca60f,cdp2w12_c18_s4_w4513be0ca-bc2b-43d1-8a33-8f88fe98a864,65,5232
544,26475.0,25591-L19-1,BRD-K81356814-001-05-8,25591,L19,1,SA1854072,BRD-K81356814,BROAD_CPD_ID,Cn1cc(cn1)S(=O)(=O)Nc1ccc2OCCOc2c1,HNHAGCHMIASXJI-UHFFFAOYSA-N,cdp2w11_l19_s1_w20a945173-bdd2-4348-a800-5cc2d836c89d,cdp2w11_l19_s1_w301090a98-4849-48bc-9858-e1afb5caf076,cdp2w11_l19_s1_w1be7394f1-4406-4904-aa50-f2a66d4c23e1,cdp2w11_l19_s1_w51f611876-4e73-47c7-bb22-60b21fecc35a,cdp2w11_l19_s1_w4c73f9002-c6ec-48e4-9648-6ccda6ff9d23,81,4640
545,25003.0,25584-G20-5,BRD-A79980229-001-05-0,25584,G20,5,SA1854743,BRD-A79980229,BROAD_CPD_ID,CC(C)CN(CC(C)C)C(=O)C12CCC(C)(C(=O)C1)C2(C)C,HNHQJGPQHLCTSC-UHFFFAOYSA-N,cdp2w11_g20_s5_w2fb57edc3-32a5-41af-8302-638a6a17c08f,cdp2w11_g20_s5_w3eac2e14e-04bb-4018-ab4e-47d5f591c4d7,cdp2w11_g20_s5_w1148f014c-2455-43bf-a173-7dabd8a8c58c,cdp2w11_g20_s5_w59e6caa25-1920-4260-b467-d8f51e55cfcb,cdp2w11_g20_s5_w4113062be-8de0-4cd0-85be-464594370994,67,7245
546,12348.0,25406-H15-4,BRD-K81653418-001-05-8,25406,H15,4,SA1856719,BRD-K81653418,BROAD_CPD_ID,CCCCCOc1ccc(CSCCN=C(S)Nc2ccccc2)cc1,HNLHVUNAGKSCKK-UHFFFAOYSA-N,cdp2w10_h15_s4_w2883be519-0b09-420a-b7fb-f2341a2e9236,cdp2w10_h15_s4_w3b6bc0fd8-b53b-4f1f-965b-de52cd07bcfb,cdp2w10_h15_s4_w1b93c9612-591b-479e-954e-fda1dbe5d8f6,cdp2w10_h15_s4_w55406dae3-9d1d-4b29-9fbb-4138a013fc6c,cdp2w10_h15_s4_w4fb087e24-32ed-47cb-9e3a-7ba98a75f2cf,40,5776
547,55072.0,26271-D22-2,BRD-K39013648-001-05-0,26271,D22,2,SA1859920,BRD-K39013648,BROAD_CPD_ID,CC(C)(C)CC(C)(C)N=C(S)NC1CCN(Cc2ccccc2)CC1,HNUKTONMTDKSNL-UHFFFAOYSA-N,cdp2w9x2-au00026606_d22_s2_w2ece9a1af-5f71-499c-95b3-eb6cbe29ead4,cdp2w9x2-au00026606_d22_s2_w3f102e26c-1b2b-42ba-998b-e46354991e47,cdp2w9x2-au00026606_d22_s2_w1a12d9883-2d8e-465d-afac-fffabd50fd79,cdp2w9x2-au00026606_d22_s2_w5c8f7cf0c-e432-4efa-906f-258576ae0205,cdp2w9x2-au00026606_d22_s2_w4e9b28ae3-d76b-4598-92e5-084d109e2b23,18,5792
548,22748.0,25575-G08-6,BRD-A33872036-001-05-7,25575,G08,6,SA1860695,BRD-A33872036,BROAD_CPD_ID,CN1C(=O)N(C)C(=O)C(=C2CC(N(N2)C(C)=O)c2ccccc2)C1=O,HPCIYRPJQBJFFL-UHFFFAOYSA-N,cdp2w11_g08_s6_w2aca6090a-fec0-4d73-8824-b0b0622aa730,cdp2w11_g08_s6_w31d528ea6-cc77-460d-b69d-c2a19456663a,cdp2w11_g08_s6_w17dbf2dcd-04a1-419d-8bb6-fc9acdbec03b,cdp2w11_g08_s6_w5931f8329-d8a8-4eab-87e6-8aada2fbcafe,cdp2w11_g08_s6_w4ff5f0e5a-214e-40ce-8b93-2dfafc7c8a02,55,7956
549,46736.0,26071-L05-6,BRD-A22773530-001-05-1,26071,L05,6,SA1859040,BRD-A22773530,BROAD_CPD_ID,CC1Cc2ccccc2N1C(=O)C1CCCN(C1)S(=O)(=O)c1cccc2nsnc12,HPODVUDKRMAOMR-UHFFFAOYSA-N,cdp2w9x2_l05_s6_w2c8535d83-8fba-4f1d-a4a3-d6ff3e45e741,cdp2w9x2_l05_s6_w33a5a93ef-ceb9-4fdc-97ea-bb665bd83c67,cdp2w9x2_l05_s6_w1aa348126-fc3d-4105-9394-f75bfd9a745e,cdp2w9x2_l05_s6_w591d80c16-271b-42ff-9779-4498788b5ec6,cdp2w9x2_l05_s6_w403259af8-b486-4ab2-84e2-5b587ff20354,59,5733
550,34190.0,25686-B11-6,BRD-K59486308-001-06-2,25686,B11,6,SA1855846,BRD-K59486308,BROAD_CPD_ID,CCc1cccc(C)c1NC(=O)CSc1nnc(CCCOc2ccc(Cl)cc2Cl)n1C,HPOGCIRVHHLONM-UHFFFAOYSA-N,cdp2w12_b11_s6_w2156ea788-13c6-4a73-b8aa-cf5137618765,cdp2w12_b11_s6_w35231a016-bb56-4cc1-b5f0-9ac0173357b9,cdp2w12_b11_s6_w14b9b0692-2d37-43d6-9235-28eafc269ae9,cdp2w12_b11_s6_w547c196fc-87d7-4fa4-a308-88cb567d10fa,cdp2w12_b11_s6_w425f5bd15-9b8a-40ee-83e2-13b3566cdffe,74,9203
551,32989.0,25679-J22-5,BRD-K00742408-001-05-9,25679,J22,5,SA1859885,BRD-K00742408,BROAD_CPD_ID,COc1cccc(Nc2nc(cs2)-c2sc(NC(=O)CC(C)C)nc2C)c1,HPRDWUINIZYOTM-UHFFFAOYSA-N,cdp2w12_j22_s5_w27b755df0-d184-442b-be04-064f5467830c,cdp2w12_j22_s5_w3c6377c3d-5999-40cd-91a0-ef42bf8031cc,cdp2w12_j22_s5_w1915c7a95-e6c9-4ad7-b38b-57006aae55af,cdp2w12_j22_s5_w555fd4637-aa84-4a53-a812-39de1072d6fb,cdp2w12_j22_s5_w4dee82fdb-87e5-4225-9c46-d613eb0ee500,54,3533
552,15251.0,25428-C06-3,BRD-K07398339-001-01-6,25428,C06,3,SA1856431,BRD-K07398339,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)n1c(N)nc2ccccc12,HPRFQHGWMAWFQS-UHFFFAOYSA-N,cdp2w10_c06_s3_w22c3060ac-9a12-4607-b64b-7f8ce19a5154,cdp2w10_c06_s3_w3eb409ccf-5a33-4866-a205-a37eff5c142c,cdp2w10_c06_s3_w165b93353-5ce3-48ed-9325-6b88b7e018e7,cdp2w10_c06_s3_w5ea6fa318-6cc4-447c-944a-1d38bcfa0156,cdp2w10_c06_s3_w42a7afd5d-6d96-4b7a-b6e9-acad1bed8c80,68,1925
553,46716.0,26071-K06-4,BRD-K11437379-001-05-8,26071,K06,4,SA1860503,BRD-K11437379,BROAD_CPD_ID,O=C(c1cccs1)n1cc(C(=S)N2CCOCC2)c2ccccc12,HPWUCFWGBAPCKY-UHFFFAOYSA-N,cdp2w9x2_k06_s4_w2cde76f7d-32a0-4c85-ab26-7d8c9c22f683,cdp2w9x2_k06_s4_w3f3d8a85c-26ae-4064-b063-7120bd7a09fb,cdp2w9x2_k06_s4_w139d603be-dd5b-4bae-aeb9-b009ef58a9a1,cdp2w9x2_k06_s4_w5ef73c34f-3ef9-4eaa-9c08-ba0a1d2cda4d,cdp2w9x2_k06_s4_w4f4f39173-f491-4833-9dea-118fc82dd84e,53,7710
554,32302.0,25677-I03-2,BRD-K82668516-001-05-6,25677,I03,2,SA1857462,BRD-K82668516,BROAD_CPD_ID,Cc1n[nH]c(SCC(=O)c2ccccc2)n1,HPZJBUNBFWPSEH-UHFFFAOYSA-N,cdp2w12_i03_s2_w2ad31b4bd-1268-4b6e-b60e-cd8283206aa9,cdp2w12_i03_s2_w32fc96b28-eeeb-4c82-a387-42a38edb1677,cdp2w12_i03_s2_w1111ba82a-86a1-4de0-a97a-685928b4ba9f,cdp2w12_i03_s2_w5293ec38c-7845-4e4f-be9a-afc5fd356da5,cdp2w12_i03_s2_w482461d76-9bda-4faf-b3c4-a798f5c5d6be,54,4227
555,29337.0,25641-M21-1,BRD-A23980907-001-05-6,25641,M21,1,SA1853119,BRD-A23980907,BROAD_CPD_ID,COc1ccc(CC(NC(C)=O)C(=O)NC2CCN(CC2)c2nnnn2-c2ccccc2)cc1,HQJYBEJZCHGQLI-UHFFFAOYSA-N,cdp2w12_m21_s1_w27ba4f523-af5d-4470-b9e8-7188e8c1c740,cdp2w12_m21_s1_w3dd30343b-0af0-4d90-8689-cfdf6524f97e,cdp2w12_m21_s1_w1b7715320-f8f3-413e-b348-76bf4b9a1249,cdp2w12_m21_s1_w526dafb93-b66c-4e5a-846c-0e988e4d9d01,cdp2w12_m21_s1_w4c29d0827-4194-4f67-bc96-360c4a32aa38,63,2951
556,28387.0,25605-H21-5,BRD-K14337427-001-05-9,25605,H21,5,SA1860530,BRD-K14337427,BROAD_CPD_ID,Clc1cccc(c1)N1CCN(CC1)C1=C(NS(=O)(=O)c2cccs2)C(=O)c2ccccc2C1=O,HQNIQZQMKGFDMV-UHFFFAOYSA-N,cdp2w11-au00029692_h21_s5_w24a287526-34cb-4cce-a201-6a286929ec52,cdp2w11-au00029692_h21_s5_w3a966bbd3-6e79-470f-95e2-351d7f9cb079,cdp2w11-au00029692_h21_s5_w14630138b-a5bf-47c4-bbc9-0799284e81ac,cdp2w11-au00029692_h21_s5_w5fac85da0-7f4d-4a97-8a38-d6028593a722,cdp2w11-au00029692_h21_s5_w49b91749e-95b3-4ab0-a033-9736c61df2ce,102,8613
557,20549.0,25567-I22-3,BRD-K61519207-001-07-6,25567,I22,3,SA1855912,BRD-K61519207,BROAD_CPD_ID,Clc1cccc(NC(=O)c2ccc(Br)o2)c1N1CCCC1,HQQJPMDLXCJWKU-UHFFFAOYSA-N,cdp2w11_i22_s3_w260d8b131-96b8-4301-b954-8d713650be28,cdp2w11_i22_s3_w3cac02efd-1730-4464-863c-776d4b97e823,cdp2w11_i22_s3_w1d9c22531-91a6-4231-ad83-66e4e78713a5,cdp2w11_i22_s3_w5c4c2cedf-afea-40c5-8c90-81d99180032d,cdp2w11_i22_s3_w451ab2b2e-fab8-4247-ab58-62930497cf62,74,9040
558,3354.0,24306-C24-1,BRD-K02900412-001-02-2,24306,C24,1,SA59445,clofoctol,INN,CC(C)(C)CC(C)(C)c1ccc(O)c(Cc2ccc(Cl)cc2Cl)c1,HQVZOORKDNCGCK-UHFFFAOYSA-N,cdp2bioactives_c24_s1_w2eaf08973-15bd-4df9-a97d-eb9f88bd51e3,cdp2bioactives_c24_s1_w37c63c7ee-5777-4ca9-b1af-c0b09b5a8017,cdp2bioactives_c24_s1_w120a1737a-0d9a-479b-ae85-4461955582e5,cdp2bioactives_c24_s1_w59f85d3c2-e91e-48cd-8d51-a28b76c2e8ba,cdp2bioactives_c24_s1_w4358e17fb-c01f-4515-ae9f-b69bfd1c0501,55,6025
559,19568.0,25564-G10-6,BRD-K28079131-001-06-6,25564,G10,6,SA1859860,BRD-K28079131,BROAD_CPD_ID,Cc1nc2c(N=Nc3ccccc3F)c(N)nn2c(N)c1C#N,HRFZSQDGLKUGKE-UHFFFAOYSA-N,cdp2w11_g10_s6_w2dd1486fb-bc93-48e6-af40-bbde25f039a4,cdp2w11_g10_s6_w33ea157f0-4761-4f1a-bd97-1d90b425f486,cdp2w11_g10_s6_w1b2c5a9af-270e-438c-8ab2-33825a611e0e,cdp2w11_g10_s6_w5881b6918-234c-49a7-8260-9d78b488d035,cdp2w11_g10_s6_w456500643-7db1-42f2-8bbc-42dc6a71165e,75,5859
560,27647.0,25598-I05-3,BRD-K98201103-001-06-5,25598,I05,3,SA1854971,BRD-K98201103,BROAD_CPD_ID,COC(=O)CSc1nnc(CCc2ccccc2)n1C,HRJBQUREDQBSBB-UHFFFAOYSA-N,cdp2w11_i05_s3_w28d561ded-abe3-4efa-9739-adbb03743d18,cdp2w11_i05_s3_w3f8669b23-a76c-499d-ab67-8589e19d06da,cdp2w11_i05_s3_w173ba9976-0d91-4277-93f7-02f18ad2b415,cdp2w11_i05_s3_w5ac748a2e-6831-4cb3-8a0f-40b219195e03,cdp2w11_i05_s3_w4742ca3fb-e562-4b0d-9a88-8cce1681588f,57,9644
561,55044.0,26271-C19-4,BRD-K25638876-001-05-3,26271,C19,4,SA1861387,BRD-K25638876,BROAD_CPD_ID,Cn1c(N)nc2nc(CCc3ccccc3)c(O)nc2c1=O,HRJLWHUNBAQPEX-UHFFFAOYSA-N,cdp2w9x2-au00026606_c19_s4_w23f872540-1cea-41d6-9694-00bf6733df1f,cdp2w9x2-au00026606_c19_s4_w3f9cfc30f-daa0-4418-8cd2-0a617d95dee3,cdp2w9x2-au00026606_c19_s4_w159ce62e3-eee1-4f20-b61d-5024b984b23c,cdp2w9x2-au00026606_c19_s4_w5c6e52ba4-61e5-4237-8c36-94a14c0796d4,cdp2w9x2-au00026606_c19_s4_w4d318b23e-08a2-4338-8827-b7e2bc1c67a2,43,5042
562,48051.0,26115-B08-1,BRD-K10852405-001-05-7,26115,B08,1,SA1860684,BRD-K10852405,BROAD_CPD_ID,CN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1\C=C(/C#N)S(=O)(=O)c1ccc(C)cc1,HRZIKHFUKPSGLA-HMMYKYKNSA-N,cdp2w9x2_b08_s1_w29cfd6d60-deb6-4f7e-8a63-9628669ccb87,cdp2w9x2_b08_s1_w366fa4141-352e-4875-abf0-8ee3cd327a8b,cdp2w9x2_b08_s1_w15c4b9080-68fd-4bc0-8237-3085ff640f75,cdp2w9x2_b08_s1_w59ccf363c-a801-4000-8a61-8a422f717243,cdp2w9x2_b08_s1_w4609af648-19fb-4756-af6e-ab62bb955e16,76,4188
564,5339.0,24312-E03-6,BRD-K46424862-001-04-2,24312,E03,6,SA83728,hymecromone,INN,Cc1cc(=O)oc2cc(O)ccc12,HSHNITRMYYLLCV-UHFFFAOYSA-N,cdp2bioactives_e03_s6_w2e857bf13-a75c-4ac0-9dcf-237383f9f583,cdp2bioactives_e03_s6_w33ed554b6-dd41-46bb-8a6a-7e3ceb8dbe9d,cdp2bioactives_e03_s6_w179e3f45c-d5d0-4fbf-bf4d-4552b82b41b3,cdp2bioactives_e03_s6_w5dbda8c13-1d52-4932-9829-2dfe658b34aa,cdp2bioactives_e03_s6_w412595c4c-433d-45b5-853f-02a44bbc7be7,67,168
565,39186.0,25855-B24-4,BRD-K38304289-001-01-7,25855,B24,4,SA786511,BRD-K38304289,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O,HSJIFMVKIOATEF-BALWLHIASA-N,cdp2w6x2_b24_s4_w267cbd065-7307-42cd-a466-2bfc03f5e12d,cdp2w6x2_b24_s4_w324f373a5-519b-43ad-bb6e-623dd07fa684,cdp2w6x2_b24_s4_w11fabaa8e-4df3-4f7d-b821-e1b060c9c908,cdp2w6x2_b24_s4_w5ed94d199-9362-426f-aa96-5ecf6e22eaa5,cdp2w6x2_b24_s4_w417d52ab2-3a69-4581-8168-d128a13b3d69,77,10284
566,39245.0,25856-C04-3,BRD-K44098776-001-01-7,25856,C04,3,SA791220,BRD-K44098776,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(c2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O,HSJIFMVKIOATEF-GGJMMHKRSA-N,cdp2w6x2_c04_s3_w20f622019-b486-4f40-aa70-c0c477646dd5,cdp2w6x2_c04_s3_w328b9e06c-65e1-42c2-92fa-56dbf77c5ecd,cdp2w6x2_c04_s3_w1974fd07c-aafb-476e-98af-c2c0d9029793,cdp2w6x2_c04_s3_w5b76457d4-52b2-404b-b878-dc0fbe3df306,cdp2w6x2_c04_s3_w4368700ad-1f19-499d-aa9d-10a73c85bb6c,75,10401
567,23046.0,25576-G07-4,BRD-K46270368-001-07-1,25576,G07,4,SA1862045,BRD-K46270368,BROAD_CPD_ID,COc1ccc(Cn2c3ccc(OC)cc3c3nc4ccccc4nc23)cc1,HSNHWHFAPQSSTR-UHFFFAOYSA-N,cdp2w11_g07_s4_w29651a31e-e43a-4150-88ef-cd81bf2bc059,cdp2w11_g07_s4_w3337cc0aa-0813-455a-b7cb-e2875f393f3a,cdp2w11_g07_s4_w1f6922113-18c5-4d4d-8eb0-c9ab4528da48,cdp2w11_g07_s4_w541037e87-034a-48d5-a137-56ef6661a542,cdp2w11_g07_s4_w4d8d8b63c-a0c3-4d8b-a9e6-ec5bdaadd071,28,1446
568,35671.0,25692-M08-5,BRD-K20726747-001-05-8,25692,M08,5,SA1857491,BRD-K20726747,BROAD_CPD_ID,Nc1nnc(CCc2ccccc2)s1,HSTFNSVDVOLQQH-UHFFFAOYSA-N,cdp2w12_m08_s5_w2bc822e4d-c006-4662-bdd4-000d13a607c9,cdp2w12_m08_s5_w309623084-f2d1-4c89-9841-328dcb0cb715,cdp2w12_m08_s5_w187df4504-c4c4-4a98-8959-7e5f58c906d5,cdp2w12_m08_s5_w5f624024f-1454-4633-8d3e-d043855acc5a,cdp2w12_m08_s5_w473c55527-a51d-4f7c-af63-da57528139f4,67,4308
569,15876.0,25432-D22-4,BRD-K83247518-001-06-4,25432,D22,4,SA1854565,BRD-K83247518,BROAD_CPD_ID,Cc1cc(NC(=O)Cn2c3ccccc3c(=O)n(Cc3ccccc3)c2=O)no1,HSYYMTSXZFJKBQ-UHFFFAOYSA-N,cdp2w10_d22_s4_w2dfdaff31-39b1-400c-aedc-63ec7eff2680,cdp2w10_d22_s4_w312dfaeed-3cc4-4106-84ef-24155121239e,cdp2w10_d22_s4_w1998aaf6a-3570-43c0-bc8f-a788d67bf0a9,cdp2w10_d22_s4_w5806d846f-1ab9-44e0-a2ca-b9e4ba9321ca,cdp2w10_d22_s4_w46a065e25-c8b6-4040-b81c-6a293797cc44,47,4934
570,25093.0,25584-L17-5,BRD-K97241521-001-06-6,25584,L17,5,SA1855463,BRD-K97241521,BROAD_CPD_ID,COC(=O)c1c(NC(=O)\C=C\C(O)=O)sc(Cc2ccccc2)c1C,HTYFKYNJJYRMJB-CMDGGOBGSA-N,cdp2w11_l17_s5_w2958a044c-909e-493f-bc92-dcfda6c76f39,cdp2w11_l17_s5_w38a0c0680-6709-4a6a-bf00-4163d0f08826,cdp2w11_l17_s5_w15c347477-42d0-4b2b-9b52-457f52bd339a,cdp2w11_l17_s5_w5117c875c-0191-4e12-a1a4-09430f48196e,cdp2w11_l17_s5_w4b69da68d-ae86-4ff2-828c-2b67b6f4fe0b,85,8880
571,3469.0,24306-H02-2,BRD-K08356259-003-05-6,24306,H02,2,SA83160,xylometazoline,INN,Cc1cc(cc(C)c1CC1=NCCN1)C(C)(C)C,HUCJFAOMUPXHDK-UHFFFAOYSA-N,cdp2bioactives_h02_s2_w2eb040676-1d22-4b68-bba2-5fd6e33c2189,cdp2bioactives_h02_s2_w3320bdfb7-9b1d-41ab-b9c6-19f9e70b9c18,cdp2bioactives_h02_s2_w10fb6b019-dda7-4024-b372-401f2160b684,cdp2bioactives_h02_s2_w5f20a6257-a9d7-4d28-ab0c-cc9cc5212675,cdp2bioactives_h02_s2_w4c7fc6d9c-6a6e-44fb-a6da-05519df3f7a8,115,646
572,32723.0,25678-L14-3,BRD-K54710378-001-06-5,25678,L14,3,SA1855848,BRD-K54710378,BROAD_CPD_ID,COc1ccccc1[C@H]1[C@@H](N(N=C1c1cccc(Cl)c1)c1ccc(Br)cc1)C(=O)N1CCOC1=O,HUGQWZZOCRYXFK-ISKFKSNPSA-N,cdp2w12_l14_s3_w26b47ebcf-b290-4792-b285-e48f87ee7908,cdp2w12_l14_s3_w30140cc24-2072-4d3b-a040-9cd6a3d3a4d3,cdp2w12_l14_s3_w104a29938-72b7-4373-a332-35084507026f,cdp2w12_l14_s3_w5fdd8f400-b259-4d41-bbdb-156fcce0a389,cdp2w12_l14_s3_w4fc531f90-a9e4-4e0c-ae2a-8f490f2807de,62,1932
573,52495.0,26202-O14-5,BRD-K72054602-001-04-9,26202,O14,5,SA1853787,BRD-K72054602,BROAD_CPD_ID,CCN1CCN(CC1)C(=O)CSCc1nc(oc1C)-c1ccc(OC)c(OC)c1,HUNNUZABMQGNGT-UHFFFAOYSA-N,cdp2w9x2-au00026617_o14_s5_w2de7ea462-2bef-4c15-86a6-1d0986fd6448,cdp2w9x2-au00026617_o14_s5_w3482e3919-3eb6-4a8f-95bc-43bd7cfaa9dc,cdp2w9x2-au00026617_o14_s5_w14c917710-7804-497d-bfd0-b9a5697777c8,cdp2w9x2-au00026617_o14_s5_w598a4acff-b175-44fa-a10c-ae7df9f1562f,cdp2w9x2-au00026617_o14_s5_w4a2f07e29-be76-4fb2-b5bd-e4ccc4fb86eb,55,5035
574,1702.0,24296-C07-5,BRD-K22031190-001-04-6,24296,C07,5,SA58272,diflunisal,INN,OC(=O)c1cc(ccc1O)-c1ccc(F)cc1F,HUPFGZXOMWLGNK-UHFFFAOYSA-N,cdp2bioactives_c07_s5_w2d2132aa3-20d1-4608-a1f0-254aee0bc87b,cdp2bioactives_c07_s5_w34867c425-a4f7-47a7-ac45-6df684c27f1a,cdp2bioactives_c07_s5_w15e420e7a-4995-4e31-bb28-57a90caf35ed,cdp2bioactives_c07_s5_w5d7fbf2c5-e14a-44c8-ae1c-0e410d98efd3,cdp2bioactives_c07_s5_w44f892687-5aaf-4802-9435-63997ee7459d,96,538
575,49286.0,26126-G22-6,BRD-K17956344-001-05-3,26126,G22,6,SA1857824,BRD-K17956344,BROAD_CPD_ID,COCCCNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccc(C)cc1,HUTKPNIRZDSCFI-UHFFFAOYSA-N,cdp2w9x2_g22_s6_w25b19ccb5-56d0-4272-9e91-a505e8d46e88,cdp2w9x2_g22_s6_w34aff9428-de57-485a-b353-731a9e411502,cdp2w9x2_g22_s6_w1db5333a6-2a39-4798-90a5-1f37fccd47d6,cdp2w9x2_g22_s6_w5a6bca4a8-9d42-4888-8b0c-b5adff10a978,cdp2w9x2_g22_s6_w4d8fb6526-4b90-4ba0-9b05-c34360973136,79,2144
576,30003.0,25643-P05-1,BRD-K58358077-001-05-5,25643,P05,1,SA1852308,BRD-K58358077,BROAD_CPD_ID,COc1ccc(Br)cc1\C=C/C(=O)NCc1cccnc1,HVJPBWMXIPYLKG-DAXSKMNVSA-N,cdp2w12_p05_s1_w2c8c75481-95fd-45fb-a2fb-0c2d8e6612f7,cdp2w12_p05_s1_w33cabb12a-3c02-4c3e-afee-b8bfd060874f,cdp2w12_p05_s1_w15f6b23fb-fa4b-479d-ac69-266fe9aae47e,cdp2w12_p05_s1_w5717f999f-d3c0-4630-8994-5493ce7ab649,cdp2w12_p05_s1_w43664163c-519f-4d3e-97f0-8526bc5d48a0,62,8276
577,38463.0,25726-K18-1,BRD-K37540966-001-05-8,25726,K18,1,SA1861473,BRD-K37540966,BROAD_CPD_ID,CCc1cc2c(SCC(=O)C(C#N)=C3N(C)c4ccccc4N3C)ncnc2s1,HVSVZPXQJNTHBO-UHFFFAOYSA-N,cdp2w12_k18_s1_w218001782-4e46-45ef-8c3e-cf3e9e4defd5,cdp2w12_k18_s1_w34e4fc577-c181-4745-8c03-a9886834c835,cdp2w12_k18_s1_w10dbf7ea5-162a-4b79-819f-60642b5388eb,cdp2w12_k18_s1_w50cb9c2bc-a134-4810-b0ba-77348452d9d6,cdp2w12_k18_s1_w4136612b9-ce8d-4c9b-988d-2729f8ca844f,84,3428
578,51754.0,26174-D08-2,BRD-K44969631-001-05-5,26174,D08,2,SA1854732,BRD-K44969631,BROAD_CPD_ID,O=C(COC(=O)C1=COCCO1)Nc1ccc(cc1)C#N,HWFBGWPNSIJYQA-UHFFFAOYSA-N,cdp2w9x2-au00026617_d08_s2_w2ba867dcc-04cf-44a8-ba0d-0a00bf899198,cdp2w9x2-au00026617_d08_s2_w313112413-b95c-401d-b3ea-fce067dfb888,cdp2w9x2-au00026617_d08_s2_w1de855adb-26af-4357-99a3-e571aaabfa28,cdp2w9x2-au00026617_d08_s2_w5895bd86a-0789-404d-bc7e-04f2e8ad1f00,cdp2w9x2-au00026617_d08_s2_w418cf6c82-fe59-4a62-992f-715cb80adc06,68,9681
579,17827.0,25488-E03-5,BRD-A10325891-001-05-7,25488,E03,5,SA1852569,BRD-A10325891,BROAD_CPD_ID,CCC(C)Sc1nc2n(C)c(=O)[nH]c(=O)c2n1Cc1ccc(Cl)cc1,HWJUDZZLUIULRG-UHFFFAOYSA-N,cdp2w10-au00024357_e03_s5_w251a33743-be54-4e61-9010-c4817504d497,cdp2w10-au00024357_e03_s5_w3641af655-6b1e-4f22-86e7-2f9cf1e86765,cdp2w10-au00024357_e03_s5_w1e971ed0c-24b0-458a-a732-37b8dfe926f4,cdp2w10-au00024357_e03_s5_w5152ab447-0dec-4a97-ae58-45afd32d87f6,cdp2w10-au00024357_e03_s5_w49ed3cef6-6a53-43e3-b5f0-7312238af526,72,3056
580,42383.0,25968-D14-3,BRD-K24201553-003-02-4,25968,D14,3,SA792560,SB 269970,common,CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1,HWKROQUZSKPIKQ-MRXNPFEDSA-N,cdp2w8x2_d14_s3_w2f4989551-0be8-4793-aff0-2448c9c315db,cdp2w8x2_d14_s3_w3da4bed91-b016-4952-8d73-1546dc82e17f,cdp2w8x2_d14_s3_w1d1b7e2dc-d2dd-41b3-a3b7-b98899333dfe,cdp2w8x2_d14_s3_w5aa8c9ee2-7f20-43b1-b984-30e73c80d8d0,cdp2w8x2_d14_s3_w4dbf8a049-e3ff-4105-a183-1bb3d45f75d1,61,376
581,19089.0,25553-A07-1,BRD-K82011025-001-05-3,25553,A07,1,SA1857807,BRD-K82011025,BROAD_CPD_ID,CC1(C)Cc2ccccc2-c2nnc(SCC(=O)N3CCN(CC3)c3ccccc3)n12,HWMDZNYGSYCFAI-UHFFFAOYSA-N,cdp2w11-au00029679_a07_s1_w218074b9b-b8ce-4649-9fc6-d4d5e14a543b,cdp2w11-au00029679_a07_s1_w35bc38c1a-66ac-4661-9b03-c58eb3ac14b7,cdp2w11-au00029679_a07_s1_w19d4a1214-137c-461f-bcce-04c8e2695709,cdp2w11-au00029679_a07_s1_w5a4176b71-7338-4a1c-9591-98c980b80202,cdp2w11-au00029679_a07_s1_w4fdafa4b6-5a62-4013-a2a2-abf6b3223eb1,67,6192
582,51537.0,26166-H17-1,BRD-K09146396-001-05-8,26166,H17,1,SA1857493,BRD-K09146396,BROAD_CPD_ID,NC(=S)N=Nc1c(O)n(CCCl)c2ccccc12,HWYRKKLBMQDXHJ-UHFFFAOYSA-N,cdp2w9x2-au00026617_h17_s1_w279b8818f-2039-4875-a706-50789eaa579c,cdp2w9x2-au00026617_h17_s1_w3975cb591-7315-4319-afc2-bd49e2703bcb,cdp2w9x2-au00026617_h17_s1_w156b7565e-411f-4bb5-baa1-d3a06581e7b5,cdp2w9x2-au00026617_h17_s1_w56a11b8be-fd60-498a-a235-cb07849f893a,cdp2w9x2-au00026617_h17_s1_w40e21f80d-3f60-4807-a267-91d9d528d096,28,5862
583,54878.0,26247-L02-6,BRD-K93176058-001-01-0,26247,L02,6,SA792854,AC55649,common,CCCCCCCCc1ccc(cc1)-c1ccc(cc1)C(O)=O,HXBKPYIEQLLNBK-UHFFFAOYSA-N,cdp2w9x2_l02_s6_w2037e5e0a-169d-4e12-98c7-5bd0449700e3,cdp2w9x2_l02_s6_w3126141f4-fdf7-4ab9-88f8-ff7888027fa0,cdp2w9x2_l02_s6_w1255c6426-21c0-46a0-8ca8-b07670b7fdff,cdp2w9x2_l02_s6_w52b18e88b-7206-415a-818e-94c6f85d359b,cdp2w9x2_l02_s6_w4aa2bb4f8-837f-41a5-a404-240e08ee5e58,73,970
584,46378.0,26061-J11-2,BRD-K74870161-001-05-6,26061,J11,2,SA1854069,BRD-K74870161,BROAD_CPD_ID,O=C1NC(=O)C(Cc2cccs2)C(=O)N1,HXPAYMYIOOYMRG-UHFFFAOYSA-N,cdp2w9x2_j11_s2_w2e5376178-6315-49b0-ae95-60348555d217,cdp2w9x2_j11_s2_w346d95568-0ea1-4a1b-a555-d7d7062b6004,cdp2w9x2_j11_s2_w132fbc03f-705a-4d3d-9c3d-d26d653b55bc,cdp2w9x2_j11_s2_w5029f4fba-27e7-463c-8921-7505a9061452,cdp2w9x2_j11_s2_w400b6c493-7184-4985-8b31-82b9dca0dec4,60,2003
585,30560.0,25664-I12-6,BRD-K07669546-001-05-0,25664,I12,6,SA1861135,BRD-K07669546,BROAD_CPD_ID,COc1ccc(cc1)N1CCN(Cc2cc(=O)oc3cc(c(O)cc23)-c2ccccc2)CC1,HXRUWPWCBPRHEV-UHFFFAOYSA-N,cdp2w12_i12_s6_w202c894fd-cd0a-4e01-bb65-02ece3f91264,cdp2w12_i12_s6_w3486222a5-6400-4ed1-b7fa-85b7d95d5d7f,cdp2w12_i12_s6_w11b1c251c-f300-4279-8eb3-8d81e7a0afd8,cdp2w12_i12_s6_w5840c6662-ce73-497f-92d1-8ea65a440304,cdp2w12_i12_s6_w4f6ef8634-769b-467d-93e4-5b6794b55be6,30,8504
586,45179.0,25991-H17-3,BRD-K68095457-001-04-4,25991,H17,3,SA792190,palmidrol,INN,CCCCCCCCCCCCCCCC(=O)NCCO,HXYVTAGFYLMHSO-UHFFFAOYSA-N,cdp2w8x2_h17_s3_w22b69c408-7b0b-484e-a254-e52c268e655a,cdp2w8x2_h17_s3_w304f68478-4f81-44eb-a885-320ec7638b81,cdp2w8x2_h17_s3_w1ceffc980-81a6-4847-a0dc-7e6d6c0cf1ec,cdp2w8x2_h17_s3_w5fc2a7f99-7e73-4f58-bff4-ad89ea1a8361,cdp2w8x2_h17_s3_w4b98019dc-cbe0-4ace-929a-f31b1e22f190,82,420
587,20054.0,25565-O08-6,BRD-K19644706-001-08-9,25565,O08,6,SA1854424,BRD-K19644706,BROAD_CPD_ID,COc1ccc(cc1OC)C(=O)Sc1ccc(Cl)cc1,HXZLPWRTIGTCLO-UHFFFAOYSA-N,cdp2w11_o08_s6_w284ace372-c689-4f1a-ab8d-83caad4a22ec,cdp2w11_o08_s6_w3ad36f59c-e0d0-4a81-a63b-d6166b36de6e,cdp2w11_o08_s6_w11be4ceed-1014-4bab-b061-e768483c5f75,cdp2w11_o08_s6_w5bfd152bf-8b49-4e14-9cac-7e303d4c0ea0,cdp2w11_o08_s6_w40a9b0e0e-2662-44d7-a48c-aee3b4b3ea22,40,4985
588,24400.0,25581-L20-2,BRD-A49581609-001-05-3,25581,L20,2,SA1854593,BRD-A49581609,BROAD_CPD_ID,COc1ccc(NC(=O)C(N(C)c2ccccc2)c2cc3OCOc3cc2[N+]([O-])=O)cc1,HYKIXFONZOPOFC-UHFFFAOYSA-N,cdp2w11_l20_s2_w2425a93b4-faf4-4a9b-8be7-89a747ae50ed,cdp2w11_l20_s2_w37d6ab7df-2445-414c-adc2-2fd09441928b,cdp2w11_l20_s2_w108741072-f03b-4e09-9c20-236c28587b3c,cdp2w11_l20_s2_w5e11a44c7-f4ee-49e9-ae19-67376b49f82a,cdp2w11_l20_s2_w459e950de-7ea0-407e-9334-24f42a443fa0,96,6693
589,9062.0,24733-A24-6,BRD-K55860636-001-02-4,24733,A24,6,SA667088,BRD-K55860636,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2cccc(F)c2)OCc2cn(CCCC1=O)nn2,HYLLQKBLPQWSSO-XGHQBKJUSA-N,cdp2w5_a24_s6_w2c365fc59-606d-4036-b5d6-6407c0e541f8,cdp2w5_a24_s6_w3e32e5a8c-1bfc-4245-a0b7-36f970b30300,cdp2w5_a24_s6_w1d2309e44-47dd-416a-8942-0624dce0cba2,cdp2w5_a24_s6_w55e8116f2-39e0-43ef-9194-96aac3a40a41,cdp2w5_a24_s6_w4e5e7d20e-295e-4b7f-a067-3102b60f42d7,64,9956
590,55838.0,26679-H06-6,BRD-K80236424-001-01-4,26679,H06,6,SA418645,BRD-K80236424,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2F)OCc2cnnn2CCCC1=O,HYXYHDZNHQRBPW-LLGFUMIMSA-N,cdp2w13_h06_s6_w2a9e73199-bc6f-4c69-a029-8241db740046,cdp2w13_h06_s6_w3835ad09a-672d-4dfb-8e2d-e4a4b0c8a6a3,cdp2w13_h06_s6_w112adc768-f45d-4a30-9636-c9f2ef3c9b77,cdp2w13_h06_s6_w5a324c4ab-0b0b-41bb-9aac-b2c3e72ceeb1,cdp2w13_h06_s6_w43964a0a1-6310-4e71-a5cb-cf43681e949f,104,9880
591,23773.0,25579-L21-5,BRD-K62978630-001-06-2,25579,L21,5,SA1856362,BRD-K62978630,BROAD_CPD_ID,COc1ccc(CC(=O)Nc2ccc(cc2)-c2noc(n2)-c2ccc(Cl)cc2)cc1,HZIPOTHIRYOTIH-UHFFFAOYSA-N,cdp2w11_l21_s5_w25e1d708c-2f79-4090-8011-8a0d3de12d96,cdp2w11_l21_s5_w3077e8c2f-769f-4393-986c-3607aeac845d,cdp2w11_l21_s5_w1b3f9dbc4-9232-4259-b5bc-22b35d9ecada,cdp2w11_l21_s5_w50754a282-a2e3-4444-9b05-5bbca4001872,cdp2w11_l21_s5_w485b9cd4c-8df9-40ea-b0ae-7b6b4901fb7d,43,8209
592,27106.0,25593-N20-2,BRD-K93752373-001-07-3,25593,N20,2,SA1855178,BRD-K93752373,BROAD_CPD_ID,COc1ccc(cc1)-c1nnc(NC(=O)c2cc(Cl)ccc2Cl)o1,HZLPGPQBBZSNRD-UHFFFAOYSA-N,cdp2w11_n20_s2_w2eb1050ca-3eea-4eef-97ea-e74c3215e007,cdp2w11_n20_s2_w33267a256-f759-48e0-81ed-5c0fca38f896,cdp2w11_n20_s2_w1bf03b06b-a7a9-4187-9fc1-1aacf9ad05a0,cdp2w11_n20_s2_w5e710938a-cf16-4acf-ae6b-1e19255ce7bf,cdp2w11_n20_s2_w4e7904933-d257-48a8-962a-427acd6a9bfe,74,9229
593,37807.0,25724-J12-5,BRD-K81969319-001-06-6,25724,J12,5,SA1856630,BRD-K81969319,BROAD_CPD_ID,Cc1oc2cc(c(O)c([N+]([O-])=O)c2c1C(=O)c1ccc(Cl)cc1)[N+]([O-])=O,HZSADKRNPPIODV-UHFFFAOYSA-N,cdp2w12_j12_s5_w243519bb6-e6be-46a1-8dc8-2dd5112a4ad6,cdp2w12_j12_s5_w3835356b4-38bf-441f-b5ab-17ab39ceca2a,cdp2w12_j12_s5_w1de160622-a621-4e00-b21a-171a93ab059a,cdp2w12_j12_s5_w555643360-98ba-45c7-8241-bfbf25bf8ed6,cdp2w12_j12_s5_w4fa6675a5-4d0d-4515-9d48-7b5127a25910,64,4290
594,55382.0,26577-K14-6,BRD-K34781184-001-01-6,26577,K14,6,SA798134,BRD-K34781184,BROAD_CPD_ID,OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Oc3ccccc3)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)c3ccc4OCOc4c3)cc21,HZYAIKCNCGBDKG-AXMQAMFRSA-N,cdp2w7x2_k14_s6_w2a5d20070-ac91-4f3d-8740-2efb5c30b34e,cdp2w7x2_k14_s6_w30fdeae41-ed07-424d-a7a0-a39df4a6b4ac,cdp2w7x2_k14_s6_w12833c2df-da85-4638-b7b4-60fbf0bf71cc,cdp2w7x2_k14_s6_w528235336-abe5-4e80-952c-9631aa100dda,cdp2w7x2_k14_s6_w4e10a837e-51d1-4ff0-96d4-215307233baf,65,10276
595,1193.0,24293-F24-6,BRD-K87048468-003-01-9,24293,F24,6,SA792303,RS 102221,to-be-curated,COc1cc(OC)c(cc1NS(=O)(=O)c1ccc(cc1)C(F)(F)F)C(=O)CCCCN1CCC2(CC1)NC(=O)NC2=O,HZZZZODVDSHQRG-UHFFFAOYSA-N,cdp2bioactives_f24_s6_w2cf18b0fc-9d68-4b50-89a9-3ec321a79ac8,cdp2bioactives_f24_s6_w39f2e549d-0727-4f52-ad54-5b3503135f09,cdp2bioactives_f24_s6_w161975350-5ad7-4e92-8ba0-b16e55b1c7f6,cdp2bioactives_f24_s6_w5a19b4641-1574-4d5d-807a-e79380c3c71e,cdp2bioactives_f24_s6_w4fb935fa8-bdf8-479a-a4ef-cafbb6889f80,106,710
596,40185.0,25944-N23-1,BRD-A90249268-001-02-4,25944,N23,1,SA36879,"5,7-dimethoxyflavanone",common,COc1cc(OC)c2C(=O)CC(Oc2c1)c1ccccc1,IAFBOKYTDSDNHV-UHFFFAOYSA-N,cdp2w8x2_n23_s1_w231d8cf22-da10-44e5-8a60-076d25bbde28,cdp2w8x2_n23_s1_w39259fc4b-57f1-4eed-a90a-4cf115af6135,cdp2w8x2_n23_s1_w12dbcbe17-10b4-4ce0-a8a8-90adfe0a0051,cdp2w8x2_n23_s1_w56a8cc3bd-83e8-4e86-a784-11f02161111f,cdp2w8x2_n23_s1_w46dc7b428-4718-4cb1-a883-432d62827511,55,753
597,11223.0,25387-I09-1,BRD-K43400236-001-05-1,25387,I09,1,SA1859986,BRD-K43400236,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(S)=NC1CCCCC1,IAFFAWSDWUDDKZ-UHFFFAOYSA-N,cdp2w10_i09_s1_w248beba52-b3d7-4e23-b6da-5b0bc9d2ed7c,cdp2w10_i09_s1_w32e8a851e-8984-4443-8f88-f6043c14506a,cdp2w10_i09_s1_w1034f6e8e-6bab-45b5-be4d-f2f73b81151a,cdp2w10_i09_s1_w5420b339f-2c4b-41a3-bfbd-e9e868798e8d,cdp2w10_i09_s1_w458cf4eca-1d4f-4e5a-a8f7-694478be0215,61,2784
598,36228.0,25695-L20-4,BRD-K05464415-001-05-6,25695,L20,4,SA1852100,BRD-K05464415,BROAD_CPD_ID,CCCCN1C(=O)NC(=O)\C(=C(\C)NCCc2c[nH]c3ccccc23)C1=O,IAIIZGTUTBPXFW-GHRIWEEISA-N,cdp2w12_l20_s4_w28bb3cc49-0278-4ef5-89d1-4b16a3e986df,cdp2w12_l20_s4_w3886a2eca-95be-4e52-ac9f-78e1bfcbbb5f,cdp2w12_l20_s4_w1aa39e650-caaf-4df8-a270-bf1c6c77e39c,cdp2w12_l20_s4_w570a38916-ea57-4240-ab6a-da3f4438ddf1,cdp2w12_l20_s4_w4e5d22fa2-dd98-4cb3-a85f-8480936477ac,78,4764
599,47156.0,26092-D07-6,BRD-K85311003-001-05-0,26092,D07,6,SA1855547,BRD-K85311003,BROAD_CPD_ID,N#Cc1ccc(Oc2ccc(cc2)-c2cnc3ccccc3n2)cc1C#N,IAIXMAGERSFZMA-UHFFFAOYSA-N,cdp2w9-au00026609_d07_s6_w2a20d2d12-1d43-4fe3-b023-25ead5f985f2,cdp2w9-au00026609_d07_s6_w388e7ffec-18d1-4fdd-93e5-08fd171e8c6b,cdp2w9-au00026609_d07_s6_w1306c8d0f-a934-4dbc-92d3-7bc98fa45b3b,cdp2w9-au00026609_d07_s6_w5a23b2211-1406-441f-8fc5-001de93d713e,cdp2w9-au00026609_d07_s6_w45f0d1dae-e501-4166-a6e1-18dc9d7107b8,74,2640
600,46450.0,26061-O04-2,BRD-K34624391-001-05-8,26061,O04,2,SA1855426,BRD-K34624391,BROAD_CPD_ID,CCOC(=O)c1[nH]c(COC(=O)c2ccccc2NC(=O)c2ccco2)c(C(=O)OCC)c1C,IAJGBQVMVUOWET-UHFFFAOYSA-N,cdp2w9x2_o04_s2_w2942c2d34-e5ee-4eb3-a329-36fd6590aa89,cdp2w9x2_o04_s2_w36dbbd7a0-3af1-4fa6-83c1-ee77b153de64,cdp2w9x2_o04_s2_w1995f9ab9-ed6d-4994-a23c-e5e0f8d2d685,cdp2w9x2_o04_s2_w544b93ff1-be91-4237-911f-e2f89ed60c12,cdp2w9x2_o04_s2_w4a7988d46-15f9-4b09-aa5d-c383ad678134,39,2986
601,24997.0,25584-G19-5,BRD-A13273443-001-06-7,25584,G19,5,SA1853934,BRD-A13273443,BROAD_CPD_ID,OC(=O)C1CC=CCC1C(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12,IBGUAUZZMLDYFF-UHFFFAOYSA-N,cdp2w11_g19_s5_w290a5bf4d-bba6-43dd-b79a-cf511a335415,cdp2w11_g19_s5_w3985ee253-a8ee-4240-864d-abec37f74188,cdp2w11_g19_s5_w14ddef8e7-48eb-41e0-8d47-b8a330ce25a9,cdp2w11_g19_s5_w5159dd61f-c580-4808-9b51-e193440fe5ad,cdp2w11_g19_s5_w429e863be-127d-4375-b155-35532a28d58e,55,8763
602,12541.0,25408-B04-5,BRD-K83572617-001-05-7,25408,B04,5,SA1860964,BRD-K83572617,BROAD_CPD_ID,Cc1nc(NC(=O)COC(=O)CCS(=O)(=O)c2ccccc2Cl)c(Cl)cc1Cl,IBLMEHPVYDRQPE-UHFFFAOYSA-N,cdp2w10_b04_s5_w2d5c31574-4a60-4a20-a5cc-4d4e498d660b,cdp2w10_b04_s5_w3ca5acc60-ab52-4f69-9886-eba1dcbb10ba,cdp2w10_b04_s5_w1a1c0ba8d-36a8-4bf0-aba0-9badf08ca670,cdp2w10_b04_s5_w5ff9f34d6-ffff-4b51-afbb-8da7c61b4b5d,cdp2w10_b04_s5_w40b64eb32-aeab-441a-b155-98f0e416b760,32,1985
603,36846.0,25704-M15-4,BRD-K40152400-001-05-1,25704,M15,4,SA1856320,BRD-K40152400,BROAD_CPD_ID,CCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1,IBRNIRCFVVCJOQ-UHFFFAOYSA-N,cdp2w12_m15_s4_w2429b40cb-ac6d-4151-8878-538004e50dfc,cdp2w12_m15_s4_w3a801ebcd-08b6-4ca7-bb74-90e38d8d162f,cdp2w12_m15_s4_w171b88d67-af01-493e-98cc-44ceb6b2576e,cdp2w12_m15_s4_w540e7d824-5557-4ea4-9e15-462b11c2a1ff,cdp2w12_m15_s4_w4cd3b7fd0-5040-48c4-b1b0-48fbe7efb55f,77,3417
604,10882.0,25382-C12-2,BRD-K16717020-001-06-9,25382,C12,2,SA1854804,BRD-K16717020,BROAD_CPD_ID,Cc1ccccc1Cn1ccc(NC(=O)c2cnn3c(cc(nc23)-c2ccco2)C(F)(F)F)n1,ICAOWTCIJTUECG-UHFFFAOYSA-N,cdp2w10_c12_s2_w2c5019dd8-bc68-4dc2-bcf5-c8e660968290,cdp2w10_c12_s2_w379fdaab2-a3ca-4366-8648-1445e044319a,cdp2w10_c12_s2_w1e5ca2c7a-89af-4f83-bff8-865b83519de5,cdp2w10_c12_s2_w550844dcf-c801-458c-8795-56ee67d17545,cdp2w10_c12_s2_w411038ca2-753c-4a43-b5be-d15a7f487bf0,65,5563
605,19335.0,25553-L10-1,BRD-A29506681-001-05-5,25553,L10,1,SA1852554,BRD-A29506681,BROAD_CPD_ID,CCN(CCCNC(=O)C1CCC(=O)N1Cc1ccccc1Cl)c1cccc(C)c1,ICCKEPIIHCJCID-UHFFFAOYSA-N,cdp2w11-au00029679_l10_s1_w216661e45-1bcd-4110-9e5e-7bc79a83b28e,cdp2w11-au00029679_l10_s1_w3f6167416-fb50-4770-bce7-18b287b02e06,cdp2w11-au00029679_l10_s1_w15d034e89-1482-4ded-9c51-c717799ea917,cdp2w11-au00029679_l10_s1_w516f8d0df-7958-4027-b977-227b6029573b,cdp2w11-au00029679_l10_s1_w4dff3d117-dbc9-4b27-8cb3-198334cc6229,66,3160
606,43198.0,25984-F13-2,BRD-K26997899-001-01-4,25984,F13,2,SA792574,D-64131,to-be-curated,COc1ccc2[nH]c(cc2c1)C(=O)c1ccccc1,ICMIJSRDISNKOC-UHFFFAOYSA-N,cdp2w8x2_f13_s2_w289915e89-c83f-4572-94f1-d95184f86399,cdp2w8x2_f13_s2_w38efc793d-a015-49af-bf6b-6dcb3b860dfb,cdp2w8x2_f13_s2_w1eb610271-2fbc-4e03-b829-86d718cb6fe4,cdp2w8x2_f13_s2_w5502ad9bd-65c5-4c4a-87e3-fe79cddb2704,cdp2w8x2_f13_s2_w4abb418c9-b3b2-4c85-993a-d249959f2a94,9,851
607,52196.0,26181-N07-6,BRD-K84502236-001-06-2,26181,N07,6,SA1857469,BRD-K84502236,BROAD_CPD_ID,CCOc1ccc(\C=C2/N(CC(=O)OC)C(=S)N(C2=O)c2ccc(OC)cc2)cc1OCC,ICOWMNWFNQFYMK-UYRXBGFRSA-N,cdp2w9x2-au00026617_n07_s6_w2d28eb553-f743-49de-b6b2-5a3838f94f5e,cdp2w9x2-au00026617_n07_s6_w37765920b-fd3e-4a65-b804-73c5bcfef1e9,cdp2w9x2-au00026617_n07_s6_w17e07ffed-39bc-4193-8d49-596127c1fd7d,cdp2w9x2-au00026617_n07_s6_w5a431637c-d936-4795-b8e6-ea7c688e095c,cdp2w9x2-au00026617_n07_s6_w4444cee2e-7486-4577-a6e6-860975f47161,51,8943
608,54726.0,26247-B12-4,BRD-K80334323-001-03-5,26247,B12,4,SA83427,noretynodrel,INN,C[C@]12CC[C@H]3[C@@H](CCC4=C3CCC(=O)C4)[C@@H]1CC[C@@]2(O)C#C,ICTXHFFSOAJUMG-SLHNCBLASA-N,cdp2w9x2_b12_s4_w2e7ddd576-8170-4a45-81a0-2b0ef8d88c6d,cdp2w9x2_b12_s4_w376b62bd2-5f9b-44d2-ab43-050566aac48f,cdp2w9x2_b12_s4_w10a5f1b78-c9c8-42f8-9d76-d176e75e671f,cdp2w9x2_b12_s4_w5ab2cde67-53db-4903-86b6-5a461b1c46f5,cdp2w9x2_b12_s4_w4782aada9-8d1c-4624-aa47-5edde17a025a,48,965
609,23728.0,25579-K11-2,BRD-K27802570-001-06-0,25579,K11,2,SA1853527,BRD-K27802570,BROAD_CPD_ID,Clc1ncccc1NC(=O)CC(=O)c1ccccc1,ICWPONHJHUMSHE-UHFFFAOYSA-N,cdp2w11_k11_s2_w2bb37edf5-09f1-4626-98be-1015ba326c85,cdp2w11_k11_s2_w30c246619-eb1f-4151-be74-805c54cb5382,cdp2w11_k11_s2_w19d2ac4ff-3359-4aae-85af-1b78c706f09e,cdp2w11_k11_s2_w5fbcddd9d-0d55-4c37-b0c9-63945e4ba006,cdp2w11_k11_s2_w4ceb9b096-b00f-48ab-b5ac-1d4b69f8feba,68,4085
610,28949.0,25639-J13-3,BRD-K45251081-001-05-2,25639,J13,3,SA1855235,BRD-K45251081,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(S)=NCC=C,IDWNGYCBOHLITE-UHFFFAOYSA-N,cdp2w12_j13_s3_w27f02b284-1ffa-4844-8c3d-cb7a50404e34,cdp2w12_j13_s3_w39dfb06e7-2b31-4b47-8092-0d54ff9ccc70,cdp2w12_j13_s3_w1d6cf3baa-2458-49f2-8545-2886409daca8,cdp2w12_j13_s3_w51b031c4e-ab54-499f-88f9-08ea0089f176,cdp2w12_j13_s3_w417631bc6-5af1-4199-b410-a36439bc6795,57,1282
611,45292.0,25991-P21-2,BRD-K78113049-001-04-8,25991,P21,2,SA59450,enoxacin,INN,CCn1cc(C(O)=O)c(=O)c2cc(F)c(nc12)N1CCNCC1,IDYZIJYBMGIQMJ-UHFFFAOYSA-N,cdp2w8x2_p21_s2_w2dcddbdad-f236-4858-b7ac-648309dbba5b,cdp2w8x2_p21_s2_w3192623ad-b19a-4d8f-8d43-4756fcb64d66,cdp2w8x2_p21_s2_w1059fbc50-9962-4fa2-bb24-b4ad6f9dbead,cdp2w8x2_p21_s2_w5d00785c2-0799-453a-9b87-63ee9206eb6a,cdp2w8x2_p21_s2_w4114ae361-a0ea-4d34-9edf-4e1b7dd592af,19,455
612,34516.0,25686-P17-2,BRD-K07314686-001-05-3,25686,P17,2,SA1858846,BRD-K07314686,BROAD_CPD_ID,Cc1n[nH]c(O)c1C(c1cn(Cc2cccc3ccccc23)c2ccccc12)c1c(C)n[nH]c1O,IEDDUUCBRAGPHC-UHFFFAOYSA-N,cdp2w12_p17_s2_w209de1c1c-8c1c-4e01-be5e-3a598a7807ca,cdp2w12_p17_s2_w39e4844d5-e37c-45ec-a1aa-ea1ded041d40,cdp2w12_p17_s2_w1a782bebd-760d-4e46-973b-77c983353c84,cdp2w12_p17_s2_w5184b3061-5ce4-46af-bf9c-e57e7a613cb0,cdp2w12_p17_s2_w4a8332ebd-48b5-432b-b06e-12deddce561d,23,8189
613,17750.0,25485-P19-6,BRD-K98736133-001-06-4,25485,P19,6,SA1861580,BRD-K98736133,BROAD_CPD_ID,CC(C)=NOc1cc(NC(=O)CCl)cc(c1)[N+]([O-])=O,IELJCNPHFSSWQX-UHFFFAOYSA-N,cdp2w10-au00024355_p19_s6_w26bd85953-13bc-4ecf-82e2-15bea8a4c1d3,cdp2w10-au00024355_p19_s6_w3a7cef9c2-04b5-4369-92bf-4149c6a10629,cdp2w10-au00024355_p19_s6_w14d12cab6-6469-4ce0-a29d-80692ca1b07d,cdp2w10-au00024355_p19_s6_w51d272e01-7363-423d-8f8e-1c9c54d4f1ae,cdp2w10-au00024355_p19_s6_w4ee7f5bd8-fd4b-4783-84d1-29c4afbdbc46,1,7074
614,28999.0,25639-L17-5,BRD-A20242387-001-05-3,25639,L17,5,SA1857934,BRD-A20242387,BROAD_CPD_ID,COc1cc(cc(OC)c1OC)C(N1CCN(CC1)c1ccccc1)c1sc2nc(C)nn2c1O,IFKHJYZMEFGHLK-UHFFFAOYSA-N,cdp2w12_l17_s5_w2e526e0c6-be06-45c0-8fc9-0c95cb942a73,cdp2w12_l17_s5_w3b25371a3-970a-4906-8077-67a385d0fc42,cdp2w12_l17_s5_w1eaf6441a-4655-44e4-a52d-245773cffc1d,cdp2w12_l17_s5_w595db6956-16dc-4ff1-a8ba-9eda52d43803,cdp2w12_l17_s5_w4144b5de4-0318-4af9-976f-7e867c1d3715,91,2351
615,53914.0,26216-L15-2,BRD-K28403392-001-05-4,26216,L15,2,SA1855685,BRD-K28403392,BROAD_CPD_ID,CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cc(nc3ccccc23)-c2ccccc2)c1,IFTXYVAKRHAAGR-UHFFFAOYSA-N,cdp2w9x2_l15_s2_w2e413cb86-f3e5-473b-8756-632f4bb2bf5c,cdp2w9x2_l15_s2_w38e6e9cad-fe9a-463e-8f94-882944fa4acc,cdp2w9x2_l15_s2_w1c5aa2f30-8796-4491-8fdf-79ec4f0db32a,cdp2w9x2_l15_s2_w54d9a9c00-85e4-4320-9bf2-c0d7603601ce,cdp2w9x2_l15_s2_w4de7439ae-7a70-4101-a4cc-bd5e420130fb,32,9359
616,27935.0,25599-F05-3,BRD-K02065805-001-05-2,25599,F05,3,SA1853294,BRD-K02065805,BROAD_CPD_ID,Cc1cc(=O)oc2cc(NC(S)=NCc3ccccn3)ccc12,IGKRBWTWRQNUEN-UHFFFAOYSA-N,cdp2w11_f05_s3_w2147c0673-0a53-4566-89f9-09f05697ae7c,cdp2w11_f05_s3_w35b451481-1a0c-48b5-bb49-1ee092475358,cdp2w11_f05_s3_w13b296733-5bdd-419f-b5ca-e1e1dc476bb6,cdp2w11_f05_s3_w5070e8a8b-2674-453c-ac99-036a65ddb7ef,cdp2w11_f05_s3_w44303e355-98c2-4174-8ad6-2f79b4b51f2c,64,9450
617,12674.0,25408-I14-6,BRD-K99250163-001-05-0,25408,I14,6,SA1853312,BRD-K99250163,BROAD_CPD_ID,CCOC(=O)c1c(C)[nH]c2cc(Br)c(O)cc12,IHGRXBMSSFFTJL-UHFFFAOYSA-N,cdp2w10_i14_s6_w2448751f9-5c59-4060-93f4-def99633c6b8,cdp2w10_i14_s6_w3dd12b674-ddbc-4482-a31c-2b5fab5f2a3b,cdp2w10_i14_s6_w1559b03bb-9df4-4e90-a0b7-6b71e4a74691,cdp2w10_i14_s6_w5120ea07e-e1fa-4640-9026-a64a19454364,cdp2w10_i14_s6_w4c32c34ec-57c5-41a5-ad57-8360435e5a67,42,5339
618,22146.0,25572-I11-4,BRD-K96098741-001-05-7,25572,I11,4,SA1858916,BRD-K96098741,BROAD_CPD_ID,CCN1C(=O)c2cccc3c(ccc1c23)S(=O)(=O)NCc1ccccn1,IIKQWKDJPZHRJE-UHFFFAOYSA-N,cdp2w11_i11_s4_w21c61313d-a15d-4c47-926e-935d53be34ba,cdp2w11_i11_s4_w32732c642-8e94-471b-a50d-615315de5d79,cdp2w11_i11_s4_w1fb24665e-bdc1-4056-862f-3e0cc0b972a5,cdp2w11_i11_s4_w5697fbca1-3083-4c47-8c54-4c819cf1e1ba,cdp2w11_i11_s4_w4fe7e9606-7f9d-4841-848b-a13dfaa939ac,83,5142
619,26546.0,25591-O22-6,BRD-K51669773-001-06-7,25591,O22,6,SA1854147,BRD-K51669773,BROAD_CPD_ID,Cc1ccc2nc(N=C(N)NC(=O)NC3CCCCC3)nc(C)c2c1,IJFNMWRASZLSEN-UHFFFAOYSA-N,cdp2w11_o22_s6_w2364c3fed-c114-4280-89a1-7a5ea4a22505,cdp2w11_o22_s6_w3c764edbb-fac6-4525-aaa8-3f5749ea40aa,cdp2w11_o22_s6_w16812926d-5264-4246-b0ba-cfb515dd4dbd,cdp2w11_o22_s6_w5ef5537c4-5e8e-404f-98ad-99239a1c2bbc,cdp2w11_o22_s6_w4298f3ba1-a9af-4fd3-a65b-5bba6e4c047f,46,1245
620,1574.0,24295-I01-3,BRD-A23072235-050-04-5,24295,I01,3,SA58640,pheniramine,INN,CN(C)CCC(c1ccccc1)c1ccccn1,IJHNSHDBIRRJRN-UHFFFAOYSA-N,cdp2bioactives_i01_s3_w21ff9ebd0-b9d5-43db-9073-51b77483819e,cdp2bioactives_i01_s3_w31b396f17-42e3-4b84-999b-7f95f1cb101d,cdp2bioactives_i01_s3_w1be067b44-9f32-48ec-bd9a-a80ecd3fa183,cdp2bioactives_i01_s3_w5f26e2cc7-dffe-4837-b8c3-7eadbc005578,cdp2bioactives_i01_s3_w4865a1edd-d8ab-487a-b09c-22f6d302f799,67,813
621,37792.0,25724-I19-2,BRD-K49018282-001-05-8,25724,I19,2,SA1856925,BRD-K49018282,BROAD_CPD_ID,CCOc1ccc(-c2[nH]ncc2-c2csc(C)n2)c(O)c1,IJHSEYRNPRHZPH-UHFFFAOYSA-N,cdp2w12_i19_s2_w2f21057bd-0a7c-4b3f-a503-bd6ff396553b,cdp2w12_i19_s2_w30c922054-4d4e-4c4e-bc55-62e2f9f0ffc5,cdp2w12_i19_s2_w1ef3a1c4e-fde0-47be-bfcb-541b27b238a1,cdp2w12_i19_s2_w562019f32-214f-446c-9f84-e921520d62ad,cdp2w12_i19_s2_w415be21fe-d9a2-45a9-ba2d-0044262512dd,67,3439
622,47472.0,26107-E10-4,BRD-K79521948-001-05-0,26107,E10,4,SA1859231,BRD-K79521948,BROAD_CPD_ID,C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(F)c(\C=C\c2ccccc2)c1,IJIJLKCYGJLICK-WACQLOJESA-N,cdp2w9x2_e10_s4_w24f7cc80f-b0ce-4d65-be52-74e71181ffc6,cdp2w9x2_e10_s4_w3378809d8-9aae-4377-a97d-8f529c301dde,cdp2w9x2_e10_s4_w1b17ee906-0429-4576-93dd-527eda2eac6e,cdp2w9x2_e10_s4_w58d17a0f2-a053-4132-92ba-9c806f089513,cdp2w9x2_e10_s4_w494dbdb4d-040c-4231-9443-84d082d35fd0,27,9051
623,7772.0,24565-N01-3,BRD-K55728478-001-01-6,24565,N01,3,SA426255,BRD-K55728478,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CC2)OCCCC[C@@H](C)Oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2C1=O,IJPCFLZWEMVLEC-VUKRRIEASA-N,cdp2bioactives-au00026722_n01_s3_w2551025bb-2e15-4ac0-b6f5-a8ebfcbbc443,cdp2bioactives-au00026722_n01_s3_w3acac4b60-5355-434b-8e72-91c4f4d1585f,cdp2bioactives-au00026722_n01_s3_w1c9d4e297-f9e3-47a3-890a-fcd8251002d1,cdp2bioactives-au00026722_n01_s3_w53f46ca16-a29d-4704-89c2-846684c37abe,cdp2bioactives-au00026722_n01_s3_w45ce14fb9-0d5e-4a8a-bbd9-d0e58e75cf42,101,9978
624,52094.0,26181-H20-6,BRD-K68853635-001-05-8,26181,H20,6,SA1858382,BRD-K68853635,BROAD_CPD_ID,CC(=O)c1ccc(NC(=O)c2noc3CCCc23)cc1,IKFPLCJKATWICF-UHFFFAOYSA-N,cdp2w9x2-au00026617_h20_s6_w21119b02d-df23-4054-b96d-fb6d88a6c650,cdp2w9x2-au00026617_h20_s6_w3e7e371dd-91e1-4006-a52f-2665cfe135ab,cdp2w9x2-au00026617_h20_s6_w1588b6866-301f-4837-80be-174f1eaf673d,cdp2w9x2-au00026617_h20_s6_w5326436b5-e444-4a5d-9f60-656a83d180ac,cdp2w9x2-au00026617_h20_s6_w4d0a0d008-26d8-447d-9824-ebbb4073216c,71,1709
625,37007.0,25707-E16-3,BRD-A42388265-001-05-5,25707,E16,3,SA1853526,BRD-A42388265,BROAD_CPD_ID,CC(=O)NC(CC(=O)N(CC=C)c1nc(cs1)-c1ccc(cc1)S(C)(=O)=O)c1ccccc1,IKJIOKLLFRSHTA-UHFFFAOYSA-N,cdp2w12_e16_s3_w2ed3a6ff0-670c-41a7-97eb-258d7296f894,cdp2w12_e16_s3_w3763890bc-73e2-473a-b514-877c2dc1bef6,cdp2w12_e16_s3_w1ded06380-5fcd-4cb4-870d-30a281bd6d26,cdp2w12_e16_s3_w5d3f86872-171f-4cd4-ac8e-17c8c0913e90,cdp2w12_e16_s3_w4b1c76c69-dffb-4788-9290-c857dda50c62,79,8481
626,11558.0,25391-L19-6,BRD-K18270329-001-06-5,25391,L19,6,SA1858540,BRD-K18270329,BROAD_CPD_ID,COc1ccccc1Nc1nc(N)nc(n1)-c1oc2ccccc2c1C,IKJLLENRNMKXGA-UHFFFAOYSA-N,cdp2w10_l19_s6_w2a5f38b47-319c-4426-993d-b4fc3b809cd4,cdp2w10_l19_s6_w34e578c47-c150-4f48-be08-d55a39b837ca,cdp2w10_l19_s6_w13073abe2-9a95-4f07-a9dc-7b6d5e9ed4f2,cdp2w10_l19_s6_w59afd26c4-8650-4312-8fea-701ead314aac,cdp2w10_l19_s6_w4cc01146e-4d79-4f4f-a14f-020c2ad14dc9,48,4535
627,9447.0,24751-D03-1,BRD-K51104732-001-02-4,24751,D03,1,SA666775,BRD-K51104732,BROAD_CPD_ID,CC(C)OC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO,IKLKAEKDATVYNM-JFIYKMOQSA-N,cdp2w5_d03_s1_w2182e8f25-f0e8-4713-9885-01ee912f88ee,cdp2w5_d03_s1_w3a6177d81-3e30-4c8d-bc7e-cd92761944f6,cdp2w5_d03_s1_w1fa844c71-3eb8-45dc-88f7-f40b46a49e69,cdp2w5_d03_s1_w5727937e7-1327-449e-9784-0ed34c912779,cdp2w5_d03_s1_w4187dc87e-c3a8-4c65-963c-1c536358413e,31,10040
628,12566.0,25408-B21-6,BRD-K06223907-001-06-8,25408,B21,6,SA1859232,BRD-K06223907,BROAD_CPD_ID,Oc1ccc(cc1)-c1nnc(SCC#C)o1,IKMRSFJGBAQXLP-UHFFFAOYSA-N,cdp2w10_b21_s6_w230de34d2-15b8-4d35-99af-b9d34cbee081,cdp2w10_b21_s6_w3b5bd89ec-80cf-4d99-aef8-bb1d0c65cca2,cdp2w10_b21_s6_w13bf595c4-8844-4d22-bec0-3bc9cca9be1a,cdp2w10_b21_s6_w52c955ff1-f14b-4f77-b57e-da609ff0eb02,cdp2w10_b21_s6_w433734076-171a-4eef-bbe5-3a73c4e7850c,67,2943
629,44439.0,25988-N24-1,BRD-K58149231-001-06-9,25988,N24,1,SA83635,esculetin,primary-common,Oc1cc2ccc(=O)oc2cc1O,ILEDWLMCKZNDJK-UHFFFAOYSA-N,cdp2w8x2_n24_s1_w2d1473865-97dd-4c78-833d-0448eee917e8,cdp2w8x2_n24_s1_w3184e29fe-843d-43cb-a69b-cec8c054b176,cdp2w8x2_n24_s1_w137b501bb-2b49-4931-8c19-5896b64234a4,cdp2w8x2_n24_s1_w587508bc2-ce7e-4aa3-bf09-b8e0685bab8c,cdp2w8x2_n24_s1_w454e2bbf7-aa1a-482b-b9d3-9acdba3a7d90,99,1035
630,12856.0,25410-A18-2,BRD-K44812364-001-05-0,25410,A18,2,SA1860892,BRD-K44812364,BROAD_CPD_ID,O=S1(=O)N(Cc2ccc(cc2)-c2nnco2)c2cccc3cccc1c23,ILHXOVKTOROISJ-UHFFFAOYSA-N,cdp2w10_a18_s2_w26f9a21b1-ae8e-48bb-8486-67f7b087c3a0,cdp2w10_a18_s2_w3d5fb0672-cbd8-41cf-bad9-052d7e3559f3,cdp2w10_a18_s2_w1c36b1354-93d7-443d-b4bc-ec286c64b7c6,cdp2w10_a18_s2_w5967fd2c7-be41-46ae-b6d9-9659c78a595e,cdp2w10_a18_s2_w418d96ea5-d0c1-4a6c-a9a1-a822d712319a,49,2319
631,22721.0,25575-F17-3,BRD-K49910317-001-06-3,25575,F17,3,SA1854143,BRD-K49910317,BROAD_CPD_ID,Cc1ccc2nc(O)c(C=C3C(=O)NC(=O)NC3=O)cc2c1,ILJUOPDTYBNOCY-UHFFFAOYSA-N,cdp2w11_f17_s3_w25d879605-a7a4-44af-9b12-20c6d0fb8535,cdp2w11_f17_s3_w389b34f19-dea7-4916-af9f-d5f0b4b3b577,cdp2w11_f17_s3_w12c4047e7-6b27-4bb9-9a03-96cc107ca6d5,cdp2w11_f17_s3_w5cc709b6f-cdbb-48d6-bf41-edc1ec478085,cdp2w11_f17_s3_w471e807f7-3e4f-4361-b4cb-7d1cd4d12f3e,53,2881
632,18134.0,25490-B21-6,BRD-K50708548-001-06-8,25490,B21,6,SA1855744,BRD-K50708548,BROAD_CPD_ID,Cc1ccccc1CSc1nnc(o1)-c1ccncc1,ILKVIRGQIRHLQF-UHFFFAOYSA-N,cdp2w10-au00024359_b21_s6_w258669d00-2a2d-4caa-8058-85b4afd6a55f,cdp2w10-au00024359_b21_s6_w3666e7b6e-90e2-497f-9206-d1cddf2b2f5c,cdp2w10-au00024359_b21_s6_w1fc4bd748-c218-4d7f-aad2-f01b6eed2aa8,cdp2w10-au00024359_b21_s6_w58b2e2764-7c88-4056-b84f-8f05c6d89d66,cdp2w10-au00024359_b21_s6_w47cb391d7-4157-446d-9502-9812274d66c0,30,6251
633,18166.0,25490-E07-2,BRD-K30923778-001-05-1,25490,E07,2,SA1853537,BRD-K30923778,BROAD_CPD_ID,c1ccc(nc1)-c1nc2ccccc2nc1-c1ccccn1,ILLTYNYTHFEGHK-UHFFFAOYSA-N,cdp2w10-au00024359_e07_s2_w22f74af8e-e98d-4b03-98ad-9fd7467f393c,cdp2w10-au00024359_e07_s2_w32bcbef2c-a13e-4650-8bf9-2d43db0cb7f6,cdp2w10-au00024359_e07_s2_w1e2e28209-97aa-4b04-9053-a77c1e178874,cdp2w10-au00024359_e07_s2_w5bd1e2966-4786-46a1-8a22-e4aec6d2292c,cdp2w10-au00024359_e07_s2_w4468cfa0e-8f52-480b-a047-a717346754bb,52,629
634,21959.0,25571-O05-3,BRD-K25743539-001-06-8,25571,O05,3,SA1853020,BRD-K25743539,BROAD_CPD_ID,Oc1ccc(cc1)N1CCN(CC1)C(S)=NCc1ccccc1,ILQJOZHUJMFHCU-UHFFFAOYSA-N,cdp2w11_o05_s3_w2666ebda3-84e0-4180-b8e1-813b3589a9e0,cdp2w11_o05_s3_w371c04b62-3554-4222-b7d3-b1b3346ec54d,cdp2w11_o05_s3_w19b84fd16-d6b4-4fc2-b290-ff925ee50220,cdp2w11_o05_s3_w5ae34e5fa-1393-44c3-a652-361350925ff9,cdp2w11_o05_s3_w46824a7b2-b9bb-44a6-859a-fa6e97aabc94,32,8403
635,34938.0,25689-D10-4,BRD-K37338244-001-05-1,25689,D10,4,SA1855204,BRD-K37338244,BROAD_CPD_ID,Clc1ccc2c(NCc3ccccc3)ccnc2c1,IMBPMAAMRHSTEU-UHFFFAOYSA-N,cdp2w12_d10_s4_w25fb4cee9-39e8-4fb8-a1cc-ce7fb82b351b,cdp2w12_d10_s4_w38f5ed474-3f12-4964-b500-5af7449c7ecc,cdp2w12_d10_s4_w15a2372b1-372e-46a3-8831-f1448697c3df,cdp2w12_d10_s4_w501a187be-a1f4-4bd9-bb89-ef3d5202a109,cdp2w12_d10_s4_w4a1b4496a-afe0-46e6-9280-06ac3249c8d2,72,1241
636,47655.0,26107-L17-1,BRD-A77697958-001-05-9,26107,L17,1,SA1862192,BRD-A77697958,BROAD_CPD_ID,CC1(C)Cc2c(cnn2-c2ccccc2)-c2c1c1ccccc1n2CC(O)CBr,IMCIDXDPSMQGLU-UHFFFAOYSA-N,cdp2w9x2_l17_s1_w2e1018f7c-548e-4723-a0e6-13c869c92e6c,cdp2w9x2_l17_s1_w3d3e02b2f-0964-4b5a-a088-c7fce8802c05,cdp2w9x2_l17_s1_w13cfbca64-74a6-4ca2-962c-d61249ed132f,cdp2w9x2_l17_s1_w575dc30d0-b214-45d9-b2c6-eb732ad4d384,cdp2w9x2_l17_s1_w4194889df-2239-4df1-8fcb-77e0f41727da,18,2747
637,7783.0,24566-B18-2,BRD-K41526317-001-01-6,24566,B18,2,SA102565,BRD-K41526317,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)c2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C,IMDGVULVCKQBDZ-SEAFADMZSA-N,cdp2bioactives-au00026722_b18_s2_w2c6a02b5c-8b6d-4086-a5d5-d840180d5638,cdp2bioactives-au00026722_b18_s2_w320cfa2b7-d257-4bc1-9512-5fa24ccd6359,cdp2bioactives-au00026722_b18_s2_w14fef6d36-027f-412d-854b-7de4775d08d2,cdp2bioactives-au00026722_b18_s2_w577bdd917-ce12-4f7c-8491-5f42600e7eef,cdp2bioactives-au00026722_b18_s2_w44010b154-aa59-4352-8359-f25d19c395bc,84,10018
638,53238.0,26205-H11-4,BRD-A28599787-001-06-2,26205,H11,4,SA1855022,BRD-A28599787,BROAD_CPD_ID,CCOC(=O)NN1C(Nc2ccccc2C1=O)c1ccc(OC)cc1,IMLYNVSNUPARMP-UHFFFAOYSA-N,cdp2w9x2-au00026617_h11_s4_w2e5715dc4-dbc3-4918-a98a-ae3611ae1bc0,cdp2w9x2-au00026617_h11_s4_w316fb6868-1f76-4be6-ba51-6aadbbccbf57,cdp2w9x2-au00026617_h11_s4_w1df1bee92-6055-4abd-b961-73f80bbb0076,cdp2w9x2-au00026617_h11_s4_w548210a46-ebca-422d-993a-cd4e33c60235,cdp2w9x2-au00026617_h11_s4_w4bb74f116-76d3-4702-9234-64328defed57,81,5483
639,2055.0,24297-D04-4,BRD-A09349126-001-02-4,24297,D04,4,SA58402,norethindrone acetate,USP,CC(=O)O[C@]1(CCC2C3CCC4=CC(=O)CC[C@@H]4C3CC[C@]12C)C#C,IMONTRJLAWHYGT-FJMAIUEKSA-N,cdp2bioactives_d04_s4_w20c3a8bf7-29a5-4d53-9e43-89ae8069988d,cdp2bioactives_d04_s4_w39e78ed04-cf45-4d06-81e7-9e6fd3c32302,cdp2bioactives_d04_s4_w15b822b2c-987a-46ed-bfe3-0bbe9704f8a2,cdp2bioactives_d04_s4_w5681a9e8c-962f-4faa-8cad-ad7879eb6451,cdp2bioactives_d04_s4_w43de00a4b-c0a5-4ac0-825c-23b1d0dfe03c,125,2934
640,31114.0,25667-E12-2,BRD-K07509832-001-05-1,25667,E12,2,SA1852375,BRD-K07509832,BROAD_CPD_ID,NNC(=O)c1cccc(COc2ccc(Br)cc2)c1,IMRIYDAFYNLOEZ-UHFFFAOYSA-N,cdp2w12_e12_s2_w267a1bab4-d22b-4794-9136-06eb14073e93,cdp2w12_e12_s2_w33002a7ab-d383-4b6c-af9c-e305b63ea36b,cdp2w12_e12_s2_w1ba985805-28bb-40d6-b912-2e167df7a87a,cdp2w12_e12_s2_w540c6cb72-67f2-4970-93b6-1610b73ee667,cdp2w12_e12_s2_w40d7772e3-ce65-4431-b7af-bde532a7fdd7,71,6340
641,40243.0,25945-D05-5,BRD-A55913614-316-04-7,25945,D05,5,SA58432,primaquine,INN,COc1cc(NC(C)CCCN)c2ncccc2c1,INDBQLZJXZLFIT-UHFFFAOYSA-N,cdp2w8x2_d05_s5_w2606cd81b-1160-4ec3-817c-88091d5d9d54,cdp2w8x2_d05_s5_w320e4e3bb-9cbc-4e3b-bbde-09043837e1ff,cdp2w8x2_d05_s5_w1ccf1df4a-efd9-4160-93f6-af8adc71538e,cdp2w8x2_d05_s5_w56f84f36a-6d9b-448d-8066-8be74ce9020f,cdp2w8x2_d05_s5_w4b03606a2-1bee-4a06-980f-25cde6b2bcfc,43,163
642,28401.0,25605-I19-1,BRD-K39349294-001-05-5,25605,I19,1,SA1859575,BRD-K39349294,BROAD_CPD_ID,CCN1C(=O)S\C(=C/c2ccc(cc2C)N2CCOCC2)C1=O,INDDLKMOXVTJBT-PTNGSMBKSA-N,cdp2w11-au00029692_i19_s1_w24621efe9-9493-4187-a281-b174a1ad3466,cdp2w11-au00029692_i19_s1_w3c4d034eb-36e7-4774-ae50-293db3651985,cdp2w11-au00029692_i19_s1_w1924be209-078c-4ce2-9969-cfc45d960b11,cdp2w11-au00029692_i19_s1_w59a44698c-7dc9-4d16-a232-524620d6a9e7,cdp2w11-au00029692_i19_s1_w49d683e30-e228-4b00-a819-29bb972ab9a0,61,4135
643,33512.0,25681-D04-6,BRD-K49654601-001-05-4,25681,D04,6,SA1854494,BRD-K49654601,BROAD_CPD_ID,CCOc1ccc(cc1)-c1nnc(NC2=NCCCCC2)o1,INPNMBZFXUQZPZ-UHFFFAOYSA-N,cdp2w12_d04_s6_w2fa07090d-6aba-4e65-a1b1-9c3ed3616818,cdp2w12_d04_s6_w3ce7043d6-4150-4347-b01d-171942bf3f3c,cdp2w12_d04_s6_w10de5648b-f3f4-4efa-996c-072027a34c26,cdp2w12_d04_s6_w557e8f6ae-8e42-4c49-912b-cdfd0bf5352b,cdp2w12_d04_s6_w4f35d514c-fc6b-4795-b7b2-8d97c2906cdc,70,8725
644,15810.0,25432-A17-4,BRD-K30128259-001-05-5,25432,A17,4,SA1855404,BRD-K30128259,BROAD_CPD_ID,CN1CCN(CC1)c1ccccc1N,INWHDRNGZMHXEZ-UHFFFAOYSA-N,cdp2w10_a17_s4_w2e04e8adb-6d62-4dd6-b2bc-8313108161c8,cdp2w10_a17_s4_w391a16611-f502-4123-a50a-809851f4cb56,cdp2w10_a17_s4_w1075ed7b1-790e-48cd-8851-1b589f79aced,cdp2w10_a17_s4_w52dc6de64-0f69-4cfa-baca-cd54e84fbd63,cdp2w10_a17_s4_w48f7d7a8e-54be-4cbf-bece-39cd198ad5d9,78,9727
645,22991.0,25576-D15-3,BRD-A37852093-001-04-8,25576,D15,3,SA1857771,BRD-A37852093,BROAD_CPD_ID,CCOC(=O)CC1N(CCNC1=O)C(=O)c1cc2c(nc3c(C)cccn3c2=O)s1,INXWVCJVINUPKX-UHFFFAOYSA-N,cdp2w11_d15_s3_w255d53724-a4fb-4c2f-990b-812c3ffff08c,cdp2w11_d15_s3_w3c5cee6de-8ea4-4e63-b31c-337da159cf2a,cdp2w11_d15_s3_w160b2042d-13a5-40e7-8683-379a3b00e664,cdp2w11_d15_s3_w54c62342c-02f8-4455-a653-02850cb7376c,cdp2w11_d15_s3_w451ea3d23-fe1f-411e-953d-ea55ce71a634,54,1861
646,49114.0,26126-A09-2,BRD-K04357662-001-04-6,26126,A09,2,SA1856738,BRD-K04357662,BROAD_CPD_ID,Clc1cccc(c1)-c1ccc(o1)C(=O)Nc1cccc2nsnc12,IPTGRSACOGFTEC-UHFFFAOYSA-N,cdp2w9x2_a09_s2_w2873f134c-3624-4e5d-94b9-1b75f21fc3b2,cdp2w9x2_a09_s2_w38bf0d2c7-7da2-4422-8353-3176cf45eb40,cdp2w9x2_a09_s2_w19c06ae3c-477e-4c8c-8d98-b77f5186358a,cdp2w9x2_a09_s2_w5fbf7a198-a9fa-4e95-a413-1a0e92081f09,cdp2w9x2_a09_s2_w4f8b8795e-bd57-46bc-b29b-2809b810ace6,104,2304
647,39875.0,25939-P05-3,BRD-A42759514-001-03-1,25939,P05,3,SA83170,ornidazole,INN,Cc1ncc(n1CC(O)CCl)[N+]([O-])=O,IPWKIXLWTCNBKN-UHFFFAOYSA-N,cdp2w8x2_p05_s3_w255b2d94e-299f-4335-a9eb-2f29bcd47f15,cdp2w8x2_p05_s3_w332d2d76f-a646-486a-96e8-7f7906d3816e,cdp2w8x2_p05_s3_w1e48a723a-6fcb-4766-b1fb-08d90108ddec,cdp2w8x2_p05_s3_w58382b3c7-0c84-4d50-b8f2-40fe87092ea6,cdp2w8x2_p05_s3_w4a48e2e93-beff-445a-9330-5f37c22d77b4,82,5327
648,11620.0,25391-P10-2,BRD-K08665105-001-06-8,25391,P10,2,SA1856572,BRD-K08665105,BROAD_CPD_ID,OC(=O)c1cc(NC(=O)CSc2nnc(s2)-c2ccncc2)ccc1Cl,IPWPZEUDOVPHLI-UHFFFAOYSA-N,cdp2w10_p10_s2_w298c3ec25-e3bf-40a3-96f5-fc5870e156ae,cdp2w10_p10_s2_w320b26462-b8d2-4edd-be2b-bd5dfb8f2c9b,cdp2w10_p10_s2_w11df97e02-b23e-494b-b9ec-b08aea1a2fab,cdp2w10_p10_s2_w53c9b70f9-65a4-45bb-8eb8-1835258161cd,cdp2w10_p10_s2_w4a5266aee-4711-437c-9681-59e9be5a9971,41,1869
649,12971.0,25410-G17-3,BRD-K43108438-001-04-9,25410,G17,3,SA1853900,BRD-K43108438,BROAD_CPD_ID,COC(=O)c1ccc2SCCN(C)c2c1,IQNAPJUAVHYVQC-UHFFFAOYSA-N,cdp2w10_g17_s3_w2970211dd-5879-442b-a0ed-a428d2c8d97f,cdp2w10_g17_s3_w3d4d4fc27-57c2-48cd-aa98-eea024c99836,cdp2w10_g17_s3_w10865a11d-f88e-41a1-bde7-09bb23995abf,cdp2w10_g17_s3_w522ab9364-971a-4bc3-801b-8d903b3dc662,cdp2w10_g17_s3_w473b1a55d-46eb-47ce-9b9c-59fee8b46931,79,4554
650,39958.0,25943-H15-2,BRD-A22380646-001-01-5,25943,H15,2,SA58780,pantoprazole,INN,COc1ccnc(CS(=O)c2nc3cc(OC(F)F)ccc3[nH]2)c1OC,IQPSEEYGBUAQFF-UHFFFAOYSA-N,cdp2w8x2_h15_s2_w2e0f05022-b873-4f27-b7c9-2628fe8814de,cdp2w8x2_h15_s2_w3f82cee5d-c1cc-4d8b-a781-8ae8ac30f415,cdp2w8x2_h15_s2_w1ee7c1a08-1e97-4194-9839-570666b06f82,cdp2w8x2_h15_s2_w5df92aef9-d5c5-4e42-a489-c70ac73b9760,cdp2w8x2_h15_s2_w44e5fc775-904c-4e58-a9f1-086b4dc9a1c4,84,1091
651,4279.0,24308-L19-2,BRD-K34359596-001-02-1,24308,L19,2,SA58751,benzylbutylphthalate,primary-common,CCCCOC(=O)c1ccccc1C(=O)OCc1ccccc1,IRIAEXORFWYRCZ-UHFFFAOYSA-N,cdp2bioactives_l19_s2_w2890c014e-0f48-4683-a5f4-beb07a0bf58e,cdp2bioactives_l19_s2_w3d6f0ad72-f1e9-413b-976c-b1c45e7b7611,cdp2bioactives_l19_s2_w152d8a178-11f0-4fac-8c83-9d196109c024,cdp2bioactives_l19_s2_w5f668a1ff-dffe-411b-a52d-68d5be14336f,cdp2bioactives_l19_s2_w438323aaf-5d02-4f51-aa04-ed8a266906b8,86,5350
652,10816.0,25380-N07-2,BRD-K98227422-001-06-4,25380,N07,2,SA1858519,BRD-K98227422,BROAD_CPD_ID,CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(c1)C(=O)NC(c1ccccc1)c1ccccc1,IRJCYQZNUUWHOO-UHFFFAOYSA-N,cdp2w10_n07_s2_w204f6e0cb-fc9d-4067-ace0-1e6b2b01733c,cdp2w10_n07_s2_w310dbc1f4-6d77-48af-983e-b926abd34bfe,cdp2w10_n07_s2_w115b994c8-a9c6-45fe-8127-72b755cbf26a,cdp2w10_n07_s2_w512efe64d-b4c2-4677-8a82-64a066cb1450,cdp2w10_n07_s2_w46b9bc810-dbcd-431d-86a5-4f7e0a11af81,81,1502
653,48827.0,26124-D16-3,BRD-K20918360-001-05-7,26124,D16,3,SA1860121,BRD-K20918360,BROAD_CPD_ID,CCOc1ccccc1C(=O)Nc1ccccc1O,IRLUOHGSVLDVLW-UHFFFAOYSA-N,cdp2w9x2_d16_s3_w2fa5ea9fe-4479-409f-96dd-63974d765dde,cdp2w9x2_d16_s3_w312c8533a-5b30-4a29-8a9b-2ce38df0bb82,cdp2w9x2_d16_s3_w104616ee7-b844-4f0e-bc22-6d599e8567af,cdp2w9x2_d16_s3_w54c556251-a71e-464b-9c21-f8ff5a475a7f,cdp2w9x2_d16_s3_w4387680bc-d5e9-41c6-a68c-a7bac703e3df,55,6213
654,46810.0,26081-B04-2,BRD-K53456628-001-07-2,26081,B04,2,SA1861731,BRD-K53456628,BROAD_CPD_ID,Cc1ccc(cc1)-c1ccc(\C=C(/C#N)C(S)=N)n1C,IRQWOJMMSKLDJQ-UKTHLTGXSA-N,u00026613_b04_s2_w255337ed0-bc6c-49d1-9df3-212d63c63574,u00026613_b04_s2_w37042576d-7d79-4b97-b7d2-4f75d2aae91c,u00026613_b04_s2_w116094c11-973c-4b4f-af1b-4ac94d8a251d,u00026613_b04_s2_w58dff5541-121a-4925-a05a-08f3d38ef368,u00026613_b04_s2_w405a48670-9c80-476c-a9e4-3063bf7e6414,78,4616
655,12686.0,25408-J04-6,BRD-A36378415-001-05-3,25408,J04,6,SA1858017,BRD-A36378415,BROAD_CPD_ID,Fc1ccccc1Cn1c2ccccc2c(=O)n(-c2ccc(CC(=O)NCC3CCCO3)cc2)c1=O,IRZFSMRPTZEUFT-UHFFFAOYSA-N,cdp2w10_j04_s6_w2287526c4-3d85-44f5-8c53-cf73431df5f5,cdp2w10_j04_s6_w3e1c67dde-e9d8-4399-a52d-7e4c21ef55a4,cdp2w10_j04_s6_w1eb8ea66e-b534-4640-891b-b4f2a06396fc,cdp2w10_j04_s6_w5453e7c7c-562a-49e4-93e3-10bc729ce31b,cdp2w10_j04_s6_w45626d3f2-e014-4715-b1a1-6c0f8c4d854c,58,8511
656,21161.0,25569-H11-3,BRD-K41273072-001-05-1,25569,H11,3,SA1858575,BRD-K41273072,BROAD_CPD_ID,Cc1ccc(NC(=O)CCC(=O)NN=C(S)Nc2ccc(F)cc2F)cc1C,ISEJNKGTTUGAIX-UHFFFAOYSA-N,cdp2w11_h11_s3_w251a4d3c3-0035-4c99-8bce-083c3d193841,cdp2w11_h11_s3_w359cd211f-a01a-46fa-b91d-f51cd10ca899,cdp2w11_h11_s3_w11377fff2-2975-437e-86ac-fccbce7bb685,cdp2w11_h11_s3_w5a7aba2ea-d8f4-4f1b-9e78-cca7a928e376,cdp2w11_h11_s3_w42b32af47-38c0-4ef5-bea1-3d8a5ed8cd1c,85,7590
657,4552.0,24309-G06-5,BRD-K27710560-001-02-6,24309,G06,5,SA82339,splitomycin,primary-common,O=C1CCc2c(O1)ccc1ccccc21,ISFPDBUKMJDAJH-UHFFFAOYSA-N,cdp2bioactives_g06_s5_w29b524764-1156-48ff-825a-3085841662e6,cdp2bioactives_g06_s5_w3dea160ef-475e-4dbd-abb6-08b48b745f16,cdp2bioactives_g06_s5_w1872cfbfe-55c3-4666-b18e-bd503c4b4378,cdp2bioactives_g06_s5_w50d472284-d14a-414c-826b-dfa1c21bf55e,cdp2bioactives_g06_s5_w4837f9812-cf0f-4161-9cff-65f50e73e32b,80,705
658,46082.0,26060-I10-6,BRD-A92490200-001-05-6,26060,I10,6,SA1861149,BRD-A92490200,BROAD_CPD_ID,CCCCC1(C)NC(=O)N(CC(=O)Nc2ccc(cc2)S(=O)(=O)N2CCOCC2)C1=O,ISHJBUDZMOAMBR-UHFFFAOYSA-N,cdp2w9x2_i10_s6_w22fcf5088-f270-45a8-9d3c-e82c8c27e8ec,cdp2w9x2_i10_s6_w3d652825d-a6fa-461e-b921-266d534bf701,cdp2w9x2_i10_s6_w1a1a704b2-0585-44da-9570-9beffb6714f2,cdp2w9x2_i10_s6_w595113cc1-c5a6-4e06-8c28-807031a3e3e6,cdp2w9x2_i10_s6_w4f1c74b02-e01d-4e7f-966b-ebc10fd3c3f2,77,5455
659,19501.0,25564-C09-5,BRD-K67831601-001-07-1,25564,C09,5,SA1860282,BRD-K67831601,BROAD_CPD_ID,CCN(CC)c1nc2c(C)cccn2c(=O)c1C=C1C(=O)NC(=O)NC1=O,ISKJIZVDEMXIBX-UHFFFAOYSA-N,cdp2w11_c09_s5_w261c20068-7ac5-409e-a03e-229f6382e0fa,cdp2w11_c09_s5_w35c69d5ec-0fcf-45ec-880c-6691a5af4016,cdp2w11_c09_s5_w1d3b78949-e4ea-41e0-98fd-fc7ac2ce517d,cdp2w11_c09_s5_w573cf6241-a5af-4ce8-a857-dc6157aa4fcb,cdp2w11_c09_s5_w44ab1f907-8896-4488-a4a4-4ba5cb3edcbc,77,1758
660,25592.0,25587-F16-6,BRD-K60036355-001-06-4,25587,F16,6,SA1854832,BRD-K60036355,BROAD_CPD_ID,CC(=O)c1ccc(NS(=O)(=O)c2ccc(N\C=C\C(=O)c3ccc(F)cc3)cc2)cc1,ISMBVCFQNZNCEW-CCEZHUSRSA-N,cdp2w11_f16_s6_w26f9ed52b-2e3f-45d8-953c-2e8218ea57e3,cdp2w11_f16_s6_w36a3df352-e25c-4ebd-b7ab-80835c87a1a0,cdp2w11_f16_s6_w14e9f1fd1-7f62-47ea-9a4d-23dc697dfeb6,cdp2w11_f16_s6_w52905221b-a742-451e-a4e1-c9af34d71a89,cdp2w11_f16_s6_w493150471-75e9-41d1-b499-ab989bd4efc7,65,7275
661,599.0,24278-O16-6,BRD-K96862998-001-03-1,24278,O16,6,SA792328,pirfenidone,INN,Cc1ccc(=O)n(c1)-c1ccccc1,ISWRGOKTTBVCFA-UHFFFAOYSA-N,cdp2bioactives_o16_s6_w2e540c46c-eca9-459b-ac3c-28f90109534d,cdp2bioactives_o16_s6_w359b30d29-a8c9-4e74-a1b6-3fa1df40384c,cdp2bioactives_o16_s6_w197f68510-10f8-445a-8875-be8385174fef,cdp2bioactives_o16_s6_w56c5cd2ab-f5a5-4800-a8fa-acca31a9441d,cdp2bioactives_o16_s6_w40ce1c2a8-4195-4d6d-8de6-2ee37bdc7508,150,1408
662,27912.0,25599-D22-4,BRD-A55411938-001-05-6,25599,D22,4,SA1861924,BRD-A55411938,BROAD_CPD_ID,CCOC(=O)C1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)NCc1ccccc1,IUMXMQSPIMHHAM-UHFFFAOYSA-N,cdp2w11_d22_s4_w2a39d960b-4dea-43dd-bb30-b482878b7a49,cdp2w11_d22_s4_w37a52e0ea-d8cd-41db-a65f-56fac6bdbb8d,cdp2w11_d22_s4_w1e89d7ecf-839c-414d-b6c5-8362c55ed094,cdp2w11_d22_s4_w58ccc4f95-f542-4faa-b4de-867a8016d5f6,cdp2w11_d22_s4_w48aae9868-4433-46a3-a194-5319cc80e1b3,86,8081
663,24229.0,25581-C08-5,BRD-K08654649-001-05-7,25581,C08,5,SA1855671,BRD-K08654649,BROAD_CPD_ID,Oc1ccc(cc1)-c1ccc(cc1)C(=O)c1ccccc1,IURCXIQRULDEEY-UHFFFAOYSA-N,cdp2w11_c08_s5_w20aa8a980-9119-48d8-90fc-8ec8b90a2a6a,cdp2w11_c08_s5_w332ef070b-c8ff-46d8-bc8f-8e81b40ddec4,cdp2w11_c08_s5_w1020dcccf-ab5b-430a-a040-ee1d1073138d,cdp2w11_c08_s5_w5ce1adfeb-14e4-4fb9-8123-dcd1a2107e32,cdp2w11_c08_s5_w4bd08ce74-fe3e-420e-8f6c-075cd92f9e46,44,2548
664,46181.0,26060-O05-3,BRD-K95558029-001-05-4,26060,O05,3,SA1852133,BRD-K95558029,BROAD_CPD_ID,Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)Nc1cccc(C)c1C,IVAPURSBEFYBCS-UHFFFAOYSA-N,cdp2w9x2_o05_s3_w2169d4492-80db-4ef1-83ff-dc5ad7054b01,cdp2w9x2_o05_s3_w3b48bcb53-bd89-4c18-884a-4da0caa3377f,cdp2w9x2_o05_s3_w122b54d35-4194-420b-9867-21fd4debacc5,cdp2w9x2_o05_s3_w561d181e3-67d0-4f14-9d1a-e2468dfe8d84,cdp2w9x2_o05_s3_w461b94c7f-7bf6-46dc-beb9-c21a7324dc9b,60,4950
665,30987.0,25665-P04-1,BRD-A28107346-001-05-0,25665,P04,1,SA1857963,BRD-A28107346,BROAD_CPD_ID,CCC(Sc1nc(O)c2ccccc2n1)C(=O)Nc1ccc(cc1)C(C)=O,IVJJEVDRHUKHKE-UHFFFAOYSA-N,cdp2w12_p04_s1_w29ac29cb0-b123-488f-a23d-6b822a0c1004,cdp2w12_p04_s1_w3b8968c8c-a26a-4280-b05e-70bfbf5c801d,cdp2w12_p04_s1_w166bc407f-ca1a-4bd2-b246-be08a96e4d17,cdp2w12_p04_s1_w5dbd9deee-863d-4fcf-b28e-5ca500725d7e,cdp2w12_p04_s1_w4dd8a4310-38c3-414d-9d97-65fe2cf71e8f,46,2088
666,36455.0,25700-J10-3,BRD-K63120275-001-05-2,25700,J10,3,SA1860768,BRD-K63120275,BROAD_CPD_ID,Clc1cccc(c1)N1CCN(CC1)C(=O)CCn1cnc2ncccc2c1=O,IVUZTMUESOXDNZ-UHFFFAOYSA-N,cdp2w12_j10_s3_w2d4fe2051-55fa-44b1-bc2c-1010efc689c1,cdp2w12_j10_s3_w393edd5ff-968d-48a6-9e49-445b40cc2b45,cdp2w12_j10_s3_w1b8a62c8e-5fd3-4d3b-b59d-4aee450726a2,cdp2w12_j10_s3_w5fccfe55d-e4b8-4350-81f2-e863a46316ad,cdp2w12_j10_s3_w41977443b-f880-47b8-8fbc-f845237ba5a1,62,9770
667,52589.0,26203-D11-3,BRD-K63175663-001-02-3,26203,D11,3,SA1852965,BRD-K63175663,BROAD_CPD_ID,COc1ccc(cc1)C(=O)Nc1cccc(NC(C)=O)c1,IVYWSOWWXLXCLS-UHFFFAOYSA-N,cdp2w9x2-au00026617_d11_s3_w22c3f0f10-9d22-4760-9aa7-a07e9d79e1b7,cdp2w9x2-au00026617_d11_s3_w3b461b63b-fbf8-43c6-8a8d-df4b659e942c,cdp2w9x2-au00026617_d11_s3_w1a0618bf7-043d-4f07-8fa9-7560ef9874af,cdp2w9x2-au00026617_d11_s3_w52a2302a8-d7a5-4f38-be1c-521dd4dfc93f,cdp2w9x2-au00026617_d11_s3_w482072cc2-15c8-4977-b7a6-8146713b11d5,33,9605
668,37600.0,25708-N17-2,BRD-K42757079-001-05-5,25708,N17,2,SA1855367,BRD-K42757079,BROAD_CPD_ID,Cc1ccnc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c1,IWHUWWSQDDVDFL-UHFFFAOYSA-N,cdp2w12_n17_s2_w209bf8fb8-c8a3-42b0-95c3-69da93cc21a2,cdp2w12_n17_s2_w3685bbda8-1748-4ef5-9e6e-fcf9f89ee7e5,cdp2w12_n17_s2_w197a27b2e-12bf-468d-9308-95721f4260b5,cdp2w12_n17_s2_w573b02f08-789f-4603-bb2c-26a61b85cae3,cdp2w12_n17_s2_w402f11c77-fe42-43eb-94a7-af776bc8c123,29,8514
669,50617.0,26138-K12-5,BRD-K58193973-001-06-9,26138,K12,5,SA1862054,BRD-K58193973,BROAD_CPD_ID,Cc1ccc(N2C(=O)C(Cl)=C(NCCO)C2=O)c(C)c1,IWUGKOQICVHWPE-UHFFFAOYSA-N,cdp2w9x2_k12_s5_w25e0fd656-3675-4439-98de-7af8084239a5,cdp2w9x2_k12_s5_w34d791c6f-6e8f-4eeb-bf43-7b6f985c3114,cdp2w9x2_k12_s5_w1c4c20fc3-cd50-4fce-beed-e263488b686b,cdp2w9x2_k12_s5_w558cb5a78-c013-4605-9093-2991fb407bbf,cdp2w9x2_k12_s5_w402b7daea-45b3-4467-9806-9d8a31388cfb,42,2332
670,35813.0,25694-F12-3,BRD-A48784068-001-06-6,25694,F12,3,SA1861420,BRD-A48784068,BROAD_CPD_ID,O=C(NCc1ccccn1)C(Cc1ccccc1)NC(=O)c1ccco1,IWVIJZQCWFDLKJ-UHFFFAOYSA-N,cdp2w12_f12_s3_w2b9e34412-b894-4b04-b76b-f4f2e38fa935,cdp2w12_f12_s3_w3110d4a85-69f3-4b27-9b90-6d68e0443bdf,cdp2w12_f12_s3_w1590ec8cb-f924-4644-acfd-90560eb59839,cdp2w12_f12_s3_w5042d1290-00b4-4d7d-8f9f-06a43dffebd3,cdp2w12_f12_s3_w4e87bcea8-0ded-42c6-9d42-c7290bd59c36,70,9121
671,31078.0,25667-C18-2,BRD-K18915563-001-06-0,25667,C18,2,SA1857166,BRD-K18915563,BROAD_CPD_ID,COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)-c2ccccc2Cl)ccc1N1CCOCC1,IXELHXKSQJPUNJ-UHFFFAOYSA-N,cdp2w12_c18_s2_w2b0b69e1e-141f-4adb-b843-29ed79f1ea03,cdp2w12_c18_s2_w34a05ca7b-7611-4714-92d0-d8079d1cad8f,cdp2w12_c18_s2_w15ae1df8c-1c10-4792-a8ea-d3c3b02cdff6,cdp2w12_c18_s2_w585557644-b071-4b6b-b1dd-7c2721e4420e,cdp2w12_c18_s2_w4a61bac97-2303-49aa-9a9f-5741333e31d8,63,2777
672,4621.0,24309-J07-2,BRD-K31812033-003-03-7,24309,J07,2,SA82871,levobunolol,INN,CC(C)(C)NC[C@H](O)COc1cccc2C(=O)CCCc12,IXHBTMCLRNMKHZ-LBPRGKRZSA-N,cdp2bioactives_j07_s2_w2a9b1ebb0-b93c-4ca6-9866-ca4a4006937c,cdp2bioactives_j07_s2_w3453647ba-3cf9-4c59-835c-27c7414c5f4b,cdp2bioactives_j07_s2_w17e633cd2-cd00-40c7-9017-9a3eb8464f7a,cdp2bioactives_j07_s2_w5e70281d0-6e88-4cb6-b251-d5a26cf3d8eb,cdp2bioactives_j07_s2_w49f22bd7b-8dfd-4647-9327-a52f459385a5,91,1374
673,16437.0,25435-A18-1,BRD-K07250593-001-06-9,25435,A18,1,SA1853052,BRD-K07250593,BROAD_CPD_ID,CC(C)(C)c1ccc(OCCCC(=O)NC2=NCCS2)cc1,IXMAETAZRNHAQE-UHFFFAOYSA-N,cdp2w10_a18_s1_w2d9a633e5-527b-43b4-b8ee-2c6b63b61844,cdp2w10_a18_s1_w3bd4916c8-98b6-4858-bccc-25ac931efaf7,cdp2w10_a18_s1_w10570924f-08bb-4205-b2aa-3410c283077b,cdp2w10_a18_s1_w5e237430d-fa40-4491-bb32-89dbbbacbd7f,cdp2w10_a18_s1_w44203e710-cd90-4cda-a793-b502c2738d7e,32,2097
674,16191.0,25434-E11-1,BRD-K96426659-001-05-0,25434,E11,1,SA1853470,BRD-K96426659,BROAD_CPD_ID,O=C(Nc1ccc2C(=O)NC(=O)c2c1)c1ccc2ncsc2c1,IXOYMIUQSYKGNJ-UHFFFAOYSA-N,cdp2w10_e11_s1_w2ed85e768-3b8b-495e-9d52-d976e6059356,cdp2w10_e11_s1_w3d6a0e51f-0de2-4751-8c06-596fbc8a06a8,cdp2w10_e11_s1_w114c082cc-d1ce-4808-9e0a-fa61ebdcb16f,cdp2w10_e11_s1_w5bc83edb9-0511-48eb-b76d-aa8431c4420a,cdp2w10_e11_s1_w430a1f91c-ad20-4e42-af22-945072ee73da,68,3561
675,11688.0,25392-C07-4,BRD-K32698573-001-06-2,25392,C07,4,SA1859028,BRD-K32698573,BROAD_CPD_ID,C(SCc1ccco1)c1cn2cccnc2n1,IXSXGQYKFGAUOB-UHFFFAOYSA-N,cdp2w10_c07_s4_w23731486d-27cc-4d32-b01b-53c7f9d5c857,cdp2w10_c07_s4_w3bb743001-061b-4369-9884-29ffa33967de,cdp2w10_c07_s4_w142429d27-ae19-4077-ac8f-aa45a422a17a,cdp2w10_c07_s4_w517bd5468-8945-4d67-a9fc-6e184a64c14d,cdp2w10_c07_s4_w45af9955f-4485-4941-9f3d-1560abefbf2a,52,3139
676,16152.0,25434-C14-4,BRD-K05896385-001-04-8,25434,C14,4,SA1856095,BRD-K05896385,BROAD_CPD_ID,Cc1cc(C)c2c(nn3c(C)c(CCC(=O)NCc4ccco4)c(C)nc23)n1,IXTLASJDWBHVIU-UHFFFAOYSA-N,cdp2w10_c14_s4_w218f319d9-27b5-4c65-94b3-6527c1fe9ed6,cdp2w10_c14_s4_w3745c302e-15a9-456c-b781-ae01dafdd6aa,cdp2w10_c14_s4_w120d7c948-4152-47e7-9f36-5a860986b2bd,cdp2w10_c14_s4_w553d4f2c3-92cb-42da-8cea-9820f96ee258,cdp2w10_c14_s4_w4bfcad47f-0e81-4ae2-82d7-61008f2ac610,69,8854
677,43726.0,25986-C10-2,BRD-K44084986-001-03-9,25986,C10,2,SA82368,Y27632,primary-common,C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1,IYOZTVGMEWJPKR-IJLUTSLNSA-N,cdp2w8x2_c10_s2_w202967c1c-8de0-40bd-99bc-68e90a1869df,cdp2w8x2_c10_s2_w388d411a3-212f-475a-9b6c-635ae4197872,cdp2w8x2_c10_s2_w1699ff4f4-0df5-44d8-a21a-226d14402ec8,cdp2w8x2_c10_s2_w5696bd905-9712-45f3-8d2f-67485c77a08c,cdp2w8x2_c10_s2_w4628fc932-8546-45ff-92df-622d4999362c,75,1262
678,6860.0,24352-L11-3,BRD-K12807006-001-02-9,24352,L11,3,SA37752,kaempherol,primary-common,Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1O,IYRMWMYZSQPJKC-UHFFFAOYSA-N,cdp2bioactives_l11_s3_w2f211fba9-b0cd-4a99-a311-a11c69c40b0a,cdp2bioactives_l11_s3_w3e45c358e-4e3c-4f9a-85e7-c3445969c292,cdp2bioactives_l11_s3_w1118d33af-8489-421c-a29b-883974c2b78c,cdp2bioactives_l11_s3_w5f4e72d19-3417-4d09-8959-f8e71e1b9dc7,cdp2bioactives_l11_s3_w4033534bd-b323-4861-9963-68220a0df560,65,417
679,18508.0,25492-E13-2,BRD-K18250782-001-06-7,25492,E13,2,SA1857315,BRD-K18250782,BROAD_CPD_ID,CC(C)CSc1n[nH]c2c(nc3ccccc23)n1,IYWZVSXMWXGDFG-UHFFFAOYSA-N,cdp2w10-au00024360_e13_s2_w2657a290e-d72c-4d99-b785-cfa3ea04f00f,cdp2w10-au00024360_e13_s2_w3256c5a4f-1c04-4c8a-b70d-610509fbc9a1,cdp2w10-au00024360_e13_s2_w10a6089b5-b592-43a2-a01f-3b30a6f714c0,cdp2w10-au00024360_e13_s2_w58e86e10e-c879-4695-af21-0dc830309f91,cdp2w10-au00024360_e13_s2_w4727448b7-c4d6-4894-9ecc-7c6af57bfced,71,7648
680,47454.0,26107-D14-4,BRD-K07662722-001-05-1,26107,D14,4,SA1855295,BRD-K07662722,BROAD_CPD_ID,COCCn1c(nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c12)-c1ccc(cc1)C#N,IYYXHZZNRSYNIR-UHFFFAOYSA-N,cdp2w9x2_d14_s4_w2207b393c-4baa-4fb5-a53e-77d9fca85275,cdp2w9x2_d14_s4_w33c0c58fa-9f38-4c47-82cd-11011e56aea4,cdp2w9x2_d14_s4_w1b18dfe42-824c-410e-ba5d-28573f5e2c5d,cdp2w9x2_d14_s4_w513045aa0-a165-418e-8601-0fbda9c60847,cdp2w9x2_d14_s4_w4d8c8af0d-8156-4e7c-9792-7794edd750d6,45,3772
681,37178.0,25707-K16-6,BRD-K88861635-001-05-7,25707,K16,6,SA1855738,BRD-K88861635,BROAD_CPD_ID,Cc1sc2nc3c(cccn3c(=O)c2c1C)C(=O)N1CCN(CC1)c1cccc(C)c1C,IZABGOMGYXOPTG-UHFFFAOYSA-N,cdp2w12_k16_s6_w2a5dfc4ec-6368-430d-b25b-55bf7fcaa06f,cdp2w12_k16_s6_w3532fa5ee-b829-4319-9db5-c9c9e37cc283,cdp2w12_k16_s6_w1ea57b002-b5ce-4514-b5d6-bb71279fed11,cdp2w12_k16_s6_w5b26283db-3653-463c-a67e-d21c79927617,cdp2w12_k16_s6_w429cc8d60-dd7a-4f3e-876d-2956941abfc9,16,8070
682,33649.0,25681-I22-5,BRD-K05701217-001-05-1,25681,I22,5,SA1857827,BRD-K05701217,BROAD_CPD_ID,COc1ccc(cc1)-n1cc(nc1S)-c1ccc(OC)c(OC)c1,IZLCIVYEZOSGHW-UHFFFAOYSA-N,cdp2w12_i22_s5_w2dcce1484-eab3-4a15-8882-eef97b8cf531,cdp2w12_i22_s5_w3e78aea7f-bbeb-4ccb-af26-d975847f6cc4,cdp2w12_i22_s5_w1213c9c71-af02-428f-a280-c3d70af0e90e,cdp2w12_i22_s5_w50c5137aa-4a79-4c65-9a5d-c173ca4335e2,cdp2w12_i22_s5_w4325f7266-f236-48ea-9a92-c5b36528db33,65,7550
683,19412.0,25553-O11-6,BRD-K53061928-001-08-5,25553,O11,6,SA1856878,BRD-K53061928,BROAD_CPD_ID,OCCCCO[C@H]1C[C@H](C=C(O1)C(=O)N1CCN(Cc2ccc3OCOc3c2)CC1)c1ccc(Br)cc1,IZLJQDMHULWICH-WXVAWEFUSA-N,cdp2w11-au00029679_o11_s6_w2f6f1999a-3c80-4f44-9749-cbf4c3f81938,cdp2w11-au00029679_o11_s6_w32e072df3-f7d6-4ce6-8f0d-202851b2fbf7,cdp2w11-au00029679_o11_s6_w1edf4bd9f-a2aa-41b5-b8ab-a2df3c293ca8,cdp2w11-au00029679_o11_s6_w54a7409fb-3fe7-47fd-97f7-e807b074ddba,cdp2w11-au00029679_o11_s6_w45c15dcd1-4730-4365-8fa3-14e1c2438ecd,53,1882
684,56596.0,26794-I01-2,BRD-K31834448-001-01-8,26794,I01,2,SA417950,BRD-K31834448,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO,IZYFSJYDPLTURU-HMFYCAOWSA-N,cdp2w13_i01_s2_w23cb662e2-e1c5-4e4e-80a4-0043b57d2c08,cdp2w13_i01_s2_w36e3e8d65-8d22-45f1-a06e-2ee5f67ff330,cdp2w13_i01_s2_w19ebe8f2b-4506-4b0a-801b-1a71dca348b2,cdp2w13_i01_s2_w51f94d8f8-0755-4909-a671-021f1117d425,cdp2w13_i01_s2_w47868db2c-37eb-4930-a42c-019dad664875,79,10347
685,55852.0,26679-H23-2,BRD-K41880142-001-01-8,26679,H23,2,SA417935,BRD-K41880142,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@H](C)CO,IZYFSJYDPLTURU-NJNPRVFISA-N,cdp2w13_h23_s2_w26a56bb07-d199-47ed-938f-090b7cc95e4d,cdp2w13_h23_s2_w3726a954d-2b7d-4209-aa5b-7c59154f4c4f,cdp2w13_h23_s2_w156a6d90f-658e-4d3c-9c9c-348b9d31e205,cdp2w13_h23_s2_w5223c95b7-15b6-4cb5-a68c-104db3c7f141,cdp2w13_h23_s2_w47e10d5a7-fd4c-4e6b-acd8-75637cc617d6,121,10027
686,38617.0,25732-J07-4,BRD-K20716797-001-06-6,25732,J07,4,SA1856236,BRD-K20716797,BROAD_CPD_ID,Cc1nc2cc3[nH]c(nc3cc2[nH]1)C(F)(F)F,JAEVGTNIGRKNBP-UHFFFAOYSA-N,cdp2w12_j07_s4_w2f4d08223-ee95-4490-a622-3cad4240f2ba,cdp2w12_j07_s4_w38bb23033-d9cc-4595-9aed-149a26e23d14,cdp2w12_j07_s4_w1aec9eb8b-8413-4a0c-967f-5a093a69497a,cdp2w12_j07_s4_w5838fe727-a3a6-439f-9c49-4df72c537971,cdp2w12_j07_s4_w4f967c004-efa3-4e63-850a-bf32ffd168fa,58,4729
687,31971.0,25676-E20-1,BRD-K58455347-001-06-1,25676,E20,1,SA1858571,BRD-K58455347,BROAD_CPD_ID,COc1cc(NC(=S)N2CCN(C\C=C\c3ccccc3)CC2)cc(OC)c1,JAFQAOSQKDLMQS-RMKNXTFCSA-N,cdp2w12_e20_s1_w2516a961f-5e7d-4b3c-a019-acb08bf26697,cdp2w12_e20_s1_w341a62d50-45fa-4823-8d43-855354c021c6,cdp2w12_e20_s1_w1f68a1432-b911-4f7a-9934-5a2a5d11e37c,cdp2w12_e20_s1_w52d5ee3cf-b9ba-41d9-8e7f-0534c1e44a37,cdp2w12_e20_s1_w49cc221a9-8b42-43ab-ac81-34769d389448,35,2982
688,26788.0,25592-O03-2,BRD-K78494082-001-07-3,25592,O03,2,SA1858958,BRD-K78494082,BROAD_CPD_ID,CC(=O)Nc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cc1,JAOFYOGMXDRJKZ-UHFFFAOYSA-N,cdp2w11_o03_s2_w2fedfc10f-0dea-44f3-88de-23d611e270a9,cdp2w11_o03_s2_w36dc9cab5-9b43-48df-9570-8190823306c1,cdp2w11_o03_s2_w1d3ddb8cc-433a-4ad4-a0a4-97fc2b7ee6ab,cdp2w11_o03_s2_w5bd784dec-11a9-4bb1-bd14-e22842084b6b,cdp2w11_o03_s2_w4ca14d638-a2c6-4504-964d-cec0e284c571,78,6006
689,10174.0,25376-D16-2,BRD-K29224644-001-05-9,25376,D16,2,SA1852588,BRD-K29224644,BROAD_CPD_ID,O=C(CSc1nc(Cc2ccccc2)nc2ccccc12)c1ccc2OCCOc2c1,JAOGFJKZKNUZCY-UHFFFAOYSA-N,cdp2w10_d16_s2_w2288c73ad-902b-4b24-8595-affbfa008ca9,cdp2w10_d16_s2_w38b3a8839-87f9-4f62-9095-14389a0490b1,cdp2w10_d16_s2_w186b51313-d555-4003-bc90-7b4a919c2c3d,cdp2w10_d16_s2_w5ad2b4d00-2bf6-4548-96f1-ed53994e8865,cdp2w10_d16_s2_w40c897dff-6c06-466e-91de-24588117c10e,63,7555
690,44343.0,25988-I11-1,BRD-K50891186-001-01-0,25988,I11,1,SA82629,GR 103691,to-be-curated,COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(cc2)-c2ccc(cc2)C(C)=O)CC1,JARNORYOPMINDY-UHFFFAOYSA-N,cdp2w8x2_i11_s1_w2088b0bcb-84ca-4fe1-b1f1-6dc1a684de19,cdp2w8x2_i11_s1_w382cda443-28f6-4569-a9da-b25bfc932f11,cdp2w8x2_i11_s1_w1306f46eb-5ccb-4c81-b92a-f85eec628e08,cdp2w8x2_i11_s1_w5e642dd44-db8d-4d87-80ac-b1f239971e1b,cdp2w8x2_i11_s1_w48f13f0ee-7ee2-4ef2-b9c6-977ffe35f3b6,59,594
691,56557.0,26794-D23-5,BRD-K14470344-001-01-7,26794,D23,5,SA418213,BRD-K14470344,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2,JATGFWCPGFHVCF-FHAGJXEFSA-N,cdp2w13_d23_s5_w2ebb9d8a8-e47f-4723-9062-746f2556052b,cdp2w13_d23_s5_w3a7831d28-bf78-4598-b421-c0aa8905a312,cdp2w13_d23_s5_w1a7cfe847-c690-4f6d-8b6e-b2ac25b3f34a,cdp2w13_d23_s5_w5f4165d45-652e-4bd7-ab42-ee078b827272,cdp2w13_d23_s5_w486460284-4af6-4e03-9544-d5d0c1564496,65,9740
692,56686.0,26795-D22-2,BRD-K60850524-001-01-5,26795,D22,2,SA418199,BRD-K60850524,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Oc2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2,JATGFWCPGFHVCF-RNHFSVANSA-N,cdp2w13_d22_s2_w298a62514-4b9c-4d33-8ec0-3b341fb4f483,cdp2w13_d22_s2_w3c4867841-9b6f-43ba-9f5a-b47eac99efbe,cdp2w13_d22_s2_w1fbfdf300-034b-4241-99e8-cf1acb215e7e,cdp2w13_d22_s2_w50851dcc0-0e24-4794-a30b-5ee37818245d,cdp2w13_d22_s2_w4b398fca6-7937-40c0-b423-39282535ea9b,106,9860
693,43485.0,25985-E21-1,BRD-K47192521-001-02-1,25985,E21,1,SA81995,icosapent,INN,CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O,JAZBEHYOTPTENJ-JLNKQSITSA-N,cdp2w8x2_e21_s1_w2876dca42-794f-4d81-9d16-d36aa78c08ca,cdp2w8x2_e21_s1_w3b5f836ea-3263-4974-9638-78c7255e6f59,cdp2w8x2_e21_s1_w11cf4552e-b6da-4004-a8e7-5ec48b7813ac,cdp2w8x2_e21_s1_w5438496d5-0b53-4d5c-a462-e793cf7d6013,cdp2w8x2_e21_s1_w4c0c7d9af-d9bf-49b3-b3c5-d1c40d48031f,70,1159
694,9711.0,25372-F03-1,BRD-K75257693-001-06-0,25372,F03,1,SA1857087,BRD-K75257693,BROAD_CPD_ID,CN(C)C(=O)c1sc(NC(=O)\C=C\c2ccccc2)nc1C,JBQYUENBTAYOTN-MDZDMXLPSA-N,cdp2w10_f03_s1_w21bd265aa-d8b9-4c8f-8957-b78840b47041,cdp2w10_f03_s1_w3a31ba2be-9f6b-4db3-8e02-bd21a0c92715,cdp2w10_f03_s1_w1e9c4eacb-3984-4e35-b4c0-bc05abb54b30,cdp2w10_f03_s1_w5fbcc27d4-3290-42d6-9ae5-763b1e858866,cdp2w10_f03_s1_w46122c2be-649f-44b0-bcf4-51ce20359bd0,45,4525
695,48525.0,26118-F14-1,BRD-A39166114-001-05-3,26118,F14,1,SA1856628,BRD-A39166114,BROAD_CPD_ID,CCC(C)[C@H](NC(=O)NC1CCCc2ccccc12)C(O)=O,JBXTXIBJTZOOPH-KWCHVYNWSA-N,cdp2w9x2_f14_s1_w28871276f-32a4-404b-9401-7f35ab36b3b0,cdp2w9x2_f14_s1_w37fedc04e-fb80-4d37-974c-2eaa4342a580,cdp2w9x2_f14_s1_w1ad695a63-f924-4682-adb3-81178736b35f,cdp2w9x2_f14_s1_w51b532467-0bb3-48d8-ac94-99874d1e3ab7,cdp2w9x2_f14_s1_w403fd746b-c54c-4580-b3fa-537f6e20214f,65,4516
696,38451.0,25726-K13-1,BRD-K65732579-001-05-5,25726,K13,1,SA1859306,BRD-K65732579,BROAD_CPD_ID,Cc1oc(nc1CN1CCN(CC1)c1cnccn1)-c1cc(F)ccc1F,JCAIXRKQWLQDJH-UHFFFAOYSA-N,cdp2w12_k13_s1_w200b7eb34-d96c-41f9-8222-8d60f22f2c6f,cdp2w12_k13_s1_w3575d232f-e830-49b9-9530-5db980e527ae,cdp2w12_k13_s1_w1757560b9-2db8-405e-8c68-192d0c2fe89c,cdp2w12_k13_s1_w58edde2ba-cb33-4763-95f1-10b76b3864f9,cdp2w12_k13_s1_w4ab7814f5-24d4-497a-8665-7e47589b53c7,97,9301
697,20635.0,25567-M05-5,BRD-K37820685-001-05-4,25567,M05,5,SA1852783,BRD-K37820685,BROAD_CPD_ID,CN1CCN(CC1)S(=O)(=O)c1cccc(c1)C(=O)N(CC=C)c1nc(cs1)-c1ccccc1,JCIVNYNONXFQPG-UHFFFAOYSA-N,cdp2w11_m05_s5_w27ad8044e-434f-4ad2-9fe9-51f0eae69681,cdp2w11_m05_s5_w368efa7e7-def2-4c4e-b51b-c3a9f1848480,cdp2w11_m05_s5_w19a3bc287-3ce2-449d-8bac-f6cc7006b6b8,cdp2w11_m05_s5_w5b9474838-1926-4e6f-bf63-881468ad16e4,cdp2w11_m05_s5_w4e50e68dc-7af0-49ba-ba52-a59b890efa0b,39,1564
698,26555.0,25591-P20-3,BRD-K17307631-001-06-9,25591,P20,3,SA1858195,BRD-K17307631,BROAD_CPD_ID,Cc1cc(Oc2nc3c(C)cccn3c(=O)c2\C=C(/C#N)S(=O)(=O)c2ccc(Cl)cc2)ccc1Cl,JCJDJFGFPSSNLX-DEDYPNTBSA-N,cdp2w11_p20_s3_w26924da0c-4bd4-468e-b4f4-64dd002773c3,cdp2w11_p20_s3_w365cfbed8-5a04-4444-9891-071813ce9d27,cdp2w11_p20_s3_w1bbfff4f6-f07c-4dfe-95cc-8be103f96953,cdp2w11_p20_s3_w5f79dc2a6-42ac-4e03-a613-a670588cc8ea,cdp2w11_p20_s3_w483e28139-f002-4470-bdc9-1e30cfd90a5f,78,4029
699,11019.0,25382-K17-1,BRD-K76885144-001-06-2,25382,K17,1,SA1852521,BRD-K76885144,BROAD_CPD_ID,O=C(Cc1cccs1)NNC(=S)NC(=O)\C=C\c1ccccc1,JCUFETFRAJGEOW-CMDGGOBGSA-N,cdp2w10_k17_s1_w27c25f1e8-055a-4d90-a11b-b16a43014c11,cdp2w10_k17_s1_w3cc79a9e7-c458-44b2-98f1-69b876c3c3bb,cdp2w10_k17_s1_w1995afb2d-488d-4d42-aa1f-774eac0adf3e,cdp2w10_k17_s1_w54047b7ce-7631-4aea-9183-a608d6f2fee3,cdp2w10_k17_s1_w43c1f7c25-aee4-442e-9261-a3afafbf3782,25,4203
700,8436.0,24642-O19-4,BRD-K36944891-001-02-0,24642,O19,4,SA851866,BRD-K36944891,BROAD_CPD_ID,CNC[C@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@@H]1C)[C@@H](C)CO,JDNCUSTXITVPAM-COPLHBTASA-N,cdp2w3_o19_s4_w216cb9f78-18eb-4116-b1e6-a3759e65fba2,cdp2w3_o19_s4_w3dd93faa0-1606-459f-b5ee-753d75117744,cdp2w3_o19_s4_w15e245876-c30a-4568-b012-cff77d410fa8,cdp2w3_o19_s4_w5d592cce8-1470-4d25-8ef4-f09f5104713d,cdp2w3_o19_s4_w4f0ef491b-8bc7-4337-8829-c598f392a305,54,10025
701,8552.0,24644-O07-6,BRD-K60337438-001-02-6,24644,O07,6,SA850181,BRD-K60337438,BROAD_CPD_ID,CNC[C@@H]1Oc2cc(Br)ccc2S(=O)(=O)N(C[C@H]1C)[C@@H](C)CO,JDNCUSTXITVPAM-SUNKGSAMSA-N,cdp2w3_o07_s6_w24ee0ac12-fffc-4d84-b1d2-3b86309a72e1,cdp2w3_o07_s6_w3522a54fd-2cbd-46b7-ade5-0872d291e327,cdp2w3_o07_s6_w1242ee5ee-ee5d-4e94-89dd-ec1714b3b082,cdp2w3_o07_s6_w5c9e7ba3e-3aad-43ec-b563-28627ec3f9bf,cdp2w3_o07_s6_w433be5b23-6eb3-4a9e-a141-2dda2c8b0946,49,9670
702,8621.0,24645-P06-3,BRD-K64860758-001-01-7,24645,P06,3,SA849575,BRD-K64860758,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F,JDSMWWFCTGPOGF-CGQTXMLISA-N,cdp2w3_p06_s3_w234cd31cf-7cea-49b7-9cde-8fa9e6d437c9,cdp2w3_p06_s3_w3f0f036aa-7fb6-4f6b-b320-7aa133549d63,cdp2w3_p06_s3_w1c085a8f2-e93f-4264-ae91-b5a34f5b4585,cdp2w3_p06_s3_w583b2d82c-2e1c-491a-9310-7ba599479406,cdp2w3_p06_s3_w487bd4637-7ce9-47c8-bf2f-b43e3ac9656d,54,10266
703,8541.0,24644-J16-1,BRD-K80725855-001-01-4,24644,J16,1,SA860128,BRD-K80725855,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F,JDSMWWFCTGPOGF-GVNDJSPXSA-N,cdp2w3_j16_s1_w2308859d0-d0ad-442e-bb94-1771dbd0f2a4,cdp2w3_j16_s1_w32f089830-344f-4b83-84b8-0864f8f077aa,cdp2w3_j16_s1_w12933c674-c3df-4128-b7f2-44ee8db5986f,cdp2w3_j16_s1_w560e409cc-c251-4504-b3fc-9036b3195ad4,cdp2w3_j16_s1_w489f675f6-171f-440e-b73a-176f58c067ef,95,9920
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726,49757.0,26133-A10-3,BRD-K37029442-001-05-6,26133,A10,3,SA1855190,BRD-K37029442,BROAD_CPD_ID,Cc1cccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](Cc2ccccc2)C(=O)OCc2ccccc2)c1,JHRQHLQSBFCUSQ-QHCPKHFHSA-N,cdp2w9x2_a10_s3_w2b3a1b5eb-dcbc-4078-b1b0-d22692be19ab,cdp2w9x2_a10_s3_w3a7f78a1a-fe97-4eda-a562-2c71ac206f11,cdp2w9x2_a10_s3_w1720258b4-8c71-4ee9-a9ea-57175be0b64b,cdp2w9x2_a10_s3_w5c4ddf8d3-63de-4dec-9e3c-925637b63264,cdp2w9x2_a10_s3_w407995f2f-8b3e-4644-be09-ad47bdd0043a,82,2314
727,49813.0,26133-E22-5,BRD-K82401173-001-05-6,26133,E22,5,SA1853207,BRD-K82401173,BROAD_CPD_ID,CCOc1ccc(cc1)-n1nnc2c1ncn(CC(=O)N1CCCc3ccccc13)c2=O,JHXHUBRDXYJIRT-UHFFFAOYSA-N,cdp2w9x2_e22_s5_w223be7a19-a498-4dd7-acdf-5239cb1940e0,cdp2w9x2_e22_s5_w32c020fef-e490-439f-a963-1b864fadbe47,cdp2w9x2_e22_s5_w1d8c1c9df-f36a-41ba-af30-40710e3b2cc2,cdp2w9x2_e22_s5_w5dfd780e7-1c3d-49d2-a22e-94eea0d67f4b,cdp2w9x2_e22_s5_w4532c3cf7-9ae1-4744-9045-2506b40f8213,75,8973
728,30313.0,25663-N10-5,BRD-K96520375-001-05-3,25663,N10,5,SA1852458,BRD-K96520375,BROAD_CPD_ID,CCOC(=O)c1ccc(NC(=O)C(CC)CC)cc1,JHXUNUIAXSKPEP-UHFFFAOYSA-N,cdp2w12_n10_s5_w2fe024f56-f219-489a-956c-5286c337794f,cdp2w12_n10_s5_w3dbafb3ed-601d-4d1e-b60d-9bbf780e5e47,cdp2w12_n10_s5_w1c0c90ec7-e0b9-40b9-b7fa-579cdd4948f6,cdp2w12_n10_s5_w5f96c90b4-987a-4f81-9df1-75f300b6377f,cdp2w12_n10_s5_w4f84f4dfc-f278-466c-8e5f-69f66f4e2898,51,4460
729,29387.0,25641-P12-3,BRD-K38190084-001-05-8,25641,P12,3,SA1858384,BRD-K38190084,BROAD_CPD_ID,COc1ccccc1N1CC=C(NC1=O)c1cccc(c1)[N+]([O-])=O,JIAGZNMPGSZKSD-UHFFFAOYSA-N,cdp2w12_p12_s3_w253f7ebbb-a7bb-4713-86a0-0e83a9ae8980,cdp2w12_p12_s3_w394e11a78-129c-4c68-9787-cf517033092d,cdp2w12_p12_s3_w1241b7dbb-566c-4fd3-a382-aea868cfc1b7,cdp2w12_p12_s3_w5a2f11cdd-4a44-4c55-b22c-c726c73325fb,cdp2w12_p12_s3_w468731714-fe1f-46da-ae14-4cf69f3846f7,71,5381
730,22045.0,25572-D03-5,BRD-K10175503-001-05-4,25572,D03,5,SA1853639,BRD-K10175503,BROAD_CPD_ID,CCc1ccc2nc(O)c(CN(Cc3nnnn3Cc3ccco3)Cc3ccccc3)cc2c1,JINCUPVACKAPQS-UHFFFAOYSA-N,cdp2w11_d03_s5_w2f1fea882-82e4-464d-8e24-eef8b1d17a78,cdp2w11_d03_s5_w3bfc8e605-0e72-4d37-9c8c-6774748196ea,cdp2w11_d03_s5_w11bfff370-549e-45db-8018-8a5d9c87cf79,cdp2w11_d03_s5_w5490d763c-1bf6-4ade-b9e5-bfbf7a346f45,cdp2w11_d03_s5_w4f6bba73f-e806-4b77-bdae-b51bbdf15c4f,79,3048
731,10331.0,25376-N16-3,BRD-A53967473-001-04-3,25376,N16,3,SA1858287,BRD-A53967473,BROAD_CPD_ID,COc1cccc(c1)C1CC(Nc2nc(N)nn12)c1ccc(F)cc1,JITIYKVPTGBVMR-UHFFFAOYSA-N,cdp2w10_n16_s3_w2eb5bfcda-56be-415f-8b47-d060dd3143c0,cdp2w10_n16_s3_w3d608d6fd-b154-49c8-9d67-f506357ad690,cdp2w10_n16_s3_w1307f74e2-aa2b-41ca-89aa-fcac41507710,cdp2w10_n16_s3_w5476d06b9-cd8b-4d01-933c-64f81d78c020,cdp2w10_n16_s3_w4a4d603b2-80f5-43cc-b71b-4e294a05c9cd,56,8607
732,39703.0,25938-J02-5,BRD-A26384407-001-04-6,25938,J02,5,SA58229,chlorthalidone,INN,NS(=O)(=O)c1cc(ccc1Cl)C1(O)NC(=O)c2ccccc12,JIVPVXMEBJLZRO-UHFFFAOYSA-N,cdp2w8x2_j02_s5_w25e3461d5-009f-4f22-ac7d-f4c876d04c8e,cdp2w8x2_j02_s5_w3e37511d0-dc2f-4e3c-b5a4-9ac0fdb7a64f,cdp2w8x2_j02_s5_w1adfbb1d8-bd43-4e14-8854-f8b7caa52c60,cdp2w8x2_j02_s5_w55852071f-388d-4f45-a8f5-9b23aa2df6f4,cdp2w8x2_j02_s5_w4f4cd54e7-61a5-462f-a06a-50a5dd230466,40,685
733,25970.0,25588-N16-6,BRD-K87534453-001-06-8,25588,N16,6,SA1860625,BRD-K87534453,BROAD_CPD_ID,OC(=O)CSc1nc(nc2c3ccccc3oc12)-c1ccccc1,JJPOVMZLCXNDCU-UHFFFAOYSA-N,cdp2w11_n16_s6_w292aaed2d-8892-424e-9286-c016340c7312,cdp2w11_n16_s6_w376c69bfa-1f00-4230-8589-bd4342555c58,cdp2w11_n16_s6_w16ff6d538-6dd7-4832-aa2d-b01191e5286e,cdp2w11_n16_s6_w541117bea-94c2-4ffa-a457-baecc4fcfb96,cdp2w11_n16_s6_w46a4951b9-b912-46c5-9eb1-d90733f69fba,69,5419
734,10499.0,25378-I22-3,BRD-A59042375-001-04-8,25378,I22,3,SA1855373,BRD-A59042375,BROAD_CPD_ID,CCOC(=O)N1CCC(CC1)N1Cc2cccc(C(=O)NCC3CCN(CC(C)C)C3)c2C1=O,JKIWFSPGYAUEPD-UHFFFAOYSA-N,cdp2w10_i22_s3_w2f4e78de7-dc8e-46a9-a597-9e96c71384c6,cdp2w10_i22_s3_w374ead728-2bee-4773-8731-5741f55fc3aa,cdp2w10_i22_s3_w113fcae11-947c-4b6f-97b3-f9415a7a279f,cdp2w10_i22_s3_w5d8473b56-f8de-40b4-93ae-1d616b670fbb,cdp2w10_i22_s3_w486a25609-c63b-47bc-95cb-a0e1941e51aa,55,7658
735,49916.0,26133-J19-6,BRD-K69350688-001-04-3,26133,J19,6,SA1860260,BRD-K69350688,BROAD_CPD_ID,COC(C[C@@H](O)C[C@@H](O)COCc1ccccc1)OC,JKQSWJHBQZFSJX-UONOGXRCSA-N,cdp2w9x2_j19_s6_w233f677be-3b96-4cf3-9184-7bffa63587f9,cdp2w9x2_j19_s6_w3c541eef0-1dd6-47ed-852a-8816e20c8ad3,cdp2w9x2_j19_s6_w1d32469f3-4e6c-431f-85a0-d1b39964e89a,cdp2w9x2_j19_s6_w5a69edddd-ae87-4908-8fbc-debc2d2cfd8e,cdp2w9x2_j19_s6_w4a053e32c-ee8d-4044-a342-355743e838f7,86,9745
736,1471.0,24294-N07-2,BRD-A37776212-003-02-5,24294,N07,2,SA792162,ICI 204448,common,CN(C(CN1CCCC1)c1cccc(OCC(O)=O)c1)C(=O)Cc1ccc(Cl)c(Cl)c1,JKYJSFISYHSNOE-UHFFFAOYSA-N,cdp2bioactives_n07_s2_w22ffd171f-b4d3-4b35-84ee-1cc7f25ff71a,cdp2bioactives_n07_s2_w3fa5d30fa-9ecd-4bf3-8c75-037ffec1cc04,cdp2bioactives_n07_s2_w18eafff9c-9d4f-468c-a7b7-46bd14dc4c19,cdp2bioactives_n07_s2_w59cd3906e-65a9-4f15-99d4-12c326a4873d,cdp2bioactives_n07_s2_w4b63fed4b-a16d-4b78-88b3-623b966dc331,116,329
737,13633.0,25416-G18-5,BRD-K38805192-001-07-6,25416,G18,5,SA1861710,BRD-K38805192,BROAD_CPD_ID,COc1ccc(NC(=O)c2sc(SC)nc2N)cc1,JLAJOZJWUBPJDB-UHFFFAOYSA-N,cdp2w10_g18_s5_w2a859f2ed-92e0-41c4-9f15-25c282581004,cdp2w10_g18_s5_w31fd17d74-10b5-4ce5-84f1-a8dee58b1192,cdp2w10_g18_s5_w1e79ba8fe-ceba-4ac8-aa1a-8290d999524c,cdp2w10_g18_s5_w5c00bf2c1-90c9-466b-bb0b-bf2e9a2bb1a8,cdp2w10_g18_s5_w4d7cfb25c-51eb-4025-b5d4-0e006db9a5c7,89,2566
738,55726.0,26669-M22-2,BRD-K65657366-001-01-0,26669,M22,2,SA1457430,BRD-K65657366,BROAD_CPD_ID,Cc1ccccc1S(=O)(=O)N1C[C@H](O)COC[C@H]2O[C@@H](CC(=O)NCc3ccccc3Cl)CC[C@H]12,JLFHHDVKVXKGLO-PABCKOPISA-N,cdp2w13_m22_s2_w2a174603d-c2b6-475b-b7f5-36133da3ad10,cdp2w13_m22_s2_w38c4695c3-c1e5-4ade-a606-0ea90f295863,cdp2w13_m22_s2_w1872da7c7-7d8d-4872-9866-80304ad150bf,cdp2w13_m22_s2_w55dc4f52e-b83b-45bb-91d2-ea32ab5bb6a9,cdp2w13_m22_s2_w465cef962-be18-4c41-9786-f03bd60d3f23,69,10173
739,12667.0,25408-H12-5,BRD-K23337016-001-05-5,25408,H12,5,SA1858405,BRD-K23337016,BROAD_CPD_ID,NC(=S)N=Nc1c(O)n(Cc2ccc(F)cc2)c2ccccc12,JLJNYCOTJDVCSB-UHFFFAOYSA-N,cdp2w10_h12_s5_w2699ce3fd-f525-44e3-8d27-ee712d9d3461,cdp2w10_h12_s5_w3631a3a0f-ad29-4bc7-81e9-cb2b140d2306,cdp2w10_h12_s5_w1f2556cc9-13d0-451e-ae0f-acb1fcbbbabd,cdp2w10_h12_s5_w53a01278a-c754-448e-a060-2a9fefc91177,cdp2w10_h12_s5_w4a11eee92-7e86-4bf4-a1e7-375c1edca604,42,6446
740,47885.0,26110-I18-3,BRD-A96536816-001-05-8,26110,I18,3,SA1857363,BRD-A96536816,BROAD_CPD_ID,CC(OC(=O)c1snc(C(=O)NC2CCCCC2)c1N)C(=O)NC1CCCCC1,JLMSMGISUYQFSP-UHFFFAOYSA-N,cdp2w9x2_i18_s3_w22b182ee9-99e5-47ec-9147-717c06fb7393,cdp2w9x2_i18_s3_w3fe035116-5900-4386-af00-769e506f6280,cdp2w9x2_i18_s3_w1f93ae158-b767-42eb-a402-4c8ad70d7ce6,cdp2w9x2_i18_s3_w5c3177591-6686-439e-9b09-ed99779f22d7,cdp2w9x2_i18_s3_w4f65ee174-a7ef-4d85-a056-3c121d342654,46,1714
741,28543.0,25638-D20-5,BRD-K50345393-001-04-0,25638,D20,5,SA1857818,BRD-K50345393,BROAD_CPD_ID,Cc1cc(C)c(NC(=O)Cn2cc3CCCCc3n2)c(C)c1,JMCHPNQXMYTLMV-UHFFFAOYSA-N,cdp2w12_d20_s5_w2cbc9c995-8475-4c02-b475-308189a063c9,cdp2w12_d20_s5_w3c80fe686-97d8-4630-96ac-22dfeb26f054,cdp2w12_d20_s5_w183775bd0-5d93-41a2-adaa-3f1ed127ffbc,cdp2w12_d20_s5_w5b59ba9de-b197-462c-a4aa-30f445e2a7bb,cdp2w12_d20_s5_w442f93846-d113-45f7-ae29-9046eed7f3c9,62,1433
742,47131.0,26092-A13-5,BRD-K68705041-001-05-8,26092,A13,5,SA1857860,BRD-K68705041,BROAD_CPD_ID,CCOC(=O)c1c(N)scc1-c1ccco1,JMLBJOYPNPOBKV-UHFFFAOYSA-N,cdp2w9-au00026609_a13_s5_w20fb9f137-2aca-49de-9fe5-7a5b69691e71,cdp2w9-au00026609_a13_s5_w31466dfdb-a546-451f-b14b-d0793656eddf,cdp2w9-au00026609_a13_s5_w1a1e2914e-a069-489d-a5ea-f53c5a95e0fa,cdp2w9-au00026609_a13_s5_w5983b2964-e46e-4cd1-90d7-ceaab486d198,cdp2w9-au00026609_a13_s5_w4a1c380fe-08c1-43c0-b02e-cbc4292e7b4f,52,5690
743,7261.0,24509-A01-2,BRD-K99377470-001-02-6,24509,A01,2,SA91533,BRD-K99377470,BROAD_CPD_ID,CC(C)NC(=O)Nc1cccc2c1O[C@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C2=O,JMXMRSKNTVHTGA-HDMKZQKVSA-N,cdp2bioactives_a01_s2_w2603ba9fd-2866-43c1-b462-c9e8ef2fd4be,cdp2bioactives_a01_s2_w329da24e3-dfe7-4e48-bbae-c1267f12b8b5,cdp2bioactives_a01_s2_w1cce189ad-0743-4266-95bd-5f13f7e786f8,cdp2bioactives_a01_s2_w55288437a-a18d-473d-82d7-c2fba5e74f80,cdp2bioactives_a01_s2_w48fb120ba-4326-44f3-bb92-8b5b5cea423c,68,10092
744,53954.0,26216-N18-6,BRD-K07863795-001-05-7,26216,N18,6,SA1854862,BRD-K07863795,BROAD_CPD_ID,Cc1nc(cs1)-c1ccc(NC(=O)c2ccccc2)cc1,JNGXZFTYKGXDPW-UHFFFAOYSA-N,cdp2w9x2_n18_s6_w2848613dc-aaa3-4dee-b9d7-535f74154b7c,cdp2w9x2_n18_s6_w34d4d6a5e-33a1-4eff-a8fc-e222b2e09650,cdp2w9x2_n18_s6_w11abeb338-5701-4dc8-8f00-daed0877baef,cdp2w9x2_n18_s6_w500a2dbc9-a3d7-4b83-b925-e92c06c978d6,cdp2w9x2_n18_s6_w4089108b1-c1ae-47fc-91ae-b3f93255ba6d,107,7921
745,23955.0,25580-F14-1,BRD-K91994666-001-05-3,25580,F14,1,SA1852355,BRD-K91994666,BROAD_CPD_ID,CCCCC(=O)Nc1c(O)nc2ccccc2c1O,JNYOMKSHUGWGRK-UHFFFAOYSA-N,cdp2w11_f14_s1_w2dfab931b-3cb0-4285-9b3e-eb01b96e17ce,cdp2w11_f14_s1_w364ce6a3d-ef0b-402f-9c71-36b28d29d865,cdp2w11_f14_s1_w156e57302-99e8-4247-b65c-7433409333d5,cdp2w11_f14_s1_w563b53649-c57f-42f6-8990-2d94cbcb0c1d,cdp2w11_f14_s1_w40cbeb233-d9b8-46b3-8f2d-866ea751fb0c,68,4819
746,12412.0,25406-L17-2,BRD-K28167567-001-05-4,25406,L17,2,SA1858259,BRD-K28167567,BROAD_CPD_ID,CNC(=O)\C=C1/NC(C)(C)Cc2ccccc12,JOHLXSYQNOBEBL-WQLSENKSSA-N,cdp2w10_l17_s2_w2d133da4f-07f0-471b-98e5-8b0e7acc56ee,cdp2w10_l17_s2_w375729e08-c61f-45eb-a9bb-b49cc12e6eb5,cdp2w10_l17_s2_w163bf54de-c7ab-4d42-a0b7-ca2e017a1a18,cdp2w10_l17_s2_w52d3df454-e6ae-4831-a5a2-a1a503b75e11,cdp2w10_l17_s2_w4001f0400-b489-44bb-bdc9-db82dc922f13,62,3518
747,53381.0,26205-P04-3,BRD-K28115689-001-05-6,26205,P04,3,SA1854936,BRD-K28115689,BROAD_CPD_ID,N=C(NOC(=O)CCC1CCCC1)c1ccccc1,JPBPZIJXUXANRK-UHFFFAOYSA-N,cdp2w9x2-au00026617_p04_s3_w28bce28bf-826d-4e95-ac51-d688af34cb44,cdp2w9x2-au00026617_p04_s3_w3c929d469-5422-4efc-8380-f4f24756f46d,cdp2w9x2-au00026617_p04_s3_w1dad9bc60-86fa-4946-a143-529fcd4e6654,cdp2w9x2-au00026617_p04_s3_w56be4a4a0-1035-4ae3-a3a7-0340922a7808,cdp2w9x2-au00026617_p04_s3_w4dfca4cb4-a364-4a10-ba85-7f0b5fd613c8,66,2241
748,31179.0,25667-H03-1,BRD-K05105053-001-05-2,25667,H03,1,SA1854075,BRD-K05105053,BROAD_CPD_ID,COc1ccccc1N1CCN(CC1)C(=O)C1CCC(Cn2c(=S)[nH]c3ccccc3c2=O)CC1,JPBWSFGLZWQGEZ-UHFFFAOYSA-N,cdp2w12_h03_s1_w24bbd02c8-8783-4a49-b378-8056408865d8,cdp2w12_h03_s1_w3f16902ca-b501-47f2-ae97-311e47a31239,cdp2w12_h03_s1_w12cf75186-e16f-486e-a6e8-6cf1be4248bc,cdp2w12_h03_s1_w5871e9ad5-49dd-414c-aea4-17e6c28b7bf6,cdp2w12_h03_s1_w4a944226d-f801-4680-b253-99fba532df86,51,5317
749,10836.0,25380-O07-4,BRD-A56740231-001-06-9,25380,O07,4,SA1855995,BRD-A56740231,BROAD_CPD_ID,CC1CN(CC(C)N1)c1ccc(c(NCCOc2ccc(Cl)cc2)c1)[N+]([O-])=O,JPFRBOZKXOCNQU-UHFFFAOYSA-N,cdp2w10_o07_s4_w2433ea2dc-4b89-47f0-b9d4-c860b5cf11fa,cdp2w10_o07_s4_w337b55e73-6c0c-4ef2-98ed-2965f9d1f847,cdp2w10_o07_s4_w1b66c2aa6-4214-449c-97e2-c8cc293a6055,cdp2w10_o07_s4_w5152e3dab-0b25-4a38-aea9-0e27a199865f,cdp2w10_o07_s4_w4ac08a64f-edc5-4d6b-b0b3-ead28720121c,35,5855
750,9534.0,24753-N19-4,BRD-K33287655-001-01-5,24753,N19,4,SA1015517,BRD-K33287655,BROAD_CPD_ID,CO[C@@H]1CN(C)C(=O)c2ccc(NC(C)=O)cc2OC[C@@H](C)N(C[C@H]1C)C(=O)c1ccccc1F,JPQILOCSRFKHEV-HOZJOUCCSA-N,cdp2w5_n19_s4_w2fa1d7da0-b7c8-4ae2-b253-b5684ca43e43,cdp2w5_n19_s4_w35f0817e0-46e9-43d7-85b0-0d1815cc7d45,cdp2w5_n19_s4_w1841c7308-8a6e-4536-ab21-e9edb9b3f7fa,cdp2w5_n19_s4_w5d86048f5-cf52-4b09-9e08-56575f6f31eb,cdp2w5_n19_s4_w412e6cf0d-fbed-4573-a18d-5ecf3232df14,49,10336
751,26622.0,25592-D04-4,BRD-K08742100-001-05-2,25592,D04,4,SA1858026,BRD-K08742100,BROAD_CPD_ID,CCc1cc2c(CN3CCN(CCO)CC3)cc(=O)oc2cc1O,JQAWKPMGFWIPSL-UHFFFAOYSA-N,cdp2w11_d04_s4_w26f056a01-de09-46da-aea4-9fc7152e09a8,cdp2w11_d04_s4_w3eef98139-1cc6-410f-9422-794aedd54ba6,cdp2w11_d04_s4_w158467bdc-ef44-4bd3-ac2c-bd2fbded5c40,cdp2w11_d04_s4_w5f218ae65-9cc0-4488-baca-6c4c21379462,cdp2w11_d04_s4_w4617441e9-a07b-49f2-b9ba-a5fe6184e1fb,72,5517
752,38740.0,25738-G22-2,BRD-K40631496-001-06-7,25738,G22,2,SA1854012,BRD-K40631496,BROAD_CPD_ID,Oc1ccccc1C(=O)NN\C=C1/C(=O)NC(=O)N(CCc2ccccc2)C1=O,JQHGGNXOYQQDBA-NTCAYCPXSA-N,cdp2w12_g22_s2_w2d296889c-134d-4fef-add3-9ea3c54b2f33,cdp2w12_g22_s2_w33c7cb65e-9585-46eb-9364-39cdfc275fc7,cdp2w12_g22_s2_w1bbcf0940-6a9e-4002-aad7-fc27f8b2d651,cdp2w12_g22_s2_w5045d978a-ef25-4974-a42e-1ff0ebee855d,cdp2w12_g22_s2_w410a5d987-3820-4ae8-93b7-229463af53ed,97,8765
753,10720.0,25380-G22-2,BRD-K15999772-001-05-6,25380,G22,2,SA1853125,BRD-K15999772,BROAD_CPD_ID,Cc1cc2ncn(-c3ncnc4scc(-c5ccccc5)c34)c2cc1C,JQSJRYIIMMVOBB-UHFFFAOYSA-N,cdp2w10_g22_s2_w26cc12b6e-d0a6-4007-b45f-c75f256b50a7,cdp2w10_g22_s2_w3fa867ca6-1e06-494b-9e4c-52f88281e520,cdp2w10_g22_s2_w122025f74-5475-46c8-9fba-0935797ed3a4,cdp2w10_g22_s2_w5903be0d9-3941-4e3e-abe8-336b92501548,cdp2w10_g22_s2_w4ff6d6422-7a8f-4cf9-ba16-c2fa119db020,45,7975
754,46577.0,26071-E12-3,BRD-K37393297-001-05-2,26071,E12,3,SA1853599,BRD-K37393297,BROAD_CPD_ID,Cc1cc(C)nc(SCC(=O)c2ccc(O)c(O)c2)n1,JQXFBAGVXOGSNK-UHFFFAOYSA-N,cdp2w9x2_e12_s3_w237844c6c-36f5-4992-ac56-f6b41d5e458f,cdp2w9x2_e12_s3_w3758a1928-2c3e-4248-81b2-7e071d38f718,cdp2w9x2_e12_s3_w1e5a34179-198a-4988-9ed9-340e0cad54b1,cdp2w9x2_e12_s3_w5d9fd2c59-2c16-4c43-b1d4-278487db92c0,cdp2w9x2_e12_s3_w4578186dc-0c1e-4ae3-bd28-246fd0100d84,59,1310
755,18586.0,25492-G21-2,BRD-K61320284-001-05-9,25492,G21,2,SA1860364,BRD-K61320284,BROAD_CPD_ID,COC(=O)c1ccccc1NC(=O)Nc1ccc(Cl)cn1,JQZQAGGMWIDIOI-UHFFFAOYSA-N,cdp2w10-au00024360_g21_s2_w2b4d0ea06-ea67-4271-b24b-945ead1aebd0,cdp2w10-au00024360_g21_s2_w3c3f60efe-8325-4267-b01c-2c07785a83f6,cdp2w10-au00024360_g21_s2_w1b2bd6955-8ccc-41d0-863b-c365d1067e8c,cdp2w10-au00024360_g21_s2_w550393d86-dedd-406d-94ed-8a3e617c1049,cdp2w10-au00024360_g21_s2_w412003a2e-56b5-4ad8-af87-5f352d209292,57,2692
756,15781.0,25430-P07-5,BRD-K86743038-001-06-0,25430,P07,5,SA1860681,BRD-K86743038,BROAD_CPD_ID,COc1ccc(cc1OC)-c1cc(n2nc(cc2n1)C(=O)NCc1ccco1)C(F)(F)F,JRGHRLVWXOQJGK-UHFFFAOYSA-N,cdp2w10_p07_s5_w232117016-e8cc-4417-90a8-373e7bd169ae,cdp2w10_p07_s5_w3105501f3-faff-493c-8dc1-64748a7b6f3b,cdp2w10_p07_s5_w1771b43eb-5bfe-4a64-858a-751492f4858a,cdp2w10_p07_s5_w5111637fd-5672-4f23-9663-815a6c017a16,cdp2w10_p07_s5_w457c5fe11-aa62-41cf-b4a8-37d1687ef0bf,48,1740
757,32487.0,25678-A19-1,BRD-A78322124-003-09-0,25678,A19,1,SA1855043,dobutamine,INN,CC(CCc1ccc(O)cc1)NCCc1ccc(O)c(O)c1,JRWZLRBJNMZMFE-UHFFFAOYSA-N,cdp2w12_a19_s1_w2d3fa9bf7-dca9-4e96-8f35-985fbad19b50,cdp2w12_a19_s1_w3e8ac4528-82cc-44de-904d-40faeec220b5,cdp2w12_a19_s1_w1001ce4af-1638-4126-b9f4-d2c627a03f3f,cdp2w12_a19_s1_w500c5823a-9ba4-43dc-9c84-cfc4d45ddaba,cdp2w12_a19_s1_w442698f2a-921a-4c38-843a-0b4d40733f8e,41,563
758,15133.0,25426-N05-5,BRD-K44144588-001-16-5,25426,N05,5,SA1859094,BRD-K44144588,BROAD_CPD_ID,CC1(C)CC(=O)C(CC2C(=O)CC(C)(C)CC2=O)C(=O)C1,JSCUZLUQVFQIII-UHFFFAOYSA-N,cdp2w10_n05_s5_w262963eef-d5ba-4cac-b2ff-85dcb5deef94,cdp2w10_n05_s5_w331a8c624-63e2-4cfd-a9a0-553da3ed94b0,cdp2w10_n05_s5_w18ddec7b7-c7a7-415a-a01c-606c0611a74e,cdp2w10_n05_s5_w55ae240f8-07c3-4953-81a6-5a2ec21cafc1,cdp2w10_n05_s5_w4a4d8edeb-58c9-401d-8f5f-02f3c2f178ae,62,3592
759,13645.0,25416-I08-5,BRD-K56499794-001-06-9,25416,I08,5,SA1854082,BRD-K56499794,BROAD_CPD_ID,Cc1ccccc1N1C(=O)CSC1=C(C#N)C#N,JSJJZYVAUBHMLJ-UHFFFAOYSA-N,cdp2w10_i08_s5_w2b7f90676-a40b-4bf5-8723-e4f93ce34aa2,cdp2w10_i08_s5_w3942c3c78-9831-4e41-8846-362eed6c5100,cdp2w10_i08_s5_w15ac9c5d4-fb4e-46ca-b4c0-b13b224db056,cdp2w10_i08_s5_w50ff745d1-8b12-463b-9c75-a5806a50a469,cdp2w10_i08_s5_w4d50b6731-31b1-4f49-bad1-0f18dd7a219d,55,3229
760,25639.0,25587-H09-5,BRD-K98700383-001-04-2,25587,H09,5,SA1860167,BRD-K98700383,BROAD_CPD_ID,COc1ccc(cc1)\N=C1\CCc2ccccc2N1,JSPWKXVREJVMOS-UHFFFAOYSA-N,cdp2w11_h09_s5_w2b8868fd2-4676-4d00-8ab9-4a45f5a089ba,cdp2w11_h09_s5_w344d7b3ec-2afa-4a14-b09f-b90f3eba9c15,cdp2w11_h09_s5_w1fe17db61-0c92-4075-b11d-c8813cab9851,cdp2w11_h09_s5_w5a9b57c36-d328-434b-980a-d06f37faf2b1,cdp2w11_h09_s5_w4cea7fa07-cc00-42a7-a267-aad8eb7797d1,51,1762
761,56339.0,26753-D22-3,BRD-K31829694-001-01-9,26753,D22,3,SA1017314,BRD-K31829694,BROAD_CPD_ID,CC(C)(C)[S@@](=O)N1Cc2cc(nc(c2[C@H]1CCO)-c1cccc(c1)-c1cccnc1)C(=O)NCc1ccc2OCOc2c1,JSQFWOWYOCZIMF-ACXULAKISA-N,cdp2w13_d22_s3_w23dc693c3-9cfe-47a3-abb6-1d3ba4e46d74,cdp2w13_d22_s3_w39bd045bd-0705-4d4f-9ab1-1b79973b1a23,cdp2w13_d22_s3_w1a7389013-5944-4219-83b4-bf784fa95455,cdp2w13_d22_s3_w538d745fa-36d2-474b-a5ac-3481ad569910,cdp2w13_d22_s3_w4bdb9a672-7200-462d-9e11-71f6eefac092,128,10342
762,19845.0,25565-F03-1,BRD-K77665426-001-05-8,25565,F03,1,SA1859243,BRD-K77665426,BROAD_CPD_ID,Cc1cc(ccc1F)S(=O)(=O)Nc1ccc2n(C)c(=O)n(C)c2c1,JUBCMJWXGXWPHB-UHFFFAOYSA-N,cdp2w11_f03_s1_w2c6fbc848-dc3f-4b08-b937-c585ddfb2cc7,cdp2w11_f03_s1_w3f8c88d4a-0aa1-43e7-ab45-b6bfe15010ff,cdp2w11_f03_s1_w1d2fd4e28-e962-41cb-9abb-62f3089086a5,cdp2w11_f03_s1_w5a4a54f2c-b8b3-4c26-bd0a-f51d3576d5eb,cdp2w11_f03_s1_w443d6b4cc-cb68-4cb7-9919-ac373440a1dd,64,1598
763,11972.0,25403-B20-6,BRD-K16193965-001-06-0,25403,B20,6,SA1855033,BRD-K16193965,BROAD_CPD_ID,Fc1ccc(cc1)S(=O)(=O)c1nc(oc1N1CCCCC1)-c1ccccc1F,JUCSIFZNOGBBAE-UHFFFAOYSA-N,cdp2w10_b20_s6_w2072be7b6-486b-46fb-8ff4-88b5a798b2fb,cdp2w10_b20_s6_w34feeb279-c14b-4e2c-aa9c-d596ce9ffa71,cdp2w10_b20_s6_w1d781f5b3-6388-4ad4-a383-493c86f5b019,cdp2w10_b20_s6_w5e7113225-0c61-4dd5-a62d-81bf8c2b0de1,cdp2w10_b20_s6_w4d2f53cfb-2197-4b1e-84cc-38eed501638e,31,4073
764,49289.0,26126-H11-3,BRD-K80092929-001-06-0,26126,H11,3,SA1859375,BRD-K80092929,BROAD_CPD_ID,CCCCOc1ccc(cc1)-c1nnn(CC(=O)NCc2ccco2)n1,JUHBAVDRLGEFCZ-UHFFFAOYSA-N,cdp2w9x2_h11_s3_w252f8065c-46d8-4fda-8d8d-cd581f561c9c,cdp2w9x2_h11_s3_w3f4370f49-c5cb-42bc-8c59-013bd667f749,cdp2w9x2_h11_s3_w1bddee895-3518-4ecb-80f3-a0504bd78c78,cdp2w9x2_h11_s3_w55319e683-b915-40f3-83a7-b8a5d733b0ce,cdp2w9x2_h11_s3_w4d5810314-2aed-48f3-b6ba-75bf841e589d,25,2679
765,55640.0,26626-I17-6,BRD-K85275903-001-01-7,26626,I17,6,SA1322479,BRD-K85275903,BROAD_CPD_ID,Cc1cccc(c1)S(=O)(=O)N[C@@H]1CC[C@@H](CCNS(=O)(=O)c2ccccc2F)O[C@@H]1CO,JUMQDWHPHZAWJD-PWIZWCRZSA-N,cdp2w7x2_i17_s6_w2b6133f70-1e10-4b4c-beb8-eaf7ac1fa617,cdp2w7x2_i17_s6_w3a73c8f10-8340-49df-a67d-0b3aaefce58a,cdp2w7x2_i17_s6_w1e11a338b-5605-4f60-9a27-e389bcfeb2bf,cdp2w7x2_i17_s6_w52f77ff53-af6f-4b1d-b3af-7ff8fee37526,cdp2w7x2_i17_s6_w4f04c56e2-1619-43a4-a156-1188deba595c,70,9955
766,53961.0,26216-O17-1,BRD-A03909373-001-05-4,26216,O17,1,SA1858860,BRD-A03909373,BROAD_CPD_ID,CCC1(C)Cc2c(CS1)sc1[nH]c(=O)[nH]c(=O)c21,JUQCFBFVMLSKFD-UHFFFAOYSA-N,cdp2w9x2_o17_s1_w283101df6-aa27-461b-a821-2d6db4a63ab5,cdp2w9x2_o17_s1_w33625e11f-9432-42fc-8fa6-15599ce8e6db,cdp2w9x2_o17_s1_w1f4ec22f5-7f1a-4694-8416-5f3c6f45a9b5,cdp2w9x2_o17_s1_w58aeb414c-0fba-43c8-a8c0-7dbae90cba03,cdp2w9x2_o17_s1_w4b37fedd5-3f13-45d0-91c5-781f8991ebfb,56,2385
767,36868.0,25704-N04-2,BRD-K91234654-001-05-8,25704,N04,2,SA1859934,BRD-K91234654,BROAD_CPD_ID,O=C(CSc1nnc2sc3ccccc3n12)c1ccco1,JURPOFUGWOBVIO-UHFFFAOYSA-N,cdp2w12_n04_s2_w2558c2cf2-362f-4f3e-87d5-87176e492ec5,cdp2w12_n04_s2_w3752e521c-0d9a-48a2-923f-42301d4ba8b3,cdp2w12_n04_s2_w19587303f-4461-4b0b-888c-de2082d594f5,cdp2w12_n04_s2_w54f68fd07-b188-490d-835b-6d50dcfabbe0,cdp2w12_n04_s2_w44d380ff5-b806-490e-8bb6-7be542776796,47,2462
768,3808.0,24307-H01-5,BRD-K08316444-001-02-7,24307,H01,5,SA58038,rotenone,primary-common,COc1cc2OC[C@H]3Oc4c5C[C@@H](Oc5ccc4C(=O)[C@H]3c2cc1OC)C(C)=C,JUVIOZPCNVVQFO-HBGVWJBISA-N,cdp2bioactives_h01_s5_w29ed73914-2187-4707-83d1-b2fb45e296a3,cdp2bioactives_h01_s5_w3586daca9-3cab-4afd-9416-15bf88ea5646,cdp2bioactives_h01_s5_w18ef504c8-2fb1-4764-a64b-ceb80c2cd07b,cdp2bioactives_h01_s5_w55c7988b3-c9b3-42f4-9b03-b646d67ea4ba,cdp2bioactives_h01_s5_w407935e01-ce23-4f2c-95ee-d3cbc5623bda,5,74
769,30221.0,25663-I08-3,BRD-K70940371-001-05-7,25663,I08,3,SA1852601,BRD-K70940371,BROAD_CPD_ID,Brc1ccc2[nH]c(=S)n(CCCC(=O)N3CCN(CC3)c3ccccn3)c(=O)c2c1,JVDAHWMLZLAMIO-UHFFFAOYSA-N,cdp2w12_i08_s3_w29f9568d8-95d6-4254-82ea-849c1187dca4,cdp2w12_i08_s3_w36e964f52-1c40-4220-8b24-48d3c36ba9eb,cdp2w12_i08_s3_w1460987de-24f6-48a4-a3ad-9eafde0c93a8,cdp2w12_i08_s3_w5a94fe6e6-1a3f-46cd-89cc-45555d07e941,cdp2w12_i08_s3_w485df8fda-2cd9-4cd1-9bc0-4a7779358232,43,3476
770,259.0,24277-K09-2,BRD-K32755366-003-03-4,24277,K09,2,SA83621,reserpic acid,primary-common,CO[C@H]1[C@H](O)C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]1C(O)=O,JVHNBFFHWQQPLL-WOXROFTLSA-N,cdp2bioactives_k09_s2_w26fbfb5ed-c961-4362-a96a-03c425f70127,cdp2bioactives_k09_s2_w35162f6ef-c299-4c30-aa35-d831088a8f0c,cdp2bioactives_k09_s2_w1d87618e2-481d-4330-9591-85541bc17d3e,cdp2bioactives_k09_s2_w5720ebf98-3af8-4720-bd06-42c2be609342,cdp2bioactives_k09_s2_w44ef52069-b06e-49ec-b282-6980d5a82ed1,100,1148
771,8186.0,24619-M18-3,BRD-K11231529-001-01-3,24619,M18,3,SA859825,BRD-K11231529,BROAD_CPD_ID,COc1ccc(NC(=O)N(C)C[C@H]2Oc3cc(ccc3S(=O)(=O)N(C[C@H]2C)[C@H](C)CO)C#CCC(C)C)cc1,JVNQANUBSNFBGV-VHFRWLAGSA-N,cdp2w3_m18_s3_w2527ae06e-4b01-42c2-8d79-e42acad2f466,cdp2w3_m18_s3_w3077aac96-7432-4c2b-a3d7-4830ef65cb5e,cdp2w3_m18_s3_w1ffb8fc68-8c19-4644-a390-b8e4046a82cb,cdp2w3_m18_s3_w56b0ac49d-179e-44d8-b681-89ab2320cbb9,cdp2w3_m18_s3_w4dc262ba4-5554-43e8-b7e8-492cc43b3559,126,10474
772,12231.0,25406-B13-1,BRD-K04930381-001-05-7,25406,B13,1,SA1859520,BRD-K04930381,BROAD_CPD_ID,Cn1c2ccc(\C=C(\C#N)c3ccccc3F)cc2n(C)c1=O,JVNWNXCBLKEJCZ-LCYFTJDESA-N,cdp2w10_b13_s1_w20fd3729b-7d27-4a62-b071-06849f54576e,cdp2w10_b13_s1_w3330f59e8-72b8-41c4-8e22-ca29433f1150,cdp2w10_b13_s1_w1b20fbb2c-6107-4181-bd2b-994c8556d995,cdp2w10_b13_s1_w5a9906e88-1c56-4f37-9405-b9a219ae57d2,cdp2w10_b13_s1_w446548388-b76a-4171-add5-0094b580c2d0,36,3293
773,21568.0,25570-L09-2,BRD-K87643564-001-05-5,25570,L09,2,SA1855446,BRD-K87643564,BROAD_CPD_ID,COc1ccc(NC(=O)c2cc(Cl)ccc2NC(=O)c2ccco2)c(OC)c1,JVRULJDJPNCHCE-UHFFFAOYSA-N,cdp2w11_l09_s2_w286ac5893-a382-4e44-819b-065b97ec9254,cdp2w11_l09_s2_w3c8d12de5-50b8-4517-9c21-033fd1e5760f,cdp2w11_l09_s2_w19f130524-8e48-4da9-97c8-424d6c02aa24,cdp2w11_l09_s2_w53c527a58-5174-4914-8f0c-f9bd2ed514ab,cdp2w11_l09_s2_w42a68d922-4fb1-4e95-a532-cef495783055,51,1452
774,48781.0,26124-B14-5,BRD-A54668105-001-05-9,26124,B14,5,SA1852085,BRD-A54668105,BROAD_CPD_ID,Fc1ccc(CN2C3CCCC2CC(C3)NC(=O)Nc2ccccc2-c2ccccc2)cc1,JVXQTICAQRFDBP-UHFFFAOYSA-N,cdp2w9x2_b14_s5_w270dca0df-ae7d-4203-a9ab-8faf7d9fd1df,cdp2w9x2_b14_s5_w307807b87-54e8-41ee-a9a8-29a94b3d5f46,cdp2w9x2_b14_s5_w1b542a499-1b7e-41d9-9e17-53e56233befa,cdp2w9x2_b14_s5_w56d5f86d5-422b-4ddd-ae88-8297f98197fb,cdp2w9x2_b14_s5_w49cf372df-b6d8-4121-9a60-58105354e212,53,2977
775,19115.0,25553-A12-3,BRD-K01990668-001-06-6,25553,A12,3,SA1860093,BRD-K01990668,BROAD_CPD_ID,C(CC1=CCCCC1)Nc1ncnc2n(ncc12)-c1ccccc1,JWIWASBOBFIAPX-UHFFFAOYSA-N,cdp2w11-au00029679_a12_s3_w2595883f1-8bf9-4345-8057-9d9c9963110d,cdp2w11-au00029679_a12_s3_w3149c097c-df99-4fa2-811d-836ac2355db0,cdp2w11-au00029679_a12_s3_w13e2d657c-453a-4915-adc0-95f1fe9e8257,cdp2w11-au00029679_a12_s3_w547cfbe50-c2a0-4c69-9e7f-6907f669281e,cdp2w11-au00029679_a12_s3_w4888a1fec-40b6-4e85-9b81-c6ded98ecd56,47,4443
776,17260.0,25438-H05-2,BRD-K80211627-001-05-3,25438,H05,2,SA1855246,BRD-K80211627,BROAD_CPD_ID,Cc1ccccc1N1CCN(CC1)C(=S)c1ccc(cc1)[N+]([O-])=O,JWSRJFBZZLXWFB-UHFFFAOYSA-N,cdp2w10_h05_s2_w2ab81e5bd-acad-49aa-b0ba-b1da62a37f2c,cdp2w10_h05_s2_w3ebca4754-fb11-4567-87c5-70189ae0feb3,cdp2w10_h05_s2_w1f144dd5f-8a62-480d-a758-f26fec9d7d22,cdp2w10_h05_s2_w545f89781-d198-40c4-b74e-82dc80a010a3,cdp2w10_h05_s2_w45d7ab624-a3b6-4427-ae8f-287b913d339a,52,1960
777,47175.0,26092-E05-1,BRD-K37619154-001-05-2,26092,E05,1,SA1860391,BRD-K37619154,BROAD_CPD_ID,CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCC1(CC1)c1ccccc1,JWUMTZQBXUPHNJ-FCHUYYIVSA-N,cdp2w9-au00026609_e05_s1_w27e009076-642e-432e-8715-9462ac3835c2,cdp2w9-au00026609_e05_s1_w3a43c02c0-5fb8-4e19-bd80-8efcca5825ab,cdp2w9-au00026609_e05_s1_w1f61ea4a1-548a-4152-a9ff-a4038ccb554f,cdp2w9-au00026609_e05_s1_w51cae48ec-d90c-4255-8dbb-8a582b22a5b1,cdp2w9-au00026609_e05_s1_w49c78bd63-bd7d-4da1-9499-178c88aabc06,10,6427
778,12709.0,25408-K21-5,BRD-K66443463-001-08-1,25408,K21,5,SA1857857,BRD-K66443463,BROAD_CPD_ID,Clc1ccc(cc1)C(=O)OCCN1C(=O)c2cccc3c(ccc(C1=O)c23)N1CCOCC1,JWZRLHFDDPZSSU-UHFFFAOYSA-N,cdp2w10_k21_s5_w23b27b053-c691-429e-bc41-c0320590e1c7,cdp2w10_k21_s5_w3bd878cf7-bc64-458b-a641-1780ca140dcc,cdp2w10_k21_s5_w19d490fbb-258c-424e-9aa0-3498d14f4c06,cdp2w10_k21_s5_w5ea1fc423-f53e-4abd-ba3d-0883c89e83df,cdp2w10_k21_s5_w43fd32a42-fab7-47d7-9f71-8e4ccdcd1d8b,9,8966
779,39773.0,25939-B09-3,BRD-A04322457-003-03-9,25939,B09,3,SA58354,isoprenaline,INN,CC(C)NCC(O)c1ccc(O)c(O)c1,JWZZKOKVBUJMES-UHFFFAOYSA-N,cdp2w8x2_b09_s3_w2ae1eda09-8e67-45e8-968d-a33b68bb7389,cdp2w8x2_b09_s3_w3231b5f5a-c57c-4b8a-b26f-9acb79b53e01,cdp2w8x2_b09_s3_w1cb658abf-8320-4db5-8ad8-ee2d14700a5d,cdp2w8x2_b09_s3_w54bec7ce6-4f12-45ad-b6f2-19b95fc09e41,cdp2w8x2_b09_s3_w4a8765748-241b-41e4-884c-24ecc0170d55,48,52
780,36634.0,25704-B18-2,BRD-K85819329-001-06-7,25704,B18,2,SA1854149,BRD-K85819329,BROAD_CPD_ID,Cc1ccc(cc1)C(O)(C(=O)NNc1ccccn1)c1ccc(C)cc1,JYLXQQVVSIIMIO-UHFFFAOYSA-N,cdp2w12_b18_s2_w26b4bd114-3747-4617-9388-722c988e58cf,cdp2w12_b18_s2_w3a0186888-f62b-4e54-a81a-457c6059e70b,cdp2w12_b18_s2_w1be555c50-0a1e-4b67-a418-1c150ec5eb3a,cdp2w12_b18_s2_w5ceeea5e4-bc02-44e7-b370-81a254fe6ff8,cdp2w12_b18_s2_w43c50e843-f482-4aa8-b534-11ccea530038,26,2993
781,21444.0,25570-E20-4,BRD-K79410675-001-07-1,25570,E20,4,SA1859420,BRD-K79410675,BROAD_CPD_ID,CN(C)S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)c1ccc2OCC(=O)Nc2c1,JYTPKLIVMPOFST-UHFFFAOYSA-N,cdp2w11_e20_s4_w26ac0c3e7-7d95-4013-bbb5-e58786edc099,cdp2w11_e20_s4_w3dd40e764-d15e-4cc2-aa2f-8447b57b558e,cdp2w11_e20_s4_w1e8fa79fa-be77-4b14-b9d9-2c535cefdf80,cdp2w11_e20_s4_w56ee0419b-02ef-4ec9-9896-029b00243c64,cdp2w11_e20_s4_w478ffed30-e2c8-45a7-a7d9-941b7ccc557f,66,4296
782,28246.0,25605-C13-2,BRD-K49829829-001-08-2,25605,C13,2,SA1858211,BRD-K49829829,BROAD_CPD_ID,Clc1ccc(C(=O)Nc2nnc(o2)-c2ccc3CCCCc3c2)c(Cl)c1,JYYQAILVCFGHGN-UHFFFAOYSA-N,cdp2w11-au00029692_c13_s2_w2e0a9535f-8599-4c27-ab93-1471556316a2,cdp2w11-au00029692_c13_s2_w38e59bb11-a65f-485c-8903-d13c978511fd,cdp2w11-au00029692_c13_s2_w163c0d75c-b435-4166-8c8c-981a43844bc4,cdp2w11-au00029692_c13_s2_w5fccb53a7-4987-4b51-b73e-b7f8d10d261b,cdp2w11-au00029692_c13_s2_w44ee46827-ba0e-4c1c-9fa4-d2e81ec6dbc4,40,6236
783,50703.0,26140-A07-1,BRD-K20061970-001-05-8,26140,A07,1,SA1852837,BRD-K20061970,BROAD_CPD_ID,CC1CCN(CC(=O)c2cc(C)n(c2C)-c2ccc(F)cc2)CC1,JZCVNTHDAGQJFQ-UHFFFAOYSA-N,cdp2w9x2_a07_s1_w2b7e70af8-1581-4f38-9011-787a3ef6e84a,cdp2w9x2_a07_s1_w397a70b43-3eab-450d-89fc-9dc6c6de4e30,cdp2w9x2_a07_s1_w173957305-9793-448f-a6ea-73474ff9d6a2,cdp2w9x2_a07_s1_w504c86c9d-de33-45b0-8bb4-c3d24e36186b,cdp2w9x2_a07_s1_w45dce6d04-2f41-4bc1-9b01-5c6fa81965c7,59,6593
784,20315.0,25566-M10-3,BRD-A77047565-001-06-0,25566,M10,3,SA1861652,BRD-A77047565,BROAD_CPD_ID,CCOC(=O)c1sc2ncnc(NCC(N(C)C)c3cccs3)c2c1C,JZEWNXLPVCBZMQ-UHFFFAOYSA-N,cdp2w11_m10_s3_w2282a0b8c-d2bb-4206-b13f-caccf41a2550,cdp2w11_m10_s3_w3ec7cc566-cab2-4eb6-b57e-a9f8b15d49ff,cdp2w11_m10_s3_w1d71a569b-7065-435c-914a-a17428533dac,cdp2w11_m10_s3_w540dd6069-282e-4012-aba0-d26ff77b0d2a,cdp2w11_m10_s3_w413cc1f0e-de01-49e2-92ed-fd9c413bdcff,60,8834
785,27746.0,25598-M16-6,BRD-K90562751-001-04-8,25598,M16,6,SA1852777,BRD-K90562751,BROAD_CPD_ID,Cn1cc(Br)c(n1)C(=O)NNC(=O)c1ccc(Br)cc1,JZKMEYUHZBAFIO-UHFFFAOYSA-N,cdp2w11_m16_s6_w268c7410f-63c9-47bc-bfb8-71babd34680e,cdp2w11_m16_s6_w34e14bd0a-d773-48e5-9593-b75f0df7e1c0,cdp2w11_m16_s6_w16bf83da5-3e4a-4e23-b357-cc7361be5966,cdp2w11_m16_s6_w5159b1bab-b8a3-4c3e-b872-bf5b274a74d3,cdp2w11_m16_s6_w488885a59-bc99-45ce-a8b8-6c66cff94151,87,5153
786,7713.0,24562-G05-4,BRD-K28282432-001-01-3,24562,G05,4,SA102544,BRD-K28282432,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2ccccc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C,KAHNNCGHTWSOBA-SEAFADMZSA-N,cdp2bioactives-au00026722_g05_s4_w2551c552f-c916-41c0-a29b-cf5d0ee8c4f3,cdp2bioactives-au00026722_g05_s4_w350404557-8387-40b1-bf00-dd5d45133aa7,cdp2bioactives-au00026722_g05_s4_w1ebb91e48-da8e-4600-981f-735f4f15cb36,cdp2bioactives-au00026722_g05_s4_w51fec1e22-483a-4d3f-9c7d-8dcbee124e3e,cdp2bioactives-au00026722_g05_s4_w468c94e6e-a4c4-4f3a-b7d3-cdcb55c1a412,123,9985
787,7281.0,24512-A11-4,BRD-A99639428-001-05-7,24512,A11,4,SA1855996,BRD-A99639428,BROAD_CPD_ID,COc1ccccc1Nc1nn2c(nc3cc(ccc3c2=O)C(=O)N2CCCC(C)C2)s1,KAODUXUKZKDUMM-UHFFFAOYSA-N,cdp2w10_a11_s4_w2c2d76dbb-2a6d-46a3-adbd-6c1aba96e949,cdp2w10_a11_s4_w39861e862-0fb9-4e13-a467-031f13b8b090,cdp2w10_a11_s4_w19842efe0-d3a0-4759-905e-787036a0eea0,cdp2w10_a11_s4_w5cb44ebef-698d-4a74-a19f-82cfcf116543,cdp2w10_a11_s4_w46b9be4f5-96e0-4c19-abd7-9a7f65afeadd,65,6397
788,36800.0,25704-L13-6,BRD-A29110038-001-05-6,25704,L13,6,SA1861700,BRD-A29110038,BROAD_CPD_ID,CC1=CC(C)(C)N2C(=O)C3(c4cccc1c24)c1ccc(O)cc1OC(N)=C3C#N,KAVKFLFQNFYHGR-UHFFFAOYSA-N,cdp2w12_l13_s6_w29d261433-782c-4f63-bc88-77132fcbb761,cdp2w12_l13_s6_w3793b0274-8e30-48aa-ae3c-29a3b8e8d238,cdp2w12_l13_s6_w124b90a1b-2106-4eb0-8ccd-253933208aea,cdp2w12_l13_s6_w5405816c6-6b0b-41ed-9b14-d5be8e72eb07,cdp2w12_l13_s6_w4f85d3be8-0b02-44a2-8f0c-8cd1d83d5a7b,67,1655
789,52513.0,26202-P06-5,BRD-A04445933-001-07-7,26202,P06,5,SA1860464,BRD-A04445933,BROAD_CPD_ID,CC1CCCN(CCCNC(=O)c2cc3c(Cl)nc4ccccc4c3s2)C1,KBQSNNCVJNKFHP-UHFFFAOYSA-N,cdp2w9x2-au00026617_p06_s5_w251fc4efb-054f-4e71-883a-b0aa6a493811,cdp2w9x2-au00026617_p06_s5_w34ba99c87-7aaf-40d9-a8ac-3f10bdcac39c,cdp2w9x2-au00026617_p06_s5_w1306e05f0-2aa1-4a6f-a1b1-47dec9d6e29c,cdp2w9x2-au00026617_p06_s5_w5f50e7bab-f19e-4c1d-b4cf-7de346e0e1e1,cdp2w9x2-au00026617_p06_s5_w45b84b6e3-900e-4964-b223-c9d252cf7dc5,40,6023
790,23759.0,25579-L19-3,BRD-A68777930-001-05-3,25579,L19,3,SA1853274,BRD-A68777930,BROAD_CPD_ID,COc1ccc(cc1OC)C1c2ccc3ccccc3c2Oc2ncn(CCCO)c(=N)c12,KBSZBAOBMABSQV-UHFFFAOYSA-N,cdp2w11_l19_s3_w2d2a242c1-3283-49de-a071-312c9661a655,cdp2w11_l19_s3_w3cec13a32-abc6-4d0d-a577-23d5818765bc,cdp2w11_l19_s3_w14b689124-552e-45f9-a379-7c4390a2f3d4,cdp2w11_l19_s3_w5caffad09-a5e6-4e4d-8958-a8390dbaae95,cdp2w11_l19_s3_w4a434b3f2-b19b-4d2d-b5ca-747dc8cc4c15,50,8925
791,12361.0,25406-I12-5,BRD-K58908981-001-06-0,25406,I12,5,SA1862011,BRD-K58908981,BROAD_CPD_ID,Cc1[nH]c2ccccc2c1CCNC(=O)c1ccc2C(=O)c3ccccc3C(=O)c2c1[N+]([O-])=O,KCGSIUAAEXGOFA-UHFFFAOYSA-N,cdp2w10_i12_s5_w24116716d-ae5e-411b-b835-7f70634c3ed7,cdp2w10_i12_s5_w3db5e9e5b-8100-4dd3-befb-1b59824fcb7e,cdp2w10_i12_s5_w16280ad01-f6f1-469c-a273-c95d044750a6,cdp2w10_i12_s5_w585d81746-a01b-49d7-a501-4e1359d5db6a,cdp2w10_i12_s5_w410552e5d-5ce8-46f2-8bd9-cfded5e08171,23,1889
792,27075.0,25593-M20-1,BRD-K07615667-001-06-4,25593,M20,1,SA1852317,BRD-K07615667,BROAD_CPD_ID,FC(F)(F)c1cc(Oc2ccccc2Cl)nc(n1)-c1ccccn1,KCIGSSKTLZLPQL-UHFFFAOYSA-N,cdp2w11_m20_s1_w2d0b8ca32-2691-4dbd-b5d8-5146ce0cd06b,cdp2w11_m20_s1_w3a95ee968-1ef7-4f19-a097-3d56d6ca4acb,cdp2w11_m20_s1_w10455e3d8-a3fb-4a4b-874b-2abab9e13645,cdp2w11_m20_s1_w56c06d5d5-a21e-45f7-8bfb-d912d518a5f7,cdp2w11_m20_s1_w44f7b59cf-12e4-4f68-b753-30d6ba5abd49,46,7877
793,7994.0,24602-K01-3,BRD-K17965071-001-01-2,24602,K01,3,SA837961,BRD-K17965071,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1,KCOGFDLBSVUITM-FGSXEWAUSA-N,cdp2w3_k01_s3_w2616d1288-3f34-4fe8-8b3e-1b210c047193,cdp2w3_k01_s3_w37f7d18dc-8fb6-4d50-9175-3ac547ba3c2d,cdp2w3_k01_s3_w159a60594-9783-4af7-ac9d-367cc027e884,cdp2w3_k01_s3_w5f1f811f6-bda4-4294-a4eb-b687f3dd585c,cdp2w3_k01_s3_w41fea5512-3b3e-4b1b-9a24-a97f41348357,123,10167
794,8017.0,24604-G06-2,BRD-K86986466-001-02-5,24604,G06,2,SA836676,BRD-K86986466,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)CN2CCOCC2)Oc2ncc(cc2C1=O)-c1cncnc1,KCOGFDLBSVUITM-NJNPRVFISA-N,cdp2w3_g06_s2_w212933ff2-3a35-48eb-b7ea-b2c931ac36f3,cdp2w3_g06_s2_w30b19ee90-f9fb-4c4b-9278-15a9cbc7422c,cdp2w3_g06_s2_w15efcc993-517a-4897-8977-651e38550de8,cdp2w3_g06_s2_w59f11e9c9-c8e1-4f88-abce-be7094fe6811,cdp2w3_g06_s2_w42536577c-5733-4be6-b564-034684e6097d,144,9767
795,49573.0,26128-I03-5,BRD-A39031631-001-05-3,26128,I03,5,SA1855782,BRD-A39031631,BROAD_CPD_ID,Clc1cccc(c1)-c1cccc(NC(=O)C2CCN(CC3CCOC3)CC2)c1,KCTKQIJFSAJZNG-UHFFFAOYSA-N,cdp2w9x2_i03_s5_w277c807b7-583f-45d6-b386-890b1ea59ab2,cdp2w9x2_i03_s5_w390276a56-343d-4e49-bc17-15ff769ee713,cdp2w9x2_i03_s5_w1c4be747f-99a3-4a7b-8cdd-41b87f044e58,cdp2w9x2_i03_s5_w5a86340fe-ad58-46e8-b662-29f988192ffb,cdp2w9x2_i03_s5_w4b72d6a38-4497-4192-bd6b-ce3329c30696,33,6717
796,36742.0,25704-J05-2,BRD-K04242120-001-05-3,25704,J05,2,SA1858797,BRD-K04242120,BROAD_CPD_ID,COc1ccccc1-c1nnc2sc(COc3ccc(Cl)cc3Cl)nn12,KDEIWIGENYCHKU-UHFFFAOYSA-N,cdp2w12_j05_s2_w28a9d046d-633e-4d32-9414-29215f03bd90,cdp2w12_j05_s2_w30787fd47-6b62-469a-bc09-3944daee35ac,cdp2w12_j05_s2_w1ecb17a1a-e83c-4265-931b-ac28d36cc0bb,cdp2w12_j05_s2_w5aae332a7-5807-420e-b47e-8dc4f92277f6,cdp2w12_j05_s2_w4e7ce68cc-cac6-4bde-b764-933095b2d99c,33,8036
797,47186.0,26092-E10-6,BRD-K58586013-001-05-8,26092,E10,6,SA1857176,BRD-K58586013,BROAD_CPD_ID,Cc1c([nH]nc1-c1ccccc1)C(=O)NN,KDLBGTXYFXKNLL-UHFFFAOYSA-N,cdp2w9-au00026609_e10_s6_w28c9e01a6-3c3c-4540-a850-bfdc31c592b6,cdp2w9-au00026609_e10_s6_w3c92f1dfc-0373-498c-b417-e4b4f18d3e94,cdp2w9-au00026609_e10_s6_w10b1db9c5-a442-4474-a510-b9730438188a,cdp2w9-au00026609_e10_s6_w55312e02c-7aa4-42ac-a082-39130e3c2ce3,cdp2w9-au00026609_e10_s6_w4fb30029a-7684-4fbd-877d-c32db6e84d09,46,9530
798,38723.0,25738-F16-3,BRD-K10811932-001-05-5,25738,F16,3,SA1856441,BRD-K10811932,BROAD_CPD_ID,Cc1cccnc1N=C(S)Nc1ccc(Br)cc1Cl,KEAKWJXFKMKZFP-UHFFFAOYSA-N,cdp2w12_f16_s3_w2f9123f82-fb9e-4cd3-bcf2-4294191aa1b4,cdp2w12_f16_s3_w33ec8f197-966b-47f1-b1ef-b93b89d44f89,cdp2w12_f16_s3_w13874ced2-6f95-4450-8097-b94fb0dde96f,cdp2w12_f16_s3_w5d0358a0b-30e2-451a-8994-5a0320b47dfa,cdp2w12_f16_s3_w47b13f359-af10-4fba-aabf-f019dc4f3a11,61,8517
799,30527.0,25664-H12-3,BRD-A14459189-001-06-9,25664,H12,3,SA1853431,BRD-A14459189,BROAD_CPD_ID,COc1ccc(cc1OC)C(=O)NCC(=O)OCC(=O)N1N=C(CC1c1ccco1)c1ccc(Cl)cc1,KEFFGNCGFQKDAH-UHFFFAOYSA-N,cdp2w12_h12_s3_w29512f8a3-315b-4c1a-ae4f-f070f0fee6bd,cdp2w12_h12_s3_w3b1bbfb6e-aa56-4a73-853c-5fa951dc0f60,cdp2w12_h12_s3_w1480cc695-a3da-48c5-9712-510f05cee2e8,cdp2w12_h12_s3_w5d0d3b62c-ea98-4107-9eca-dc2eb887036c,cdp2w12_h12_s3_w458fb179d-21f9-4253-897b-7dc428214741,67,4590
800,30275.0,25663-L06-3,BRD-A21765353-001-06-0,25663,L06,3,SA1857458,BRD-A21765353,BROAD_CPD_ID,COc1ccc(\C=C\CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc1,KETQGNPDHAUPMQ-ZZXKWVIFSA-N,cdp2w12_l06_s3_w28a7987c7-3278-4797-a48a-56090a849be9,cdp2w12_l06_s3_w384e78500-d4ec-4639-bae4-9f3c7f7eec7b,cdp2w12_l06_s3_w194d30264-224e-4460-b5a2-fcf0c846abed,cdp2w12_l06_s3_w5c05f7dab-a768-46a6-bf0e-0e3715f2bf45,cdp2w12_l06_s3_w42bc7b9f9-402f-4f78-b54b-aea09fb0309f,41,2911
801,14426.0,25422-G05-6,BRD-K80616260-001-06-3,25422,G05,6,SA1861835,BRD-K80616260,BROAD_CPD_ID,COc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O,KEURXGXXXHDSIW-UHFFFAOYSA-N,cdp2w10_g05_s6_w20596f53f-f956-4e45-a299-0b27bf8f61f3,cdp2w10_g05_s6_w3670601da-f16f-424c-9c2a-974e90c90e8a,cdp2w10_g05_s6_w142680713-8264-4869-b557-032be9cdcadc,cdp2w10_g05_s6_w5d7c63535-02c9-4a2b-a58d-610fd8a2ec41,cdp2w10_g05_s6_w46ade7df4-99aa-46f1-9af3-677ba5d20aee,83,5919
802,18086.0,25488-P15-6,BRD-K30234286-001-06-6,25488,P15,6,SA1858075,BRD-K30234286,BROAD_CPD_ID,CCCSc1nc2sc-3c(CCc4ccccc-34)c2c(=O)n1CC=C,KEVYJDLJLCDSKR-UHFFFAOYSA-N,cdp2w10-au00024357_p15_s6_w289e928d4-a0e8-4ed9-b3d8-f0b1e970fb28,cdp2w10-au00024357_p15_s6_w38632e9c3-4729-44e0-a681-b976bafc73c6,cdp2w10-au00024357_p15_s6_w1acc7d167-17bd-455e-8c49-5c0232565b45,cdp2w10-au00024357_p15_s6_w5a0fb23a1-171e-415f-97c9-9b4c74a65c76,cdp2w10-au00024357_p15_s6_w41632393e-caa4-4a79-bf11-cdf86445dfac,66,1664
803,13100.0,25410-O05-6,BRD-K78692447-001-05-6,25410,O05,6,SA1860879,BRD-K78692447,BROAD_CPD_ID,[O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccc(Br)cc1,KFCPVCCIYPGHHK-UHFFFAOYSA-N,cdp2w10_o05_s6_w2c11d514f-f93b-4099-937b-093886e629cd,cdp2w10_o05_s6_w329ab89af-fa7e-4913-af0d-85df1a6ef3ad,cdp2w10_o05_s6_w1aee1f44e-bf6f-454b-ac41-803a681e4cd2,cdp2w10_o05_s6_w574fdb7fc-df59-44d3-a07c-32889fdf6b0f,cdp2w10_o05_s6_w4182ae50b-0bef-4b54-b908-d137e593ea00,33,2781
804,23119.0,25576-J03-5,BRD-K53107402-001-07-3,25576,J03,5,SA1858531,BRD-K53107402,BROAD_CPD_ID,[O-][N+](=O)c1cc(ccc1NCCCNC(=O)c1ccc(F)cc1)C(F)(F)F,KFIBMBAWEJGQRA-UHFFFAOYSA-N,cdp2w11_j03_s5_w243172c91-17ce-4feb-8321-cc20d4b0cf54,cdp2w11_j03_s5_w36d58f67e-91a4-4751-acd3-b8adf4687f82,cdp2w11_j03_s5_w1de42e9ee-5e2e-4458-b081-2486599328fc,cdp2w11_j03_s5_w5e7d4556a-e667-4f5c-b5c4-a26d205ea61c,cdp2w11_j03_s5_w449d7e34c-a7ef-4858-9836-ffd2dfbd2dd8,55,9458
805,50906.0,26140-I03-6,BRD-K35098144-001-05-4,26140,I03,6,SA1861107,BRD-K35098144,BROAD_CPD_ID,Clc1cc2nc3ccccn3c2cc1Cl,KGOQVKQJXJLTDN-UHFFFAOYSA-N,cdp2w9x2_i03_s6_w2ff941c3b-da72-4a61-a6e6-3ba6c8e02d5c,cdp2w9x2_i03_s6_w31370876d-afc7-4a22-91f3-52d4e939279a,cdp2w9x2_i03_s6_w12744f66b-fbaf-472a-90bf-f6ce35b6460f,cdp2w9x2_i03_s6_w500d5e799-ed06-4f93-890c-9dc9f097fa8d,cdp2w9x2_i03_s6_w48f6abd6a-82af-42f5-aa38-7f6084a913b1,27,7136
806,1441.0,24294-I16-2,BRD-A24817035-001-04-7,24294,I16,2,SA57992,laudanosine,primary-common,COc1ccc(CC2N(C)CCc3cc(OC)c(OC)cc23)cc1OC,KGPAYJZAMGEDIQ-UHFFFAOYSA-N,cdp2bioactives_i16_s2_w299b82350-973e-4d04-8513-0fa9b238e940,cdp2bioactives_i16_s2_w39b74a50e-b95f-44f3-a5c2-4cf1b8dbc2ef,cdp2bioactives_i16_s2_w1461232cc-3f56-4e9b-8f40-de043352b1aa,cdp2bioactives_i16_s2_w59860ea77-7aa6-467d-b8aa-d2a8b8841ef6,cdp2bioactives_i16_s2_w451fd150c-a399-48dc-80b4-4273d59d462f,142,981
807,5040.0,24311-B16-1,BRD-K42748308-300-01-2,24311,B16,1,SA792695,XE 991,to-be-curated,O=C1c2ccccc2C(Cc2ccncc2)(Cc2ccncc2)c2ccccc12,KHJFBUUFMUBONL-UHFFFAOYSA-N,cdp2bioactives_b16_s1_w25fdd3014-d6eb-49b5-9555-e01289aa76f7,cdp2bioactives_b16_s1_w3b524b04f-db71-431d-be91-afb4bb44d41b,cdp2bioactives_b16_s1_w1a9381fb6-1646-4b9e-a069-e51f16e0cf81,cdp2bioactives_b16_s1_w560f44fb2-ccfa-4c98-bb1a-cf284915b408,cdp2bioactives_b16_s1_w45a8da67b-a559-4cbf-8408-06f2cfe40421,123,856
808,38218.0,25725-L21-2,BRD-K30681000-001-05-5,25725,L21,2,SA1860134,BRD-K30681000,BROAD_CPD_ID,Cc1ccc(cc1)-c1nnc2sc(nn12)-c1ccncc1,KIEHGMVRXGSIJJ-UHFFFAOYSA-N,cdp2w12_l21_s2_w2397cee0b-cacf-4f39-b6fd-3a19f53ecea3,cdp2w12_l21_s2_w39d5b04bf-4523-4aab-af9b-6620bfe930bb,cdp2w12_l21_s2_w12409949f-0279-488e-af46-9151dd807c3d,cdp2w12_l21_s2_w5dbce5ee8-8c87-49fc-b3c7-516bc23da1f3,cdp2w12_l21_s2_w49daac653-cda5-46e1-bc4a-3b0cbf7e4725,61,3209
809,15203.0,25426-P17-3,BRD-K82371836-001-05-0,25426,P17,3,SA1862076,BRD-K82371836,BROAD_CPD_ID,Clc1ccsc1-c1csc(n1)-c1cccnc1,KIHWNFXLKWHVRY-UHFFFAOYSA-N,cdp2w10_p17_s3_w2989ebd1d-5bb3-4785-bc4d-e4ec488c0d99,cdp2w10_p17_s3_w326ee2cf7-f081-45cd-89f6-677ebe5eaa1c,cdp2w10_p17_s3_w1bbe42a0f-58fe-4be4-a802-c56812d3bf41,cdp2w10_p17_s3_w55cab7ca7-220e-4a56-809e-9074174197dc,cdp2w10_p17_s3_w470a6d144-6f4a-4d31-b4ee-55503f0f12b4,58,4219
810,30110.0,25663-E19-6,BRD-K75102759-001-05-1,25663,E19,6,SA1852255,BRD-K75102759,BROAD_CPD_ID,COc1ccc(cc1)-c1ccnc2nc(Sc3ncc(cc3Cl)C(F)(F)F)nn12,KIMKGQVCXHWZFA-UHFFFAOYSA-N,cdp2w12_e19_s6_w2b2dd2d21-5acb-40c4-bd4e-67ea5dd74203,cdp2w12_e19_s6_w30dc2cc6e-bec3-4dfb-9f39-bc3398614cb9,cdp2w12_e19_s6_w1edcba38a-d399-4957-8406-691163c8d41c,cdp2w12_e19_s6_w5491ecbf5-10e8-48d0-9518-5e0d57af94a1,cdp2w12_e19_s6_w4105fc2d9-8ccb-4005-9f4c-0bcd29bdb0a7,101,9349
811,39396.0,25862-I17-4,BRD-K92008394-001-01-9,25862,I17,4,SA791401,BRD-K92008394,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,KIMVBWBBLXVDQH-IHMCZWCLSA-N,cdp2w6x2-au00026438_i17_s4_w287dc9c0b-8f98-41ef-9e7c-d74c61662210,cdp2w6x2-au00026438_i17_s4_w3c6c47ceb-ddb5-49d0-aa19-a5d3e40ee1e6,cdp2w6x2-au00026438_i17_s4_w14033c44b-1c8c-4476-b645-562835a6d676,cdp2w6x2-au00026438_i17_s4_w5f5007cf0-2a94-4b95-af7e-ed38a0c0f9bd,cdp2w6x2-au00026438_i17_s4_w489c33343-2cc2-4630-8c4a-90b588f2d90f,68,10528
812,46465.0,26061-O08-5,BRD-A25883214-001-05-8,26061,O08,5,SA1857559,BRD-A25883214,BROAD_CPD_ID,CC(N1C(=O)C2C3CC(C(Br)C3Br)C2C1=O)C(=O)Nc1ccc(C)cc1,KIYFNBKONQMDDJ-UHFFFAOYSA-N,cdp2w9x2_o08_s5_w2b24b5e69-6810-4943-8b31-23d359f7019a,cdp2w9x2_o08_s5_w34dd4809d-2987-4613-ae4e-c0456a5ab185,cdp2w9x2_o08_s5_w161e392d8-3827-435c-a663-ff53bc3d3708,cdp2w9x2_o08_s5_w58a8dc779-af05-4106-a448-8201d09e8d2a,cdp2w9x2_o08_s5_w497de371c-1b01-4e65-a3bc-8ca0eafd8442,112,7752
813,16028.0,25432-M06-6,BRD-A10124716-001-05-7,25432,M06,6,SA1855863,BRD-A10124716,BROAD_CPD_ID,CC(CCc1ccc(O)cc1)N(C)CCc1ccccc1,KJAVDHZFEIJNMJ-UHFFFAOYSA-N,cdp2w10_m06_s6_w275d08186-8a61-40a4-aa49-14c22d7be85d,cdp2w10_m06_s6_w3202b69bc-3c0f-4d47-942f-64b7e2827bcb,cdp2w10_m06_s6_w14ec7e498-7d5c-42af-97a8-6699f8ab5e83,cdp2w10_m06_s6_w5e9073204-f8c4-4853-af46-d2931433a1f9,cdp2w10_m06_s6_w4fd1ea3c1-3e6e-4669-8f3b-1ffa44b94303,57,8578
814,23601.0,25579-C15-1,BRD-K57769329-001-05-0,25579,C15,1,SA1859039,BRD-K57769329,BROAD_CPD_ID,Cn1ccnc1SCc1ccc(Cl)cc1Cl,KJQJXALEDMTJBP-UHFFFAOYSA-N,cdp2w11_c15_s1_w285450d75-0554-46ae-9afd-f2c82e018d26,cdp2w11_c15_s1_w3704a66e2-eb24-4b1a-a453-61c451b0cc81,cdp2w11_c15_s1_w14dd88ee3-13aa-438f-b3aa-ec6448a61336,cdp2w11_c15_s1_w5fe39247f-8b92-48ef-938b-2f9d572fd6d7,cdp2w11_c15_s1_w48f9b8322-08c3-4b20-b835-62e81397aab5,71,2721
815,46807.0,26081-A15-5,BRD-K79147587-001-06-8,26081,A15,5,SA1854582,BRD-K79147587,BROAD_CPD_ID,[O-][N+](=O)c1cc(cc(c1-n1nnc2ccccc12)[N+]([O-])=O)C#N,KKBPVHRLGDZJFG-UHFFFAOYSA-N,u00026613_a15_s5_w26a32e1e5-c86c-45f9-a224-4065b6f2a12e,u00026613_a15_s5_w3979f68ee-a3e9-45ca-afc0-618ef5b930a2,u00026613_a15_s5_w1eb068db1-e31c-47bc-9606-c6d8d8802582,u00026613_a15_s5_w511d701d1-f96e-474f-82bc-e709b2c7bb69,u00026613_a15_s5_w4fd424c5d-c369-4185-8749-2c3b159d42c6,6,6558
816,7646.0,24518-B10-3,BRD-K86089999-001-02-4,24518,B10,3,SA91389,BRD-K86089999,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O,KKCRHGGATFNVQS-WZOHSFFVSA-N,cdp2bioactives-au00026390_b10_s3_w232a7c29a-8747-41db-be7a-1c1ae681a242,cdp2bioactives-au00026390_b10_s3_w3857c8e88-4c3e-47b2-8f54-316638cb2fc3,cdp2bioactives-au00026390_b10_s3_w1f9afae4b-0587-4e28-a606-77be3c190919,cdp2bioactives-au00026390_b10_s3_w5aa3c3dee-ae89-46d0-a715-92873b590d02,cdp2bioactives-au00026390_b10_s3_w40902ca1a-a5d5-449e-a4dd-21a2eec43703,93,9645
817,37561.0,25708-L14-5,BRD-K54419754-001-06-7,25708,L14,5,SA1859192,BRD-K54419754,BROAD_CPD_ID,COc1ccccc1CNC(=O)CSc1nc(N)c(C#N)c(-c2cccs2)c1C#N,KKLGJQYLQBJYML-UHFFFAOYSA-N,cdp2w12_l14_s5_w28d2ddb4a-dc61-48d1-a02a-b747a5ac2df2,cdp2w12_l14_s5_w35d694fc3-a98c-471c-be9d-7be48ef15c5c,cdp2w12_l14_s5_w1e173fab7-2c8f-49f3-8557-96b2a5857065,cdp2w12_l14_s5_w58b3a4366-6874-45a1-bddf-7c95bd1a0100,cdp2w12_l14_s5_w47c991654-f110-42d8-8162-ceeefec2e714,95,7364
818,17537.0,25485-F17-3,BRD-K44607884-001-06-3,25485,F17,3,SA1861292,BRD-K44607884,BROAD_CPD_ID,CCCS(=O)(=O)NCc1cn2c(C)csc2n1,KKSHWAITTSRIHM-UHFFFAOYSA-N,cdp2w10-au00024355_f17_s3_w23959075d-aadd-42cb-b04c-bec5dabe6e44,cdp2w10-au00024355_f17_s3_w3db499c04-c738-47fa-9640-a22fdee57afa,cdp2w10-au00024355_f17_s3_w1de55f105-8ad6-4593-8169-801bd290a4f8,cdp2w10-au00024355_f17_s3_w56c9964b7-f696-4940-bc33-3e30b3fadb9b,cdp2w10-au00024355_f17_s3_w404a56b01-a392-4c4c-9fc3-24966a43104c,84,1833
819,6801.0,24352-I07-4,BRD-K09537769-001-01-6,24352,I07,4,SA63332,NU7026,primary-common,O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1,KKTZALUTXUZPSN-UHFFFAOYSA-N,cdp2bioactives_i07_s4_w2815cbc21-e99b-4e27-9b45-0099a1f3fb8a,cdp2bioactives_i07_s4_w357af9739-0e14-4da5-91dc-81fa801ceab2,cdp2bioactives_i07_s4_w1f86e24a8-6783-4d04-a22b-858c8aa8f4ca,cdp2bioactives_i07_s4_w5f51853c2-beed-4024-ac26-3a5e42365cf2,cdp2bioactives_i07_s4_w49abc5e90-7ef6-4d60-ab8d-12a6e419e191,92,751
820,9662.0,25372-B21-6,BRD-K25522720-001-04-0,25372,B21,6,SA1852495,BRD-K25522720,BROAD_CPD_ID,COc1ccc(cc1)-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C,KKUJUVOEUPSRQJ-UHFFFAOYSA-N,cdp2w10_b21_s6_w2f288d33a-9e40-4325-91b8-4d04120be310,cdp2w10_b21_s6_w3313523ea-c5d2-4dd6-98e7-de9c2100fc13,cdp2w10_b21_s6_w131defdde-47de-49fa-aea8-e6485f2173f7,cdp2w10_b21_s6_w57ffa0b18-a46f-4758-a647-a8d1e4bbb30f,cdp2w10_b21_s6_w4fd2663ef-dd38-467a-b90f-63cb11ed613c,27,9029
821,43105.0,25984-C02-5,BRD-K21680192-300-05-2,25984,C02,5,SA83157,mitoxantrone,INN,OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12,KKZJGLLVHKMTCM-UHFFFAOYSA-N,cdp2w8x2_c02_s5_w246eb03b1-20b6-403a-a352-bde981939bed,cdp2w8x2_c02_s5_w3989ebdb8-913c-4944-9af8-67ffa2878b50,cdp2w8x2_c02_s5_w1b111743e-1842-4d6e-8120-8688208d84e3,cdp2w8x2_c02_s5_w5505348fa-4b8d-4264-bd54-ec696c569fe2,cdp2w8x2_c02_s5_w4efb9afb9-8c4e-4fea-860b-57d9548704d8,1,99
822,38579.0,25732-B10-3,BRD-K88811374-001-07-3,25732,B10,3,SA1857822,BRD-K88811374,BROAD_CPD_ID,Cc1sc2ncnc(NCc3cccs3)c2c1C,KLHVRBIPSAKIKO-UHFFFAOYSA-N,cdp2w12_b10_s3_w24a4c70ba-3dd4-4b55-b075-9803c8d811f3,cdp2w12_b10_s3_w39096b810-465f-476a-b664-9b2f1c0fe4d6,cdp2w12_b10_s3_w18c37ceeb-bc04-4ae3-a849-ee8d91bd2d08,cdp2w12_b10_s3_w5ef996d33-fd09-4167-a121-0126588896f8,cdp2w12_b10_s3_w478b4578a-6699-446c-afbe-216d681a08eb,48,8732
823,27962.0,25599-G12-6,BRD-A61522392-001-05-1,25599,G12,6,SA1855375,BRD-A61522392,BROAD_CPD_ID,Cc1ccc(o1)-c1nnn(CC(=O)N(Cc2cccs2)C(C(=O)NC(C)(C)C)c2ccco2)n1,KLVIWFOZQCTLQL-UHFFFAOYSA-N,cdp2w11_g12_s6_w280f43072-52ae-4ddc-af5b-c459a5061019,cdp2w11_g12_s6_w34a1e568c-ec3b-4f28-91cc-e8bb21482097,cdp2w11_g12_s6_w1fbdb7599-89f0-4ad7-8a7d-73e89176b5b9,cdp2w11_g12_s6_w56fee2546-f37b-46b7-86b0-2fdb6489b657,cdp2w11_g12_s6_w4bc932b98-ab93-4430-ba96-02b9702aae50,72,5450
824,26631.0,25592-E21-1,BRD-K44624496-001-06-8,25592,E21,1,SA1854088,BRD-K44624496,BROAD_CPD_ID,S=C(NCCc1ccccc1)Nc1cccc2cnccc12,KMFSWUHRISKCRW-UHFFFAOYSA-N,cdp2w11_e21_s1_w27bc70441-fed1-4680-9f39-6122a5731d61,cdp2w11_e21_s1_w36eed40ea-609a-4297-8208-edb4ef519013,cdp2w11_e21_s1_w166ae3753-3cfa-4036-be60-1cc50c118e5e,cdp2w11_e21_s1_w5734ef225-5ca8-4fc6-a5cc-5b3afe13e363,cdp2w11_e21_s1_w4f1b0aa9f-80a4-4f82-9039-a20a0726e02a,66,3215
825,45940.0,26060-A03-2,BRD-K70685307-001-07-3,26060,A03,2,SA1854855,BRD-K70685307,BROAD_CPD_ID,CC(C)C(=O)Nc1c2CCN(C)c2nc2ccccc12,KMMOBCXLHOOSGS-UHFFFAOYSA-N,cdp2w9x2_a03_s2_w200a9ad93-a13a-47ee-8f40-2c77aba73103,cdp2w9x2_a03_s2_w3b6c9db4b-511a-4547-a10b-6fc0941ddff4,cdp2w9x2_a03_s2_w1ccaaa4d8-ed70-4118-88cc-bc2113e1ab78,cdp2w9x2_a03_s2_w5e89c3a6a-db42-42e6-9fac-3c1fcd8490be,cdp2w9x2_a03_s2_w4a6d5219d-9de3-421f-95d6-01f6c4058ff3,50,3051
826,41469.0,25965-M04-1,BRD-K13642330-001-02-6,25965,M04,1,SA59129,cosmosiin,primary-common,OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O,KMOUJOKENFFTPU-QNDFHXLGSA-N,cdp2w8x2_m04_s1_w22354c3fa-6072-45bc-aec3-ec6dbdbcb5c3,cdp2w8x2_m04_s1_w346bb37d1-20ef-47dc-be3b-34b7c3e057cd,cdp2w8x2_m04_s1_w1d3dd6af0-589b-4bf6-b22a-54bedf991475,cdp2w8x2_m04_s1_w55b39e8b9-35a8-4b4f-a9e0-037e696904c1,cdp2w8x2_m04_s1_w4789b58e3-215d-45f8-ae3c-f95f33cba744,55,1158
827,43788.0,25986-G05-4,BRD-K48168960-001-05-1,25986,G05,4,SA83362,propylthiouracil,INN,CCCc1cc(=O)[nH]c(=S)[nH]1,KNAHARQHSZJURB-UHFFFAOYSA-N,cdp2w8x2_g05_s4_w2cd6f9cee-9d02-4eb7-890d-6b6a1c1cf273,cdp2w8x2_g05_s4_w33fb4e5e6-184d-4bda-8939-5c13d0151e67,cdp2w8x2_g05_s4_w1ba07952a-75ac-4fab-950a-cb06cbc429ac,cdp2w8x2_g05_s4_w552a397c9-f96e-437e-b799-005ec2eb7a43,cdp2w8x2_g05_s4_w44142e49d-0b46-4108-bf8a-b4f4badd5e9d,70,1098
828,19736.0,25564-O03-6,BRD-K89873893-001-05-8,25564,O03,6,SA1852285,BRD-K89873893,BROAD_CPD_ID,FC(F)(F)Oc1ccc(NC(=O)c2ccc(o2)S(=O)(=O)N2CCOCC2)cc1,KNPFPXMLKVJIFZ-UHFFFAOYSA-N,cdp2w11_o03_s6_w2089bc536-2d00-4eaf-9dfd-fda83d6b03f3,cdp2w11_o03_s6_w39f4e4e40-b83a-492c-8c9e-3626c70c7410,cdp2w11_o03_s6_w1c8d0e514-52cf-42a6-a708-d94d163dc122,cdp2w11_o03_s6_w5b13e7447-e9b7-48b3-b468-010bc215b94d,cdp2w11_o03_s6_w4d97d369f-5472-4cca-9b7d-8bfdf4ebc3bc,71,9516
829,29679.0,25642-O08-1,BRD-K90049800-001-05-4,25642,O08,1,SA1860617,BRD-K90049800,BROAD_CPD_ID,CCOc1ccc(cc1Cl)C(=O)Nc1cccc(c1)-c1nc2cccnc2o1,KNRQWYZQUVVSRF-UHFFFAOYSA-N,cdp2w12_o08_s1_w2f0664e3c-3b95-45fa-8541-eed84a3d5832,cdp2w12_o08_s1_w3a111b377-83e1-49cb-825b-fb51f12e8387,cdp2w12_o08_s1_w1aee6e71c-abf3-436e-a958-d36f7baffc6c,cdp2w12_o08_s1_w54cfd0d87-af63-47dc-8982-173a6c428d02,cdp2w12_o08_s1_w4ec527101-bfd8-4aec-bf2a-157b93aace59,57,7453
830,37486.0,25708-I13-2,BRD-K87049226-001-06-3,25708,I13,2,SA1859664,BRD-K87049226,BROAD_CPD_ID,CC(C)(C)c1nnc(NC(=O)c2cc(nc3ccccc23)-c2ccccc2)s1,KNVXXUYZHQCJPS-UHFFFAOYSA-N,cdp2w12_i13_s2_w28cc29174-972c-47a6-8247-68a7d1d3d151,cdp2w12_i13_s2_w32d1d20a1-64c4-4da9-b50b-5091293feab3,cdp2w12_i13_s2_w1e6866536-bcc9-47d6-ac9f-bcf98aa40aa1,cdp2w12_i13_s2_w5153b5cad-0634-404e-ad3a-ed76542f46c5,cdp2w12_i13_s2_w48b33a10f-7ff5-46a6-b72b-317d1b4fe360,45,8218
831,7047.0,24357-C24-4,BRD-K62609077-001-02-2,24357,C24,4,SA83125,scoulerine,primary-common,COc1cc2CCN3Cc4c(C[C@H]3c2cc1O)ccc(OC)c4O,KNWVMRVOBAFFMH-HNNXBMFYSA-N,cdp2bioactives_c24_s4_w2786f5e91-6821-4024-a851-01de38071b25,cdp2bioactives_c24_s4_w366a71ac4-ad3f-47ab-8bd3-4cde2e5422e0,cdp2bioactives_c24_s4_w16567653d-d0ce-4008-8ae8-91e5aafaaba9,cdp2bioactives_c24_s4_w5fec17760-bc4e-4151-a18d-853bcc675f53,cdp2bioactives_c24_s4_w4bf3a4d3b-6dc8-47bb-abbd-ab29714c0aaa,75,1396
832,27868.0,25599-C03-2,BRD-K74688087-001-06-1,25599,C03,2,SA1853357,BRD-K74688087,BROAD_CPD_ID,COc1ccc(CCNc2ccc(cc2[N+]([O-])=O)C(O)=O)cc1OC,KOCALSLUENBTBQ-UHFFFAOYSA-N,cdp2w11_c03_s2_w266dda53e-3b0f-4270-8faf-95dd3a760294,cdp2w11_c03_s2_w3c199c4f9-652f-4896-a53f-5077cfd1b3fe,cdp2w11_c03_s2_w1ebeffdfe-e85b-480a-a395-87fae87f71a6,cdp2w11_c03_s2_w5037a513b-a7dd-4ec3-a72b-e6bffc6e8e62,cdp2w11_c03_s2_w4fc633bc4-0251-4ac2-b644-08c0ec816868,73,1481
833,19505.0,25564-C21-3,BRD-K07612530-001-06-6,25564,C21,3,SA1858065,BRD-K07612530,BROAD_CPD_ID,C1CN(CCN1c1ccccc1)c1nc(nc(n1)-n1ccnc1)-c1ccccc1,KOGKLWVBRDGPOX-UHFFFAOYSA-N,cdp2w11_c21_s3_w24d96cf48-5b5a-45fe-8d72-cdd1482d44c6,cdp2w11_c21_s3_w31d9788c1-ed9e-46da-844e-946a81e25dfe,cdp2w11_c21_s3_w1810af8a5-8d96-4d47-acdb-b0f260012a03,cdp2w11_c21_s3_w56b16b854-c68c-461c-adcd-9d7d0173564a,cdp2w11_c21_s3_w4f0307228-98c4-4464-bef1-b8f6af347f40,66,2565
834,15293.0,25428-E09-3,BRD-K04592097-001-05-0,25428,E09,3,SA1858873,BRD-K04592097,BROAD_CPD_ID,Cc1cc(co1)C(=O)Nc1cccc(O)c1,KOHYRMHFQJXHDI-UHFFFAOYSA-N,cdp2w10_e09_s3_w295ec48af-3122-42bd-a47c-947b3f14d20d,cdp2w10_e09_s3_w398068b43-b642-49a5-9fcd-7997cdee54fc,cdp2w10_e09_s3_w10a1e59c9-c966-4281-b976-e894a1d78b4a,cdp2w10_e09_s3_w5f0c680e6-53b7-42ba-b50e-4d280f2f75a0,cdp2w10_e09_s3_w4a00d2284-71f7-4c0c-90b8-a6b29d5549db,47,6993
835,29955.0,25643-L22-1,BRD-K56597705-001-05-0,25643,L22,1,SA1853057,BRD-K56597705,BROAD_CPD_ID,C(Nc1nc(nc2ccccc12)-c1cccs1)c1cccs1,KPHOJOSUCIJYIZ-UHFFFAOYSA-N,cdp2w12_l22_s1_w282aa827a-f886-43a6-a6d2-9987a42883e6,cdp2w12_l22_s1_w3eb5273fe-62fc-4151-b026-f40ba7446d65,cdp2w12_l22_s1_w1f5273953-b2d2-42ea-9a35-b7911aafc9ee,cdp2w12_l22_s1_w5d486862d-fea7-4dba-b0dd-e42fd1f1a003,cdp2w12_l22_s1_w4a15df8d0-304c-4980-8d8e-2a58391f7430,53,9319
836,32774.0,25678-N14-6,BRD-K24499852-001-07-5,25678,N14,6,SA1852353,BRD-K24499852,BROAD_CPD_ID,Clc1ccccc1-c1nc2cc(NC(=O)c3cncc(Br)c3)ccc2o1,KPIQFMUOSWEVOO-UHFFFAOYSA-N,cdp2w12_n14_s6_w28566b893-e3e4-423c-aec4-5842583f73a6,cdp2w12_n14_s6_w38a7ccf2c-5fe0-4455-9365-b5c10b126a04,cdp2w12_n14_s6_w1e0b0a05e-fffc-4404-888f-7ef5bff26614,cdp2w12_n14_s6_w50f30675a-e1e4-4a82-bf1a-f6ada0c4bc2a,cdp2w12_n14_s6_w45434afb3-0341-4bd7-84f0-b9c62e2e45a8,86,9551
837,45751.0,26058-F09-5,BRD-A63704386-001-06-9,26058,F09,5,SA1860261,BRD-A63704386,BROAD_CPD_ID,CCCc1n[nH]c2OC(N)=C(C#N)C(c12)c1ccccc1OC,KPJRRWCLHUKDJO-UHFFFAOYSA-N,cdp2w9x2_f09_s5_w211a70afe-aef8-4f09-a88b-ff4ef8c9cfc1,cdp2w9x2_f09_s5_w3f6114794-dfa3-4c3f-aa07-e9e339944c72,cdp2w9x2_f09_s5_w1feced952-3ddd-42b0-af51-7cb433389dd9,cdp2w9x2_f09_s5_w5ef407934-2e64-4a33-95cc-a1d3ca14cc8a,cdp2w9x2_f09_s5_w4fb155c80-893f-42c2-ad39-d2cd3cfc5ef7,48,7893
838,23427.0,25578-J07-1,BRD-K58935949-001-09-8,25578,J07,1,SA1854949,BRD-K58935949,BROAD_CPD_ID,[O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(cc1)-c1nc2ncccc2o1,KPPHBMOZKRLTCW-UHFFFAOYSA-N,cdp2w11_j07_s1_w2dae32bd8-48df-4e51-8776-fe7ada1f4e57,cdp2w11_j07_s1_w329c0ea80-ad51-417b-a7ea-bdec8e150508,cdp2w11_j07_s1_w1373754f4-e4f5-413d-b327-9b5e6b0d2c5a,cdp2w11_j07_s1_w5f24bd31c-e943-4f0b-a79e-db6e492622b0,cdp2w11_j07_s1_w47186977b-b8be-4fdb-8a08-4a3b78b6f2f7,10,7187
839,40377.0,25949-B02-1,BRD-A49358627-001-03-9,25949,B02,1,SA83680,ciprofibrate,INN,CC(C)(Oc1ccc(cc1)C1CC1(Cl)Cl)C(O)=O,KPSRODZRAIWAKH-UHFFFAOYSA-N,cdp2w8x2_b02_s1_w2796249e9-5ebf-48df-815a-5a3b1f0fa6cc,cdp2w8x2_b02_s1_w3d13975a7-73d4-4561-b7d5-32bcec81c0c8,cdp2w8x2_b02_s1_w1c0b6b8de-3c67-4a9a-a954-6aea65e653d9,cdp2w8x2_b02_s1_w597f35a77-4108-4137-a79e-753156011cc6,cdp2w8x2_b02_s1_w4be21e28c-e095-44f4-a143-652ae8e12979,16,1263
840,44958.0,25990-L19-4,BRD-K73210450-001-02-3,25990,L19,4,SA59808,triptophenolide,primary-common,CC(C)c1ccc2c(CC[C@H]3C4=C(CC[C@]23C)C(=O)OC4)c1O,KPXIBWGPZSPABK-FXAWDEMLSA-N,cdp2w8x2_l19_s4_w2e79cf800-613d-481c-8541-2d8d969da0b8,cdp2w8x2_l19_s4_w3b71d8b64-e16c-4480-9d62-42bf7a57597f,cdp2w8x2_l19_s4_w16248c62d-2c84-4378-8b77-4767ea076fa0,cdp2w8x2_l19_s4_w5872d1929-5d0b-478f-91a2-c37802ba1e29,cdp2w8x2_l19_s4_w4252ddbde-17ad-4269-8ffc-0902a9b7d3f0,46,10567
841,56034.0,26680-M21-4,BRD-K89844894-001-01-7,26680,M21,4,SA417985,BRD-K89844894,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(C)(=O)=O)OCc2cnnn2CCCC1=O,KPZGSTQZFNZEDR-IJEWVQPXSA-N,cdp2w13_m21_s4_w25bceb16b-c1cd-4da4-99f8-72444b2034cc,cdp2w13_m21_s4_w3edf31c26-3ca7-41d9-a525-5b96fc2460ed,cdp2w13_m21_s4_w1123c53f2-e889-4464-8bc2-4a7a27498a90,cdp2w13_m21_s4_w57ca24d29-3399-483e-b2ad-985a6b66e3f6,cdp2w13_m21_s4_w437371f05-d0bb-4744-acdf-508a0ea39f24,97,9912
842,18963.0,25503-J13-1,BRD-K50094664-001-05-3,25503,J13,1,SA1861286,BRD-K50094664,BROAD_CPD_ID,Clc1cc(NC(=O)c2ccccc2)ccc1NC(=O)c1ccco1,KQCGDUIWZNCAAH-UHFFFAOYSA-N,cdp2w11-au00029680_j13_s1_w26b290b9b-78a4-476f-8807-407e7e30628c,cdp2w11-au00029680_j13_s1_w3689e665c-a179-4bf0-aa4a-c377fac5910b,cdp2w11-au00029680_j13_s1_w141fa5245-7dd2-45d0-9307-8bd1ba74757b,cdp2w11-au00029680_j13_s1_w563c1441d-4460-43af-befc-89b156ad4253,cdp2w11-au00029680_j13_s1_w4dd84e5a8-b581-4fc7-b32c-e68c402875b5,40,8913
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864,6294.0,24320-M03-1,BRD-K73394555-001-04-5,24320,M03,1,SA59370,oxolinic acid,INN,CCn1cc(C(O)=O)c(=O)c2cc3OCOc3cc12,KYGZCKSPAKDVKC-UHFFFAOYSA-N,cdp2bioactives_m03_s1_w23631b10e-015c-4cb8-8d30-5269b5364d2c,cdp2bioactives_m03_s1_w35249a5b9-069e-49a1-9645-6feb5f5a6a88,cdp2bioactives_m03_s1_w193ea3864-50e0-40dd-99f8-39a7013a29e2,cdp2bioactives_m03_s1_w510705da0-f4f6-442c-b3d5-08ac3b96075b,cdp2bioactives_m03_s1_w4b3edda4d-d3ed-41c8-9c26-dae17003e5d1,169,385
865,34376.0,25686-J07-6,BRD-K21345422-001-05-8,25686,J07,6,SA1856244,BRD-K21345422,BROAD_CPD_ID,Cc1ccc2nc(O)c(CN(Cc3nnnn3Cc3ccco3)Cc3ccc4OCOc4c3)cc2c1,KYIWUANOGAVPOM-UHFFFAOYSA-N,cdp2w12_j07_s6_w26cc02b03-c07a-4256-a1b7-996590f948ff,cdp2w12_j07_s6_w3a1b074dd-1980-492c-ac93-b7c1cd871083,cdp2w12_j07_s6_w1158c478f-7586-4af1-8c1e-49f948fa9559,cdp2w12_j07_s6_w563f6a22f-0314-4c85-89ef-bd1efb104ce1,cdp2w12_j07_s6_w4e05f6cf1-ade0-41fb-ad8f-6d981b0e679c,71,3994
866,13466.0,25414-P07-6,BRD-K99377280-001-05-9,25414,P07,6,SA1859381,BRD-K99377280,BROAD_CPD_ID,Clc1ccc(NC(=O)[C@@H]2[C@H]3[C@@H]([C@H]4C=CC=NN24)C(=O)N(C3=O)c2ccc(Cl)cc2)cc1,KZEUTKQNAREPMT-MKXGPGLRSA-N,cdp2w10_p07_s6_w219403186-29d9-4f7a-b876-9f2141d1874b,cdp2w10_p07_s6_w387a6945f-eba4-4845-a4d6-de5c91fb59a9,cdp2w10_p07_s6_w100722a73-3a28-45ec-be83-709b46683915,cdp2w10_p07_s6_w5aee0c2dd-3a54-4934-932b-dd4187276122,cdp2w10_p07_s6_w454196801-1fa4-4354-a228-297b4f28870f,50,5854
867,14922.0,25426-A18-4,BRD-K37827001-001-05-6,25426,A18,4,SA1857659,BRD-K37827001,BROAD_CPD_ID,CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnnn2-c2ccc(C)cc2)c1C,KZUCFQLQDUSNBZ-UHFFFAOYSA-N,cdp2w10_a18_s4_w2b5e90679-fc2d-43f1-83f7-71976dfd9776,cdp2w10_a18_s4_w3ae880d69-83b3-43be-acdf-f730974962b3,cdp2w10_a18_s4_w131a13b09-8fca-4fbd-bf1f-3b1a853dc9e4,cdp2w10_a18_s4_w5413e707b-bec5-44d7-850e-cac337db88d9,cdp2w10_a18_s4_w4a843c1dc-46a9-4c47-9649-72211873f3bf,71,9053
868,20409.0,25567-A19-1,BRD-A90025074-001-05-5,25567,A19,1,SA1855364,BRD-A90025074,BROAD_CPD_ID,COc1ccccc1NC(=O)CC1C(=O)Nc2c1c(=O)n(C)c(=O)n2C,LAFVQHDPCXQYIG-UHFFFAOYSA-N,cdp2w11_a19_s1_w24c0a569b-9001-4791-a8f9-d6a47ca8d190,cdp2w11_a19_s1_w3448de9cc-f2f0-411d-b2b3-19390256a4ea,cdp2w11_a19_s1_w173355301-d77d-4300-85df-2a75b856fea0,cdp2w11_a19_s1_w5a0e066fa-c2ee-4085-911a-888917a20750,cdp2w11_a19_s1_w45d03717e-1e8b-4be9-bb8a-3e2972122965,40,4855
869,52371.0,26202-I09-1,BRD-K29448239-001-06-3,26202,I09,1,SA1852505,BRD-K29448239,BROAD_CPD_ID,OCCCCO[C@@H]1C[C@@H](C=C(O1)C(=O)Nc1ccccc1)c1ccc(Br)cc1,LATSOZBAVVRALT-UTKZUKDTSA-N,cdp2w9x2-au00026617_i09_s1_w2779344f2-7862-4a97-a4f4-2a51055d6b74,cdp2w9x2-au00026617_i09_s1_w394beef74-400b-4b8a-a4dc-12f750e82cd2,cdp2w9x2-au00026617_i09_s1_w1ca7ed396-22bf-4fb4-ac0e-a667d0ac3f73,cdp2w9x2-au00026617_i09_s1_w5f25ac708-040c-4843-9a39-cfba8fc57129,cdp2w9x2-au00026617_i09_s1_w416f12324-7de6-40c8-ad60-2f66f7578865,82,8562
870,21955.0,25571-N21-5,BRD-K43872124-001-05-6,25571,N21,5,SA1861741,BRD-K43872124,BROAD_CPD_ID,CCCc1cc(cs1)C(=O)NN=C(S)Nc1cccc(C)c1,LAWMTNHANIOMNE-UHFFFAOYSA-N,cdp2w11_n21_s5_w24ab55480-6148-443e-b422-23a08b4d467a,cdp2w11_n21_s5_w35922db07-e0d1-4449-8d75-f8f6600577f6,cdp2w11_n21_s5_w10c6c23a0-0b2c-4440-bfe8-9821d5066ebe,cdp2w11_n21_s5_w53d765d1d-d6f3-40a7-9564-c7d0a6e4f9b1,cdp2w11_n21_s5_w44f1e4636-2536-48b7-b8b1-0ca6ccfa8648,73,4045
871,49885.0,26133-I17-5,BRD-A69648159-001-05-9,26133,I17,5,SA1855125,BRD-A69648159,BROAD_CPD_ID,CCOc1ccc(NS(=O)(=O)c2ccc3ncc(C(=O)NC(C)CC)c(O)c3c2)cc1,LBCKGKHGGGKUBU-UHFFFAOYSA-N,cdp2w9x2_i17_s5_w2d2cc5a73-def2-4d16-90ef-d4205b2ef446,cdp2w9x2_i17_s5_w3c20a9866-c3f5-4b45-9a24-88fda2c73985,cdp2w9x2_i17_s5_w114587f39-acf5-4f5a-a42c-8e88fda0b88c,cdp2w9x2_i17_s5_w5c2d711a2-88bc-4c0c-b75d-e0e23f0cef8d,cdp2w9x2_i17_s5_w404028f39-abd0-4bbf-8613-b652baaad86e,44,3481
872,16147.0,25434-C08-5,BRD-K81628216-001-05-4,25434,C08,5,SA1856284,BRD-K81628216,BROAD_CPD_ID,Cc1cc(=O)oc2cc(OCC(=O)NCc3ccccn3)ccc12,LBCYLKQMVUMYRW-UHFFFAOYSA-N,cdp2w10_c08_s5_w2ec8fd3d6-aecd-4a60-ad92-c3700c587063,cdp2w10_c08_s5_w34453961f-92e8-4af0-a379-801f8ecf115e,cdp2w10_c08_s5_w168ee286a-713b-4120-a5a0-1870fcc80b7e,cdp2w10_c08_s5_w5fd402fa6-c07b-472b-b3e1-60fde89e5a73,cdp2w10_c08_s5_w4dac7b370-2539-4078-8000-5afbbb37a5cb,79,4992
873,15185.0,25426-O17-3,BRD-K78200415-001-05-6,25426,O17,3,SA1859809,BRD-K78200415,BROAD_CPD_ID,CCOc1ccc(cc1)C(=O)N1CCCN(CC1)C(=O)c1ccc(OCC)cc1,LBEADUIZJVSPSH-UHFFFAOYSA-N,cdp2w10_o17_s3_w2820c9b20-1a18-4440-8fb4-80e4679fe457,cdp2w10_o17_s3_w39129d7f2-e7c6-40f1-993f-91788d4ee563,cdp2w10_o17_s3_w1426659cd-b489-460d-9875-7553d52f9b71,cdp2w10_o17_s3_w5c42f8f33-220b-410f-96b0-0389b86f48a5,cdp2w10_o17_s3_w4738ed9a9-21e5-46da-8197-5281b3e2900f,30,4540
874,45527.0,25992-N04-3,BRD-K74990253-001-01-0,25992,N04,3,SA792583,BW 373U86,to-be-curated,CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1,LBLDMHBSVIVJPM-YZIHRLCOSA-N,cdp2w8x2_n04_s3_w2b2a34fcd-f074-4779-a784-fbbd4377e109,cdp2w8x2_n04_s3_w32f03a9c0-b117-48ac-b7d3-5f628130eac6,cdp2w8x2_n04_s3_w14a33e06e-b9c6-4244-b09e-ede375d345fc,cdp2w8x2_n04_s3_w54fc178d4-4e32-47ac-ae07-7811781591d6,cdp2w8x2_n04_s3_w4dd02c91b-39ba-4574-a9b0-a9103e354cb4,80,352
875,37718.0,25724-E15-6,BRD-A06283479-001-05-4,25724,E15,6,SA1858600,BRD-A06283479,BROAD_CPD_ID,Nc1c(sc(=S)n1CC=C)C(=O)NCC1CCCO1,LBMHYUPARPBHQJ-UHFFFAOYSA-N,cdp2w12_e15_s6_w2e0f057fd-5d79-44c2-8e36-80057437ae15,cdp2w12_e15_s6_w318e2ae36-8c51-4a16-a0d3-bb1df18f175c,cdp2w12_e15_s6_w158d32ac4-bdb4-428d-8803-05c3d3668fe4,cdp2w12_e15_s6_w5bda26ede-bd88-428f-a874-362a67699422,cdp2w12_e15_s6_w4929f6099-60ac-4dd2-9bb6-9740949cf26f,50,5387
876,38485.0,25726-L08-5,BRD-K20960840-001-05-9,25726,L08,5,SA1854608,BRD-K20960840,BROAD_CPD_ID,Cn1cccc1\C=C1/SC(Nc2ccccc2)=NC1=O,LCISGORPEYFNGS-RAXLEYEMSA-N,cdp2w12_l08_s5_w2a2c8f5e1-e986-4470-87a5-018644805b27,cdp2w12_l08_s5_w36241e9a6-9428-4b7d-ba73-212b05a18d85,cdp2w12_l08_s5_w118cd4500-95fd-4a0b-81a5-be3136f78115,cdp2w12_l08_s5_w5fe234f70-ddd7-43e8-ade6-f44c905a4a11,cdp2w12_l08_s5_w4d245afa7-6b7c-4398-afa8-1c3519f47d73,11,8544
877,48596.0,26118-I16-6,BRD-K51781055-001-05-1,26118,I16,6,SA1862218,BRD-K51781055,BROAD_CPD_ID,COc1ccccc1-n1c(S)ncc1-c1ccccc1,LCWBURIJWSVRGX-UHFFFAOYSA-N,cdp2w9x2_i16_s6_w2bf7effb3-5617-4b7b-86ae-9b36969cf8c9,cdp2w9x2_i16_s6_w31440fbdb-115c-4c6d-bd6d-42c805bb3f1c,cdp2w9x2_i16_s6_w194d2a6ca-86aa-4f42-b7c1-6b513d3e1a75,cdp2w9x2_i16_s6_w559afcc4c-a30f-4456-be69-a3c70dc6dc5d,cdp2w9x2_i16_s6_w477c833b2-3c14-4fe4-8336-3bc02bb65edf,78,6310
878,17941.0,25488-H15-5,BRD-K39577752-001-05-6,25488,H15,5,SA1860665,BRD-K39577752,BROAD_CPD_ID,Cc1ccc(O)c(c1)C1=Nc2ccccc2N=C(C1)c1cccs1,LDCRJHTVWQFOCB-UHFFFAOYSA-N,cdp2w10-au00024357_h15_s5_w2fe1a58d4-34dc-414e-a577-a8960bd98833,cdp2w10-au00024357_h15_s5_w3a528e147-f84d-4456-8b1d-ef73e8904d9a,cdp2w10-au00024357_h15_s5_w153e66513-6eae-4bce-aeaa-b9c5ab4c277e,cdp2w10-au00024357_h15_s5_w55b0bed62-14bf-4150-bf5d-15f358a1272b,cdp2w10-au00024357_h15_s5_w452b729e4-7323-43b2-879c-34eff4b39994,51,2533
879,22618.0,25573-P16-2,BRD-K45620924-001-05-9,25573,P16,2,SA1855291,BRD-K45620924,BROAD_CPD_ID,Cc1cc(SCC(=O)c2cc3ccccc3o2)nc2ccccc12,LDEZHWFQZKSQEN-UHFFFAOYSA-N,cdp2w11_p16_s2_w209e11bf5-1d0f-4994-89a2-6d9fa868242f,cdp2w11_p16_s2_w325ce1756-7358-4207-863b-dc4569c75988,cdp2w11_p16_s2_w1b8b2b922-81df-4602-906f-1c70f68add6d,cdp2w11_p16_s2_w52251ab5d-01a6-4421-a776-b6406d875120,cdp2w11_p16_s2_w482daf074-5388-428c-b495-50a4ee2e1e71,60,3268
880,37222.0,25707-M22-2,BRD-K17927475-001-05-5,25707,M22,2,SA1858686,BRD-K17927475,BROAD_CPD_ID,O=C(NCc1ccco1)c1csc2CCCCCc12,LDLYKRKLWJUWHW-UHFFFAOYSA-N,cdp2w12_m22_s2_w274f75a86-09b6-45a0-9c21-637a76141414,cdp2w12_m22_s2_w3014734f6-920f-4af9-8935-968e0a2b6a6e,cdp2w12_m22_s2_w1559a35b6-09a4-452b-b853-c474ca3b2f4d,cdp2w12_m22_s2_w56b62c9f9-dcf8-475e-9fbb-964270a58dd6,cdp2w12_m22_s2_w4176f7123-014d-412f-b4f4-4d417a4f6797,80,4981
881,37812.0,25724-J19-4,BRD-K72036124-001-06-0,25724,J19,4,SA1854148,BRD-K72036124,BROAD_CPD_ID,CC1=NN(C(=O)C\1=C/c1cn(C)c2ccccc12)c1ccccc1,LDXSNVKQYCIAAK-PDGQHHTCSA-N,cdp2w12_j19_s4_w2fa43c854-3562-41df-8d83-c7b1785e8ae7,cdp2w12_j19_s4_w3cd010f6f-7cd6-4d2b-b35b-ce24738a0545,cdp2w12_j19_s4_w11ebe7403-4ab9-4abf-b251-975824d53dd6,cdp2w12_j19_s4_w586a718f4-e27c-4157-b8e4-f8d54fae45c5,cdp2w12_j19_s4_w43d045597-05c2-4236-b78d-ed33f5eb8a84,54,8923
882,15997.0,25432-L03-5,BRD-K45593020-001-05-1,25432,L03,5,SA1861357,BRD-K45593020,BROAD_CPD_ID,CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)c1[nH]cnc1C(=O)N1CCN(CC1)c1ccccc1,LEDSKCIDPIEJLN-QFIPXVFZSA-N,cdp2w10_l03_s5_w230ecb676-1a53-49c2-ab85-9edaae3c9095,cdp2w10_l03_s5_w33d39b088-5bfa-4719-b931-f0f2c8adce09,cdp2w10_l03_s5_w1390646b0-e0d7-4129-bc14-3e5c9411c392,cdp2w10_l03_s5_w54bad0025-bb16-474d-8c85-04e0f6c8e819,cdp2w10_l03_s5_w48825725f-68b6-4636-9d22-69269784197f,66,2930
883,11666.0,25392-B03-6,BRD-K69855419-001-05-4,25392,B03,6,SA1857770,BRD-K69855419,BROAD_CPD_ID,COc1ccc(cc1)-c1nc2n(Cc3ccccc3)c(=O)[nH]c(=O)c2n1C,LEOPPMHUMJRAHV-UHFFFAOYSA-N,cdp2w10_b03_s6_w204f88fbb-51e1-4d79-ab04-8d641fad6ddb,cdp2w10_b03_s6_w31f68578b-a254-4480-bfcc-88c2db2ffae9,cdp2w10_b03_s6_w125579326-edef-49aa-8810-74a36a83e881,cdp2w10_b03_s6_w593e2f04d-3d47-4743-b92a-7a0b67787668,cdp2w10_b03_s6_w41f34cd6e-4402-476f-b62b-3645a5be5e7e,21,8539
884,31580.0,25674-O18-6,BRD-K75728245-001-05-5,25674,O18,6,SA1856710,BRD-K75728245,BROAD_CPD_ID,Cc1cc2cc(CN=C(S)NCc3ccccc3)ccc2n1C,LEQLIZOPUUBOQK-UHFFFAOYSA-N,cdp2w12_o18_s6_w24c6fb55b-e4df-4b92-b202-5fb3bef0dd88,cdp2w12_o18_s6_w3796988dc-2df0-47d4-925a-7af1f3e08654,cdp2w12_o18_s6_w11e485555-d862-43ea-ac72-9848f1ef378d,cdp2w12_o18_s6_w520c65df3-a676-4d90-a3e5-b1a1279f7970,cdp2w12_o18_s6_w456e09560-efae-4914-9abb-ddca32a78cff,62,7009
885,48788.0,26124-B17-6,BRD-K77709544-001-08-5,26124,B17,6,SA1857429,BRD-K77709544,BROAD_CPD_ID,COC(=O)Nc1nc(c(s1)C(=O)c1ccccc1)-c1ccccc1,LEXZXNMSSMJPKV-UHFFFAOYSA-N,cdp2w9x2_b17_s6_w298f3ace0-9cd6-4c51-8dd3-f03a27943fcb,cdp2w9x2_b17_s6_w314cd4fdc-ee98-4f39-ba58-77917cb4ad79,cdp2w9x2_b17_s6_w11a2fc80f-7f84-40cd-bcf4-d197efba69cd,cdp2w9x2_b17_s6_w50f99f2f3-083f-4bf1-9db1-af47fd719ead,cdp2w9x2_b17_s6_w421e807f3-ac0d-4127-aee0-28666f863b8e,13,3308
886,28856.0,25639-E04-6,BRD-K27374902-001-06-9,25639,E04,6,SA1858364,BRD-K27374902,BROAD_CPD_ID,COc1ccc(cc1)-c1csc(N=C(N)N)n1,LFCQUNMSNZYLTF-UHFFFAOYSA-N,cdp2w12_e04_s6_w2c2debead-6810-4d7e-a465-25125471cc3f,cdp2w12_e04_s6_w340bd8659-456a-4632-a5ba-55e099a9f42c,cdp2w12_e04_s6_w1c755e77c-cd9b-497b-94ca-d6c26206e739,cdp2w12_e04_s6_w534ee236e-1c0b-4c5f-80fe-e67b19e5db71,cdp2w12_e04_s6_w41bcc45c3-5d0f-4e2c-bd4c-b35188a2c292,106,885
887,40695.0,25955-H08-1,BRD-K08618283-001-02-0,25955,H08,1,SA58699,propanil,primary-common,CCC(=O)Nc1ccc(Cl)c(Cl)c1,LFULEKSKNZEWOE-UHFFFAOYSA-N,cdp2w8x2_h08_s1_w2ddf7906f-2a98-4f84-a19b-a984e9f30470,cdp2w8x2_h08_s1_w39b234fbe-8650-4cf5-a069-367f863f3a41,cdp2w8x2_h08_s1_w17a0fdc3e-e2e7-4199-baa7-2c03a089f88e,cdp2w8x2_h08_s1_w52845f0f8-6b55-4c8a-878c-915fc27b3ce8,cdp2w8x2_h08_s1_w4c16d8523-7c75-4760-af71-fa467f84a2c7,97,1386
888,43316.0,25984-K02-6,BRD-K32584078-001-02-3,25984,K02,6,SA81896,BML-257,to-be-curated,OC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccccc1,LFWGZXMTCUOPFI-UHFFFAOYSA-N,cdp2w8x2_k02_s6_w2634f5e75-8fee-4bf7-9eb1-3515467a1235,cdp2w8x2_k02_s6_w31e5eedb4-2f04-43fb-a07d-f62d2a96bfc8,cdp2w8x2_k02_s6_w12dcae90f-ab34-4cd3-9dec-41dc3dfd2577,cdp2w8x2_k02_s6_w539b7633a-1e2c-4f60-a10d-86336a337b7b,cdp2w8x2_k02_s6_w4952b419c-4111-4e39-ba11-ac0f66dfd45a,57,1064
889,14595.0,25422-P05-1,BRD-A87973172-001-05-2,25422,P05,1,SA1858957,BRD-A87973172,BROAD_CPD_ID,CSC1=NC2C(N1)N(C)C(=O)N2C,LGAGNAHUEANJLO-UHFFFAOYSA-N,cdp2w10_p05_s1_w2ad1d5482-a9a5-45a2-ba00-1efa626d5342,cdp2w10_p05_s1_w398947ac4-1ddd-484b-a922-ae4111e5b97d,cdp2w10_p05_s1_w1f5dc55c1-6f19-4a9f-a5e5-5e2b3a065576,cdp2w10_p05_s1_w580fab756-ce8d-481e-b886-9c2199037030,cdp2w10_p05_s1_w42970744b-7387-4eab-8f3c-a4b251d0dcd4,30,9568
890,14184.0,25420-J18-4,BRD-K27008127-001-05-4,25420,J18,4,SA1858270,BRD-K27008127,BROAD_CPD_ID,Oc1ccc(O)c(Cc2nc3ccccc3[nH]2)c1,LGDLZQUSAVSGIM-UHFFFAOYSA-N,cdp2w10_j18_s4_w25e9fe967-40b1-43bf-bd6e-174f30810289,cdp2w10_j18_s4_w3f1211b46-17ff-40da-a69a-3567fc8d99f6,cdp2w10_j18_s4_w198e6d135-a8b7-41e2-9f5a-a5311e99c024,cdp2w10_j18_s4_w556b041d1-60a5-4a44-b407-769a8d12d83d,cdp2w10_j18_s4_w40de2cec7-21b7-47fb-8629-f220264a825b,22,3456
891,22628.0,25575-A03-6,BRD-K46948679-001-05-0,25575,A03,6,SA1852258,BRD-K46948679,BROAD_CPD_ID,O=C(N1CCCc2ccccc12)c1noc-2c1CCc1ccccc-21,LGFUURIRYOCCRM-UHFFFAOYSA-N,cdp2w11_a03_s6_w20ac7646b-f157-4275-9c3a-34590a3c7c7a,cdp2w11_a03_s6_w3624ed978-d111-4fe3-8613-a3f5ebef5fc4,cdp2w11_a03_s6_w150f5b226-21a1-4c94-baab-2eda594c04d4,cdp2w11_a03_s6_w5e0b2952a-fd66-4e79-a135-d825e01a4208,cdp2w11_a03_s6_w49505428a-c152-4e30-a41a-ebddec1de372,79,6845
892,50718.0,26140-A16-4,BRD-K06830450-001-05-3,26140,A16,4,SA1855833,BRD-K06830450,BROAD_CPD_ID,CCOC(=O)c1cc2sc(C)cc2n1CC(=O)NCCc1ccccc1,LHIUGLBENAPLCU-UHFFFAOYSA-N,cdp2w9x2_a16_s4_w27df42b82-6a43-4969-a2a9-b875798030ae,cdp2w9x2_a16_s4_w3e58b20a9-6829-44c9-865a-3ee21bce16e1,cdp2w9x2_a16_s4_w172cfd8ce-558e-412b-805f-f7ec57643140,cdp2w9x2_a16_s4_w5ae8f2f53-cb7f-455d-ac2d-6b09b1b466d7,cdp2w9x2_a16_s4_w4f5c974b7-7e4d-441e-8ded-3755c9049406,66,9084
893,37837.0,25724-L10-5,BRD-K79335867-001-05-2,25724,L10,5,SA1853631,BRD-K79335867,BROAD_CPD_ID,CCOc1cc2[nH]c(=S)n(CCCC(=O)N3CCC4(CC3)OCCO4)c(=O)c2cc1OCC,LHOXOGTWVAVRGV-UHFFFAOYSA-N,cdp2w12_l10_s5_w2ffbed722-2538-4bfa-99ce-713707dcefe8,cdp2w12_l10_s5_w3cf2b93d9-086b-4744-9847-9443dfa9ecec,cdp2w12_l10_s5_w13fc8a888-fc8d-4928-832e-394223baccb0,cdp2w12_l10_s5_w5d4680fab-d8ab-48b6-8fcb-83b96d273c7e,cdp2w12_l10_s5_w4d16923e4-7bd1-4fa4-a477-1dddc9b831bd,209,3975
894,51088.0,26159-D12-2,BRD-K82662168-001-05-0,26159,D12,2,SA1853043,BRD-K82662168,BROAD_CPD_ID,Cc1ccc(O)c(NC(=S)NC(=O)COc2ccc(Br)cc2)c1,LHTCPJYUVYTPMM-UHFFFAOYSA-N,cdp2w9x2-au00026617_d12_s2_w24a1f5fb1-d601-490f-9b6a-f132dcf487f8,cdp2w9x2-au00026617_d12_s2_w3785ab8c8-b7c8-4f4e-a129-ebdb3289c13c,cdp2w9x2-au00026617_d12_s2_w1c6ed5dcd-5aac-4cd3-a0da-dd6dfa36e0ab,cdp2w9x2-au00026617_d12_s2_w5a4d19b2a-e37d-4fd1-b355-c6eaaa90776f,cdp2w9x2-au00026617_d12_s2_w4ba80aa17-45f0-4783-a960-dce8a1d8ca97,52,4536
895,9521.0,24752-P09-3,BRD-K11188962-001-01-9,24752,P09,3,SA1435887,BRD-K11188962,BROAD_CPD_ID,CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)Nc3ccc(Cl)c(Cl)c3)ccc2OC[C@@H](C)NC[C@@H]1C,LHXFIZLNBSIVPU-SMASLZHESA-N,cdp2w5_p09_s3_w25a175f0a-3577-48ce-a8fc-7fa872794e9f,cdp2w5_p09_s3_w398a1f35d-cf21-4703-9029-ccda8e365336,cdp2w5_p09_s3_w18e5fa394-197d-4826-a210-a8e0fa247350,cdp2w5_p09_s3_w524aec1f2-43d5-4dd7-be4d-02b3f11dc472,cdp2w5_p09_s3_w415250258-2d5b-4496-889c-af65228032fd,51,10363
896,16642.0,25435-L06-2,BRD-K90708444-001-05-7,25435,L06,2,SA1854919,BRD-K90708444,BROAD_CPD_ID,NN=C(S)Nc1cccc(c1)-c1nnc(S)o1,LHXWPDUWZAYBJV-UHFFFAOYSA-N,cdp2w10_l06_s2_w203de155e-ec61-4a02-be70-5b277ee293bb,cdp2w10_l06_s2_w36f586783-f3a8-4fd4-86aa-1c11fe24c3de,cdp2w10_l06_s2_w164665016-c636-41af-b5ae-0a164ceb3848,cdp2w10_l06_s2_w5bc2e11a0-573d-4047-aecf-13212c6eb002,cdp2w10_l06_s2_w4d31b665f-dc29-48c0-bc1b-1755fd32ff99,69,4975
897,15126.0,25426-L21-4,BRD-K83579280-001-05-8,25426,L21,4,SA1852719,BRD-K83579280,BROAD_CPD_ID,CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1nn(ccc1=O)-c1ccccc1,LIOAXJASPFPCTE-UHFFFAOYSA-N,cdp2w10_l21_s4_w22caaa6b9-2a4d-41cf-b2fa-c89f4c7c2471,cdp2w10_l21_s4_w33260eab3-b4f1-42f9-a203-dfc2ee5ac709,cdp2w10_l21_s4_w1090f311a-d4ec-4464-a62c-65ecf285b628,cdp2w10_l21_s4_w55cb691d6-947e-4ba1-8c61-34a942bb57c7,cdp2w10_l21_s4_w4a12b5a96-728a-4abd-bf0a-5060331dfbca,63,2914
898,52879.0,26204-E08-5,BRD-K98919736-001-05-9,26204,E08,5,SA1855191,BRD-K98919736,BROAD_CPD_ID,Fc1ccc(NC(=O)CN2C(=O)CSC2=O)c(F)c1F,LIUSCLYEBGVJRP-UHFFFAOYSA-N,cdp2w9x2-au00026617_e08_s5_w2fd1e96d3-7a8e-43f6-9220-2aad7aedfddd,cdp2w9x2-au00026617_e08_s5_w357dd3c6e-2938-4337-8ec6-e1417f4977a8,cdp2w9x2-au00026617_e08_s5_w128731608-56ea-4992-af8d-433f81ca5529,cdp2w9x2-au00026617_e08_s5_w5fa8bdbeb-4778-41aa-b089-a36b89312fea,cdp2w9x2-au00026617_e08_s5_w4529bff24-19c4-4a34-8bc6-88de48d07f73,46,7343
899,21801.0,25571-H14-1,BRD-K60605940-001-03-5,25571,H14,1,SA1856862,BRD-K60605940,BROAD_CPD_ID,COc1ccc(CCNc2ncnc3[nH]cnc23)cc1OC,LIUUGIOJOWHONS-UHFFFAOYSA-N,cdp2w11_h14_s1_w2e717744a-e4e9-425b-87fc-ad692c8f7074,cdp2w11_h14_s1_w3ce1b0a21-4526-4b5a-9dd3-84add390ec87,cdp2w11_h14_s1_w1436bd753-cb47-4ea9-9baa-4bbde2272a49,cdp2w11_h14_s1_w544b7a1a8-eda8-425d-af49-61e727cde0b7,cdp2w11_h14_s1_w477929248-625d-48e1-8527-ab38939d01cf,71,5893
900,22451.0,25573-G15-3,BRD-K04068887-001-05-5,25573,G15,3,SA1853867,BRD-K04068887,BROAD_CPD_ID,CC(C)NC(=O)COC(=O)c1ccccc1Oc1ccccc1,LIVNCTKXZFUZPF-UHFFFAOYSA-N,cdp2w11_g15_s3_w2c8ea4817-3d94-422c-8eba-b25065e2a31c,cdp2w11_g15_s3_w3476449d8-dba5-45e7-beaf-cc9b0c1561c5,cdp2w11_g15_s3_w1a1d44e21-2773-4014-95b2-dcbab73480b1,cdp2w11_g15_s3_w5c1528d3b-e4e0-44c5-b71c-e7d271c00bfc,cdp2w11_g15_s3_w426d34902-97c3-4258-a547-4fa5be341057,75,5861
901,47984.0,26110-M03-6,BRD-K61485947-001-06-7,26110,M03,6,SA1862123,BRD-K61485947,BROAD_CPD_ID,CCOC(=O)C1CCN(CC1)C(C)=C1C(=O)c2ccccc2C1=O,LJBVQFICKAVNOV-UHFFFAOYSA-N,cdp2w9x2_m03_s6_w2827ad33d-0648-4580-b3c9-01274a346d98,cdp2w9x2_m03_s6_w3111aeb40-5d0a-46bd-b980-a11b96d534cb,cdp2w9x2_m03_s6_w18d395b95-3abf-4f3f-9b2a-d425b5c417c9,cdp2w9x2_m03_s6_w5d69e51f6-10ad-4430-8241-884d44d61a9e,cdp2w9x2_m03_s6_w455f8e3e4-8249-42cc-8382-a529ddd04752,76,6308
902,9429.0,24751-A17-1,BRD-K05957858-001-02-0,24751,A17,1,SA666424,BRD-K05957858,BROAD_CPD_ID,COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO,LJFLDXJAOYTNMN-FGSXEWAUSA-N,cdp2w5_a17_s1_w2ec5b75cf-aa6a-4bdd-8a0a-7c7803af927c,cdp2w5_a17_s1_w37c897134-eb06-477e-9508-1cf876bb8835,cdp2w5_a17_s1_w196ada404-9a9c-4df1-a474-ae8340a120a2,cdp2w5_a17_s1_w5d5f3a2fe-29f2-45da-a823-8c0e3157ec95,cdp2w5_a17_s1_w423ffefb0-7afb-4545-ae20-1ed52ea8774f,37,10033
903,9091.0,24733-H12-5,BRD-K57873755-001-02-0,24733,H12,5,SA667006,BRD-K57873755,BROAD_CPD_ID,COc1ccccc1NC(=O)N(C)C[C@@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO,LJFLDXJAOYTNMN-HMFYCAOWSA-N,cdp2w5_h12_s5_w248753c96-1794-464d-849e-5567be2d030b,cdp2w5_h12_s5_w334a2157e-031a-4451-9965-27a0b66e8bc7,cdp2w5_h12_s5_w1bbae963e-ae99-444f-8273-d02c9643ebf7,cdp2w5_h12_s5_w545dfc2cf-1ef1-4d70-8be6-0c897e53594f,cdp2w5_h12_s5_w4d6321753-cffc-462f-a859-fea5e063151d,78,10068
904,3652.0,24306-P16-5,BRD-K17796732-001-02-0,24306,P16,5,SA792437,JWH-015,primary-common,CCCn1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc12,LJSBBBWQTLXQEN-UHFFFAOYSA-N,cdp2bioactives_p16_s5_w276a01c22-352f-40fc-bb2e-f6b913a9b176,cdp2bioactives_p16_s5_w36f82c012-3f1a-46d5-b966-0487c3264442,cdp2bioactives_p16_s5_w1a258251f-0383-41b5-a81a-3e8012355419,cdp2bioactives_p16_s5_w5fffd33ee-d26d-4643-81b4-c54da481444e,cdp2bioactives_p16_s5_w445df5ed8-403e-433d-b94d-17c94d545242,82,658
905,18118.0,25490-B10-2,BRD-K86813828-001-05-7,25490,B10,2,SA1860237,BRD-K86813828,BROAD_CPD_ID,Fc1ccccc1CN1C(=O)N\C(=C\c2c[nH]c3ccccc23)C1=O,LKEBYYIMIKDDMS-RQZCQDPDSA-N,cdp2w10-au00024359_b10_s2_w20f42d247-58ca-498e-8330-332540fa7fad,cdp2w10-au00024359_b10_s2_w34c470060-44a6-4990-902c-75c94248451d,cdp2w10-au00024359_b10_s2_w15b943c5b-5f87-418a-b1c0-4adc780db8c6,cdp2w10-au00024359_b10_s2_w5fdf4c42a-145b-47da-93d1-3653dc438c36,cdp2w10-au00024359_b10_s2_w455c9653b-2040-4873-b52d-e39764001700,42,6534
906,23610.0,25579-D03-4,BRD-A77134384-001-05-7,25579,D03,4,SA1860025,BRD-A77134384,BROAD_CPD_ID,COc1cc(NC(=O)C(C)Oc2ccccc2)c(cc1OC)C(O)=O,LKEPKOUIYQXLDG-UHFFFAOYSA-N,cdp2w11_d03_s4_w2c93377e6-ccdf-43b4-a99d-46f39e52dfd0,cdp2w11_d03_s4_w305593494-9275-43df-b892-d071343f5e32,cdp2w11_d03_s4_w169890244-f2c5-4316-988a-f1d966811d1e,cdp2w11_d03_s4_w501044e18-5951-46bd-9630-260cbb581929,cdp2w11_d03_s4_w49e3f27b3-52a7-4e4c-8dde-3a37f6ff93bb,58,7011
907,53863.0,26216-K03-5,BRD-K34703863-001-05-9,26216,K03,5,SA1855577,BRD-K34703863,BROAD_CPD_ID,Cc1ccc(C)c(c1)S(=O)(=O)N1CCN(CC(=O)Nc2sccc2C#N)CC1,LKSOXZFPPRSRAO-UHFFFAOYSA-N,cdp2w9x2_k03_s5_w2dde427e8-c24b-4cab-ac1c-0b5310151f21,cdp2w9x2_k03_s5_w3650ce81e-a153-4afc-bff5-51005f244c7b,cdp2w9x2_k03_s5_w1b924dfa9-21da-462f-913c-9dca5e4b4f4c,cdp2w9x2_k03_s5_w56b25ac92-2540-4ac7-b03e-6504afc98fef,cdp2w9x2_k03_s5_w44bc711aa-3fb7-43bd-b37d-b4fc3c3125c7,77,8363
908,10545.0,25378-M09-1,BRD-K02679776-001-05-5,25378,M09,1,SA1852563,BRD-K02679776,BROAD_CPD_ID,Cc1[nH]c2ccccc2c1\C=C\C(=O)c1ccncc1,LKXOPRJGYYWDEI-VOTSOKGWSA-N,cdp2w10_m09_s1_w2c9b81117-7a54-4e39-beb5-8c6059085b9e,cdp2w10_m09_s1_w339239df5-f296-43bf-ac1d-9da8cc1e2e8a,cdp2w10_m09_s1_w191865edf-6c61-4942-9d95-5312beeff63d,cdp2w10_m09_s1_w57202cf39-8925-4c49-bdb2-c4534c2a47bc,cdp2w10_m09_s1_w4513b1e3b-0f05-410e-9a02-979bdfb812f0,63,1451
909,36425.0,25700-H12-3,BRD-K53756135-001-05-5,25700,H12,3,SA1856537,BRD-K53756135,BROAD_CPD_ID,CCN(CC(=O)Nc1ccc2OCOc2c1)Cc1nc(O)c2ccccc2n1,LKXUWZZXBNQMRT-UHFFFAOYSA-N,cdp2w12_h12_s3_w2408cd1ef-2f62-453c-9c6f-96a7c73bf8fb,cdp2w12_h12_s3_w3ad7157c8-a454-4db3-b522-52644e99652f,cdp2w12_h12_s3_w1df21a806-1374-4d42-88b0-221d787cc57f,cdp2w12_h12_s3_w5dee81bc7-724c-4dba-9c19-07eff4e6db7f,cdp2w12_h12_s3_w47530e454-e309-491e-96b0-9d6ac867c48a,78,1907
910,37700.0,25724-D16-6,BRD-K63932701-001-05-4,25724,D16,6,SA1856601,BRD-K63932701,BROAD_CPD_ID,NS(=O)(=O)c1ccc(NC(S)=NC2CC2)cc1,LKZHBUZAWUGNOM-UHFFFAOYSA-N,cdp2w12_d16_s6_w23063d36d-e404-4226-854e-9e6e553faec0,cdp2w12_d16_s6_w32546b1a0-66f4-4d17-bb2e-4dd0c1894928,cdp2w12_d16_s6_w1d5856979-1d3f-4b87-8ba6-aec4757bf896,cdp2w12_d16_s6_w509b52573-5cea-4956-80b2-57c41b16a00d,cdp2w12_d16_s6_w410062458-8fb0-469c-8646-036433efba60,73,8422
911,13594.0,25416-F04-2,BRD-K11989972-001-05-9,25416,F04,2,SA1861527,BRD-K11989972,BROAD_CPD_ID,CCOC(=O)c1sc2nccc(N(C)C)c2c1N=CNOCc1ccccc1,LLBPKAIWBYHSTJ-UHFFFAOYSA-N,cdp2w10_f04_s2_w220b838d8-125b-484e-9a0e-fb810191cc69,cdp2w10_f04_s2_w38800ad13-bc41-4f87-94ce-a22f1a8f3cef,cdp2w10_f04_s2_w15867bd50-f319-4a1e-9077-315729693610,cdp2w10_f04_s2_w589f25a6a-751e-4869-8e66-d9afa3e7fbbf,cdp2w10_f04_s2_w420ee74f0-baaf-4357-9887-b8fbaa8f41dc,63,3580
912,17344.0,25438-M14-2,BRD-K33608055-001-05-9,25438,M14,2,SA1852968,BRD-K33608055,BROAD_CPD_ID,O=C(NCCOc1nc(nc(n1)N1CCCCC1)N1CCCCC1)Nc1ccccc1,LMCCBWSELFUBDN-UHFFFAOYSA-N,cdp2w10_m14_s2_w2701b631f-8c8f-4486-b9e8-da9e015cac74,cdp2w10_m14_s2_w3d72942b7-a124-4541-afdf-49f4583a1946,cdp2w10_m14_s2_w1eee20dd4-2141-44e5-8016-9a8808ef0077,cdp2w10_m14_s2_w5b7abbc9b-e4e4-4fc6-a5bf-343c2221e66e,cdp2w10_m14_s2_w400404c75-dfdf-4586-9920-53f47d983ef2,38,4959
913,20293.0,25566-L16-5,BRD-K58633762-001-05-1,25566,L16,5,SA1861403,BRD-K58633762,BROAD_CPD_ID,Clc1ccc(OCC(=O)Nc2ccc(cc2)N2CCN(CC2)C(=O)c2ccco2)cc1,LMEBUDRQJGLULG-UHFFFAOYSA-N,cdp2w11_l16_s5_w2f6a803bd-c052-4b52-82ce-ad1bc215ddb7,cdp2w11_l16_s5_w38ad72e93-7bc5-493b-8290-d889b9fa5d37,cdp2w11_l16_s5_w1ccaba27e-92c0-4c09-a8b9-8144cfef22b2,cdp2w11_l16_s5_w5678e5cda-06c7-4992-b127-265bbeeb2371,cdp2w11_l16_s5_w400311e0b-12fe-4217-9e01-75dbfb8b116c,61,5197
914,11522.0,25391-I16-6,BRD-K54894818-001-05-7,25391,I16,6,SA1858214,BRD-K54894818,BROAD_CPD_ID,N#Cc1c(nc(N2CCCCC2)c2CN(CCc12)C1CCCCC1)N1CCOCC1,LMHRUVOWZDZKLT-UHFFFAOYSA-N,cdp2w10_i16_s6_w251ebbeeb-0734-4ddf-896e-785ec8ea03d8,cdp2w10_i16_s6_w30b67eea6-ec6d-4ffe-9979-219de6ce2bc4,cdp2w10_i16_s6_w1aab0140d-2cf6-4f4d-b133-227d19d163e5,cdp2w10_i16_s6_w59f296014-bbca-42b7-b34a-d3cbf78313fe,cdp2w10_i16_s6_w4326a478b-91b3-4a6c-b3c8-03d314266231,71,5038
915,15493.0,25428-P11-5,BRD-K89630816-001-06-4,25428,P11,5,SA1859836,BRD-K89630816,BROAD_CPD_ID,Clc1ccc(\C=[N+]2/CCC(=O)[N-]2)cc1Cl,LMPZWYJEHZUASK-MKMNVTDBSA-N,cdp2w10_p11_s5_w2e18c8539-240e-4546-ac37-97124a4e9ae9,cdp2w10_p11_s5_w3495b9104-7536-4204-bd2a-26185a495d58,cdp2w10_p11_s5_w1e6e98f3d-776f-4260-97d9-4a19899460e9,cdp2w10_p11_s5_w5af2d9cce-e966-4a97-90b2-27fe99d25ba4,cdp2w10_p11_s5_w48718b813-b73e-4030-af36-d90372d1cd82,30,7504
916,21328.0,25569-O06-2,BRD-K63811550-001-06-0,25569,O06,2,SA1860371,BRD-K63811550,BROAD_CPD_ID,Cc1cccc(C)c1OCC(=O)N=Nc1c(O)[nH]c2ccc(Br)cc12,LMQLBFGGBUCAPF-UHFFFAOYSA-N,cdp2w11_o06_s2_w2bcc935e2-d698-4c6a-8ec9-2993450fd270,cdp2w11_o06_s2_w388edcbaa-0d2a-4985-9a5a-d6100f3f13d9,cdp2w11_o06_s2_w13dbe3196-78c3-405f-9430-839ee235fa42,cdp2w11_o06_s2_w54a2e6bda-e4dc-4ee8-917b-d3ccef82b59b,cdp2w11_o06_s2_w42a9b862f-5a68-46d3-b056-e0243ce8c503,14,4566
917,8871.0,24726-N21-1,BRD-K62191543-001-02-7,24726,N21,1,SA666748,BRD-K62191543,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O,LMWGPKORGYIWNW-VVZHRXSXSA-N,cdp2w5_n21_s1_w2ac96e946-8884-421b-8a48-60bb1d04d874,cdp2w5_n21_s1_w3faaab65f-6c5d-4c26-9b4d-f2c4fd99084c,cdp2w5_n21_s1_w1967a6e84-6b5a-4c80-9c7a-b7909f205f37,cdp2w5_n21_s1_w5934d84d0-be98-4493-b3d6-c0befc1830e8,cdp2w5_n21_s1_w4e96f81ad-07eb-429c-ba89-6a1323d69ff4,92,9929
918,10164.0,25376-C11-4,BRD-K18603805-001-05-2,25376,C11,4,SA1858207,BRD-K18603805,BROAD_CPD_ID,NC1=C(C#N)C2(CCCCC2)C(C#N)=C(N1)SCC(=O)c1ccc(Br)cc1,LNGPKGVQSMWPND-UHFFFAOYSA-N,cdp2w10_c11_s4_w2b882c52c-2da4-4bf6-99b0-1556d1f790a2,cdp2w10_c11_s4_w3b0505b86-71c3-4c1f-993d-ae5eded0eb9b,cdp2w10_c11_s4_w191d38efd-b489-4b7e-9d05-ec8622b5b5f8,cdp2w10_c11_s4_w5f7a4d0e2-f53a-4664-9bd0-30dd4c087068,cdp2w10_c11_s4_w4be9c63cd-30c9-4f45-975e-e8ab100a448b,34,1973
919,35656.0,25692-L15-2,BRD-K02381571-001-05-5,25692,L15,2,SA1857139,BRD-K02381571,BROAD_CPD_ID,Fc1ccc(cc1)-n1nnc(n1)-c1ccnc2ccccc12,LNWUZDAXRXUTPL-UHFFFAOYSA-N,cdp2w12_l15_s2_w22bd14e99-19cc-419f-b5b8-9db5921f8c11,cdp2w12_l15_s2_w3971997de-ec75-48a4-a113-d5b6428ae640,cdp2w12_l15_s2_w1dbe45ed8-6a3d-4796-a8e7-002f6b95cc8b,cdp2w12_l15_s2_w563f5fb61-560b-492b-b01d-637a8c45c6cb,cdp2w12_l15_s2_w4363dc9db-db59-446d-a1f0-c0265564f0e9,83,6654
920,1363.0,24293-P20-2,BRD-K98157055-001-04-2,24293,P20,2,SA792378,SIB 1757,to-be-curated,Cc1ccc(O)c(N=Nc2ccccc2)n1,LOCPVWIREQIGNQ-UHFFFAOYSA-N,cdp2bioactives_p20_s2_w2b9c48057-2c22-4fc5-b255-b8b1fa51b185,cdp2bioactives_p20_s2_w34eec028a-9f82-452f-9c44-fc20debf8e26,cdp2bioactives_p20_s2_w1922f1dcd-4737-4f6d-967c-29efbdc4a311,cdp2bioactives_p20_s2_w5036de52f-e0b2-4284-9f46-0a09121573d8,cdp2bioactives_p20_s2_w4fa435ce3-1edf-4c32-8279-85f1a37cb7b9,117,4813
921,47966.0,26110-L16-6,BRD-K39046749-001-05-8,26110,L16,6,SA1861729,BRD-K39046749,BROAD_CPD_ID,CCCn1c(SCC(=O)c2cc(OC)ccc2OC)nnc1-c1ccco1,LOCYCRDZJGPBQB-UHFFFAOYSA-N,cdp2w9x2_l16_s6_w2c41bd690-8702-459b-b914-2dde7a603fca,cdp2w9x2_l16_s6_w385a332db-cbd7-4736-aec5-ace6da2e7ad9,cdp2w9x2_l16_s6_w1bb2bee2a-054a-4ef5-82b8-d325232c28ac,cdp2w9x2_l16_s6_w5e7cc4bf8-990e-4a4e-95a4-543d2dc94956,cdp2w9x2_l16_s6_w4dde03be7-2750-4502-a830-8999e6073337,82,1658
922,1099.0,24280-O23-2,BRD-K97354755-001-01-5,24280,O23,2,SA63233,SU-6656,primary-common,CN(C)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3cc4CCCCc4[nH]3)c2c1,LOGJQOUIVKBFGH-YBEGLDIGSA-N,cdp2bioactives_o23_s2_w2b1d449fe-e969-4f61-a847-19fcd6e5ea36,cdp2bioactives_o23_s2_w39ad7cbf9-0592-4194-b4c7-5080a44fbc4c,cdp2bioactives_o23_s2_w1673d7b5b-37e2-49ba-b4f9-b2787eca5718,cdp2bioactives_o23_s2_w5f8306588-9276-4f51-af81-ff64531ae277,cdp2bioactives_o23_s2_w414d7bca9-8721-49f6-a315-565636bc461c,92,1306
923,55676.0,26662-N21-6,BRD-K54546524-001-01-7,26662,N21,6,SA1458776,BRD-K54546524,BROAD_CPD_ID,Cc1cccc(c1)S(=O)(=O)N1C[C@@H](O)COC[C@@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]12,LOPBZILAZMWERO-HTCHUFIESA-N,cdp2w13_n21_s6_w2aea7e706-4eef-4299-baca-12e50d6a91e2,cdp2w13_n21_s6_w3fa432601-e5b4-47f6-9d3f-a11f1a89f573,cdp2w13_n21_s6_w16d0b77b2-a871-4711-90bc-850f29049fdd,cdp2w13_n21_s6_w55f71d516-99ee-463a-8211-120f6373ccbe,cdp2w13_n21_s6_w447889f0c-b7a9-45f0-8599-dd4e3c19ae7a,66,10148
924,50539.0,26138-H13-5,BRD-K22069962-001-06-7,26138,H13,5,SA1855746,BRD-K22069962,BROAD_CPD_ID,CCN(CC)c1ccc2cc(C#N)c(=O)oc2c1,LOUYEVRVQGFIFB-UHFFFAOYSA-N,cdp2w9x2_h13_s5_w2963be66e-348e-4d65-a55e-0bfd36a9a589,cdp2w9x2_h13_s5_w3bc349639-be8a-4ca6-a528-39eb4835af0d,cdp2w9x2_h13_s5_w1fb6aaed1-3717-4251-8e84-beb006e6817f,cdp2w9x2_h13_s5_w56a40f2a7-2a9b-4a9f-b2dc-fb9ee68c731e,cdp2w9x2_h13_s5_w4ec7e58b3-54e1-479d-9e52-6b877a946a38,26,9097
925,51379.0,26166-A21-5,BRD-K49681465-001-05-2,26166,A21,5,SA1859633,BRD-K49681465,BROAD_CPD_ID,Fc1ccc2nc(Nc3ccccc3)sc2c1,LPCVVVLTUPKXIU-UHFFFAOYSA-N,cdp2w9x2-au00026617_a21_s5_w2e4a69a5a-663d-443e-a03a-2926b3a9fec4,cdp2w9x2-au00026617_a21_s5_w3a5040640-02be-43d0-8b35-c0c0acafd360,cdp2w9x2-au00026617_a21_s5_w1532e5ebe-eb84-491e-ac96-e1e819f2cdcb,cdp2w9x2-au00026617_a21_s5_w55cb99316-8f73-46ed-b5e1-8fdad0dd1b09,cdp2w9x2-au00026617_a21_s5_w4ddc4ceb0-211e-4bca-a02d-3ee8f23832fa,3,3877
926,13946.0,25418-L11-6,BRD-K93712505-001-05-2,25418,L11,6,SA1858865,BRD-K93712505,BROAD_CPD_ID,CCOc1cccc(NC(=O)CSc2nc(C)c3CCCCc3c2C#N)c1,LPEJECVDLDVRQG-UHFFFAOYSA-N,cdp2w10_l11_s6_w2d80c3347-5724-448f-88c4-23dbc65c4104,cdp2w10_l11_s6_w3ce33b9e9-f8a9-44e0-893f-fe3b8e008bd4,cdp2w10_l11_s6_w139f9278a-19d0-4f6c-9e2c-25bf40ae7da8,cdp2w10_l11_s6_w5709fb155-a7e6-4df3-9e33-c56660b2dfbd,cdp2w10_l11_s6_w497c252ea-a778-4a3f-bf14-dfa70f3ed4cb,75,9313
927,36784.0,25704-K22-2,BRD-A22299460-001-05-1,25704,K22,2,SA1857632,5-methoxy-N-(2-methoxy-1-methylethyl)-1H-indole-2-carboxamide,to-be-curated,COCC(C)NC(=O)c1cc2cc(OC)ccc2[nH]1,LPLUMFPBJGLPKS-UHFFFAOYSA-N,cdp2w12_k22_s2_w22b352b95-051e-45a7-a5b3-be6b9d1455cf,cdp2w12_k22_s2_w384f71dfa-9a57-4b4a-b4aa-dc123fcad406,cdp2w12_k22_s2_w18709bf31-4721-485d-a133-e212ca75c898,cdp2w12_k22_s2_w5e82216fe-d736-4acf-a794-571729c9de8a,cdp2w12_k22_s2_w47cee8fe5-07f6-454e-877c-4a2898acb1a6,90,8271
928,19777.0,25565-C03-5,BRD-A13883216-001-06-8,25565,C03,5,SA1858703,BRD-A13883216,BROAD_CPD_ID,Oc1ccc(Cl)cc1N\C=C(/C1OC(=O)c2ccccc12)[N+]([O-])=O,LPWFEDGLJDFTSH-MDWZMJQESA-N,cdp2w11_c03_s5_w24fc957b8-e1f5-4bd8-aa1e-e81a16c7f5d2,cdp2w11_c03_s5_w3f56dfcd4-b758-49ad-94e0-cd57b2a6ca21,cdp2w11_c03_s5_w1b7979e3c-f55c-4946-8d6c-c3c987dd01ca,cdp2w11_c03_s5_w585a8ff98-e66e-4b35-8a59-5d09244c5752,cdp2w11_c03_s5_w4b3c670c9-eee1-4152-a948-62e83b838e2e,50,2078
929,54408.0,26232-M17-4,BRD-K94832621-001-01-5,26232,M17,4,SA792976,Y 134,to-be-curated,CC(C)N1CCN(CC1)c1ccc(cc1)C(=O)c1c(sc2cc(O)ccc12)-c1ccc(O)cc1,LQEOPHGPHCWOAC-UHFFFAOYSA-N,cdp2w9x2_m17_s4_w29807d140-d447-40a1-bae7-a19a700fe0ec,cdp2w9x2_m17_s4_w3b77f378e-bf00-451c-b3c7-b71914eb876a,cdp2w9x2_m17_s4_w1ab65027e-b15b-48ac-8206-3d8df71ffb9d,cdp2w9x2_m17_s4_w5f4bfcb33-fa34-46a0-a0fc-4e60dcb0c3b3,cdp2w9x2_m17_s4_w469535153-009b-4b88-9308-2ab68bb1a77e,47,935
930,44465.0,25988-O19-3,BRD-K59284035-001-02-0,25988,O19,3,SA59063,chrysophanol,primary-common,Cc1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1,LQGUBLBATBMXHT-UHFFFAOYSA-N,cdp2w8x2_o19_s3_w26d40a585-5a80-4aa1-a73f-fb23d6ee37cb,cdp2w8x2_o19_s3_w3ea46bb12-b28f-4c53-9f49-32ce2fcca9c4,cdp2w8x2_o19_s3_w1e72af5cf-28bc-44cc-88c8-289b10b03b78,cdp2w8x2_o19_s3_w5bbde119a-39ba-4df2-a6b5-0691499ad6d2,cdp2w8x2_o19_s3_w48362908c-b7d3-488e-a58a-999b2bd20e48,68,477
931,35992.0,25694-N21-2,BRD-K60500314-001-05-1,25694,N21,2,SA1852423,BRD-K60500314,BROAD_CPD_ID,Clc1cc2OCCOc2cc1NC(=O)CCc1ccccc1,LQKZLYZBKGTRSC-UHFFFAOYSA-N,cdp2w12_n21_s2_w29a826466-31a9-49bc-97f2-10aec2be0849,cdp2w12_n21_s2_w375e60c58-7a7f-4a02-a729-311ca7a9dba4,cdp2w12_n21_s2_w1e4fd4a27-ab43-471b-8551-5e8cbb1beb95,cdp2w12_n21_s2_w550104414-3d0e-41fa-8d0e-0e76b1dbc88b,cdp2w12_n21_s2_w43d706d5c-07d3-4e0d-961d-819022121132,62,3110
932,39428.0,25891-F13-6,BRD-K90873269-001-01-0,25891,F13,6,SA929112,BRD-K90873269,BROAD_CPD_ID,OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)c(Cl)c2)C=C[C@H]1NS(=O)(=O)c1ccccc1,LRDWIZFOJOHHOT-CDHQVMDDSA-N,cdp2w6x2_f13_s6_w2a9d8aa5a-f498-4f9f-ac8b-196dc71649b8,cdp2w6x2_f13_s6_w35b4453c4-f5b5-4d31-a9f1-53e1a3e40124,cdp2w6x2_f13_s6_w1717a93bc-ea1a-4daf-9a97-4f0275e07782,cdp2w6x2_f13_s6_w5b158a2f4-ca39-4dd3-94b4-77d1b2722feb,cdp2w6x2_f13_s6_w49aee867c-b591-4e87-94cb-781ed391b394,108,10177
933,11108.0,25387-A12-6,BRD-K39163260-001-05-0,25387,A12,6,SA1859191,BRD-K39163260,BROAD_CPD_ID,Oc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1Sc1nc2ccccc2s1,LRNSEWVOKBURRE-UHFFFAOYSA-N,cdp2w10_a12_s6_w22887a148-b364-40b5-8129-3e9e36263241,cdp2w10_a12_s6_w368467707-ec0a-4c98-a8aa-5cf3cb06e05b,cdp2w10_a12_s6_w18dc31673-5f9e-4a1e-a0e2-a260e6eb2d9c,cdp2w10_a12_s6_w53d5c1456-eb7a-4b52-a678-20d9882f925b,cdp2w10_a12_s6_w4b11643b5-b543-47a7-b3e9-b8b2bfa9a67e,57,8611
934,52325.0,26202-E13-3,BRD-K43194993-001-05-3,26202,E13,3,SA1852191,BRD-K43194993,BROAD_CPD_ID,CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2ccccc2O)CC1,LRXLNMZQHZJZBB-UHFFFAOYSA-N,cdp2w9x2-au00026617_e13_s3_w23ac5de44-e820-4a98-ac57-d52e4403d1ec,cdp2w9x2-au00026617_e13_s3_w336e470db-2654-4136-998e-95856bcf4ae1,cdp2w9x2-au00026617_e13_s3_w1691f81b9-8ad5-4e41-b65e-3b79bac3a592,cdp2w9x2-au00026617_e13_s3_w586417a25-4a86-4154-8451-1fe8a008ce84,cdp2w9x2-au00026617_e13_s3_w4bc05d9f0-f1e7-40c9-9cb8-b87c33c1aab3,70,3340
935,20177.0,25566-F13-3,BRD-K00899044-001-05-7,25566,F13,3,SA1856534,BRD-K00899044,BROAD_CPD_ID,Cc1cc(C)cc(NC(S)=Nc2ccc(Cl)c(Cl)c2)c1,LSLBZAFVKUEBJS-UHFFFAOYSA-N,cdp2w11_f13_s3_w219b19dec-6527-4a75-9b6e-e6aa2f779e25,cdp2w11_f13_s3_w37a0b07d6-f7dd-4414-8a83-b5072784eb5c,cdp2w11_f13_s3_w122a6257b-7374-46bc-8d9b-699f4cbeab20,cdp2w11_f13_s3_w56b072b5a-a601-4f4d-914b-9b925930a956,cdp2w11_f13_s3_w400040ad6-f2c7-47b9-a115-23fa6f9fcf1d,83,7411
936,36434.0,25700-I12-6,BRD-A12306934-001-05-4,25700,I12,6,SA1862100,BRD-A12306934,BROAD_CPD_ID,CCN1CC2=C(OC(N)=C(C#N)C2c2ccc(OC)cc2)C(Cc2ccc(OC)cc2)=C1,LSLYBGCMZYXURD-UHFFFAOYSA-N,cdp2w12_i12_s6_w22e6c1ca0-91cd-4ea2-9a05-dbbcd00bc350,cdp2w12_i12_s6_w38fd38d35-bfbb-4062-9c08-f6eeb73f9d8f,cdp2w12_i12_s6_w1a429b2f2-046f-42ed-8a1b-a1e1899931f8,cdp2w12_i12_s6_w5d05f3b23-7a41-44b5-9b8d-f0a6f2d5c970,cdp2w12_i12_s6_w469d7c8ec-2495-49fd-8afd-d74095525f7d,71,5211
937,22875.0,25575-N04-1,BRD-A64862239-001-05-5,25575,N04,1,SA1855012,BRD-A64862239,BROAD_CPD_ID,CCCc1nc(SCC(=O)N2C(C)Cc3ccccc23)c2c(C)c(C)sc2n1,LSZQUPRZSNNOKU-UHFFFAOYSA-N,cdp2w11_n04_s1_w22da059ae-3696-4c17-9109-6f8f1cef47aa,cdp2w11_n04_s1_w3ef3b8c1f-31d7-4f35-a283-1dd5fc833c0f,cdp2w11_n04_s1_w1c27f4450-9583-4239-a8f4-4d8f896c685c,cdp2w11_n04_s1_w54b578a35-01cb-4402-a22a-14c23e091cbf,cdp2w11_n04_s1_w494115417-e61e-4256-8506-276b74453241,73,2046
938,43126.0,25984-D02-2,BRD-K23478508-001-03-7,25984,D02,2,SA82874,digoxin,INN,C[C@H]1O[C@H](C[C@H](O)[C@@H]1O)O[C@H]1[C@@H](O)C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3CC[C@@]4(C)[C@H](CC[C@@H]5[C@@H]4C[C@@H](O)[C@]4(C)[C@H](CC[C@]54O)C4=CC(=O)OC4)C3)O[C@@H]2C)O[C@@H]1C,LTMHDMANZUZIPE-PUGKRICDSA-N,cdp2w8x2_d02_s2_w2bb355445-e163-459e-be7d-edbbeea3ba49,cdp2w8x2_d02_s2_w3389f134b-2311-4cea-888f-43c30c0aabee,cdp2w8x2_d02_s2_w16338b402-578f-4d3f-a1ab-6aafaec28b39,cdp2w8x2_d02_s2_w5af3d9f51-8744-4e73-b417-696f53b56f0d,cdp2w8x2_d02_s2_w4d4f1d726-4ca1-4295-b14b-0b8cdf1b5f63,2,1276
939,46029.0,26060-F10-1,BRD-K81160595-001-05-9,26060,F10,1,SA1861477,BRD-K81160595,BROAD_CPD_ID,Cc1onc(c1C(=O)NC(=S)Nc1sc2CCCCc2c1C#N)-c1ccccc1,LTRHHYCDHDAFSE-UHFFFAOYSA-N,cdp2w9x2_f10_s1_w2c446eb79-06e8-4e27-8378-21918b938e60,cdp2w9x2_f10_s1_w3212979d5-b2eb-4c46-b242-fed28aa67a27,cdp2w9x2_f10_s1_w1f6715fb6-80da-451c-a071-fc636d505cb9,cdp2w9x2_f10_s1_w51796fae9-7bfc-48cb-a528-f0c99cd41e39,cdp2w9x2_f10_s1_w44d9f28eb-a306-4420-989b-f88c8a2d5a72,64,4754
940,29438.0,25642-C18-6,BRD-K39688447-001-05-2,25642,C18,6,SA1855743,BRD-K39688447,BROAD_CPD_ID,CCCn1cnc2cc(NCc3cccc(OC)c3O)ccc12,LTVSJAQANUCADC-UHFFFAOYSA-N,cdp2w12_c18_s6_w2f3a356c5-f40b-4c20-bd82-ec89db9b6eb8,cdp2w12_c18_s6_w388d4ff2c-81bc-4517-a551-6ef4c98b2be1,cdp2w12_c18_s6_w14a5ca65d-bcac-4389-9611-b7a84daa8275,cdp2w12_c18_s6_w503e95e41-85a3-4cec-8435-b7cab5d156a7,cdp2w12_c18_s6_w40a395f1b-52d7-4bca-a625-e9413d6f9607,63,6774
941,40238.0,25945-C18-6,BRD-A54845972-066-01-5,25945,C18,6,SA791991,dihydro-ergotamine,to-be-curated,CN1CC(CC2C1Cc1c[nH]c3cccc2c13)C(=O)NC1(C)OC2(O)C3CCCN3C(=O)C(Cc3ccccc3)N2C1=O,LUZRJRNZXALNLM-UHFFFAOYSA-N,cdp2w8x2_c18_s6_w2b22b2036-3708-4013-bed1-26df0de40ee6,cdp2w8x2_c18_s6_w391cb5d6f-3d31-43a5-925c-fe0feeb1df3e,cdp2w8x2_c18_s6_w12904e706-031a-437b-b75c-ad23a340ccb2,cdp2w8x2_c18_s6_w5b6815777-d138-4fc0-8244-8cf05f24af4d,cdp2w8x2_c18_s6_w4768135d0-81cb-4b39-82ae-822e28a00428,56,10547
942,37594.0,25708-N12-2,BRD-A56119076-001-05-6,25708,N12,2,SA1857665,BRD-A56119076,BROAD_CPD_ID,COC(=O)COc1ccc(Cl)cc1C1Nc2ccccc2C(=O)N1c1ccc(OC)cc1,LVQVEKLXWORDSL-UHFFFAOYSA-N,cdp2w12_n12_s2_w2aa5a520a-2b7b-4b07-8b1b-f57e9bb90561,cdp2w12_n12_s2_w3c307b0c8-61db-43fa-ac52-7bd17656148f,cdp2w12_n12_s2_w12f48ef7a-d320-40c0-b8a8-8087ef5ad95f,cdp2w12_n12_s2_w5072f0f3c-f392-4bc7-90ed-2bb37b3b56b8,cdp2w12_n12_s2_w40ffe3087-3741-4c9b-be9a-48bc500c289a,42,8677
943,35948.0,25694-M11-6,BRD-K59855942-001-06-0,25694,M11,6,SA1855700,BRD-K59855942,BROAD_CPD_ID,CCOC(=O)c1cc2occc2n1CC(=O)N1CCCc2ccccc12,LVRHABGQKFQNCY-UHFFFAOYSA-N,cdp2w12_m11_s6_w22b2a6e2f-a33b-41ab-b034-60b85c7151d2,cdp2w12_m11_s6_w3d7ac2a1b-9742-4f16-82b2-357cf1979f8b,cdp2w12_m11_s6_w19ec28075-5b23-4dc5-8192-115db0d1d08a,cdp2w12_m11_s6_w550c1009f-dba7-42ab-a89c-a30e0910e72d,cdp2w12_m11_s6_w4c7349d09-72ac-4b38-ac26-cb3cb599cab9,65,9427
944,26414.0,25591-H20-6,BRD-K44454431-001-05-0,25591,H20,6,SA1860026,BRD-K44454431,BROAD_CPD_ID,Cc1ccc(o1)C(c1ccc(C)o1)c1cccc(c1O)[N+]([O-])=O,LVYPAEPKTFJTIC-UHFFFAOYSA-N,cdp2w11_h20_s6_w2aec2f0b1-7494-4d81-8d05-ae583ea947ff,cdp2w11_h20_s6_w3aa316513-2cba-4499-9826-c11b35940c74,cdp2w11_h20_s6_w1f0c8b049-15a2-4c78-9cf7-bb906518cc56,cdp2w11_h20_s6_w5911aba17-56ce-47c4-b691-001f3fc4acb7,cdp2w11_h20_s6_w49de5a586-8c60-4c0c-a62c-c99b6258b060,81,7474
945,5498.0,24312-M23-3,BRD-K56429665-001-03-9,24312,M23,3,SA792988,calcipotriol,primary-common,C[C@H](\C=C\[C@@H](O)C1CC1)[C@H]1CC[C@@H]2[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](O)C1=C,LWQQLNNNIPYSNX-UROSTWAQSA-N,cdp2bioactives_m23_s3_w25b480860-5183-482b-bdc7-e12c3ad73f6b,cdp2bioactives_m23_s3_w33a243bd1-ac10-40ae-bf21-9dc191a71ce4,cdp2bioactives_m23_s3_w1bf79165a-4a03-45cc-a02e-4688e8aaccaf,cdp2bioactives_m23_s3_w5d3239e88-aa3c-42cc-87d5-abf2de3615f9,cdp2bioactives_m23_s3_w4fcf68ec8-fdad-469c-91cf-d8c1ecfb66f4,116,1355
946,49276.0,26126-G16-2,BRD-A60640164-001-06-6,26126,G16,2,SA1856861,BRD-A60640164,BROAD_CPD_ID,OC(=O)C1CCCCC1C(=O)Nc1ccc2OCCOc2c1,LWYYYWNLCLHWQV-UHFFFAOYSA-N,cdp2w9x2_g16_s2_w214311751-25f4-400b-93b5-7ce8ba056d8a,cdp2w9x2_g16_s2_w34222fc5b-757a-42e9-b654-9ae2d5b7b0d9,cdp2w9x2_g16_s2_w12378d479-1fbc-471f-bb25-349830c1b262,cdp2w9x2_g16_s2_w5f03bd51d-0be9-48fe-abb7-302bc1bf6484,cdp2w9x2_g16_s2_w4abb80674-0f25-499c-aef7-1fb250535ea4,65,3714
947,33014.0,25679-K13-6,BRD-K64129922-001-05-9,25679,K13,6,SA1855405,BRD-K64129922,BROAD_CPD_ID,CCCOc1ccccc1Cn1c2ccccc2oc1=O,LXCSCBRELHFMMF-UHFFFAOYSA-N,cdp2w12_k13_s6_w2dd112363-d074-4941-b2a3-fc4051595380,cdp2w12_k13_s6_w35a4e57eb-e792-4f3e-98c4-42f35a1b8161,cdp2w12_k13_s6_w1bd183236-c444-4ff0-a649-341116a129af,cdp2w12_k13_s6_w50e32e77b-9c8b-4a7e-a36c-1404cbd00661,cdp2w12_k13_s6_w49a71aa64-f62e-41e8-95e8-a1224f8411a3,58,4365
948,28619.0,25638-I15-3,BRD-A04618830-001-05-7,25638,I15,3,SA1852751,BRD-A04618830,BROAD_CPD_ID,CCC(Sc1nc2nnc(C)c2c(N)n1-c1cccc(Cl)c1)C(=O)NCCOC,LXNUZWHEMOKYNJ-UHFFFAOYSA-N,cdp2w12_i15_s3_w210e0ed4d-7d1f-4b0a-b0ae-5aefc3795788,cdp2w12_i15_s3_w3485c56bb-5288-4932-b981-39136cea4ad8,cdp2w12_i15_s3_w1f68ff474-da51-4b9a-aafc-0942b2c315ee,cdp2w12_i15_s3_w512180c12-3e2b-4143-acc4-2b163d5ff290,cdp2w12_i15_s3_w4d9e802b8-24b0-41ea-805c-f29ab2c3fd7b,84,3706
949,30941.0,25665-L15-3,BRD-K56312355-001-05-7,25665,L15,3,SA1853375,BRD-K56312355,BROAD_CPD_ID,OC(=O)CCc1ccc(-c2ccccc2)n1CC(O)=O,LXPFFYQTJXBQJX-UHFFFAOYSA-N,cdp2w12_l15_s3_w2686ec4bb-135b-42c8-868c-d7b0f5dac9d3,cdp2w12_l15_s3_w32a08e896-54e5-4373-abc6-3c098330b91b,cdp2w12_l15_s3_w12ce9d08a-900b-479d-9ffa-aeabaee11ecb,cdp2w12_l15_s3_w5e3f96162-8278-44a1-b699-883285c9f0b2,cdp2w12_l15_s3_w4c9a7e26b-2bd5-4ad3-b7bb-0c15422c99fd,71,7190
950,32291.0,25677-H04-3,BRD-K47004627-001-05-4,25677,H04,3,SA1860705,BRD-K47004627,BROAD_CPD_ID,CC1CCN(CC(=O)Nc2ccccc2Sc2ccccc2)CC1,LYPDZWFWTRSAIS-UHFFFAOYSA-N,cdp2w12_h04_s3_w25e19fa9b-9fb0-493d-b9a9-2bdd7651bd4f,cdp2w12_h04_s3_w3de9ab1d9-e3be-4fd4-a4a9-6014e0db0c12,cdp2w12_h04_s3_w1d24a9429-ef10-43fe-865c-7d37f6f3f51f,cdp2w12_h04_s3_w526f75420-a7fc-4213-9453-fe30c42d6c9d,cdp2w12_h04_s3_w4d56bce5a-b434-486f-9af2-f5908474b7e4,59,3938
951,53304.0,26205-L06-4,BRD-K14942344-001-05-6,26205,L06,4,SA1861764,BRD-K14942344,BROAD_CPD_ID,Fc1ccc(cc1)C(=O)CSc1nnc(COc2ccccc2)n1Cc1ccco1,LZGGMIYLNQXAPB-UHFFFAOYSA-N,cdp2w9x2-au00026617_l06_s4_w2bef7d014-f6de-404d-8a97-6cf596a1c4fd,cdp2w9x2-au00026617_l06_s4_w30a382582-440c-4a7b-9efc-d7b5a37fc05e,cdp2w9x2-au00026617_l06_s4_w160068e17-e1f6-43a5-bed8-df696838459a,cdp2w9x2-au00026617_l06_s4_w58822b6f9-0594-4b29-ae76-1d581c117d39,cdp2w9x2-au00026617_l06_s4_w4facd1d28-69bd-4fda-be28-1706445c11c6,73,1834
952,2640.0,24303-A01-1,BRD-A44966919-001-03-1,24303,A01,1,SA38455,boldine,primary-common,COc1cc-2c(CC3N(C)CCc4cc(O)c(OC)c-2c34)cc1O,LZJRNLRASBVRRX-UHFFFAOYSA-N,cdp2bioactives_a01_s1_w2e1beeed4-b35b-4ed1-bcf6-3e6a91e83c8c,cdp2bioactives_a01_s1_w30df3bfcb-c7a5-451b-8822-841dda239836,cdp2bioactives_a01_s1_w186f723a5-60f3-43ed-b952-9264cad73e36,cdp2bioactives_a01_s1_w5bafa76b1-c4c1-4e94-8430-0fb28438c344,cdp2bioactives_a01_s1_w44091d6af-06f8-46b3-b6d7-5f2ee5e5cf47,79,1994
953,7892.0,24591-C01-3,BRD-K81372179-001-01-3,24591,C01,3,SA432701,BRD-K81372179,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C,LZRQCLPDICKWHD-MBWUYLOXSA-N,cdp2bioactives_c01_s3_w2bf0d31b8-2fc9-4d8c-8e8f-548171a9b64d,cdp2bioactives_c01_s3_w34f60c9ce-faf7-4862-813e-8603e3dc597a,cdp2bioactives_c01_s3_w10337f219-d1bf-4801-ab34-c0cf52b722a6,cdp2bioactives_c01_s3_w5f549f6fb-a6a0-43c7-9448-673cea67427f,cdp2bioactives_c01_s3_w4638ac240-faf6-401f-9632-133ded3a54d0,58,10154
954,6518.0,24321-H21-3,BRD-K68143200-001-04-2,24321,H21,3,SA792541,NSC95397,common,OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O,MAASHDQFQDDECQ-UHFFFAOYSA-N,cdp2bioactives_h21_s3_w28bb1f892-8c06-4b92-89a0-2c1759e7b289,cdp2bioactives_h21_s3_w3e7cdc68e-0bc7-4cff-b953-67f13c218478,cdp2bioactives_h21_s3_w1f2d11755-84b0-4961-9adc-415881ac25fa,cdp2bioactives_h21_s3_w5f9684261-698c-4692-a7f0-737038e65bfa,cdp2bioactives_h21_s3_w4b7c1a90c-bdaf-4540-8692-f4612131af07,18,1067
955,18246.0,25490-G20-4,BRD-A00430899-001-05-9,25490,G20,4,SA1853675,BRD-A00430899,BROAD_CPD_ID,COC(=O)C1=C(CSc2nc3CCN(C)Cc3cc2C#N)OC(N)=C(C#N)C1c1ccc(F)cc1,MADHSJGAYLGOTF-UHFFFAOYSA-N,cdp2w10-au00024359_g20_s4_w20296e037-7d76-4c73-814b-d1eebd9e6565,cdp2w10-au00024359_g20_s4_w3bc20dac5-6597-4424-bfb2-39c3aed76e4e,cdp2w10-au00024359_g20_s4_w1e92fe3ec-503a-451f-b554-f58cb035cff0,cdp2w10-au00024359_g20_s4_w50b3396a0-fa72-418d-840a-2a9dfac77252,cdp2w10-au00024359_g20_s4_w4e7470c6f-1250-4744-a1d1-42f92abd80ad,65,9223
956,31647.0,25675-C22-1,BRD-K98146210-001-07-0,25675,C22,1,SA1854174,BRD-K98146210,BROAD_CPD_ID,COc1ccc(cc1)-c1nnc(Nc2ccc(CC(N)=O)cc2)c2ccccc12,MAECILYKCQUQAF-UHFFFAOYSA-N,cdp2w12_c22_s1_w2b9e4756d-299f-4672-936d-a199d8221075,cdp2w12_c22_s1_w309313b8c-16e3-4711-ab33-dc2f6eb8a9de,cdp2w12_c22_s1_w11dfbd5c7-53e4-4274-a1d4-ce6f9ed11d5d,cdp2w12_c22_s1_w543159b80-da8f-4cab-8914-283e7b96b8b2,cdp2w12_c22_s1_w4ff5a975a-f78e-49b2-b93d-4bb33caa0994,47,9105
957,344.0,24277-O17-3,BRD-K38197229-001-06-7,24277,O17,3,SA82195,bumetanide,INN,CCCCNc1cc(cc(c1Oc1ccccc1)S(N)(=O)=O)C(O)=O,MAEIEVLCKWDQJH-UHFFFAOYSA-N,cdp2bioactives_o17_s3_w2fcbd2d13-dfb2-4b7a-bacc-d7de770b39cb,cdp2bioactives_o17_s3_w3fc09ce33-c73e-42be-aa78-e6a008bed366,cdp2bioactives_o17_s3_w16d4ab385-7762-4f0a-8d94-adbf95cb3b76,cdp2bioactives_o17_s3_w51db70fb7-286d-475c-8e67-b8d6378ac33c,cdp2bioactives_o17_s3_w4215373c7-97bf-41f8-ac99-c00869947bf1,116,698
958,35464.0,25692-B17-2,BRD-K49464210-001-04-4,25692,B17,2,SA1861343,BRD-K49464210,BROAD_CPD_ID,C(NC1CCCCC1)c1c[nH]c2ccccc12,MAMUGDCJLAKCPT-UHFFFAOYSA-N,cdp2w12_b17_s2_w26d154a5c-1b46-4d87-b56d-c55ece5265b3,cdp2w12_b17_s2_w3aa3aaba5-5a9e-4e3c-9209-6fc6c420fe01,cdp2w12_b17_s2_w152d5c9ef-5e15-44f1-8b81-bc4c40079542,cdp2w12_b17_s2_w59fedd95f-d093-4337-b765-149a1084e5f4,cdp2w12_b17_s2_w450c5eb20-d8a1-4052-8344-f3118f305d91,59,9330
959,34241.0,25686-D07-3,BRD-K17476836-001-05-7,25686,D07,3,SA1853286,BRD-K17476836,BROAD_CPD_ID,COc1cccc(CNc2ccc(cc2)N2CCC(C)CC2)c1OC,MATSUFORSCSJSR-UHFFFAOYSA-N,cdp2w12_d07_s3_w2d33a9856-b61d-4184-b0cd-d6fd7ec5d048,cdp2w12_d07_s3_w3c08def99-e087-46b2-88bf-974cf94ac177,cdp2w12_d07_s3_w1c37d965c-984d-4554-99df-8fa4d59b138c,cdp2w12_d07_s3_w5e0328d13-4a70-4e9f-93c3-4f0b494d365d,cdp2w12_d07_s3_w4de3eb3e5-ff0a-4865-9ba0-7dd1450e7324,41,1493
960,24731.0,25583-M09-3,BRD-K90314108-001-05-1,25583,M09,3,SA1856561,BRD-K90314108,BROAD_CPD_ID,CCc1cccc(OCC(=O)Nc2ccc(cc2)S(=O)(=O)Nc2ccccn2)c1,MBUXEGUOLZAIGI-UHFFFAOYSA-N,cdp2w11_m09_s3_w25d2db6d5-329b-45c5-9f15-b0e70410d5a9,cdp2w11_m09_s3_w3cb7ede7d-9a6b-4d83-bdbb-8d5cd1932a8b,cdp2w11_m09_s3_w1ba4848c3-530a-4546-88ab-6f11673d8b1b,cdp2w11_m09_s3_w552135553-52cd-49ec-acec-7b744985f2cc,cdp2w11_m09_s3_w43349b433-4813-4fd8-a23e-2b69d313787a,49,8484
961,48914.0,26124-G14-6,BRD-K26252468-001-05-6,26124,G14,6,SA1858275,BRD-K26252468,BROAD_CPD_ID,COc1ccc(cc1Br)C(=O)NC(=S)NC(C)C,MBVNCKWMUMLRFQ-UHFFFAOYSA-N,cdp2w9x2_g14_s6_w25a42f662-b66d-46bc-b4e4-b0838181fce5,cdp2w9x2_g14_s6_w336638419-6aa7-49b9-a75e-7ac2ef0f73c4,cdp2w9x2_g14_s6_w15c186a36-dbe4-4785-a615-9b8d3a4df5e4,cdp2w9x2_g14_s6_w5e9c99e88-e39d-4b5a-a08f-2a2e7e40d0c4,cdp2w9x2_g14_s6_w4f183ea85-a883-43e7-abec-ed683ca493ab,77,2818
962,44381.0,25988-L04-3,BRD-K54411430-001-02-5,25988,L04,3,SA59682,robustic acid,primary-common,COc1ccc(cc1)-c1c(O)c2c(OC)c3C=CC(C)(C)Oc3cc2oc1=O,MBZKDBQDALOSRP-UHFFFAOYSA-N,cdp2w8x2_l04_s3_w260b5078a-16a9-451c-a542-eeb328e35a9e,cdp2w8x2_l04_s3_w3c4c0e99e-7f6a-433a-94dd-313ceadc8fff,cdp2w8x2_l04_s3_w122d7f9fa-6f2d-4bd4-8a15-3fa00ff4a738,cdp2w8x2_l04_s3_w500031af6-0389-4f8e-99c8-927ed895100b,cdp2w8x2_l04_s3_w4a0d33d96-c0d0-4f8e-b8da-8e731009f29c,88,1102
963,56092.0,26685-H21-2,BRD-K51175229-001-01-6,26685,H21,2,SA800339,BRD-K51175229,BROAD_CPD_ID,OC[C@H]1O[C@@H](CC(=O)NC2CCCC2)C[C@@H]2[C@H]1Oc1ccc(NC(=O)Nc3ccccc3)cc21,MCJXNBRGFCMFNB-RIPRBREISA-N,cdp2w13_h21_s2_w22931ad8a-4a62-430f-b5b1-e6c69b9af1bb,cdp2w13_h21_s2_w3b3779f18-4644-48e3-a1e8-77a032857046,cdp2w13_h21_s2_w14914bc89-5504-48b2-a9a0-435bace7def2,cdp2w13_h21_s2_w59ddb4c9f-f375-45fe-b395-dc5c777dd00b,cdp2w13_h21_s2_w4a51116eb-3393-43d0-9182-f018ed57ba82,122,10454
964,36685.0,25704-F08-5,BRD-K27616003-001-07-9,25704,F08,5,SA1855576,BRD-K27616003,BROAD_CPD_ID,CCc1ccc(NC2=NC(=O)\C(S2)=C\c2cc(OC)c(O)c(OC)c2)cc1,MDHXRSDCPWIQIZ-BOPFTXTBSA-N,cdp2w12_f08_s5_w21e13861d-4c57-43ca-a907-bfa194effab8,cdp2w12_f08_s5_w3541046fb-4fbf-4737-94cd-1bdef50f57c0,cdp2w12_f08_s5_w1ea755241-d415-4a54-b9e2-c597d0e57165,cdp2w12_f08_s5_w5c3301fe8-e41e-4a28-95ca-dc66d1fc3b7d,cdp2w12_f08_s5_w454acc4c3-be28-40d0-a798-18f6c9d35fe4,53,5986
965,13106.0,25410-O09-6,BRD-K23386514-001-05-9,25410,O09,6,SA1856822,BRD-K23386514,BROAD_CPD_ID,CCCc1cc(cs1)-c1nnc(S)n1Cc1ccccc1,MEAZJYZPOWUZGB-UHFFFAOYSA-N,cdp2w10_o09_s6_w24dff0894-aba9-48a3-8958-f35dc15cc909,cdp2w10_o09_s6_w3d483b80c-5b33-4f2a-9540-c4e97e16df69,cdp2w10_o09_s6_w144f95cb6-e7bf-41c4-98f3-766d8c5301eb,cdp2w10_o09_s6_w5e0579fc3-cd5f-4487-9318-538774c81cf6,cdp2w10_o09_s6_w4afd5200e-825b-488a-842b-882f76a23bbc,47,5247
966,7731.0,24563-P18-4,BRD-K38977317-001-01-6,24563,P18,4,SA102114,BRD-K38977317,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCCCC[C@@H](C)Oc2ccc(cc2C1=O)N(C)C,MEJMTXOOFVGIJM-KAMGSVSWSA-N,cdp2bioactives-au00026722_p18_s4_w275f93ea0-cb27-455a-a137-803168d764bc,cdp2bioactives-au00026722_p18_s4_w38fb3fd46-5d3a-414a-8b30-8bf17abb42d9,cdp2bioactives-au00026722_p18_s4_w1bc65fd70-0284-4345-833d-df9cb6dd2d32,cdp2bioactives-au00026722_p18_s4_w58a3cb453-6915-489e-b884-7c27e520e467,cdp2bioactives-au00026722_p18_s4_w4bcdbdb8e-f78e-48f9-b8c4-ec07cf4359e7,45,10429
967,7117.0,24357-H16-2,BRD-K68075732-001-03-5,24357,H16,2,SA83649,esatenolol,INN,CC(C)NC[C@@H](O)COc1ccc(CC(N)=O)cc1,METKIMKYRPQLGS-GFCCVEGCSA-N,cdp2bioactives_h16_s2_w23db608c5-c2c1-4982-9aa1-0648aeda096b,cdp2bioactives_h16_s2_w3b457575c-603d-471f-a807-c87aded7580c,cdp2bioactives_h16_s2_w10627e74a-9c42-46eb-925a-aaef0c1b1c03,cdp2bioactives_h16_s2_w5a2610c26-8dc9-4809-8ca3-4f41035fd56d,cdp2bioactives_h16_s2_w48eafafb3-a63b-48d7-9fd7-5c7edb06e737,146,1390
968,13481.0,25416-A05-3,BRD-K46028325-001-05-9,25416,A05,3,SA1859545,BRD-K46028325,BROAD_CPD_ID,COc1cccc(c1)C(=O)Nc1ccc2C(=O)NC(=O)c2c1,MEXLAWWGIJKKDH-UHFFFAOYSA-N,cdp2w10_a05_s3_w233ce80bf-3e5f-4949-b74b-95266cde762d,cdp2w10_a05_s3_w38a0b5850-16dc-4f74-b84b-ee44b5c8e474,cdp2w10_a05_s3_w1547044f1-f46a-46cd-8ba3-6d484fb16604,cdp2w10_a05_s3_w52e9a6b9d-b461-4a81-b1cc-dd085b44cef5,cdp2w10_a05_s3_w476b9d7f7-4714-4024-8510-00e42b67b7b2,29,1929
969,54290.0,26232-F14-6,BRD-K86434416-001-02-7,26232,F14,6,SA82136,selegiline,INN,C[C@H](Cc1ccccc1)N(C)CC#C,MEZLKOACVSPNER-GFCCVEGCSA-N,cdp2w9x2_f14_s6_w27dc1d230-a000-40fb-a9bb-1b3c171dea59,cdp2w9x2_f14_s6_w36de4c4ea-72f7-41d1-a6c8-6cc121fcf9c1,cdp2w9x2_f14_s6_w16ea43519-758e-4e2f-a6d7-b892ad20a14c,cdp2w9x2_f14_s6_w5d5fab116-ee8d-4595-9d18-e81f5f4675b1,cdp2w9x2_f14_s6_w4e076e5a9-e59f-4b09-aac8-28bdbcaef6e1,51,598
970,50408.0,26138-C03-6,BRD-K17416171-001-07-2,26138,C03,6,SA1853937,BRD-K17416171,BROAD_CPD_ID,CC(C)CC1=NN2C(S1)=NC(=O)\C(=C/c1c[nH]c3ccccc13)C2=N,MFLNIGJUHNYFBE-STBHAXGISA-N,cdp2w9x2_c03_s6_w23b331146-b1b6-46e0-a7a9-acdffd566981,cdp2w9x2_c03_s6_w3ecb1bb06-90ce-467c-9b15-d1f15c7362f2,cdp2w9x2_c03_s6_w10d1c96c1-4a25-4c34-8d84-10a07591da43,cdp2w9x2_c03_s6_w5b223f2ec-8eca-463b-b107-14ff5f2194dd,cdp2w9x2_c03_s6_w49a3f89dd-db46-42a2-8936-1ec05a848d43,53,3445
971,55582.0,26607-G14-2,BRD-K84439371-001-01-3,26607,G14,2,SA1322775,BRD-K84439371,BROAD_CPD_ID,OC[C@H]1O[C@H](CCNS(=O)(=O)c2ccccc2Cl)CC[C@H]1NC(=O)c1ccc(F)cc1,MGFIPLUDFSCRIT-QXAKKESOSA-N,cdp2w7x2_g14_s2_w2970250ad-9d52-4e6c-91fb-495abfcc1f1f,cdp2w7x2_g14_s2_w3f66ef86d-bb72-44d8-9555-c349a61c3b10,cdp2w7x2_g14_s2_w1436dfbb5-38ac-4e4e-9cbf-766fbbb96d63,cdp2w7x2_g14_s2_w5be77bd18-52fd-40e4-9be9-0e3e32879eaf,cdp2w7x2_g14_s2_w4060fcc3c-f1f6-4639-804f-0258b10add9d,93,10356
972,24201.0,25581-B08-1,BRD-K53101923-001-05-0,25581,B08,1,SA1852541,BRD-K53101923,BROAD_CPD_ID,CCn1c(S)nnc1-c1cc2ccccc2cc1O,MGJTUWIRWFUWOF-UHFFFAOYSA-N,cdp2w11_b08_s1_w22b86bf94-0870-40df-9e19-eb7e2372cf31,cdp2w11_b08_s1_w3dcb5206a-79df-4e90-8bff-1c2dfaf111de,cdp2w11_b08_s1_w19f64ee82-9611-48fb-ae69-99a048377e9b,cdp2w11_b08_s1_w5e37fda35-32b6-4920-8607-386af54b0292,cdp2w11_b08_s1_w4ae35c933-27df-45e1-b5c4-3666d008a45e,46,6670
973,19132.0,25553-B04-2,BRD-K00052415-001-06-2,25553,B04,2,SA1856527,BRD-K00052415,BROAD_CPD_ID,Clc1ccc(cc1C(=O)Nc1ccc2CCCc2c1)S(=O)(=O)N1CCN(CC1)c1ccccc1,MHIZILWBZBKEHC-UHFFFAOYSA-N,cdp2w11-au00029679_b04_s2_w2b7c21a1d-01b0-45a8-93aa-09000f23bdfd,cdp2w11-au00029679_b04_s2_w3cd1f476a-8401-4cc2-91f0-6221fd5a92b4,cdp2w11-au00029679_b04_s2_w1a8b15b45-edca-4bab-a1a1-b0eedfd83db9,cdp2w11-au00029679_b04_s2_w58e6e07b6-d856-4ee2-a21c-82615afd75c2,cdp2w11-au00029679_b04_s2_w4911b5524-ca44-4f48-a1a8-b08d5b639d64,62,7397
974,19959.0,25565-K22-1,BRD-K80660686-001-03-4,25565,K22,1,SA1853622,BRD-K80660686,BROAD_CPD_ID,COc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2c3nc4ccccc4n3c(S)nc2c1,MHNCNEAYEIKRDF-UHFFFAOYSA-N,cdp2w11_k22_s1_w2e896bb1e-66ad-4226-8445-8899ba49504d,cdp2w11_k22_s1_w347de2524-2f3b-4636-b291-8459ccb4c5a2,cdp2w11_k22_s1_w1b672f82e-46ba-4355-ae25-52227fde9d93,cdp2w11_k22_s1_w5b2af937d-d893-455e-8370-2dd45cc285b0,cdp2w11_k22_s1_w4950035d8-c30f-4fc6-a3be-8a275bfe57e6,46,7825
975,2774.0,24303-M20-3,BRD-A85216385-001-01-0,24303,M20,3,SA82641,3-alpha-BIS-(4-FLUOROPHENYL)METHOXYTROPANE,to-be-curated,CN1C2CCC1CC(C2)OC(c1ccc(F)cc1)c1ccc(F)cc1,MHNSOBBJZCWUGS-UHFFFAOYSA-N,cdp2bioactives_m20_s3_w2bcd2ec43-4396-4cc0-9127-f3ff9b84a1fb,cdp2bioactives_m20_s3_w392605d1e-6340-43b0-92ee-8649b9d56f34,cdp2bioactives_m20_s3_w1fa255da1-6ab7-4d0d-a8b5-efe765e07494,cdp2bioactives_m20_s3_w53825f825-996b-4c90-88fa-bc8037d5cd53,cdp2bioactives_m20_s3_w4780e9398-75b3-475d-9b32-df01da91cbaa,100,739
976,8446.0,24643-B08-2,BRD-K59821747-001-02-8,24643,B08,2,SA859601,BRD-K59821747,BROAD_CPD_ID,CCCC#Cc1ccc2c(O[C@H](CN(C)S(=O)(=O)c3cccc(OC)c3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1,MIBYCFWLJSOUAV-IPVFLDMMSA-N,cdp2w3_b08_s2_w22af63ab7-f29c-470a-8987-acefbe87e0d0,cdp2w3_b08_s2_w35687247a-948c-4677-974c-245b1d5da5d1,cdp2w3_b08_s2_w1c899ad49-6068-4228-964c-c8f57d512f7a,cdp2w3_b08_s2_w58bcdf306-f717-4cbb-bccf-ff2fef20683e,cdp2w3_b08_s2_w4091d39f5-f664-48ba-9e9e-f0142af29199,32,9773
977,17806.0,25488-D04-2,BRD-K71811334-001-05-5,25488,D04,2,SA1855010,BRD-K71811334,BROAD_CPD_ID,Cc1cccc(OCC(=O)NC(=S)N2CCCc3ccccc23)c1,MIFCIOSXIXIIRZ-UHFFFAOYSA-N,cdp2w10-au00024357_d04_s2_w206e85b3c-9312-49d8-8852-93188471ea4a,cdp2w10-au00024357_d04_s2_w337fd0acb-44ee-4f41-b2e5-3b77fa0aca68,cdp2w10-au00024357_d04_s2_w1231702d3-3751-4763-833d-b4966284d3a0,cdp2w10-au00024357_d04_s2_w53b217e66-1016-4445-b42e-453364edac2c,cdp2w10-au00024357_d04_s2_w42c6366a2-1191-4ac9-a308-28c7cbf25d76,48,7578
978,28623.0,25638-I21-1,BRD-A64915300-001-05-5,25638,I21,1,SA1861587,BRD-A64915300,BROAD_CPD_ID,CC(C)C(OC(=O)c1cc2oc(C)cc2n1C)C(=O)NCC1CCCO1,MIFOMLKDBYKSDC-UHFFFAOYSA-N,cdp2w12_i21_s1_w232fb3544-41a8-44c6-88d1-151e35425da6,cdp2w12_i21_s1_w3adb06b95-e52d-4165-b25e-121095b52276,cdp2w12_i21_s1_w198a83a18-2856-4f08-a2e4-e5ea12534a4c,cdp2w12_i21_s1_w57ef7dac0-5796-4331-8465-d73d0a5788eb,cdp2w12_i21_s1_w4242a3c6c-3c80-4ee6-9783-896e526189a5,68,7903
979,49627.0,26128-K08-5,BRD-K01285236-001-05-6,26128,K08,5,SA1858944,BRD-K01285236,BROAD_CPD_ID,Cc1cc(c2sc(N)nc2n1)C(F)(F)F,MIHOXIANEPXGEH-UHFFFAOYSA-N,cdp2w9x2_k08_s5_w21323f9eb-c373-49cf-ac59-75dacbd78021,cdp2w9x2_k08_s5_w31888ccfd-6aec-44dc-a303-212f9e7c9f03,cdp2w9x2_k08_s5_w199c8e2a9-7590-428d-8303-f6e769a97925,cdp2w9x2_k08_s5_w576b6b818-0fa3-4be3-9b33-05c9ef6429e1,cdp2w9x2_k08_s5_w4cdca0d93-eb77-4e90-ab44-7ed0a2ce9be9,67,3632
980,28209.0,25605-B04-1,BRD-K86738897-001-06-0,25605,B04,1,SA1855380,BRD-K86738897,BROAD_CPD_ID,Cc1onc(c1C(=O)NNC(=S)NC(=O)\C=C\c1cccs1)-c1ccccc1,MIMKBKGPDPZVSW-MDZDMXLPSA-N,cdp2w11-au00029692_b04_s1_w25d1cc939-e56d-4349-bce5-baedc9a1a0e7,cdp2w11-au00029692_b04_s1_w3313f8521-bbd0-4576-a142-08d208b8339c,cdp2w11-au00029692_b04_s1_w1ee9f4dd2-db8e-4793-a33e-b9e5281a7cb7,cdp2w11-au00029692_b04_s1_w50a2e7ac1-7d20-4904-ae2b-e04a3ba3b973,cdp2w11-au00029692_b04_s1_w42c0b9dbf-e9b0-4bb8-8449-a41df1f813bc,37,6506
981,16900.0,25436-H09-2,BRD-K17367766-001-06-0,25436,H09,2,SA1855886,BRD-K17367766,BROAD_CPD_ID,COc1ccc(C)cc1NC(=O)C(=O)NNC(=O)COc1ccc(Cl)cc1,MJAYKSVSWMXNOV-UHFFFAOYSA-N,cdp2w10_h09_s2_w2432a51ec-5ac8-4571-b727-75d79d6486d1,cdp2w10_h09_s2_w302974813-f233-4314-958e-e619c7f5572b,cdp2w10_h09_s2_w1c373cc9b-8c6b-465e-a49e-5d7db33856b3,cdp2w10_h09_s2_w5a25fd288-db8c-42c0-9716-e37027481bb6,cdp2w10_h09_s2_w4dc31b94a-a497-4a56-a6bf-1ec528f1d543,55,4962
982,3389.0,24306-E14-6,BRD-K05361803-001-01-3,24306,E14,6,SA63481,SC-10,common,CCCCCCCNS(=O)(=O)c1cccc2c(Cl)cccc12,MJMJERJFCHYXEM-UHFFFAOYSA-N,cdp2bioactives_e14_s6_w2dc06cc72-27a8-4b2a-8758-e007d16df525,cdp2bioactives_e14_s6_w3573e9768-27f9-4317-8c39-c31c94789490,cdp2bioactives_e14_s6_w1fc8d7d54-9724-4e2e-9ab4-043312afc1f7,cdp2bioactives_e14_s6_w5e026c904-b7cb-41ef-995d-074a54190b29,cdp2bioactives_e14_s6_w4a7531f3b-4136-484c-890f-1508d55f2033,132,3964
983,32220.0,25677-E03-4,BRD-K58576780-001-05-0,25677,E03,4,SA1858273,BRD-K58576780,BROAD_CPD_ID,COC(=O)c1ccc(C(=O)OC)c(NC(=S)N2CCN(C)CC2)c1,MJOUQLXHYGATDU-UHFFFAOYSA-N,cdp2w12_e03_s4_w2e4e6d2b1-10b3-4da4-ba50-70dfa85e2805,cdp2w12_e03_s4_w3fc146679-8a31-43d2-9ccd-919737c9df03,cdp2w12_e03_s4_w1f843de84-c062-4ab8-870f-6bca1a9f4e36,cdp2w12_e03_s4_w554da8d1c-524a-431a-80f4-5e8c51c43030,cdp2w12_e03_s4_w4d840e4c3-f545-4abf-af43-4252c7370e3f,69,2960
984,35530.0,25692-E18-2,BRD-K75438609-001-07-7,25692,E18,2,SA1853103,BRD-K75438609,BROAD_CPD_ID,O=C1OC2(CCCC2)OC(=O)C1=Cc1c[nH]c2ccccc12,MJWHROGCWPIPKO-UHFFFAOYSA-N,cdp2w12_e18_s2_w2696bd9b5-68f0-453c-b741-b70975e44f06,cdp2w12_e18_s2_w351d619e7-655f-426d-ac0e-7ab57434ce53,cdp2w12_e18_s2_w1b340e001-3bc0-45e1-a6b6-e9e9984c8afc,cdp2w12_e18_s2_w52adbe13c-9343-492f-8c4c-c64aa11b7769,cdp2w12_e18_s2_w4e5aaf6fe-97c3-4b4a-8844-b0f11f1ab042,65,3529
985,38272.0,25725-O12-2,BRD-K95356204-001-05-0,25725,O12,2,SA1858062,BRD-K95356204,BROAD_CPD_ID,CCCNC(=O)c1ccc2c(c1)nc1scc(-c3ccc(C)cc3)n1c2=O,MJZXHNHXKGHOTR-UHFFFAOYSA-N,cdp2w12_o12_s2_w2ae657973-565b-4cef-9a33-c2e416535c8a,cdp2w12_o12_s2_w3d08bb97e-6289-42e3-a771-f704760cf2f6,cdp2w12_o12_s2_w1774b8183-fe94-4624-9bf5-be9f0f3623bf,cdp2w12_o12_s2_w5f67cf514-9488-4ad1-ad27-142110b3637f,cdp2w12_o12_s2_w4354e5b0e-3072-4b1b-872c-baa836dd72aa,46,8121
986,31755.0,25675-H18-1,BRD-K65489619-001-06-2,25675,H18,1,SA1853350,BRD-K65489619,BROAD_CPD_ID,CC(C)(C)c1ccc(cc1)\C=C\C(=O)NC1=NCCS1,MKBNQMCQEMJHFS-RMKNXTFCSA-N,cdp2w12_h18_s1_w2f675558f-0ec9-40e5-bc8a-3d7cb8c988f8,cdp2w12_h18_s1_w39613fcd1-6eda-4065-92bf-a1367d1af63b,cdp2w12_h18_s1_w115707439-b248-4786-abfe-ddd71dba2a03,cdp2w12_h18_s1_w53463487a-efe3-42b1-9331-316353add665,cdp2w12_h18_s1_w4fc53499d-cc88-4970-909a-3aa9968ed75b,74,1574
987,27137.0,25593-P06-3,BRD-K27354087-001-05-0,25593,P06,3,SA1860186,BRD-K27354087,BROAD_CPD_ID,COC(=O)c1ccc(COc2cc(C)cc3oc(=O)c4CCCCc4c23)o1,MKKXFJVEZIBZJT-UHFFFAOYSA-N,cdp2w11_p06_s3_w24d73afd8-1495-4c84-b93a-6a8441c19eca,cdp2w11_p06_s3_w3ef586c3b-f360-49c0-8d09-3d8216545867,cdp2w11_p06_s3_w1f9356d5e-e5b1-4f85-8b48-4a8d0d04438d,cdp2w11_p06_s3_w569402399-db2c-41f2-b7fc-491dd0b42a74,cdp2w11_p06_s3_w417584311-e76d-4e9c-be30-7303dd4286a0,68,8003
988,28281.0,25605-E05-1,BRD-K86326540-001-05-7,25605,E05,1,SA1860329,BRD-K86326540,BROAD_CPD_ID,Cc1c(C)c(=O)oc2cc(OCC(=O)OCC=C)ccc12,MKPOGFKSYUTWKG-UHFFFAOYSA-N,cdp2w11-au00029692_e05_s1_w21d3c8411-d90c-41ec-8fbd-ab6a1300ecf1,cdp2w11-au00029692_e05_s1_w3ac6b5290-f8ca-4997-9c5f-fdb3d4c5d5bb,cdp2w11-au00029692_e05_s1_w12396e722-7a5a-45bb-8513-ede5442e34f8,cdp2w11-au00029692_e05_s1_w5e1b4eb6f-87dc-41d7-86ba-f43780a93068,cdp2w11-au00029692_e05_s1_w497d4d43b-fe18-40b6-aed1-370c3a6a7a61,78,1558
989,1824.0,24296-G17-1,BRD-K28307902-001-04-3,24296,G17,1,SA59301,flutamide,INN,CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O,MKXKFYHWDHIYRV-UHFFFAOYSA-N,cdp2bioactives_g17_s1_w2e35b7e53-1352-403e-93a2-95dd52328b0e,cdp2bioactives_g17_s1_w3c32f8a33-c2b1-46d8-91dc-4f33efa772ab,cdp2bioactives_g17_s1_w1ed708e60-c73e-4882-88af-a1229b1d842e,cdp2bioactives_g17_s1_w5da24a32c-cde0-4d06-8a58-4b56bcbca5f7,cdp2bioactives_g17_s1_w4c7406fc1-3d60-4d50-a17f-84b15b59faa3,134,439
990,36002.0,25694-O21-6,BRD-K11018825-001-05-6,25694,O21,6,SA1860524,BRD-K11018825,BROAD_CPD_ID,CCOc1ccc(cc1)C(=O)N(Cc1ccc(OC)cc1)Cc1cc2cc(OC)ccc2nc1O,MLAUSULBYMVQSR-UHFFFAOYSA-N,cdp2w12_o21_s6_w2466bb822-c585-43e2-9a47-546cb385c79a,cdp2w12_o21_s6_w33eeb4451-3b4a-4e64-8691-06863d5f7f56,cdp2w12_o21_s6_w14f379aa6-3d78-42df-91d2-bdc10fcc709f,cdp2w12_o21_s6_w5319fb3d7-b2b4-4ef6-ae48-416158419bfa,cdp2w12_o21_s6_w4f6f48895-34d2-485c-b58f-56bdbc3769f5,98,7936
991,37742.0,25724-G14-6,BRD-K93545925-001-05-8,25724,G14,6,SA1857394,BRD-K93545925,BROAD_CPD_ID,CC1(C)CC(=O)C(=NNc2ccc(cc2)-c2ccccc2)C(=O)C1,MLOFCFMKIBGBRP-UHFFFAOYSA-N,cdp2w12_g14_s6_w2bba153e9-a4bc-4cb5-b59f-a9cc832b476b,cdp2w12_g14_s6_w3b8aa280a-85ea-4ea2-9751-f73a50ffb99d,cdp2w12_g14_s6_w1e0ffa968-9de2-4887-a2d0-dd924a6eb2a4,cdp2w12_g14_s6_w5aabbefed-d053-4d0c-a7b1-dd61fd21885d,cdp2w12_g14_s6_w4f87fd848-05f7-42f7-9efd-27bff4ebaa77,85,9034
992,51575.0,26166-I15-3,BRD-K30799912-001-06-0,26166,I15,3,SA1860295,BRD-K30799912,BROAD_CPD_ID,Clc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2,MLUHBNBLLWQMDJ-UHFFFAOYSA-N,cdp2w9x2-au00026617_i15_s3_w2b588936b-5ab4-4d57-8f44-8049da114715,cdp2w9x2-au00026617_i15_s3_w3aac418e0-6333-4381-8f12-f142dfa726c1,cdp2w9x2-au00026617_i15_s3_w178354109-0e9e-4068-82b2-d4e922706bf4,cdp2w9x2-au00026617_i15_s3_w57ebed377-2c6b-4dbb-b3cb-868baa0723ae,cdp2w9x2-au00026617_i15_s3_w4d533982f-5942-4a7a-813a-5641e69b78d2,91,1577
993,12826.0,25408-P21-2,BRD-A41183160-001-05-7,25408,P21,2,SA1859832,BRD-A41183160,BROAD_CPD_ID,OC1(C2CCCCCC2=NN1C(=O)c1ccco1)C(F)(F)F,MLZOQSJEXLROFX-UHFFFAOYSA-N,cdp2w10_p21_s2_w2f9ce0a2e-6937-46c1-a487-c7b575f1c03f,cdp2w10_p21_s2_w39c8bb689-ca36-459d-a0e8-39e48c6c69b1,cdp2w10_p21_s2_w178ca9b39-3496-43f5-8e46-56f7b881379f,cdp2w10_p21_s2_w50b2fa247-b8f6-4189-a394-cd798ff70369,cdp2w10_p21_s2_w4ef5798ed-d21e-4ce0-ac90-186c2adbf10b,32,1952
994,35371.0,25690-L14-5,BRD-K57202717-001-06-0,25690,L14,5,SA1853451,BRD-K57202717,BROAD_CPD_ID,CCN(CCCn1c(=S)[nH]c2ccc(cc2c1=O)N1CCOCC1)c1ccccc1,MMGHBKRCUCRVNT-UHFFFAOYSA-N,cdp2w12_l14_s5_w2e3106b9d-cb34-46c2-9f1d-ecae5f00ed35,cdp2w12_l14_s5_w3bde3257c-c3d4-4b8d-bead-0d639dea9ef9,cdp2w12_l14_s5_w1c0fe3563-95be-4641-ba90-767b59fd77db,cdp2w12_l14_s5_w5d2a1f5be-f553-43ee-8600-febbe4c4279b,cdp2w12_l14_s5_w46ab05943-dfbb-4dc9-8d58-32641d862392,54,3104
995,55160.0,26271-H19-6,BRD-K98889734-001-05-6,26271,H19,6,SA1856743,BRD-K98889734,BROAD_CPD_ID,FC(F)(F)c1c[nH]c2c(nnc2c1)-c1ccccc1,MMNAKMWOCMAJNU-UHFFFAOYSA-N,cdp2w9x2-au00026606_h19_s6_w22edfd2cf-b7b5-4232-bca5-9161a0b5ca74,cdp2w9x2-au00026606_h19_s6_w34f85d64f-f9ac-4545-94d2-c03b5d568fdf,cdp2w9x2-au00026606_h19_s6_w1c299d763-3ebe-47a1-8a02-1855ccbd2a4e,cdp2w9x2-au00026606_h19_s6_w5a6a00bf3-25f6-4c51-b04a-dd33f9b31eca,cdp2w9x2-au00026606_h19_s6_w42404caa9-8e3c-46f3-a080-6616173f2a23,76,5476
996,55965.0,26680-G21-1,BRD-K38144989-001-01-0,26680,G21,1,SA418294,BRD-K38144989,BROAD_CPD_ID,CC(C)COC(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@@H](C)CO,MNAJUJYQFCFYAB-ZIFCJYIRSA-N,cdp2w13_g21_s1_w2de656185-4ce7-4e4e-a3da-74488d2be088,cdp2w13_g21_s1_w38aeb8616-e55e-40d6-b3b6-003fc955c201,cdp2w13_g21_s1_w15181fe73-19c8-49eb-846a-e9e94f259758,cdp2w13_g21_s1_w5024fd8ec-8066-4087-a245-74b585a56490,cdp2w13_g21_s1_w4b43bd203-24cf-401f-93c9-b3bde3f9463a,129,9968
997,23084.0,25576-H15-6,BRD-K78234015-001-05-9,25576,H15,6,SA1857160,BRD-K78234015,BROAD_CPD_ID,CC(=O)Nc1ccc(cc1)C(=O)NCCc1ccccc1,MNPSTSJIPGRCAX-UHFFFAOYSA-N,cdp2w11_h15_s6_w28dd5fa4d-48af-4080-b016-761165530cf8,cdp2w11_h15_s6_w336c7c369-a92d-4f24-97e2-34f629bf5126,cdp2w11_h15_s6_w184910a41-088c-48ef-8101-bc8bfba5ffe6,cdp2w11_h15_s6_w5d0ed2c2f-3cad-4043-9f94-151899ae1b98,cdp2w11_h15_s6_w42918f0b5-7cd6-413d-9ac2-a88116deac51,69,7309
998,24653.0,25583-I14-3,BRD-K54839924-001-05-3,25583,I14,3,SA1856945,BRD-K54839924,BROAD_CPD_ID,Oc1nc(nc2n(Cc3ccccc3Cl)nnc12)C1CCN(CC1)C(=O)Cc1cccs1,MNRIXBGUJBMPDM-UHFFFAOYSA-N,cdp2w11_i14_s3_w26c1075bd-9881-4b7a-a52e-1204ca97878c,cdp2w11_i14_s3_w3fc56b9f9-c0ae-4e5c-a617-f6c49b04c93e,cdp2w11_i14_s3_w16662bcec-78be-4976-8a7a-5756d5a239b1,cdp2w11_i14_s3_w52cacd9fd-667c-4154-af9e-41f2a8761dba,cdp2w11_i14_s3_w4f7295b31-d9b0-440c-92ab-fdb5ef8a8408,81,5377
999,17292.0,25438-H22-4,BRD-K71608445-001-05-1,25438,H22,4,SA1854563,BRD-K71608445,BROAD_CPD_ID,Fc1ccc(SCC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)cc1,MOAJUWCZSDEERL-UHFFFAOYSA-N,cdp2w10_h22_s4_w260b88f67-b602-4790-900e-8542d10acfb6,cdp2w10_h22_s4_w3f6dc609f-3691-4814-a342-401493a28b90,cdp2w10_h22_s4_w164c71122-e8e6-4a92-b5d7-b548b8573e66,cdp2w10_h22_s4_w5e3cd5775-633f-41aa-89fe-1ddd4e8c1a89,cdp2w10_h22_s4_w47475a9b3-a6dc-4938-9659-687ab660da77,56,1526
1000,27089.0,25593-N05-3,BRD-K15742845-001-06-1,25593,N05,3,SA1856018,BRD-K15742845,BROAD_CPD_ID,Cc1cc(C)n2cc(CSCC(O)=O)nc2n1,MOKSCDRNNQRPRU-UHFFFAOYSA-N,cdp2w11_n05_s3_w2f55cacd2-a0b5-4095-af9f-2b0cacea7141,cdp2w11_n05_s3_w3418d572d-b788-4a02-8d21-106d60103743,cdp2w11_n05_s3_w156e73489-7c46-46b3-9a71-6dda435e32af,cdp2w11_n05_s3_w558ad750f-3888-44f5-8723-177d1ab8111d,cdp2w11_n05_s3_w469d1c54b-0504-489b-9429-06e13a25acee,73,3782
1001,37390.0,25708-F16-2,BRD-K26278645-001-05-7,25708,F16,2,SA1855724,BRD-K26278645,BROAD_CPD_ID,CCn1c2ccc(NC(=O)CCl)cc2oc1=O,MOXIZUOIEDHYCB-UHFFFAOYSA-N,cdp2w12_f16_s2_w2b370f8f9-a32d-457d-a037-b64886840de9,cdp2w12_f16_s2_w3cf385e76-b4c2-4506-982e-327494a627ce,cdp2w12_f16_s2_w16db194e8-f40f-467f-9ecd-1b933d163885,cdp2w12_f16_s2_w51496c05b-b62c-4377-b518-cfcfb72d090f,cdp2w12_f16_s2_w492398214-a2ef-4eb7-9921-55ced91d4e5b,6,5091
1002,21359.0,25569-P19-3,BRD-K47271938-001-06-1,25569,P19,3,SA1859691,BRD-K47271938,BROAD_CPD_ID,COc1ccc(cc1OC)C(=O)n1cc(cn1)C(=O)c1cc(C)ccc1O,MPMQKZNBYNBNSF-UHFFFAOYSA-N,cdp2w11_p19_s3_w28e8797ae-66b0-4a4a-8793-e630fd8fc400,cdp2w11_p19_s3_w3591fb695-c88b-4829-9ed4-8a71dcdb5303,cdp2w11_p19_s3_w1ba73977b-84ed-42e3-8137-69e9124ff981,cdp2w11_p19_s3_w54232d9c2-be11-477a-aee4-03d7d0fcd861,cdp2w11_p19_s3_w4623bc810-1f07-4327-b42a-39de93c63e41,58,2615
1003,55020.0,26271-C07-4,BRD-K68072222-001-05-4,26271,C07,4,SA1853293,BRD-K68072222,BROAD_CPD_ID,Brc1ccc(o1)C(=O)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1,MPQDYLJVMYGFRE-UHFFFAOYSA-N,cdp2w9x2-au00026606_c07_s4_w2ffb776a9-afd1-4fe9-b65e-3b3ef89ba383,cdp2w9x2-au00026606_c07_s4_w3b1ce63e2-fdc9-4aab-9ac7-73faee04b329,cdp2w9x2-au00026606_c07_s4_w1dad72a1c-0784-4e9a-8de8-58130027ebb3,cdp2w9x2-au00026606_c07_s4_w56254d321-9153-4ce3-a18a-bd8b7838ee8f,cdp2w9x2-au00026606_c07_s4_w47cff3b9b-cc49-4ff6-9dc2-669f7df25cd4,64,2537
1004,19085.0,25503-P15-3,BRD-K61596148-001-06-8,25503,P15,3,SA1854492,BRD-K61596148,BROAD_CPD_ID,Cc1nc2c(cc(Oc3ccc(cn3)S(=O)(=O)N3CCOCC3)c3ccsc23)s1,MPSXPWMJSXBEON-UHFFFAOYSA-N,cdp2w11-au00029680_p15_s3_w283df2045-6bce-4bc4-8137-8f8e3a138bf2,cdp2w11-au00029680_p15_s3_w38cb664f0-6043-4016-b2b2-f6d219555335,cdp2w11-au00029680_p15_s3_w175790589-fd69-43f4-8d70-bd177d9f297c,cdp2w11-au00029680_p15_s3_w5fe60ab6b-dd8b-4459-a817-da3ade2e58b6,cdp2w11-au00029680_p15_s3_w42bf59563-2598-47b3-bf90-6ab20417873c,38,3084
1005,48986.0,26124-K14-6,BRD-K23940360-001-05-8,26124,K14,6,SA1854731,BRD-K23940360,BROAD_CPD_ID,Clc1ccc(NC(=O)c2cc3COc4ccccc4-c3s2)nc1,MQEIINXDSUUUBD-UHFFFAOYSA-N,cdp2w9x2_k14_s6_w284407723-4385-4fc2-9ab0-a44ff39ef9eb,cdp2w9x2_k14_s6_w3e8a4300f-b29f-42f7-ba83-6553e67b9b74,cdp2w9x2_k14_s6_w185b196ca-328d-41da-9718-8632e4073927,cdp2w9x2_k14_s6_w58253dc29-c564-49dd-af7c-2c8b1567309b,cdp2w9x2_k14_s6_w4997d7980-3956-4e5e-903d-428935aa94cf,121,3645
1006,38427.0,25726-I04-1,BRD-K53035405-001-05-7,25726,I04,1,SA1856071,BRD-K53035405,BROAD_CPD_ID,Clc1cccc(OCC(=O)Nc2ccc3CCCc3c2)c1Cl,MQRPMZUQJJIFBP-UHFFFAOYSA-N,cdp2w12_i04_s1_w2364c9fb1-7436-458e-ba34-e4e12b7c5b05,cdp2w12_i04_s1_w3cbdd77a5-c518-4854-b24a-85e2669dc16e,cdp2w12_i04_s1_w195b7a9bc-4cf8-4138-8a9d-dec186ea5db5,cdp2w12_i04_s1_w591c1317d-5c23-416d-995e-664724a7e694,cdp2w12_i04_s1_w409f23943-49cc-42e0-ac4c-0cf3bbbd517c,66,7601
1007,28377.0,25605-H20-1,BRD-K54922437-001-06-5,25605,H20,1,SA1861493,BRD-K54922437,BROAD_CPD_ID,Cc1ccc2nc(cn2c1)-c1ccc(cc1)S(=O)(=O)N1CCCCC1,MQSQEXCUZALYQZ-UHFFFAOYSA-N,cdp2w11-au00029692_h20_s1_w2e0fd159a-27d6-4709-9623-426f8f965195,cdp2w11-au00029692_h20_s1_w3f2244bdf-09b8-4a93-a8a9-55609981c11a,cdp2w11-au00029692_h20_s1_w199416836-a3f5-4ec9-9cfc-e5f56b124dcb,cdp2w11-au00029692_h20_s1_w5f5627ace-d336-4664-b784-91a717951743,cdp2w11-au00029692_h20_s1_w4bb25bd6f-6851-41bc-8008-a7b4b4689fbc,60,8918
1008,31995.0,25676-F18-1,BRD-A45657137-001-06-4,25676,F18,1,SA1862221,BRD-A45657137,BROAD_CPD_ID,CCOC(=O)C1=C(N=c2sc(=Cc3cc(OC)c(OC)c(OC)c3)c(=O)n2C1c1cccs1)c1ccccc1,MQTMDDXRQIEIKY-UHFFFAOYSA-N,cdp2w12_f18_s1_w25a17b4c6-3c30-4805-ba3a-28336a767df8,cdp2w12_f18_s1_w344abbe0d-8836-471b-99ce-821baef1e3b9,cdp2w12_f18_s1_w1f32e04f8-e777-4eab-a2f0-5377d4f30cda,cdp2w12_f18_s1_w53342da3b-0fba-4987-a89e-efb6fffe06a5,cdp2w12_f18_s1_w42eac7894-9bf8-4699-859c-b572af6d31f6,56,9402
1009,38425.0,25726-H16-5,BRD-K92995730-001-05-1,25726,H16,5,SA1858770,BRD-K92995730,BROAD_CPD_ID,COc1ccccc1NC(=O)c1ccc(o1)-c1ccc(Br)cc1,MRBXGCKSWCHGMQ-UHFFFAOYSA-N,cdp2w12_h16_s5_w25a682d56-1e87-42a0-acd9-96a649f858c7,cdp2w12_h16_s5_w32190df2e-c5fb-48d4-9f77-fcbba1d370d8,cdp2w12_h16_s5_w1ec6e3068-c694-45ca-800b-934dce0fa9aa,cdp2w12_h16_s5_w58b20d6c2-3abe-47eb-a47c-94c4c3234e83,cdp2w12_h16_s5_w46cea6787-6b9f-4ca3-b18b-f2c8d18dea1f,52,2130
1010,8810.0,24688-D06-6,BRD-K18657361-001-01-3,24688,D06,6,SA1441837,BRD-K18657361,BROAD_CPD_ID,CCCNC(=O)Nc1ccc2c(OC[C@@H](C)N(CC3CCCC3)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1,MRCAHRJZOZLPQK-UMEGOILYSA-N,cdp2w3_d06_s6_w25efc5d5a-0adb-400e-b0cb-943a2efea1d0,cdp2w3_d06_s6_w38ebea663-9f7d-4d33-8b12-b004da22b55c,cdp2w3_d06_s6_w16783f67e-316c-4a5f-b706-1b68979dd27f,cdp2w3_d06_s6_w5c35daa73-8fe5-47b7-80cf-2f25c7a190e9,cdp2w3_d06_s6_w41d21d32f-3476-4859-8e26-d353c9fbf0d8,98,10526
1011,3074.0,24305-F22-3,BRD-K06753942-001-02-0,24305,F22,3,SA37251,nobiletin,primary-common,COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1,MRIAQLRQZPPODS-UHFFFAOYSA-N,cdp2bioactives_f22_s3_w23ecec50c-209b-4499-a5f5-4323bc2c8e8b,cdp2bioactives_f22_s3_w30e973b55-daad-4788-87f5-9eac754e57af,cdp2bioactives_f22_s3_w117dd315e-35bf-4b5b-aa83-aef50c5bbb82,cdp2bioactives_f22_s3_w5f68c3391-9931-468a-8ed0-1cde7d4633fa,cdp2bioactives_f22_s3_w4ccd5bf48-eb78-471c-a9f3-b884f6c0744e,163,660
1012,11372.0,25391-A18-6,BRD-K91025797-001-06-6,25391,A18,6,SA1853683,BRD-K91025797,BROAD_CPD_ID,Cc1onc(C(=O)Nc2sc3CCCCc3c2C#N)c1[N+]([O-])=O,MRLCOQNXYQPSLO-UHFFFAOYSA-N,cdp2w10_a18_s6_w2c9276ffe-a59b-4bcc-ac57-4cfcb25d7603,cdp2w10_a18_s6_w3b6de81d7-adbd-4df0-9972-48535efe91d0,cdp2w10_a18_s6_w178066f41-6a32-4751-aaae-6429fcb3ae92,cdp2w10_a18_s6_w52a858a00-7239-4192-96f5-66e354fd57a4,cdp2w10_a18_s6_w46fa9b9c4-9633-4a75-9a93-d415df4cbe95,61,2178
1013,15738.0,25430-M14-4,BRD-K31071925-001-05-0,25430,M14,4,SA1858098,BRD-K31071925,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)c1cn(Cc2ccc(F)cc2)c2cc3OCOc3cc2c1=O,MSEQKMPIPAPCAU-UHFFFAOYSA-N,cdp2w10_m14_s4_w2aab97878-f74a-4322-8433-7965a10f1e9f,cdp2w10_m14_s4_w30a6b7df2-1cc2-4b1f-b016-e93fd5931c7c,cdp2w10_m14_s4_w1e07714c9-70dd-45b3-88ed-da52f1152237,cdp2w10_m14_s4_w56afecec3-349a-40bf-9aa2-51dfec05cfbb,cdp2w10_m14_s4_w416f0ee47-3b28-49b9-b6c0-a8b8eec9eaea,51,8084
1014,56578.0,26794-H15-2,BRD-K02960110-001-01-3,26794,H15,2,SA418033,BRD-K02960110,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O,MSGDIDWYZNYHQU-DRLORSAXSA-N,cdp2w13_h15_s2_w2de4b2f9a-4da4-464d-b8ca-a8646d1c45b8,cdp2w13_h15_s2_w3706167b2-d2ba-44d9-8e24-50f4cd41dfe1,cdp2w13_h15_s2_w1052a23e2-6d60-4e1c-9f86-3ebd8b251b79,cdp2w13_h15_s2_w5a1e0bf27-db87-4bf1-b5f0-aa35e6a57866,cdp2w13_h15_s2_w4c9a88154-ac13-42c0-a149-a6f215cdfae9,131,9718
1015,9207.0,24736-E23-1,BRD-K16769896-001-02-0,24736,E23,1,SA667133,BRD-K16769896,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)c2ccc(cc2)N2CCN(C)CC2)OCc2cnnn2CCCC1=O,MSGDIDWYZNYHQU-XLGIIRLISA-N,cdp2w5_e23_s1_w2b295ede7-81de-4a0d-bda7-578bddbd117b,cdp2w5_e23_s1_w368cd1739-24ad-4add-846e-7db7339453c4,cdp2w5_e23_s1_w1ca958120-4bc9-4674-8f30-1a5c6d415c80,cdp2w5_e23_s1_w5b4159cdb-f69a-4ef8-b9e3-23b873e66e16,cdp2w5_e23_s1_w418db77c8-12f2-4da9-b5a9-56744935ba44,76,9817
1016,34828.0,25688-O03-2,BRD-K07162418-001-07-7,25688,O03,2,SA1857127,BRD-K07162418,BROAD_CPD_ID,CCn1c2ccccc2c(O)c(C(=O)Nc2nc3ccccc3[nH]2)c1=O,MSIIQGRNGMMSTR-UHFFFAOYSA-N,cdp2w12_o03_s2_w292ee56e0-04a4-43d9-a509-78129768addc,cdp2w12_o03_s2_w39ddadd61-be02-4b81-8809-62fb97239e05,cdp2w12_o03_s2_w13d83b870-0e36-4a01-9e62-df701901f801,cdp2w12_o03_s2_w51e4df3f3-02d3-445b-a6d1-3f32e26061d5,cdp2w12_o03_s2_w4e909ba9a-29a8-4f99-9003-0289642e70f5,47,7514
1017,44325.0,25988-G16-1,BRD-K49049886-001-03-8,25988,G16,1,SA792599,CGS-15943,primary-common,Nc1nc2ccc(Cl)cc2c2nc(nn12)-c1ccco1,MSJODEOZODDVGW-UHFFFAOYSA-N,cdp2w8x2_g16_s1_w2f8e1070f-0350-49a5-9c62-b99ad9fb7d48,cdp2w8x2_g16_s1_w3992dad55-71a2-4a0b-8cc9-7429fcb5609d,cdp2w8x2_g16_s1_w1bf849965-11e3-46df-9abc-4e600d0103c0,cdp2w8x2_g16_s1_w5ee708a1e-81a5-4a3c-a9db-ae91a5409967,cdp2w8x2_g16_s1_w453b7970d-6e9a-4422-955a-16e12de74adf,57,247
1018,27486.0,25594-P18-4,BRD-K55665639-001-05-7,25594,P18,4,SA1855899,BRD-K55665639,BROAD_CPD_ID,CCC(=O)Oc1ccc(NC(=O)c2ccco2)cc1,MSPUYHYGERNXGU-UHFFFAOYSA-N,cdp2w11_p18_s4_w2bb16d606-87a8-4ffa-b6d9-665db4b427ca,cdp2w11_p18_s4_w35cc8c465-fe99-4168-8b16-a84cce72385f,cdp2w11_p18_s4_w1938b8a90-e0e9-48a7-8381-6f95c00f5f4d,cdp2w11_p18_s4_w5b993a58a-b36d-4dcc-901b-f6cb7de6de7a,cdp2w11_p18_s4_w40336641f-a839-48d0-87e1-e90188d170fe,65,8956
1020,34327.0,25686-G11-5,BRD-K22083193-001-04-4,25686,G11,5,SA1852383,BRD-K22083193,BROAD_CPD_ID,CCc1ccc(s1)S(=O)(=O)NCc1csc(n1)-c1cccnc1,MSZJNNMULKOVET-UHFFFAOYSA-N,cdp2w12_g11_s5_w2637bbd00-de4a-4bdc-ab96-b191c6922c6e,cdp2w12_g11_s5_w30e93c94c-7322-43f3-88e7-dc0a4b52c697,cdp2w12_g11_s5_w17abe8cbf-ecf7-4b7c-93ef-39c5dbf5dc35,cdp2w12_g11_s5_w5d0afa019-c9c7-490b-91b9-4c4b61970a1f,cdp2w12_g11_s5_w40e82a5f6-74ce-4b6d-864a-59824bcbacfc,31,2486
1021,24233.0,25581-C09-3,BRD-A36720314-001-05-8,25581,C09,3,SA1857053,BRD-A36720314,BROAD_CPD_ID,Oc1ccccc1C1CC(=NN1C(=O)c1ccncc1)c1ccc(Br)cc1,MSZXBQPIAUHVDL-UHFFFAOYSA-N,cdp2w11_c09_s3_w2c4627931-7d28-442c-ad4f-fd2c239205e7,cdp2w11_c09_s3_w3cc5b4b4d-e8a1-4dc3-b842-1c7ca9d3caca,cdp2w11_c09_s3_w1e26effef-55e5-46c0-9aac-8e6a9f5cc2e5,cdp2w11_c09_s3_w5eade5faf-e662-43cd-a925-1ea10d2ec20f,cdp2w11_c09_s3_w4ccef6b4f-f16a-4e13-8130-7ea0eb30029a,52,2671
1022,19124.0,25553-A17-6,BRD-K06654104-001-05-7,25553,A17,6,SA1856764,BRD-K06654104,BROAD_CPD_ID,CCN(CC)c1ccc(NC(=O)c2ccco2)cc1,MTRAVDMFUGBQBM-UHFFFAOYSA-N,cdp2w11-au00029679_a17_s6_w230790fdc-b96e-4edf-874f-0558ae74d422,cdp2w11-au00029679_a17_s6_w31c87ede8-0de9-4896-b816-aea0301e5793,cdp2w11-au00029679_a17_s6_w1ed0b6177-7c2c-477d-b8cb-172c23224f58,cdp2w11-au00029679_a17_s6_w5308616ba-fab8-4f41-9932-f41ed4a19c67,cdp2w11-au00029679_a17_s6_w447e0a3cb-cace-4dea-a1c5-592cafd51962,64,8463
1023,31383.0,25674-D17-1,BRD-K65118526-001-05-1,25674,D17,1,SA1862159,BRD-K65118526,BROAD_CPD_ID,Cc1nc2cc(N3CCCCC3)c(NC(=O)c3cccnc3)cc2c(=O)n1Cc1ccccc1,MTVKCPKOKLLYCE-UHFFFAOYSA-N,cdp2w12_d17_s1_w23ab0830c-32d0-42ed-b48e-9411190fdd40,cdp2w12_d17_s1_w3989c0d24-97d3-41a0-8d3e-f5c79583c493,cdp2w12_d17_s1_w1ad22bf00-220d-4164-bb1e-c90aad8babef,cdp2w12_d17_s1_w5ce08ce64-3e5f-489f-bc3d-ff5e223c24e3,cdp2w12_d17_s1_w464392467-4eb8-42e2-b2de-6ab8be8fe2ad,62,3291
1024,23403.0,25578-I07-1,BRD-K33115108-001-05-2,25578,I07,1,SA1861185,BRD-K33115108,BROAD_CPD_ID,CCOc1ccc(OCc2ccc(o2)C(=O)Nc2cccnc2)cc1,MUJJOVYQYSVVTE-UHFFFAOYSA-N,cdp2w11_i07_s1_w2e3f5b808-c23f-4acc-b680-817077559e77,cdp2w11_i07_s1_w35ecee5ff-d206-4c80-957f-66d00a598e3b,cdp2w11_i07_s1_w184177acf-c97c-437f-aee2-2ee7bb7f3f54,cdp2w11_i07_s1_w516482810-f945-4b91-b3f9-38d369741d10,cdp2w11_i07_s1_w4277196b5-4de6-4f81-bc1b-ac75a385e427,67,7934
1025,49637.0,26128-L03-3,BRD-K35879814-001-06-4,26128,L03,3,SA1859850,BRD-K35879814,BROAD_CPD_ID,Cc1ccc(N\C=C(\C#N)c2ccsc2)cc1,MUMLJJBCDLNKTP-LCYFTJDESA-N,cdp2w9x2_l03_s3_w2c95a9e28-a069-4934-be89-e079f6050157,cdp2w9x2_l03_s3_w357f844a4-f36f-4fd0-95d8-4b9e4e4394e9,cdp2w9x2_l03_s3_w119e2cad5-333d-44c2-92ff-d6be360e7481,cdp2w9x2_l03_s3_w56d4ddd85-f14c-41a6-8e85-48cdf2b8accf,cdp2w9x2_l03_s3_w4aca00a1b-50ee-4dea-b94a-3dd5730ff1e8,24,5216
1026,31226.0,25667-J14-6,BRD-K64472183-001-05-7,25667,J14,6,SA1855489,BRD-K64472183,BROAD_CPD_ID,Cc1ccc(OCc2nnc(S)n2-c2ccc(Br)cc2)cc1,MURJKRIXESYAJG-UHFFFAOYSA-N,cdp2w12_j14_s6_w28f5d706f-5c13-41c4-ac7c-b5de403dd202,cdp2w12_j14_s6_w3d0f7abc1-4831-4846-a771-348292a9ff3b,cdp2w12_j14_s6_w11b752a3b-6315-4d2d-9dfe-71c936ccb788,cdp2w12_j14_s6_w5732fbd9e-b529-4dea-b99d-7e5f979167a8,cdp2w12_j14_s6_w49385e4a9-3137-4226-aa73-a8dd2a021c15,88,7839
1027,31740.0,25675-G21-4,BRD-K44146005-001-05-8,25675,G21,4,SA1859337,BRD-K44146005,BROAD_CPD_ID,Cc1ccc(cc1)C(=O)CSc1nc[nH]n1,MUVSMNVNXKMPGC-UHFFFAOYSA-N,cdp2w12_g21_s4_w2ab02c171-b42b-485d-be93-9a6b7fc41709,cdp2w12_g21_s4_w355d1682b-ae8b-4bc0-94cc-ed1569fb674e,cdp2w12_g21_s4_w1d56050f6-290e-4091-99fe-692918c9b281,cdp2w12_g21_s4_w53db8f37d-5f50-40c7-9960-0bab8af1e8f3,cdp2w12_g21_s4_w4e6270966-0bbc-403d-9117-4abf49840db0,46,8292
1028,4118.0,24308-E20-3,BRD-K26140483-001-01-3,24308,E20,3,SA59751,N-acetylserotonin,primary-common,CC(=O)NCCc1c[nH]c2ccc(O)cc12,MVAWJSIDNICKHF-UHFFFAOYSA-N,cdp2bioactives_e20_s3_w2f651a2ec-d052-4998-95ba-44e5ecd3900c,cdp2bioactives_e20_s3_w344dfba1b-e48a-45a2-b5ec-1b97b3419b78,cdp2bioactives_e20_s3_w14f7d524b-924e-449f-9308-b3e00e834849,cdp2bioactives_e20_s3_w5046c2922-3c0e-4f35-ba7b-eb7fd84f06d0,cdp2bioactives_e20_s3_w4eacd95c9-1021-4dd4-864f-0fe73caf0370,114,408
1029,36175.0,25695-J17-5,BRD-K65070020-001-05-5,25695,J17,5,SA1858153,BRD-K65070020,BROAD_CPD_ID,COc1ccc(CCNc2oc(Cc3cccc4ccccc34)nc2C#N)cc1OC,MVSMAYUECPPYMV-UHFFFAOYSA-N,cdp2w12_j17_s5_w22379d6f2-2068-40ab-8cab-392ca035e161,cdp2w12_j17_s5_w36ea3a9e6-ded3-4117-a27c-81489a275f09,cdp2w12_j17_s5_w13dd5b2ba-0bbf-4fce-8b9b-2e5fc56a848f,cdp2w12_j17_s5_w544cd243f-5e2a-4c9c-963f-0487b2efed67,cdp2w12_j17_s5_w4fd919f68-f8e3-4583-ab19-5d1b627a192d,68,5915
1030,27232.0,25594-D19-2,BRD-K22063616-001-06-0,25594,D19,2,SA1853316,BRD-K22063616,BROAD_CPD_ID,O=C(Nc1ccc2c(c1)oc1ccccc21)N1CCOCC1,MVWIJRRHQKNOJU-UHFFFAOYSA-N,cdp2w11_d19_s2_w286a5be3a-2199-4b09-b4b9-12e707d9e7eb,cdp2w11_d19_s2_w31cc04400-b308-410b-a4f5-2dee99b0271d,cdp2w11_d19_s2_w1f392d37e-4693-4bad-b17e-d890959d92ee,cdp2w11_d19_s2_w53708e064-0506-4c47-bcd1-ff6e9fad99ec,cdp2w11_d19_s2_w40a6f5790-57d4-49d1-b0ab-1a08163e010b,65,3177
1031,16778.0,25436-A20-6,BRD-K62326950-001-05-8,25436,A20,6,SA1852171,BRD-K62326950,BROAD_CPD_ID,O=C(Nc1ncc(Cc2ccccc2)s1)C1=NCCN1,MWBDLRSLPPAPFE-UHFFFAOYSA-N,cdp2w10_a20_s6_w22d9e443b-2da2-4ac6-a03b-6d3e53dc5cd3,cdp2w10_a20_s6_w3a30dab19-a133-47e3-823a-3bcab43de512,cdp2w10_a20_s6_w1aadf50b5-e6e6-40d2-9705-2524d4272b17,cdp2w10_a20_s6_w5be8dfd75-f1ed-4e0f-abe8-ae9e76473f10,cdp2w10_a20_s6_w474a70310-f6bb-4faf-957a-483c51e0fa01,49,9122
1032,30458.0,25664-F10-6,BRD-A76042151-001-05-4,25664,F10,6,SA1858487,BRD-A76042151,BROAD_CPD_ID,CC(C)Oc1ccc(cc1)C1CC(=O)N(Nc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)C1=O,MWQHYFBKDKJTSZ-UHFFFAOYSA-N,cdp2w12_f10_s6_w236c8d87a-9634-4c46-85f8-733fde7c670c,cdp2w12_f10_s6_w37804084d-f10f-4b6a-9c5c-287c7872e31a,cdp2w12_f10_s6_w1b1b2fbc6-034f-45e2-b332-ac3e5f97192c,cdp2w12_f10_s6_w56d89166f-ec4a-48b7-802c-be1136b31e9a,cdp2w12_f10_s6_w47a4abfaa-8722-4f68-87a1-2817456314ab,64,4217
1033,26461.0,25591-K22-5,BRD-A00595016-001-05-7,25591,K22,5,SA1852439,BRD-A00595016,BROAD_CPD_ID,COc1cccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2ccc(cc2)-n2cnnn2)c1,MXXDERMISKKKKI-UHFFFAOYSA-N,cdp2w11_k22_s5_w2d325b648-a3a1-439d-b202-71d1c48ed24d,cdp2w11_k22_s5_w367d2a6c8-78bc-4b7f-a4e6-10dcf2f5beea,cdp2w11_k22_s5_w1c3844baf-f28d-4c77-8a08-d79005f1c8b6,cdp2w11_k22_s5_w5d2e0381f-d40d-4679-abcc-fdb81e024179,cdp2w11_k22_s5_w416b419a8-4fec-4a7d-8bf1-b179118512e9,69,6258
1034,28008.0,25599-J10-4,BRD-A07861932-001-06-5,25599,J10,4,SA1853865,BRD-A07861932,BROAD_CPD_ID,CCOC(=O)c1c(NC(=O)C2C3CC(C=C3)C2(C)C(O)=O)sc2CCCCc12,MYCPMISCHRNPFC-UHFFFAOYSA-N,cdp2w11_j10_s4_w2791bcec9-6cc5-4bb0-a003-a7f73e2beeba,cdp2w11_j10_s4_w3459264e2-60bb-4e6a-93c5-b96ef102bb6f,cdp2w11_j10_s4_w11329adce-2874-490d-94f2-907a1da69d9c,cdp2w11_j10_s4_w5d54b5a71-9d4c-4779-8d80-98cde5817e1a,cdp2w11_j10_s4_w4be6ce039-5622-4c6d-b42d-01bcbbe3f698,67,6301
1035,3381.0,24306-E07-4,BRD-K04804440-311-02-3,24306,E07,4,SA82772,ciprofloxacin,INN,OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O,MYSWGUAQZAJSOK-UHFFFAOYSA-N,cdp2bioactives_e07_s4_w285f54491-6479-4386-aa1a-304eafceab4b,cdp2bioactives_e07_s4_w34a98c2ff-9ede-4778-84b4-ff5495949576,cdp2bioactives_e07_s4_w1ea023221-840d-4f20-8de5-8e5b6b9ffc5e,cdp2bioactives_e07_s4_w5d5f6d4d6-7be8-4ee5-a449-41050fcc21ec,cdp2bioactives_e07_s4_w49d1fa6e5-2b96-47bc-83df-397f45201a30,111,4
1036,8343.0,24640-I12-1,BRD-K27294633-001-01-6,24640,I12,1,SA850254,BRD-K27294633,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)-c1cccc(c1)C(=O)N(C)C,MYWSUSXCAZFZDP-WOGZVKCMSA-N,cdp2w3_i12_s1_w23fd57b83-4285-4848-a39a-a1b224e05f39,cdp2w3_i12_s1_w34d1e9e7f-f957-4915-a6dd-a0a50baf5abf,cdp2w3_i12_s1_w16781b737-c11c-4516-ae1e-86344a9e3926,cdp2w3_i12_s1_w589349b16-023b-401e-83b7-03e8b0ac1d4c,cdp2w3_i12_s1_w4ee90d817-6293-4ac0-a361-aaf479546bd0,112,10423
1037,33709.0,25681-L08-5,BRD-K78498445-001-05-0,25681,L08,5,SA1861091,BRD-K78498445,BROAD_CPD_ID,Fc1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2Cl)o1,MYYIHYITRHWMGQ-UHFFFAOYSA-N,cdp2w12_l08_s5_w2f4badb07-e838-448c-b176-d73b31cd3188,cdp2w12_l08_s5_w3bbad2e4c-f5e8-4758-a7a7-16e3fc27f0fd,cdp2w12_l08_s5_w1680e5fc4-b508-444a-a8e1-361f149ba4e3,cdp2w12_l08_s5_w52b98cd3a-6314-4a37-91fd-cfed7b559b8c,cdp2w12_l08_s5_w44e2ecadd-d0fc-40fb-a9b7-2d43e14ad502,45,6965
1038,17200.0,25438-F03-2,BRD-A77404109-001-05-8,25438,F03,2,SA1853127,BRD-A77404109,BROAD_CPD_ID,O=C(Nc1ccccc1)N1CCC(C1)c1ccccc1,MZAQOOWXHQBKBK-UHFFFAOYSA-N,cdp2w10_f03_s2_w286304b32-6c9a-442f-8319-f9abf411d586,cdp2w10_f03_s2_w32ded1fb6-9caa-4931-83a1-2006dc440241,cdp2w10_f03_s2_w15e82a111-b58e-4171-a66f-88f9af96c5db,cdp2w10_f03_s2_w5f5684994-9234-476e-82bc-21e162f66b05,cdp2w10_f03_s2_w4e40d76e2-3bf7-4ac1-850b-195253bd4d69,57,7855
1039,13558.0,25416-D12-2,BRD-K02715134-001-07-0,25416,D12,2,SA1859581,BRD-K02715134,BROAD_CPD_ID,CC(=C/c1ccccc1)\C=C1/SC(=S)N(CCCC(=O)Nc2ccc(cc2)C(O)=O)C1=O,MZEGQCZARRMPMR-GEZYKDBCSA-N,cdp2w10_d12_s2_w21940dde8-6193-407a-83b3-d40ce9727bd8,cdp2w10_d12_s2_w376bfb09b-1c6c-4307-b383-96f59a1bf93a,cdp2w10_d12_s2_w1447a28ae-1bfd-42d7-a7ed-6b3bbdb0714d,cdp2w10_d12_s2_w51d0f79bc-72db-495c-9cfd-cd2b68f95522,cdp2w10_d12_s2_w4459ff815-87f9-4c2a-a86d-9668cbec1eba,55,6315
1040,11197.0,25387-G16-5,BRD-K57631144-001-05-5,25387,G16,5,SA1859623,BRD-K57631144,BROAD_CPD_ID,Clc1ccc(OS(=O)(=O)NC(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1,MZLRSFBNYSKEPU-XJKSGUPXSA-N,cdp2w10_g16_s5_w28d2aa9ad-e5a6-41a2-a4c1-2298281bba5b,cdp2w10_g16_s5_w31a07c633-ebc8-4909-a4a1-d84b2880e3a8,cdp2w10_g16_s5_w1c9438e7b-732c-4ef4-a3da-51aa115374d5,cdp2w10_g16_s5_w500521cb1-8ff4-4eb3-9f41-5195e112c466,cdp2w10_g16_s5_w4ed4e156a-ec94-486f-a236-9a7ebdc0d3ae,67,5922
1041,43057.0,25983-P20-5,BRD-K40255344-001-05-1,25983,P20,5,SA82361,tyrphostin A9,primary-common,CC(C)(C)c1cc(C=C(C#N)C#N)cc(c1O)C(C)(C)C,MZOPWQKISXCCTP-UHFFFAOYSA-N,cdp2w8x2_p20_s5_w2562ed858-74bb-41ec-a30d-8e9722936afe,cdp2w8x2_p20_s5_w3af65d6ff-0a38-48e5-8bf4-028bb4349235,cdp2w8x2_p20_s5_w143560d89-2a6b-436a-98b3-a902ceaf0283,cdp2w8x2_p20_s5_w5db7f2967-b598-4e51-85d2-bdc83c6627e5,cdp2w8x2_p20_s5_w463bc228b-9d75-4d41-9cad-a2a01b3ba140,6,670
1042,8107.0,24618-B04-2,BRD-K80531070-001-01-5,24618,B04,2,SA860955,BRD-K80531070,BROAD_CPD_ID,COc1ccccc1-c1ccc2c(O[C@@H](CN(C)S(=O)(=O)c3ccc(F)cc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1,NAXOUWLFRBOFLI-OSOCVKALSA-N,cdp2w3_b04_s2_w2ea993515-a26c-4ed8-acb2-5e58716c2450,cdp2w3_b04_s2_w3bec045a2-b20f-497f-b899-a5a51252672e,cdp2w3_b04_s2_w11a19768e-2f36-4e70-85d1-53449a3ecc6f,cdp2w3_b04_s2_w527b7e9f6-7419-4df9-bf79-622cac58fbf5,cdp2w3_b04_s2_w470171c9b-cc81-4920-ab79-66dc0b430bdf,112,10322
1043,18077.0,25488-P10-3,BRD-K76820832-001-05-8,25488,P10,3,SA1859787,BRD-K76820832,BROAD_CPD_ID,CC(=O)c1ccc(NC(S)=NCCc2ccc(F)cc2)cc1,NBJVCTQBIHIHGE-UHFFFAOYSA-N,cdp2w10-au00024357_p10_s3_w24edae913-49cb-456b-b9b8-ca68ef96a6e5,cdp2w10-au00024357_p10_s3_w3520a6e32-6834-49aa-88cf-644727408a5b,cdp2w10-au00024357_p10_s3_w1deb439b3-a864-4abd-a731-90bbaca7901c,cdp2w10-au00024357_p10_s3_w5b5f9369d-8a61-4df5-a0c1-14e38097ff4a,cdp2w10-au00024357_p10_s3_w48f17a2f7-e0c7-4375-91a0-63350576c4f6,47,7398
1044,28425.0,25605-L07-1,BRD-K02772399-001-06-3,25605,L07,1,SA1856827,BRD-K02772399,BROAD_CPD_ID,CC1=NN(C(=O)C\1=C\C=C\c1ccccc1)c1ccccc1,NBPIVZCAUUWNER-DWRJGLHPSA-N,cdp2w11-au00029692_l07_s1_w238eb1924-ad9e-47ab-94ee-83c93fac407f,cdp2w11-au00029692_l07_s1_w349538816-f44d-4905-9ed9-b8d40c96d5b2,cdp2w11-au00029692_l07_s1_w1c98c0262-19e7-4058-91a7-c99683e25813,cdp2w11-au00029692_l07_s1_w507e5b00f-5670-491d-810f-989be82acf31,cdp2w11-au00029692_l07_s1_w4134f5bf1-e29d-4e7d-9331-edf234ff8629,1,9519
1045,23722.0,25579-K03-2,BRD-K52113409-001-05-9,25579,K03,2,SA1858493,BRD-K52113409,BROAD_CPD_ID,CCCCN(C)C(S)=Nc1ccc2nc3CCCCCn3c(=O)c2c1,NBSROBPIGKGLNY-UHFFFAOYSA-N,cdp2w11_k03_s2_w2deb04875-8d3f-405c-8a73-8476dd90ef0a,cdp2w11_k03_s2_w31a993260-8612-4601-9e2c-af6d147f10d1,cdp2w11_k03_s2_w1cf21dca0-d597-494f-9f48-64544b26e672,cdp2w11_k03_s2_w597c537c7-e9f8-4211-9d30-c7e977b77795,cdp2w11_k03_s2_w41594d213-c6e3-496e-afa5-8b4e06ba7b9c,83,2991
1046,52280.0,26202-B09-6,BRD-K06857049-001-05-4,26202,B09,6,SA1859059,BRD-K06857049,BROAD_CPD_ID,Sc1nc2ccccc2c2ccccc12,NCIDEKDUBRWLJO-UHFFFAOYSA-N,cdp2w9x2-au00026617_b09_s6_w2765e218b-5462-4e56-99ef-e98c49bc12ce,cdp2w9x2-au00026617_b09_s6_w36a5a6a58-06df-44ce-a947-eddf05ce4ea8,cdp2w9x2-au00026617_b09_s6_w1caee8db5-b24d-4eba-bf71-7d46e6a730e8,cdp2w9x2-au00026617_b09_s6_w5a627dffa-ea98-4b90-b06e-7aaca628acdf,cdp2w9x2-au00026617_b09_s6_w4faae8055-add9-439a-9f5b-fef76453208c,63,7392
1047,46974.0,26081-H19-4,BRD-K60057192-001-05-9,26081,H19,4,SA1861219,BRD-K60057192,BROAD_CPD_ID,COc1ccc(cc1)C(=O)Nc1cc(C)on1,NCSMCVZNYCCOGI-UHFFFAOYSA-N,u00026613_h19_s4_w2a8d45632-c9da-4804-afc5-0318a2d16595,u00026613_h19_s4_w3956b8626-e6da-4fe8-b576-fdeaf5c33fcb,u00026613_h19_s4_w11c8fdf7b-91e7-4188-b52a-8028b20b95fe,u00026613_h19_s4_w5d8029cb3-85a1-4699-9b5d-4b5cc5fa7e13,u00026613_h19_s4_w402ec6267-d221-4d00-a222-6fb9ef033d5d,35,7070
1048,4040.0,24308-B21-3,BRD-K21450440-001-04-7,24308,B21,3,SA58195,benzthiazide,INN,NS(=O)(=O)c1cc2c(cc1Cl)N=C(CSCc1ccccc1)NS2(=O)=O,NDTSRXAMMQDVSW-UHFFFAOYSA-N,cdp2bioactives_b21_s3_w275be81fb-1f0e-4d26-a3ca-4a835ee98802,cdp2bioactives_b21_s3_w337b1ac40-0ed0-43ed-bd37-a74740d61cae,cdp2bioactives_b21_s3_w1e0494d63-9290-432e-a112-29552293e85c,cdp2bioactives_b21_s3_w5a6a52803-8c90-4852-b41b-54675d677ecb,cdp2bioactives_b21_s3_w49be6c5e7-a765-414a-95bc-de7ca68cdb29,149,1365
1049,44434.0,25988-N20-2,BRD-K57586808-001-01-7,25988,N20,2,SA82639,1-[1-(2-BENZO[B]THIENYL)CYCLOHEXYL]PYRROLIDINE,to-be-curated,C1CCN(C1)C1(CCCCC1)c1cc2ccccc2s1,NDVZYCXZMVQYBS-UHFFFAOYSA-N,cdp2w8x2_n20_s2_w2c598bfb3-0023-48ca-8583-8cc13fbffd54,cdp2w8x2_n20_s2_w31a1f3119-dbaf-4ffd-8f03-f9ca0f0d4dfa,cdp2w8x2_n20_s2_w1c4b6caee-bf77-4bfb-bc3d-59815380d879,cdp2w8x2_n20_s2_w51a4eab2b-6a04-4414-bcf8-d6f3a0fd3b01,cdp2w8x2_n20_s2_w49bcf8767-9ee3-44dd-a432-61092babf9f7,47,258
1050,38284.0,25725-O19-2,BRD-A76985501-001-06-9,25725,O19,2,SA1852179,BRD-A76985501,BROAD_CPD_ID,Cc1ccccc1C(CC(=O)c1cccs1)C(C#N)C#N,NEEVBWZTPVZUSU-UHFFFAOYSA-N,cdp2w12_o19_s2_w2303a0f36-ec97-4db7-9bd1-54b7447a1b57,cdp2w12_o19_s2_w3b1763dc8-ce91-4e43-b270-4c179e700872,cdp2w12_o19_s2_w1e1aa70a9-1ec4-4b35-99a0-3d0c47c9b993,cdp2w12_o19_s2_w5607597fd-772e-49ab-adf7-b0c7fbcf3280,cdp2w12_o19_s2_w4a9724639-ed3d-4f5a-b13a-94ef0961d0a1,13,4476
1051,13360.0,25414-K22-2,BRD-K11727348-001-05-0,25414,K22,2,SA1857055,BRD-K11727348,BROAD_CPD_ID,Clc1ccc(cc1Cl)-n1nnc(n1)-c1cccnc1Cl,NEIJVSMAWWDACY-UHFFFAOYSA-N,cdp2w10_k22_s2_w2fe0b81f1-e41d-4f25-8a5e-07943010ab16,cdp2w10_k22_s2_w3cea2b5ec-c965-479a-917c-ee457addfde4,cdp2w10_k22_s2_w16bcf2096-1031-4965-ae10-354ad81f2024,cdp2w10_k22_s2_w57d16fb37-27e4-4f19-bc0e-497b55895f76,cdp2w10_k22_s2_w49f7613a0-6725-416f-a6d6-2eff24dac320,62,2196
1052,25842.0,25588-F22-4,BRD-K02421873-001-08-8,25588,F22,4,SA1858529,BRD-K02421873,BROAD_CPD_ID,[O-][N+](=O)c1ccc(o1)C(=O)OCc1nnc(o1)-c1ccccc1,NENLILZNTFFZKS-UHFFFAOYSA-N,cdp2w11_f22_s4_w287ba15f8-e968-4727-9c11-691ea757f300,cdp2w11_f22_s4_w387a5fd10-62a5-4ef4-8658-783b257f4777,cdp2w11_f22_s4_w1c4dd1b75-bf1b-4a2a-8f4f-457595486302,cdp2w11_f22_s4_w5bb15547d-8d93-4514-a5c1-b976f786d6be,cdp2w11_f22_s4_w494d1ddd7-1c61-4f56-8a89-297dbf8ccd94,78,9481
1053,3318.0,24306-A19-1,BRD-A99571536-001-01-0,24306,A19,1,SA21852,dubinidine,primary-common,COc1c2CC(Oc2nc2ccccc12)C(C)(O)CO,NETGEQWGGLFVRL-UHFFFAOYSA-N,cdp2bioactives_a19_s1_w2e6b0c821-816f-4be7-af44-2b7e0d1a7a85,cdp2bioactives_a19_s1_w332ef7fe5-1186-4c9d-ac33-b0c86a89ebdd,cdp2bioactives_a19_s1_w1970d7963-b97d-4d72-a1f1-29bc5cb95910,cdp2bioactives_a19_s1_w52af29352-d2f2-4f10-9895-75734dffe9ca,cdp2bioactives_a19_s1_w474c1fd10-cf40-4991-a003-9c5cafe8b456,66,1404
1054,23676.0,25579-H11-4,BRD-K46095033-001-05-1,25579,H11,4,SA1852080,BRD-K46095033,BROAD_CPD_ID,Cc1oc(cc1NC(=O)Nc1ccc(F)cc1)S(=O)(=O)N1CCCCC1,NEYVPAWWSHFUOH-UHFFFAOYSA-N,cdp2w11_h11_s4_w28f1491ec-67fd-4b67-bd25-7c0f23f9486a,cdp2w11_h11_s4_w31db6a805-8cfc-4c05-b2f4-eff6d01dc39c,cdp2w11_h11_s4_w1a0f78f04-cf98-4def-b9c0-ce19ade52d79,cdp2w11_h11_s4_w575d2b555-1c43-4f42-9bae-db24eab6974f,cdp2w11_h11_s4_w41a891493-8ac8-4fdc-8b9c-f675bc4214f5,65,8101
1055,46603.0,26071-F17-5,BRD-K96493283-001-05-4,26071,F17,5,SA1852373,BRD-K96493283,BROAD_CPD_ID,COc1cc(OC)cc(c1)C(=O)N[C@@H](C(C)C)C(=O)OCC(=O)Nc1ccc(cc1)C(C)C,NEZVXQGPXYPDSG-QHCPKHFHSA-N,cdp2w9x2_f17_s5_w29bebbaa8-be67-44dc-bf4c-8bd7310317e8,cdp2w9x2_f17_s5_w3238444f6-9e04-4baa-8e23-e4293f7defed,cdp2w9x2_f17_s5_w1c9c372f0-9187-49ca-94d0-c4346642590e,cdp2w9x2_f17_s5_w50546c7dd-534e-49f4-9a44-8564f75a3424,cdp2w9x2_f17_s5_w46c1b0d51-1f56-4a38-a033-c0e95aa53b09,28,2610
1056,45692.0,26058-B17-6,BRD-K73355908-001-05-7,26058,B17,6,SA1857888,BRD-K73355908,BROAD_CPD_ID,CCOC(=O)c1sc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c(C(=O)OCC)c1C,NFLAMWCWTZFAFU-UHFFFAOYSA-N,cdp2w9x2_b17_s6_w2505ff2a2-cc21-4a06-9c82-01416d9d2bf2,cdp2w9x2_b17_s6_w38fae0c46-f982-4bf6-bf90-0123c9abfa3d,cdp2w9x2_b17_s6_w147ad4daa-e368-40e6-a16c-f62698cc0844,cdp2w9x2_b17_s6_w583a1e5ea-5c7c-4b2f-a47e-6654c0dd2bf6,cdp2w9x2_b17_s6_w44dabe0c9-0453-4eb8-9aa6-2134e4b96197,84,1675
1057,34889.0,25688-P22-3,BRD-A86592402-001-05-3,25688,P22,3,SA1855896,BRD-A86592402,BROAD_CPD_ID,Cn1nnnc1SCC1=C(N2C(SC1)C(NC(=O)Cn1nc(cc1C1CC1)C(F)F)C2=O)C(O)=O,NGEHZQYUQUZTQF-UHFFFAOYSA-N,cdp2w12_p22_s3_w2ae791108-6cb3-4636-a552-0b99068abd39,cdp2w12_p22_s3_w37239beae-d167-4ceb-ae66-73e627d43269,cdp2w12_p22_s3_w16560db3b-8cad-4283-8c46-049f80c7dac1,cdp2w12_p22_s3_w546d1ff72-7375-4ea0-b2c0-6ab11211a290,cdp2w12_p22_s3_w451beca2a-27f8-4f19-a49d-b3a9de150540,95,2815
1058,11000.0,25382-J06-6,BRD-K36223761-001-05-9,25382,J06,6,SA1854420,BRD-K36223761,BROAD_CPD_ID,Oc1cc(-c2ccc(cc2)[N+]([O-])=O)c2oc(=O)sc2c1,NGGKZEUPYOGAHM-UHFFFAOYSA-N,cdp2w10_j06_s6_w275bd7df8-ff1e-4eeb-a0a5-ead8d90ec36a,cdp2w10_j06_s6_w3f8b7aa05-e3c3-4b5a-ab92-0cfff519170b,cdp2w10_j06_s6_w10b66994e-5729-4619-99f1-1cd2fa7e730c,cdp2w10_j06_s6_w5cd4eb28f-6b77-4816-be10-4a183ea08128,cdp2w10_j06_s6_w4bf19a487-4bb2-4031-9296-13e91a2424e1,52,2106
1059,53337.0,26205-L17-1,BRD-K56598835-001-05-1,26205,L17,1,SA1858862,BRD-K56598835,BROAD_CPD_ID,CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)OCc1cc(cc2COCOc12)[N+]([O-])=O,NGUGKXKGCUGHKI-SFHVURJKSA-N,cdp2w9x2-au00026617_l17_s1_w2cd10a863-41a3-4430-8c9a-cc587ae77170,cdp2w9x2-au00026617_l17_s1_w36ba829e1-2fce-42a1-8d15-ad4e2355f1aa,cdp2w9x2-au00026617_l17_s1_w1115aff0b-63b8-45a6-b14d-9aaec176ddc1,cdp2w9x2-au00026617_l17_s1_w51ab6f8d7-fbe7-40f2-b6bc-6effba9d0638,cdp2w9x2-au00026617_l17_s1_w4071ca9d1-b012-431e-b1d0-6b9209435c6e,46,8661
1060,16930.0,25436-J07-2,BRD-K63613104-001-05-3,25436,J07,2,SA1857109,BRD-K63613104,BROAD_CPD_ID,COc1nc(nc(n1)C(=N)NO)N1CCCCC1,NGYYAZPHRXDUDE-UHFFFAOYSA-N,cdp2w10_j07_s2_w2be950962-f1ab-43df-a6fe-a32d802d6595,cdp2w10_j07_s2_w3aa158e28-b1cc-49d4-afbc-9a633a554d2e,cdp2w10_j07_s2_w1e5b4d7d8-dcdd-4ace-ada9-43516e58a804,cdp2w10_j07_s2_w58aae4234-f6fa-4701-a4c3-ccbd778e6181,cdp2w10_j07_s2_w42a7c12e2-32f4-4a2b-9673-3b75a4750ee2,61,2414
1061,36614.0,25700-P17-6,BRD-K23754425-001-05-6,25700,P17,6,SA1861153,BRD-K23754425,BROAD_CPD_ID,COc1ccc(NC(=O)Cn2cnc3n(ncc3c2=O)-c2ccc(C)c(C)c2)c(OC)c1,NHANYQUWFGOOMZ-UHFFFAOYSA-N,cdp2w12_p17_s6_w250f24179-da03-48bd-811f-5ca361adbec7,cdp2w12_p17_s6_w3da35dca2-5623-4026-b9a7-d5806c2cdb5f,cdp2w12_p17_s6_w156bda932-8669-4069-b5e2-14ded09db32d,cdp2w12_p17_s6_w55646d801-1dd5-4a4e-b5c5-b670bdf07257,cdp2w12_p17_s6_w47df704ca-a417-402b-b669-da6f1c3cb1de,118,6080
1062,2413.0,24301-L10-2,BRD-A81615860-001-02-9,24301,L10,2,SA59646,fenclonine,INN,NC(Cc1ccc(Cl)cc1)C(O)=O,NIGWMJHCCYYCSF-UHFFFAOYSA-N,cdp2bioactives_l10_s2_w2cfca99f5-e249-4fce-805b-3191441b0816,cdp2bioactives_l10_s2_w3b3b2111c-58f9-42a3-bd84-5361fe067586,cdp2bioactives_l10_s2_w175cd38f4-dc55-4f9a-89f2-76808baa96df,cdp2bioactives_l10_s2_w57733d18c-c315-4969-9109-c432e8390a14,cdp2bioactives_l10_s2_w4b1606e98-a3f5-4502-9a2c-1c0c0195b736,101,1407
1063,11694.0,25392-C10-4,BRD-K53811464-001-05-9,25392,C10,4,SA1856741,BRD-K53811464,BROAD_CPD_ID,OC(=O)c1cccc(c1)N1C(=O)c2cc(cc3cc(cc(C1=O)c23)[N+]([O-])=O)[N+]([O-])=O,NIPZTHWSGKAQER-UHFFFAOYSA-N,cdp2w10_c10_s4_w24e7a1c4c-8cf4-40ff-9d3f-a69b3df12ee2,cdp2w10_c10_s4_w30ab4fdad-65fe-4191-9e85-c08de51b5207,cdp2w10_c10_s4_w1ae8aea51-6e88-4c84-b4c0-0bbbe3d1e4e5,cdp2w10_c10_s4_w56e8f3e3e-d983-4c8b-b7bb-241b83eb19b5,cdp2w10_c10_s4_w46427989f-832e-480c-988a-e5c0f1598264,53,1680
1064,51243.0,26159-L08-1,BRD-K75679095-001-05-1,26159,L08,1,SA1856992,BRD-K75679095,BROAD_CPD_ID,Clc1ncccc1C(=O)OCC(=O)N1CCc2ccccc12,NJMVXXUOYZYXGF-UHFFFAOYSA-N,cdp2w9x2-au00026617_l08_s1_w2a6f8893d-b8ba-47e0-9b87-c01a8d180282,cdp2w9x2-au00026617_l08_s1_w35b8260f8-3b62-45fc-a6e9-24479fcb5885,cdp2w9x2-au00026617_l08_s1_w1c2086c6d-044f-42c3-80b4-3ce040704070,cdp2w9x2-au00026617_l08_s1_w5c6eac8d1-a3e0-449c-b3fc-a2eff546941c,cdp2w9x2-au00026617_l08_s1_w49ea64ebb-fc57-4b6c-87ed-dc9cb01a47f4,51,1587
1065,7150.0,24357-J10-5,BRD-K70487031-001-01-0,24357,J10,5,SA82609,flupentixol,INN,OCCN1CCN(CC\C=C2\c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1,NJMYODHXAKYRHW-DVZOWYKESA-N,cdp2bioactives_j10_s5_w2dda82182-67e6-4a0a-b70b-ba673bf8e9ab,cdp2bioactives_j10_s5_w3dff74ceb-2c1c-48e6-a69f-8ff1f9d8a788,cdp2bioactives_j10_s5_w18d722d3e-bf0b-4c5b-a31b-c5ee7578a77c,cdp2bioactives_j10_s5_w5a7360562-9539-482a-8739-722f3fc9d40c,cdp2bioactives_j10_s5_w4a8553a6a-89aa-4013-915a-48ea453fcdd4,57,550
1066,9414.0,24750-K06-4,BRD-K48050202-001-02-6,24750,K06,4,SA666853,BRD-K48050202,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccncc2)OCc2cnnn2CCCC1=O,NJZPXWDDBMYIMJ-WAOWUJCRSA-N,cdp2w5_k06_s4_w243f67190-3dfa-4bba-b4be-e5175813dc96,cdp2w5_k06_s4_w3f897aa1f-89fb-47b1-b518-511eff2e5cc1,cdp2w5_k06_s4_w1abbfe3a4-dd76-4b78-a493-ce208dd4ac41,cdp2w5_k06_s4_w581f634de-53b4-4fee-abef-db5285dec81a,cdp2w5_k06_s4_w4f304b22f-56e4-4ff9-8bbe-c700bb7dccfa,41,9669
1067,31698.0,25675-E21-4,BRD-K70831943-001-07-3,25675,E21,4,SA1853595,BRD-K70831943,BROAD_CPD_ID,Cc1ccc(cc1S(=O)(=O)N1CCCCC1)-n1sc2ccccc2c1=O,NKPYARCADGOZKH-UHFFFAOYSA-N,cdp2w12_e21_s4_w22f93c8f6-cd33-427f-b66e-1420f34087e8,cdp2w12_e21_s4_w3a136e8cf-ef45-4168-8c0c-1e6103f354e9,cdp2w12_e21_s4_w13421fb8d-4faa-4a6e-99ab-490b766deed6,cdp2w12_e21_s4_w5ff9b2505-6e97-43d1-bdb7-260d33e5954e,cdp2w12_e21_s4_w4580ccd63-f6ab-4ed7-96a4-c8b27181abe1,9,4697
1068,10561.0,25378-N03-5,BRD-K69849083-001-05-2,25378,N03,5,SA1857355,BRD-K69849083,BROAD_CPD_ID,CCOc1ncccc1C(=O)OCc1cn2cc(Cl)ccc2n1,NKRNVINSQXBVMV-UHFFFAOYSA-N,cdp2w10_n03_s5_w2f5a4b415-7396-4607-8800-bd769d2d63c0,cdp2w10_n03_s5_w349350d95-ffe2-49f7-832e-4eb56d6725f8,cdp2w10_n03_s5_w1cf87fa65-e833-4c2c-b380-35a89b3a4865,cdp2w10_n03_s5_w54af5ffd3-51ee-475e-924b-ece8d01ec9c8,cdp2w10_n03_s5_w4b8217e89-ec3a-41d4-b3b3-745f851df3f5,48,4282
1069,22578.0,25573-N15-4,BRD-K36646212-001-05-6,25573,N15,4,SA1859214,BRD-K36646212,BROAD_CPD_ID,Cc1ccc(cc1)-n1cc(CN2CCN(Cc3nccn3C)CC2)c(n1)-c1ccc(F)cc1,NKVFJSGYMQEBRF-UHFFFAOYSA-N,cdp2w11_n15_s4_w24b61963f-d309-4ecb-a0a1-231d9f6da607,cdp2w11_n15_s4_w36f26450f-c7d5-488e-a6e7-027e6e30aea7,cdp2w11_n15_s4_w16ed3b1bc-37ba-45aa-824f-6d5786f3e680,cdp2w11_n15_s4_w576912331-0995-4d71-9f0f-cd24b047e35f,cdp2w11_n15_s4_w4627aa2a7-510c-4c27-9cb6-9ab640146030,54,6804
1070,19697.0,25564-M13-3,BRD-K56620303-001-05-6,25564,M13,3,SA1861808,BRD-K56620303,BROAD_CPD_ID,Brc1ccc(o1)C(=O)NC(=S)NNC(=O)c1cccs1,NLKORLKZQPZEEI-UHFFFAOYSA-N,cdp2w11_m13_s3_w2942f0427-a715-4b9c-b73d-2a5d20a0abce,cdp2w11_m13_s3_w365db2a2f-e939-4d91-8396-ae1cfcc16819,cdp2w11_m13_s3_w1792d70c1-65bd-4661-a1f7-5215685d370c,cdp2w11_m13_s3_w5dd25e99c-af97-4de5-9654-58d8da74831b,cdp2w11_m13_s3_w4af6918db-7007-4abb-9a76-15a1c872ea7e,76,1667
1071,14755.0,25424-H06-5,BRD-K55224251-001-05-0,25424,H06,5,SA1856589,BRD-K55224251,BROAD_CPD_ID,Cn1nnnc1SCC(=O)Nc1ccccc1-c1ccccc1,NLPJCTBGVLOWSX-UHFFFAOYSA-N,cdp2w10_h06_s5_w27107cfbf-b90e-4ecc-814e-f89d7008b700,cdp2w10_h06_s5_w32b993420-2b76-4b0f-837d-c98fa7301b4c,cdp2w10_h06_s5_w101fdaec1-fd19-4b3c-a2ac-700f83a7941b,cdp2w10_h06_s5_w5a505ddb5-c3e3-4c33-811b-26ce1acb240d,cdp2w10_h06_s5_w4cfa0865f-0b48-48a5-a9bb-74a5f9ead39f,80,2601
1072,45115.0,25991-D07-5,BRD-K63151507-001-01-6,25991,D07,5,SA792888,MNITMT,to-be-curated,Cn1cnnc1Sc1c(ncn1C)[N+]([O-])=O,NMBDIMPYACLUDE-UHFFFAOYSA-N,cdp2w8x2_d07_s5_w2dfae9d64-f05e-4a05-afe1-d4554cbc1881,cdp2w8x2_d07_s5_w355eb0065-90eb-4a65-a140-5f57aee4abf6,cdp2w8x2_d07_s5_w1bd88d124-05d3-4ef1-8ec1-364ed0b2d0c1,cdp2w8x2_d07_s5_w5901d41ea-40f1-45c5-bfed-62d0a4593d24,cdp2w8x2_d07_s5_w456de9ee7-c3a7-4c76-8c4e-b93d239b9741,20,711
1073,23795.0,25579-M22-3,BRD-K08304598-001-10-0,25579,M22,3,SA1854815,BRD-K08304598,BROAD_CPD_ID,COc1cccc(c1)N1C(=O)[C@@H]2NN=C([C@@H]2C1=O)C(=O)c1cnccn1,NMOZCKQFQXCMBL-GXTWGEPZSA-N,cdp2w11_m22_s3_w2c38d5480-90f0-4a41-b63b-1ff994c1396c,cdp2w11_m22_s3_w38304aa2e-a4fe-4c00-8783-ee5722ae1681,cdp2w11_m22_s3_w1a67ea4af-bafd-45bc-9f4a-a0ce565d9c98,cdp2w11_m22_s3_w5fdfbc2b8-a9b5-48cc-a708-5bb398c5eb50,cdp2w11_m22_s3_w4345f5fea-b5e9-46af-a7cb-1ea971b73823,50,2854
1074,29835.0,25643-G16-1,BRD-K29385413-001-05-7,25643,G16,1,SA1856632,BRD-K29385413,BROAD_CPD_ID,O=C(NC(=S)NCCC1=CCCCC1)c1ccco1,NMPTXOFVGXIWRZ-UHFFFAOYSA-N,cdp2w12_g16_s1_w2245408cc-9fc2-4e66-9732-48073ac079b6,cdp2w12_g16_s1_w345c7951b-0e30-43b6-bf6f-0b8877996d6e,cdp2w12_g16_s1_w16ab183dc-757b-4677-b969-fc266cd454e8,cdp2w12_g16_s1_w5cd396d7b-5eec-4341-8f06-e906215fae31,cdp2w12_g16_s1_w43390d0d5-c116-4315-bb5b-241fd644c323,57,4298
1075,45849.0,26058-K21-1,BRD-K93662118-001-04-1,26058,K21,1,SA1854040,BRD-K93662118,BROAD_CPD_ID,Cc1cccc(OCc2nc(no2)-c2ccc(cc2)-n2cccc2)c1,NMXNNBMGMUREIP-UHFFFAOYSA-N,cdp2w9x2_k21_s1_w2c94676dd-736c-498f-9af7-9bcbbe6602bf,cdp2w9x2_k21_s1_w3cc0d42c0-dc0c-4a06-ac43-1e877fc086e3,cdp2w9x2_k21_s1_w115b08b58-330e-477b-82b0-c8403b60c388,cdp2w9x2_k21_s1_w5e7d03ed3-b140-4a15-be51-667c3af161ac,cdp2w9x2_k21_s1_w4b4ec2d9d-ca38-4113-bd41-90a45435577b,44,6389
1076,5177.0,24311-J14-6,BRD-K52397688-001-01-9,24311,J14,6,SA82507,amperozide,common,CCNC(=O)N1CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1,NNAIYOXJNVGUOM-UHFFFAOYSA-N,cdp2bioactives_j14_s6_w2b16e0e53-7d9b-4fe2-b253-ba11b6194ea8,cdp2bioactives_j14_s6_w36470d6f2-05af-4367-904e-e58213804d97,cdp2bioactives_j14_s6_w1d7599c36-6069-4da2-957d-ab333decc13b,cdp2bioactives_j14_s6_w546ca6fb7-1a55-48ac-b4b4-d26938cea6ef,cdp2bioactives_j14_s6_w40ade9751-9095-4fc1-beef-3ec500a4609a,126,1319
1077,11773.0,25392-F22-5,BRD-K74965657-001-05-5,25392,F22,5,SA1861645,BRD-K74965657,BROAD_CPD_ID,CCCn1c(SCC(=O)Nc2ccccc2N2CCCCC2)nc2n(C)c(=O)n(C)c(=O)c12,NNILYJTZTWGWRW-UHFFFAOYSA-N,cdp2w10_f22_s5_w2c0398dff-c845-49e4-b44d-2cfe7ffc2de2,cdp2w10_f22_s5_w3d480ea04-f123-49b3-bc46-c2e3cc46b4ca,cdp2w10_f22_s5_w12f1a2781-96d5-46f0-9e69-4b0f9efbee7d,cdp2w10_f22_s5_w5ef53c1e8-cf03-4ddb-bb54-d8ebb04d5f9b,cdp2w10_f22_s5_w413fb572a-42c5-4e6b-a751-9c6f6b8d8db5,42,7357
1078,44106.0,25987-J18-4,BRD-K52662033-001-02-6,25987,J18,4,SA82081,lidocaine,INN,CCN(CC)CC(=O)Nc1c(C)cccc1C,NNJVILVZKWQKPM-UHFFFAOYSA-N,cdp2w8x2_j18_s4_w2cee76368-ff7c-4121-8152-b80dc96aaeed,cdp2w8x2_j18_s4_w3a0533f29-cb57-4577-8660-0b5b9ad28aa8,cdp2w8x2_j18_s4_w1285b8e56-0e9b-49bf-a597-464a9277d950,cdp2w8x2_j18_s4_w547a3e31e-26b6-424f-a8da-829e68d97b7f,cdp2w8x2_j18_s4_w4d14a4035-5e30-4da3-a7a8-8e3a57fd2fa4,81,129
1079,23680.0,25579-H12-2,BRD-K90940383-001-05-9,25579,H12,2,SA1853231,BRD-K90940383,BROAD_CPD_ID,O=C(N1CCCCCC1)c1ccc(CSc2ccccc2)cc1,NNLHCQFFYNKDGS-UHFFFAOYSA-N,cdp2w11_h12_s2_w246876fcd-e6b8-4844-a690-339592b57cc1,cdp2w11_h12_s2_w36a0fd35b-70ba-4e77-b594-d3cd27a9fa25,cdp2w11_h12_s2_w12b79fadb-fe96-4957-9bd6-c298b7354bd9,cdp2w11_h12_s2_w5525d66ca-becc-4557-9693-b24b50d39a1e,cdp2w11_h12_s2_w4f87276d8-61b6-414a-8c31-6117c9e2ee78,86,6356
1080,36605.0,25700-P12-3,BRD-K78140317-001-05-3,25700,P12,3,SA1860015,BRD-K78140317,BROAD_CPD_ID,CCc1nn(CC(=O)NCc2ccccc2Cl)c(=O)c2cccn12,NNMCTWVXYHSUPA-UHFFFAOYSA-N,cdp2w12_p12_s3_w2dab99fd2-6333-472f-a2a2-261b0110a711,cdp2w12_p12_s3_w36ba008b6-a1ec-4844-8d4a-8d5e4676e0db,cdp2w12_p12_s3_w1be9b5a13-12af-4137-8c4a-d340f1b3cacc,cdp2w12_p12_s3_w5ab62b7c2-12fc-40f8-a4fc-2c7402eb7768,cdp2w12_p12_s3_w44002587d-c10e-4ace-b2c9-3f6a9595ca08,49,1976
1081,33757.0,25681-O06-5,BRD-K71430627-001-05-0,25681,O06,5,SA1859278,BRD-K71430627,BROAD_CPD_ID,CCc1nc2ccccc2n1Cc1ccccc1OC,NNTTVNGXVPOWDS-UHFFFAOYSA-N,cdp2w12_o06_s5_w2fd5d6d5b-70dd-4e36-bdb7-2b419e78dcc0,cdp2w12_o06_s5_w3dd919522-9db5-4b0f-a35a-da33ab9096ce,cdp2w12_o06_s5_w1f0507898-1959-451a-8c32-607ce0e7c069,cdp2w12_o06_s5_w581d9b84c-bfa9-4432-84a8-ee383c388a27,cdp2w12_o06_s5_w4ee68e654-aab6-45a4-9c5d-613bea127e69,63,8879
1082,2389.0,24301-J02-2,BRD-A74667430-001-04-6,24301,J02,2,SA59309,etodolac,INN,CCc1cccc2c3CCOC(CC)(CC(O)=O)c3[nH]c12,NNYBQONXHNTVIJ-UHFFFAOYSA-N,cdp2bioactives_j02_s2_w21d529a89-94da-49ec-bebd-4b3e720d371c,cdp2bioactives_j02_s2_w392b27674-9e3b-4aee-bcec-75e9aaf7f211,cdp2bioactives_j02_s2_w13c1c1260-2f16-4bc2-b1e3-3f3d0ca2dfd9,cdp2bioactives_j02_s2_w5533aca04-f8d5-4c23-850b-4a4fdc3a812b,cdp2bioactives_j02_s2_w499c923ae-756b-434f-bcd1-fefc00f93455,81,289
1083,53450.0,26207-D15-6,BRD-K01169312-001-11-7,26207,D15,6,SA1853686,BRD-K01169312,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)N1c2cc(Cl)ccc2Oc2nc3ccccc3nc12,NOINQIQOKCGVPO-UHFFFAOYSA-N,cdp2w9x2-au00026617_d15_s6_w2c1e27c17-e47d-4896-9013-1fb8fe48ba12,cdp2w9x2-au00026617_d15_s6_w3b5e3722d-a71a-4f28-8746-e35594802dfa,cdp2w9x2-au00026617_d15_s6_w13d2b301d-e594-466e-9251-0b0e0c97615b,cdp2w9x2-au00026617_d15_s6_w506121a47-560f-46b7-879e-535920ad39a9,cdp2w9x2-au00026617_d15_s6_w4206bd376-67e4-45e6-9253-af70d5eedcd8,10,8384
1084,55088.0,26271-F11-6,BRD-A42246453-001-05-7,26271,F11,6,SA1857905,BRD-A42246453,BROAD_CPD_ID,CCNCC(O)COCC(O)CNCC,NOWSFZSRGQDPTC-UHFFFAOYSA-N,cdp2w9x2-au00026606_f11_s6_w2ffb65f03-c341-435b-b9f1-63ad21542f93,cdp2w9x2-au00026606_f11_s6_w3ef7377b2-b98b-46ea-b83d-7c16fdf64068,cdp2w9x2-au00026606_f11_s6_w19eda61f1-2ce1-4cca-9198-71a63aa036cb,cdp2w9x2-au00026606_f11_s6_w5050b2848-2001-41e6-83f3-d3d81f9dba8c,cdp2w9x2-au00026606_f11_s6_w468db3540-a3f7-48e7-8ffe-7a0364a45306,28,7430
1085,9879.0,25374-A20-1,BRD-K24164610-001-06-0,25374,A20,1,SA1852861,BRD-K24164610,BROAD_CPD_ID,CS(=O)(=O)Nc1ccc2CCc3cccc1c23,NPGRAIIBMVPZHD-UHFFFAOYSA-N,cdp2w10_a20_s1_w2a4cf3252-b69c-4b92-bb16-8a69eec224ad,cdp2w10_a20_s1_w3033fb3ce-46c1-48a7-a1b6-1751f4273f8c,cdp2w10_a20_s1_w1a1d33191-86f0-4109-9e07-7b6b4f787ac6,cdp2w10_a20_s1_w513a0ff4d-296f-4b4d-b1eb-28dfb04d3c07,cdp2w10_a20_s1_w40b9f1cf1-b30d-4ba7-9433-b944c249af43,45,3510
1087,56059.0,26681-P24-5,BRD-K77759000-001-02-0,26681,P24,5,SA794944,BRD-K77759000,BROAD_CPD_ID,COC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NS(=O)(=O)c4ccccc4)cc23)[C@@H](CO)O1,NPRGNJUPYHXXCW-QBGRRASTSA-N,cdp2w13_p24_s5_w2411c73cd-d3eb-421a-af17-b1a097f889b1,cdp2w13_p24_s5_w310266913-85d7-4678-9148-5f1b3bdbaa28,cdp2w13_p24_s5_w192e9f474-4c8c-483f-bbaf-aadcbf38cdd4,cdp2w13_p24_s5_w59810117c-de42-4566-8f81-dbbcd2a2ccce,cdp2w13_p24_s5_w484b124be-ba99-47a1-b921-634573ffa68c,55,9820
1088,36221.0,25695-L16-3,BRD-K94584466-001-05-1,25695,L16,3,SA1860312,BRD-K94584466,BROAD_CPD_ID,CCOC(=O)c1sc(NC(=O)c2ccc(cc2)S(=O)(=O)N(CC)CC)nc1C,NQKYAUGUQSTEAV-UHFFFAOYSA-N,cdp2w12_l16_s3_w2db4846d2-4615-4484-a6c5-d04037624af2,cdp2w12_l16_s3_w33136b9f3-4e76-4dd7-b6cd-1bc4133ad6fd,cdp2w12_l16_s3_w1eb19dcf8-be5b-4ce0-bd36-b0d36519aa25,cdp2w12_l16_s3_w54eafd41b-aac3-4ecd-95ca-ee9963f78d0d,cdp2w12_l16_s3_w44c5b0d36-85e7-47fa-8239-19238de14648,67,5221
1089,55124.0,26271-G20-6,BRD-A43164341-001-05-7,26271,G20,6,SA1861840,BRD-A43164341,BROAD_CPD_ID,CC12COC3(CC1CCC23C)C(=O)Nc1cccnc1,NQOTWEWBZJOSEX-UHFFFAOYSA-N,cdp2w9x2-au00026606_g20_s6_w2c5876092-f9b9-45e2-8ee0-f10c271be778,cdp2w9x2-au00026606_g20_s6_w323482d6b-f699-4e36-85f8-5ca92ed89628,cdp2w9x2-au00026606_g20_s6_w15a07e814-4fe9-448b-8cf9-fbb4ebbac39f,cdp2w9x2-au00026606_g20_s6_w58f252e5c-6636-4bf7-8e7c-865e3608b1e2,cdp2w9x2-au00026606_g20_s6_w4c6b068f1-585e-4044-884b-18418a223147,53,5550
1090,14861.0,25424-N21-3,BRD-A28409908-001-05-0,25424,N21,3,SA1856221,BRD-A28409908,BROAD_CPD_ID,CN(C(=O)C1CCOC1)c1nnc(s1)-c1ccccn1,NQUVOUKOXGTLEL-UHFFFAOYSA-N,cdp2w10_n21_s3_w293cfe7e4-38e1-4220-9268-e9f0f0445c19,cdp2w10_n21_s3_w300d03cdb-5379-490b-bdd6-93f32845341d,cdp2w10_n21_s3_w112ed8ccc-c64b-4920-a1eb-68daa21e013a,cdp2w10_n21_s3_w53bf80cc8-5404-4018-a99a-e7420ac9c913,cdp2w10_n21_s3_w44d7a9552-32b6-4155-bb31-0291d3a8f9c9,55,7090
1091,30804.0,25665-F20-4,BRD-K50937034-001-05-6,25665,F20,4,SA1853855,BRD-K50937034,BROAD_CPD_ID,CC(=O)c1ccc(NC(=O)CSc2ccc3nnc(-c4ccccn4)n3n2)cc1,NQYWPEYUYIJTTM-UHFFFAOYSA-N,cdp2w12_f20_s4_w27f2d9ffc-a9e6-437c-a1fe-eacae77eb53f,cdp2w12_f20_s4_w341bec657-e6a7-48d3-b672-e4d91a15d3fd,cdp2w12_f20_s4_w162e4b4ec-f6cd-4ba7-b248-947afd0281e8,cdp2w12_f20_s4_w5bcfc81e3-db8f-4c75-b316-64e1013bcb1d,cdp2w12_f20_s4_w46f6ba982-ee18-4e3f-a3dc-3002e2789769,53,3033
1092,17389.0,25438-N21-5,BRD-K78142829-001-05-0,25438,N21,5,SA1860235,BRD-K78142829,BROAD_CPD_ID,CCOc1ccc(cc1)N1C(=O)NC(=O)\C(=C/c2ccc(cc2C)N2CCOCC2)C1=O,NQZVDBLCAOLRGZ-RCCKNPSSSA-N,cdp2w10_n21_s5_w24a3e3c85-00d4-4873-a862-f71c4301d231,cdp2w10_n21_s5_w33aa74f07-dc3c-4b56-b192-69cce7b973f6,cdp2w10_n21_s5_w1a30e897e-9ee6-4fa0-b993-0f4d41b4eb3c,cdp2w10_n21_s5_w51484fd52-50f1-4e45-85d5-a22fe1027f04,cdp2w10_n21_s5_w4d8e066d9-2e48-41a5-8dc6-c3d523c81046,56,9210
1093,55237.0,26271-L03-5,BRD-K26582498-001-05-0,26271,L03,5,SA1861370,BRD-K26582498,BROAD_CPD_ID,Cc1cccc(OCCNC(=O)c2nc[nH]n2)c1,NRBQTYGTSXZAJI-UHFFFAOYSA-N,cdp2w9x2-au00026606_l03_s5_w2e62080ec-8e3c-443c-b760-93b9749a4957,cdp2w9x2-au00026606_l03_s5_w3cba2a26a-e3fe-4003-844a-4cc612b0160c,cdp2w9x2-au00026606_l03_s5_w1579ad8d6-0fe7-4930-a371-5c950a431272,cdp2w9x2-au00026606_l03_s5_w594c6bd9e-4280-4745-a52d-cf30065c17e1,cdp2w9x2-au00026606_l03_s5_w441c6330e-1b14-4a85-8a9d-6379fabf6f78,69,4002
1094,11073.0,25382-N19-1,BRD-K96601418-001-05-0,25382,N19,1,SA1860990,BRD-K96601418,BROAD_CPD_ID,Cc1ccccc1-c1ccc(o1)C(=O)NCc1ccccc1,NRDAHWVAKMEMEF-UHFFFAOYSA-N,cdp2w10_n19_s1_w24832945f-f41e-4d69-9b95-1fe80c4c2528,cdp2w10_n19_s1_w3d98e6534-ec75-4f41-917d-7dc7615ae5f1,cdp2w10_n19_s1_w13c631055-7068-41a5-ad17-94bd2e051ab7,cdp2w10_n19_s1_w5ef27127b-07d5-4749-a852-1d7850f5144e,cdp2w10_n19_s1_w4d6c7e40f-467c-4caf-ae37-e67a41fa2244,63,7204
1095,35939.0,25694-M09-3,BRD-K87234097-001-05-9,25694,M09,3,SA1852736,BRD-K87234097,BROAD_CPD_ID,COCc1cc(C)n(CC(=O)Nc2ccccc2C(=O)OC)c(=O)c1C#N,NRNTXYRVKCFNDU-UHFFFAOYSA-N,cdp2w12_m09_s3_w2b08a4ae3-c7e8-44d7-aadd-4f087992f933,cdp2w12_m09_s3_w3abe17064-8faf-458e-8d0e-71b879383426,cdp2w12_m09_s3_w1d039bc69-e713-419b-9dc5-511828492dea,cdp2w12_m09_s3_w5d64183f5-dad2-475a-939c-cb5dbec66a78,cdp2w12_m09_s3_w4635f5d4c-8f33-4fa6-bd24-e6d42d504ecc,78,2708
1096,51975.0,26181-A03-1,BRD-K68761274-001-05-9,26181,A03,1,SA1857448,BRD-K68761274,BROAD_CPD_ID,CCCCN=C(S)NNC(=O)c1csc(c1)C(C)C,NSAJSIBOZIQZFR-UHFFFAOYSA-N,cdp2w9x2-au00026617_a03_s1_w25a82f5cd-705f-4cef-96db-9f3c3f98cc1b,cdp2w9x2-au00026617_a03_s1_w304e77e44-3902-41c3-9adc-91faffe425ff,cdp2w9x2-au00026617_a03_s1_w1764dcb75-6903-4421-91da-d70fd1cecf1e,cdp2w9x2-au00026617_a03_s1_w55e6a9d4d-cb03-49f0-818e-f49716d61b28,cdp2w9x2-au00026617_a03_s1_w464d02232-0442-425a-bdc9-a31f70c59f90,91,7242
1097,33664.0,25681-J13-2,BRD-K43610438-001-05-1,25681,J13,2,SA1854623,BRD-K43610438,BROAD_CPD_ID,CCCC(=O)Nc1ccc2nn(nc2c1)-c1ccc(OC)cc1,NSJWOTURAYVXJE-UHFFFAOYSA-N,cdp2w12_j13_s2_w219a6d6d3-4c6d-4914-8656-d970033767f3,cdp2w12_j13_s2_w3742c164b-a085-49c2-ac99-e93939e2d3e4,cdp2w12_j13_s2_w11bc73842-5cf3-45d1-b261-145a93bf43d0,cdp2w12_j13_s2_w59e70728c-46cc-438c-b771-41b3211763ec,cdp2w12_j13_s2_w4bab69c17-aec7-4e68-8e63-770ee3488718,57,2154
1098,9874.0,25374-A18-2,BRD-A13980926-001-05-5,25374,A18,2,SA1857681,BRD-A13980926,BROAD_CPD_ID,Fc1ccc(cc1)C(C#N)c1ccc(cc1)C(=O)c1ccc(F)cc1,NSLYLZYECDXPAV-UHFFFAOYSA-N,cdp2w10_a18_s2_w23271dd3c-7d36-43f9-98a7-9f7b31b5876d,cdp2w10_a18_s2_w3c1208d59-2835-4de1-8983-5384f623acdc,cdp2w10_a18_s2_w112acbf9b-db7a-4754-95a7-6c120a65c11c,cdp2w10_a18_s2_w52e33a103-f76d-4af7-9501-ae82d6979732,cdp2w10_a18_s2_w4f90323a1-b679-4e4b-af3b-8ce1306bdc04,44,5490
1099,14364.0,25422-D13-4,BRD-K66549663-001-05-9,25422,D13,4,SA1859485,BRD-K66549663,BROAD_CPD_ID,CSc1nc2ccc(NC(=O)c3ccco3)cc2s1,NTDRTSAQTBRJNC-UHFFFAOYSA-N,cdp2w10_d13_s4_w2b36fe84b-9e6c-41ed-99b6-89beca2caa8c,cdp2w10_d13_s4_w3fcbf3a7a-c591-4ad0-ac64-b530d07557ab,cdp2w10_d13_s4_w1efb106bf-d507-46da-9adc-297b045a4ad7,cdp2w10_d13_s4_w59d1289c7-bbbf-49fd-9d91-8b9c18e45097,cdp2w10_d13_s4_w4d16dd65b-388f-4e22-a2cc-4c9364910910,51,2442
1100,39015.0,25849-E22-1,BRD-K44818533-001-01-2,25849,E22,1,SA791091,BRD-K44818533,BROAD_CPD_ID,COc1ccc(NC(=O)N(C)C[C@H]2OCc3ccccc3-c3c(C(=O)N(C[C@@H]2C)[C@H](C)CO)n(C)c2ccccc32)c(OC)c1,NTGYADANNGAILP-INEJIFKHSA-N,cdp2w6x2_e22_s1_w256cf49ea-d2cb-4c47-870d-95a0a2991718,cdp2w6x2_e22_s1_w350d97dfc-1706-4241-b90b-22aa6dfea10c,cdp2w6x2_e22_s1_w1e5ecf2d1-3054-4083-a4cc-1b7e5d0bbb1b,cdp2w6x2_e22_s1_w56253c879-c2e8-4196-b677-5d66eaccc1c8,cdp2w6x2_e22_s1_w4bb363a1d-cb07-4153-b260-7a1c247a91c2,124,10445
1101,26424.0,25591-J18-4,BRD-K22221338-001-05-3,25591,J18,4,SA1853053,BRD-K22221338,BROAD_CPD_ID,c1coc(c1)-c1nn2c(nnc2s1)-c1ccco1,NTJAHJNZTGHMTR-UHFFFAOYSA-N,cdp2w11_j18_s4_w241334155-a0d1-4953-82dd-4d6921829a73,cdp2w11_j18_s4_w308f74858-1e74-4208-a7a5-b0f28967998d,cdp2w11_j18_s4_w18ee821b3-bb29-4aee-aa4a-3980a86498c0,cdp2w11_j18_s4_w59c789183-1d71-46fa-86bd-7e2f055d2d9f,cdp2w11_j18_s4_w48627aebb-3be7-41ef-b94f-c62afda0f2af,60,6556
1102,25563.0,25587-E15-1,BRD-A73347505-001-05-3,25587,E15,1,SA1861046,BRD-A73347505,BROAD_CPD_ID,CC1(C)NC(=O)N(CC(O)CN2CCOCC2)C1=O,NTMQHOLHUHTIQJ-UHFFFAOYSA-N,cdp2w11_e15_s1_w234983f59-408f-4c64-ad0f-2ecab7b6ef76,cdp2w11_e15_s1_w311911562-7114-4a20-aeee-35c525bb695b,cdp2w11_e15_s1_w11a8611b8-3a1b-48fc-80fd-d7d25c985263,cdp2w11_e15_s1_w572fee3b6-e06d-42eb-bf24-5346f55276b6,cdp2w11_e15_s1_w48735e637-fcb9-4110-9496-912f8fb3d10c,81,2647
1103,34093.0,25683-M20-5,BRD-K88780295-001-05-0,25683,M20,5,SA1854931,BRD-K88780295,BROAD_CPD_ID,Cc1nn(c(NC(=O)c2ccc(Cl)cc2Cl)c1Br)C(C)(C)C,NTUXVUQBYKOQAD-UHFFFAOYSA-N,cdp2w12_m20_s5_w2e96d4527-4dc2-4fdc-b68b-4e64fe7db4e5,cdp2w12_m20_s5_w3b0c15937-2c05-4b03-b657-a75cb477e8e8,cdp2w12_m20_s5_w16570ef24-4d2f-4fba-bdc0-54d836290010,cdp2w12_m20_s5_w5b3dedd6b-4268-4c4f-9b70-85e0dc5623a4,cdp2w12_m20_s5_w4ce8a49db-9608-4b3f-8fc6-34333a11045c,63,3883
1104,27547.0,25598-C17-5,BRD-K21201014-001-05-7,25598,C17,5,SA1858722,BRD-K21201014,BROAD_CPD_ID,CCN(CC)C(=S)SCCC(=O)NC(=O)Oc1ccc(cc1)C(C)C,NUEOQLXPVLVOIQ-UHFFFAOYSA-N,cdp2w11_c17_s5_w209ebb6b4-548d-4826-b6be-f046ff269904,cdp2w11_c17_s5_w39c264482-7e26-4862-9adc-bdcaa9bedbcf,cdp2w11_c17_s5_w1cf8e17c9-2721-45d2-b7aa-9784e74ae159,cdp2w11_c17_s5_w5cfa48ad6-ce6e-4cca-8ce2-23453ecbd013,cdp2w11_c17_s5_w42db67ac3-cd6a-48d8-9e3e-fecbe7491fcc,66,9338
1105,25923.0,25588-L10-1,BRD-K76539182-001-05-0,25588,L10,1,SA1852581,BRD-K76539182,BROAD_CPD_ID,COc1ccc(NC(=O)CSc2nc(O)cc(NS(=O)(=O)c3ccc(C)cc3)n2)cc1,NUGRGXXRCSYGGA-UHFFFAOYSA-N,cdp2w11_l10_s1_w2b8bb4860-c398-47d5-a5b5-2f0dd6d54fb4,cdp2w11_l10_s1_w328e80e57-d03a-4e59-a952-ec54919ad046,cdp2w11_l10_s1_w1476f7e38-db17-4895-a0fe-6482b9faeb3a,cdp2w11_l10_s1_w52476149a-0f55-4b8b-b5ca-db07ff8ce7b1,cdp2w11_l10_s1_w45c4db120-6bae-4aa3-a5d2-f619e61b4f35,81,4944
1106,32382.0,25677-K22-4,BRD-K40957415-001-05-6,25677,K22,4,SA1855216,BRD-K40957415,BROAD_CPD_ID,CC(C)(C)OC(=O)CNC(=O)c1[nH]cnc1C(=O)Nc1ccc(Cl)cc1,NUHNBOBCXDYEON-UHFFFAOYSA-N,cdp2w12_k22_s4_w29d0d2bca-02e4-4df4-a73f-66b0fed68f1a,cdp2w12_k22_s4_w367009a7b-d4a8-40df-a75c-510e4e277d63,cdp2w12_k22_s4_w13c590148-6aa3-4335-9f0d-fc963010a0b9,cdp2w12_k22_s4_w5984042a0-be81-40ac-8477-6f9b257b124a,cdp2w12_k22_s4_w41bd364cb-2b02-468f-9884-6851589fef13,55,5877
1107,27517.0,25598-B05-5,BRD-K89650689-001-06-6,25598,B05,5,SA1856495,BRD-K89650689,BROAD_CPD_ID,O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC1,NVTIIEDNXCIXRE-UHFFFAOYSA-N,cdp2w11_b05_s5_w2bb309160-76ab-40b0-8e50-c1e7622223f7,cdp2w11_b05_s5_w382fc9e6f-8ab5-434b-9e4a-36887f33a63d,cdp2w11_b05_s5_w12301b1b8-8129-4c3a-b9a4-14fc17f3729f,cdp2w11_b05_s5_w5527256c5-805e-4d17-83ad-1699685c973e,cdp2w11_b05_s5_w486fb8f00-efad-489a-807f-8176ce5d70d8,65,2439
1108,6173.0,24320-D02-6,BRD-K62929068-001-01-7,24320,D02,6,SA22924,6-benzylaminopurine,primary-common,N(Cc1ccccc1)c1ncnc2nc[nH]c12,NWBJYWHLCVSVIJ-UHFFFAOYSA-N,cdp2bioactives_d02_s6_w2ec502a11-cd14-4e0e-ac68-944df1d3dacb,cdp2bioactives_d02_s6_w3633128ed-c5ad-4e47-9f57-bc024476cfe5,cdp2bioactives_d02_s6_w1297ca813-0b22-46b0-a02d-3f394df82d43,cdp2bioactives_d02_s6_w544bbd5cc-124b-42ca-8fcc-c72b81f402a7,cdp2bioactives_d02_s6_w4bc225614-2036-4801-af0c-b7ce6e465595,104,1031
1109,32501.0,25678-B18-3,BRD-K61597089-001-05-9,25678,B18,3,SA1857697,BRD-K61597089,BROAD_CPD_ID,[O-][N+](=O)c1cc2OCOc2cc1CN1CCN(CC1)c1ccccc1F,NWLSYTXOZRHQNV-UHFFFAOYSA-N,cdp2w12_b18_s3_w220f46c9d-fb4c-47eb-a9fc-33faa2582ebd,cdp2w12_b18_s3_w3004ef554-0795-4449-9464-fc7178a8cd74,cdp2w12_b18_s3_w18703afb9-7857-4c3d-9606-10f87fe7e60a,cdp2w12_b18_s3_w58dad3552-2d92-45e1-8cff-7c1d07fb3fb6,cdp2w12_b18_s3_w41d04ad78-a752-417c-bd34-53730d18dba0,74,9429
1110,32607.0,25678-G20-1,BRD-K88892681-001-05-5,25678,G20,1,SA1853617,BRD-K88892681,BROAD_CPD_ID,CCC(=O)N1CCN(CC1)c1ccc(NC(=O)c2ccco2)cc1,NWSLMJAYZDILSI-UHFFFAOYSA-N,cdp2w12_g20_s1_w21bbf3e3b-47b2-46c6-b137-380925c2b8fd,cdp2w12_g20_s1_w361ab49fa-a50b-4a10-a8c7-8f885c45376e,cdp2w12_g20_s1_w1d59c32ad-361a-483b-89bb-61d55c17a15a,cdp2w12_g20_s1_w507ae319b-e3c7-4cd4-bf9a-1238005a0b9b,cdp2w12_g20_s1_w4d42c6888-bdcb-491e-b140-b23e82b3dbb4,61,7047
1111,37854.0,25724-M07-4,BRD-K29112518-001-05-9,25724,M07,4,SA1860288,BRD-K29112518,BROAD_CPD_ID,NC(=O)SCC(=O)Nc1ccccc1C(O)=O,NWUAPELPCMQTDN-UHFFFAOYSA-N,cdp2w12_m07_s4_w2dc906a8f-49b8-42dc-9671-c728e8b3d392,cdp2w12_m07_s4_w305ad25c1-ba15-43c9-a69b-11809a7bd326,cdp2w12_m07_s4_w1e8cdf38c-9de2-4852-9989-b5fb8727e33d,cdp2w12_m07_s4_w5cade7c2c-432b-4c0b-be51-4ea44412d6a7,cdp2w12_m07_s4_w49c312d9d-d6be-4dee-82de-7a5870a88d58,84,5590
1112,52054.0,26181-E21-2,BRD-A28006745-001-05-1,26181,E21,2,SA1855832,BRD-A28006745,BROAD_CPD_ID,COc1cccc(CC(NC(C)=O)C(=O)NC2CCN(CC2)c2nc(C)cc(C)c2C#N)c1,NWUFGLDPGOLEFF-UHFFFAOYSA-N,cdp2w9x2-au00026617_e21_s2_w25e486861-8123-4749-b787-7bf051e81cfb,cdp2w9x2-au00026617_e21_s2_w3866b1251-ac1f-469e-b0f1-607379d105d6,cdp2w9x2-au00026617_e21_s2_w19f9df166-965a-4651-9f9f-dbad68429e34,cdp2w9x2-au00026617_e21_s2_w577b6ba8c-745a-4729-9330-dcc61611fa96,cdp2w9x2-au00026617_e21_s2_w4c0ef49f9-0cb6-4c5c-9047-31f7c0ac5d19,33,2654
1113,27464.0,25594-O21-6,BRD-K72591075-001-06-3,25594,O21,6,SA1852819,BRD-K72591075,BROAD_CPD_ID,CCOc1ccc2nc(O)c(CN(Cc3cccs3)Cc3nnnn3C(C)(C)CC)cc2c1,NXHUITDSVPREHK-UHFFFAOYSA-N,cdp2w11_o21_s6_w214f1f012-fb9a-43eb-9231-0c279fdb40c6,cdp2w11_o21_s6_w3e08aa5a1-2001-4f24-aee9-125370b1fccf,cdp2w11_o21_s6_w1377b5760-bf8d-4c20-abce-c674eb0f9ad7,cdp2w11_o21_s6_w541f60c9b-3f6a-4f11-a408-a96a02c76e97,cdp2w11_o21_s6_w4d55cbf22-f8ae-43d4-8053-35181e3cfb28,73,3657
1114,31275.0,25667-M20-1,BRD-K93651844-001-05-2,25667,M20,1,SA1860304,BRD-K93651844,BROAD_CPD_ID,Cn1c2ccc(Cl)cc2c2nc3ccccc3nc12,NXJNINUNSFIGJN-UHFFFAOYSA-N,cdp2w12_m20_s1_w2cf1f2c41-6cd4-4139-bbef-ae123eee361a,cdp2w12_m20_s1_w37b1b190a-7ea8-4028-a4e4-e5c00f257fbf,cdp2w12_m20_s1_w1932489ff-d738-4c47-91ea-de5f0f8b32d7,cdp2w12_m20_s1_w5321873c3-d51f-42b6-9255-ddae7e6c3c76,cdp2w12_m20_s1_w4a5a503c7-1b06-468d-b000-e9f42a32bc99,65,7677
1115,56147.0,26702-D06-3,BRD-K81164606-001-01-7,26702,D06,3,SA1481840,BRD-K81164606,BROAD_CPD_ID,CCCNC(=O)N1[C@@H](CO)[C@H]([C@H]1C#N)c1ccc(cc1)-c1ccccc1F,NYKFFZXKZNVNOG-AABGKKOBSA-N,cdp2w13_d06_s3_w22a72c62c-23f3-4a54-8801-9c74c87bd5e2,cdp2w13_d06_s3_w3eb5f1f7a-97ef-4358-936d-880413c4a76e,cdp2w13_d06_s3_w159c8b158-5847-44e3-816c-7e57bb0a5cbd,cdp2w13_d06_s3_w592225169-7e9f-47fa-b454-f6abf278fca6,cdp2w13_d06_s3_w49d9a0358-b971-4584-b3dd-75b831514170,74,10471
1116,42981.0,25983-M24-1,BRD-K36116267-001-05-4,25983,M24,1,SA82845,pyrithyldione,INN,CCC1(CC)C(=O)NC=CC1=O,NZASCBIBXNPDMH-UHFFFAOYSA-N,cdp2w8x2_m24_s1_w2ef4401ab-1fa4-4883-a034-17a4244fe35a,cdp2w8x2_m24_s1_w3c00f6cc0-93ae-4954-aef1-8ffa7de5a72c,cdp2w8x2_m24_s1_w17beac4a4-a752-4e25-a547-8c91d7b0b665,cdp2w8x2_m24_s1_w5f86259b8-e758-4d1d-81c6-cb90743d70c2,cdp2w8x2_m24_s1_w45efddebd-768b-499b-8b05-966bbb655061,31,9627
1117,37417.0,25708-G08-5,BRD-A38078247-001-05-1,25708,G08,5,SA1855770,BRD-A38078247,BROAD_CPD_ID,Cc1nn(-c2ccc(F)cc2)c2sc(cc12)C(=O)OC1CCOC1=O,NZSWRFJIZIXLGX-UHFFFAOYSA-N,cdp2w12_g08_s5_w2057afde4-ddcf-4029-876f-02bc5d799bea,cdp2w12_g08_s5_w3742370de-d991-40d6-9ed7-8db1db28a4ce,cdp2w12_g08_s5_w1427a7ac2-1099-4197-a557-c65718d33b44,cdp2w12_g08_s5_w52b33f55d-c369-4801-97d2-8420c7b7ee6b,cdp2w12_g08_s5_w4f4363a3b-ade5-40f2-9357-d6304ed9ab67,49,5133
1118,24600.0,25583-F18-4,BRD-K85694064-001-05-5,25583,F18,4,SA1854893,BRD-K85694064,BROAD_CPD_ID,CCn1c(Cc2cccs2)nnc1SCC(=O)c1ccc(C)cc1,OAUMKTQGRKVSHL-UHFFFAOYSA-N,cdp2w11_f18_s4_w211485180-9fd0-4a9c-900a-ee916ad6382f,cdp2w11_f18_s4_w3491eaaf3-98eb-4653-ade5-d8ca494b19f4,cdp2w11_f18_s4_w1422eab5f-0350-4120-87d1-1506d23cc05d,cdp2w11_f18_s4_w57e9cf883-355d-437a-9969-36a9d83a3c49,cdp2w11_f18_s4_w4c0775080-1591-4926-aa39-bd3c651ccc1e,63,2894
1119,27324.0,25594-I16-4,BRD-K55104181-001-06-7,25594,I16,4,SA1855565,BRD-K55104181,BROAD_CPD_ID,CCOc1ccccc1NC(=O)Nc1ccc(Cl)cc1,OBLVETBTEXMBBF-UHFFFAOYSA-N,cdp2w11_i16_s4_w24dad01ee-48d8-4633-83fa-1e96c2994ca0,cdp2w11_i16_s4_w31940c704-c242-4b82-9c99-97c70a28dc7b,cdp2w11_i16_s4_w1f011085f-fc57-4ac0-814a-9eb1ea9e07c1,cdp2w11_i16_s4_w5a5eb48ed-3b13-42da-a901-85e6c8b4c298,cdp2w11_i16_s4_w4ec986f02-7d04-4366-96cc-872a5a8f27d2,65,2004
1120,52437.0,26202-L20-1,BRD-K19027210-001-01-1,26202,L20,1,SA1855839,BRD-K19027210,BROAD_CPD_ID,C(c1ccccc1)n1ncc2c(ncnc12)N1CCN(CC1)c1ccccc1,OBNJYHVKQLPHEM-UHFFFAOYSA-N,cdp2w9x2-au00026617_l20_s1_w2eec22251-d8f2-4003-8c66-02f76f518d91,cdp2w9x2-au00026617_l20_s1_w3abf29e8e-b623-4649-903f-be3a1346a11a,cdp2w9x2-au00026617_l20_s1_w16ea427c1-87a1-4a69-bec0-0e6127bafb7f,cdp2w9x2-au00026617_l20_s1_w59b809234-1876-43a3-9726-d82d7694ffb1,cdp2w9x2-au00026617_l20_s1_w43743cb82-36c3-4150-83f1-a1ef51b0d120,91,9640
1121,37978.0,25725-C07-2,BRD-K83821605-001-05-2,25725,C07,2,SA1854121,BRD-K83821605,BROAD_CPD_ID,CCOC(=O)Cc1csc(NC(=O)\C=C/c2ccccc2Cl)n1,OBPZXQPDHJXIEU-FPLPWBNLSA-N,cdp2w12_c07_s2_w25eb23b71-5503-44b2-a885-fcfaa633955e,cdp2w12_c07_s2_w377d79b72-f0cf-4536-95a2-60d557a0c614,cdp2w12_c07_s2_w1169ed9fe-7761-49d0-8e58-694fbc1d1424,cdp2w12_c07_s2_w534e2e8a5-994d-4935-aa88-dd1033895d4f,cdp2w12_c07_s2_w439df5f0c-ee1d-47f5-b2b1-470f07f05fdb,54,2620
1122,22834.0,25575-J17-2,BRD-A59067516-001-05-2,25575,J17,2,SA1854188,BRD-A59067516,BROAD_CPD_ID,COc1ccccc1C1N(C)C=C(C=C1[N+]([O-])=O)[N+]([O-])=O,OBQPGIJAIYVZLY-UHFFFAOYSA-N,cdp2w11_j17_s2_w2b39d59ed-93ee-4b7a-91b3-828b6e0a504d,cdp2w11_j17_s2_w3aa7747f5-5222-4871-a557-3e9c1c25e83f,cdp2w11_j17_s2_w1a3de2cab-f15e-4e87-a531-568edba9bbb0,cdp2w11_j17_s2_w5addd8938-0cdf-4942-bded-dba3b9136db0,cdp2w11_j17_s2_w418f5f473-95f1-4e56-82bf-69cbad7b843e,78,3692
1123,48878.0,26124-F05-6,BRD-K78865413-001-05-8,26124,F05,6,SA1852509,BRD-K78865413,BROAD_CPD_ID,Cc1cccc(C)c1NC(=O)COC(=O)c1nonc1N,OBUYGPOVKSSWCJ-UHFFFAOYSA-N,cdp2w9x2_f05_s6_w24cb3f844-bd93-45e4-adfe-541877ec0fba,cdp2w9x2_f05_s6_w351aead26-205f-42f1-9fc3-ed04f73b4db4,cdp2w9x2_f05_s6_w159d1e003-8013-4ea8-93dc-0020b64c3e13,cdp2w9x2_f05_s6_w5c326391d-8c2f-477a-acac-52cc3708f61d,cdp2w9x2_f05_s6_w4497232be-bc87-40c4-9fc0-d8c826962989,39,9800
1124,14846.0,25424-N12-6,BRD-K81524053-001-06-9,25424,N12,6,SA1858083,BRD-K81524053,BROAD_CPD_ID,Cc1ccc(cc1S(=O)(=O)N1CCCCC1)C(=O)Nc1ccccc1C(=O)NCc1ccco1,OBZURGGDVSLKAS-UHFFFAOYSA-N,cdp2w10_n12_s6_w26d4983bb-6b32-48d8-a7f5-bf5a715a86c5,cdp2w10_n12_s6_w384ace14b-10fd-4e40-a573-b69584a7be8c,cdp2w10_n12_s6_w10c8fe4d6-c75c-4802-8dad-1e98ca93703f,cdp2w10_n12_s6_w54cc86dc4-8e45-444b-b9ce-8af41ac29c0d,cdp2w10_n12_s6_w43ab6b73f-7e03-4759-94a4-fb9d4446d0b3,39,6694
1125,29818.0,25643-G11-2,BRD-K70427147-001-06-6,25643,G11,2,SA1855780,BRD-K70427147,BROAD_CPD_ID,Cc1cc(SC#N)cc(C)c1NC(=O)CCl,OCBBHLKACGBRNA-UHFFFAOYSA-N,cdp2w12_g11_s2_w28cc45272-ded8-4788-97fb-e886f9d1643c,cdp2w12_g11_s2_w315fda764-fea1-4721-ad04-825cc3ef02a1,cdp2w12_g11_s2_w1258795e3-6959-462b-83e0-7c7ebbbad07b,cdp2w12_g11_s2_w582b65911-e377-43b3-adc2-588ce8d8d87d,cdp2w12_g11_s2_w40ae47edd-8ac9-4d2c-a0b2-5058f6d0c076,28,5592
1126,25052.0,25584-J04-6,BRD-K30978849-001-05-0,25584,J04,6,SA1856747,BRD-K30978849,BROAD_CPD_ID,COC(=O)c1c(C)[nH]cc1-c1ccccc1,OCIWPTHNKMNUIK-UHFFFAOYSA-N,cdp2w11_j04_s6_w21e0eb368-0d7e-49d8-985d-1113d0d5a22e,cdp2w11_j04_s6_w3653beeac-ca8e-46e8-8fb9-9386e60f5d96,cdp2w11_j04_s6_w15f9d3fd0-2fd0-4d20-b44f-2d2c96958e72,cdp2w11_j04_s6_w533d53b41-f3ee-4394-8667-0d1622c97647,cdp2w11_j04_s6_w44ad56bcc-10f0-4b82-ac13-69c7327315f8,52,1796
1127,13966.0,25418-M14-2,BRD-K89539872-001-05-0,25418,M14,2,SA1859758,BRD-K89539872,BROAD_CPD_ID,CS(=O)(=O)Nc1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1,OCMRFULKMXYDHL-UHFFFAOYSA-N,cdp2w10_m14_s2_w25c34e148-4ba9-4c1d-b9c6-9d3e688c8f0d,cdp2w10_m14_s2_w387b3dc87-02be-444f-8228-ac478d06b290,cdp2w10_m14_s2_w13c350174-9c68-4efb-8c45-19280e3984ac,cdp2w10_m14_s2_w50aca99e5-977d-4d61-9d87-d789f25deb4d,cdp2w10_m14_s2_w48be0f9cb-71f3-4561-ab96-faba25718241,72,8588
1128,38338.0,25726-C14-2,BRD-K14849833-001-05-1,25726,C14,2,SA1858907,BRD-K14849833,BROAD_CPD_ID,Cc1ccc(cc1Nc1nc(nc(n1)N1CCCC1)N1CCCC1)[N+]([O-])=O,OCWNPSSCQWGLKS-UHFFFAOYSA-N,cdp2w12_c14_s2_w247d14878-0874-4b83-8122-f8b56726935d,cdp2w12_c14_s2_w36a35226d-0868-4b87-91cf-b32b22b936dd,cdp2w12_c14_s2_w1a0be02a4-a722-4cf1-9430-12fef87d8b40,cdp2w12_c14_s2_w5762e6efe-fbe2-46bb-879b-87c153f644a1,cdp2w12_c14_s2_w4bf2e5050-16b9-4d0f-a35d-ac80f696cee8,9,5818
1129,20597.0,25567-K14-3,BRD-K37352137-001-05-2,25567,K14,3,SA1855643,BRD-K37352137,BROAD_CPD_ID,O=C1CCCC2=C1C1(CCCC1)NC(Nc1nc3ccccc3s1)=N2,ODANYRXUIXFPLA-UHFFFAOYSA-N,cdp2w11_k14_s3_w299ed26b2-b342-429a-a9d3-8e7964798356,cdp2w11_k14_s3_w348c496eb-abc3-440c-b100-68d7d535185b,cdp2w11_k14_s3_w1d24c3485-deea-4298-b1f2-0d2977589dda,cdp2w11_k14_s3_w56e90db9d-e4eb-46b7-977b-f38abd7063ab,cdp2w11_k14_s3_w414b06e01-ab27-414b-849f-07d03a80fc10,57,3151
1130,46928.0,26081-G03-6,BRD-K05902089-001-05-0,26081,G03,6,SA1857143,BRD-K05902089,BROAD_CPD_ID,Cc1nnc2ccc(nn12)N1CCCC1,ODRDNKHQIVRNRC-UHFFFAOYSA-N,u00026613_g03_s6_w22b3e85fd-041a-42ac-bcd4-5ecea3d99900,u00026613_g03_s6_w365eb9df8-8782-4612-be86-92102628010b,u00026613_g03_s6_w16137944b-8db5-4384-9b8d-8811375a905e,u00026613_g03_s6_w589ed5e6a-ba7c-4843-90e3-a55c46dcc8fe,u00026613_g03_s6_w46952c99a-07f6-4e58-8cc5-21d434a3a379,62,6644
1131,47999.0,26110-N08-3,BRD-K48406740-001-05-2,26110,N08,3,SA1854523,BRD-K48406740,BROAD_CPD_ID,COC(=O)CSc1nc(cc(c1C#N)C(F)(F)F)C1CC1,OEVFMFILPWISDE-UHFFFAOYSA-N,cdp2w9x2_n08_s3_w2802e2705-4901-4017-aeec-4e98d688ae61,cdp2w9x2_n08_s3_w3610eea5b-8502-40e6-a5ee-385f1d00f212,cdp2w9x2_n08_s3_w140420d8a-5a62-4b23-86d5-d1141b6da1ce,cdp2w9x2_n08_s3_w502fc8446-7edf-46da-9191-72eaf8d3dfd7,cdp2w9x2_n08_s3_w4b1037973-9e66-46e2-812a-d861a7f180b0,80,2151
1132,21387.0,25570-C13-1,BRD-K35103690-001-05-0,25570,C13,1,SA1862233,BRD-K35103690,BROAD_CPD_ID,Clc1ccccc1COc1ccccc1C(=O)NC1=NCCS1,OEVSYCFZIAVZAY-UHFFFAOYSA-N,cdp2w11_c13_s1_w260be4e97-934d-45ed-bc96-3223ebb39eda,cdp2w11_c13_s1_w3b8c38593-ea4e-47a5-b244-f53088c4a93a,cdp2w11_c13_s1_w183512d7c-12f5-48d7-a5a8-955d3ab516ba,cdp2w11_c13_s1_w53c2e37f9-e9be-470c-befd-66e59b4dcb20,cdp2w11_c13_s1_w499232816-e7b1-48fc-8198-b32017ed8704,51,9094
1133,37250.0,25707-N20-6,BRD-K08252773-001-06-6,25707,N20,6,SA1852460,BRD-K08252773,BROAD_CPD_ID,Oc1ccc(cc1)-c1cc(no1)C(=O)N1CCN(CC1)c1ccc(F)cc1,OFFAYDIHAZBGNH-UHFFFAOYSA-N,cdp2w12_n20_s6_w211f09f61-d00a-491a-b39b-33f1ed4d7fe1,cdp2w12_n20_s6_w32e0f225d-707d-4487-ad29-0afbc930f4ab,cdp2w12_n20_s6_w1b5dda402-8cd6-4bcf-a308-c97d7dc2cb5d,cdp2w12_n20_s6_w52b297e75-9ee8-4f01-a0f7-ef831137f7e0,cdp2w12_n20_s6_w4e54aa206-fd63-46ca-bf68-ba9dbbbdfda8,70,6015
1134,38823.0,25738-L10-1,BRD-K15750886-001-05-6,25738,L10,1,SA1853840,BRD-K15750886,BROAD_CPD_ID,CC(C)CCN1NC2(CCC(C)CC2)N=C1S,OFLFECLXRXZURX-UHFFFAOYSA-N,cdp2w12_l10_s1_w2c4a3460e-ab42-4fbe-871c-9f121786ee56,cdp2w12_l10_s1_w3144ed5f2-0a02-43f8-9f97-6abd482f43d9,cdp2w12_l10_s1_w12d9a2eda-7e0a-4a65-8734-3b8337e4be94,cdp2w12_l10_s1_w5c84167ad-d76c-4426-8658-81a349afe5f2,cdp2w12_l10_s1_w4b5c6dd96-7271-42ad-8a55-24ef26262580,78,2737
1135,52727.0,26203-M12-3,BRD-K32625107-001-05-2,26203,M12,3,SA1852656,BRD-K32625107,BROAD_CPD_ID,O=C(CSc1ncnc2c3ccccc3oc12)c1cccs1,OFQHSVSIMICVEF-UHFFFAOYSA-N,cdp2w9x2-au00026617_m12_s3_w288a68698-2c25-4d7f-91cc-ea5828bc31b9,cdp2w9x2-au00026617_m12_s3_w372f573b4-16e6-4df1-9b79-b1ca42b8d00e,cdp2w9x2-au00026617_m12_s3_w15c9710f5-baf0-47da-81ef-bb3a335d8ebd,cdp2w9x2-au00026617_m12_s3_w5c47de7b1-28cd-4085-8e24-31cfed162215,cdp2w9x2-au00026617_m12_s3_w4eb2d16fc-b340-46c2-8349-caef7900a498,178,2733
1136,6982.0,24357-A10-5,BRD-K72703948-001-01-0,24357,A10,5,SA442628,ZM447439,primary-common,COc1cc2c(Nc3ccc(NC(=O)c4ccccc4)cc3)ncnc2cc1OCCCN1CCOCC1,OGNYUTNQZVRGMN-UHFFFAOYSA-N,cdp2bioactives_a10_s5_w2b4f3d878-ffd6-4f5b-9871-268623c8519b,cdp2bioactives_a10_s5_w385ae0f94-63b1-4087-9b86-5d31fb64e5b8,cdp2bioactives_a10_s5_w174cf50e6-92b1-4672-abe6-a16af71c4b19,cdp2bioactives_a10_s5_w5be232cb5-3353-4d7a-aac2-35013d50662c,cdp2bioactives_a10_s5_w4883dbca1-dd7e-4201-8f6c-da93821bbc17,32,977
1137,34791.0,25688-L21-1,BRD-K96024990-001-05-1,25688,L21,1,SA1858610,BRD-K96024990,BROAD_CPD_ID,C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(cc1F)-c1ccc(cc1)N(C)C,OGOYFYBJGOZDCJ-SZOMIKIBSA-N,cdp2w12_l21_s1_w2f28828db-6579-487b-9c2c-9ff4f7cb3534,cdp2w12_l21_s1_w3202bab86-85ac-4a03-9ad6-a7057403fe92,cdp2w12_l21_s1_w14fb0d5b5-1e5e-4230-ae21-45f53002409f,cdp2w12_l21_s1_w58d55d8ce-bf2c-4909-82bb-9ff652cce39d,cdp2w12_l21_s1_w45e144c25-73ac-4866-8eee-ee98f1a38de3,43,4737
1138,48734.0,26118-P19-6,BRD-K30935732-001-06-8,26118,P19,6,SA1852889,BRD-K30935732,BROAD_CPD_ID,Cc1cc(O)n2nc(N)c(N=Nc3ccccc3F)c2n1,OGYDIZMADSHSOF-UHFFFAOYSA-N,cdp2w9x2_p19_s6_w244a5677f-e7e9-45e1-b656-1bbae910e65b,cdp2w9x2_p19_s6_w32fbbb7be-9ce5-402a-8ece-63e19430abf6,cdp2w9x2_p19_s6_w138c4e5de-2731-46fa-bdec-fa218f3172ed,cdp2w9x2_p19_s6_w5cac6a688-d1a6-4413-8e38-870db011936a,cdp2w9x2_p19_s6_w450f8ecc0-86d1-444a-9b72-be206fd90be2,100,7767
1139,52668.0,26203-J17-4,BRD-K68225257-001-05-6,26203,J17,4,SA1858472,BRD-K68225257,BROAD_CPD_ID,Oc1ccc(cc1)N1CCN(CC(=O)NC(=O)NCc2ccco2)CC1,OHCDFZMCCJMYTE-UHFFFAOYSA-N,cdp2w9x2-au00026617_j17_s4_w24c67d5d1-a886-468d-95d5-52fc9b8eedc7,cdp2w9x2-au00026617_j17_s4_w3a9de9513-a8ff-40df-b199-e876d4d36d0e,cdp2w9x2-au00026617_j17_s4_w15ae28d9d-f686-43da-8ff7-ead74ee7b1f9,cdp2w9x2-au00026617_j17_s4_w5fc2c358f-3f43-451e-b7b5-8968b3a253a1,cdp2w9x2-au00026617_j17_s4_w484ee36a3-d795-4a27-84c6-aff5ca0ac117,64,8814
1140,38878.0,25738-N16-2,BRD-K13398517-001-05-3,25738,N16,2,SA1858883,BRD-K13398517,BROAD_CPD_ID,CS(=O)(=O)NCCCc1ccccc1,OHLXNOLHHQPVJR-UHFFFAOYSA-N,cdp2w12_n16_s2_w22c4c181f-8b8c-4324-88a7-05299e6fe8c9,cdp2w12_n16_s2_w36dc0b810-2bed-4c1f-b4d7-70e02e33c5fa,cdp2w12_n16_s2_w1943d2481-9140-42b9-abe1-bdf275c64681,cdp2w12_n16_s2_w5c5192eb0-ef55-472c-bab9-58dee26087fe,cdp2w12_n16_s2_w43512a6ad-cf5a-474f-a327-0f9de9f84315,57,4941
1141,50068.0,26135-B18-2,BRD-K09460582-001-07-3,26135,B18,2,SA1854286,BRD-K09460582,BROAD_CPD_ID,COc1cccc(c1)-c1nc(O)c2c3CCCCCc3sc2n1,OHQNHGDOKOMLFS-UHFFFAOYSA-N,cdp2w9x2_b18_s2_w2f7c87387-33a8-4ee9-b2a7-93f88f9db242,cdp2w9x2_b18_s2_w36a5375cc-a2a9-44d3-97bc-b4ce6bf6cf17,cdp2w9x2_b18_s2_w19d9483aa-d492-4390-814e-04cf965e5be3,cdp2w9x2_b18_s2_w5f128cd13-f54a-4b28-a823-596979025624,cdp2w9x2_b18_s2_w43837c028-fc7c-46d8-bfbd-5d67acd6bb95,35,4256
1142,14269.0,25420-O04-5,BRD-K83349888-001-05-2,25420,O04,5,SA1859749,BRD-K83349888,BROAD_CPD_ID,COc1ccccc1CC(=O)Nc1ccc(cc1)-c1nnc(o1)-c1ccco1,OHSIRHBXHGGCQC-UHFFFAOYSA-N,cdp2w10_o04_s5_w2547aa917-18f3-4bbc-8296-6c73f0473f4c,cdp2w10_o04_s5_w3a67d35c9-f1bb-463d-ae75-dd8f348b718f,cdp2w10_o04_s5_w15ffecca7-c58c-4d40-8265-93a1ca15e426,cdp2w10_o04_s5_w5c567c3dd-dfd9-40d7-83e7-582606d460fe,cdp2w10_o04_s5_w4cfeb9c2c-7ba0-4308-ad82-94ef09207d61,27,1432
1143,54848.0,26247-J09-6,BRD-K90976994-001-02-1,26247,J09,6,SA83101,dehydrocholic acid,INN,C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@H]3[C@H](CC(=O)[C@]12C)[C@@]1(C)CCC(=O)C[C@H]1CC3=O,OHXPGWPVLFPUSM-KLRNGDHRSA-N,cdp2w9x2_j09_s6_w2701e22cd-9f3d-4e74-bd79-fabe213b9d55,cdp2w9x2_j09_s6_w3a82054bd-f918-4482-b94e-4ad8c4878907,cdp2w9x2_j09_s6_w1728daa25-7ab8-41ce-94b8-ba3b028f98ce,cdp2w9x2_j09_s6_w58ec8af44-0714-4edf-8435-60a297cc18a3,cdp2w9x2_j09_s6_w42f888fb2-3aa8-45ff-981c-f6e5cfd2ff9d,28,1222
1144,35048.0,25689-J06-6,BRD-K52179506-001-06-0,25689,J06,6,SA1858743,BRD-K52179506,BROAD_CPD_ID,[O-][N+](=O)c1ncccc1OCC(=O)Nc1ccc2CCCc2c1,OHYBJDLWXZKHJW-UHFFFAOYSA-N,cdp2w12_j06_s6_w22eebde4a-8c67-404d-a6c9-75913441f842,cdp2w12_j06_s6_w38e88a05a-2116-46eb-946a-e139bf4bc936,cdp2w12_j06_s6_w12e7318e4-3cd4-47a7-84ec-df228415e2fa,cdp2w12_j06_s6_w5a16605ce-51d9-478d-b9f6-94cc332c06ca,cdp2w12_j06_s6_w471d8f8f5-ac95-4177-bf8b-e80d401a74de,54,2704
1145,26969.0,25593-G21-3,BRD-K85656316-001-05-0,25593,G21,3,SA1856152,BRD-K85656316,BROAD_CPD_ID,Fc1ccc(cc1)-c1cc2nc(cc(N3CCOCC3)n2n1)-c1ccccc1,OIHQWUKPJWZTQS-UHFFFAOYSA-N,cdp2w11_g21_s3_w2f2399992-6ef5-48cc-a817-4bae4470ac7d,cdp2w11_g21_s3_w311832b97-47c7-406d-bf63-f64feae18e4a,cdp2w11_g21_s3_w17a5a6423-48c4-4a15-8a14-b767f3e1bdf2,cdp2w11_g21_s3_w5263a1311-ab52-42eb-91ec-863a96bd903f,cdp2w11_g21_s3_w4f7369876-85ba-464f-89dc-5950eca8eac8,88,8709
1146,23303.0,25578-D20-3,BRD-A05350058-001-04-4,25578,D20,3,SA1859847,BRD-A05350058,BROAD_CPD_ID,CCOC(=O)c1ccc(NC(=O)C2CCCN(C2)S(=O)(=O)c2c[nH]cn2)cc1,OILMKIYBXZGMQM-UHFFFAOYSA-N,cdp2w11_d20_s3_w2843990b1-816c-4d89-8066-b4d44aa9f53f,cdp2w11_d20_s3_w3a0ca324b-1b98-4774-ae1f-8f241ec0c605,cdp2w11_d20_s3_w18c8aaf9d-00d2-4467-982a-a54d7f7c7066,cdp2w11_d20_s3_w5dde02526-511b-4193-a6d1-4b813a67bcd8,cdp2w11_d20_s3_w42886484d-2800-469d-a39e-2a07813b528f,77,8656
1147,28673.0,25638-K13-3,BRD-A88237615-001-14-8,25638,K13,3,SA1857901,vidarabine,primary-common,Nc1ncnc2n(cnc12)C1OC(CO)C(O)C1O,OIRDTQYFTABQOQ-UHFFFAOYSA-N,cdp2w12_k13_s3_w298bd3d5b-3a99-45cb-9498-331862a2f8fe,cdp2w12_k13_s3_w37554a21f-58a4-4551-8605-bea216cd0fd9,cdp2w12_k13_s3_w1ede9be6c-0d73-44bf-b8bc-cd8fae970b33,cdp2w12_k13_s3_w544a40e2b-d1ad-4c7a-9510-ff759678bbfd,cdp2w12_k13_s3_w4808a55ef-d756-4799-a3c1-a8daff9a3ba3,84,161
1148,1479.0,24294-P04-4,BRD-A42628519-001-04-1,24294,P04,4,SA82865,iopanoic acid,INN,CCC(Cc1c(I)cc(I)c(N)c1I)C(O)=O,OIRFJRBSRORBCM-UHFFFAOYSA-N,cdp2bioactives_p04_s4_w2f1a529ce-47dc-4fa4-a867-48ff7bcb6ae5,cdp2bioactives_p04_s4_w33a7e7c97-6aad-468b-83eb-43386ee593a8,cdp2bioactives_p04_s4_w1b78ee204-012e-4018-9b7b-be1e7eec1ca0,cdp2bioactives_p04_s4_w52c3fdd5b-ef53-476d-8af7-9c745213c890,cdp2bioactives_p04_s4_w41156dbdf-59ca-48b2-aaeb-3e75d9b6938f,122,511
1149,55660.0,26662-G18-2,BRD-K92795064-001-01-0,26662,G18,2,SA1459243,BRD-K92795064,BROAD_CPD_ID,O[C@@H]1COC[C@H]2O[C@@H](CC(=O)Nc3ccc(cc3)-c3ccccc3)CC[C@@H]2N(Cc2ccc3OCOc3c2)C1,OJBHRHOQEWVARJ-DEJVGURISA-N,cdp2w13_g18_s2_w21571be07-8c25-4443-bdda-f2bc617147eb,cdp2w13_g18_s2_w36dc095d5-5f06-4dc4-a14f-77a9a207c1d2,cdp2w13_g18_s2_w19cccc155-fe6c-41c2-9fe2-106a50ab04d3,cdp2w13_g18_s2_w50607120c-5f4a-4447-8587-d3efd97ebb3c,cdp2w13_g18_s2_w473bba338-9908-44df-b824-62c807d6d976,72,10141
1150,31348.0,25674-C06-2,BRD-K86168888-001-05-3,25674,C06,2,SA1858665,BRD-K86168888,BROAD_CPD_ID,CCCC[C@@H]1CN=C(N)N1CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F,OJDAJFVUJSNUHG-CQSZACIVSA-N,cdp2w12_c06_s2_w272c673b4-a2a9-46c6-bcca-15f87d0a9895,cdp2w12_c06_s2_w334a5f52b-af7c-42a0-bfae-c7c6dfd7ce87,cdp2w12_c06_s2_w180463ea8-81b9-4503-8866-6bc1dc8a1d0f,cdp2w12_c06_s2_w562e58143-9366-4650-b359-12f084de36b6,cdp2w12_c06_s2_w45cedccc6-199a-4b62-8421-922ed40de37d,61,1617
1152,30494.0,25664-G14-6,BRD-K00168920-001-06-4,25664,G14,6,SA1854151,BRD-K00168920,BROAD_CPD_ID,OC(=O)CCN1C(=S)SC(C1=O)=C1CCCCCC1,OJSYQBBXPIPBGL-UHFFFAOYSA-N,cdp2w12_g14_s6_w27826b0fd-6353-41fb-84b7-c9dfa11f2b15,cdp2w12_g14_s6_w3807ff20a-c4ea-4bb1-825e-b2e018dff188,cdp2w12_g14_s6_w11f65e0bb-174b-4319-9603-403a5a90668d,cdp2w12_g14_s6_w53ea37f56-f24e-4391-92d8-7a4eaaa6c194,cdp2w12_g14_s6_w4493db18b-b81b-46df-b5ef-a4d8415a2a8d,85,2407
1153,22104.0,25572-H06-4,BRD-K36559317-001-05-5,25572,H06,4,SA1862202,BRD-K36559317,BROAD_CPD_ID,COc1ccc(OC)c(c1)-c1nnc(o1)-c1ccc(C)o1,OKEQHMGHHFSGJW-UHFFFAOYSA-N,cdp2w11_h06_s4_w2bc9e539d-9a38-4521-a7e8-c8a3ff1934e8,cdp2w11_h06_s4_w349a13baa-1313-4304-8d2b-c041fb831edf,cdp2w11_h06_s4_w15be643e7-9268-469a-8005-e9d587221a68,cdp2w11_h06_s4_w5229a5163-9591-4cd0-aabd-47dfd1caf4e2,cdp2w11_h06_s4_w4f05a9038-5561-43da-aaf4-484f3e1bf68d,86,3903
1154,49354.0,26126-L17-2,BRD-K06172453-001-05-7,26126,L17,2,SA1854396,BRD-K06172453,BROAD_CPD_ID,CCCCNc1nc2ccccc2[nH]1,OKKUCNXCFWODOE-UHFFFAOYSA-N,cdp2w9x2_l17_s2_w2093d43ad-a101-4f5b-a03a-d993687844e9,cdp2w9x2_l17_s2_w3aea0c52e-6cbc-406e-a1f7-5328dcd5126e,cdp2w9x2_l17_s2_w1760c419d-d5a2-4a71-8f9d-77560c361bbc,cdp2w9x2_l17_s2_w510e7a4a1-b05d-40b2-af46-54ece8e6a1e3,cdp2w9x2_l17_s2_w4f3e89e0c-c36e-4078-99b8-89c1422036e8,76,3441
1155,11509.0,25391-H17-5,BRD-K31189414-001-04-1,25391,H17,5,SA1859582,BRD-K31189414,BROAD_CPD_ID,COc1ccc(cc1OC)-c1c(C)oc2cc(O)cc(O)c2c1=O,OKMZAQXBYWZWCL-UHFFFAOYSA-N,cdp2w10_h17_s5_w20ccb0dce-4b41-4ac7-9ccb-153ed3b2c2f2,cdp2w10_h17_s5_w304273dbd-edb1-4359-b4a6-299a4441f3ef,cdp2w10_h17_s5_w12602c6e1-d419-4a20-a17f-2b5e80333ac5,cdp2w10_h17_s5_w5a5502508-1af1-4938-8a68-ea9b612a9235,cdp2w10_h17_s5_w4dd7372ca-25ab-42b3-87fa-f2745db3b9ee,84,7913
1156,49523.0,26128-F09-3,BRD-A25869984-001-05-5,26128,F09,3,SA1852571,BRD-A25869984,BROAD_CPD_ID,Oc1ccc(cc1C1=NNC(C1)c1ccccc1F)[N+]([O-])=O,OKWVXVZNZAVFBE-UHFFFAOYSA-N,cdp2w9x2_f09_s3_w2617eed4b-82b1-46ab-8a13-3c6478554bde,cdp2w9x2_f09_s3_w34d983a54-fce2-47d5-9089-ba21356c1dde,cdp2w9x2_f09_s3_w1aa195464-5279-43b4-afc0-6e33f925c737,cdp2w9x2_f09_s3_w5d2296cc1-9e25-4dd4-ba0b-f18449bf7893,cdp2w9x2_f09_s3_w431cc2a3d-554d-4d52-a379-4ecf2618c350,62,7663
1157,28943.0,25639-J12-3,BRD-K54686062-001-06-8,25639,J12,3,SA1853223,BRD-K54686062,BROAD_CPD_ID,COCCN(C(=O)\C=C\c1ccccc1)c1nnc(s1)-c1cccnc1,OKXJPDSIZNCWMY-MDZDMXLPSA-N,cdp2w12_j12_s3_w23b1cfaf7-7f4d-4fe5-8ca9-0e9459f556a6,cdp2w12_j12_s3_w3d9ad1bfb-32aa-4cbc-b202-2a8c34e3fe4a,cdp2w12_j12_s3_w1b9981fe3-e675-49eb-b7a3-8d1eae4a67d3,cdp2w12_j12_s3_w51a6312c1-6468-4c21-bbac-5a6e8523351b,cdp2w12_j12_s3_w448f3ff76-fb5f-4d60-979c-24d0941c96cc,58,1825
1158,6740.0,24352-G02-3,BRD-K07117950-001-02-6,24352,G02,3,SA36475,imperatorin,primary-common,CC(C)=CCOc1c2occc2cc2ccc(=O)oc12,OLOOJGVNMBJLLR-UHFFFAOYSA-N,cdp2bioactives_g02_s3_w23861aa60-4d4f-46f3-bfea-a400ddbfbfdc,cdp2bioactives_g02_s3_w3c5e8be08-511d-4a44-856b-bdd889062478,cdp2bioactives_g02_s3_w1580ac69b-6777-4ca7-a712-7e3cc284e7e3,cdp2bioactives_g02_s3_w5197a18af-0b9e-490d-9273-b743f944e6ea,cdp2bioactives_g02_s3_w4ab5df219-2d38-4dcb-a629-9324e369764e,62,1154
1159,50641.0,26138-L16-5,BRD-K39029546-001-05-9,26138,L16,5,SA1858662,BRD-K39029546,BROAD_CPD_ID,CCSc1oc(nc1S(=O)(=O)c1ccccc1)-c1ccccc1,OLQJVXFSFSZYOU-UHFFFAOYSA-N,cdp2w9x2_l16_s5_w2bf4e5bcc-e28f-4864-adde-931f0784f986,cdp2w9x2_l16_s5_w32d8e70cb-b1c6-4dd7-b2c4-14e6591a0750,cdp2w9x2_l16_s5_w103cabf0b-9bd4-4db6-9934-834ac871ae0f,cdp2w9x2_l16_s5_w5b01181db-cce1-4535-ba8c-b3cd61c816af,cdp2w9x2_l16_s5_w4e620d521-6484-4faa-966c-f778e1d1f489,75,8595
1160,26527.0,25591-O07-5,BRD-K27945373-001-05-8,25591,O07,5,SA1855278,BRD-K27945373,BROAD_CPD_ID,COc1ccc2C(=O)\C(CCc2c1)=C/c1ccncc1,OMJQCRYAFOMMKI-UVTDQMKNSA-N,cdp2w11_o07_s5_w27f4a69aa-e3d8-47db-8c98-af8889780a6f,cdp2w11_o07_s5_w335bab2a3-dd52-4277-b08a-7124afcc79cc,cdp2w11_o07_s5_w145d475ac-d876-41b4-ae7c-7e74d65c7305,cdp2w11_o07_s5_w5441c1f70-0d65-484e-b8b6-4bbcc0727799,cdp2w11_o07_s5_w445397829-9c83-4c71-b95c-7a27551ab651,54,6888
1161,605.0,24278-O18-6,BRD-K97118047-001-01-2,24278,O18,6,SA63281,"4,5,6,7-tetrabromobenzotriazole",primary-common,Brc1c(Br)c(Br)c2[nH]nnc2c1Br,OMZYUVOATZSGJY-UHFFFAOYSA-N,cdp2bioactives_o18_s6_w2cb95dfe9-6d52-4c27-af77-6b38c35e64a3,cdp2bioactives_o18_s6_w3a863b7c9-e0f5-4ab1-8709-06d878d81171,cdp2bioactives_o18_s6_w196e7a46f-14dd-4fa9-ba86-b56b78da5f98,cdp2bioactives_o18_s6_w5cd60755d-44fc-441a-b680-996dbdc4a1eb,cdp2bioactives_o18_s6_w43d4cab66-bcf1-44d8-8238-4a1cdf6abb52,104,932
1162,19470.0,25564-B05-4,BRD-K00888242-001-05-0,25564,B05,4,SA1852139,BRD-K00888242,BROAD_CPD_ID,[O-][N+](=O)c1cc(ccc1Br)C(=O)Oc1ccccc1C(=O)Nc1ccccc1,ONLMRIYNWGCRLQ-UHFFFAOYSA-N,cdp2w11_b05_s4_w2193869fc-0d79-4929-a4fd-f04b07c039f3,cdp2w11_b05_s4_w3f77612cd-53a5-47e3-93c8-7d7a47ad8982,cdp2w11_b05_s4_w1bad467ff-24ea-4ef4-bed6-41e50bb7d898,cdp2w11_b05_s4_w5250ebd5d-8b2e-4b8a-8c10-634e18cd4609,cdp2w11_b05_s4_w47ec85928-81b9-4d0d-a0fb-f29a62705dee,65,6885
1163,24006.0,25580-H16-4,BRD-A30630604-001-06-2,25580,H16,4,SA1855320,BRD-A30630604,BROAD_CPD_ID,CC(C)=C1C2CCC1C1C2C(=O)N(C1=O)c1nc(c(C)s1)-c1ccccc1,ONPLRFHNPZGXQL-UHFFFAOYSA-N,cdp2w11_h16_s4_w2e05312f2-ec79-4d3c-a755-3855cbbb987b,cdp2w11_h16_s4_w399a9ba6d-7609-49e2-9d70-a79aaa884f27,cdp2w11_h16_s4_w1f37a3ec5-f403-4968-8986-040fe55394c8,cdp2w11_h16_s4_w5c53cec83-e26c-4362-8304-c5017803ccfc,cdp2w11_h16_s4_w4e5003311-1e44-4fc6-b66a-743bfb5a1bce,67,9308
1164,53594.0,26207-K22-6,BRD-A83474016-001-05-5,26207,K22,6,SA1853246,BRD-A83474016,BROAD_CPD_ID,CC(CC(=O)c1ccccc1)C(=C)C(=O)c1ccccc1,OOADQCRZDPSFER-UHFFFAOYSA-N,cdp2w9x2-au00026617_k22_s6_w207bda3f6-bb8b-4ed0-b463-161d55c4a771,cdp2w9x2-au00026617_k22_s6_w34d7be63f-ca17-46fd-bf8d-9e0f87555071,cdp2w9x2-au00026617_k22_s6_w1055d2ac2-8660-4ec8-933c-518fdb658f05,cdp2w9x2-au00026617_k22_s6_w5ca6a62a8-feb0-428f-9892-dcc50c0d79cf,cdp2w9x2-au00026617_k22_s6_w47bcb7870-3850-42dc-b6c4-4184165d8f1a,49,6680
1165,28911.0,25639-I04-1,BRD-K36084688-001-05-5,25639,I04,1,SA1852767,BRD-K36084688,BROAD_CPD_ID,CCOC(=O)N1CCN(CC1)C(=O)c1cc2c(nc3ccccn3c2=O)s1,OODXHJLIJWNJIH-UHFFFAOYSA-N,cdp2w12_i04_s1_w2a05397f0-5eaa-4d88-b361-f9ddfed3d656,cdp2w12_i04_s1_w316904871-4541-4054-9fe7-822b3ef652b6,cdp2w12_i04_s1_w19f4e4511-f3c9-41ce-8bed-6d118b1f0b5a,cdp2w12_i04_s1_w523240988-445b-4e93-9c40-be98929d4c2c,cdp2w12_i04_s1_w4451beab3-2c7d-4ec0-b690-987bb899c4bd,83,6346
1166,27146.0,25593-P17-6,BRD-K71592817-001-06-5,25593,P17,6,SA1861283,BRD-K71592817,BROAD_CPD_ID,Brc1ccc2nc3c(cccn3c(=O)c2c1)C(=O)N1CCC2(CC1)OCCO2,OOJANGFXTFGKRR-UHFFFAOYSA-N,cdp2w11_p17_s6_w2dfa04664-131f-4266-9fce-c829ea3d6c13,cdp2w11_p17_s6_w38bffabcb-558f-4770-a0ac-dc1360854a86,cdp2w11_p17_s6_w12b84f256-a9ae-46d4-af37-e12c1e703ce6,cdp2w11_p17_s6_w5519bf33d-b75c-4711-bd36-52346f1d018c,cdp2w11_p17_s6_w465e84715-b6e4-4f45-b12e-d07cfaa25a1e,71,8917
1167,16011.0,25432-L21-1,BRD-K99205029-001-05-8,25432,L21,1,SA1856024,BRD-K99205029,BROAD_CPD_ID,CCCCN1C(=S)S\C(C1=O)=C1/C=CC=CN1C,OOMBSJIHVPLNSK-ZHACJKMWSA-N,cdp2w10_l21_s1_w295aafe60-1c12-47f0-900d-b60d91a5f1f7,cdp2w10_l21_s1_w38186b942-8e30-477d-80f1-1e79b8703a3f,cdp2w10_l21_s1_w19bea7868-bf54-432f-a52b-e25735a90ef5,cdp2w10_l21_s1_w509dcc9f8-9fa2-4b33-bf9d-2a06ab9c218a,cdp2w10_l21_s1_w4ffea3263-ec60-4359-a465-16499e03cdf9,28,8811
1168,9194.0,24735-N20-6,BRD-K70274124-001-02-8,24735,N20,6,SA667015,BRD-K70274124,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O,OOPGLCWBUZVAMU-CBGDNZLLSA-N,cdp2w5_n20_s6_w2cbcd2b58-185b-4e5a-8d1a-f31141dcbaa2,cdp2w5_n20_s6_w395cb4513-4c69-4911-9b66-714b5c6d9cce,cdp2w5_n20_s6_w1ed924c6f-f20d-42ef-bebf-14f277f9ac49,cdp2w5_n20_s6_w565b7f764-e5e0-4f6e-bae4-29cb1ba525fb,cdp2w5_n20_s6_w4332a4c9c-9042-4e3d-bd70-de7ee6c56190,118,9806
1169,9318.0,24740-H24-4,BRD-K28746174-001-02-7,24740,H24,4,SA667041,BRD-K28746174,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(F)cc2)OCc2cnnn2CCCC1=O,OOPGLCWBUZVAMU-WWMYMODYSA-N,cdp2w5_h24_s4_w28df818b6-70b0-4531-8bf0-70b1e27c5d0c,cdp2w5_h24_s4_w315cd1ad9-9a76-4662-a833-3dd696f55704,cdp2w5_h24_s4_w1160a0709-b8d3-48d4-a173-f3cbe3c719ac,cdp2w5_h24_s4_w59def41dd-d295-454c-9802-6fc7b3247a8c,cdp2w5_h24_s4_w4b2a3b384-0149-450d-967a-7432fab72470,86,9917
1170,16733.0,25435-O21-3,BRD-A03549855-001-05-5,25435,O21,3,SA1855669,BRD-A03549855,BROAD_CPD_ID,CC1CCc2cc(F)ccc2N1C(=O)c1cc2nc(cc(n2n1)C(F)(F)F)-c1ccco1,OOQHCHRXDFMUNN-UHFFFAOYSA-N,cdp2w10_o21_s3_w29b1abf83-4ffe-4bc3-b364-3840e6aeca9c,cdp2w10_o21_s3_w3cfa4a4e7-77e9-407a-986f-6f7a3a0fb8f2,cdp2w10_o21_s3_w15336bf66-6696-4d27-8770-b3bde09addca,cdp2w10_o21_s3_w5f0debe88-50a9-4ad1-8de6-06d04e5fd32a,cdp2w10_o21_s3_w462aa71c6-b008-4fee-8370-398ee84e2f9f,66,7337
1171,19780.0,25565-C11-2,BRD-K50153919-001-07-6,25565,C11,2,SA1861579,BRD-K50153919,BROAD_CPD_ID,Fc1cccc(F)c1C(=O)Nc1nnc(o1)-c1ccc2CCCCc2c1,OOSXJRTZMCAXPR-UHFFFAOYSA-N,cdp2w11_c11_s2_w255302fc7-2fc0-44bf-b864-c814475484f6,cdp2w11_c11_s2_w3a988c1e6-0df3-4c94-aafc-9fccad9f25e4,cdp2w11_c11_s2_w197f50959-e245-46df-8bcb-32d9261c6e4d,cdp2w11_c11_s2_w5e60d75b2-4f66-4d65-b1e5-83bc81b503fd,cdp2w11_c11_s2_w4432d5aa6-91e0-42eb-850f-41e480390bbd,77,8563
1172,37370.0,25708-E10-6,BRD-A84517860-001-06-5,25708,E10,6,SA1860436,BRD-A84517860,BROAD_CPD_ID,Fc1ccc(cc1)C(=O)NC(=S)N1CCCCC1c1cccnc1,OPBIMMOKSSEPPP-UHFFFAOYSA-N,cdp2w12_e10_s6_w2431a44a5-6f91-477c-b4ff-d9f6d7a17f84,cdp2w12_e10_s6_w364fa4406-f669-4c64-bb25-84957c4c5e15,cdp2w12_e10_s6_w1a21f3e6b-7063-4987-87e4-a57a852e362f,cdp2w12_e10_s6_w595476ddc-0703-4be4-912f-100ac7d5fc68,cdp2w12_e10_s6_w4391439cd-c638-4708-be82-cb1f335e8c5c,40,7516
1173,20036.0,25565-O05-6,BRD-K57795363-001-05-2,25565,O05,6,SA1853833,BRD-K57795363,BROAD_CPD_ID,Cc1ccc2oc(nc2c1)-c1cccc(NC(=O)Cc2cccs2)c1,OPMWDIBAAWLKQY-UHFFFAOYSA-N,cdp2w11_o05_s6_w29f14bf96-d350-4aba-9017-f8689ce9353a,cdp2w11_o05_s6_w3e87e7894-06da-4071-b37e-80a725d1db87,cdp2w11_o05_s6_w1b11cfd16-8a08-4de4-880e-351759341545,cdp2w11_o05_s6_w509420659-76b3-4127-a863-0da0fc8fa3f1,cdp2w11_o05_s6_w4b1d7507b-dca9-4b7b-b08f-abb200e10493,54,3290
1174,50484.0,26138-F13-4,BRD-K60772078-001-07-8,26138,F13,4,SA1860478,BRD-K60772078,BROAD_CPD_ID,CCN(CC)CCNc1c2CCCCc2c(C#N)c2nc3ccccc3n12,OPPRXNURMZWNBU-UHFFFAOYSA-N,cdp2w9x2_f13_s4_w2d0ba29fa-3939-46cd-9e08-c06d6fcc9191,cdp2w9x2_f13_s4_w38e58d1b9-4475-4b88-a60b-6ff56c6c88b1,cdp2w9x2_f13_s4_w13382c769-7c27-4466-a30d-54faf99dcfa2,cdp2w9x2_f13_s4_w5f712cb61-a9a4-4902-86b3-a471c4c5fc32,cdp2w9x2_f13_s4_w43f4a67a1-8e4b-48ae-88db-6405c4e0024f,27,7592
1175,4516.0,24309-E24-5,BRD-K26383086-001-02-8,24309,E24,5,SA59109,euparin,primary-common,CC(=C)c1cc2cc(C(C)=O)c(O)cc2o1,OPUFDNZTKHPZHM-UHFFFAOYSA-N,cdp2bioactives_e24_s5_w227da7037-3c0e-4833-96e2-7193d69aea5a,cdp2bioactives_e24_s5_w3ad548997-4cfd-4bbb-8395-54e09883ccce,cdp2bioactives_e24_s5_w104c9b561-54c9-4d99-a989-c10b787f78bc,cdp2bioactives_e24_s5_w5264bc932-9c37-47d8-9829-692ab67d9b21,cdp2bioactives_e24_s5_w4ef998aa6-92a9-4609-a87f-2c126aa61c81,55,1155
1176,37508.0,25708-J04-6,BRD-K28743880-001-06-0,25708,J04,6,SA1862098,BRD-K28743880,BROAD_CPD_ID,Cc1ccc2cccc(NC(=O)C(F)(F)F)c2n1,OQPXWXNHOKPRTE-UHFFFAOYSA-N,cdp2w12_j04_s6_w2b7d34817-f809-4255-99e6-a8e922b993cc,cdp2w12_j04_s6_w328e2d34d-9ead-47dd-bc37-ff61d3899f19,cdp2w12_j04_s6_w196623a52-3258-470c-8eba-086a57aef8a3,cdp2w12_j04_s6_w59bf25c42-1d18-46f2-88f9-5742c5a5c433,cdp2w12_j04_s6_w430c95544-cf61-45bb-8924-e15e70977c6c,55,3752
1177,41840.0,25966-N03-6,BRD-K14807180-001-01-7,25966,N03,6,SA792455,SB-221284,to-be-curated,CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F,OQZOXHCRSXYSPM-UHFFFAOYSA-N,cdp2w8x2_n03_s6_w2be8636a7-ca18-4421-be8c-a9ecedf29f5b,cdp2w8x2_n03_s6_w3ac144309-9ee0-4d35-8cca-3c8b93a77feb,cdp2w8x2_n03_s6_w1791a151b-5bbf-4372-a107-075588851b1c,cdp2w8x2_n03_s6_w5f07a77cb-bb3f-43f2-bc19-1aa8e774e66e,cdp2w8x2_n03_s6_w4a46af26e-89ed-4b8d-83f4-ea40ed16376d,26,200
1178,32584.0,25678-G06-2,BRD-A64476468-001-06-4,25678,G06,2,SA1854235,BRD-A64476468,BROAD_CPD_ID,C\C(=C/c1ccco1)C1c2c(OC(N)=C1C#N)[nH]nc2-c1ccccc1,ORRIBHZQKOAYQB-ZRDIBKRKSA-N,cdp2w12_g06_s2_w2ef540be6-d367-488c-8206-3f1b3c9eaacb,cdp2w12_g06_s2_w3b3a5a2e3-ba9d-47e7-9b52-48d9fd33107d,cdp2w12_g06_s2_w1b6d6cea9-b835-47b4-aba7-74369431c039,cdp2w12_g06_s2_w5e1581436-14ae-4c56-b797-d2b75ca78c47,cdp2w12_g06_s2_w4be407934-b8b0-4812-9b2e-60cf399cf691,51,4611
1179,47846.0,26110-G15-6,BRD-K06148713-001-05-3,26110,G15,6,SA1860428,BRD-K06148713,BROAD_CPD_ID,O=C(NC1CCCCC1)N1CCc2ccccc12,OSIPNWACISSEHG-UHFFFAOYSA-N,cdp2w9x2_g15_s6_w25046f054-07f5-4778-9637-43d3846f0a91,cdp2w9x2_g15_s6_w3e5cfff1a-bcf9-4f91-8e75-037a1d61230c,cdp2w9x2_g15_s6_w101c1f53c-5444-44c5-b40c-86426b3329cf,cdp2w9x2_g15_s6_w576b252cd-fd9f-421e-bc43-35caa771ccf7,cdp2w9x2_g15_s6_w4eed8bee7-f9e7-4a24-95b1-6409b91498d2,41,8119
1180,4946.0,24310-M01-3,BRD-K55344148-003-01-8,24310,M01,3,SA792112,BU 224,to-be-curated,C1CN=C(N1)c1ccc2ccccc2n1,OSUVWJGCKQEMHK-UHFFFAOYSA-N,cdp2bioactives_m01_s3_w29132619e-a736-4e9a-8137-4b06d3232c6c,cdp2bioactives_m01_s3_w3eb9f606e-f300-44a9-b13f-2958202d486d,cdp2bioactives_m01_s3_w15e7fbed4-712b-4d37-aa7b-a8b8f811f75d,cdp2bioactives_m01_s3_w5d05dd557-6c5b-4e6a-a57d-16581387f611,cdp2bioactives_m01_s3_w48bf9f608-e089-4d25-85a4-315b70b381d8,86,191
1181,49846.0,26133-G14-2,BRD-K97935314-001-05-6,26133,G14,2,SA1859046,BRD-K97935314,BROAD_CPD_ID,CCCCCCCCc1n[nH]c(S)n1,OTAAOINHVFMIDG-UHFFFAOYSA-N,cdp2w9x2_g14_s2_w26a33b004-39f9-46cb-bc3e-fe05bf7287a0,cdp2w9x2_g14_s2_w3a75cae40-d012-4b17-9bf7-da1b7e9edd60,cdp2w9x2_g14_s2_w1fc95e465-a71c-4075-84c4-4fc8e87a8d24,cdp2w9x2_g14_s2_w595777d94-02a1-42df-a108-e2a34b17099a,cdp2w9x2_g14_s2_w448200350-016c-44c5-b494-30e8820c9a43,61,5589
1182,52761.0,26203-O04-1,BRD-K21972179-001-05-4,26203,O04,1,SA1862201,BRD-K21972179,BROAD_CPD_ID,CC(=O)c1sc(NC(=O)c2ccccc2C)nc1C,OTEXMVRSMNKYFS-UHFFFAOYSA-N,cdp2w9x2-au00026617_o04_s1_w2fa302143-758e-47bf-9cb5-633cef812c47,cdp2w9x2-au00026617_o04_s1_w3fb33a1ba-d5ac-45c6-a698-a24d0ae8903f,cdp2w9x2-au00026617_o04_s1_w179726c91-650f-45b8-b7e3-fecc1bea5273,cdp2w9x2-au00026617_o04_s1_w50882294e-85d1-457c-a27f-09ce759355d2,cdp2w9x2-au00026617_o04_s1_w4b92cc4bf-3b45-4c2a-b849-a651b7b87951,102,8358
1183,49863.0,26133-H08-1,BRD-K38248167-001-06-2,26133,H08,1,SA1856904,BRD-K38248167,BROAD_CPD_ID,Fc1ccccc1N=C(S)Nc1ccc(Br)cc1,OTFSLGRMDQRXQJ-UHFFFAOYSA-N,cdp2w9x2_h08_s1_w2a4594496-de1f-4e1f-ac0e-a68f8d5cdd83,cdp2w9x2_h08_s1_w35838e996-6d9f-49b0-8c0e-837a14e55f91,cdp2w9x2_h08_s1_w110e257a7-9feb-4e8e-ab29-9b67dcbe826a,cdp2w9x2_h08_s1_w5aa581731-e64d-4f95-86b2-9a1320343863,cdp2w9x2_h08_s1_w40a5eafd0-c79b-49d6-b3b7-ba9352e1efa3,62,3260
1184,32185.0,25677-C13-5,BRD-K10228739-001-06-5,25677,C13,5,SA1856704,BRD-K10228739,BROAD_CPD_ID,Oc1ccc(cc1)C(=C)c1ccc(O)cc1,OTJFTLRXGXUHEJ-UHFFFAOYSA-N,cdp2w12_c13_s5_w2e415df9f-24d5-41aa-b10a-2b794df1225b,cdp2w12_c13_s5_w316752056-7e63-4b88-820a-60b6d916ce76,cdp2w12_c13_s5_w18e286b17-ce02-40c2-bbfc-2a521be36bd4,cdp2w12_c13_s5_w53ea42d2d-a15a-45bf-91c7-8f06df6c9f20,cdp2w12_c13_s5_w467a08829-812e-4a71-aacd-63fac8db3056,63,5549
1185,19589.0,25564-I04-3,BRD-K16064228-001-05-8,25564,I04,3,SA1855819,BRD-K16064228,BROAD_CPD_ID,OC(=O)C1CCN(CC1)C(=O)Cc1ccccc1,OTVPLNPLEZXHGE-UHFFFAOYSA-N,cdp2w11_i04_s3_w2380c49ec-d180-4cae-afe4-89376db64ac2,cdp2w11_i04_s3_w39f040c49-9efa-4f73-8331-130dddcf7a70,cdp2w11_i04_s3_w125eb8336-80e8-45fb-859f-a536b6cf2c20,cdp2w11_i04_s3_w5113aeeb4-03e3-4d87-8220-74b7be447f93,cdp2w11_i04_s3_w433a2f41d-5ff9-464d-90b6-944b51d8540c,90,4360
1186,31382.0,25674-D05-6,BRD-K33742819-001-05-3,25674,D05,6,SA1857342,BRD-K33742819,BROAD_CPD_ID,CCc1nc2oc3ccccc3c(=O)c2c(=O)n1Cc1ccc(OC)cc1,OUDFIOVNIWPUCQ-UHFFFAOYSA-N,cdp2w12_d05_s6_w2e01f95e9-1d0a-4a66-a218-b2a6549865ea,cdp2w12_d05_s6_w37e01598c-5ceb-43f5-9506-d38881fb51ed,cdp2w12_d05_s6_w1d835469f-39fb-456f-b67f-94b9eb7f2224,cdp2w12_d05_s6_w541c49c13-af61-4993-86d5-9c3fbc1776d9,cdp2w12_d05_s6_w45784b9c9-c9df-43d0-ace2-59ebaa75b19d,57,4676
1187,1891.0,24296-J15-2,BRD-K32164935-001-06-8,24296,J15,2,SA82114,tolazamide,INN,Cc1ccc(cc1)S(=O)(=O)NC(=O)NN1CCCCCC1,OUDSBRTVNLOZBN-UHFFFAOYSA-N,cdp2bioactives_j15_s2_w29904f1b3-44ad-4652-b66c-f0692defab28,cdp2bioactives_j15_s2_w3d8f30da4-61bd-4c46-87ae-128d1d7404c8,cdp2bioactives_j15_s2_w180bc1452-2a61-473e-b439-c0d90bfd6051,cdp2bioactives_j15_s2_w5905bd5a3-9225-425d-b1f9-416f4aad6331,cdp2bioactives_j15_s2_w479f7db9c-0e1b-495b-ae36-3697e2e58710,130,450
1188,51718.0,26174-B04-2,BRD-K41049580-001-05-0,26174,B04,2,SA1859171,BRD-K41049580,BROAD_CPD_ID,[O-][N+](=O)c1ccccc1OCC(=O)NNC(=O)Nc1cccc2ccccc12,OUPAOZBBESVOIZ-UHFFFAOYSA-N,cdp2w9x2-au00026617_b04_s2_w2cf102ae2-c7d9-4d70-9928-4af0ea90c3b8,cdp2w9x2-au00026617_b04_s2_w3808cf6aa-ff5d-4741-9d7f-c4aea08620c0,cdp2w9x2-au00026617_b04_s2_w1f1bc0b8c-fa37-4aec-abc5-b71769851c3c,cdp2w9x2-au00026617_b04_s2_w51183651e-ec53-4107-b7a4-a0960f8e0030,cdp2w9x2-au00026617_b04_s2_w4c7dcdfdf-eefa-4ade-8b61-fe96e461caa5,80,8920
1189,18777.0,25503-A11-1,BRD-K03223543-001-07-9,25503,A11,1,SA1862067,BRD-K03223543,BROAD_CPD_ID,CCCCCCCNC(=O)COc1ccc2OC(C)(C)CC(=O)c2c1,OUUJBRWYDJDOHO-UHFFFAOYSA-N,cdp2w11-au00029680_a11_s1_w284f79470-19e3-4a9d-ac7e-b5fc804712de,cdp2w11-au00029680_a11_s1_w3e259ed20-8983-4ced-99cc-15f967007a36,cdp2w11-au00029680_a11_s1_w1821d78c8-c163-44a1-9aa2-ed2ce2ccce31,cdp2w11-au00029680_a11_s1_w58265bc94-109b-41c3-b7cd-e8fd57f69a5f,cdp2w11-au00029680_a11_s1_w4a4eb68a6-24f0-4d3c-b9d9-98bd15074dd9,47,4176
1190,33463.0,25681-B04-5,BRD-K18131774-001-12-7,25681,B04,5,SA1854163,BRD-K18131774,BROAD_CPD_ID,CCOc1ccc2nc(sc2c1)S(N)(=O)=O,OUZWUKMCLIBBOG-UHFFFAOYSA-N,cdp2w12_b04_s5_w2ca4e9365-abc9-43b4-8398-2e79d03967cb,cdp2w12_b04_s5_w38d985b92-11b1-4eb9-9d60-a63db405bba5,cdp2w12_b04_s5_w13b1195d5-eed2-4dd5-ac07-3eb7ea6f48cb,cdp2w12_b04_s5_w561529a04-510e-4d16-a645-461816643b07,cdp2w12_b04_s5_w4edf31393-fa06-472a-919d-27a8375145fd,45,29
1191,37058.0,25707-G09-6,BRD-K70510768-001-07-5,25707,G09,6,SA1858076,BRD-K70510768,BROAD_CPD_ID,[O-][N+](=O)c1ccccc1\C=C\C(=O)c1ccccc1Br,OVCQEXNEMJEJRT-MDZDMXLPSA-N,cdp2w12_g09_s6_w2d2e5f09a-bb81-4ade-b550-91f977230421,cdp2w12_g09_s6_w382cd965f-a243-4ca0-bd75-359f7635ffad,cdp2w12_g09_s6_w15964d24a-25ee-467b-b4fe-86663a094d59,cdp2w12_g09_s6_w558cabca0-e8bf-4ee7-bb9b-e306c9004af3,cdp2w12_g09_s6_w4a96a09ea-70e8-42c8-beb5-46214514643b,7,7530
1192,37117.0,25707-I10-5,BRD-A30776477-001-04-2,25707,I10,5,SA1852799,BRD-A30776477,BROAD_CPD_ID,CCC1CCCCN1C(=S)NC(=O)c1cccs1,OVEHKGROSRNRCP-UHFFFAOYSA-N,cdp2w12_i10_s5_w207ae94d8-4e88-495a-881d-f7a1fde128c3,cdp2w12_i10_s5_w307eee9a8-e9ba-4cc9-86b7-678f4d7a83fc,cdp2w12_i10_s5_w1082a4240-082c-4eb4-b80b-efdfa0fb1edb,cdp2w12_i10_s5_w50d45b176-ec88-47a8-b3a2-b8938b6bebe8,cdp2w12_i10_s5_w4356c11da-bdb0-4613-aa66-2c51adcbcad9,52,4249
1193,12327.0,25406-F14-1,BRD-K56471541-001-06-4,25406,F14,1,SA1860119,BRD-K56471541,BROAD_CPD_ID,CC(C)CCCCCCN=C(S)Nc1ccc(cc1)S(=O)(=O)N1CCOCC1,OVIAQMLMUCTBFS-UHFFFAOYSA-N,cdp2w10_f14_s1_w28617530a-20e0-40fe-a596-31378d8f2b8f,cdp2w10_f14_s1_w3174cd1e8-c014-414d-8017-0a2240231ea2,cdp2w10_f14_s1_w1d34840cc-1016-4bf3-8f9a-72434b4d0005,cdp2w10_f14_s1_w53f94430c-7c15-4ec1-961b-437d3c500a86,cdp2w10_f14_s1_w439dab282-b2e2-4486-a302-f83749a4a80f,63,5929
1194,12037.0,25403-E16-5,BRD-K73711782-001-05-2,25403,E16,5,SA1853437,BRD-K73711782,BROAD_CPD_ID,CCOc1cc(\C=C2SC(=O)N=C/2N)ccc1O,OVJVVTLPOZCJIU-POHAHGRESA-N,cdp2w10_e16_s5_w25c4b1ded-cf6c-4258-942b-08eaf493e174,cdp2w10_e16_s5_w36f5e5ca9-5e65-4ffe-9665-f7ed3184435f,cdp2w10_e16_s5_w1858fb411-0b30-41e8-b04f-82831595edab,cdp2w10_e16_s5_w5622f9fa3-b302-446f-b6ee-0fdff50fc9ab,cdp2w10_e16_s5_w4fcd2bee7-51b3-4828-b287-ae54b672aa03,34,7076
1195,44970.0,25990-M15-4,BRD-K73991644-001-01-7,25990,M15,4,SA36461,iso-quercitrin,to-be-curated,OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O,OVSQVDMCBVZWGM-QSOFNFLRSA-N,cdp2w8x2_m15_s4_w268885574-4b5d-469b-a590-b80983a197ee,cdp2w8x2_m15_s4_w3ccc0c80c-9bb4-4982-9345-7ccfc21bd865,cdp2w8x2_m15_s4_w1bc3a5c40-d7ed-44c6-8a1b-ca464415a9f2,cdp2w8x2_m15_s4_w582cfb7f1-ddfa-4935-b2ed-811aef5cac9f,cdp2w8x2_m15_s4_w4e46803c2-47b0-4d11-a4fc-31a32062479e,67,1093
1196,49040.0,26124-N15-6,BRD-K56757219-001-05-9,26124,N15,6,SA1858670,BRD-K56757219,BROAD_CPD_ID,NC1=NC[C@@H](N1CCCCC1CCCCC1)c1ccccc1,OWCJTQHZMVKDLV-GOSISDBHSA-N,cdp2w9x2_n15_s6_w20100a54e-33c9-45ee-8b81-d6356e8a7bbd,cdp2w9x2_n15_s6_w33be9168d-eac2-4a43-97d3-ebe8bed06f43,cdp2w9x2_n15_s6_w1076e0209-a26f-4ec1-91a3-76d4aec41aec,cdp2w9x2_n15_s6_w562887e7e-eb4f-4860-b978-249798f71d8e,cdp2w9x2_n15_s6_w4f55adfe2-99b7-41ed-9f31-60167fc16065,43,1475
1197,38363.0,25726-E08-3,BRD-K95342582-001-05-2,25726,E08,3,SA1854288,BRD-K95342582,BROAD_CPD_ID,CCOC(=O)c1sc(=S)n(C)c1NC(=O)c1ccc(cc1)C(C)(C)C,OWEYCOKXAHWNFI-UHFFFAOYSA-N,cdp2w12_e08_s3_w2bdee2042-8a1c-49b7-96a8-a1971ba62c53,cdp2w12_e08_s3_w3ad520941-0c8d-482b-bb56-447533d0e169,cdp2w12_e08_s3_w15899a674-d07b-452d-b749-d767a6a133dd,cdp2w12_e08_s3_w5c05ecfa7-5994-41e0-8135-85c7398c2205,cdp2w12_e08_s3_w42bf32a0f-1e0e-4097-865e-02f45ef12858,44,8773
1198,7641.0,24517-I13-4,BRD-K74267000-001-01-9,24517,I13,4,SA244864,BRD-K74267000,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O,OWJOIEFDHRCHNY-HOIFWPIMSA-N,cdp2bioactives_i13_s4_w2f94e523a-f17e-4fee-8aef-45e8d2e4f1c6,cdp2bioactives_i13_s4_w31d5076f4-e85d-41f8-acbd-de964795ff66,cdp2bioactives_i13_s4_w17435472d-8346-45bd-b0b5-9e89498248ac,cdp2bioactives_i13_s4_w58ac8f520-1c72-4afd-9437-86143fcfaae7,cdp2bioactives_i13_s4_w40f7f2557-6683-49dd-b26e-4428157a6549,91,9706
1199,16779.0,25436-B04-1,BRD-K51240517-001-05-0,25436,B04,1,SA1856908,BRD-K51240517,BROAD_CPD_ID,NC(S)=NNC(=O)c1ccccc1,OWKWAVBMKKZMHE-UHFFFAOYSA-N,cdp2w10_b04_s1_w2a402d707-c4f8-4ebe-9e77-bf3bf1c7ae8b,cdp2w10_b04_s1_w3c4e78c4f-aa82-4137-ac0c-5e9bb9616de4,cdp2w10_b04_s1_w1a14c839c-8200-4c3f-a979-db1ee5439e89,cdp2w10_b04_s1_w5660bfd3e-6937-40a6-a672-988e6e2f2b43,cdp2w10_b04_s1_w4b7ac70df-7b5c-469d-83b6-1827ac74e019,81,8621
1200,49010.0,26124-M13-6,BRD-K27985733-001-05-9,26124,M13,6,SA1860013,BRD-K27985733,BROAD_CPD_ID,Oc1ccnc2cc(ccc12)C(F)(F)F,OWPLFJSQLPTCHS-UHFFFAOYSA-N,cdp2w9x2_m13_s6_w2beb32def-81bd-4342-bfe5-2a31f9b401f5,cdp2w9x2_m13_s6_w3434116ea-a899-4bfb-91e5-288377a80d3b,cdp2w9x2_m13_s6_w115cd0164-bb04-4040-bd42-97220221037a,cdp2w9x2_m13_s6_w5112be13f-6de5-41ef-839b-42824a948c3d,cdp2w9x2_m13_s6_w4932ec8c1-6813-486d-86bb-121a0977596d,97,2379
1201,30964.0,25665-N06-2,BRD-K97850117-001-05-6,25665,N06,2,SA1856765,BRD-K97850117,BROAD_CPD_ID,[O-][N+](=O)c1ccc(CSc2nc3ccccc3o2)cc1,OWRFFBWURVTRDI-UHFFFAOYSA-N,cdp2w12_n06_s2_w2765b5713-f97e-4e24-b723-e7b283c2a170,cdp2w12_n06_s2_w3e80ff84b-9240-42c6-843c-cc8d39d958fc,cdp2w12_n06_s2_w1024f2e95-0097-4553-bafb-fc2faf094108,cdp2w12_n06_s2_w53ee818f1-a82b-4f3d-a762-abf0f8dbc112,cdp2w12_n06_s2_w4c5b5cb66-7236-44ca-837d-4d8452562ff1,87,772
1202,28.0,24277-B01-5,BRD-K19462402-003-03-0,24277,B01,5,SA83339,buflomedil,INN,COc1cc(OC)c(C(=O)CCCN2CCCC2)c(OC)c1,OWYLAEYXIQKAOL-UHFFFAOYSA-N,cdp2bioactives_b01_s5_w2ee50f437-2076-4898-978e-44e328b4bcc4,cdp2bioactives_b01_s5_w33075493c-ab20-421a-994a-107ae88c5d27,cdp2bioactives_b01_s5_w178e94a8f-f366-4e49-8900-143ac2c596b3,cdp2bioactives_b01_s5_w5cece35aa-6716-423f-a000-3a000e32ac87,cdp2bioactives_b01_s5_w4f807509c-828d-4e07-a416-bf1243d4a95c,61,947
1203,8698.0,24661-M02-2,BRD-K31207674-001-01-2,24661,M02,2,SA1014857,BRD-K31207674,BROAD_CPD_ID,CO[C@@H]1CN(C)C(=O)c2cc(NC(=O)c3cccc(OC)c3)ccc2OC[C@@H](C)N(CCc2ccccc2)C[C@H]1C,OXAYHDRNXZXDOZ-OVMXQCPESA-N,cdp2w3_m02_s2_w24b959367-c9a7-47b3-9215-83177acc4fe6,cdp2w3_m02_s2_w3ee6f84d4-566e-4185-8ddd-327acda85ec7,cdp2w3_m02_s2_w18d20b487-1b4d-4edc-904d-837e9550bcff,cdp2w3_m02_s2_w5a15c55bb-dde6-41dc-9fa7-f79dd8fb6c01,cdp2w3_m02_s2_w4268b1954-721d-4c93-bd8b-f49368fe2048,120,10463
1204,17105.0,25438-B04-3,BRD-K70333305-001-05-6,25438,B04,3,SA1855476,BRD-K70333305,BROAD_CPD_ID,CCn1c2ccccc2c2cc(N)ccc12,OXEUETBFKVCRNP-UHFFFAOYSA-N,cdp2w10_b04_s3_w27314e699-f600-4277-b175-06a8c169f107,cdp2w10_b04_s3_w3b3a43be9-b5e0-42e0-892a-b7187b639b50,cdp2w10_b04_s3_w1c68d0deb-b1ee-4f95-a7bf-81cfa787c40d,cdp2w10_b04_s3_w51a03af5e-2ee5-49b7-918f-5f31e510de88,cdp2w10_b04_s3_w4b771f276-1500-432e-8415-a5ade5ce2b50,64,793
1205,51114.0,26159-F06-4,BRD-K26786741-001-05-2,26159,F06,4,SA1858762,BRD-K26786741,BROAD_CPD_ID,OC(=O)c1ccccc1-c1ccc(\C=C(/C#N)c2nc3ccccc3[nH]2)o1,OXMPHBICAHAOIC-ACCUITESSA-N,cdp2w9x2-au00026617_f06_s4_w2a9f0301b-8779-4bef-9ff1-4620c350f497,cdp2w9x2-au00026617_f06_s4_w3a80202c6-ddb0-4f39-9307-8a3035dff537,cdp2w9x2-au00026617_f06_s4_w16ee15452-7dee-444a-ae31-885e78649c4e,cdp2w9x2-au00026617_f06_s4_w50aabd21b-1f7b-478e-9ce5-27fec8516658,cdp2w9x2-au00026617_f06_s4_w4d622297e-30a5-47ce-9416-99112db22548,58,7942
1206,46294.0,26061-E14-2,BRD-K56034970-001-05-2,26061,E14,2,SA1861568,BRD-K56034970,BROAD_CPD_ID,CCN1CN(Cc2ccccc2)CN=C1S,OXOCBHPYFBVZDH-UHFFFAOYSA-N,cdp2w9x2_e14_s2_w2a2698199-7e6e-4741-b395-2f62e2d00c7a,cdp2w9x2_e14_s2_w38e372964-b6a7-45c4-aedb-a431bcbde846,cdp2w9x2_e14_s2_w18df3d77c-664c-4ce5-9dfa-b384a5755f70,cdp2w9x2_e14_s2_w5116b8e5d-b744-4482-9dd8-0a512cbf1698,cdp2w9x2_e14_s2_w41d2d23e0-d100-4052-b28b-dc7cfafc2886,70,3152
1207,51988.0,26181-A12-2,BRD-K77858004-001-05-9,26181,A12,2,SA1853666,BRD-K77858004,BROAD_CPD_ID,Cc1cc(NC(=O)c2ccc3OCOc3c2)no1,OXODSZPOYQHMPS-UHFFFAOYSA-N,cdp2w9x2-au00026617_a12_s2_w22686897a-1bd7-4b4a-84fb-0f54e51edf8f,cdp2w9x2-au00026617_a12_s2_w32ef07e2a-d8d6-486a-afbb-5470d9ffabac,cdp2w9x2-au00026617_a12_s2_w149d2a694-a88b-4072-949f-59096d268cd7,cdp2w9x2-au00026617_a12_s2_w59d036466-49f8-4e12-aef3-45634acaeb89,cdp2w9x2-au00026617_a12_s2_w48137df70-9ba5-450b-9b4c-7c1684f9159d,77,5404
1208,8154.0,24619-F06-1,BRD-K33514849-001-01-9,24619,F06,1,SA851094,BRD-K33514849,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1,OYKBHWDUAQJSNT-CJYOKPGZSA-N,cdp2w3_f06_s1_w22d721f20-e3ff-47c5-99f8-97ec49a9c00c,cdp2w3_f06_s1_w3441a75d5-807a-4c2f-acb1-86158d32f34a,cdp2w3_f06_s1_w161aff8b3-b2f9-47f0-a672-e0e2c6e3c11b,cdp2w3_f06_s1_w5c023ae1e-c91a-4e1f-9e04-06c8410dd548,cdp2w3_f06_s1_w40e0660f1-76c0-4ace-87f4-0500cf046868,75,10127
1209,8211.0,24623-L09-4,BRD-K68216590-001-01-0,24623,L09,4,SA859115,BRD-K68216590,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1,OYKBHWDUAQJSNT-PHVLTXCSSA-N,cdp2w3_l09_s4_w21afc6384-204b-4f22-802f-ab831dddef9c,cdp2w3_l09_s4_w30a074f72-c7e3-44d0-92fc-4abef42fde5a,cdp2w3_l09_s4_w140d435f1-8755-4d4b-8754-db899c2ff313,cdp2w3_l09_s4_w55db23a85-80aa-4854-a4c9-2dc055cc4fd0,cdp2w3_l09_s4_w42b595d82-962d-4e1b-b672-912e7274be44,126,10011
1210,8126.0,24618-L03-3,BRD-K23378122-001-01-9,24618,L03,3,SA860315,BRD-K23378122,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1,OYKBHWDUAQJSNT-UMQWNRPGSA-N,cdp2w3_l03_s3_w2022a4f5d-5814-4979-a19e-c5faf5f548de,cdp2w3_l03_s3_w382154817-2294-4ef4-b069-afe59b24e26a,cdp2w3_l03_s3_w18e2fc96f-dd8f-48d1-b96d-2590f772d8e9,cdp2w3_l03_s3_w5213f413f-295e-4037-a53d-dec17a51586e,cdp2w3_l03_s3_w435ff62ba-7a89-4edc-93a5-caeb5999a4c2,112,10047
1211,38202.0,25725-K21-4,BRD-K41951173-001-05-0,25725,K21,4,SA1855173,BRD-K41951173,BROAD_CPD_ID,Cc1ccc(\C=C\C(=O)N2CCc3ccccc3C2)cc1,OYMYPUTVEZWFAQ-ZHACJKMWSA-N,cdp2w12_k21_s4_w247203a58-1213-4289-9798-735f7027601e,cdp2w12_k21_s4_w374699e85-1dce-4ff7-a6e6-3e87546a041a,cdp2w12_k21_s4_w1598d90ee-db96-4da6-aa04-5d59c96ec30f,cdp2w12_k21_s4_w520878584-b735-4ff6-a679-405f25b470db,cdp2w12_k21_s4_w4fbad65cb-c41a-40ec-83fc-bd3d916b686f,76,7575
1212,44276.0,25988-E22-6,BRD-K47207162-312-02-2,25988,E22,6,SA83443,zimelidine,primary-common,CN(C)C\C=C(/c1ccc(Br)cc1)c1cccnc1,OYPPVKRFBIWMSX-CXUHLZMHSA-N,cdp2w8x2_e22_s6_w2823aa298-c044-41bd-96af-e99c57ebe0d2,cdp2w8x2_e22_s6_w3afc81383-a5a3-40af-b9c5-030e7cfbafad,cdp2w8x2_e22_s6_w14936fb73-f832-4418-8a66-d7e133419a48,cdp2w8x2_e22_s6_w54998b7b0-acb0-4569-9678-eb523bc8f6c4,cdp2w8x2_e22_s6_w49f76c433-2e46-4227-878e-b28f48b12727,39,919
1213,20213.0,25566-I05-3,BRD-K48812970-001-05-2,25566,I05,3,SA1857225,BRD-K48812970,BROAD_CPD_ID,Cc1nc(cn2c3ccccc3nc12)-c1ccccc1,OZEPKGBSALEXRT-UHFFFAOYSA-N,cdp2w11_i05_s3_w27cf9b8bb-e5c6-4bb0-9e68-bc82dadbbb84,cdp2w11_i05_s3_w3ce1b5720-11dd-4475-a14a-a59b3169f540,cdp2w11_i05_s3_w1b1a75425-e9cf-4111-8a5a-b8e79b1054f3,cdp2w11_i05_s3_w549afe215-2d1d-4c81-972b-f5693beabb21,cdp2w11_i05_s3_w4fb5e1a95-ea48-4382-9c5e-13a783727720,63,3060
1214,36101.0,25695-F11-3,BRD-K46487274-001-06-6,25695,F11,3,SA1853841,BRD-K46487274,BROAD_CPD_ID,CCn1cnc2sc(C(=O)Nc3ccc4OCOc4c3)c(C)c2c1=O,OZWVGXILNZHMJF-UHFFFAOYSA-N,cdp2w12_f11_s3_w222660d8e-1f53-475d-a3d4-4dfcd2acdf3f,cdp2w12_f11_s3_w3f962d686-aae0-4e3d-8cb7-f306a2f3bd7a,cdp2w12_f11_s3_w13e010904-33df-46bf-95ae-2b7cd1bd1bfe,cdp2w12_f11_s3_w52733d515-0d54-4ed3-b500-22b48912ace6,cdp2w12_f11_s3_w467c83b07-e4de-47b2-9da7-36e5bd19dc69,72,2812
1215,34029.0,25683-K05-1,BRD-K91634964-001-06-2,25683,K05,1,SA1852946,BRD-K91634964,BROAD_CPD_ID,COc1cc(CN2CCN(CC2)c2cccc(Cl)c2)cc(OC)c1OC,OZZZZNWJPKCYDI-UHFFFAOYSA-N,cdp2w12_k05_s1_w2b358e9cc-b58b-4eb1-b379-0b5e2befe267,cdp2w12_k05_s1_w3c8cde572-6b7d-48fe-a48c-612a8f3198b0,cdp2w12_k05_s1_w1a772c2ef-9f3f-470a-bc85-93e71bca6d84,cdp2w12_k05_s1_w5bfbfbbc3-f2f7-4c47-bf7e-a5ea3d3cc92e,cdp2w12_k05_s1_w4e31d3553-c598-481a-aa30-4467af2cc967,20,2578
1216,35834.0,25694-H10-6,BRD-K91893126-001-05-1,25694,H10,6,SA1856093,BRD-K91893126,BROAD_CPD_ID,Clc1ccc(cc1)-c1nc(C#N)c(NCCc2ccccn2)o1,PAETVSOVNBBHAS-UHFFFAOYSA-N,cdp2w12_h10_s6_w2c0e1b84d-6b20-486d-85a2-76815679871b,cdp2w12_h10_s6_w3dbf8e5e3-56ce-4980-84d4-dd66754035c6,cdp2w12_h10_s6_w119bbd80d-abd4-4e5d-b4ac-ce6229d66d2a,cdp2w12_h10_s6_w59603ba30-13e1-4bd8-9cd3-0cbfba99927e,cdp2w12_h10_s6_w4dd5a62b9-f155-4ebe-a8c9-cd348e9c4762,70,8844
1217,35849.0,25694-I13-3,BRD-K98122962-001-06-3,25694,I13,3,SA1858983,BRD-K98122962,BROAD_CPD_ID,COc1cccc(c1)C(=O)Nc1nc(C)cs1,PAGPVSQZNPBQLP-UHFFFAOYSA-N,cdp2w12_i13_s3_w2da7fa342-0c3e-4e32-927a-64d6c02e7fed,cdp2w12_i13_s3_w396c6ff5c-c798-49e1-a047-196f2cd6b755,cdp2w12_i13_s3_w17f9cbbd4-e6ad-4355-a1db-88580c8154f3,cdp2w12_i13_s3_w5fc4cc679-6902-40b8-965d-6a36c674a93e,cdp2w12_i13_s3_w4363c9c68-b281-4026-b5ab-ad9058b2c7ee,54,988
1218,24986.0,25584-G06-6,BRD-A00993607-003-17-0,25584,G06,6,SA1853574,alprenolol,INN,CC(C)NCC(O)COc1ccccc1CC=C,PAZJSJFMUHDSTF-UHFFFAOYSA-N,cdp2w11_g06_s6_w213ef8501-799d-4cb5-9238-68d464023275,cdp2w11_g06_s6_w36d38715c-71cc-479a-8958-62716535935c,cdp2w11_g06_s6_w1e73c0d7e-c5e5-4d8e-8cad-875172bfd13f,cdp2w11_g06_s6_w572425ba4-16f3-4c0f-9fc0-77a62e6f34f9,cdp2w11_g06_s6_w422260c81-3ca5-43a3-9e47-38ae58ae6078,43,19
1219,55067.0,26271-D19-3,BRD-K86677819-001-05-7,26271,D19,3,SA1853130,BRD-K86677819,BROAD_CPD_ID,Cn1ncc2c1ncn1nc(CCc3ccccc3)nc21,PBABZDHXDUJKLR-UHFFFAOYSA-N,cdp2w9x2-au00026606_d19_s3_w2e2ab612f-86f0-4009-992e-61fa54fc8018,cdp2w9x2-au00026606_d19_s3_w3158a4566-6a03-4d63-96ac-d53d47bdad81,cdp2w9x2-au00026606_d19_s3_w149d7a971-a795-46b0-98ec-2eaab58f043a,cdp2w9x2-au00026606_d19_s3_w5f91ed194-5745-4f2d-82c2-dcb16babce72,cdp2w9x2-au00026606_d19_s3_w4e4b2ce2c-546e-4f54-8c8f-dd6817482fc1,90,3797
1220,39332.0,25857-N16-6,BRD-K45265806-001-01-5,25857,N16,6,SA791403,BRD-K45265806,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccccc2F)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,PCQGWFREXHAZIT-RXYILKCJSA-N,cdp2w6x2_n16_s6_w2baf5671d-b850-4803-8a2d-bbe84ead78c0,cdp2w6x2_n16_s6_w3fc989ace-c79c-4c39-9785-40a3c7d14b29,cdp2w6x2_n16_s6_w1926b1579-9b8f-49f8-9546-69cb6f65eab8,cdp2w6x2_n16_s6_w51efda02a-02bc-429a-99ce-bca95d9822b9,cdp2w6x2_n16_s6_w4cdbedbc0-fa27-42d6-afec-4efb9f30f7f5,90,10541
1221,272.0,24277-L13-3,BRD-K34154330-003-04-9,24277,L13,3,SA792548,tracazolate,INN,CCCCNc1c(C(=O)OCC)c(C)nc2n(CC)ncc12,PCTRYMLLRKWXGF-UHFFFAOYSA-N,cdp2bioactives_l13_s3_w251a97578-798c-4af2-b694-b8f6c2438dfe,cdp2bioactives_l13_s3_w3dd11a791-5e88-4d3e-952a-2e28a0b19000,cdp2bioactives_l13_s3_w129e275f9-5468-40c6-afc9-43e238187d54,cdp2bioactives_l13_s3_w54082b400-cae6-4002-97b3-4b9170249ccb,cdp2bioactives_l13_s3_w4fd9b685e-1f95-4100-b636-1236c49fdb68,102,689
1222,403.0,24278-B24-2,BRD-K80946661-001-02-8,24278,B24,2,SA59702,triacetylresveratrol,primary-common,CC(=O)Oc1ccc(cc1)\C=C\c1cc(OC(C)=O)cc(OC(C)=O)c1,PDAYUJSOJIMKIS-SNAWJCMRSA-N,cdp2bioactives_b24_s2_w21623a195-421e-428e-aa46-a4bb6c77f439,cdp2bioactives_b24_s2_w32c78d215-5caa-49f6-a3f7-7132f0d45f52,cdp2bioactives_b24_s2_w10eecaae1-349b-4044-bb4e-8ea9e0ea4d6a,cdp2bioactives_b24_s2_w5feb44841-9f18-4130-a8c4-07071aea4be7,cdp2bioactives_b24_s2_w45d3778d1-fa81-43d0-b779-30b40c5fec05,75,1309
1223,48702.0,26118-P12-4,BRD-K95351944-001-05-6,26118,P12,4,SA1853662,BRD-K95351944,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)Cc1ccc(o1)C(=O)N1CCN(CC1)c1cccc(C)c1C,PDNWQTIPSVDUJE-UHFFFAOYSA-N,cdp2w9x2_p12_s4_w24c12b173-a462-4cc3-957c-816574b69cf2,cdp2w9x2_p12_s4_w3d043d3f5-411c-40c8-ab4a-3d2667f13c63,cdp2w9x2_p12_s4_w1ad323f97-187d-4417-8f8f-5da2bc0d6d2f,cdp2w9x2_p12_s4_w57f4f81d9-e930-421d-9034-a23f4b8d3fd7,cdp2w9x2_p12_s4_w451f70370-3e9a-460f-896a-3daf1c58a097,54,7403
1224,37909.0,25724-O21-5,BRD-A17082641-001-05-0,25724,O21,5,SA1855795,BRD-A17082641,BROAD_CPD_ID,Brc1ccc(cc1)-c1cc(C(=O)OC2CCOC2=O)c2ccccc2n1,PDOHGSITFBKCRS-UHFFFAOYSA-N,cdp2w12_o21_s5_w257e23a51-79eb-454f-a2ef-58331a4d568d,cdp2w12_o21_s5_w314cc6de3-f7b9-439f-b300-2b55f0fd7cb1,cdp2w12_o21_s5_w15c410e0e-945c-4fce-8c99-c86f7515809f,cdp2w12_o21_s5_w562b5544e-3e29-4efd-9f09-741bca86f2b4,cdp2w12_o21_s5_w47714b282-81ef-4cb2-bbe6-0a6ff8493023,63,5524
1225,12883.0,25410-B15-5,BRD-A82925153-001-05-0,25410,B15,5,SA1853908,BRD-A82925153,BROAD_CPD_ID,NC(=O)c1ccc(Sc2nnc(-c3cccs3)n2CC2CCCO2)c(c1)[N+]([O-])=O,PDZHTLVMZXEBHV-UHFFFAOYSA-N,cdp2w10_b15_s5_w2b45095f0-9020-498c-99a3-58607f21084b,cdp2w10_b15_s5_w36f1e4053-d7a5-47b3-b6ad-648abf159cc8,cdp2w10_b15_s5_w1d1446526-f9d6-4569-8651-dd62eb61c6a2,cdp2w10_b15_s5_w59d384bf8-0b59-4738-b94f-cc01c7d99f5a,cdp2w10_b15_s5_w49ec2af60-45d1-4497-94bb-d4debd62f9d7,59,3745
1226,19027.0,25503-L20-5,BRD-K03350751-001-05-1,25503,L20,5,SA1856946,BRD-K03350751,BROAD_CPD_ID,COc1ccc2-c3onc(C(=O)Nc4ccc(OC)c(OC)c4)c3CCc2c1,PELZYFPYXBGSIZ-UHFFFAOYSA-N,cdp2w11-au00029680_l20_s5_w2a7e498e3-7616-4728-a8c0-e9989649b11e,cdp2w11-au00029680_l20_s5_w3e881a861-c317-42b9-b20e-9bd5c2be099f,cdp2w11-au00029680_l20_s5_w17cd66b95-2d55-4b0f-b45f-9616c73ca063,cdp2w11-au00029680_l20_s5_w5e1248140-f3fd-4cd1-90fd-b54ef5739751,cdp2w11-au00029680_l20_s5_w4e8ad1dfa-01d2-4bc5-a09d-249fec088b71,67,4700
1227,35959.0,25694-M14-5,BRD-A57779024-001-06-7,25694,M14,5,SA1861172,BRD-A57779024,BROAD_CPD_ID,CC1(C)CC2(C)OC(=N)C1(C#N)C2(C#N)C#N,PERGIMFAIDAJHC-UHFFFAOYSA-N,cdp2w12_m14_s5_w29e02a26c-ec30-4312-a7ff-46af545c85eb,cdp2w12_m14_s5_w354f6f98d-cbaf-4188-9f58-626e932b8676,cdp2w12_m14_s5_w1e09d6840-2185-4eeb-8d7d-57afc7dab21b,cdp2w12_m14_s5_w51da22652-afd9-47d0-9e3a-f636b97bbbb2,cdp2w12_m14_s5_w4710b8366-7c56-420b-8180-cbc8fa15b0ef,69,4881
1228,663.0,24279-D05-4,BRD-K82561139-001-01-9,24279,D05,4,SA23202,ricinine,primary-common,COc1ccn(C)c(=O)c1C#N,PETSAYFQSGAEQY-UHFFFAOYSA-N,cdp2bioactives_d05_s4_w2393e0f63-2b83-4b3d-8636-b3576624c64f,cdp2bioactives_d05_s4_w302718b44-d021-4eff-8978-c498fbd49d3f,cdp2bioactives_d05_s4_w1bcac869e-4d3e-49ea-8df2-a8806fb768cc,cdp2bioactives_d05_s4_w5eba984eb-065e-4cfa-b4d7-d7bd4b242f63,cdp2bioactives_d05_s4_w44a1139c0-3b3e-4986-b523-dfadcac8aab0,145,2226
1229,47093.0,26081-M20-3,BRD-K68916730-001-05-7,26081,M20,3,SA1862080,BRD-K68916730,BROAD_CPD_ID,[O-][N+](=O)c1ccc(NCc2ccc3OCOc3c2)cc1,PFLKVMJVHVUPMR-UHFFFAOYSA-N,u00026613_m20_s3_w2941d4b12-8cca-46b6-96d6-1710d63fc7b0,u00026613_m20_s3_w3ec4c582c-fcbc-4bff-bd4e-e31e7894daa6,u00026613_m20_s3_w1ee3e1a3c-13e4-48a0-a1d9-cf56f5fca5fb,u00026613_m20_s3_w57933effd-6acf-4946-9ddc-8a6aa4d35525,u00026613_m20_s3_w458d1eb25-d870-4c7b-a70f-21058748bbc6,87,9061
1230,4222.0,24308-I17-5,BRD-K31477169-001-02-1,24308,I17,5,SA58144,methyl everninic acid,primary-common,COC(=O)c1c(C)cc(OC)cc1O,PFVPJOAAHSOENR-UHFFFAOYSA-N,cdp2bioactives_i17_s5_w2e191ab04-56dc-41fc-a73e-1b4c4396e344,cdp2bioactives_i17_s5_w372e39473-d809-4f80-b04d-7de3d3331cf9,cdp2bioactives_i17_s5_w1b7edb239-d71c-4a4b-a42c-76457b62f474,cdp2bioactives_i17_s5_w50ceb3d42-9761-43ed-a6c3-02c6b1f1d434,cdp2bioactives_i17_s5_w429e7aef3-6ac7-4489-994d-ef012212b5bc,130,9066
1231,46993.0,26081-I22-5,BRD-A64761364-001-05-6,26081,I22,5,SA1854587,BRD-A64761364,BROAD_CPD_ID,Cc1ccc(o1)C(N(Cc1ccc(F)cc1)C(=O)c1csnn1)C(=O)NC1CCCC1,PFXVNPUAHLUCNF-UHFFFAOYSA-N,u00026613_i22_s5_w29b255e04-be03-48b6-872b-aff369a478b6,u00026613_i22_s5_w3a6ba9fcf-7a81-463d-a634-27dae0f6b8d8,u00026613_i22_s5_w13b2649b4-964c-4f81-9cc7-487717c2d002,u00026613_i22_s5_w530fd13d0-e022-4b6d-b0c8-b3d26cacbad7,u00026613_i22_s5_w43325036b-0819-4031-a2d8-64ca0d42707c,96,7745
1232,33532.0,25681-D17-2,BRD-A10073163-001-05-4,25681,D17,2,SA1861457,BRD-A10073163,BROAD_CPD_ID,O=c1[nH]c2SC3C4CCC(C4)C3C(c3ccco3)c2s1,PGOHYRVPWXTGJJ-UHFFFAOYSA-N,cdp2w12_d17_s2_w2741abae7-675b-41f9-8cf5-6cdcf143b905,cdp2w12_d17_s2_w39e6194ec-e1d7-4e17-a7d3-cdbc48f58812,cdp2w12_d17_s2_w11c8e8984-b118-43af-95cf-4dc2e1fbc2fc,cdp2w12_d17_s2_w548e6bc12-8220-4e81-9416-f3651ebcfacf,cdp2w12_d17_s2_w482846664-2631-46a8-8665-c4ffe9c5ab50,60,7261
1233,32841.0,25679-D08-1,BRD-K56604379-001-05-9,25679,D08,1,SA1852551,BRD-K56604379,BROAD_CPD_ID,COc1cccc(N\C=C\c2onc(C)c2[N+]([O-])=O)c1,PHDPDISOBZPHKI-VOTSOKGWSA-N,cdp2w12_d08_s1_w23516ddde-65c0-44b2-b704-daaa311113f5,cdp2w12_d08_s1_w3ae8fe72c-8a08-4045-afcb-7725a4dba0bd,cdp2w12_d08_s1_w13ec07e66-41b6-4abc-af56-bb643271775a,cdp2w12_d08_s1_w5f2feef4c-93ba-4aa8-bfd1-b5d2ac7f84d1,cdp2w12_d08_s1_w4489b0135-dc70-4817-a20d-1db66f47adf8,68,8663
1234,14672.0,25424-D20-6,BRD-K12235135-001-05-0,25424,D20,6,SA1861405,BRD-K12235135,BROAD_CPD_ID,OC(=O)c1ccc(cc1)-c1nc(cs1)-c1ccc(Cl)cc1Cl,PHLNMNRVMBDTSX-UHFFFAOYSA-N,cdp2w10_d20_s6_w2d7c0c48f-1a20-4f35-bd98-9d03b6051359,cdp2w10_d20_s6_w3d2ba9285-c096-4bd2-8ed3-90ea1c16d015,cdp2w10_d20_s6_w1fbad0f4d-15b7-4ed2-875d-16b863e895a8,cdp2w10_d20_s6_w509eb59d6-9dda-47d1-b4d2-d56e2138273f,cdp2w10_d20_s6_w42fc97f7d-ef86-4e55-843d-d4eb524f3941,82,8508
1235,26178.0,25590-K10-4,BRD-K77069004-001-06-1,25590,K10,4,SA1854818,BRD-K77069004,BROAD_CPD_ID,[O-][N+](=O)c1ccccc1C(=O)NNC(=O)c1ccccn1,PIBAUNUWYKCFCJ-UHFFFAOYSA-N,cdp2w11_k10_s4_w20cefbd74-07ee-4ef5-8ce9-35db0ac99411,cdp2w11_k10_s4_w370fd5843-44b1-44cd-9ca2-98f5251c1bca,cdp2w11_k10_s4_w10b6163b2-c57f-440c-9a96-b43d8a28001f,cdp2w11_k10_s4_w55a6e8d80-9169-4cb8-9fa5-d20bee8d8731,cdp2w11_k10_s4_w48f4262ab-f14a-4750-886e-381387317625,60,5567
1236,8036.0,24605-C07-3,BRD-K18493795-001-01-9,24605,C07,3,SA851165,BRD-K18493795,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@H]1C)[C@H](C)CO)C1=CCCCC1,PIKMQEDGBFJLCE-GNMOFYLKSA-N,cdp2w3_c07_s3_w2a93cef0e-766e-4b6d-a138-7628608e7828,cdp2w3_c07_s3_w334e6191e-babb-452f-bd7f-c913d978bb31,cdp2w3_c07_s3_w16a27874d-9d80-428a-b19b-749537251ab1,cdp2w3_c07_s3_w53490b906-5385-4db8-9f10-59bd6b408c2f,cdp2w3_c07_s3_w41712c3f5-1820-4acb-b9b9-07f39335ab27,81,9957
1237,8040.0,24605-I18-1,BRD-K72515004-001-01-9,24605,I18,1,SA852404,BRD-K72515004,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C1=CCCCC1,PIKMQEDGBFJLCE-ISCCLHIJSA-N,cdp2w3_i18_s1_w2423bf17c-7b5d-481a-8d6e-09c930da7f0a,cdp2w3_i18_s1_w3946c62f0-7fc5-421b-87f5-83925c22af9e,cdp2w3_i18_s1_w15ee3fcd9-5b43-411a-bd72-843050fc085b,cdp2w3_i18_s1_w541600123-32fc-4b0d-95d2-442d2c431bb3,cdp2w3_i18_s1_w4067e4487-5eda-45a9-bed8-6fbdca23d0f9,99,10352
1238,33786.0,25681-P13-4,BRD-A03739427-001-04-4,25681,P13,4,SA1859175,BRD-A03739427,BROAD_CPD_ID,OCc1cc(=O)c(O)c(o1)C(Nc1ccccn1)c1cccc(F)c1,PIMBWGQKUSYHBN-UHFFFAOYSA-N,cdp2w12_p13_s4_w24b26b08b-2d3c-4301-9e0d-5c6ec95381ce,cdp2w12_p13_s4_w34cca274d-e80a-4a2c-a6e2-97838017dac1,cdp2w12_p13_s4_w15bf5f51a-15b6-4ef3-b741-37fe0bd4599c,cdp2w12_p13_s4_w565222f23-fdc5-47b4-819f-c4e02626feb0,cdp2w12_p13_s4_w4f1a88097-3bc1-47b8-af79-6a6ff3aa4bb1,81,6686
1239,53581.0,26207-K08-5,BRD-A10385098-001-06-0,26207,K08,5,SA1856222,BRD-A10385098,BROAD_CPD_ID,CCCCNS(=O)(=O)c1ccc(NC(=O)C(Sc2ccccc2)c2ccccc2)cc1,PJHDFVPJMNSKHT-UHFFFAOYSA-N,cdp2w9x2-au00026617_k08_s5_w2fc239ef7-5a93-4d0f-81dd-683f17965886,cdp2w9x2-au00026617_k08_s5_w349dbbe27-a396-485e-81c3-20695667a6ba,cdp2w9x2-au00026617_k08_s5_w1bc5eed35-ae5c-4f99-acab-956f348eb3b6,cdp2w9x2-au00026617_k08_s5_w5033a0998-85e0-4aaa-bda1-3f09f6adf9ab,cdp2w9x2-au00026617_k08_s5_w4823e1e72-5435-48ae-b901-f5945cb7ffae,83,2216
1240,21614.0,25570-M18-6,BRD-K28901743-001-05-3,25570,M18,6,SA1853229,BRD-K28901743,BROAD_CPD_ID,Cc1cc(=O)oc2cc(OC(=O)CCCCCN3C(=O)c4ccccc4C3=O)ccc12,PKHXZCADQSXUCF-UHFFFAOYSA-N,cdp2w11_m18_s6_w2432c29d6-1eda-44bd-9f94-12b3c9352d5b,cdp2w11_m18_s6_w372a0fbd6-cfb3-4c11-8fbc-04d294585131,cdp2w11_m18_s6_w1f9a8db8f-1795-4880-b75e-ca6d82fa32da,cdp2w11_m18_s6_w5a9669904-1abe-43ee-812a-8751b5919a6c,cdp2w11_m18_s6_w47ce2c3fd-470d-4aa0-b878-ef35c66e5809,62,2853
1241,1317.0,24293-O04-4,BRD-K96263742-001-02-3,24293,O04,4,SA792590,gw 7647,to-be-curated,CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC2CCCCC2)cc1)C(O)=O,PKNYXWMTHFMHKD-UHFFFAOYSA-N,cdp2bioactives_o04_s4_w2206ce978-0612-49b2-9158-0dec5b08cac2,cdp2bioactives_o04_s4_w325279f92-2239-4c24-8a18-881d128c8ea6,cdp2bioactives_o04_s4_w105595773-195f-40ca-895a-d78cd2fe0687,cdp2bioactives_o04_s4_w5433305bf-e2c0-4697-8e72-a0880a6782ea,cdp2bioactives_o04_s4_w492d7e57c-6d55-4628-8abb-caeb6cf42950,151,285
1242,8908.0,24731-B03-2,BRD-K52117630-001-02-8,24731,B03,2,SA667032,BRD-K52117630,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C)OCc2cnnn2CCCC1=O,PKTOTAWSKYPRKJ-SBHAEUEKSA-N,cdp2w5_b03_s2_w29e25a7af-e9ec-4419-ae45-56d6e5ebb10a,cdp2w5_b03_s2_w3fedbcb79-96b4-4ff6-8281-2de5b3508304,cdp2w5_b03_s2_w1432d5767-4876-4273-8ad4-de1bf4c34066,cdp2w5_b03_s2_w50ebd4545-7d64-48e2-b458-2170f94626d9,cdp2w5_b03_s2_w4b7a1f2f5-0aff-49c6-92e3-ed45536d9bf3,76,10080
1243,13054.0,25410-L09-2,BRD-K62395412-001-06-3,25410,L09,2,SA1861893,BRD-K62395412,BROAD_CPD_ID,Clc1ccc(cc1Cl)C(=O)NNc1cc(nc(n1)N1CCOCC1)N1CCOCC1,PKWGFGRQRBAQMM-UHFFFAOYSA-N,cdp2w10_l09_s2_w268cfb7b3-f293-4243-b9a7-c4a6404a4769,cdp2w10_l09_s2_w3ccdb4f5c-a0db-47b3-9e91-8be5fa2b3e79,cdp2w10_l09_s2_w198e6600f-3cf1-4e2b-b1b8-41b3510f6215,cdp2w10_l09_s2_w5d4194b54-b099-4ef1-bbad-f9b29be08ab9,cdp2w10_l09_s2_w4cdeb09ba-287e-4c56-9a5d-a3c535ed3c7b,46,1886
1244,50156.0,26135-H04-6,BRD-K45833502-001-05-8,26135,H04,6,SA1854128,BRD-K45833502,BROAD_CPD_ID,[O-][N+](=O)c1cc(ccc1S(=O)(=O)c1ccccc1Cl)C(=O)N1CCN(Cc2ccccc2)CC1,PLEPZKJLVYQJMF-UHFFFAOYSA-N,cdp2w9x2_h04_s6_w26e7fc7ad-48bb-4f29-ae43-b9113c1c96f6,cdp2w9x2_h04_s6_w346458260-dd5b-4518-8bee-7775c39c943f,cdp2w9x2_h04_s6_w143383ca4-c631-4e53-b37b-420916c47738,cdp2w9x2_h04_s6_w5150a037c-2fe2-4507-8c4f-651789545884,cdp2w9x2_h04_s6_w488a6050d-90dd-46e5-b50e-b170c57f6062,16,8694
1245,14916.0,25426-A06-4,BRD-K55286161-001-05-8,25426,A06,4,SA1852359,BRD-K55286161,BROAD_CPD_ID,Cc1cc(C)nc(Nc2nc3ccccc3s2)n1,PLHCEZLRRVUOQJ-UHFFFAOYSA-N,cdp2w10_a06_s4_w25571c184-5814-4736-821a-8dcb4f0a4aaf,cdp2w10_a06_s4_w3f0af4c28-83b5-40cf-8f51-283a8c2e59a9,cdp2w10_a06_s4_w16130e49a-8e9e-47e1-b5db-3ef19b542ee8,cdp2w10_a06_s4_w59987f78e-6f6a-4c7e-b398-a8fc752eb9a2,cdp2w10_a06_s4_w45f04af03-39e2-43a9-af77-1cbe2a09d14e,39,1606
1246,38521.0,25726-N08-5,BRD-K55746737-001-05-6,25726,N08,5,SA1857010,BRD-K55746737,BROAD_CPD_ID,Cc1ccc(NC(=O)c2ccccc2NC(=O)c2cccnc2)cc1,PLIACWIWRWIRLF-UHFFFAOYSA-N,cdp2w12_n08_s5_w2cf6211cd-1d14-4811-b4b9-640a26c3e01f,cdp2w12_n08_s5_w30edf9945-d121-499e-8dcc-a951dcae6c69,cdp2w12_n08_s5_w1cb417ed9-fbc0-453a-8b82-f991a76d2df6,cdp2w12_n08_s5_w5433aa329-d3cd-47a6-b903-51db7e7723cc,cdp2w12_n08_s5_w493f9e68d-37e5-44c2-a5f4-471a5553df7b,97,5185
1247,7275.0,24512-A09-4,BRD-K74221467-001-05-3,24512,A09,4,SA1862043,BRD-K74221467,BROAD_CPD_ID,Clc1ccccc1C(=O)NCCc1ccccc1,PLSUZSSOFMKWLH-UHFFFAOYSA-N,cdp2w10_a09_s4_w2f4d13f2b-1a0d-4252-9db5-d8a665b3f041,cdp2w10_a09_s4_w34e698643-4820-4f25-bb33-e2faa6f9d422,cdp2w10_a09_s4_w119a62b0a-e0a2-4faa-ba6e-c24348164dfb,cdp2w10_a09_s4_w5c2caa8ec-1d49-495f-b28c-506e65d6ade3,cdp2w10_a09_s4_w47affe676-6090-482b-ab4f-d042d8ab1097,80,7086
1248,2541.0,24302-H21-4,BRD-A69815203-001-02-7,24302,H21,4,SA59473,ciclosporin,INN,CCC1NC(=O)C(C(O)C(C)C\C=C\C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C,PMATZTZNYRCHOR-IMVLJIQESA-N,cdp2bioactives_h21_s4_w2813a6aea-897d-410a-b7c3-c7a9277f5989,cdp2bioactives_h21_s4_w368f2ee64-bb2d-42e5-a8fe-f3b1a2fbbf6c,cdp2bioactives_h21_s4_w134b0e8f3-80f9-4750-9360-a4da4deee9c5,cdp2bioactives_h21_s4_w5272b670e-d500-41cf-9c3f-093de36264a6,cdp2bioactives_h21_s4_w4941df33c-d13c-4f10-a856-344bf86b59e0,88,123
1249,49733.0,26128-P04-3,BRD-K76620631-001-05-5,26128,P04,3,SA1852366,BRD-K76620631,BROAD_CPD_ID,COc1ccc(Nc2oc(nc2C#N)-c2ccccc2F)cc1,PMVMZHXCYPLPCF-UHFFFAOYSA-N,cdp2w9x2_p04_s3_w26dad291d-0208-4836-b8cf-be86906d0f85,cdp2w9x2_p04_s3_w3154e1bc3-d6d4-4982-8c15-14f1de9aa7f0,cdp2w9x2_p04_s3_w1c7fe7f9b-c5f7-4613-9349-b795cc1efa5c,cdp2w9x2_p04_s3_w5ff999c3b-ec61-4774-9f64-2479314f5538,cdp2w9x2_p04_s3_w4564e3a1d-f549-4440-a511-76da14ed5e99,64,6884
1250,36654.0,25704-D10-4,BRD-K79458448-001-05-0,25704,D10,4,SA1855501,BRD-K79458448,BROAD_CPD_ID,CCNc1nc(NCC)nc(n1)N(CC)C(S)=N,PNJNJSLWDICINV-UHFFFAOYSA-N,cdp2w12_d10_s4_w2281d5e43-ca89-4019-92d6-7a672b252eab,cdp2w12_d10_s4_w3f6dc89b4-cf63-4671-b512-074486e6c3fa,cdp2w12_d10_s4_w18d431ee3-1b84-4e2e-b04e-cbc88ccd4cd9,cdp2w12_d10_s4_w56a10d996-0a93-4d8e-8e74-c0fc3d75753b,cdp2w12_d10_s4_w4f8a12b15-0129-4ed0-a0b7-07bf2da84ac0,75,3117
1251,10709.0,25380-G17-3,BRD-A88118845-001-05-0,25380,G17,3,SA1857063,BRD-A88118845,BROAD_CPD_ID,CCCCCC1(C)NN(C(S)=N1)c1ccccc1,PNZKZFFPLXJZJA-UHFFFAOYSA-N,cdp2w10_g17_s3_w26c5f3a78-7d94-4517-ab3d-4a3f961171dc,cdp2w10_g17_s3_w358cea3ad-ff80-4a0f-94d2-046ef508e415,cdp2w10_g17_s3_w1928b0709-6ea3-41a3-b040-f64557fe1c25,cdp2w10_g17_s3_w5b9e66344-b09f-4b63-9202-97a3820d5f75,cdp2w10_g17_s3_w44a9126a6-4ecb-4806-8095-beeed843b999,67,1496
1252,7564.0,24512-O17-5,BRD-K58538309-001-06-0,24512,O17,5,SA1857330,BRD-K58538309,BROAD_CPD_ID,CN(NC(=O)c1ccccc1C)c1nc2ccccc2nc1C(F)(F)F,POCREAFIBPVMBR-UHFFFAOYSA-N,cdp2w10_o17_s5_w21bb321d4-7e3f-4a16-8905-4112e6274192,cdp2w10_o17_s5_w32cd89204-041a-49cd-986e-11dd01abee2a,cdp2w10_o17_s5_w157846f9c-1e14-4f80-842d-dcf37d29928f,cdp2w10_o17_s5_w5199a344c-88d0-4a85-bfe1-8404ad6bde01,cdp2w10_o17_s5_w4ce1b0121-bfb8-4d2d-a734-981fb05833fb,12,6183
1253,25177.0,25585-B13-5,BRD-K88390751-001-05-5,25585,B13,5,SA1854559,BRD-K88390751,BROAD_CPD_ID,Oc1ccc2c(cc(=O)oc2c1CN1CCCCC1)-c1ccccc1,PODWTADXQSKRMR-UHFFFAOYSA-N,cdp2w11_b13_s5_w2733b8f35-03b9-45ec-bf8c-638d6d1a1996,cdp2w11_b13_s5_w37fd0c924-b783-42e9-9771-19f67a38033f,cdp2w11_b13_s5_w193451a0e-6237-42a9-a705-edf29d97dd64,cdp2w11_b13_s5_w5c5a32314-67db-467d-aa67-28eaf0861b45,cdp2w11_b13_s5_w4c59c13b2-8639-4138-9d48-bf4b1d48dd4b,78,1885
1254,31805.0,25675-K04-3,BRD-K31469986-001-05-2,25675,K04,3,SA1852979,BRD-K31469986,BROAD_CPD_ID,CCN=C(S)N(Cc1ccco1)Cc1cc2cc3OCCOc3cc2nc1O,POGDIIFPZYLQSV-UHFFFAOYSA-N,cdp2w12_k04_s3_w2c7b24f28-bcf0-45cf-bb22-594137d5d1eb,cdp2w12_k04_s3_w3f8b29f57-f4a7-4f26-9bb1-55e09ab8993a,cdp2w12_k04_s3_w1bbdd2129-dfb3-4403-ab1f-a99066dcfd38,cdp2w12_k04_s3_w574e88268-7bc4-48df-b03e-a4b9d0421120,cdp2w12_k04_s3_w44f896579-07e0-4a8b-8df2-539ad14ac17c,59,3216
1255,15827.0,25432-B14-3,BRD-K87157409-001-05-5,25432,B14,3,SA1858277,BRD-K87157409,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)-n1[nH]c(=O)c2ccccc2c1=O,POOVNRMVMWCFKK-UHFFFAOYSA-N,cdp2w10_b14_s3_w2f31ee919-5c11-4309-abce-a5b14ff4cf3d,cdp2w10_b14_s3_w36a020ca3-5527-48d0-852b-9a2fed31404c,cdp2w10_b14_s3_w1d0cb1103-4dba-414c-9204-2f22de7993e2,cdp2w10_b14_s3_w59e690379-6b1e-4554-90af-935cba160a18,cdp2w10_b14_s3_w44e13925e-4229-428d-a65d-3d1fc4a1aff7,35,5214
1256,38360.0,25726-D14-6,BRD-A96444402-001-05-5,25726,D14,6,SA1855353,BRD-A96444402,BROAD_CPD_ID,COC(=O)CN(C)C1CC(=O)N(C1=O)c1ccc(Cl)cc1,PORZWAKMDSHJPG-UHFFFAOYSA-N,cdp2w12_d14_s6_w25c24b082-cceb-4c69-adce-63952986abdb,cdp2w12_d14_s6_w3dc43fc37-3822-4d9a-864f-216147b8803a,cdp2w12_d14_s6_w1b470b24f-2d40-4316-a8c5-c776143ce4d6,cdp2w12_d14_s6_w5fab2f884-1607-4057-b09d-68ab11736f10,cdp2w12_d14_s6_w4f8d90331-e930-4bf5-84f6-6566ffbf0aef,55,1986
1257,14158.0,25420-H19-2,BRD-K71329101-001-05-9,25420,H19,2,SA1856477,BRD-K71329101,BROAD_CPD_ID,CCOC(=O)NCCc1c(C)nc2n(nc(C)c2c1C)C(C)(C)C,POSNDLRTSIMCBO-UHFFFAOYSA-N,cdp2w10_h19_s2_w270f894f2-d69d-4b33-b49f-7d10f6118de2,cdp2w10_h19_s2_w3fd65240f-bbaa-486f-835b-bd603524b180,cdp2w10_h19_s2_w1b7f4dab1-b5b3-44ee-996d-716efc1870b6,cdp2w10_h19_s2_w54a6adcb6-92a6-494f-b57b-1b0296b717cd,cdp2w10_h19_s2_w4b9a2189e-d027-4294-8ed6-f60f41c71e22,63,1684
1258,4871.0,24310-G14-6,BRD-K48970916-001-03-0,24310,G14,6,SA82854,danazol,INN,C[C@]12CC[C@H]3[C@@H](CCC4=Cc5oncc5C[C@]34C)[C@@H]1CC[C@@]2(O)C#C,POZRVZJJTULAOH-LHZXLZLDSA-N,cdp2bioactives_g14_s6_w2d60c8571-ff59-46f8-a620-e7ed755dddb5,cdp2bioactives_g14_s6_w3759ab119-736c-4d22-b444-dc8c2335834b,cdp2bioactives_g14_s6_w11e338d63-144f-459d-9a74-4de01f305de3,cdp2bioactives_g14_s6_w5ed73ab35-19ec-4bd2-950e-94b3ae4e6227,cdp2bioactives_g14_s6_w435e19d36-61ea-4987-b7a7-6a7f8d292881,125,1056
1259,34905.0,25689-B21-1,BRD-K67748685-001-06-8,25689,B21,1,SA1862236,BRD-K67748685,BROAD_CPD_ID,O=C(NCc1nc(no1)-c1ccccc1)c1cccs1,PPJTWHARWSRTBQ-UHFFFAOYSA-N,cdp2w12_b21_s1_w259483fc8-04d8-4a07-a556-6f14857f41b1,cdp2w12_b21_s1_w39f67dda4-476a-42e6-ae6f-bb50a824b206,cdp2w12_b21_s1_w14ca17dea-4f4f-494d-8f8c-885bf2aa411f,cdp2w12_b21_s1_w5ade4740e-11f6-4e3f-a494-532c1e0f4513,cdp2w12_b21_s1_w4c7dd49d8-c2c4-472e-8c35-63a81043cad8,58,6838
1260,31258.0,25667-M14-2,BRD-A45839063-001-05-8,25667,M14,2,SA1857078,BRD-A45839063,BROAD_CPD_ID,COCC(C)NC1=NN=C(CS1)c1c[nH]c2ccccc12,PPMUCCOJGIQBCN-UHFFFAOYSA-N,cdp2w12_m14_s2_w2c8b9071d-c47e-4170-8673-6beae1c09b03,cdp2w12_m14_s2_w366440c08-94ee-43a6-917b-cf841ac102a4,cdp2w12_m14_s2_w1cccaf54e-8013-41a5-b595-8c4d09f59ccf,cdp2w12_m14_s2_w5b12ee75b-8c07-42ec-80cf-101a5bbf18f4,cdp2w12_m14_s2_w47f0d9413-0733-4d86-9021-6663ed8037ee,77,7925
1261,13347.0,25414-K11-1,BRD-K25751806-001-04-2,25414,K11,1,SA1860546,BRD-K25751806,BROAD_CPD_ID,COc1ccccc1CNC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2cccnc12,PPOUFWVZSOTONG-UHFFFAOYSA-N,cdp2w10_k11_s1_w2587906a6-70b1-40bc-9edb-f0f91a4b0974,cdp2w10_k11_s1_w3776defe7-c973-4aff-9916-2be32e63ea59,cdp2w10_k11_s1_w1b501bff1-29a5-469f-abcf-10454031ee58,cdp2w10_k11_s1_w526fdc3b7-cce9-45e5-a8e5-c3a7c80ac894,cdp2w10_k11_s1_w42441777e-3f8d-450d-b21a-fe7a91f02bbf,55,5998
1262,38644.0,25738-B12-2,BRD-K59076967-001-06-3,25738,B12,2,SA1853430,BRD-K59076967,BROAD_CPD_ID,Cc1onc(c1C(=O)Nc1sc2CCCc2c1C#N)-c1ccccc1Cl,PPPHOQFSIXVYRL-UHFFFAOYSA-N,cdp2w12_b12_s2_w260c836ed-a519-44ab-8e5e-50dfd1a10b1d,cdp2w12_b12_s2_w39ba99114-38f1-49cb-8d4f-59aaf9bda146,cdp2w12_b12_s2_w1019e7d47-e8db-42d4-a724-32d7b29398c9,cdp2w12_b12_s2_w59fc2821a-4327-44a6-802e-a60c7c9ec173,cdp2w12_b12_s2_w464660776-55a2-4739-a4ea-ba9481adb679,58,7884
1263,45353.0,25992-B21-3,BRD-K61463582-001-02-3,25992,B21,3,SA59082,3-methoxycholanthrene,primary-common,Cc1ccc2cc3c(ccc4ccccc34)c3CCc1c23,PPQNQXQZIWHJRB-UHFFFAOYSA-N,cdp2w8x2_b21_s3_w28d7576f8-8f03-4d7e-bd06-18da0af3c1fd,cdp2w8x2_b21_s3_w3fb935e49-77be-4ee4-bf95-6c16bfa816af,cdp2w8x2_b21_s3_w106289647-7a3b-495f-b053-32bef4c9feaf,cdp2w8x2_b21_s3_w5bf1737a7-d4b7-4a91-8d53-7a51b8224c16,cdp2w8x2_b21_s3_w41fcdcefc-9ac0-4138-99f6-e1edc8350d7a,40,465
1264,41619.0,25966-E05-1,BRD-K04430056-001-02-9,25966,E05,1,SA59860,7-nitroindazole,primary-common,[O-][N+](=O)c1cccc2cn[nH]c12,PQCAUHUKTBHUSA-UHFFFAOYSA-N,cdp2w8x2_e05_s1_w222954297-3c71-4582-af3b-3bb17543e263,cdp2w8x2_e05_s1_w3d1ca3f93-558e-44e0-9f5a-ca44e82f5ed4,cdp2w8x2_e05_s1_w1ccc5b157-fdad-493e-b48f-febfad118e00,cdp2w8x2_e05_s1_w5056a864d-84a8-4798-a099-e77f2fe8de08,cdp2w8x2_e05_s1_w4e2b966b3-b974-47a8-a9f8-1447971106f5,51,1072
1265,53389.0,26205-P07-5,BRD-K43885503-001-05-9,26205,P07,5,SA1861521,BRD-K43885503,BROAD_CPD_ID,CC(C)Cc1cc([nH]n1)C(=O)N1CCC(CC1)N1CCC(CC1)C(=O)N1CCOCC1,PQDROMHCEFPCMS-UHFFFAOYSA-N,cdp2w9x2-au00026617_p07_s5_w2bb9d429a-79f5-47e8-a21d-238447c08bcc,cdp2w9x2-au00026617_p07_s5_w372b767de-6c52-40ee-b718-e63992a78755,cdp2w9x2-au00026617_p07_s5_w173b457e3-c5fc-46ce-8f0c-8b69b354a746,cdp2w9x2-au00026617_p07_s5_w5dd19bea2-4d3f-4863-af9e-00720496d9ef,cdp2w9x2-au00026617_p07_s5_w4baf515a4-75b0-4303-945e-030fe6b26629,91,9594
1266,14405.0,25422-F13-3,BRD-K44111592-001-05-1,25422,F13,3,SA1862170,BRD-K44111592,BROAD_CPD_ID,Cn1cc(cn1)C(=O)N1CCc2ccccc12,PQLLCYOGQUSCOU-UHFFFAOYSA-N,cdp2w10_f13_s3_w2053adf64-3992-44fa-b122-48d838a2284c,cdp2w10_f13_s3_w333af1489-450c-4889-a958-ba4104c4fc36,cdp2w10_f13_s3_w13367b7b4-385e-487c-8f65-82cbf1dc019b,cdp2w10_f13_s3_w5bce02895-5eb7-49bf-9a33-10ac63193f5d,cdp2w10_f13_s3_w4252b146b-b4bf-403a-b688-11794b76d2ba,85,6000
1267,28596.0,25638-G06-4,BRD-K14392619-001-05-2,25638,G06,4,SA1854769,BRD-K14392619,BROAD_CPD_ID,Cc1ccc(OCC(=O)NNC(=O)Cn2nnc(n2)-c2ccccc2)cc1,PQONJSRKTLAQLC-UHFFFAOYSA-N,cdp2w12_g06_s4_w208540f86-c25d-4e04-8631-c634ffb74bfb,cdp2w12_g06_s4_w3f332bec0-f82c-40f2-9427-761469d2d263,cdp2w12_g06_s4_w1c2a2e829-5881-48a3-b15e-2fa6cbfe310d,cdp2w12_g06_s4_w5639738cc-f174-4c73-8b7f-6b986ae1eb7e,cdp2w12_g06_s4_w4298a5a93-092a-4a55-beda-4801edda2339,61,7147
1268,22478.0,25573-I05-6,BRD-K54005694-001-06-7,25573,I05,6,SA1860162,BRD-K54005694,BROAD_CPD_ID,CC(=O)OCC(=O)c1ccc2ccn(C(C)=O)c2c1,PRLTXVOLFJIINC-UHFFFAOYSA-N,cdp2w11_i05_s6_w29cb1d882-e644-455e-a960-c7ba5fa64278,cdp2w11_i05_s6_w3056f1160-876e-4156-b44a-9346aaea5cbd,cdp2w11_i05_s6_w1d96daaec-d592-4c18-8413-2d8272de897e,cdp2w11_i05_s6_w5a2d04765-19cf-4058-85f9-cd32d9972c22,cdp2w11_i05_s6_w4b0fe0ac0-2f63-4c8e-9a97-9a74eb1192c1,80,2683
1269,19199.0,25553-E08-3,BRD-K59061227-001-05-3,25553,E08,3,SA1855337,BRD-K59061227,BROAD_CPD_ID,FC(F)(F)c1cc(nc2c(cnn12)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1)-c1cccs1,PRONAQWXGYDKCB-UHFFFAOYSA-N,cdp2w11-au00029679_e08_s3_w2eda7e223-52ca-409f-92d2-e28b60e2c4be,cdp2w11-au00029679_e08_s3_w3f17178b0-9270-45c6-89fa-f252296a68b4,cdp2w11-au00029679_e08_s3_w18ef1c7a9-6b1b-4e58-97b6-7d0c3fd70c64,cdp2w11-au00029679_e08_s3_w573095576-1123-44f8-bc76-2395b76138cc,cdp2w11-au00029679_e08_s3_w43dd7328b-7cda-4196-bd46-7375d8ba58f9,70,8708
1270,33182.0,25680-D14-6,BRD-K22876403-001-06-2,25680,D14,6,SA1859755,BRD-K22876403,BROAD_CPD_ID,O=S(=O)(Nc1ccc(cc1)N1CCOCC1)c1cccs1,PRTSNNYICAXBIW-UHFFFAOYSA-N,cdp2w12_d14_s6_w265a8a7cc-ff80-4d34-a7b2-a77768c63f71,cdp2w12_d14_s6_w35e711efe-e11f-4c21-a424-2e43932bb852,cdp2w12_d14_s6_w1d26feedc-a404-4308-a80d-892489fd3786,cdp2w12_d14_s6_w590c7a25b-9a9a-44ac-9b76-21a3ec555240,cdp2w12_d14_s6_w47abecc76-bb38-4103-8e7d-1f04be258544,37,9532
1272,3198.0,24305-L09-1,BRD-K12630395-001-03-2,24305,L09,1,SA792357,harmane,primary-common,Cc1nccc2c3ccccc3[nH]c12,PSFDQSOCUJVVGF-UHFFFAOYSA-N,cdp2bioactives_l09_s1_w2e477cd40-a2fd-462d-9191-090740c6488c,cdp2bioactives_l09_s1_w392209449-556c-45d8-bb8d-d4f98dca8e3f,cdp2bioactives_l09_s1_w1c24d79c0-7e51-4bca-82c4-1756bc2386b3,cdp2bioactives_l09_s1_w508c04859-f700-4740-99fb-693c7b8dec8d,cdp2bioactives_l09_s1_w4000f7c3f-989c-45a9-8af4-77a7ab502fcc,121,155
1273,34139.0,25683-P09-3,BRD-A48081261-001-03-9,25683,P09,3,SA1854291,BRD-A48081261,BROAD_CPD_ID,CC1Cc2ccccc2N1C(=O)CSc1nnc(NC(=O)Cc2cccs2)s1,PSLMFSOEBNFDQW-UHFFFAOYSA-N,cdp2w12_p09_s3_w24f2ab33f-de91-472d-9861-b23179507215,cdp2w12_p09_s3_w3370eede5-aec5-4d84-b203-4bc3598068f8,cdp2w12_p09_s3_w19a7bf3ad-10d9-4ad9-9a2e-5ffcaaabd620,cdp2w12_p09_s3_w50810d482-4313-4567-a934-e286f1d4b54e,cdp2w12_p09_s3_w4a55e1fdd-935a-4380-a042-5a667b7612d7,53,2224
1274,30538.0,25664-H18-2,BRD-K11474067-001-06-6,25664,H18,2,SA1856472,BRD-K11474067,BROAD_CPD_ID,COc1cccc(Nc2c(F)c(F)c(F)c(F)c2C(O)=O)c1,PSRYBZDEEXBKMI-UHFFFAOYSA-N,cdp2w12_h18_s2_w294af8305-d9ed-4b91-a1ed-a5ad33032c9d,cdp2w12_h18_s2_w31dfb6769-8266-47be-9aaa-d6089a38baa2,cdp2w12_h18_s2_w1e8439fc1-c06f-48e0-bcea-18c42b9a6e9b,cdp2w12_h18_s2_w51c19a6df-c018-4b26-a3dd-cda5ab329cfd,cdp2w12_h18_s2_w450090d3b-4433-40d8-a34a-5bbc11c9ddd2,88,1798
1275,22430.0,25573-G05-6,BRD-K22565782-001-05-4,25573,G05,6,SA1859953,BRD-K22565782,BROAD_CPD_ID,Clc1cccc(NC(=O)Nc2ccc(cc2)C(=O)N2CCOCC2)c1,PSZFDQQWUGYIAD-UHFFFAOYSA-N,cdp2w11_g05_s6_w27270749c-517c-4b1f-9c14-3a2e99b1532c,cdp2w11_g05_s6_w318b2bf35-6bef-4faa-a493-6be193947cfa,cdp2w11_g05_s6_w1057cc7ce-26bd-4307-a929-b4bcaa342905,cdp2w11_g05_s6_w5588896ad-b637-4dca-9aad-49f6a4cd2393,cdp2w11_g05_s6_w4b50bd4ad-ee4f-40e8-b3e9-82e40f026ea0,65,7439
1276,8397.0,24642-D07-1,BRD-K14124956-001-01-9,24642,D07,1,SA848281,BRD-K14124956,BROAD_CPD_ID,CNC[C@H]1Oc2cc(ccc2S(=O)(=O)N(C[C@@H]1C)[C@H](C)CO)C#CC1CCCCC1,PTEAFCJBUOPAHG-NJNPRVFISA-N,cdp2w3_d07_s1_w2540e2b36-3bbd-415e-8614-68b7871a9310,cdp2w3_d07_s1_w31d019c39-8b61-4267-9cf1-5020095745f3,cdp2w3_d07_s1_w105c97c75-0ebe-4547-a041-98b86062294d,cdp2w3_d07_s1_w5def4567e-9145-4a3d-8a9d-f957406db4d6,cdp2w3_d07_s1_w4a3a62d10-eaf3-43be-9eb7-f77b644d8d21,36,10366
1277,48223.0,26115-H19-5,BRD-A98673575-001-05-8,26115,H19,5,SA1858612,BRD-A98673575,BROAD_CPD_ID,CC(C)(C)NC(=O)c1ccc(NC(=O)C2COc3ccccc3O2)cc1,PTFVLKUZOCJAQV-UHFFFAOYSA-N,cdp2w9x2_h19_s5_w20f81a884-1528-479c-86b3-0d401ed201bf,cdp2w9x2_h19_s5_w3a367a753-03fc-4341-b0f8-ee621b04de58,cdp2w9x2_h19_s5_w152015e11-8fbb-4edf-8a7d-4591ce281546,cdp2w9x2_h19_s5_w5399d215f-0dbe-4b7a-b1db-50edb104a566,cdp2w9x2_h19_s5_w4a3abb7e7-32d4-442c-9947-38c607f7a5b8,51,7091
1278,37943.0,25725-A17-3,BRD-K59420052-001-05-1,25725,A17,3,SA1858773,BRD-K59420052,BROAD_CPD_ID,Fc1ccc(NC(=O)N2CCc3ccccc3C2)cc1,PTKRIJQZPBQGGV-UHFFFAOYSA-N,cdp2w12_a17_s3_w2e32f2378-03ff-477e-be84-3a7524e83b1b,cdp2w12_a17_s3_w3315793c0-6254-43ef-bd5c-7b3198d37a71,cdp2w12_a17_s3_w17d85a63e-1bfc-400d-b105-a7da98f9a3ca,cdp2w12_a17_s3_w54de2735d-cebd-40ef-8bd7-46f29bb3f68c,cdp2w12_a17_s3_w46fba85e0-6a25-4a7e-a8d6-eb6664e7068c,57,5020
1279,34561.0,25688-C04-5,BRD-K08747234-001-07-6,25688,C04,5,SA1854382,BRD-K08747234,BROAD_CPD_ID,OCc1ccc(CO[C@@H]2C[C@@H](C=C(O2)C(=O)N2CCN(Cc3ccccc3)CC2)c2csc3ccccc23)cc1,PTTHOVHGPPERMY-ZUKKLESISA-N,cdp2w12_c04_s5_w29bf7639e-18e2-40a0-9ede-e74f75a81095,cdp2w12_c04_s5_w353e7366f-eeb9-4cd1-b541-8446fac25473,cdp2w12_c04_s5_w1ecb65456-ede7-4874-bc5b-109955298f82,cdp2w12_c04_s5_w55e58ae19-96c9-488d-9478-898871b1aa0c,cdp2w12_c04_s5_w44175c10d-04f1-4d31-bf06-957dd9b3eacc,73,6715
1280,39985.0,25943-J23-5,BRD-A29349577-001-04-0,25943,J23,5,SA59308,dropropizine,INN,OCC(O)CN1CCN(CC1)c1ccccc1,PTVWPYVOOKLBCG-UHFFFAOYSA-N,cdp2w8x2_j23_s5_w2d2100366-5658-43e8-a749-67e5de4c7871,cdp2w8x2_j23_s5_w3441a24bb-f606-4ed5-b19b-ce5edc4ddbed,cdp2w8x2_j23_s5_w16af679dc-f717-4338-a004-6cc5a9943d87,cdp2w8x2_j23_s5_w530a6c201-1b5a-4666-ab32-95fc1604e6ee,cdp2w8x2_j23_s5_w4bbeffd24-8716-46b8-80fe-f37072e78bf5,68,875
1281,12255.0,25406-C11-1,BRD-K90537228-001-05-2,25406,C11,1,SA1854119,BRD-K90537228,BROAD_CPD_ID,Brc1cc(Br)c2nc(ccc2c1)-c1cccs1,PTYRKABTXKOOKE-UHFFFAOYSA-N,cdp2w10_c11_s1_w2b0460452-c75f-4fea-a9df-335f2c96036a,cdp2w10_c11_s1_w3a65fd60b-b7a6-4222-8be1-bdd03c6e339b,cdp2w10_c11_s1_w1fc187819-33e3-4072-9048-4ca35b4798d7,cdp2w10_c11_s1_w51deea0e5-565b-40e4-a45b-d3fc01630b84,cdp2w10_c11_s1_w4e313adba-9c33-4347-88a5-d5b0b1e2b950,52,5334
1282,9725.0,25372-F21-3,BRD-K44335043-001-05-1,25372,F21,3,SA1852922,BRD-K44335043,BROAD_CPD_ID,c1ccc(cc1)-c1nccnc1-c1ccccc1,PTZIVVDMBCVSMR-UHFFFAOYSA-N,cdp2w10_f21_s3_w23a0250df-d4cf-4518-9ca1-1406a617e979,cdp2w10_f21_s3_w310c98e5e-32ea-43e0-8287-21cf57d8a106,cdp2w10_f21_s3_w1e0fa6602-5442-4221-8d61-1a420814883c,cdp2w10_f21_s3_w50406943e-8c48-40a2-a798-b3643ad0a2f2,cdp2w10_f21_s3_w47efa020f-9667-485d-bba9-251184e34e87,53,531
1283,9285.0,24740-B04-1,BRD-K75073374-001-02-6,24740,B04,1,SA667174,BRD-K75073374,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(C)(=O)=O)OCc2cn(CCCC1=O)nn2,PUHFBKBPROGAIN-FMKPAKJESA-N,cdp2w5_b04_s1_w2b492c52b-39a3-4355-a32e-8a7d120c9815,cdp2w5_b04_s1_w32e252b80-9a11-4b85-a102-cf8a9151907a,cdp2w5_b04_s1_w19356079a-a4e9-45de-aeb5-fe65d855e67a,cdp2w5_b04_s1_w5d10640a5-1044-4a09-9644-1b116aa88541,cdp2w5_b04_s1_w441de331d-7574-4bab-9b6f-a1729a6787ec,57,9797
1284,15433.0,25428-L22-5,BRD-K29356312-001-05-0,25428,L22,5,SA1860455,BRD-K29356312,BROAD_CPD_ID,O=C(Nc1ccc2OCOc2c1)c1ccc(CN2CCOCC2)cc1,PUOGDXPWFUYYGN-UHFFFAOYSA-N,cdp2w10_l22_s5_w20dbc2f1c-33a8-4117-af7f-0cd38844629a,cdp2w10_l22_s5_w3803f5d30-2ca1-440d-9b36-bf75df0be344,cdp2w10_l22_s5_w1c9e25dd5-8de0-45e9-befc-2f67cf27979a,cdp2w10_l22_s5_w5ca15b983-cb4d-4bf7-8944-4c0e461f1ac7,cdp2w10_l22_s5_w4eb31e38c-a0b2-4d39-a0a7-e193f1ea09b4,66,2014
1285,19002.0,25503-L05-4,BRD-A27931246-001-05-5,25503,L05,4,SA1854156,BRD-A27931246,BROAD_CPD_ID,COc1ccc(cc1)N1CCC(CNC(=O)Nc2ccc(Cl)cc2)C1,PVAFMKDKWQMBLH-UHFFFAOYSA-N,cdp2w11-au00029680_l05_s4_w28458490f-c166-4536-a115-b248d50124c0,cdp2w11-au00029680_l05_s4_w3d205bee9-6268-4f07-9146-a3f004a57855,cdp2w11-au00029680_l05_s4_w1f3ae65f0-47de-4040-904a-852f919388f0,cdp2w11-au00029680_l05_s4_w5ff16da6f-ec38-4216-8b23-748f9f8c2465,cdp2w11-au00029680_l05_s4_w4c763b9f9-12f0-406e-87a8-b390efb9122c,61,4191
1286,29273.0,25641-K07-3,BRD-A95480808-001-05-0,25641,K07,3,SA1854167,BRD-A95480808,BROAD_CPD_ID,COc1ccc(cc1)C(NC(=O)C(C)C)c1c(O)ccc2ccccc12,PVVXKVZDFCYHSG-UHFFFAOYSA-N,cdp2w12_k07_s3_w22a9265b9-097e-4f54-9ea2-c9134b7fb872,cdp2w12_k07_s3_w3af8f113f-7083-43d3-9944-2a8edbf21008,cdp2w12_k07_s3_w159662a12-b5c8-4252-a604-92c76080b8c3,cdp2w12_k07_s3_w513429ee9-835f-4366-880a-230755f6ca10,cdp2w12_k07_s3_w4e41dbebc-c551-4f24-bc90-9017264a226c,55,3357
1287,25352.0,25585-I14-6,BRD-K83303188-001-06-4,25585,I14,6,SA1853262,BRD-K83303188,BROAD_CPD_ID,COc1ccc(C(=O)OCc2csc(C)n2)c(O)c1,PWJJFOPAFDHVEW-UHFFFAOYSA-N,cdp2w11_i14_s6_w2609d3804-bf09-41fc-9c76-d189b7e80086,cdp2w11_i14_s6_w3fe266e4c-f5ea-4c18-a879-fe546cc756a8,cdp2w11_i14_s6_w17f6bf604-34bb-4a18-8fff-1e4a4f199668,cdp2w11_i14_s6_w50efe741d-a97e-44ef-b2ed-2b26cba69039,cdp2w11_i14_s6_w4bb2934d3-fd5b-43f1-a195-bc5113887d86,78,2519
1288,34218.0,25686-C15-4,BRD-K36020099-001-06-0,25686,C15,4,SA1857158,BRD-K36020099,BROAD_CPD_ID,CC(=O)N1CCc2cc3nc(C)cc(C)c3cc12,PWJUBTOPMCVVII-UHFFFAOYSA-N,cdp2w12_c15_s4_w2d10c36fc-2fe8-4924-8b76-8dde076faead,cdp2w12_c15_s4_w39b242d41-8abc-4ab1-a918-24c5c4babc4f,cdp2w12_c15_s4_w14de8b26c-8206-4b50-8473-0d59d614810d,cdp2w12_c15_s4_w5b24277d0-f659-4f0e-9548-f9d0790b5455,cdp2w12_c15_s4_w4bd5b5c81-6a5a-4aa8-8d96-73f3b8eae4bb,36,4407
1289,32804.0,25678-P19-6,BRD-K17547979-001-05-2,25678,P19,6,SA1861673,BRD-K17547979,BROAD_CPD_ID,COc1ccc(cc1[N+]([O-])=O)C(=O)NC(=S)Nc1cccc(Cl)c1N1CCOCC1,PWVCXEQGHKHDHR-UHFFFAOYSA-N,cdp2w12_p19_s6_w2e65a0f29-6bb4-48f3-bc2c-2e539048c3c6,cdp2w12_p19_s6_w3237e030c-ce8e-441d-8281-1a061206c3c4,cdp2w12_p19_s6_w16ef35b05-80e3-437b-b7c6-97cd26e88423,cdp2w12_p19_s6_w5256e7ba8-42e5-469e-a1ad-36cc4a5d28e0,cdp2w12_p19_s6_w4baadf29e-7519-43e5-8dc4-390fb8f5ba2b,42,7505
1290,19347.0,25553-L18-1,BRD-K30947691-001-05-4,25553,L18,1,SA1856794,BRD-K30947691,BROAD_CPD_ID,O=C(CCn1c(=O)n(CC(=O)OCc2ccccc2)c2ccsc2c1=O)NCc1ccco1,PXKPYBQMLXOGSL-UHFFFAOYSA-N,cdp2w11-au00029679_l18_s1_w287258f9b-b3c4-4ee4-ac2d-751cb24182f0,cdp2w11-au00029679_l18_s1_w3a25f3ed6-0b8d-4014-b116-a85a0bd70e65,cdp2w11-au00029679_l18_s1_w1a5ccd926-f3be-44fc-8703-384aa75eff4b,cdp2w11-au00029679_l18_s1_w571cba68a-6152-4bbd-9b9d-7cf3df39fa25,cdp2w11-au00029679_l18_s1_w4a265d8b0-bf63-4657-aced-32c33131f0e2,84,3852
1291,44147.0,25987-M11-3,BRD-K55748775-001-01-4,25987,M11,3,SA792592,SCH 28080,to-be-curated,Cc1nc2c(OCc3ccccc3)cccn2c1CC#N,PYKJFEPAUKAXNN-UHFFFAOYSA-N,cdp2w8x2_m11_s3_w2ec8d390a-ba64-4adc-ab5a-c1e38b0d427d,cdp2w8x2_m11_s3_w309332093-1df3-4cf7-a4d7-1ce60eb98802,cdp2w8x2_m11_s3_w1372db333-8fde-43a7-8028-eec33b6a80b7,cdp2w8x2_m11_s3_w59b100f10-9a70-4c4a-84ae-4daaafbdc05c,cdp2w8x2_m11_s3_w4f04163e6-911b-42c0-9e58-0ed16edc67f4,69,515
1292,26234.0,25590-N15-6,BRD-K19923229-001-06-9,25590,N15,6,SA1852112,BRD-K19923229,BROAD_CPD_ID,Cc1cc(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)nc(N)n1,PYLQFLPNCXPNNY-UHFFFAOYSA-N,cdp2w11_n15_s6_w2c7dfafe2-9887-44d9-85e0-02e83e93d895,cdp2w11_n15_s6_w3448181b1-825d-44b3-b4c3-59ba601be6a4,cdp2w11_n15_s6_w150e5a257-6ca9-4b06-ae0d-ed15361eabad,cdp2w11_n15_s6_w500d316b4-26a7-45b0-a851-2dda8b76e4dc,cdp2w11_n15_s6_w46174f12c-0d03-4c49-8eab-436698645ce4,61,2190
1293,31723.0,25675-G10-5,BRD-K48696144-001-05-0,25675,G10,5,SA1857289,BRD-K48696144,BROAD_CPD_ID,O=C(Nc1nnc(CCN2CCOCC2)s1)C1CCCCC1,PYPJIIUVKAJBGL-UHFFFAOYSA-N,cdp2w12_g10_s5_w2c8410a05-9ace-481e-ac7c-f14571739afc,cdp2w12_g10_s5_w38424a62c-fe4f-47bd-8d97-25bdb5b60df5,cdp2w12_g10_s5_w139b9714a-7d4a-4532-a514-8292765ed48c,cdp2w12_g10_s5_w5938f64f9-9a66-432b-9773-cf974b3e28b3,cdp2w12_g10_s5_w4f8a174fd-659d-487f-9b82-c6c5041d85ee,63,8995
1294,51127.0,26159-G06-5,BRD-K16885048-001-07-0,26159,G06,5,SA1856494,BRD-K16885048,BROAD_CPD_ID,CCNc1nc(C)c(CN(C(C)=O)c2ccccc2)nc1C#N,PYXLLRIFIPALBS-UHFFFAOYSA-N,cdp2w9x2-au00026617_g06_s5_w295f8845f-636a-4306-a49d-2556973f0382,cdp2w9x2-au00026617_g06_s5_w34a0afb0d-05ab-4001-aa7b-7de31a8d298e,cdp2w9x2-au00026617_g06_s5_w16ba36a2c-e12e-48e5-b08f-6b42d91f47f2,cdp2w9x2-au00026617_g06_s5_w526d6f956-b8e3-4738-b6f7-3da450b41aa9,cdp2w9x2-au00026617_g06_s5_w49d6c41a7-cf0c-4038-9025-96247e661c21,60,6729
1295,1402.0,24294-E06-5,BRD-A11776908-001-03-6,24294,E06,5,SA83709,enilconazole,INN,Clc1ccc(C(Cn2ccnc2)OCC=C)c(Cl)c1,PZBPKYOVPCNPJY-UHFFFAOYSA-N,cdp2bioactives_e06_s5_w21d05814e-06b7-48b3-8a4b-71f777bcff80,cdp2bioactives_e06_s5_w3237bd926-d784-4fc2-87f1-babd8a755d3e,cdp2bioactives_e06_s5_w1cb700e12-bd08-407c-a2e6-50ec46320d27,cdp2bioactives_e06_s5_w51aa50d99-f72e-4139-a9ec-e9db70ae6080,cdp2bioactives_e06_s5_w418e1815e-9c9e-4942-b88d-e0b4d00a512a,86,892
1296,24583.0,25583-E16-5,BRD-K69203373-001-05-1,25583,E16,5,SA1858625,BRD-K69203373,BROAD_CPD_ID,COc1ccc(cc1)\C=C1\SC(=S)N(C1=O)n1c(C)ccc1C,PZOXRWHIFUFFGV-XNTDXEJSSA-N,cdp2w11_e16_s5_w24aa2b171-69f8-4fdb-9c12-52283837b050,cdp2w11_e16_s5_w3b99552dc-f022-4e34-85d8-50aeb71b8010,cdp2w11_e16_s5_w12f966581-5408-4d2a-8f69-026b92e18b54,cdp2w11_e16_s5_w5547e67f0-e122-4b23-960b-a61c1a4c583e,cdp2w11_e16_s5_w4f82c146d-4d43-4eaa-9675-d3dc37e00ffb,76,7763
1297,47629.0,26107-K22-5,BRD-K15378071-001-06-9,26107,K22,5,SA1860890,BRD-K15378071,BROAD_CPD_ID,Cc1ccc(OCC(=O)Nc2ccc(cc2)-c2oc3cccnc3n2)cc1,PZSJAZISEBOWAH-UHFFFAOYSA-N,cdp2w9x2_k22_s5_w23555bc26-fd4d-4fff-bbe8-4f2ace0cd903,cdp2w9x2_k22_s5_w3011e223b-a621-4e40-9aa8-42aad630780d,cdp2w9x2_k22_s5_w1a3ffe826-68b1-4c1f-93bd-42b6440f8084,cdp2w9x2_k22_s5_w52fd39e20-a916-4780-9a3d-05d0f044a1ca,cdp2w9x2_k22_s5_w4e96b2888-eb16-4bcf-9954-b12ce04b9c44,39,8636
1298,6013.0,24319-K20-2,BRD-K72066653-001-02-5,24319,K20,2,SA58966,derrusnin,primary-common,COc1cc(OC)c2c(OC)c(-c3ccc4OCOc4c3)c(=O)oc2c1,PZYZNVLXKYMURF-UHFFFAOYSA-N,cdp2bioactives_k20_s2_w2862ff67b-8457-4252-9bf6-700252ca67ef,cdp2bioactives_k20_s2_w35b0e999e-c9be-486f-a7b6-932ad12e23c9,cdp2bioactives_k20_s2_w1730e68e9-6048-4afa-b4fe-ad7e44facfdc,cdp2bioactives_k20_s2_w55da3202c-fa00-4a76-b738-f449572182f2,cdp2bioactives_k20_s2_w428126dcd-6829-470b-973b-94bc13211716,106,7292
1299,47323.0,26092-M08-5,BRD-K45350681-001-06-4,26092,M08,5,SA1855441,BRD-K45350681,BROAD_CPD_ID,ON1N(c2cc(no2)-c2cccc(Cl)c2)C(=O)Nc2ccccc12,QAIWDUVAMGXTMG-UHFFFAOYSA-N,cdp2w9-au00026609_m08_s5_w270092e9e-b94b-45a1-ae5b-7fd40948f5b0,cdp2w9-au00026609_m08_s5_w37cd60aea-42f5-442f-a95d-81c6ac4e6e5c,cdp2w9-au00026609_m08_s5_w195773c56-9c06-42ca-ba14-4940afebac14,cdp2w9-au00026609_m08_s5_w50f2b494d-09c9-4996-8442-a4cfaa6bedbe,cdp2w9-au00026609_m08_s5_w4c91806cc-f185-46e8-80d4-749c3baead62,27,6088
1300,22536.0,25573-L12-4,BRD-K90675977-001-05-3,25573,L12,4,SA1855812,BRD-K90675977,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)NCCC(=O)NCc1ccccc1,QALLGHGEBNUBRQ-UHFFFAOYSA-N,cdp2w11_l12_s4_w239f689d4-c1e4-4c87-b862-7ab96b9909a9,cdp2w11_l12_s4_w3e53cd44b-72ff-43a4-aede-99bdebddf8e6,cdp2w11_l12_s4_w10aef2fc9-e8a4-474c-a798-856f5a88414a,cdp2w11_l12_s4_w572884941-bed4-4e9a-ba51-082701b1a43d,cdp2w11_l12_s4_w4e7ee0fb4-6790-431c-9550-538ce910e4cc,69,3865
1301,43676.0,25985-O09-6,BRD-K58938839-001-03-8,25985,O09,6,SA82317,cyclopamine,primary-common,C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2O[C@]11CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC2=C1C,QASFUMOKHFSJGL-LAFRSMQTSA-N,cdp2w8x2_o09_s6_w27a3873a6-d434-42af-b82e-b9ff907c469b,cdp2w8x2_o09_s6_w300bcc62c-a252-44a2-a3d3-06e79c620645,cdp2w8x2_o09_s6_w1da079835-011f-4ae1-9326-31a14c2f4162,cdp2w8x2_o09_s6_w55413081c-81b2-4139-9b60-bffb56a0d2fc,cdp2w8x2_o09_s6_w4d8efeb1f-f3be-4aec-b44f-bb2df4db766e,40,1103
1302,24735.0,25583-M15-1,BRD-A02131228-001-05-3,25583,M15,1,SA1862132,BRD-A02131228,BROAD_CPD_ID,O=C(Nc1ccccc1)C1C2CCCC\C=C/C12,QAUWUDWLPNVUBH-POHAHGRESA-N,cdp2w11_m15_s1_w2004879a1-cf87-493b-a5ac-30dba9d9a34f,cdp2w11_m15_s1_w3b8b65ae4-f58f-4407-9574-1898076a4761,cdp2w11_m15_s1_w143eaee4e-2f10-4740-82bb-e6db9eeb501d,cdp2w11_m15_s1_w54c097b8e-6d36-4797-93ed-98171eb6ae54,cdp2w11_m15_s1_w4938ab78c-fffb-4089-afb3-8b5d049faa45,56,5369
1303,47772.0,26110-D18-4,BRD-K03549232-001-06-5,26110,D18,4,SA1855117,BRD-K03549232,BROAD_CPD_ID,CC(C)Cn1c(nc2ccccc12)N1CCN(CC1)C(=O)\C=C\c1ccccc1,QBHTUAJZNQZEGR-OUKQBFOZSA-N,cdp2w9x2_d18_s4_w2c0186b75-7ed7-462e-8800-2bdb8fa5e2a8,cdp2w9x2_d18_s4_w3a5bd37fd-c3ba-4066-92f7-e022753be4a0,cdp2w9x2_d18_s4_w1e23affc6-3541-4276-b4c5-d622e7a35852,cdp2w9x2_d18_s4_w56b087a94-1b1e-422c-9b26-704717363ebd,cdp2w9x2_d18_s4_w44b15703f-74ef-4d75-9da0-a6a3af08d13a,82,4885
1304,27317.0,25594-I14-3,BRD-A36938160-001-05-1,25594,I14,3,SA1860605,BRD-A36938160,BROAD_CPD_ID,ON1C2CCCCC2N(O)C(=O)C1=O,QBIMPGNQKASPJE-UHFFFAOYSA-N,cdp2w11_i14_s3_w2a8521243-63cd-4a6d-84a5-6fb4e4fc29e2,cdp2w11_i14_s3_w3a2367a7a-87be-443c-a7b2-22b8aa49c0c9,cdp2w11_i14_s3_w1de07fb56-930a-479f-a5d4-356ccc8ede46,cdp2w11_i14_s3_w516b20655-8a40-4daa-9f73-fdaafb533a78,cdp2w11_i14_s3_w460ccb54b-0812-4d4f-a0e6-dd978e672130,52,2888
1305,22648.0,25575-B11-2,BRD-A57520205-001-05-8,25575,B11,2,SA1854988,BRD-A57520205,BROAD_CPD_ID,CC1CCc2c(C1)scc2C(=O)Nc1nnc(C)s1,QBJHONOUTKNSLO-UHFFFAOYSA-N,cdp2w11_b11_s2_w2e8f2ab9c-81cb-49f9-b7ef-7497f10f27b9,cdp2w11_b11_s2_w33fe6e2c2-21c2-498e-8266-f0abdf4b2dc8,cdp2w11_b11_s2_w17d7317e6-85a3-4318-b6f5-c6c33062171b,cdp2w11_b11_s2_w540ab67da-c314-46c9-bcfa-be2a41df04d6,cdp2w11_b11_s2_w44673ca4f-e010-40f2-ab5c-9cd0cce393a5,49,4389
1306,17.0,24277-A20-6,BRD-K19295594-001-04-4,24277,A20,6,SA58982,gossypol,primary-common,CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O,QBKSWRVVCFFDOT-UHFFFAOYSA-N,cdp2bioactives_a20_s6_w23dac7fe8-828e-43d8-9feb-48c7fd6a2a13,cdp2bioactives_a20_s6_w31672ee9f-8faf-42c3-8428-5d05ee3dad93,cdp2bioactives_a20_s6_w18bb47a95-d867-4ef9-b506-84ba3b13c796,cdp2bioactives_a20_s6_w5458451a2-da71-4e9d-92ed-8431207e10aa,cdp2bioactives_a20_s6_w446bcc67b-a843-4081-8b60-8f469198db30,85,542
1307,37965.0,25725-B20-1,BRD-K50920395-001-05-5,25725,B20,1,SA1860828,BRD-K50920395,BROAD_CPD_ID,CCOC(=O)C1CCN(CC1)C(=O)c1cnn2c(C)cc(C)nc12,QBSPUVMXBWTPCN-UHFFFAOYSA-N,cdp2w12_b20_s1_w2d4c906a9-8980-4b73-8d43-4c38cb72be0b,cdp2w12_b20_s1_w39dc42008-eed9-4ca2-8cb9-f54a9ff397cf,cdp2w12_b20_s1_w1391a105a-ecb7-4381-b3a9-836998f2e59c,cdp2w12_b20_s1_w574b13b46-f6ee-4881-bcce-55214442cc72,cdp2w12_b20_s1_w4d5fe830a-f63a-4a3a-8f03-ccf8df797bd7,41,5047
1308,32061.0,25676-J12-1,BRD-K65985499-001-06-4,25676,J12,1,SA1857722,BRD-K65985499,BROAD_CPD_ID,CC(=O)Nc1ccc2n(cnc2c1)-c1ccc(C)cc1,QBTHFKPSCQLJKV-UHFFFAOYSA-N,cdp2w12_j12_s1_w2a0b9834b-5f2e-413a-8167-de079669cd66,cdp2w12_j12_s1_w3d82f18d4-193e-41af-8710-a8b2a83656c5,cdp2w12_j12_s1_w1c63fc8d0-9abd-482d-a3c7-97acb0ba96f4,cdp2w12_j12_s1_w576f2ad09-d288-4d30-8924-9feccf081566,cdp2w12_j12_s1_w472291fd8-c6d4-429f-968d-055f1f2c29e4,52,6169
1309,26627.0,25592-D13-3,BRD-K86418557-001-05-2,25592,D13,3,SA1853938,BRD-K86418557,BROAD_CPD_ID,COc1ccc(NN=C2C(=O)CC(C)(C)CC2=O)cc1,QBZKKBNWRSLLRY-UHFFFAOYSA-N,cdp2w11_d13_s3_w28d6a0bc6-52a2-4b8a-9c37-a67f361ab1cb,cdp2w11_d13_s3_w32b801fef-a61e-40bb-b0a4-9ad6e76faebf,cdp2w11_d13_s3_w1706f06ef-ba66-4606-bc94-466411fd48ef,cdp2w11_d13_s3_w50e25ca2c-0fac-47e4-b5e6-5b7adcf6b687,cdp2w11_d13_s3_w4a70c5dfc-98f7-4200-b4b1-030277675512,73,4907
1310,37581.0,25708-M20-1,BRD-K84427671-001-05-6,25708,M20,1,SA1854877,BRD-K84427671,BROAD_CPD_ID,CCCCOC(=O)COc1cc(C)cc2oc(=O)c3CCCc3c12,QCSMTHWMEKZWDK-UHFFFAOYSA-N,cdp2w12_m20_s1_w2705604d6-3819-4c39-af03-36ccdeb22986,cdp2w12_m20_s1_w3f3a2b9a0-e676-4f1c-b91f-6c869a36483b,cdp2w12_m20_s1_w1df5bf466-f3cd-403e-baa5-eb56a496989a,cdp2w12_m20_s1_w5c43d1968-7426-4df1-9360-8693b1cc2e1d,cdp2w12_m20_s1_w4a3454e6b-a27e-4bb2-8f8d-e87bc989d468,67,7036
1311,27630.0,25598-G13-4,BRD-K80232129-001-11-0,25598,G13,4,SA1859924,BRD-K80232129,BROAD_CPD_ID,COc1cc(cc(=O)c2c(C)oc(C)c12)-c1cccs1,QDMVZWDWJDRLQK-UHFFFAOYSA-N,cdp2w11_g13_s4_w2b0770cd7-839f-40eb-a95b-46e86eaf6eda,cdp2w11_g13_s4_w322c08fda-247f-48d5-b126-25a56bdf7485,cdp2w11_g13_s4_w164ad4d3b-df91-4671-861a-0e1f3053759f,cdp2w11_g13_s4_w5f4a9e7e0-09b7-4a4e-9498-80f9490adb5b,cdp2w11_g13_s4_w4c78dba89-5c21-48cc-ac25-90afa40a3283,56,8160
1312,22669.0,25575-C07-5,BRD-K41651675-001-05-9,25575,C07,5,SA1859350,BRD-K41651675,BROAD_CPD_ID,CCN(CC)c1ccc(cc1)C(=O)OCC(=O)N1CCN(CC1)c1ccccc1,QDUCWVIFLLKBSB-UHFFFAOYSA-N,cdp2w11_c07_s5_w25f187cf1-9a57-4480-b0f7-c4a260480314,cdp2w11_c07_s5_w3979e0067-47f7-4825-a597-f6db2a2e81d7,cdp2w11_c07_s5_w137a8b95f-9498-4214-9a3b-9b7b2a69b18d,cdp2w11_c07_s5_w5f7476154-555e-4a90-a704-dfa46d520173,cdp2w11_c07_s5_w4c2ac48db-e03f-4899-9a98-cabae4d99ce0,60,3650
1313,38727.0,25738-F21-1,BRD-K35225716-001-05-1,25738,F21,1,SA1861215,BRD-K35225716,BROAD_CPD_ID,Oc1cccc(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)c1,QFEKNTWDMBSFRL-UHFFFAOYSA-N,cdp2w12_f21_s1_w2ab062d23-9b6e-4293-88a7-d2938e58da15,cdp2w12_f21_s1_w361635c2a-646b-433c-bcee-502a173501d8,cdp2w12_f21_s1_w1b3f49120-1c6b-4db9-9658-e391f9dcb822,cdp2w12_f21_s1_w59b667829-95de-49a1-b5f1-2e52a28340d5,cdp2w12_f21_s1_w45130618f-6e8d-4296-8793-b9d22e3d7a96,33,1483
1314,27886.0,25599-D05-2,BRD-K22215695-001-06-0,25599,D05,2,SA1856757,BRD-K22215695,BROAD_CPD_ID,Cc1ccc(Cn2ncc3c(ncnc23)N2CCN(CC2)c2ccccc2C)cc1,QFKWGNHOYQRRKI-UHFFFAOYSA-N,cdp2w11_d05_s2_w2b7fe2446-d7e2-4001-8abb-7bb53eabc036,cdp2w11_d05_s2_w35eecea0d-5073-4f0c-81e1-cd578ef78b3d,cdp2w11_d05_s2_w1a6d8834e-4aa0-4ba2-a924-a56dc89d9a3d,cdp2w11_d05_s2_w55306188f-02b8-4ac2-a683-c613e2ab2f62,cdp2w11_d05_s2_w4d1724941-65f9-42af-bc8f-5684bdb34a27,68,4872
1315,5949.0,24319-F20-4,BRD-K65814004-001-02-3,24319,F20,4,SA82235,diphenyleneiodonium,to-be-curated,[I+]1c2ccccc2-c2ccccc12,QFXKXRXFBRLLPQ-UHFFFAOYSA-N,cdp2bioactives_f20_s4_w22bbeecc4-16f8-450f-8c28-33dc27a919d3,cdp2bioactives_f20_s4_w300b0b6f1-5004-45c4-8e31-38e18a932e87,cdp2bioactives_f20_s4_w1724c2a04-5e51-4a1e-ac47-6a08eb668a81,cdp2bioactives_f20_s4_w5ba76df70-0240-44a0-abfd-47fb8e3fce33,cdp2bioactives_f20_s4_w4fb2a588f-ee59-4acb-8749-8c45399b6ddf,125,960
1316,52145.0,26181-L03-3,BRD-K28900312-001-06-4,26181,L03,3,SA1854155,BRD-K28900312,BROAD_CPD_ID,CCCN(CCC)C(=O)c1ccc2c(c1)[nH]c(=S)n(Cc1ccco1)c2=O,QGIAVUQSFVCLRL-UHFFFAOYSA-N,cdp2w9x2-au00026617_l03_s3_w25f2d1fd8-2d5a-4b2b-8c33-c36b19aea19d,cdp2w9x2-au00026617_l03_s3_w3fda915c5-d5de-4f92-ac70-206406aefc82,cdp2w9x2-au00026617_l03_s3_w1afa581b5-e076-4630-b49b-c12f54c550c9,cdp2w9x2-au00026617_l03_s3_w5941da0fc-a7a1-4ef7-abeb-fb916def8bb1,cdp2w9x2-au00026617_l03_s3_w4a2727ff7-b899-41aa-a9f0-8f7187366fe0,64,7549
1317,53229.0,26205-H09-1,BRD-K22520312-001-05-8,26205,H09,1,SA1860208,BRD-K22520312,BROAD_CPD_ID,Cc1ccc(cc1)-n1c(Cl)c(Cl)[nH]c(=O)c1=O,QHEAMMAWYIVSEH-UHFFFAOYSA-N,cdp2w9x2-au00026617_h09_s1_w28c3b54ab-5da0-4778-a293-c0ac5d0fa3d6,cdp2w9x2-au00026617_h09_s1_w34f6f45f0-17bf-4f80-a60e-71209753cd24,cdp2w9x2-au00026617_h09_s1_w12d0a8043-0a02-444f-8c02-200281c6ddcf,cdp2w9x2-au00026617_h09_s1_w501f7b966-9585-45df-9848-5d94540d248d,cdp2w9x2-au00026617_h09_s1_w4f8cb3cf6-07ad-4a00-8cc5-8164cd52329d,40,1610
1318,28101.0,25599-N16-1,BRD-K59560948-001-05-2,25599,N16,1,SA1861655,BRD-K59560948,BROAD_CPD_ID,COc1ccc(cc1)-n1ncc2c(NCCN3CCOCC3)ncnc12,QHEAREBENILWNA-UHFFFAOYSA-N,cdp2w11_n16_s1_w2de114b16-7f1d-464f-a7a6-ec84573fb1fe,cdp2w11_n16_s1_w36f680d2a-3cf3-487a-aefa-7fbe309490e1,cdp2w11_n16_s1_w1a12b6a5e-404e-4512-96dd-2b5a0ff1e276,cdp2w11_n16_s1_w5dffda13d-f31a-41af-b419-5b0164b6a2ba,cdp2w11_n16_s1_w47f542bfb-6a10-4f88-bf34-405442e13977,88,6004
1319,47276.0,26092-J08-6,BRD-K09450441-001-06-7,26092,J08,6,SA1860411,BRD-K09450441,BROAD_CPD_ID,CNC[C@H](CC1CCCCC1)NC[C@H](CO)NCCc1cccc(c1)C(F)(F)F,QHEJTEZIIWTDPM-LEWJYISDSA-N,cdp2w9-au00026609_j08_s6_w2abe0ce75-d482-44e8-a884-2114aab80fd7,cdp2w9-au00026609_j08_s6_w35847557d-cd7c-4b9a-847f-64653ed063c9,cdp2w9-au00026609_j08_s6_w1d761d37b-48b4-404c-b939-d98c1211b5d3,cdp2w9-au00026609_j08_s6_w5d5db61ed-cc83-439b-af35-a5f38faa29e2,cdp2w9-au00026609_j08_s6_w41fdc4022-c90c-481f-9d1a-07de290a98de,35,6011
1320,8575.0,24645-B20-5,BRD-K90519599-001-02-8,24645,B20,5,SA858975,BRD-K90519599,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)Oc2cc(Br)ccc2S1(=O)=O,QHGLBWHFCGZTIC-IIYDPXPESA-N,cdp2w3_b20_s5_w2f889d9e8-77ee-429e-9f61-f61426ddef33,cdp2w3_b20_s5_w305e93c56-5142-40fe-af99-f93e8fc3eb05,cdp2w3_b20_s5_w1627b376f-025e-4dc8-817e-9bf10a513447,cdp2w3_b20_s5_w5b6a2dd72-0d4a-4c2f-a234-78d6fb2069fc,cdp2w3_b20_s5_w4e9e4f69f-42cf-456f-8448-5ef283a881e0,78,9884
1321,28910.0,25639-H13-6,BRD-K15280583-001-05-0,25639,H13,6,SA1857971,BRD-K15280583,BROAD_CPD_ID,COc1ccccc1N1CCN(CC1)C(=O)CSc1nnc2-c3ccccc3CC(C)(C)n12,QHRLIQVZSCVBLO-UHFFFAOYSA-N,cdp2w12_h13_s6_w2d55cd306-bb20-48bf-8548-fc86289772d9,cdp2w12_h13_s6_w304c63f04-337c-4c7f-aef2-44b5ab52269d,cdp2w12_h13_s6_w1a288edb6-8c2c-40fa-a202-9d0f85aea8a7,cdp2w12_h13_s6_w5bedf56c2-4784-4983-bc7c-97d6e2d47ad0,cdp2w12_h13_s6_w4f881b367-8989-4efd-920f-cb43d4e934be,49,7572
1322,55915.0,26679-O06-5,BRD-K27682976-001-01-7,26679,O06,5,SA419271,BRD-K27682976,BROAD_CPD_ID,COc1ccccc1CN(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@@H]1C)[C@@H](C)CO,QHTRHHVBBSPOHC-SFYKDHMMSA-N,cdp2w13_o06_s5_w21007c1ce-09f0-43c2-8da2-b81f345a7fab,cdp2w13_o06_s5_w3256a176e-0d12-420c-b84d-7620869edc1a,cdp2w13_o06_s5_w185964b71-fbbb-4778-8ff2-f314228f0d63,cdp2w13_o06_s5_w52cbf9cfb-03ca-4c8c-ac41-a2737a15686a,cdp2w13_o06_s5_w49b71d1b4-723a-4c17-b104-2f79f1e3b94c,103,9829
1323,30713.0,25665-B13-3,BRD-A65739997-001-05-6,25665,B13,3,SA1852553,BRD-A65739997,BROAD_CPD_ID,CC(C)NS(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(cc2)C(=O)c2ccccc2)cc1,QIPQZGYKZDHDPJ-UHFFFAOYSA-N,cdp2w12_b13_s3_w21e9e5c24-f264-40d5-8e41-e106cae33a61,cdp2w12_b13_s3_w3dc26c7ae-fc37-4be1-9cb1-0975906c9ccb,cdp2w12_b13_s3_w18d62f58f-5575-4e89-b541-2f42653ce9b2,cdp2w12_b13_s3_w59f66d298-96ab-44e8-9c7b-c676af6d7e13,cdp2w12_b13_s3_w4228ff399-e6aa-4e71-9379-2823308ccc38,79,2175
1324,2835.0,24304-B23-4,BRD-A51829654-001-01-4,24304,B23,4,SA82481,"BRL-15,572",common,OC(CN1CCN(CC1)c1cccc(Cl)c1)C(c1ccccc1)c1ccccc1,QJHCTHPYUOXOGM-UHFFFAOYSA-N,cdp2bioactives_b23_s4_w2c0102083-3319-4e44-bc3b-788d993eb7c9,cdp2bioactives_b23_s4_w3f53e00d5-8e58-4c0c-a64d-6a790b2b8995,cdp2bioactives_b23_s4_w1abadc04c-b95d-4e7c-8ad8-91561df3a9cc,cdp2bioactives_b23_s4_w55a1be824-85ce-4648-a398-a6a26dafd25c,cdp2bioactives_b23_s4_w4786b7a98-c8de-49fa-9675-128fa16bd89d,85,1249
1325,34845.0,25688-P03-1,BRD-K07745565-001-05-4,25688,P03,1,SA1859261,BRD-K07745565,BROAD_CPD_ID,CN=C(S)N(CCc1c(C)[nH]c2ccc(C)cc12)Cc1cccs1,QKCPZWFKHBBANF-UHFFFAOYSA-N,cdp2w12_p03_s1_w29e3e0aa0-715f-4dce-9a5c-ae0fa63b6d7d,cdp2w12_p03_s1_w3b6d3a589-1783-437f-bdfd-32298fbc15aa,cdp2w12_p03_s1_w18d8d2cef-c15f-4ac5-aaee-e8cc26a7e335,cdp2w12_p03_s1_w566cdb592-ff64-44bd-883b-33490453ecc5,cdp2w12_p03_s1_w425640d71-e7db-423a-9e86-f465c3009612,76,7588
1326,26007.0,25588-P18-1,BRD-K68964479-001-07-8,25588,P18,1,SA1859942,BRD-K68964479,BROAD_CPD_ID,Cc1nc(NC(=O)c2ccco2)sc1-c1csc(Nc2ccc(Cl)cc2)n1,QKEWXZJHCYKZLR-UHFFFAOYSA-N,cdp2w11_p18_s1_w20d6b8ff7-7378-48ea-b4fa-23235d15502f,cdp2w11_p18_s1_w337897fed-54cb-4340-a21b-51527b459b4b,cdp2w11_p18_s1_w119ed79d4-1c63-4d3c-9a59-601bd5c25b01,cdp2w11_p18_s1_w525d2f9a7-86ae-42a4-9d5f-2100a7449fae,cdp2w11_p18_s1_w44d60f71d-0b23-4a34-96db-1350e706008a,39,9443
1327,49875.0,26133-I08-1,BRD-K91189798-001-05-1,26133,I08,1,SA1856644,BRD-K91189798,BROAD_CPD_ID,CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc2ccccc2nc1Nc1ccc(O)c(c1)C(O)=O,QKJBNXQNGGHPGN-UHFFFAOYSA-N,cdp2w9x2_i08_s1_w28aba8730-ffc2-401f-8832-36177eddf843,cdp2w9x2_i08_s1_w373ee7689-9487-4eb0-8155-6e5b069cb00f,cdp2w9x2_i08_s1_w14bf23cbf-6951-4ed7-8f69-c9f1f7331101,cdp2w9x2_i08_s1_w580bafd3e-da52-443b-8022-95e628d6b066,cdp2w9x2_i08_s1_w499588dff-18cd-4caa-8b2b-b655441299b2,50,2788
1328,42534.0,25968-J14-4,BRD-K32049721-001-02-8,25968,J14,4,SA59139,lonchocarpic acid,primary-common,COc1c2C=CC(C)(C)Oc2c(CC=C(C)C)c2oc(=O)c(-c3ccc(O)cc3)c(O)c12,QKTFIWUHGFCLHF-UHFFFAOYSA-N,cdp2w8x2_j14_s4_w2d6e0b60c-44ca-4bc6-9b45-b414ea38196c,cdp2w8x2_j14_s4_w3ed6b0afb-34d8-4f6e-9fde-147d4d9be053,cdp2w8x2_j14_s4_w117bdae05-9e3e-4e8c-8449-570e9b1b2610,cdp2w8x2_j14_s4_w52f43a263-f6a2-4741-8f53-b4170710f924,cdp2w8x2_j14_s4_w46aa18060-ae2a-4339-b264-b01f594b2e49,52,7318
1329,28063.0,25599-L20-5,BRD-A20213616-001-04-0,25599,L20,5,SA1854713,BRD-A20213616,BROAD_CPD_ID,CCC(C)Sc1nc(O)c2cnn(-c3ccc(C)c(C)c3)c2n1,QKUVCRKEQJWNGM-UHFFFAOYSA-N,cdp2w11_l20_s5_w28c885b3c-53c6-4264-9401-3660ae4df2a4,cdp2w11_l20_s5_w34c2c01df-09eb-4bca-9d27-3bc95a7a1238,cdp2w11_l20_s5_w17bb019e6-c2ed-43d7-b7a5-e4c128710b0b,cdp2w11_l20_s5_w523ec9063-2f1f-4aa2-90d2-0a7c57a3add3,cdp2w11_l20_s5_w4952db0ec-42dd-4c34-840a-060b5e704731,64,9599
1330,19927.0,25565-J19-5,BRD-K96492506-001-05-7,25565,J19,5,SA1856866,BRD-K96492506,BROAD_CPD_ID,CCN=C(S)NS(=O)(=O)c1ccc(C)cc1,QKXAKHONQHLDJH-UHFFFAOYSA-N,cdp2w11_j19_s5_w214b32b9e-640e-479f-bcbe-3f7715a26f98,cdp2w11_j19_s5_w3b120616d-7dc8-4694-b851-228b3888eda5,cdp2w11_j19_s5_w180c5655f-affa-4362-a2f7-6a7ebc8074a1,cdp2w11_j19_s5_w50b89dedd-2797-4818-809b-935520df8da3,cdp2w11_j19_s5_w416ff4152-a712-4bdb-a9e5-8543792a4f0d,56,5100
1331,21106.0,25569-E03-2,BRD-K90579328-001-06-1,25569,E03,2,SA1858836,BRD-K90579328,BROAD_CPD_ID,COc1cccc(c1)N1CCN(CC1)C(S)=Nc1cc(C)cc(C)c1,QKZLPIJCCJKBPE-UHFFFAOYSA-N,cdp2w11_e03_s2_w20b83d941-bb94-4855-95ca-b0ef7a97bb08,cdp2w11_e03_s2_w3790e453d-9ffa-492a-9adb-e96aa62db761,cdp2w11_e03_s2_w1f30d6288-ff44-4258-aa8f-3ba7428e3d02,cdp2w11_e03_s2_w5c5584b31-16a3-42d9-9f43-ec78ad2e2845,cdp2w11_e03_s2_w45e92762e-ebf7-4f39-a018-072af8738d48,68,2189
1332,30861.0,25665-H14-1,BRD-K00784777-001-05-4,25665,H14,1,SA1856859,BRD-K00784777,BROAD_CPD_ID,NC(=S)c1cc2c(ccc3ccccc23)oc1=N,QLPSUFKUPWGVHY-UHFFFAOYSA-N,cdp2w12_h14_s1_w2fa3c1c0d-de6e-4f01-b00a-63fcb4e71e70,cdp2w12_h14_s1_w3a4e43eb0-f2c4-454f-8911-a13e86a47dfb,cdp2w12_h14_s1_w115d7ceb0-14e9-4625-8658-c50aec47d8d1,cdp2w12_h14_s1_w55aed412e-510f-4611-ab84-5f7af1274141,cdp2w12_h14_s1_w48719a067-ed2c-42f1-9ea4-7b0e1bd26f28,66,6503
1333,13917.0,25418-K03-1,BRD-K62834004-001-05-7,25418,K03,1,SA1852360,BRD-K62834004,BROAD_CPD_ID,CCOC(=O)c1ccc(CC(=O)c2oc3cc(O)ccc3c2C)o1,QLROMLCJNZEAIL-UHFFFAOYSA-N,cdp2w10_k03_s1_w226c8e2b7-3a39-4bc2-a29e-2c1e7224091a,cdp2w10_k03_s1_w307037cba-6172-43b6-8c2a-edf6d06a63a2,cdp2w10_k03_s1_w10f9d01f0-3797-492d-a6b0-68fa2ba62079,cdp2w10_k03_s1_w570d0ddb0-1bb2-42c8-818c-227466d2f56d,cdp2w10_k03_s1_w4bdc8954a-6be2-4654-8e89-6c57d16cf050,47,6576
1334,1256.0,24293-J17-3,BRD-K91758890-001-03-5,24293,J17,3,SA792755,4-hydroxyquinazoline,primary-common,Oc1ncnc2ccccc12,QMNUDYFKZYBWQX-UHFFFAOYSA-N,cdp2bioactives_j17_s3_w2317bdbc3-85d2-4652-840b-0286e94aec3b,cdp2bioactives_j17_s3_w330866523-4b1f-46ae-acda-26d013f12b8b,cdp2bioactives_j17_s3_w1a73307a5-90e6-4d18-bddd-fb0562a681f8,cdp2bioactives_j17_s3_w591d6a69d-65d4-43c1-97b1-982581c82327,cdp2bioactives_j17_s3_w46a2b31bc-4cea-4a4f-b930-bdfa671e365d,143,43
1335,15681.0,25430-K10-1,BRD-A18609450-001-07-5,25430,K10,1,SA1856323,BRD-A18609450,BROAD_CPD_ID,Fc1ccc(cc1)-c1cc(n2nc(cc2n1)C(=O)N1CCCCC1c1cccnc1)C(F)(F)F,QMNWXSUUWIKMAI-UHFFFAOYSA-N,cdp2w10_k10_s1_w275b1ba41-3190-4779-b6c0-12d6d8316f63,cdp2w10_k10_s1_w3a5bb2372-8120-4076-804d-b74cb05fe853,cdp2w10_k10_s1_w1b5c990c4-7b30-4bf1-ad85-c9f8f2e259e5,cdp2w10_k10_s1_w5adad579c-7e1a-40d0-af8b-1f7112a134a7,cdp2w10_k10_s1_w49d55d2fe-45ef-4e50-b7c2-18dc28e2bf40,39,6979
1336,32231.0,25677-E15-3,BRD-A95882986-001-05-1,25677,E15,3,SA1861157,BRD-A95882986,BROAD_CPD_ID,S=C(NCc1ccccc1)NC1CCCc2ccccc12,QMPKYZMMCRCHNT-UHFFFAOYSA-N,cdp2w12_e15_s3_w2e7d1c6c7-b837-43d1-b3d6-a9d85ad2b06b,cdp2w12_e15_s3_w39236c23d-2a14-4168-8820-2892be59e6ec,cdp2w12_e15_s3_w1cea8c7fa-40e8-420c-8ac1-2da1482f614d,cdp2w12_e15_s3_w582d2f982-7164-46ea-97e2-c3251c920f1c,cdp2w12_e15_s3_w495b019f2-4d03-4be8-a3b1-10a6933eb463,79,7616
1337,53250.0,26205-I22-4,BRD-K52580035-001-06-9,26205,I22,4,SA1859260,BRD-K52580035,BROAD_CPD_ID,Clc1cc(Cl)c2ncnc(OCc3cc(=O)n4ccsc4n3)c2c1,QMSBGRMIUYUUIW-UHFFFAOYSA-N,cdp2w9x2-au00026617_i22_s4_w2890db06d-fbaf-4904-949c-2dccfd842f9f,cdp2w9x2-au00026617_i22_s4_w30b8855fa-f703-4d21-9086-6ac56c95f201,cdp2w9x2-au00026617_i22_s4_w1b492a4e6-b7fc-4915-a994-3028b71ccfa9,cdp2w9x2-au00026617_i22_s4_w5498ea727-bb23-480a-97e4-1489b5341745,cdp2w9x2-au00026617_i22_s4_w4e6fe513d-b55c-4c1f-bf99-3edf03ec52c9,64,5907
1338,28054.0,25599-L16-2,BRD-A09115727-001-05-5,25599,L16,2,SA1854170,BRD-A09115727,BROAD_CPD_ID,C1CCC2(C1)CC1CC(N2O1)c1ccccc1,QMXWPGNYNKFWCU-UHFFFAOYSA-N,cdp2w11_l16_s2_w26483703a-ad90-4158-b5ef-c325e010e590,cdp2w11_l16_s2_w33ec68213-c2bc-42d7-a408-e945e9004032,cdp2w11_l16_s2_w1b574dfd2-ec27-4fd7-a156-ec7cdfc01299,cdp2w11_l16_s2_w52278648a-3ba3-467c-8775-d1e292be049b,cdp2w11_l16_s2_w42f9c03b9-93b5-4a88-947b-703f466c1afc,84,6351
1339,4371.0,24308-P07-4,BRD-K39187410-001-01-7,24308,P07,4,SA82660,"R(-)-2,10,11-trihydroxyaporphine",primary-common,CN1CCc2cc(O)cc-3c2[C@H]1Cc1ccc(O)c(O)c-31,QNBCPLWFVGLFHO-CYBMUJFWSA-N,cdp2bioactives_p07_s4_w21a8d92e6-22e3-4de1-823d-7f1cec0318a7,cdp2bioactives_p07_s4_w310eadd72-10ee-4247-8286-6e8844b23852,cdp2bioactives_p07_s4_w1ed6a38f9-bba6-43f6-bc6e-1d37ad1cc8c7,cdp2bioactives_p07_s4_w56b91cfd4-1529-4ee1-b54d-e4454238bdac,cdp2bioactives_p07_s4_w4f41dc374-f13b-4786-ad7e-9f2b1107893f,65,271
1340,29856.0,25643-H06-4,BRD-K13892375-001-05-6,25643,H06,4,SA1852154,BRD-K13892375,BROAD_CPD_ID,CCOC(=O)c1oc2ccc(Br)cc2c1CSc1nnc(C)s1,QOFUSEJVOGYLJR-UHFFFAOYSA-N,cdp2w12_h06_s4_w240a63f2f-ad57-4bb1-ac13-873426fc0eb0,cdp2w12_h06_s4_w326a75e34-1eeb-4530-9720-bc1ecfd54293,cdp2w12_h06_s4_w1cc82cbc6-4d05-481f-a844-925e52a8a67b,cdp2w12_h06_s4_w5343ecca6-cb46-4e18-9378-f46d52a2299d,cdp2w12_h06_s4_w4a3d0bc9b-c2d0-4230-8b5d-457c791352cb,80,6801
1341,46841.0,26081-D04-3,BRD-K29820234-001-05-0,26081,D04,3,SA1858121,BRD-K29820234,BROAD_CPD_ID,CC(=O)c1ccc(OCc2ccc(Oc3c(Cl)cccc3[N+]([O-])=O)cc2)cc1,QOHUQCONBIESPG-UHFFFAOYSA-N,u00026613_d04_s3_w28a5eea63-a717-49b9-b205-05f21857056e,u00026613_d04_s3_w3944baee4-5e80-4724-9e85-505fef478c81,u00026613_d04_s3_w12d62cbd9-4e9a-4e30-85aa-436c5bc6161f,u00026613_d04_s3_w5c41325aa-d95f-4092-83d2-91e2ae3e6135,u00026613_d04_s3_w4be22c1c0-5e9d-423d-ac4f-2a013e331256,34,4021
1342,29185.0,25641-F04-5,BRD-K71836501-001-06-7,25641,F04,5,SA1855800,BRD-K71836501,BROAD_CPD_ID,NC(=O)c1ccsc1NC(=O)C1CCCCC1,QOPUTUZZAFIRJE-UHFFFAOYSA-N,cdp2w12_f04_s5_w294936a45-4f40-42f0-b815-838b8cc6fdf1,cdp2w12_f04_s5_w32a7f3374-daf1-4dc7-ada4-954ed5ef0f25,cdp2w12_f04_s5_w1831293eb-0622-4264-8670-5de0537f2f3d,cdp2w12_f04_s5_w5c3aed299-1702-411c-8e30-b87dfd54df9d,cdp2w12_f04_s5_w46a2c4339-e1d4-4517-8f05-5e5740a3343e,63,2689
1343,30701.0,25665-A08-3,BRD-A94224584-001-05-3,25665,A08,3,SA1856675,BRD-A94224584,BROAD_CPD_ID,CC(C)COP(=O)(C(O)c1ccccc1F)c1ccc(cc1)N(C)C,QOVNMUHVDCGDOR-UHFFFAOYSA-N,cdp2w12_a08_s3_w20ca0e078-e61b-4bfd-9848-a3dfb4a0806f,cdp2w12_a08_s3_w30b775e29-a013-4c4f-b607-2e1047cb7a87,cdp2w12_a08_s3_w11d415431-c142-402b-9bbf-fdd1f71ef847,cdp2w12_a08_s3_w59626026e-59d9-4307-a847-c094c9ec4e1a,cdp2w12_a08_s3_w4c55e7086-77c1-4869-8964-9101a1a81e29,37,1677
1344,7227.0,24357-P16-4,BRD-K77947974-001-04-9,24357,P16,4,SA82073,fluspirilene,INN,Fc1ccc(cc1)C(CCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc(F)cc1,QOYHHIBFXOOADH-UHFFFAOYSA-N,cdp2bioactives_p16_s4_w25fb463fe-1810-4a54-9ea6-6f9ee4804592,cdp2bioactives_p16_s4_w3d2c7d398-173c-4ed2-8293-83fc2f1b1e5a,cdp2bioactives_p16_s4_w169958bc9-d3ef-475c-b5c6-f33f2be36e39,cdp2bioactives_p16_s4_w5f368506d-3366-4c56-959e-1e90a74941ac,cdp2bioactives_p16_s4_w4ecb15e21-f03f-4c2f-8760-0127ba005f9b,4,502
1345,45592.0,26007-A24-2,BRD-K39134386-001-01-9,26007,A24,2,SA801166,BRD-K39134386,BROAD_CPD_ID,COc1ccccc1CNC(=O)C[C@@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Nc4ccccc4F)cc23)[C@@H](CO)O1,QPCDPRLGXJQWSH-BJSMQDGRSA-N,cdp2w8x2_a24_s2_w2bb253ea7-4ff4-4791-a598-cc5f58804ea3,cdp2w8x2_a24_s2_w3b2afc4bb-b4ac-4f28-8e20-9738cc8b68f2,cdp2w8x2_a24_s2_w1e2f70155-abe4-4589-aaff-16c612dd1511,cdp2w8x2_a24_s2_w5a9742f9f-5f3c-4ac3-8064-ba8ccef06ea4,cdp2w8x2_a24_s2_w4e87929f3-9134-4ea4-a831-11acb6581267,28,10312
1346,45540.0,25992-O05-4,BRD-K76304753-003-04-7,25992,O05,4,SA58424,phenazopyridine,common,Nc1ccc(\N=N\c2ccccc2)c(N)n1,QPFYXYFORQJZEC-FOCLMDBBSA-N,cdp2w8x2_o05_s4_w20aa821f7-9b70-4556-b6a8-9e9fa640aef9,cdp2w8x2_o05_s4_w35f545473-633a-4a3a-af86-93c280760c20,cdp2w8x2_o05_s4_w17accff82-601c-46b3-b816-59099b7a67ac,cdp2w8x2_o05_s4_w586eaa10b-04c5-48d5-ba66-9b94e9e5cb95,cdp2w8x2_o05_s4_w484de862b-1762-4ac6-83a2-f337a74bb731,58,847
1347,26066.0,25590-C15-6,BRD-K28513206-001-07-2,25590,C15,6,SA1857072,BRD-K28513206,BROAD_CPD_ID,COc1ccc(cc1)-c1c(C)sc(NC(=O)c2ccnn2C)c1C#N,QPSQPHLXEVIHPZ-UHFFFAOYSA-N,cdp2w11_c15_s6_w2cbba7084-89bd-4394-a2aa-ea61a67980d2,cdp2w11_c15_s6_w3457e35bc-b110-48b4-a275-3b12d4552da3,cdp2w11_c15_s6_w1ae867f02-2e2b-40db-b0dd-6b64df5d3417,cdp2w11_c15_s6_w570a86e83-8ca3-4561-801e-2390df2c9a12,cdp2w11_c15_s6_w4ddbc5db1-1041-401c-8907-90e19b24abe2,61,6202
1348,55467.0,26588-F19-1,BRD-K82758569-001-01-0,26588,F19,1,SA799488,BRD-K82758569,BROAD_CPD_ID,CN(C)c1ccc2O[C@@H]3[C@@H](C[C@H](CC(=O)N4CCc5ccccc5C4)O[C@H]3CO)c2c1,QQFBCVYCCQBHCE-IQKBUIRBSA-N,cdp2w7x2_f19_s1_w2fb12b459-509d-41e4-a438-d8c16fb81462,cdp2w7x2_f19_s1_w3cb158075-5b43-4d09-99df-64fb63233a19,cdp2w7x2_f19_s1_w10815a24f-3c0f-43ee-b714-8cab58eeffa5,cdp2w7x2_f19_s1_w56973e8e8-b6a6-42c9-9b4b-aa168dacf277,cdp2w7x2_f19_s1_w4ef1296d4-9c3f-4463-bcbf-c180f97cca0d,79,10490
1349,23984.0,25580-G14-6,BRD-K48905682-001-07-9,25580,G14,6,SA1859955,BRD-K48905682,BROAD_CPD_ID,COc1ccc2c(C)nc(Nc3nc(C)c(C)c(O)n3)nc2c1,QQJIYKXTEMDJFM-UHFFFAOYSA-N,cdp2w11_g14_s6_w24531fba9-2b30-4ec8-90fc-eef6124e58d7,cdp2w11_g14_s6_w3de7887df-7a2d-462a-a887-44e1aa9738b2,cdp2w11_g14_s6_w1bc7ece0a-34ab-4843-b992-a8896a087c03,cdp2w11_g14_s6_w505235bd0-1a53-4140-96ad-2cb11b311360,cdp2w11_g14_s6_w4fbe81197-2f8e-4071-81f0-01991b3794c9,14,7195
1350,27594.0,25598-E11-4,BRD-K06117861-001-05-8,25598,E11,4,SA1858310,BRD-K06117861,BROAD_CPD_ID,Clc1ccc(cc1)-n1ncc2ccccc2c1=O,QQJQSWFPMBORPH-UHFFFAOYSA-N,cdp2w11_e11_s4_w21bc98084-ebdf-417b-9fab-e57626e027a8,cdp2w11_e11_s4_w369cf3e3c-89da-4829-9ebe-673a391fc609,cdp2w11_e11_s4_w1be725117-d576-4075-a1c0-78b1d1b2bd45,cdp2w11_e11_s4_w5344d5044-20a5-4af2-a5eb-f25f09b0e2fe,cdp2w11_e11_s4_w42a00c257-038f-436a-9dbb-e11bf707bf99,55,5643
1351,46290.0,26061-E11-4,BRD-K98941192-001-05-0,26061,E11,4,SA1858476,BRD-K98941192,BROAD_CPD_ID,CC(C)c1ccccc1N=C(S)NC1CCN(Cc2ccccc2)CC1,QQWPAAYLSWYFAO-UHFFFAOYSA-N,cdp2w9x2_e11_s4_w2c28e17e6-5bfc-4f0e-a11c-6bcfffc6d212,cdp2w9x2_e11_s4_w3f1cd7725-7d24-4e76-b277-bcae475ca9fa,cdp2w9x2_e11_s4_w19dd190f4-7854-44dd-a4c2-716d30e698ad,cdp2w9x2_e11_s4_w5cb77c157-ee85-48db-8d68-909750452de3,cdp2w9x2_e11_s4_w4e74c1bcb-d95e-4dc1-884b-74872bfe534f,64,4800
1352,52833.0,26204-C11-1,BRD-K89622378-001-05-3,26204,C11,1,SA1860799,BRD-K89622378,BROAD_CPD_ID,CCc1ccc(cc1)-c1csc(NC(=O)Oc2ccccc2)n1,QRANLPFERFBRNN-UHFFFAOYSA-N,cdp2w9x2-au00026617_c11_s1_w2cd80eb5b-447e-4866-be4d-4d3ec9edc32b,cdp2w9x2-au00026617_c11_s1_w3aab780b5-cb62-4264-a496-b0ca88503127,cdp2w9x2-au00026617_c11_s1_w12a167807-a4a8-443e-a436-c392c7e90986,cdp2w9x2-au00026617_c11_s1_w54ed257cf-a9ab-4fe3-a99a-aa758cf7fa07,cdp2w9x2-au00026617_c11_s1_w438ef1fb5-ca91-4f02-9f1c-621891127190,31,7833
1353,32369.0,25677-K17-3,BRD-K75049653-001-05-1,25677,K17,3,SA1852064,BRD-K75049653,BROAD_CPD_ID,CC(C)CSc1n[nH]c(N)n1,QRRACGCDDYGSMN-UHFFFAOYSA-N,cdp2w12_k17_s3_w25d4c07eb-59c1-4e15-b341-f13392088032,cdp2w12_k17_s3_w35734d2e9-9919-4540-9b30-0c9facbeb09c,cdp2w12_k17_s3_w1e60ea1d0-03df-4a9d-b1be-72b95a1c2f3b,cdp2w12_k17_s3_w568c018c5-31f5-4af3-97ec-74ad6909f8b6,cdp2w12_k17_s3_w45607e7e4-2141-4da1-a38e-fbdb8492a3f0,72,1235
1354,11151.0,25387-E22-1,BRD-K73832060-001-05-9,25387,E22,1,SA1862128,BRD-K73832060,BROAD_CPD_ID,CC1CCN(CC1)C1=NC(=O)\C(S1)=C\c1c[nH]nc1-c1ccccc1,QSCNMGHRKNZEBR-WJDWOHSUSA-N,cdp2w10_e22_s1_w291a1152b-098a-4307-85db-7c55661204eb,cdp2w10_e22_s1_w35c22ede6-9f17-4b1e-a164-341e463a7800,cdp2w10_e22_s1_w1de477be0-ced6-4ac8-a512-850fdf308a73,cdp2w10_e22_s1_w5ed26929d-f814-42e7-84fa-8ebceba12e12,cdp2w10_e22_s1_w4c8c51e8c-b4af-4bd6-aca8-fb739aba6beb,58,4537
1355,7677.0,24523-J03-4,BRD-K50334155-001-01-8,24523,J03,4,SA86737,BRD-K50334155,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(cc2C1=O)N(C)C,QSGCCBXTIZPHMD-WOGXIUBCSA-N,cdp2bioactives-au00026391_j03_s4_w20630f571-7121-4476-a8e9-82aafc6d7996,cdp2bioactives-au00026391_j03_s4_w3537c4261-3b54-4586-8d80-e692749fd156,cdp2bioactives-au00026391_j03_s4_w122b77c68-a10f-4c41-8cd1-dd5564260318,cdp2bioactives-au00026391_j03_s4_w57f9d4bdd-900c-4822-8882-8a5656722d4b,cdp2bioactives-au00026391_j03_s4_w49b3e169d-ff23-4faa-b92c-94f3e12b323e,76,10350
1356,19645.0,25564-K09-5,BRD-K20711747-001-05-0,25564,K09,5,SA1853277,BRD-K20711747,BROAD_CPD_ID,CCOc1c(C)cnc2n(C)c(=O)n(Cc3cccc(Cl)c3)c(=O)c12,QSMJWYHULICDHE-UHFFFAOYSA-N,cdp2w11_k09_s5_w20420287a-e4ad-46e6-888e-b65520897790,cdp2w11_k09_s5_w3e7cd12dd-c14e-489b-80f7-ee0c82bb3e0c,cdp2w11_k09_s5_w1ec74d1d5-63c1-48e6-b2ff-7a70c80b1453,cdp2w11_k09_s5_w55ff827b7-21f3-4978-9881-a1fc20f9ec51,cdp2w11_k09_s5_w4900b42a5-e0c3-4b30-a655-9d8199176dab,54,3497
1357,11003.0,25382-J08-3,BRD-A39570609-001-06-6,25382,J08,3,SA1853279,BRD-A39570609,BROAD_CPD_ID,Cc1nc2ccccc2n1CC(O)COc1ccccc1Cl,QSNHAWLIONBKPZ-UHFFFAOYSA-N,cdp2w10_j08_s3_w2a8ea050f-51d2-420a-8ddc-577bc4f1831b,cdp2w10_j08_s3_w3465ef005-d840-466f-b6a1-be7eab93e6b5,cdp2w10_j08_s3_w181e21d64-60bb-4ee5-99fa-74bf463df11e,cdp2w10_j08_s3_w5be9c3a96-350d-4082-9ef3-929aa3650ad9,cdp2w10_j08_s3_w460e2fff2-71ea-40cf-a7e8-5b3805b76b16,30,4303
1358,36998.0,25707-D19-6,BRD-K50537271-001-05-6,25707,D19,6,SA1861615,BRD-K50537271,BROAD_CPD_ID,Fc1ccc2nc(Nc3nc4cc5OCCOc5cc4s3)sc2c1,QSOMZIBTZRYYGF-UHFFFAOYSA-N,cdp2w12_d19_s6_w21c5aa1a0-ab6b-4bb4-af53-ac98f2426c8c,cdp2w12_d19_s6_w33295aa70-8238-45b1-ba76-d1e7f2e2aaf7,cdp2w12_d19_s6_w18b19fafa-fdf6-438f-81ea-7d04dde4b097,cdp2w12_d19_s6_w5b5e967a8-7331-4171-b9e2-280271826cb7,cdp2w12_d19_s6_w4b3f9cc3f-dca8-4988-88e0-4936e3bc61cd,61,2748
1359,10822.0,25380-N18-2,BRD-K99758956-001-05-3,25380,N18,2,SA1859472,BRD-K99758956,BROAD_CPD_ID,CCCCc1nc2sc3c(SCCN(C)C)ncnc3c2c2CCCc12,QSWCNAHQOVQMEL-UHFFFAOYSA-N,cdp2w10_n18_s2_w2da1b2655-334b-4e0a-af25-b8d16bb74bdf,cdp2w10_n18_s2_w382fb86f3-0dc6-436c-a9ee-ecc2817e7347,cdp2w10_n18_s2_w1e69bc6c1-c3be-4f52-ba71-edff8646d934,cdp2w10_n18_s2_w57df3d54e-9d4b-4446-82da-b42cc1fc2c64,cdp2w10_n18_s2_w4be13132f-c000-402b-a093-21075c9b0398,35,9022
1360,52355.0,26202-H12-3,BRD-A09796989-001-06-3,26202,H12,3,SA1853303,BRD-A09796989,BROAD_CPD_ID,CC1CCc2nc(N)c(C#N)c(-c3cccnc3)c2C1,QSYBDNXNOJIKML-UHFFFAOYSA-N,cdp2w9x2-au00026617_h12_s3_w271894179-e30a-4d7b-b640-e39677a130e1,cdp2w9x2-au00026617_h12_s3_w36f363902-fbc4-4ac6-a7f1-275902fcd7f5,cdp2w9x2-au00026617_h12_s3_w16d9cb032-c192-4831-922d-a66c1dc8dce7,cdp2w9x2-au00026617_h12_s3_w50eb05009-d788-4686-b7c2-94698314bfdb,cdp2w9x2-au00026617_h12_s3_w40a4f0266-72e9-4690-8275-3f081b00a90f,31,4260
1361,32897.0,25679-F03-3,BRD-A77256733-001-05-6,25679,F03,3,SA1858248,BRD-A77256733,BROAD_CPD_ID,CC(Oc1ccc(Cl)cc1C)C(=O)Nc1ccccc1N1CCOCC1,QSYJBBIVXVGYMR-UHFFFAOYSA-N,cdp2w12_f03_s3_w28a206608-ca38-4ce4-adaf-5777066a9ff4,cdp2w12_f03_s3_w3e95ec871-1552-44e7-a1e3-84f6cb59eba2,cdp2w12_f03_s3_w1ad893ef0-c392-411d-bb96-2f747a283576,cdp2w12_f03_s3_w5125b8056-2db5-4749-b040-b97bee7225f4,cdp2w12_f03_s3_w421dc3d92-7ed1-470d-a915-265351c869d0,55,6031
1362,7270.0,24509-F23-5,BRD-K28317853-001-01-7,24509,F23,5,SA440072,BRD-K28317853,BROAD_CPD_ID,COc1ccc(NC(=O)Nc2ccc3O[C@H](CN(C)CC4CCCCC4)[C@@H](C)CN([C@H](C)CO)C(=O)Cc3c2)cc1,QTHBIZIZCLMCFV-DDFCPOBKSA-N,cdp2bioactives_f23_s5_w2127ede06-0f80-4ab3-99a2-0043eebef32f,cdp2bioactives_f23_s5_w35e90ac4b-148a-45a3-940c-6016ff4dc37b,cdp2bioactives_f23_s5_w18c9465d5-2ade-44a2-b5d0-e8172d501c1f,cdp2bioactives_f23_s5_w565ad7326-9390-4fec-b34c-c9627a7ded9a,cdp2bioactives_f23_s5_w4e4a064e1-ff26-4c95-b1b7-b32b6b3441c3,84,10448
1363,42138.0,25967-I23-4,BRD-K31627533-001-03-8,25967,I23,4,SA83791,rimexolone,INN,CCC(=O)[C@@]1(C)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]12C,QTTRZHGPGKRAFB-OOKHYKNYSA-N,cdp2w8x2_i23_s4_w28aaa4927-e46d-474f-8b8a-956e56be9a69,cdp2w8x2_i23_s4_w3bfd24741-56e2-456b-8309-27d491f7eda1,cdp2w8x2_i23_s4_w1c262a3ea-6c01-4497-b954-5375a9cab521,cdp2w8x2_i23_s4_w58025afca-68b5-41dc-a7e2-2bbb479f231c,cdp2w8x2_i23_s4_w458d67b65-3e97-49db-9828-d740b0af807a,57,1354
1364,17043.0,25436-O04-1,BRD-K85808903-001-05-6,25436,O04,1,SA1852881,BRD-K85808903,BROAD_CPD_ID,CCOc1ccccc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccc(C)n1,QTXVATMWRBCVEZ-UHFFFAOYSA-N,cdp2w10_o04_s1_w2df060baa-dd9c-48e3-ac53-a57abcb3bac1,cdp2w10_o04_s1_w3979e1b16-1204-4e7a-adda-a01d38e98097,cdp2w10_o04_s1_w1e26b4c92-e178-4e99-a0ba-a7b554e05be2,cdp2w10_o04_s1_w5ab02f9ff-07e3-4201-8ad5-c1f0c7b7a087,cdp2w10_o04_s1_w402502e43-b033-4641-95f2-f1155f440866,68,7390
1365,55541.0,26598-M20-3,BRD-K93164329-001-01-9,26598,M20,3,SA798174,BRD-K93164329,BROAD_CPD_ID,OC[C@H]1O[C@@H](CC(=O)NCc2ccc(Cl)cc2)C[C@H]2[C@@H]1Oc1ccc(NC(=O)Nc3ccc(cc3)C(F)(F)F)cc21,QUFPSNAFNYGAMM-UFUIAINPSA-N,cdp2w7x2_m20_s3_w28a892f48-ff94-4473-ac17-5b25d207d104,cdp2w7x2_m20_s3_w3fd8b4797-0d17-4559-af6f-df2b31b15aa1,cdp2w7x2_m20_s3_w194d50989-d180-4c30-817b-27978ff6a651,cdp2w7x2_m20_s3_w5065323b9-de71-4899-a477-5c8c37f48992,cdp2w7x2_m20_s3_w42fbb62e2-f406-45c7-bf89-ce858fa95a21,57,10292
1366,50667.0,26138-N15-1,BRD-K84836394-001-06-2,26138,N15,1,SA1856762,BRD-K84836394,BROAD_CPD_ID,Cc1ccc2nc(NCc3ccccc3)c(C=O)c(=O)n2c1,QUIXAOYCLGSUQR-UHFFFAOYSA-N,cdp2w9x2_n15_s1_w29142dcdb-5d5a-4147-b6a3-351c5c137654,cdp2w9x2_n15_s1_w3f65b5690-2cb7-4a83-878d-03fddcd3dbc8,cdp2w9x2_n15_s1_w1f63777ec-0ec4-48cf-9b18-ddb1afafe5af,cdp2w9x2_n15_s1_w54a46bfb7-9edc-490d-ae65-27d0626ace6d,cdp2w9x2_n15_s1_w42bde14b9-98ff-49b7-aea8-a19b7071ecf2,52,4356
1367,4467.0,24309-D10-4,BRD-K24084088-001-02-2,24309,D10,4,SA58654,paraxanthine,primary-common,Cn1cnc2[nH]c(=O)n(C)c(=O)c12,QUNWUDVFRNGTCO-UHFFFAOYSA-N,cdp2bioactives_d10_s4_w29cbc5319-10da-4de4-b48b-c1be87398ed3,cdp2bioactives_d10_s4_w38c16986d-64de-407a-b714-4cfc8d7f24f3,cdp2bioactives_d10_s4_w18b191ab2-132c-4b02-8303-d2dd3be39c27,cdp2bioactives_d10_s4_w5d52059d5-1977-431b-b599-bb62b5468f2a,cdp2bioactives_d10_s4_w484c4f9d2-a98d-4413-aeaf-1c1962d444c7,109,781
1368,20488.0,25567-E12-2,BRD-A29021272-001-05-0,25567,E12,2,SA1858262,BRD-A29021272,BROAD_CPD_ID,[O-][N+]1=CC(c2ccc(Oc3ccccc3)cc2)=[N+]([O-])C2CCCCC12,QUQPREFMDUPVMG-UHFFFAOYSA-N,cdp2w11_e12_s2_w2a17f5837-fa25-49d6-ae55-53f9381a3ae0,cdp2w11_e12_s2_w30699beba-69bd-46de-bd14-4a2865432e1c,cdp2w11_e12_s2_w1beb9c8ff-613b-4a3a-b682-42091af5372b,cdp2w11_e12_s2_w51154f421-2ec5-42b2-863b-584f31f5d47d,cdp2w11_e12_s2_w4277dea33-8f4a-44e3-ba0c-3022d0f9d03d,56,1313
1369,44600.0,25989-F14-6,BRD-K65508953-001-05-5,25989,F14,6,SA83013,monocrotaline,primary-common,C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23,QVCMHGGNRFRMAD-XFGHUUIASA-N,cdp2w8x2_f14_s6_w26b2fccb4-98c4-499d-b333-5f986eec3402,cdp2w8x2_f14_s6_w3ec307e7b-8770-4790-81ae-55a753148eb3,cdp2w8x2_f14_s6_w1bf221289-1d0d-4f73-93b9-4c591bac749d,cdp2w8x2_f14_s6_w54968c0e8-92d4-4994-a905-a7e6912c1c8c,cdp2w8x2_f14_s6_w483c70ce9-b575-47f7-96fa-6914a776b59c,72,1157
1370,9178.0,24735-H01-2,BRD-K75152103-001-02-6,24735,H01,2,SA666932,BRD-K75152103,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)N(C)C[C@H]1OCc2cnnn2CCCC(=O)N(C[C@H]1C)[C@H](C)CO,QVFRXOMYJDWMPT-JBYIUTFZSA-N,cdp2w5_h01_s2_w20372c99e-6846-4b1d-93f6-0320a544771d,cdp2w5_h01_s2_w352ef0bf7-7ea5-4fdc-908c-d1ace209c548,cdp2w5_h01_s2_w1f6dc9583-8a64-45e2-9873-17a269a56acc,cdp2w5_h01_s2_w5b564b0d6-d6f8-4322-a6d7-de7cb96667c2,cdp2w5_h01_s2_w4275d7932-74e4-4890-b49d-83fd6a498fc2,60,9839
1371,16516.0,25435-D21-2,BRD-A19953985-001-05-4,25435,D21,2,SA1860318,BRD-A19953985,BROAD_CPD_ID,Fc1ccc(cc1)C1CC(=NN1c1ccccc1)c1ccco1,QVGADSAEXXGQMO-UHFFFAOYSA-N,cdp2w10_d21_s2_w2bb685b41-aee9-455c-8118-2b4bcef5220a,cdp2w10_d21_s2_w3835adeaa-6182-4295-bb1b-272029cda92a,cdp2w10_d21_s2_w1afbd75c7-aa4f-4655-a4c1-c57da4a38406,cdp2w10_d21_s2_w5548433b8-ade8-4ab8-98c8-3dd32da9d161,cdp2w10_d21_s2_w47f321fe8-9501-4004-a422-c75ae40fd71d,37,9006
1372,56781.0,26795-N22-1,BRD-K65067638-001-01-4,26795,N22,1,SA417906,BRD-K65067638,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3ccccc3c2)OCc2cn(CCCC1=O)nn2,QVHCTLOUCAXGOY-RNHFSVANSA-N,cdp2w13_n22_s1_w2905dc08d-91e3-4495-9348-9e0af2c0a85c,cdp2w13_n22_s1_w3698d6c78-a444-41d8-9946-fcba880bebf8,cdp2w13_n22_s1_w1e96d4b43-3a2a-42a2-9e55-a1b35b0cd4ea,cdp2w13_n22_s1_w52672231a-1e37-4a43-9c49-f351fad941c3,cdp2w13_n22_s1_w47e9331c7-9cb8-48ac-aef6-a7b78d91d2c0,69,10074
1373,48326.0,26115-O07-6,BRD-A94184316-001-05-4,26115,O07,6,SA1853903,BRD-A94184316,BROAD_CPD_ID,Cc1ccc(Cn2nnc3c2ncn(CC(=O)NCC2CCCO2)c3=O)cc1,QVHGNTPRWOGBOT-UHFFFAOYSA-N,cdp2w9x2_o07_s6_w213863bae-3ed9-4378-a301-83568e7c313d,cdp2w9x2_o07_s6_w375e7fb17-1f71-4bc4-983a-8de75a132d7b,cdp2w9x2_o07_s6_w1db154eb4-3ca2-4193-bc25-1c031417e059,cdp2w9x2_o07_s6_w5050805f0-530b-4181-91b4-94d0c34a43c5,cdp2w9x2_o07_s6_w4b0ffb78f-0d68-40fb-9b6c-6b122a2ba8f7,57,8206
1374,4271.0,24308-L12-6,BRD-K34092021-001-02-3,24308,L12,6,SA82165,arvanil,primary-common,CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(O)c(OC)c1,QVLMCRFQGHWOPM-ZKWNWVNESA-N,cdp2bioactives_l12_s6_w2d096c8b6-d9ae-4460-9e41-e25fdcfa4d75,cdp2bioactives_l12_s6_w3cd2bb95a-f1ab-4621-8aad-f56386c8f95b,cdp2bioactives_l12_s6_w133964b19-31fe-488c-903e-2f44cb52bf51,cdp2bioactives_l12_s6_w583cabb6b-4117-4b52-a76c-e551f9cddf50,cdp2bioactives_l12_s6_w42ff47f73-3934-452a-872b-998c1430bb59,95,807
1375,22131.0,25572-I03-1,BRD-K89526504-001-11-1,25572,I03,1,SA1855769,BRD-K89526504,BROAD_CPD_ID,OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccccc3)ncnc12,QVUUUSJUORLECR-XNIJJKJLSA-N,cdp2w11_i03_s1_w20f12ac2a-5ed8-4ce6-b4ad-daae4ad3db13,cdp2w11_i03_s1_w3d46bd06b-84a8-4aa7-bcbd-0fa3f4e12b5a,cdp2w11_i03_s1_w1913ad35b-667c-45a5-a1ea-a55f99bcbc6c,cdp2w11_i03_s1_w5757a690d-de31-43ec-a8a4-876334e0c5a6,cdp2w11_i03_s1_w4288aa5b2-8b24-4382-b3f0-b703118da4ef,40,1115
1376,44052.0,25987-G12-4,BRD-K48722258-300-04-5,25987,G12,4,SA791994,dilazep,INN,COc1cc(cc(OC)c1OC)C(=O)OCCCN1CCCN(CCCOC(=O)c2cc(OC)c(OC)c(OC)c2)CC1,QVZCXCJXTMIDME-UHFFFAOYSA-N,cdp2w8x2_g12_s4_w26af046b8-f4d5-45b8-9e08-8e207b230007,cdp2w8x2_g12_s4_w35633b2d1-4b48-4323-934a-ecd0978af581,cdp2w8x2_g12_s4_w1c4da61ba-daf3-4dac-8a00-cc4735421993,cdp2w8x2_g12_s4_w5870f055c-c1c0-4c43-aea5-970e30e15d8f,cdp2w8x2_g12_s4_w4240765e3-de25-4813-9ebd-eebde4a3cb39,86,820
1377,3352.0,24306-C05-5,BRD-K02265150-001-04-2,24306,C05,5,SA58947,amoxapine,INN,Clc1ccc2Oc3ccccc3N=C(N3CCNCC3)c2c1,QWGDMFLQWFTERH-UHFFFAOYSA-N,cdp2bioactives_c05_s5_w2b1d9cc16-6208-41bf-a171-ea0fd4cef5b9,cdp2bioactives_c05_s5_w3d2b81cf5-77dd-4439-b7e0-53ef8da12cf4,cdp2bioactives_c05_s5_w1294158e1-c649-465f-9355-51166ff20832,cdp2bioactives_c05_s5_w530fa57f7-90a4-4159-a7f8-b0054956429c,cdp2bioactives_c05_s5_w40da396e7-945d-4ae8-8353-29033c805fb1,98,731
1378,28556.0,25638-E07-6,BRD-K17606413-001-06-8,25638,E07,6,SA1860375,BRD-K17606413,BROAD_CPD_ID,COc1cccc(c1)N=Nc1c(N)nn2c(O)cc(nc12)-c1ccccc1,QWZDAYOWZVUNRA-UHFFFAOYSA-N,cdp2w12_e07_s6_w2e1e1bbcf-5086-4f6e-aa6d-b467a796853c,cdp2w12_e07_s6_w34a87817e-9814-484c-9bdc-6fc29d6d533b,cdp2w12_e07_s6_w1c260c405-3be7-4452-ae49-0c6885193e5b,cdp2w12_e07_s6_w563aa00c9-a90c-42d4-bc91-94e38462be4c,cdp2w12_e07_s6_w44795b3c7-401d-4028-9f3e-6793ac1672ef,184,6533
1379,5969.0,24319-H06-6,BRD-K67445247-001-01-3,24319,H06,6,SA791992,flurofamide,to-be-curated,NP(N)(=O)NC(=O)c1ccc(F)cc1,QWZFVMCWPLMLTL-UHFFFAOYSA-N,cdp2bioactives_h06_s6_w2ea4f9e58-47b8-40aa-a014-c6b6547cbb52,cdp2bioactives_h06_s6_w38ce51f1e-ffbb-4b44-a676-d686da3627ce,cdp2bioactives_h06_s6_w18aa68908-4b8c-4564-a7ed-7559cda071a1,cdp2bioactives_h06_s6_w5ccd6808a-b953-475f-8a01-495953fc6a84,cdp2bioactives_h06_s6_w4698c0409-87fb-4262-b1cc-47c8b9ad583e,131,864
1380,55082.0,26271-F10-6,BRD-K25954314-001-05-4,26271,F10,6,SA1853362,BRD-K25954314,BROAD_CPD_ID,Cc1ccc(Nc2c(ccc3=NC4(CCCCC4)N=c23)[N+]([O-])=O)cc1,QXFHLLATYJOLGL-UHFFFAOYSA-N,cdp2w9x2-au00026606_f10_s6_w20dad3874-e3a2-4640-a63b-e6b7669235bb,cdp2w9x2-au00026606_f10_s6_w3d021a3f9-ff6e-4ec5-8a07-1de075a3dc92,cdp2w9x2-au00026606_f10_s6_w1ae47678b-1c95-40d4-9cdb-9d8617f0ab0b,cdp2w9x2-au00026606_f10_s6_w580071f95-21ae-4458-8b3b-807a3b3dd3e7,cdp2w9x2-au00026606_f10_s6_w4daafc76b-7743-4c57-a63a-49e13cc1a77c,55,4987
1381,18525.0,25492-E21-1,BRD-K47995064-001-05-3,25492,E21,1,SA1859284,BRD-K47995064,BROAD_CPD_ID,C(Nc1nc2ccccc2[nH]1)c1ccc2OCOc2c1,QXKFXLLCKVUQPZ-UHFFFAOYSA-N,cdp2w10-au00024360_e21_s1_w28485b29d-f5bf-403c-8e8a-506a00dc233e,cdp2w10-au00024360_e21_s1_w3d2a268ba-a7ef-4096-8077-cf77965ba94b,cdp2w10-au00024360_e21_s1_w1f86b22c7-8e91-4859-a86b-6a7df2611e4a,cdp2w10-au00024360_e21_s1_w522d928d6-ff41-46b6-b3f0-330cfe4a4314,cdp2w10-au00024360_e21_s1_w4bf73296e-49f7-45d0-a7a8-9df2da4e2830,88,7811
1382,11653.0,25392-A11-5,BRD-K70622456-001-05-9,25392,A11,5,SA1855245,BRD-K70622456,BROAD_CPD_ID,Cc1ccc(OCc2nc(no2)-c2ccccc2)cc1,QXOWFMYRZSTHIB-UHFFFAOYSA-N,cdp2w10_a11_s5_w2f71997f0-550d-43bc-85ba-f09e3a67a443,cdp2w10_a11_s5_w34c506d22-f371-4ec9-b636-df972237c740,cdp2w10_a11_s5_w167ffa40f-288d-4206-8a44-50d820639130,cdp2w10_a11_s5_w5793cc48c-5e8b-4294-8e81-522dc0e0034c,cdp2w10_a11_s5_w4ab91ae56-c43d-4eef-9107-1f0128caed37,52,4055
1383,9582.0,24756-F14-4,BRD-K36104357-001-01-0,24756,F14,4,SA1015081,BRD-K36104357,BROAD_CPD_ID,CCCC(=O)Nc1ccc2c(OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@@H](CN(C)C2=O)OC)c1,QXVLXOALVVIWSG-LJKQEARRSA-N,cdp2w5_f14_s4_w2b56d9f21-582f-47f5-9aab-3d6563712d44,cdp2w5_f14_s4_w3123b9e84-bab5-46fc-ac7e-d8800820f7d0,cdp2w5_f14_s4_w1cdf4c36a-7435-4ad7-8f7b-588d5ac32f2f,cdp2w5_f14_s4_w57247efa2-cc71-4d67-848d-b4aaa55b272e,cdp2w5_f14_s4_w48369d9c9-b98a-4dc3-ab43-e1daf1c6b6aa,79,10498
1384,18154.0,25490-D21-2,BRD-K77220065-001-05-8,25490,D21,2,SA1860358,BRD-K77220065,BROAD_CPD_ID,O=C(Nc1nccs1)C(=O)c1c[nH]c2ccccc12,QXWUXNUOPOLUHR-UHFFFAOYSA-N,cdp2w10-au00024359_d21_s2_w26cec6105-61e3-423c-9d85-9f8d2fa18d14,cdp2w10-au00024359_d21_s2_w3cc939af3-7590-4ccd-a37f-dd904a98c8e7,cdp2w10-au00024359_d21_s2_w1517494a9-3086-46fb-a213-8729a31ca9d2,cdp2w10-au00024359_d21_s2_w56db35f50-597d-4a49-8d12-848021f5b119,cdp2w10-au00024359_d21_s2_w4ec323d5c-15bd-47ce-be49-44eceef627f9,62,7037
1385,56142.0,26702-B07-4,BRD-K68554461-001-01-0,26702,B07,4,SA1481790,BRD-K68554461,BROAD_CPD_ID,COc1cccc(c1)-c1ccc(cc1)[C@@H]1[C@H](CO)N(C(=O)Cc2ccncc2)[C@H]1C#N,QYAAHEQVWPVPBC-LSQMVHIFSA-N,cdp2w13_b07_s4_w219cd5918-8d4e-4422-ac0f-86cd794db097,cdp2w13_b07_s4_w389c7791e-21ae-4b70-aa41-99d5b1516a4a,cdp2w13_b07_s4_w1ab8be815-7b26-4fa5-9341-c6d3a9a74a12,cdp2w13_b07_s4_w53fa3111f-609b-4a1a-8b82-1128f825aa13,cdp2w13_b07_s4_w4abdda575-9cdf-43f6-9ea6-f99ae046911d,76,10514
1386,46223.0,26061-A10-3,BRD-A20208638-001-05-1,26061,A10,3,SA1855358,BRD-A20208638,BROAD_CPD_ID,CC1CN(CC(C)O1)S(=O)(=O)c1cccc(c1)C(=O)Nc1ncc(C)s1,QYEKUAKGOAYUDR-UHFFFAOYSA-N,cdp2w9x2_a10_s3_w2d671c346-cb03-4158-9f04-630709cfd7a6,cdp2w9x2_a10_s3_w30edf8183-3418-4ba4-bcf7-b65e1d5bebb9,cdp2w9x2_a10_s3_w19d77098a-63ba-48cc-8900-fa2b87828779,cdp2w9x2_a10_s3_w51d5cdcd2-d1c2-4fbf-95cd-8458f02880ce,cdp2w9x2_a10_s3_w4934d8eaf-3e62-4ea4-86a6-a05053cab7e3,55,2105
1387,24901.0,25584-C20-5,BRD-K43991526-001-07-4,25584,C20,5,SA1854395,BRD-K43991526,BROAD_CPD_ID,COc1ccc(NC(=O)COC(=O)\C=C\C(=O)OCC(=O)Nc2ccc(OC)c(Cl)c2)cc1Cl,QYIBZXMTOIPDDS-BQYQJAHWSA-N,cdp2w11_c20_s5_w2764e92f8-2183-480c-a879-0147e487a6a0,cdp2w11_c20_s5_w3b0d4ce53-81dc-493f-9a80-91a809b2284f,cdp2w11_c20_s5_w18cd0e177-8a98-42fc-b45e-51800ae8c4b6,cdp2w11_c20_s5_w5e4717d2a-9dd8-4ab0-bfc8-608cda9334ba,cdp2w11_c20_s5_w466217361-b269-4062-aca1-ed9614a9db68,37,5897
1388,38903.0,25738-P03-3,BRD-K53472839-001-05-8,25738,P03,3,SA1853849,BRD-K53472839,BROAD_CPD_ID,CC(C)N(Cc1cc2ccc(C)cc2nc1O)C(=O)c1ccncc1,QYJVCMLMINQANH-UHFFFAOYSA-N,cdp2w12_p03_s3_w2ea46c96b-c42b-44a9-86ea-b124a81f2d93,cdp2w12_p03_s3_w3bf15b2eb-a15d-4234-94e8-fc029b2d4e59,cdp2w12_p03_s3_w1fca1cae9-2728-4d84-804c-8f843996c08e,cdp2w12_p03_s3_w516eb9671-0726-49b6-a16c-62e27010d663,cdp2w12_p03_s3_w4cf0a0ca6-d761-48f6-8b46-1634d9d39173,53,8571
1389,15910.0,25432-F10-2,BRD-K33375279-001-05-5,25432,F10,2,SA1860775,BRD-K33375279,BROAD_CPD_ID,SC1=NC2(CCCCC2)Cc2ccccc12,QYYVLDGAEAKTDX-UHFFFAOYSA-N,cdp2w10_f10_s2_w2f0b13994-e4fc-4c60-96cb-7b7d3c40e309,cdp2w10_f10_s2_w3caa51382-269d-4992-a698-a45975a7c147,cdp2w10_f10_s2_w16e22c7fa-7b85-4818-b8ef-3804318824c9,cdp2w10_f10_s2_w5640ed205-987b-4f2e-9560-bffe4c84ee97,cdp2w10_f10_s2_w42d2e5eea-8d35-4d0e-8783-7c8700a6bd81,66,4453
1390,30299.0,25663-M22-3,BRD-K69589866-001-05-7,25663,M22,3,SA1852282,BRD-K69589866,BROAD_CPD_ID,Cc1cc(C)n(CCc2nc(cs2)-c2cccs2)n1,RAONHHVSFVIECY-UHFFFAOYSA-N,cdp2w12_m22_s3_w269a8f3f5-6570-469d-9ca2-f00bc9a06e40,cdp2w12_m22_s3_w3fb5b378f-03b8-4625-95ca-948662f6fe50,cdp2w12_m22_s3_w1a37b9d43-f7fa-481d-a81a-f8ae65a41b5e,cdp2w12_m22_s3_w56d7029ba-2de7-4d03-83b5-7a492700eb2e,cdp2w12_m22_s3_w4f1b6fea1-809b-47dc-ac87-619290a04d4b,91,6220
1391,51259.0,26159-M06-5,BRD-A80081229-001-05-4,26159,M06,5,SA1858302,BRD-A80081229,BROAD_CPD_ID,CC1OC23CCCCC2C(C#N)(C(=N)O3)C1(C#N)C#N,RASWCAKLSZMKOI-UHFFFAOYSA-N,cdp2w9x2-au00026617_m06_s5_w242021100-281e-4ea7-9e22-b9806d4e7419,cdp2w9x2-au00026617_m06_s5_w39b36a61b-a906-40e6-bb70-25227698c384,cdp2w9x2-au00026617_m06_s5_w1410b7b34-268a-4653-8d81-0d6329591299,cdp2w9x2-au00026617_m06_s5_w5dd65e93d-b820-432e-a785-2343ea757d9e,cdp2w9x2-au00026617_m06_s5_w457fe4bca-9ec8-49a9-9f18-721c543720fd,65,1966
1392,45865.0,26058-L19-5,BRD-K53770426-001-06-2,26058,L19,5,SA1859774,BRD-K53770426,BROAD_CPD_ID,C[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc2ccccc2c1,RBOGTOKHHDCLPU-DNQHQPOYSA-N,cdp2w9x2_l19_s5_w2922bf520-a92d-4b5a-b2d0-f57de646a398,cdp2w9x2_l19_s5_w377ca9c54-cdc0-4f85-bda2-86ae69b09969,cdp2w9x2_l19_s5_w1a74e8ac6-ba62-438e-992d-47edc1b8bb10,cdp2w9x2_l19_s5_w56565998a-d00c-4b9c-b3a6-ec867d51db8b,cdp2w9x2_l19_s5_w4ebce8aaa-c465-44bc-b32d-fdce3ffce275,69,6461
1393,19996.0,25565-M12-2,BRD-K63355328-001-07-7,25565,M12,2,SA1856101,BRD-K63355328,BROAD_CPD_ID,Cc1noc(C)c1CSc1nc2sc3CCCCCc3c2c(=O)n1CC=C,RBTURZSCIGSYAQ-UHFFFAOYSA-N,cdp2w11_m12_s2_w2304bf69b-401f-4f0b-8ef7-a900c45f76e9,cdp2w11_m12_s2_w349ca301b-af6c-41d5-a261-2cbe3a135a85,cdp2w11_m12_s2_w174b107d8-c173-4664-85f0-66fc35e181e1,cdp2w11_m12_s2_w5bee597df-a42f-4a6f-9f61-49990acc4bae,cdp2w11_m12_s2_w4ca3b82a0-a9fa-4505-8120-2d74c88f1eb7,70,3523
1394,18738.0,25492-O14-4,BRD-A86473322-001-05-3,25492,O14,4,SA1859217,BRD-A86473322,BROAD_CPD_ID,Clc1ccc(NC(=O)NC2CCCCC2Cc2ccco2)cc1,RBZBREHMJDJRDP-UHFFFAOYSA-N,cdp2w10-au00024360_o14_s4_w22efe50b2-72dc-4b6c-b471-77b7ed0ede4b,cdp2w10-au00024360_o14_s4_w32abbd77b-a475-4057-97cb-50844b09cf53,cdp2w10-au00024360_o14_s4_w14a3f4aa3-5269-4b67-b722-4440e641e895,cdp2w10-au00024360_o14_s4_w5f516a51b-f1b7-4901-be56-01b3487b4499,cdp2w10-au00024360_o14_s4_w41d5614e3-9582-4895-90b8-bf437137c8a8,43,4496
1395,20253.0,25566-J20-1,BRD-K19301906-001-05-0,25566,J20,1,SA1857086,BRD-K19301906,BROAD_CPD_ID,Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl,RCEMVBIZOPRKNR-UHFFFAOYSA-N,cdp2w11_j20_s1_w27a4965dd-c523-42e0-8e5f-2d63dc98cf56,cdp2w11_j20_s1_w3d378ef27-6d3c-42cd-b0cf-b442d260f26f,cdp2w11_j20_s1_w103e0bb13-52ee-4bb8-bf22-e76a30566eff,cdp2w11_j20_s1_w5b7cb5d31-4b95-4f76-8160-7d680cb0acf0,cdp2w11_j20_s1_w4cc5ded45-c878-4074-8b84-8ee872d8d7a2,73,5225
1396,47583.0,26107-J03-1,BRD-K94346447-001-06-7,26107,J03,1,SA1857539,BRD-K94346447,BROAD_CPD_ID,CCn1c(SCC(=O)Nc2ccc(NC(C)=O)cc2)nnc1C1CC1,RCEWNKADOBBYMI-UHFFFAOYSA-N,cdp2w9x2_j03_s1_w212db23b9-9967-42f6-934a-05a8aa6aeb9c,cdp2w9x2_j03_s1_w3e8221048-db00-4e21-bfde-6829d4cc78e6,cdp2w9x2_j03_s1_w15f7c2c39-0bf6-41a0-95b8-41733ecda5d4,cdp2w9x2_j03_s1_w5b8d6507f-9495-435c-a054-8df8309fea22,cdp2w9x2_j03_s1_w40d9aea75-da1b-4ab5-ade7-5d569fb6fc30,89,5901
1397,21197.0,25569-I22-3,BRD-K38995169-001-06-6,25569,I22,3,SA1854797,BRD-K38995169,BROAD_CPD_ID,Fc1ccccc1C(=O)Nc1ccc2[nH]c(nc2c1)-c1cccnc1,RCXGQDPHZKTBKW-UHFFFAOYSA-N,cdp2w11_i22_s3_w22d4d7bd9-c2f1-498f-be24-dbf76bc24600,cdp2w11_i22_s3_w3798933f1-10f2-4534-8dd4-f228c8708014,cdp2w11_i22_s3_w19bb12597-cf01-447b-9d54-9be58ea08062,cdp2w11_i22_s3_w599439a5f-be19-43e6-a65b-925c68390df7,cdp2w11_i22_s3_w47a63c9d2-3024-40c6-9ff5-62f90f2ee0f2,60,8851
1398,34440.0,25686-M04-4,BRD-K83291035-001-05-8,25686,M04,4,SA1859766,BRD-K83291035,BROAD_CPD_ID,CCOC(=O)Cc1c(C)c2c(O)cc(O)cc2oc1=O,RDSHEHFDUUPIAW-UHFFFAOYSA-N,cdp2w12_m04_s4_w223bff0f5-8304-481e-af2e-12db7464f388,cdp2w12_m04_s4_w308ebc406-3bfe-43f4-9303-f504a9b78b34,cdp2w12_m04_s4_w13ea39fb7-71c0-4a3b-9d9d-aed5195b9e46,cdp2w12_m04_s4_w577f99fc9-113f-4b23-a263-41c98ed148d3,cdp2w12_m04_s4_w4d13c5522-0fa8-43b3-ad2f-116237e8baa6,50,4672
1399,47327.0,26092-M10-3,BRD-K03370561-001-06-7,26092,M10,3,SA1854009,BRD-K03370561,BROAD_CPD_ID,COc1cc(NC(=O)c2ccnc(N)c2)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F,RDZJISXYOIRMMX-UHFFFAOYSA-N,cdp2w9-au00026609_m10_s3_w25d2e6e43-ab5c-4038-90ff-009a0c3f7fa0,cdp2w9-au00026609_m10_s3_w3453a7557-0808-4d50-a802-706e7c480487,cdp2w9-au00026609_m10_s3_w1879dd448-6230-4e0b-8f6b-c88d252c24d4,cdp2w9-au00026609_m10_s3_w5744f0a7f-40a7-425d-90b6-53b35aa7bb05,cdp2w9-au00026609_m10_s3_w40f22dba2-c40a-4f57-bb84-abd625d231df,49,6287
1400,16577.0,25435-H11-3,BRD-A37823663-001-06-4,25435,H11,3,SA1857501,BRD-A37823663,BROAD_CPD_ID,CCCCCNC(=O)c1ccc2c(c1)[nH]c(=O)n(CC1CCCO1)c2=O,RENFDUMNIKCHGX-UHFFFAOYSA-N,cdp2w10_h11_s3_w229581778-6c10-4966-87f8-b100da933e95,cdp2w10_h11_s3_w33cb54b84-8d0f-4997-be4b-4f175c0fe8da,cdp2w10_h11_s3_w1553210d8-584a-402b-89a1-f265044c6d45,cdp2w10_h11_s3_w5fb002516-980b-4fef-90cc-a8e2359266e2,cdp2w10_h11_s3_w477ef85cf-f532-4caa-9706-fd058d8a1e69,65,7295
1401,50273.0,26135-M17-3,BRD-K94427708-001-05-1,26135,M17,3,SA1856466,BRD-K94427708,BROAD_CPD_ID,CCOC(=O)c1sc(nc1O)-c1ccc(Cl)cc1Cl,REQSKIDVCSYJER-UHFFFAOYSA-N,cdp2w9x2_m17_s3_w2eb5f6651-26dd-462f-9316-2021e810fcd6,cdp2w9x2_m17_s3_w39031f7c6-0bf9-4d2b-9923-44a3ac104ef7,cdp2w9x2_m17_s3_w14607c0e5-2b88-4442-a8b0-3fe081d17f9b,cdp2w9x2_m17_s3_w54cf04ab4-0448-439d-89ac-b91ad0bb9e66,cdp2w9x2_m17_s3_w45e533868-f7da-440b-93b7-cbf7ca18c541,56,4960
1402,49191.0,26126-D19-1,BRD-K70264441-001-05-8,26126,D19,1,SA1853829,BRD-K70264441,BROAD_CPD_ID,CN(C)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3n2)ccc1C,REWOYCGJXJSSRQ-UHFFFAOYSA-N,cdp2w9x2_d19_s1_w2b6e38a6c-4a0d-484c-9241-30a043e1b991,cdp2w9x2_d19_s1_w33c4d926c-c6ef-4de4-a862-69ea3a1ddc00,cdp2w9x2_d19_s1_w1f6c9faf2-4d64-4ba8-8af9-11b9ecc934e5,cdp2w9x2_d19_s1_w566dbee71-8ee7-4b63-a4d3-059295513af9,cdp2w9x2_d19_s1_w4278c7972-bb48-4852-bf83-1b53abba451a,30,7755
1403,6930.0,24352-O16-1,BRD-K16542329-001-05-1,24352,O16,1,SA82155,zaprinast,INN,CCCOc1ccccc1-c1nc2[nH]nnc2c(=O)[nH]1,REZGGXNDEMKIQB-UHFFFAOYSA-N,cdp2bioactives_o16_s1_w2dcbc6ae1-3148-4da6-97ea-d8f682d9bcca,cdp2bioactives_o16_s1_w3ba64e42b-ff84-41a4-80d8-c0100ce4925d,cdp2bioactives_o16_s1_w16e4a8660-a061-4208-90a8-75f17c07d43a,cdp2bioactives_o16_s1_w538b64600-3147-4955-96aa-b20c15d86ecc,cdp2bioactives_o16_s1_w424dbd4be-ad63-4f69-a991-9a97dd3dbf36,75,391
1404,37020.0,25707-F14-4,BRD-A06664848-001-05-9,25707,F14,4,SA1856227,BRD-A06664848,BROAD_CPD_ID,CC(Sc1nc2cc(Cl)ccc2s1)C(=O)Nc1cccc(c1)S(=O)(=O)N1CCOCC1,RFBPLZZVEFTOML-UHFFFAOYSA-N,cdp2w12_f14_s4_w2eff6d6ac-9a0d-4a6f-8c55-e08e42a2b1ad,cdp2w12_f14_s4_w3f90dfacf-fe51-4067-93ce-46ac6eb67100,cdp2w12_f14_s4_w168dd3239-32d8-4379-8f72-d487f45519af,cdp2w12_f14_s4_w53fc2d5f3-9f01-43dc-9b7c-0e34095964ef,cdp2w12_f14_s4_w4cdce71a2-1fe6-45f1-8d9f-9a443dd66f0c,76,3969
1405,6706.0,24352-F03-5,BRD-K05977355-001-02-6,24352,F03,5,SA59792,fluconazole,INN,OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F,RFHAOTPXVQNOHP-UHFFFAOYSA-N,cdp2bioactives_f03_s5_w2c6e241b8-60fc-49d5-a297-7d659732affd,cdp2bioactives_f03_s5_w387771206-cfe6-44e3-8a8a-0b1075c3702f,cdp2bioactives_f03_s5_w1aefadf3f-79c2-44ab-8704-e7d6ff661e34,cdp2bioactives_f03_s5_w5d9b86447-69b9-468e-8d5f-99a789984d05,cdp2bioactives_f03_s5_w48081b778-798b-407b-9c66-a73e3cddf80c,84,196
1406,35730.0,25692-P17-4,BRD-K94868185-001-05-8,25692,P17,4,SA1857553,BRD-K94868185,BROAD_CPD_ID,O=C(Nc1cccc2ccccc12)N1CCN(Cc2ccccc2)CC1,RFMHQGJRWXPKJH-UHFFFAOYSA-N,cdp2w12_p17_s4_w24eb7cb10-de1c-4084-9c3e-641a46e2e479,cdp2w12_p17_s4_w3a1144a36-c4c1-477f-8b88-5ccd04e81dd0,cdp2w12_p17_s4_w11932c8e7-b12d-4d90-bd9c-ae514690cea6,cdp2w12_p17_s4_w51dc4e0d3-1552-4cdf-9fda-c130d89734d7,cdp2w12_p17_s4_w452524a03-bd1d-4349-a934-42dd223d589e,62,5609
1407,18207.0,25490-F07-1,BRD-K34435351-001-05-7,25490,F07,1,SA1857737,BRD-K34435351,BROAD_CPD_ID,Cc1cccc(C)c1NC(=O)Nc1cccs1,RFYOTDOOADPFKW-UHFFFAOYSA-N,cdp2w10-au00024359_f07_s1_w2fb012e3b-6522-41cc-aaf9-f57439a2a2ba,cdp2w10-au00024359_f07_s1_w3a070792b-05b3-419d-94f2-d013ef736ee2,cdp2w10-au00024359_f07_s1_w1788e96c1-ef3e-4aad-a372-47be4f6c0f9a,cdp2w10-au00024359_f07_s1_w5e0816a6f-3e48-4ca5-bd50-665c15189666,cdp2w10-au00024359_f07_s1_w41c08dffd-706f-4c9f-ae58-5c43ed552572,47,9237
1408,15562.0,25430-C21-2,BRD-K42557763-001-05-0,25430,C21,2,SA1852578,BRD-K42557763,BROAD_CPD_ID,O=C(NCc1nc2ccccc2[nH]1)c1ccc(cc1)S(=O)(=O)N1CCCC1,RGEJEBFSAUMZKZ-UHFFFAOYSA-N,cdp2w10_c21_s2_w27290a536-5002-4817-9b45-e955db5aaafd,cdp2w10_c21_s2_w37956417c-2811-47b6-bb9c-5ac9c5877e9c,cdp2w10_c21_s2_w1ac76b9f7-077f-4477-bfbd-b49cd3a6b38d,cdp2w10_c21_s2_w56351bfc4-115f-4998-9893-af1a3f748bcb,cdp2w10_c21_s2_w433b810cd-0f44-41b5-8745-069abb4bec41,47,9573
1409,10396.0,25378-C16-2,BRD-K85693506-001-06-1,25378,C16,2,SA1861680,BRD-K85693506,BROAD_CPD_ID,CC(C)(C)n1ncc2c1ncn(CC(=O)c1ccc(Cl)cc1)c2=O,RGHMGVRHYMHHPL-UHFFFAOYSA-N,cdp2w10_c16_s2_w2a1058126-7233-4278-a4f7-ce43b6f09a87,cdp2w10_c16_s2_w33a4085bd-9dbd-4872-a3a9-4c716c8eda89,cdp2w10_c16_s2_w1c10fb019-95d5-41fc-a6fd-703658ab49b8,cdp2w10_c16_s2_w583d7d89a-fc3a-4664-8f5a-4ef2e79744d7,cdp2w10_c16_s2_w41d789840-1e5a-4e54-831a-bb82db9b98e8,70,2085
1410,16674.0,25435-M03-4,BRD-K46698069-001-06-7,25435,M03,4,SA1853972,BRD-K46698069,BROAD_CPD_ID,CC(C)CCNc1nc(N2CCCC2)c2CN(C)CCc2c1C#N,RGMLPLCSNQEKLO-UHFFFAOYSA-N,cdp2w10_m03_s4_w254388efb-02ba-4c82-ba90-81fb5b866c1d,cdp2w10_m03_s4_w3d01ed85f-4f8a-43ca-a209-fecdd68ad7ce,cdp2w10_m03_s4_w127031e47-729d-4395-a226-56750c36e118,cdp2w10_m03_s4_w507bfddd5-75b1-410f-ba40-e502cefe4ba5,cdp2w10_m03_s4_w4be9216ae-1147-4143-9b85-435adfc27e9c,10,8988
1411,53119.0,26205-B09-5,BRD-K28207794-001-06-1,26205,B09,5,SA1854766,BRD-K28207794,BROAD_CPD_ID,CCN(CC)C(=O)c1cc(on1)-c1ccc(Br)cc1,RGPBBNVHNWQLRB-UHFFFAOYSA-N,cdp2w9x2-au00026617_b09_s5_w2292460e3-1ef2-46a5-9737-9df74ad61ec5,cdp2w9x2-au00026617_b09_s5_w342893daf-832b-4b82-b1a1-83e49d8d24e5,cdp2w9x2-au00026617_b09_s5_w1ad6d5f31-f82a-4768-867f-4d7f780a0a7e,cdp2w9x2-au00026617_b09_s5_w5f3222b5e-2c66-424e-91af-7398cbafe3ab,cdp2w9x2-au00026617_b09_s5_w4f3030dd2-8f19-4574-ad07-ba78bd38427c,73,7651
1412,40464.0,25949-K11-4,BRD-A78877355-003-03-6,25949,K11,4,SA83020,nefopam,INN,CN1CCOC(c2ccccc2)c2ccccc2C1,RGPDEAGGEXEMMM-UHFFFAOYSA-N,cdp2w8x2_k11_s4_w21393653d-7bbf-43da-9d10-c762faf974f6,cdp2w8x2_k11_s4_w36328a6ea-d7aa-41fa-8687-e3abe00f230e,cdp2w8x2_k11_s4_w1629a9e06-c2b5-4014-b45b-f3124907cfd9,cdp2w8x2_k11_s4_w5ae2e6418-38e3-4855-9e83-d5c4518ba02c,cdp2w8x2_k11_s4_w4a3f06ea0-5ef0-43b2-8c1d-703dca8eedf8,71,1177
1413,41850.0,25966-N17-4,BRD-K15519488-001-01-6,25966,N17,4,SA82595,benocyclidine,primary-common,C1CCN(CC1)C1(CCCCC1)c1cc2ccccc2s1,RGSVXQJPSWZXOP-UHFFFAOYSA-N,cdp2w8x2_n17_s4_w2404d18b1-f21f-4fb3-8a82-02ef865765d6,cdp2w8x2_n17_s4_w3ac50f0ef-854d-43f8-babc-22b1a1172404,cdp2w8x2_n17_s4_w193440379-2382-44a7-8ce5-500428bdc2dd,cdp2w8x2_n17_s4_w5ed91d951-281c-41f9-9fb0-c9cc557b9cac,cdp2w8x2_n17_s4_w4d618be13-02d2-477c-b60d-10b74cf448c0,60,261
1414,8667.0,24651-M21-1,BRD-K62599818-001-02-9,24651,M21,1,SA836441,BRD-K62599818,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccccc2)Oc2ncc(cc2C1=O)C#CC1CCCCC1,RGYLHRJGNKTVCX-OREGWCPLSA-N,cdp2w3_m21_s1_w28b29e995-089d-406b-ad31-2809bfcc0914,cdp2w3_m21_s1_w325970f88-4c47-49d9-a54c-7b102414cb56,cdp2w3_m21_s1_w1b13959e4-1dab-4c47-8267-ad3d0831d9c8,cdp2w3_m21_s1_w5505622b0-4987-4fb4-b1a0-791509c8c836,cdp2w3_m21_s1_w4b9881b6d-7b3a-4b60-9e35-345ed9f73977,77,10013
1415,24369.0,25581-L04-1,BRD-K36511139-001-05-2,25581,L04,1,SA1859595,BRD-K36511139,BROAD_CPD_ID,Fc1ccc(cc1)N1C(=S)S\C(=C/c2nc3ccccc3[nH]2)C1=O,RHCANUFDCKJCRQ-ZROIWOOFSA-N,cdp2w11_l04_s1_w207fe3c90-f40a-473f-b07e-8fe061e56dbb,cdp2w11_l04_s1_w37f8eddf3-3e5b-4d38-857e-32385f41ea1d,cdp2w11_l04_s1_w1faa5c95d-12e5-4071-95d0-858add6db406,cdp2w11_l04_s1_w5f4d38760-5cdf-41af-a298-e29bbbb586ae,cdp2w11_l04_s1_w48f5fe69d-6454-485a-add6-1168bb45f7f7,78,8011
1416,22588.0,25573-O07-2,BRD-K79702333-001-07-5,25573,O07,2,SA1860106,BRD-K79702333,BROAD_CPD_ID,N=c1c(cc(nn1-c1ccccc1)C(=O)c1cccs1)-c1nc2ccccc2[nH]1,RHDIOIKWAASMRW-UHFFFAOYSA-N,cdp2w11_o07_s2_w2043ca7db-972d-4efd-b0c5-7bc6b1b041b7,cdp2w11_o07_s2_w3bca30486-5149-42d3-95a6-be6b2237c254,cdp2w11_o07_s2_w1c21951cb-d147-4b96-b472-0251ff756904,cdp2w11_o07_s2_w50704eda3-45bc-47f0-b8fd-e9c37f214e9f,cdp2w11_o07_s2_w4fb8e2bd0-3f53-4ede-a4d2-c7e377d97995,71,5820
1417,18915.0,25503-H09-1,BRD-K84479162-001-06-1,25503,H09,1,SA1856080,BRD-K84479162,BROAD_CPD_ID,CC(=O)N(c1ccc2oc(C)c(C(C)=O)c2c1)S(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O,RHDIXELWUIYPIB-UHFFFAOYSA-N,cdp2w11-au00029680_h09_s1_w23582f624-6555-481f-9c64-800bb33139e9,cdp2w11-au00029680_h09_s1_w3d9c8fa7d-8022-4b7b-82d1-d9ed21c4e8df,cdp2w11-au00029680_h09_s1_w1eecf1b2f-779f-4436-bc23-342711e57491,cdp2w11-au00029680_h09_s1_w561a5d884-fd2d-4a0c-891b-3745d0b19b2d,cdp2w11-au00029680_h09_s1_w4b4de3ff2-1299-4f05-bbc2-279414b0caae,81,6856
1418,33471.0,25681-B16-1,BRD-A13318633-001-06-0,25681,B16,1,SA1857333,BRD-A13318633,BROAD_CPD_ID,OC(COc1ccc(CNCCc2ccc(cc2)C(F)(F)F)cc1)CN1CCCCC1,RHHUEMKHXMZVIG-UHFFFAOYSA-N,cdp2w12_b16_s1_w2855b00a7-6e27-4528-891d-364419721462,cdp2w12_b16_s1_w36881b284-3fc4-453a-b9de-3c0e60ae8b0d,cdp2w12_b16_s1_w10c3b7bba-a6e5-4e13-b6e1-111a6ac7d0dc,cdp2w12_b16_s1_w5c9e2a8ed-6383-4189-aa45-384c161b423a,cdp2w12_b16_s1_w4491ba065-6b3b-4e2f-bfec-bed0ef980790,39,7476
1419,26309.0,25591-A19-3,BRD-K73220266-001-05-9,25591,A19,3,SA1853521,BRD-K73220266,BROAD_CPD_ID,CN(C1CCCCC1)c1ccc(cc1[N+]([O-])=O)C(=O)Nc1cccc(C)n1,RHRQLRGZUIGXLQ-UHFFFAOYSA-N,cdp2w11_a19_s3_w2fd5d2208-0387-46c9-9d99-759dd409f024,cdp2w11_a19_s3_w321313e02-e79d-4ff5-9043-cbb6160df955,cdp2w11_a19_s3_w1ce35e4a9-9d43-42fc-958c-55801335c5e3,cdp2w11_a19_s3_w5721deee0-5f8d-4529-9bfd-cdedf1db5eae,cdp2w11_a19_s3_w48f921396-ef8d-4bb2-ba7a-7458f7d3b21b,51,3901
1420,13742.0,25416-P03-6,BRD-A44938643-001-05-8,25416,P03,6,SA1858132,BRD-A44938643,BROAD_CPD_ID,Cc1cc2nnc(SC3CCCCN(C(=O)c4ccc(F)cc4)C3=O)n2c2ccccc12,RIWDNPWRWRQCDB-UHFFFAOYSA-N,cdp2w10_p03_s6_w2406d084e-5866-4c38-b531-15636d91227a,cdp2w10_p03_s6_w3e65f0697-03e4-4d25-925e-db222b649151,cdp2w10_p03_s6_w1c03f61c3-3f5f-4820-9ab8-68f50a71e39b,cdp2w10_p03_s6_w5e8cd9a8c-a9dc-46b4-98af-1595eb1cb79d,cdp2w10_p03_s6_w4c481cf53-e0d7-4d36-a298-5e0f40cd087b,43,8806
1421,38615.0,25732-I07-6,BRD-K63478344-001-05-1,25732,I07,6,SA1859106,BRD-K63478344,BROAD_CPD_ID,O=C(Nc1cc2ccccc2oc1=O)C1CCCCC1,RJKSUFSHJKUPEX-UHFFFAOYSA-N,cdp2w12_i07_s6_w211dee328-3435-45bd-912a-7eff418ee769,cdp2w12_i07_s6_w3d246b720-c8ef-416c-bae8-ee4b67b32046,cdp2w12_i07_s6_w1b32f3955-0cf4-4f57-8e8f-22c772ae6edd,cdp2w12_i07_s6_w596d0d34f-2b95-4ba6-a01d-25d49b7a3293,cdp2w12_i07_s6_w4e41a7734-91f3-4cd9-b30f-a97652c37474,54,4801
1422,53699.0,26216-A13-3,BRD-K64657423-001-05-3,26216,A13,3,SA1858974,BRD-K64657423,BROAD_CPD_ID,Nc1nc(CSc2nc3ccccc3[nH]2)cs1,RJNOQUZPWTYHLI-UHFFFAOYSA-N,cdp2w9x2_a13_s3_w24942f880-7fff-46e0-903a-6c32c2e27bb7,cdp2w9x2_a13_s3_w334e80145-1da2-4c31-9e84-37634dc6a8a6,cdp2w9x2_a13_s3_w127942c51-6804-4513-a402-50121017f9c1,cdp2w9x2_a13_s3_w5a73c9401-c718-4861-9e6f-b28908c2ec4f,cdp2w9x2_a13_s3_w40b1ae55d-f2fe-412b-86c0-f1f885d24182,37,8023
1423,40131.0,25944-L05-1,BRD-A81177136-001-03-6,25944,L05,1,SA81861,KN-62,primary-common,CN(C(Cc1ccc(OS(=O)(=O)c2cccc3cnccc23)cc1)C(=O)N1CCN(CC1)c1ccccc1)S(=O)(=O)c1cccc2cnccc12,RJVLFQBBRSMWHX-UHFFFAOYSA-N,cdp2w8x2_l05_s1_w2fccf84e9-b352-4d7d-864b-ee1de1b09f5f,cdp2w8x2_l05_s1_w332322db4-7dd9-429b-b7e0-912d7a086ebf,cdp2w8x2_l05_s1_w154b4a965-87a0-4fd7-8a7d-cc0650ba87d7,cdp2w8x2_l05_s1_w52fe13f0d-321e-45ff-b574-84e4f9be97f6,cdp2w8x2_l05_s1_w4c9f54b23-51b6-478c-9e19-f4fea08bff75,61,838
1424,28710.0,25638-L21-4,BRD-K32406588-001-05-5,25638,L21,4,SA1860059,BRD-K32406588,BROAD_CPD_ID,COc1ccccc1C1CCN(CC1)C(S)=Nc1ccc(Br)cc1,RJYFVJPEXKPGNZ-UHFFFAOYSA-N,cdp2w12_l21_s4_w217578c37-ce8c-4a6f-9c77-0d59aa6dfac0,cdp2w12_l21_s4_w339d69ec7-b33a-49fb-a505-bfa9c54e8a18,cdp2w12_l21_s4_w1a03891c2-18c1-4028-a3fd-ca8b25aff705,cdp2w12_l21_s4_w5fca1eeaf-3b67-4699-9820-b68ccd004a2e,cdp2w12_l21_s4_w49a1e6c6f-942a-4c45-b5e3-ca7c5118600f,79,7488
1425,51439.0,26166-C21-5,BRD-K63584084-001-05-0,26166,C21,5,SA1857907,BRD-K63584084,BROAD_CPD_ID,Clc1ccc(NC(=O)Nc2ccccc2)cc1S(=O)(=O)N1CCOCC1,RKAXFNHIHLETJN-UHFFFAOYSA-N,cdp2w9x2-au00026617_c21_s5_w2e74e664b-c1b0-446f-8b3f-345e8e6d26a2,cdp2w9x2-au00026617_c21_s5_w3d26025a9-627d-41c9-b5b6-2caa5ec44a0c,cdp2w9x2-au00026617_c21_s5_w16220762c-f444-46d6-805e-57331d7fc169,cdp2w9x2-au00026617_c21_s5_w56bffe6bb-69cc-4620-8ae1-477e0af1ffd2,cdp2w9x2-au00026617_c21_s5_w4ecc6efe5-3c4a-493d-8be4-becc68bfb9ac,15,7307
1426,10543.0,25378-L10-5,BRD-K21287452-001-05-5,25378,L10,5,SA1857567,BRD-K21287452,BROAD_CPD_ID,COc1cc(NC(=O)CSc2nc3c(C)ccc(C)c3cc2C)c(cc1OC)C(O)=O,RKMNDAWJVXOWIR-UHFFFAOYSA-N,cdp2w10_l10_s5_w219858d1d-fe3a-47fc-9afd-29b37ff48335,cdp2w10_l10_s5_w3f96eeaec-1351-4b61-b09e-b5cb3a818da2,cdp2w10_l10_s5_w18268164a-ed3c-4ea6-ab47-0dc56934834d,cdp2w10_l10_s5_w557315ae3-fd42-406d-8672-64a49a07d6f7,cdp2w10_l10_s5_w464d2415a-e206-49df-b611-6f57723cb9cf,53,5697
1427,1237.0,24293-I18-2,BRD-K90065682-300-01-8,24293,I18,2,SA792529,5-Iodo-A-85380 dihydrochloride,to-be-curated,Ic1cncc(OC[C@@H]2CCN2)c1,RKVRGRXOYDTUEY-QMMMGPOBSA-N,cdp2bioactives_i18_s2_w2814b2787-529c-41a6-8c36-eb2da25d4f58,cdp2bioactives_i18_s2_w3303aeef8-2539-41d7-80c6-b282a15699a2,cdp2bioactives_i18_s2_w163d6e03f-ea47-4777-ba4e-c8b9e00a0ad6,cdp2bioactives_i18_s2_w513d53db3-b273-43f6-b1ac-d3b643444ae1,cdp2bioactives_i18_s2_w40c2218c9-509e-4934-b8e8-f12d4ea6327e,129,801
1428,34277.0,25686-F03-3,BRD-K48308907-001-05-9,25686,F03,3,SA1853500,BRD-K48308907,BROAD_CPD_ID,Nc1nc(O)c(cc1S(=O)(=O)c1ccc(Cl)cc1)C#N,RLBOYZWCNDHMNA-UHFFFAOYSA-N,cdp2w12_f03_s3_w254639993-5a57-4195-9309-7783cc7dbb38,cdp2w12_f03_s3_w3d3faed40-7d1a-47a8-86ea-ff20406d22d0,cdp2w12_f03_s3_w187472308-78e1-446d-b3eb-ace00c7f5002,cdp2w12_f03_s3_w5e1851e2d-edb2-48ab-8f08-bfd110d6e4ba,cdp2w12_f03_s3_w449571600-4a00-414d-93d3-d2be2568a0c4,62,4480
1429,11997.0,25403-D04-1,BRD-K62469681-001-05-2,25403,D04,1,SA1852518,BRD-K62469681,BROAD_CPD_ID,CC(C)CCN=C(S)Nc1ccc(Br)cc1,RLFJFXJUHLAJGX-UHFFFAOYSA-N,cdp2w10_d04_s1_w2afdf80ff-8a6e-4aa5-a72c-bc3eb8015eae,cdp2w10_d04_s1_w3dbf42da4-db50-4e78-949f-9e69d5cb4b85,cdp2w10_d04_s1_w16129fe15-c97d-4e93-a9e5-fff8083d2c97,cdp2w10_d04_s1_w5176964d9-beb7-49b8-9b3c-aaf73ebcfb32,cdp2w10_d04_s1_w47e33c0d1-a20e-45dd-b824-69fa7b1f9f66,48,9217
1430,17790.0,25488-B12-4,BRD-K51011518-001-05-4,25488,B12,4,SA1857527,BRD-K51011518,BROAD_CPD_ID,Fc1cccc2sc(C(=O)Nc3cccnc3)c(Cl)c12,RLHIURWBOSZJQC-UHFFFAOYSA-N,cdp2w10-au00024357_b12_s4_w2a75008ea-881e-495b-aea5-24cfc255f86b,cdp2w10-au00024357_b12_s4_w30e76a540-fd4f-474c-9049-7ad69e6f9ae4,cdp2w10-au00024357_b12_s4_w1da3e4665-a13a-4790-997d-35921dc298ad,cdp2w10-au00024357_b12_s4_w59909fda4-fe4a-4218-b8bb-5d7b3bace4e3,cdp2w10-au00024357_b12_s4_w4f8c8b693-f82d-49f0-86dd-02ccd645da3f,34,5132
1431,8892.0,24726-P23-4,BRD-K00468432-001-02-8,24726,P23,4,SA666917,BRD-K00468432,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2,RLIRIECCVMDDQV-FGSXEWAUSA-N,cdp2w5_p23_s4_w2fbaccc3d-c455-4bc7-82b9-0109788332fb,cdp2w5_p23_s4_w3abc44e93-413a-4539-b041-27abb5bbbb63,cdp2w5_p23_s4_w1fb316d36-afa5-4dec-9021-383e79178905,cdp2w5_p23_s4_w55159e197-2137-447b-9a18-bec423346d9e,cdp2w5_p23_s4_w46d2686a1-2b07-41cd-90a6-99c727b985a0,95,9792
1432,24971.0,25584-F17-3,BRD-K10099406-001-05-4,25584,F17,3,SA1859169,BRD-K10099406,BROAD_CPD_ID,CSc1nc(C)c(CC=C)c(Nc2ccc(cc2)C(C)=O)n1,RLOYZRXJORMUGM-UHFFFAOYSA-N,cdp2w11_f17_s3_w299e4fe1d-c593-45eb-b6a8-459a78240e06,cdp2w11_f17_s3_w3154579c6-8f64-4546-9b5f-d2956d752e3e,cdp2w11_f17_s3_w121da8fd1-0d16-43e8-a3f5-6a8870a06316,cdp2w11_f17_s3_w56aca1ff7-424b-4d22-9784-1b3e3a310dfd,cdp2w11_f17_s3_w4ae23c68d-df90-494c-a406-182449a6680f,73,4037
1433,13850.0,25418-E21-6,BRD-K49217806-001-05-3,25418,E21,6,SA1861011,BRD-K49217806,BROAD_CPD_ID,[O-][N+](=O)c1cccc2ccc(\C=C\c3cccc(Br)c3)nc12,RLTWFNLCFOIRSF-VQHVLOKHSA-N,cdp2w10_e21_s6_w2891b0371-60ea-4361-b932-b1067a688f67,cdp2w10_e21_s6_w3fa6e43e4-72d4-4042-bde4-d298f04e0775,cdp2w10_e21_s6_w165e38013-f3de-45ed-8e58-e78d8b2e20f8,cdp2w10_e21_s6_w5e4f23c77-3fdc-45a1-8860-859dd821d5ff,cdp2w10_e21_s6_w481d52bbd-b9d1-4e89-8d4a-60cb3d8bc64b,42,2098
1434,7488.0,24512-L05-1,BRD-K66869427-001-05-8,24512,L05,1,SA1854913,BRD-K66869427,BROAD_CPD_ID,COc1cc(NC(=O)Nc2ccc(C)cc2)cc(c1)[N+]([O-])=O,RMAVCEAOKKMEAX-UHFFFAOYSA-N,cdp2w10_l05_s1_w24daeec6b-fefe-4877-bf32-4a63ac879450,cdp2w10_l05_s1_w39dd9b070-b978-4c9a-bfe9-130ef1fb89e0,cdp2w10_l05_s1_w17722cd05-ce86-4737-9b8d-a894d41d9cc0,cdp2w10_l05_s1_w56b1b1002-0a9e-49f1-80af-be20e43ccafc,cdp2w10_l05_s1_w4f947f0cf-c1c6-4c39-981e-5ce97edf9abc,29,6186
1435,50794.0,26140-D06-2,BRD-K22797212-001-05-3,26140,D06,2,SA1858521,BRD-K22797212,BROAD_CPD_ID,Fc1cccc(Cl)c1Cn1nnc(n1)-c1ccc2OCOc2c1,RMCVPFPCKDTWRN-UHFFFAOYSA-N,cdp2w9x2_d06_s2_w2467dc4cf-05fe-4249-a639-c1152e7d20e2,cdp2w9x2_d06_s2_w3a113ad5c-c1f6-4614-a674-ff54457c4373,cdp2w9x2_d06_s2_w12aef2ca2-c0c9-4b94-88c5-ebcf4324e267,cdp2w9x2_d06_s2_w5921204e9-8a2d-4ca5-a059-7637c767b4dc,cdp2w9x2_d06_s2_w4b5ffeccc-2ee1-4803-83eb-2494c4a225ac,91,6353
1436,22010.0,25572-A18-6,BRD-K75977772-001-05-9,25572,A18,6,SA1861199,BRD-K75977772,BROAD_CPD_ID,Oc1cccc(NC(=S)NC(=O)c2ccco2)c1,RMDOBGURCUPDKG-UHFFFAOYSA-N,cdp2w11_a18_s6_w2e2031a44-ebd3-4353-b72d-d7aed8548acb,cdp2w11_a18_s6_w366cb512c-7e08-4ac1-a964-c83946b27b07,cdp2w11_a18_s6_w1f84a7128-6506-4cf5-aceb-2e72bd332b2d,cdp2w11_a18_s6_w590e7a808-b5ff-4f11-8611-3cec019b249e,cdp2w11_a18_s6_w425b8076f-f94d-428b-9bc3-109076f04f5c,76,4362
1437,25631.0,25587-H08-3,BRD-A40790605-001-05-3,25587,H08,3,SA1857133,BRD-A40790605,BROAD_CPD_ID,CCC(CC(C)(C)O)C(=O)NN=C(S)Nc1ccccc1,RMNBOJKGAAWJLB-UHFFFAOYSA-N,cdp2w11_h08_s3_w28322d410-3e9e-43c2-922b-e4030e4ccb74,cdp2w11_h08_s3_w3d4773411-4e76-48bc-94e3-e4f1b1829ac4,cdp2w11_h08_s3_w18dc3a02a-b8ca-4604-9a0a-d981d99fda40,cdp2w11_h08_s3_w56bd8ec44-4fe9-4264-8cec-2fa6bef5a79b,cdp2w11_h08_s3_w45b060c63-75e8-49e6-ab9b-6847467874c5,49,3261
1438,18185.0,25490-E20-3,BRD-K47056313-001-05-3,25490,E20,3,SA1860945,BRD-K47056313,BROAD_CPD_ID,Cc1ccn2c(NCc3ccc4OCOc4c3)c(nc2c1)-c1ccc(O)cc1,RMNOPEFPXPCWOO-UHFFFAOYSA-N,cdp2w10-au00024359_e20_s3_w2cbfae745-1cd6-443f-8423-9be2fe4ad2e8,cdp2w10-au00024359_e20_s3_w340f7ff2d-4ba4-4c15-a021-6f76269c4f12,cdp2w10-au00024359_e20_s3_w1c8f82f2a-8500-4eed-99d6-6b74f8a407d9,cdp2w10-au00024359_e20_s3_w5cf7caee9-be9e-47e7-ae20-f5bf7a57fb91,cdp2w10-au00024359_e20_s3_w49bc1f6c9-8819-42ca-9b73-ee9cb118a435,65,3893
1439,49992.0,26133-N09-4,BRD-A64849281-001-06-7,26133,N09,4,SA1860541,BRD-A64849281,BROAD_CPD_ID,COc1ccc(cc1CN1CCN(CC1)c1ccc(F)cc1)C1c2c(C)n[nH]c2OC(N)=C1C#N,RMRMZYPGKLMUFK-UHFFFAOYSA-N,cdp2w9x2_n09_s4_w27591b132-b153-4bad-bdd1-1f878e055b8d,cdp2w9x2_n09_s4_w31ffc6328-0606-47f1-8669-480014fe7130,cdp2w9x2_n09_s4_w1e746f275-f932-4758-8190-de25966b8ff9,cdp2w9x2_n09_s4_w52fba7880-2be5-4cf2-a348-5ac4adeae4e8,cdp2w9x2_n09_s4_w4337888b9-62d7-4984-b8f0-0d76462a1f5c,93,9539
1440,46048.0,26060-F22-2,BRD-K20470077-001-05-3,26060,F22,2,SA1855434,BRD-K20470077,BROAD_CPD_ID,Clc1ccc(cc1)-c1cn2CCSc2n1,RMVBKVLYENHZTQ-UHFFFAOYSA-N,cdp2w9x2_f22_s2_w2fb5d0df2-4b25-4469-913c-eb5edfcdc298,cdp2w9x2_f22_s2_w396135f6a-35ef-4515-aa56-4ab761c76a60,cdp2w9x2_f22_s2_w15da97862-d2f1-40a2-b920-cbbe90b02fb9,cdp2w9x2_f22_s2_w529be4ea6-f29c-4e9c-8fd7-de5034aee034,cdp2w9x2_f22_s2_w42503acb0-1e61-4500-a7bf-7814868679de,77,9018
1441,2216.0,24300-G07-3,BRD-A17831693-001-02-4,24300,G07,3,SA58121,dihydromunduletone,primary-common,COc1c(CC(=O)c2cc3CC(O)C(C)(C)Oc3cc2O)ccc2OC(C)(C)C=Cc12,RMVZECFNOTWEKD-UHFFFAOYSA-N,cdp2bioactives_g07_s3_w25eab71dd-162b-4bd0-9108-87a45842fc10,cdp2bioactives_g07_s3_w39cde2047-73be-456c-aa16-92baab3a5feb,cdp2bioactives_g07_s3_w1143aa337-62a3-4b63-81b5-005f14944071,cdp2bioactives_g07_s3_w5a86c918f-a950-4107-8ba0-9d93fd410777,cdp2bioactives_g07_s3_w43d2b28b4-5a3c-4f30-ad4b-339169cbcfcc,50,6532
1442,29281.0,25641-K10-5,BRD-K32699895-001-05-3,25641,K10,5,SA1855945,BRD-K32699895,BROAD_CPD_ID,CCOC(=O)N1CCN(CC1)C(=O)CSc1nc(O)c2cnn(-c3ccc(Cl)cc3)c2n1,RMWHYSKNRURCFY-UHFFFAOYSA-N,cdp2w12_k10_s5_w24013b9e9-bfd9-4209-83bf-b296bdd6b84f,cdp2w12_k10_s5_w399b7f7c6-c270-4b53-b6e8-d0139c04ace9,cdp2w12_k10_s5_w1eb9fdf27-68b5-48cf-9a9e-c49c8914288f,cdp2w12_k10_s5_w5c98711ca-e177-4ce6-8123-9bda809b9f01,cdp2w12_k10_s5_w416990034-ed4a-4fdf-a5e4-a3ae0a87d54a,72,6302
1443,55939.0,26680-D05-5,BRD-K49896017-001-01-8,26680,D05,5,SA418630,BRD-K49896017,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Nc2c(C)noc2C)OCc2cnnn2CCCC1=O,RMZGJSLXUIRDMP-SPYBWZPUSA-N,cdp2w13_d05_s5_w249faa82b-4d0c-4112-9bf8-b93d47e0bcf8,cdp2w13_d05_s5_w3b98c54db-3934-45bd-bac7-2e66647d067d,cdp2w13_d05_s5_w1f9e674a8-5ba2-4557-bd0c-397e9b9bbc35,cdp2w13_d05_s5_w5781349c1-db09-4252-a0fa-50ee297137e5,cdp2w13_d05_s5_w49ec7bf23-b582-4f76-9910-8bb1d1bf3ce6,96,9990
1444,54270.0,26232-F04-4,BRD-K85383046-001-02-5,26232,F04,4,SA82079,IAA-94,common,C[C@]1(Cc2cc(OCC(O)=O)c(Cl)c(Cl)c2C1=O)C1CCCC1,RNOJGTHBMJBOSP-KRWDZBQOSA-N,cdp2w9x2_f04_s4_w251bcbde1-4638-4a76-a57b-c0cb3f89e087,cdp2w9x2_f04_s4_w319220ac8-2b85-4bca-b8a0-807dff42f104,cdp2w9x2_f04_s4_w18dd142e3-bcec-43c9-9d02-47ceee6e80bd,cdp2w9x2_f04_s4_w5d8404c7a-c497-4b2f-9502-46592a7cbb35,cdp2w9x2_f04_s4_w44f337193-97b3-439d-8626-74f9f1a4d108,56,4189
1445,816.0,24279-O01-1,BRD-K96163925-001-06-5,24279,O01,1,SA83623,scopoletin,primary-common,COc1cc2ccc(=O)oc2cc1O,RODXRVNMMDRFIK-UHFFFAOYSA-N,cdp2bioactives_o01_s1_w2fe502e40-fb50-4d48-82cd-38f27e9b0dbe,cdp2bioactives_o01_s1_w39ac3bb18-ab2b-4ee5-a418-5e4a76d187c3,cdp2bioactives_o01_s1_w1cacf3dcb-3bb7-49f2-9799-f0478b0166ee,cdp2bioactives_o01_s1_w534f32040-d368-40c4-8d27-b93b29d3da28,cdp2bioactives_o01_s1_w45496a839-a446-43fb-ba14-039851e8fa6e,79,637
1446,30153.0,25663-G12-1,BRD-K20323744-001-05-7,25663,G12,1,SA1852431,BRD-K20323744,BROAD_CPD_ID,COc1ccc(cc1)-c1cccc(c1)C(=O)Nc1cccc(c1)C(O)=O,ROHSXYKNRZDETL-UHFFFAOYSA-N,cdp2w12_g12_s1_w286b6bccf-e724-4786-8d38-5c4a74162a94,cdp2w12_g12_s1_w3fc9fe7e6-0df7-4e5a-9f8d-acc556d89cf8,cdp2w12_g12_s1_w1d5c43cb1-a0c8-46ad-baeb-c835626a3bd5,cdp2w12_g12_s1_w5d0085902-f3cd-46bc-aff2-769901bb1373,cdp2w12_g12_s1_w44753a80f-2e0a-4eac-9378-6042c8e09ecf,73,6365
1447,17037.0,25436-N18-1,BRD-K67118123-001-04-9,25436,N18,1,SA1854457,BRD-K67118123,BROAD_CPD_ID,CCCCn1c(O)c(N=Nc2ccccc2O)c2ccccc12,ROUWLSYGZNMXGO-UHFFFAOYSA-N,cdp2w10_n18_s1_w2f67b4733-5ec9-46d1-b4ba-d8d24fa83473,cdp2w10_n18_s1_w347e346e7-6f04-4a27-92cf-005dbc7e6992,cdp2w10_n18_s1_w189dee280-dd7f-4cc4-84b7-1c009c5d3387,cdp2w10_n18_s1_w554766213-e38a-4560-bb8d-82d08e412285,cdp2w10_n18_s1_w4c5a0e8f6-9333-4a6a-85ec-f1426685c04b,54,8054
1448,26415.0,25591-I18-1,BRD-K48189030-001-05-3,25591,I18,1,SA1859050,BRD-K48189030,BROAD_CPD_ID,OC(=O)\C=C/c1cn(nc1-c1cc2ccccc2o1)-c1ccccc1,RPBVHEVTQXVWDL-KHPPLWFESA-N,cdp2w11_i18_s1_w281a85cd3-b909-4109-acdc-907b3c5c0446,cdp2w11_i18_s1_w38cb7cf36-c9b7-46fe-bfdd-69da3abb3067,cdp2w11_i18_s1_w11f29bf11-541e-491c-9450-6668cbaa5cee,cdp2w11_i18_s1_w5fe5cc7ee-17c6-439e-b6bb-032eb4762124,cdp2w11_i18_s1_w4110dd476-907d-4986-8885-afa4a22dfbb6,72,1642
1449,34479.0,25686-O20-1,BRD-K49243142-001-05-2,25686,O20,1,SA1853343,BRD-K49243142,BROAD_CPD_ID,C=CCSc1n[nH]c(n1)-c1cccs1,RPRQETFEPUYFMP-UHFFFAOYSA-N,cdp2w12_o20_s1_w25878640f-bede-4077-a048-ea2bb70c172a,cdp2w12_o20_s1_w39c84d2aa-7440-4833-8895-ad6f9bf1565f,cdp2w12_o20_s1_w1c62cd5b3-3f7a-45b5-a104-2df2ac4f654e,cdp2w12_o20_s1_w5b4dac263-20d1-4d75-917b-a831d5d2b91a,cdp2w12_o20_s1_w405365261-b57b-4a39-bbbf-9855bf86b1eb,48,8178
1450,26495.0,25591-N14-3,BRD-K75536516-001-05-4,25591,N14,3,SA1857970,BRD-K75536516,BROAD_CPD_ID,Oc1nc(nc2n(Cc3cccc(Cl)c3)nnc12)C(=O)NCc1ccco1,RPSTZWISHZSYDI-UHFFFAOYSA-N,cdp2w11_n14_s3_w2d03d6678-4602-434c-8584-835603a8e8a2,cdp2w11_n14_s3_w31b1dacaf-ac0b-4aac-a741-623012a9c47e,cdp2w11_n14_s3_w1f2660e31-e88e-438b-bac2-313eadd3fc75,cdp2w11_n14_s3_w504736901-ab1b-4909-b68d-deb6cf5f7b61,cdp2w11_n14_s3_w4acf71047-9cfb-4f13-9c2c-69b8eaf780bc,78,8161
1451,26391.0,25591-G13-1,BRD-K14593914-001-06-5,25591,G13,1,SA1855242,BRD-K14593914,BROAD_CPD_ID,Cc1ccc(Cn2nnc3c(O)nc(nc23)C2CCN(CC2)S(=O)(=O)c2cc(C)ccc2C)cc1,RPUZVOGBSPSARV-UHFFFAOYSA-N,cdp2w11_g13_s1_w2f008d846-3024-4182-bc31-cd77971c6d2f,cdp2w11_g13_s1_w31b9f14e3-88af-4206-8893-05f820ce814f,cdp2w11_g13_s1_w1640b8d5e-6319-4ca7-af1b-01dcf780c47b,cdp2w11_g13_s1_w5c7e14b0f-dec7-4f5b-947c-b92429d83cae,cdp2w11_g13_s1_w4d90b8b7a-972f-46c9-a7de-e54c10ad8046,62,9046
1452,35314.0,25690-I17-2,BRD-K03591115-001-05-1,25690,I17,2,SA1858012,BRD-K03591115,BROAD_CPD_ID,COc1cc2c(CC(=O)Nc3ccccc3)c(O)cc(N3CCOCC3)c2cc1OC,RPWLKLZKOBXITE-UHFFFAOYSA-N,cdp2w12_i17_s2_w2799c732c-a7f6-421e-9e72-5f518f5e8163,cdp2w12_i17_s2_w3405979c4-534e-44bd-a685-e5989c6ba8a6,cdp2w12_i17_s2_w1f23ccf6f-3b30-43d3-a0f6-67fac712c8c1,cdp2w12_i17_s2_w5b00ddd7d-5687-45e6-9bad-a625f71d5e86,cdp2w12_i17_s2_w41ebc56bd-e53e-42a0-8145-72e07d555046,101,1286
1453,44373.0,25988-K11-1,BRD-K53545112-304-01-6,25988,K11,1,SA792298,CNQX,common,Oc1nc2cc(C#N)c(cc2nc1O)[N+]([O-])=O,RPXVIAFEQBNEAX-UHFFFAOYSA-N,cdp2w8x2_k11_s1_w20646bf42-4c14-4507-8b78-f5eb3aed4eba,cdp2w8x2_k11_s1_w3a620202c-d384-4d8b-9fea-05b473a24bcc,cdp2w8x2_k11_s1_w1980980fb-f94e-4590-9934-da9f01fcfd97,cdp2w8x2_k11_s1_w51a490215-b5fb-489b-a91e-fb8a9df8e630,cdp2w8x2_k11_s1_w4d944aca8-affb-4789-9b67-e6cb7bd403aa,62,1008
1454,42977.0,25983-M22-3,BRD-K36021395-300-01-6,25983,M22,3,SA792829,ABT-702,primary-common,Nc1ncnc2nc(cc(-c3cccc(Br)c3)c12)-c1ccc(nc1)N1CCOCC1,RQCXKDWOCUJWQZ-UHFFFAOYSA-N,cdp2w8x2_m22_s3_w2f97c4220-8a1a-443c-a96f-965f21f3d908,cdp2w8x2_m22_s3_w36873390f-5936-48a9-bbb9-92cec36d211e,cdp2w8x2_m22_s3_w1da9c491e-9ebc-4bad-801c-be4794c44bb5,cdp2w8x2_m22_s3_w51f472d35-e116-475e-b391-f1908a759996,cdp2w8x2_m22_s3_w4c51036db-741c-4f9b-b0aa-712d8b56327d,34,609
1455,44166.0,25987-N16-4,BRD-K57304726-003-03-6,25987,N16,4,SA792045,PRE-084,to-be-curated,O=C(OCCN1CCOCC1)C1(CCCCC1)c1ccccc1,RQHKZUBCUZVZEF-UHFFFAOYSA-N,cdp2w8x2_n16_s4_w2e5922227-0406-484e-9dd7-2bfd333b2d97,cdp2w8x2_n16_s4_w3ec1a32ce-c151-4bbf-8ff6-47aa2af6fa2b,cdp2w8x2_n16_s4_w13a6770a5-3fac-4bcd-bebf-67f45757e97d,cdp2w8x2_n16_s4_w58b5bb3de-9d40-4ebe-82e7-d5b64443f8df,cdp2w8x2_n16_s4_w41e524609-b030-44ee-97c9-efef78779081,42,654
1456,56184.0,26703-F13-4,BRD-K32986110-001-01-2,26703,F13,4,SA1481594,BRD-K32986110,BROAD_CPD_ID,COc1cccc(c1)C#Cc1ccc(cc1)[C@H]1[C@H](CO)N([C@@H]1C#N)C(=O)c1ccccn1,RQNIZPLHIPGYGU-DSNGMDLFSA-N,cdp2w13_f13_s4_w2712919bc-5e64-4258-97d6-595c50f9dfb6,cdp2w13_f13_s4_w3ba530063-5003-4042-bcd1-9cedc4d3e751,cdp2w13_f13_s4_w19d9a3f4f-cad9-4a5e-9684-fe2f7b57eec1,cdp2w13_f13_s4_w56b4c9c10-9cc4-4f32-a0d0-015c28b8f34f,cdp2w13_f13_s4_w46305081a-8bd9-4320-874d-c55de5e7e2f1,61,10442
1457,15956.0,25432-I15-6,BRD-K93608743-001-05-4,25432,I15,6,SA1852278,BRD-K93608743,BROAD_CPD_ID,Cc1nnc(NC(=O)CSc2nnc(-c3ccoc3C)n2-c2cc(C)ccc2C)s1,RQOHWYYMMAZHPG-UHFFFAOYSA-N,cdp2w10_i15_s6_w25dbbac54-df0e-463a-96d8-a739c61191dd,cdp2w10_i15_s6_w3b44840f4-a910-4d7f-878e-a6d34bd21330,cdp2w10_i15_s6_w170d10fea-fcea-4d66-8fa3-4377932303d9,cdp2w10_i15_s6_w5b6d66378-1626-4fc3-a12f-4fc462a4fc59,cdp2w10_i15_s6_w4a600fc9f-f5be-492a-b5ef-3ea22e57964c,47,6602
1458,14358.0,25422-C13-4,BRD-K93001141-001-06-8,25422,C13,4,SA1853495,BRD-K93001141,BROAD_CPD_ID,CC(C)CN(CC(C)C)C(S)=NC1CCCCC1,RQQYMIYZTDXXRP-UHFFFAOYSA-N,cdp2w10_c13_s4_w216f84c2d-8bb7-4e9a-aaa9-a3cdaf9dffed,cdp2w10_c13_s4_w3445a7e0a-b016-4c2a-91f5-6168d186e53e,cdp2w10_c13_s4_w1900923c6-917c-4c45-a442-4bf7d6f34668,cdp2w10_c13_s4_w59dc4d6c3-e22c-4872-a370-a44470fa9d70,cdp2w10_c13_s4_w49f6869e9-cf23-47d4-a834-e2a1ebc2070a,60,2419
1459,26292.0,25591-A13-4,BRD-K27695682-001-05-5,25591,A13,4,SA1854709,BRD-K27695682,BROAD_CPD_ID,Brc1cccc(c1)C(=O)Nc1nnc(s1)S(=O)(=O)N1CCOCC1,RQUSDTWRBIDVPI-UHFFFAOYSA-N,cdp2w11_a13_s4_w2f4d87249-b9a8-43ad-aa74-02145077d927,cdp2w11_a13_s4_w30cb05a9c-70e0-43b3-acaf-a54ea7e48194,cdp2w11_a13_s4_w159813e4d-3792-404e-990b-abf1fc8223f4,cdp2w11_a13_s4_w548fdc3c9-2b21-478e-a45d-0f19170a91da,cdp2w11_a13_s4_w429183b73-1827-4c28-bd3f-dcd46e880884,94,4361
1460,42325.0,25968-B02-5,BRD-K19507340-001-03-1,25968,B02,5,SA83664,megestrol acetate,USAN,CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O,RQZAXGRLVPAYTJ-GQFGMJRRSA-N,cdp2w8x2_b02_s5_w26ff605de-896d-4a5d-b8d9-d0607ab828bd,cdp2w8x2_b02_s5_w33dbe39a9-4e48-465a-9551-b65de60680fb,cdp2w8x2_b02_s5_w1e2a84295-66a3-49f4-9db0-0804f9c7e338,cdp2w8x2_b02_s5_w5952483c1-26fa-4961-a178-36f62182ffee,cdp2w8x2_b02_s5_w4a74473ec-f45f-4420-9cc6-0cbb4dc7620f,49,1368
1461,11741.0,25392-E10-3,BRD-K33945151-001-06-6,25392,E10,3,SA1859342,BRD-K33945151,BROAD_CPD_ID,NNc1nc2c(Cl)ccc(Cl)c2s1,RRAGSBRZTNXWEH-UHFFFAOYSA-N,cdp2w10_e10_s3_w26abdfd01-adda-454d-8919-fbd6bf554d92,cdp2w10_e10_s3_w39bedc0b8-a4ee-4a3c-b73b-4c5b377c81c8,cdp2w10_e10_s3_w1c9359c53-2a4c-40f1-9e76-a64057953ec8,cdp2w10_e10_s3_w5047d5cac-6757-4f83-a773-c8fe57a768f1,cdp2w10_e10_s3_w4a31601f2-2165-4aeb-95cd-7ad95515dae0,64,8733
1462,24588.0,25583-E18-4,BRD-K98983552-001-06-4,25583,E18,4,SA1854085,BRD-K98983552,BROAD_CPD_ID,CCN1CCCc2cc(CN(CCN3CCOCC3)C(S)=Nc3cccc(C)c3)ccc12,RRENLRDKBVITHW-UHFFFAOYSA-N,cdp2w11_e18_s4_w2136657af-1e2c-44c0-8984-f1b8ebab8295,cdp2w11_e18_s4_w318269ba1-87aa-4c66-8eea-2ac2b29599cf,cdp2w11_e18_s4_w19744e85f-b46c-43bf-b22a-823593593926,cdp2w11_e18_s4_w5cdfdce3e-d57c-4ecd-9fc5-ad0f597d75ef,cdp2w11_e18_s4_w4fa4e5a83-f7f9-48a7-8a1e-8d7a382697d3,76,4961
1463,24962.0,25584-F13-6,BRD-K08104195-001-06-9,25584,F13,6,SA1859229,BRD-K08104195,BROAD_CPD_ID,CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccccc3)n2)nc1N,RRXYXSMOOQIPTM-UHFFFAOYSA-N,cdp2w11_f13_s6_w291e41eee-34be-4d62-bf24-d915e609452b,cdp2w11_f13_s6_w3b0df4a78-38ea-4e7d-8557-cc5070e15936,cdp2w11_f13_s6_w1a2e81970-6d10-456e-948e-427c7ba05329,cdp2w11_f13_s6_w541e1ee17-a23b-466d-9698-84607cc7fab1,cdp2w11_f13_s6_w40f1c8f7f-762a-4995-84e7-bbda676bf4c6,65,7837
1464,29265.0,25641-K06-1,BRD-K20416270-001-06-9,25641,K06,1,SA1861050,BRD-K20416270,BROAD_CPD_ID,Cc1ccc(cc1)C(=O)NNc1ncnc2ccccc12,RSDGCYDAXDDFIL-UHFFFAOYSA-N,cdp2w12_k06_s1_w241cc85fd-a27a-4c28-895e-0117bec775a2,cdp2w12_k06_s1_w346b33609-df95-41e3-92aa-672437bad46c,cdp2w12_k06_s1_w166ca992c-ca25-4e49-842c-90dbbe6905ac,cdp2w12_k06_s1_w567d33de6-551b-464c-ac9a-99647a5e552f,cdp2w12_k06_s1_w47500a487-9b4e-4264-9997-e938460913ba,41,6633
1465,7767.0,24565-M19-4,BRD-K55461955-001-01-6,24565,M19,4,SA430797,BRD-K55461955,BROAD_CPD_ID,CC(C)NC(=O)N(C)C[C@H]1OCCCC[C@H](C)Oc2ccc(NC(=O)NC3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@H](C)CO,RSKGZFLSRBPJST-YDXRHMNESA-N,cdp2bioactives-au00026722_m19_s4_w2979c2934-220a-4d52-8174-fc666190b5b5,cdp2bioactives-au00026722_m19_s4_w341b8eb25-6da3-407e-bb77-fe7b99eeed66,cdp2bioactives-au00026722_m19_s4_w1ef9106cc-1196-4e82-8507-8fd06d5dff73,cdp2bioactives-au00026722_m19_s4_w50b86067f-e2d4-4a3c-9279-322acc12fce1,cdp2bioactives-au00026722_m19_s4_w40cab7e2f-c0d6-4013-9fb2-7a944eea60d8,120,9959
1466,16301.0,25434-K22-3,BRD-K82542855-001-05-2,25434,K22,3,SA1859344,BRD-K82542855,BROAD_CPD_ID,C\[N+]([O-])=C/c1ccc2cccc(O)c2n1,RSUJKVFIFBVKPR-NTUHNPAUSA-N,cdp2w10_k22_s3_w20cd59f61-f60d-4019-960d-56aa9eccf00b,cdp2w10_k22_s3_w30bfa49a9-73c9-42d9-a0a3-d4822fe7b3ab,cdp2w10_k22_s3_w1682d6db7-209a-41a3-9a24-d59d231950bd,cdp2w10_k22_s3_w597ad77dd-fcaf-4a98-813b-7464488b78f2,cdp2w10_k22_s3_w40a2d6379-c1c4-4297-be39-4f0e42590e1f,42,6075
1467,17369.0,25438-N11-3,BRD-K81581075-001-06-3,25438,N11,3,SA1859608,BRD-K81581075,BROAD_CPD_ID,FC(F)(F)Oc1ccc(NC(=O)COC(=O)Cc2c(Cl)cccc2Cl)cc1,RTGOJNYUSNXXMX-UHFFFAOYSA-N,cdp2w10_n11_s3_w23a4268de-87fd-4216-b33e-2670ccf4a10a,cdp2w10_n11_s3_w3cc550475-8f14-4b60-a553-949c2d4b3650,cdp2w10_n11_s3_w1b904e659-bbfc-45ac-b404-45efe0610f6d,cdp2w10_n11_s3_w599f8ce72-4cdd-4e70-9c0c-4d2f864f0b9a,cdp2w10_n11_s3_w4cf34848b-f0c2-4e07-bdd4-9e5e9d33ec68,76,5903
1468,39855.0,25939-K18-1,BRD-A31159102-001-01-9,25939,K18,1,SA82515,fluoxetine,INN,CNCCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1,RTHCYVBBDHJXIQ-UHFFFAOYSA-N,cdp2w8x2_k18_s1_w2463e4b14-f098-466f-ba8b-1ef431da540a,cdp2w8x2_k18_s1_w3deebb3b5-a3c7-464a-b083-3a1efcbeb188,cdp2w8x2_k18_s1_w1dccdc214-92da-4cf5-8a73-5fda4a2451b6,cdp2w8x2_k18_s1_w5249ab0f6-b090-4b9e-9255-b3e917dca47c,cdp2w8x2_k18_s1_w40f5f86a1-9e24-437d-907f-e668366d17a5,103,61
1469,49919.0,26133-J22-3,BRD-K07540687-001-06-0,26133,J22,3,SA1852934,BRD-K07540687,BROAD_CPD_ID,COc1cccc(CNc2ccc(cc2Cl)[N+]([O-])=O)c1O,RTLZOBRZHORAJW-UHFFFAOYSA-N,cdp2w9x2_j22_s3_w2f7c14319-db48-4a80-81dc-8e9b41043467,cdp2w9x2_j22_s3_w3e5fed628-81ab-4696-9051-cd0dfc6eba1c,cdp2w9x2_j22_s3_w17446efa2-7f51-408d-9c01-1a6d3060059c,cdp2w9x2_j22_s3_w52f77398b-eecd-4494-830c-9cba5d88e1e5,cdp2w9x2_j22_s3_w40f9380b8-08a8-4c94-9ffc-5b873eb6c570,86,5537
1470,21060.0,25569-B05-4,BRD-K19009762-001-05-2,25569,B05,4,SA1855941,BRD-K19009762,BROAD_CPD_ID,CC(=O)c1cccc(NC(=O)Cc2cccs2)c1,RTOCXMYDWNDHFW-UHFFFAOYSA-N,cdp2w11_b05_s4_w28e4f7a26-b91f-4ed6-9ccb-56a6f2e9fe79,cdp2w11_b05_s4_w35d484f6f-9d4e-4faf-9e24-3456e2d5c520,cdp2w11_b05_s4_w1ed01130b-9e2a-496f-8d9b-2d0dabd213a6,cdp2w11_b05_s4_w5de151a2b-5d67-4d31-9ba5-d2d31e9e4980,cdp2w11_b05_s4_w4be8e9fea-ff69-483e-a99c-eb0bcfd401bf,80,8524
1471,26783.0,25592-N22-3,BRD-K33972619-001-05-8,25592,N22,3,SA1852262,BRD-K33972619,BROAD_CPD_ID,CCCCCN1CC(=O)C(c2nc3ccccc3[nH]2)=C1N,RTOVTWXWLCETFP-UHFFFAOYSA-N,cdp2w11_n22_s3_w234df423d-3c18-4a41-9453-8478e61265d8,cdp2w11_n22_s3_w3a714a007-3191-40ee-9cef-215758cf85c2,cdp2w11_n22_s3_w18a67bfbc-e6d2-4f08-9646-3769c49f4f92,cdp2w11_n22_s3_w58d15c5fd-c7ee-4728-8a0a-104696830493,cdp2w11_n22_s3_w4b88ff98d-b646-4337-964a-4dd96d32e478,62,8901
1472,28535.0,25638-D12-3,BRD-K65137277-001-05-2,25638,D12,3,SA1860461,BRD-K65137277,BROAD_CPD_ID,OC(=O)c1cc(O)ccc1NC(=O)c1cccc(Br)c1,RTWXTCVRZFFJIJ-UHFFFAOYSA-N,cdp2w12_d12_s3_w23d187419-dd4d-49bb-97b8-2d9bedd01d20,cdp2w12_d12_s3_w3b5beed34-6975-40c4-82af-d6b29b7833a6,cdp2w12_d12_s3_w13bd1151b-4406-46a5-86c1-e7f129d10dd7,cdp2w12_d12_s3_w586be84ec-413b-4a5d-b954-5f398862f17b,cdp2w12_d12_s3_w4c3490b19-3863-4ef1-8b73-cf90716e2c63,65,6521
1473,14611.0,25422-P22-5,BRD-K64483217-001-05-4,25422,P22,5,SA1861610,BRD-K64483217,BROAD_CPD_ID,C(Sc1nnc(-c2ccncc2)n1Cc1ccco1)\C=C\c1ccccc1,RVJUHENLPLOUPV-VMPITWQZSA-N,cdp2w10_p22_s5_w28087a82b-0c15-41e8-b257-6be4e01bae5f,cdp2w10_p22_s5_w3ee2ab7a8-fd6a-46aa-bcf1-036f7aefe1e0,cdp2w10_p22_s5_w16fd2c44f-fd40-4955-a6bc-11543680f7d0,cdp2w10_p22_s5_w58295d64e-14ff-4748-8c44-9e516662dd0d,cdp2w10_p22_s5_w4ad6a7348-0bc2-472e-a895-e816f25441d0,19,2111
1474,39011.0,25849-A23-3,BRD-K92953840-001-01-6,25849,A23,3,SA791529,BRD-K92953840,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2cccc(c2)C#N)OCc2ccccc2-c2ccccc2C1=O,RWOMJVAVZPFCIF-QLVXXPONSA-N,cdp2w6x2_a23_s3_w2dc1c42a3-eb9f-4721-a984-797123290bfc,cdp2w6x2_a23_s3_w3a297fb4a-dd3d-486d-962b-6b28db1842f3,cdp2w6x2_a23_s3_w1401f26a0-c783-4cf6-83cf-b3a983629c8e,cdp2w6x2_a23_s3_w5d7f6adde-ad32-4c9a-8da0-5b7862bbeba8,cdp2w6x2_a23_s3_w4ab65d715-c465-43be-9731-44cf753454c0,63,10105
1475,54808.0,26247-I12-2,BRD-K89704198-001-04-0,26247,I12,2,SA59261,vincamine,INN,CC[C@@]12CCCN3CCc4c([C@H]13)n(c1ccccc41)[C@@](O)(C2)C(=O)OC,RXPRRQLKFXBCSJ-HLAWJBBLSA-N,cdp2w9x2_i12_s2_w2549aaf19-b39d-4701-a40f-fe871817b8eb,cdp2w9x2_i12_s2_w33e1b0bb8-b6d2-434a-88ae-2700f01f1dff,cdp2w9x2_i12_s2_w16ac36314-17ef-47c6-a8f1-330ebccfc4da,cdp2w9x2_i12_s2_w5c47be2a4-2be0-485f-a19d-fe15cec3d096,cdp2w9x2_i12_s2_w45034ea48-6402-4be4-b9da-9632846acb7b,65,9639
1476,292.0,24277-M20-5,BRD-K36007650-300-02-3,24277,M20,5,SA83205,puromycin,INN,COc1ccc(C[C@H](N)C(=O)N[C@@H]2[C@@H](CO)O[C@H]([C@@H]2O)n2cnc3c(ncnc23)N(C)C)cc1,RXWNCPJZOCPEPQ-NVWDDTSBSA-N,cdp2bioactives_m20_s5_w2e5b2e6ac-9c3e-4047-880d-830146c47cd1,cdp2bioactives_m20_s5_w3574f24e0-2936-41af-9a14-24ce77b346f3,cdp2bioactives_m20_s5_w11846bf0e-3606-47ed-9ecc-1a9a51d084ad,cdp2bioactives_m20_s5_w531c6cfa7-f33d-4583-a8f3-0d35dc6c209f,cdp2bioactives_m20_s5_w48c8ac1ab-2d74-4c26-a48e-6f30bc540caf,4,1162
1477,49489.0,26128-C15-5,BRD-A27407220-001-05-6,26128,C15,5,SA1856145,BRD-A27407220,BROAD_CPD_ID,Cc1cccc2cc(C(N3CCCC3)c3nnnn3Cc3ccc4OCOc4c3)c(O)nc12,RYCAEYBFASCZEV-UHFFFAOYSA-N,cdp2w9x2_c15_s5_w2b6ca7d81-bf03-42d7-96c4-36bfe5d1ec3a,cdp2w9x2_c15_s5_w3583951eb-04bf-444a-9070-c4dd0fb6d156,cdp2w9x2_c15_s5_w198f132c4-826f-40af-92cd-7e0f06ca5dd9,cdp2w9x2_c15_s5_w548d19ccf-3f85-4a17-8890-86c732d72f3c,cdp2w9x2_c15_s5_w48c53d0a4-6540-4a14-8604-e5396bc758bc,74,6513
1478,28504.0,25638-B16-2,BRD-K39985369-001-06-4,25638,B16,2,SA1858420,BRD-K39985369,BROAD_CPD_ID,CN(C1CCCCC1)C(S)=NC1=CCS(=O)(=O)C1,RYJYEOJHMSTHSG-UHFFFAOYSA-N,cdp2w12_b16_s2_w25562b0f7-7a88-46c0-9359-865fce9071c5,cdp2w12_b16_s2_w3f92d5f59-5574-4c39-864a-ec9dddbda423,cdp2w12_b16_s2_w1b2c28359-02d9-4399-a368-c5a24efeee07,cdp2w12_b16_s2_w565f551c7-f71a-445a-a721-aa2c234d5e49,cdp2w12_b16_s2_w45df26577-4445-4d7f-90de-eb5095e229a8,99,3162
1479,47867.0,26110-H10-3,BRD-A30369394-001-06-1,26110,H10,3,SA1861582,BRD-A30369394,BROAD_CPD_ID,CC1c2c(OC(N)=C1C#N)[nH]nc2-c1ccc(C)cc1,RYWSKZCSEHLKHR-UHFFFAOYSA-N,cdp2w9x2_h10_s3_w222f5a429-d4e9-4b98-bc99-2956a553ffd3,cdp2w9x2_h10_s3_w3cc986a5d-d8ef-4060-80c4-93e488f98017,cdp2w9x2_h10_s3_w1939443f3-ba3e-4c4f-af9b-8442753e72fa,cdp2w9x2_h10_s3_w508435027-cec7-4f34-b61f-beb335b9ed2e,cdp2w9x2_h10_s3_w42fe0b7f8-a9bf-438b-8805-e3215ec4e920,58,4614
1480,18814.0,25503-B12-2,BRD-K15718920-001-06-9,25503,B12,2,SA1856526,BRD-K15718920,BROAD_CPD_ID,Fc1ccccc1OCC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccco1,RZFRZVXOTNQLIL-UHFFFAOYSA-N,cdp2w11-au00029680_b12_s2_w204412797-474f-4e2c-8981-dc8f898625bb,cdp2w11-au00029680_b12_s2_w368e2226b-30ec-4c24-a8bf-420b7e28be65,cdp2w11-au00029680_b12_s2_w1a70a885b-dcb4-42da-a2d7-b15d6543d0ec,cdp2w11-au00029680_b12_s2_w503eb8327-ec9a-4612-997a-36fce63e3836,cdp2w11-au00029680_b12_s2_w437d7fbd4-06dc-411e-9447-e7af5fd78391,74,6994
1481,3180.0,24305-J19-1,BRD-K11163873-001-02-8,24305,J19,1,SA82312,phenanthridone,primary-common,O=c1[nH]c2ccccc2c2ccccc12,RZFVLEJOHSLEFR-UHFFFAOYSA-N,cdp2bioactives_j19_s1_w203117da1-a689-4449-89a7-0e968c5388a6,cdp2bioactives_j19_s1_w3191c629a-1886-4a34-b96c-41e257caf5fb,cdp2bioactives_j19_s1_w156fa2dcd-1189-475f-a3b3-32b15c350a30,cdp2bioactives_j19_s1_w5ef8ca59f-8017-48b5-8271-9dbb1815df44,cdp2bioactives_j19_s1_w480225b44-3583-4624-a5bb-05bb3a0b4ab2,73,512
1482,48768.0,26124-B06-4,BRD-A58851360-001-05-7,26124,B06,4,SA1860174,BRD-A58851360,BROAD_CPD_ID,COC(=O)c1c(NC(=O)C2Cc3ccccc3C(=O)O2)sc2CCCCc12,RZHQKEHUOJBXON-UHFFFAOYSA-N,cdp2w9x2_b06_s4_w2e6a212da-22dc-4ce5-92d4-483ce4b493a6,cdp2w9x2_b06_s4_w3f71792c5-be4a-4bdb-9102-e6e672cc6d55,cdp2w9x2_b06_s4_w115b7acd2-cf40-4b25-91f8-72cc09565785,cdp2w9x2_b06_s4_w55e82f484-723c-4190-a0e8-ac4b2e12c9f5,cdp2w9x2_b06_s4_w44e4797d5-254e-4480-965a-6da34ed8efd9,63,9648
1483,4434.0,24309-C03-1,BRD-K21733600-001-02-6,24309,C03,1,SA59033,rofecoxib,INN,CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1,RZJQGNCSTQAWON-UHFFFAOYSA-N,cdp2bioactives_c03_s1_w2ed91426a-7116-4357-abcc-535f4a9efcc3,cdp2bioactives_c03_s1_w32efc3462-48b8-4b29-a145-9e3b0353b75d,cdp2bioactives_c03_s1_w1219696b8-bb70-4203-baf9-c61af19a5ff1,cdp2bioactives_c03_s1_w547214440-8538-413a-b6cf-8ba300032379,cdp2bioactives_c03_s1_w40c74834b-50ce-46a0-96a7-5b5485da78f1,160,268
1484,31618.0,25675-B12-2,BRD-K02247990-001-05-1,25675,B12,2,SA1853776,BRD-K02247990,BROAD_CPD_ID,COc1cc(ccc1OCC(=O)Nc1cccc(c1)C(F)(F)F)\C=C(/C#N)C(=O)Nc1cc(ccc1Cl)C(F)(F)F,RZNOUJVZRGPNED-CXUHLZMHSA-N,cdp2w12_b12_s2_w27d711a03-bacb-4e52-b9ff-e20ca8ecf165,cdp2w12_b12_s2_w3832001a0-6911-4e2b-a7d7-8cba86d1327f,cdp2w12_b12_s2_w198e50de7-8a35-4e09-bec8-507b56e10dcb,cdp2w12_b12_s2_w547720c40-3135-4c33-8308-63531cb54bc2,cdp2w12_b12_s2_w4174b21fb-ea24-4373-ab5c-aaab28902ab1,73,6961
1485,47377.0,26092-O22-5,BRD-K20236423-001-05-9,26092,O22,5,SA1858976,BRD-K20236423,BROAD_CPD_ID,C1CCc2nnc(-c3ccncc3)n2CC1,RZQQPARKDTYYBY-UHFFFAOYSA-N,cdp2w9-au00026609_o22_s5_w27ae389ab-725c-4cea-b8cb-add6ac9e47cc,cdp2w9-au00026609_o22_s5_w3fe800d98-4147-4f62-8c51-ff0a20b780f4,cdp2w9-au00026609_o22_s5_w1790d11bf-1936-4fe2-82bb-dba231da1bc3,cdp2w9-au00026609_o22_s5_w528e76c64-5dd9-4269-9886-c195f1cf51f9,cdp2w9-au00026609_o22_s5_w47a899a47-71f1-405e-8386-e47850ed975b,46,9709
1486,40855.0,25955-P04-5,BRD-K17368287-001-03-5,25955,P04,5,SA83653,adrenosterone,primary-common,C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=O,RZRPTBIGEANTGU-IRIMSJTPSA-N,cdp2w8x2_p04_s5_w228269689-0750-4765-bd30-3c6e354aca2a,cdp2w8x2_p04_s5_w3ac607df9-0a60-40d0-8f19-0dd8ef07d8ac,cdp2w8x2_p04_s5_w1d648076a-c3d7-49f7-b37f-fabd859041d8,cdp2w8x2_p04_s5_w5f6ec09ee-4aa5-4aef-a025-e838623bd756,cdp2w8x2_p04_s5_w4d92a7d82-cf78-4b3c-91b7-5850bac41036,37,1218
1487,3275.0,24305-O08-6,BRD-K15957397-001-02-6,24305,O08,6,SA59381,anthraquinone,primary-common,O=C1c2ccccc2C(=O)c2ccccc12,RZVHIXYEVGDQDX-UHFFFAOYSA-N,cdp2bioactives_o08_s6_w236309f05-5a84-4e02-956e-baf5ebdf807f,cdp2bioactives_o08_s6_w34136aa88-0f84-4f1d-8ccf-1fd5c23067a6,cdp2bioactives_o08_s6_w1c006ef3b-f7be-4631-bf90-59c6a22942d3,cdp2bioactives_o08_s6_w57455d45f-26cc-4e67-bde0-1949fbd295e0,cdp2bioactives_o08_s6_w4aef1309c-ec7c-44a9-bab2-e6018d62728d,146,557
1488,3554.0,24306-L19-3,BRD-K13169950-001-04-5,24306,L19,3,SA792908,5-nitroso-8-cinnolinol,primary-common,Oc1ccc([N+][O-])c2cccnc12,RZWRYPGAUIOOMK-UHFFFAOYSA-N,cdp2bioactives_l19_s3_w2c43a3900-5cb1-4a67-9a06-77eaa27a2fd9,cdp2bioactives_l19_s3_w342619110-07f6-4dad-aec4-109f4285fa39,cdp2bioactives_l19_s3_w1d43e04b8-5044-4e74-b22e-353c462c1dca,cdp2bioactives_l19_s3_w5299d20dc-9948-47c8-be5f-84fb73df345e,cdp2bioactives_l19_s3_w42c2c390e-64e6-4138-ab4e-8dd3c3b0f62a,27,6098
1489,19057.0,25503-N14-5,BRD-K13627294-001-07-0,25503,N14,5,SA1852774,BRD-K13627294,BROAD_CPD_ID,Cc1cc(Cl)ccc1OCCCC(=O)N1CCOCC1,SACVJJTXPBVABM-UHFFFAOYSA-N,cdp2w11-au00029680_n14_s5_w2dcdd8569-f9c8-44b8-b2ce-cb01ce47b84f,cdp2w11-au00029680_n14_s5_w3da1a3391-ff83-4849-b6f9-061c5f1e9139,cdp2w11-au00029680_n14_s5_w1bc15d6a1-08e4-49b1-b4e3-861678fb646f,cdp2w11-au00029680_n14_s5_w582c7c29a-20c1-4426-8372-14c12f4d7ea8,cdp2w11-au00029680_n14_s5_w471994039-0f47-42ab-a961-647f2caaadd7,78,6819
1490,14289.0,25420-O20-1,BRD-A64180536-001-06-0,25420,O20,1,SA1852748,BRD-A64180536,BROAD_CPD_ID,Fc1cccc(Cl)c1Cn1c(=O)c(F)cn(C2CCCO2)c1=O,SALKRGIQFMMYBW-UHFFFAOYSA-N,cdp2w10_o20_s1_w270348bb4-18cd-42ed-bd6b-239a916a5e15,cdp2w10_o20_s1_w376190d2f-4197-44cd-bc12-60058475980a,cdp2w10_o20_s1_w1498729db-56b5-48b5-af4b-f37fe4a6f711,cdp2w10_o20_s1_w53f90ddec-ed25-4509-a7c8-e85c922283d0,cdp2w10_o20_s1_w460fd65a5-e981-4741-b954-c22b5e677b19,47,4514
1491,35714.0,25692-O19-6,BRD-K35238169-001-05-6,25692,O19,6,SA1855818,BRD-K35238169,BROAD_CPD_ID,CC(=O)c1ccc(OCCCC(=O)OCc2nnc(o2)-c2ccc(Cl)cc2)cc1,SBWWJGMNCQQHKA-UHFFFAOYSA-N,cdp2w12_o19_s6_w23eb0985e-946c-469e-8398-b8b1c57379ba,cdp2w12_o19_s6_w323345a6a-eca6-43b1-aa60-ad0ecbbb8c7b,cdp2w12_o19_s6_w1d9931217-5f1d-4ae0-8be4-d207db73fff1,cdp2w12_o19_s6_w54d1d94ae-5d51-4d84-9433-c785e29defa5,cdp2w12_o19_s6_w41c39751a-04af-4cc6-8ef7-ca5b5346e5f3,89,4263
1492,48368.0,26115-P18-6,BRD-K19411733-001-05-6,26115,P18,6,SA1852323,BRD-K19411733,BROAD_CPD_ID,Cc1ccccc1N=C(S)N(Cc1ccco1)Cc1cccnc1,SCKDJBQVQXLHRG-UHFFFAOYSA-N,cdp2w9x2_p18_s6_w27040c60d-e237-4c0c-b4db-b9374075a5b9,cdp2w9x2_p18_s6_w30fec67fe-159c-4728-a32d-042a40cd6b60,cdp2w9x2_p18_s6_w178ae2a6b-40cf-4ae8-92fe-5ca6c8ad6934,cdp2w9x2_p18_s6_w537c12f1b-b910-4d71-b0da-61d2bd0e7ae5,cdp2w9x2_p18_s6_w4c36860f1-7f1f-45f8-bb88-3416d5c80657,74,5113
1493,17114.0,25438-B07-6,BRD-K91655106-001-05-8,25438,B07,6,SA1862075,BRD-K91655106,BROAD_CPD_ID,Cc1cc(C)n(CCNCc2cn(nc2-c2ccc(F)cc2)-c2ccc(C)cc2)n1,SCKXXJKTIMSHFN-UHFFFAOYSA-N,cdp2w10_b07_s6_w23c755044-6a63-4e02-b070-272920656410,cdp2w10_b07_s6_w3cc00cdac-dee7-41d8-bbbe-a639cbbcb5d4,cdp2w10_b07_s6_w184b6bacf-9d8d-4890-aedc-b7980647a483,cdp2w10_b07_s6_w52e706ea2-592c-49d5-93ac-b1305640168d,cdp2w10_b07_s6_w4c251b696-8563-4107-a4f0-2f0ba39010b0,50,4795
1494,12926.0,25410-D11-6,BRD-A48883036-001-05-7,25410,D11,6,SA1856503,BRD-A48883036,BROAD_CPD_ID,CCN(C(=O)CN1C(C)Cc2ccccc12)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O,SCTGLDJHFROAGX-UHFFFAOYSA-N,cdp2w10_d11_s6_w2f1a243c0-4e7d-4f88-b87e-84cf4834d160,cdp2w10_d11_s6_w3c844c2ba-b7e0-4f42-b7b2-7195996c0d12,cdp2w10_d11_s6_w11a088e1c-a683-496f-a0d7-1a884eb27dc3,cdp2w10_d11_s6_w5ce2fb366-1f3c-475d-8306-813672a08835,cdp2w10_d11_s6_w4c2db43e6-2105-4445-a906-5d7457e458c3,56,2614
1495,53165.0,26205-E07-3,BRD-K24414287-001-05-3,26205,E07,3,SA1852055,BRD-K24414287,BROAD_CPD_ID,COc1ccccc1CNC(=O)c1ccc2[nH]c3nc4ccccc4c3nc2c1,SDNBEVPGQRBNEI-UHFFFAOYSA-N,cdp2w9x2-au00026617_e07_s3_w2edd5ca5f-f518-48f8-ab4e-2fda353c6f98,cdp2w9x2-au00026617_e07_s3_w3d2a43c65-8293-4ea8-9f43-05eeffc17f0e,cdp2w9x2-au00026617_e07_s3_w1a851443b-e54e-4f19-8c9f-81f8deeba9af,cdp2w9x2-au00026617_e07_s3_w5bdc19084-bd6b-4d42-80b3-6dc8f3f69670,cdp2w9x2-au00026617_e07_s3_w4b54ffa7b-6810-452f-8d84-d8dc9f6659f4,59,2963
1496,22201.0,25572-L07-5,BRD-K90692821-001-05-6,25572,L07,5,SA1853278,BRD-K90692821,BROAD_CPD_ID,CSc1ccc2nc(O)cc(C)c2c1,SDTDDKCWIYAIOT-UHFFFAOYSA-N,cdp2w11_l07_s5_w269b38e2a-b3d6-4dc9-a1fb-f0999b51a5ea,cdp2w11_l07_s5_w32ee83299-a1a0-40ee-a9c7-3851e09b80f1,cdp2w11_l07_s5_w1c6a67336-674d-4fe3-8757-570d5372d75a,cdp2w11_l07_s5_w5d8d63668-3d8b-4226-995c-55effd191a1f,cdp2w11_l07_s5_w4eaa49048-a1f5-41db-b33a-6f498af0e4b0,81,5763
1497,50134.0,26135-G08-2,BRD-K76588081-001-05-9,26135,G08,2,SA1852309,BRD-K76588081,BROAD_CPD_ID,Oc1nc2ccccc2cc1C=C1C(=O)NC(=S)NC1=O,SEEZKTOCLICXGJ-UHFFFAOYSA-N,cdp2w9x2_g08_s2_w2f6fa07d7-82e8-4c21-b357-401cb57dd48f,cdp2w9x2_g08_s2_w3df59d72f-e77a-443f-8783-82639a854741,cdp2w9x2_g08_s2_w1888ddd64-0950-4f30-9502-c0e6e00ca1e2,cdp2w9x2_g08_s2_w51ded205a-9325-473f-9502-6c181f2c1d7a,cdp2w9x2_g08_s2_w489d10704-a146-489a-862a-42b7b70d7223,54,1866
1498,48450.0,26118-C13-4,BRD-K72326510-001-08-3,26118,C13,4,SA1852260,BRD-K72326510,BROAD_CPD_ID,COC(=O)c1ccccc1NC(=O)Nc1ccc2OCOc2c1,SEOQVRQVJFXJGL-UHFFFAOYSA-N,cdp2w9x2_c13_s4_w2e2530014-cc86-42e9-ac95-66e9e8484118,cdp2w9x2_c13_s4_w3abb57dc8-75fe-4199-bb61-e4fa55b83c06,cdp2w9x2_c13_s4_w1d33f45a2-c035-40b2-9b0f-fdc191bb0890,cdp2w9x2_c13_s4_w5e5466b84-3a99-458e-86ea-6a2d9103496b,cdp2w9x2_c13_s4_w4d405e354-6c6f-46b5-9eae-a4d5a718c778,66,7559
1499,55762.0,26672-J20-2,BRD-K78845122-001-01-1,26672,J20,2,SA1484898,BRD-K78845122,BROAD_CPD_ID,CN(C)C(=O)[C@@H]1[C@@H](CO)[C@@H]2Cn3c(ccc(\C=C\c4ccccc4)c3=O)[C@H]1N2C(C)=O,SFMBZXLPYFCTAU-RMDVGAJOSA-N,cdp2w13_j20_s2_w20f55a6c3-8e6e-43e7-bd13-7c11b0e28410,cdp2w13_j20_s2_w3f31e0f63-e9e3-4a31-ac43-b10aa5768655,cdp2w13_j20_s2_w11746f91d-4095-4340-8604-c194a1f67bf6,cdp2w13_j20_s2_w53e38dbc4-5546-4f09-a7f6-5f53d59b1397,cdp2w13_j20_s2_w4ed31e5d5-0630-4927-afde-a9df80ce5377,113,10395
1500,9761.0,25372-J03-3,BRD-K96837765-001-05-9,25372,J03,3,SA1855858,BRD-K96837765,BROAD_CPD_ID,COc1ccc(cc1)-c1cc(C(=O)NCCN2CCOCC2)c2ccccc2n1,SGBBRKAISVWHMV-UHFFFAOYSA-N,cdp2w10_j03_s3_w273a40f02-82d2-4cc0-ab7a-b983ec5508a0,cdp2w10_j03_s3_w3e01b3c5e-1a2b-4f5a-8ac3-9f89c6bf19dc,cdp2w10_j03_s3_w19a91a2da-417e-4a3d-90c0-79ee266155dd,cdp2w10_j03_s3_w5eecd7358-990a-40c9-b322-8442e67e1ceb,cdp2w10_j03_s3_w410f56ba0-c06a-4180-85b1-d9daed968795,40,8666
1501,41002.0,25962-G08-2,BRD-K07325606-001-02-3,25962,G08,2,SA63266,hispidin,common,Oc1cc(\C=C\c2ccc(O)c(O)c2)oc(=O)c1,SGJNQVTUYXCBKH-HNQUOIGGSA-N,cdp2w8x2_g08_s2_w2d21fbc27-b8d7-4833-9129-843afd9606b0,cdp2w8x2_g08_s2_w35a8a4769-2b10-4406-b340-28d0a67e45ec,cdp2w8x2_g08_s2_w1627de4a3-21e9-41be-80a4-cbeff953f005,cdp2w8x2_g08_s2_w5942e8c3e-2f16-482b-821c-330b869c083f,cdp2w8x2_g08_s2_w4dc1b32c5-2f3e-481d-be4b-e64c00a5feb2,70,1388
1502,1529.0,24295-C08-6,BRD-A07440155-003-04-9,24295,C08,6,SA59461,labetalol,INN,CC(CCc1ccccc1)NCC(O)c1ccc(O)c(c1)C(N)=O,SGUAFYQXFOLMHL-UHFFFAOYSA-N,cdp2bioactives_c08_s6_w24c835ff7-97a6-4856-8b23-09ed302b09e2,cdp2bioactives_c08_s6_w34c11a65c-c9ea-431d-b857-01af19a35e77,cdp2bioactives_c08_s6_w189658c13-bafa-47ef-893f-69cadb43b6e9,cdp2bioactives_c08_s6_w5b7c99223-8918-48d1-ad08-ac1d26ad622d,cdp2bioactives_c08_s6_w4c95b6179-b60e-44c9-873e-b47feafb8cb5,84,50
1503,28698.0,25638-L18-4,BRD-K15591233-001-06-2,25638,L18,4,SA1862231,BRD-K15591233,BROAD_CPD_ID,Clc1nc2ccccc2nc1NS(=O)(=O)c1ccc2ccccc2c1,SGXPMUXCSGOXQW-UHFFFAOYSA-N,cdp2w12_l18_s4_w29be75c2a-f50f-4636-8633-5a6ac2ad4333,cdp2w12_l18_s4_w3623a14eb-3c64-48e0-bc5c-3648065b1013,cdp2w12_l18_s4_w1ae1c2dba-a59e-4133-8abd-dbe089de1b34,cdp2w12_l18_s4_w52cab3c39-3f1c-48a1-8539-e28cd47fdff8,cdp2w12_l18_s4_w465439d18-172d-44f6-99c4-436370c807b1,82,4210
1504,30062.0,25663-C03-6,BRD-K99886365-001-05-7,25663,C03,6,SA1854093,BRD-K99886365,BROAD_CPD_ID,CCOc1cc(ccc1O)-c1c2CCc3ccccc3-c2nc(N)c1C#N,SHFWXLJFNDXSPU-UHFFFAOYSA-N,cdp2w12_c03_s6_w221c61856-b359-44f8-97f0-ba6db1c9a2cf,cdp2w12_c03_s6_w376e923af-5889-4750-95fb-1c2069bbb34d,cdp2w12_c03_s6_w1c24dc3ac-2b6d-4a21-8417-d61fb1c52b35,cdp2w12_c03_s6_w530301321-9819-4c4b-a92a-52295345e3c8,cdp2w12_c03_s6_w45891c2e1-605f-4df2-936f-63e7b7faed98,56,3971
1505,3.0,24277-A06-4,BRD-K18619710-001-03-7,24277,A06,4,SA83657,digoxigenin,primary-common,C[C@@]12[C@H](CC[C@]1(O)[C@@H]1CC[C@@H]3C[C@@H](O)CC[C@]3(C)[C@H]1C[C@H]2O)C1=CC(=O)OC1,SHIBSTMRCDJXLN-KCZCNTNESA-N,cdp2bioactives_a06_s4_w2c656db09-645d-4965-8304-d25dbd2bbbb0,cdp2bioactives_a06_s4_w3e5e21ebe-3229-4792-aa7b-38d62f65cc64,cdp2bioactives_a06_s4_w1f727546f-e823-4bdb-994c-0edc5177aa42,cdp2bioactives_a06_s4_w501a556e5-f22f-4858-9e55-b007717173c0,cdp2bioactives_a06_s4_w4809f0532-43f4-4767-9c1f-506df418ef0c,2,769
1506,50950.0,26140-K03-2,BRD-K55220938-001-04-2,26140,K03,2,SA1855252,BRD-K55220938,BROAD_CPD_ID,Cc1ccc(cc1)-n1ncc2c1nc(SCC(=O)N1CCCc3ccccc13)[nH]c2=O,SHNSGYDVGABRJA-UHFFFAOYSA-N,cdp2w9x2_k03_s2_w2ce26efb8-bac0-4dd9-a451-75f21023a5ac,cdp2w9x2_k03_s2_w3196ee4af-6632-46fa-b2b0-bcfc75f9ee0c,cdp2w9x2_k03_s2_w19ee95186-652e-46f1-80a3-e7ae520ee4f6,cdp2w9x2_k03_s2_w501829fe1-ee59-4c19-ab72-9b1fc8ac65b8,cdp2w9x2_k03_s2_w405c58ed7-ee33-409c-a5f6-7c30e0738b79,27,3466
1507,34661.0,25688-F21-3,BRD-K98724916-001-05-5,25688,F21,3,SA1861879,BRD-K98724916,BROAD_CPD_ID,CC(=C)C(=O)Nc1ccc2OCCOCCOCCOc2c1,SHOAYIYXGKLRBB-UHFFFAOYSA-N,cdp2w12_f21_s3_w2c87e5c7c-f325-4850-9691-daeedddc8bb7,cdp2w12_f21_s3_w36b88a206-6895-43d7-9faa-d45ff06f1a83,cdp2w12_f21_s3_w1ef166964-dcfa-4a85-a882-c2e1ea8768e6,cdp2w12_f21_s3_w5ea7479f4-3da9-49b9-9b2a-b864092ff68c,cdp2w12_f21_s3_w44d989c81-773e-4c8c-a08f-9b7cd3d0d864,85,8447
1508,19635.0,25564-K05-1,BRD-K65742362-001-04-8,25564,K05,1,SA1859471,BRD-K65742362,BROAD_CPD_ID,CN(C)S(=O)(=O)c1cccc(c1)-n1sc2ccccc2c1=O,SHVMSYDTOYCGDZ-UHFFFAOYSA-N,cdp2w11_k05_s1_w20487f078-433f-4c3f-86cd-a43c1780593f,cdp2w11_k05_s1_w30c054e4e-5dbc-4d1b-bebf-600ce6b1f92c,cdp2w11_k05_s1_w1db360b99-80bd-49f8-bcfb-c096b1b6975d,cdp2w11_k05_s1_w5543b4ee0-b716-40db-8f24-00a5864dfa38,cdp2w11_k05_s1_w4ae22965f-ddd6-4325-8ab5-657cbe03516a,13,2478
1510,52661.0,26203-J15-3,BRD-K61503276-001-06-8,26203,J15,3,SA1852769,BRD-K61503276,BROAD_CPD_ID,CC(C)Cc1nnc(NC(=O)Cc2cccs2)s1,SIILNOLGPIOEMP-UHFFFAOYSA-N,cdp2w9x2-au00026617_j15_s3_w26a520b6d-b8a0-40f0-bd91-cd6a6cab8e23,cdp2w9x2-au00026617_j15_s3_w344765df7-bcbc-49f6-82d4-8216b904cbc1,cdp2w9x2-au00026617_j15_s3_w162f4474a-1fb9-4513-a0cb-ac8d214427f8,cdp2w9x2-au00026617_j15_s3_w52caec77a-a4e8-4a0f-b972-b3759938752a,cdp2w9x2-au00026617_j15_s3_w4abd54148-d1c8-4b32-9f59-7770efe8e876,58,9128
1511,23792.0,25579-M19-6,BRD-K88715136-001-06-7,25579,M19,6,SA1861284,BRD-K88715136,BROAD_CPD_ID,COc1ccc(\C=C\C(=O)Nc2ccc3nc4CCCCn4c(=O)c3c2)cc1,SJSUIEJFRUPQPF-KPKJPENVSA-N,cdp2w11_m19_s6_w294e1699e-14fc-4681-9ffa-3a386e56978c,cdp2w11_m19_s6_w3f4484067-c20d-47a4-827a-560625a74c83,cdp2w11_m19_s6_w141bfd2bb-8aab-4c41-b3d5-e74d003f24d6,cdp2w11_m19_s6_w553ea95e6-0408-4fbe-9144-9f10377b952d,cdp2w11_m19_s6_w4b1d53e1f-e621-4d25-ac84-327f332157f0,63,8489
1512,50432.0,26138-C15-6,BRD-K28433349-001-04-8,26138,C15,6,SA1857565,BRD-K28433349,BROAD_CPD_ID,O=C(CSc1nnc2ccccn12)c1ccccc1,SJTGXXJHHAEOCA-UHFFFAOYSA-N,cdp2w9x2_c15_s6_w23d3419a2-b2ae-452d-a9d0-194634503740,cdp2w9x2_c15_s6_w37db4ab27-d56e-4840-a4fd-89b3ed06dcdf,cdp2w9x2_c15_s6_w180efa0d6-90af-4c4f-9639-cca86eaa99de,cdp2w9x2_c15_s6_w5e0110bfc-b190-4f38-8dc1-2b389587113d,cdp2w9x2_c15_s6_w4b084e3b5-d8ba-44eb-8c53-cbc2fb9874e2,92,2245
1513,51921.0,26174-N08-1,BRD-K98579162-001-05-4,26174,N08,1,SA1859614,BRD-K98579162,BROAD_CPD_ID,CCN1CCN(CC1)C(=O)COc1ccc2OC3(CCN(CC3)C(C)=O)CC(=O)c2c1,SJYQXSKDUDDADR-UHFFFAOYSA-N,cdp2w9x2-au00026617_n08_s1_w234bb2231-ce71-47a2-9ab0-854f3f70b15a,cdp2w9x2-au00026617_n08_s1_w3c2016212-c9d6-46a3-b998-691c0a6898cf,cdp2w9x2-au00026617_n08_s1_w12f651be4-6eea-481e-9704-04b0f02fc982,cdp2w9x2-au00026617_n08_s1_w595fa677c-dc5a-4a0b-8f1b-ff709fd1ceb7,cdp2w9x2-au00026617_n08_s1_w415168653-379b-4dfc-af53-776e60dbec52,81,6501
1514,43990.0,25987-D24-2,BRD-K46384212-001-01-1,25987,D24,2,SA792664,o-3M3FBS,to-be-curated,Cc1cc(C)c(c(C)c1)S(=O)(=O)Nc1ccccc1C(F)(F)F,SKJJIFRWCCSXGL-UHFFFAOYSA-N,cdp2w8x2_d24_s2_w28b69285d-ec83-4c83-b9f9-bc087cbf21b2,cdp2w8x2_d24_s2_w325d53612-b23d-41b1-adc5-0640e212f58e,cdp2w8x2_d24_s2_w134f7c7d4-d14f-4564-b0f5-3e0a38f88f72,cdp2w8x2_d24_s2_w58e654fe2-d6c5-4743-8792-087cb69361b0,cdp2w8x2_d24_s2_w4a6853035-ce8b-410b-996b-22648484e780,67,5159
1515,33610.0,25681-H09-2,BRD-K21281823-001-05-0,25681,H09,2,SA1852324,BRD-K21281823,BROAD_CPD_ID,OC(=O)c1cccc(c1)-n1cccc1\C=C1\NC(=O)N(C1=O)c1cccc(Cl)c1,SKNKQCUDNWAXHL-LDADJPATSA-N,cdp2w12_h09_s2_w2de406cd6-ba04-441e-916e-82105067be50,cdp2w12_h09_s2_w356045b30-f826-4084-b902-ed3d56703380,cdp2w12_h09_s2_w1b1e4821b-85cb-426e-b143-63e989efb6d4,cdp2w12_h09_s2_w5c7d804ff-e971-4320-b8f4-6d1f3ce78dee,cdp2w12_h09_s2_w4de56c0ba-a268-400e-8eb4-f867ecc76558,44,1108
1516,24487.0,25581-O20-5,BRD-K29125586-001-05-8,25581,O20,5,SA1862148,BRD-K29125586,BROAD_CPD_ID,CCOC(=O)C1(CCN(Cc2ccc(Cl)cc2)CC1)S(=O)(=O)c1ccc(Cl)cc1,SLDHMWQQBRXOPJ-UHFFFAOYSA-N,cdp2w11_o20_s5_w2ecdbf57d-395b-4b9f-966b-81bca98790e8,cdp2w11_o20_s5_w3f5ebd59d-5b3e-41f1-9b63-28cd749bd5eb,cdp2w11_o20_s5_w11b0f95bb-daa4-42c1-8248-c3d2a033d608,cdp2w11_o20_s5_w5187783d6-6ab9-4e03-bfe2-c4d3cc31fdd3,cdp2w11_o20_s5_w4903af5a2-5990-4e6c-9a8f-3569cf50d74a,46,6760
1517,50686.0,26138-P11-2,BRD-K75380271-001-12-8,26138,P11,2,SA1861854,BRD-K75380271,BROAD_CPD_ID,CC(C)Nc1ccc(NC(=O)C(C)=C)cc1,SLHDOPUIZPVUFW-UHFFFAOYSA-N,cdp2w9x2_p11_s2_w28e51e5f5-ab62-41d2-9058-721e8d8444ea,cdp2w9x2_p11_s2_w3c7273e39-b209-4483-822a-7fd98d78c7bd,cdp2w9x2_p11_s2_w1c27ffc9a-e711-4c5a-8dff-ee72b03c48ee,cdp2w9x2_p11_s2_w5627c5e03-3e7f-486e-a962-8061396a992b,cdp2w9x2_p11_s2_w4fdf7b7a7-a598-4849-8ef6-fa1fca68aa42,68,8525
1518,17421.0,25485-A05-1,BRD-K83720391-001-05-4,25485,A05,1,SA1853481,BRD-K83720391,BROAD_CPD_ID,Cc1ccc(NC(S)=NCCSc2ccc(Cl)cc2)cc1,SLIIHRMQGFXOGC-UHFFFAOYSA-N,cdp2w10-au00024355_a05_s1_w22b156c8d-4da8-4048-bbd6-5e07dfe23d70,cdp2w10-au00024355_a05_s1_w36e575325-2cec-48c5-a0aa-f3a55cce7ecd,cdp2w10-au00024355_a05_s1_w1557e8d44-745b-4e59-934c-3e0049e23904,cdp2w10-au00024355_a05_s1_w573cb861f-46ec-4ac2-8b38-ea8df3daadb1,cdp2w10-au00024355_a05_s1_w4e91ddd1c-bcf1-446b-9975-a1c1c0f8f47a,20,5356
1519,32859.0,25679-D21-1,BRD-K33985118-001-05-6,25679,D21,1,SA1861213,BRD-K33985118,BROAD_CPD_ID,COc1ccc(cc1)-c1nc(NC(=O)c2ccc(OCC(=O)Nc3ccc(F)cc3)c(OC)c2)sc1C,SLKZSBNPGHDFSQ-UHFFFAOYSA-N,cdp2w12_d21_s1_w25c7d0f65-0923-4bf2-8fcf-caf81ed715d3,cdp2w12_d21_s1_w39f18e6d4-d8ac-4ffe-acc8-864a4f5eae1c,cdp2w12_d21_s1_w12f798d03-ac8e-4d33-aa32-babae76df3d4,cdp2w12_d21_s1_w59827a5f4-91a4-4639-b6c5-4728f8cc6e67,cdp2w12_d21_s1_w4316bc719-5501-4f49-8cae-ff967354b8aa,18,3425
1520,21714.0,25571-C18-4,BRD-K03065379-001-08-1,25571,C18,4,SA1860047,BRD-K03065379,BROAD_CPD_ID,N(c1c(nc2ccccn12)-c1ccco1)c1ccccc1,SLWCTSPVYONLNO-UHFFFAOYSA-N,cdp2w11_c18_s4_w2170a8076-64b9-42da-a4f8-b41e65300460,cdp2w11_c18_s4_w360f96cf1-a1de-4b05-856f-8680f0faae17,cdp2w11_c18_s4_w1c5271719-1139-47e0-bade-0fde051069a2,cdp2w11_c18_s4_w5216171a7-0b7c-4e9a-951f-ad38942f9633,cdp2w11_c18_s4_w4b1c08f10-4a38-452f-b02f-bb6be98fc80f,61,6195
1521,18655.0,25492-K13-5,BRD-K86299582-001-05-5,25492,K13,5,SA1861755,BRD-K86299582,BROAD_CPD_ID,CC(C)c1nnc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)s1,SLYGXKIQTSSLCA-UHFFFAOYSA-N,cdp2w10-au00024360_k13_s5_w23eb3f649-b671-457f-bcb8-1ecba8ff4d54,cdp2w10-au00024360_k13_s5_w37a99d0d0-5585-45a3-8f67-785fde1a582c,cdp2w10-au00024360_k13_s5_w14e3d676b-77f4-4a91-b195-61dd73ec6103,cdp2w10-au00024360_k13_s5_w572399aa5-0445-4d7c-9911-08a34aeae346,cdp2w10-au00024360_k13_s5_w46c1b8252-b8c1-43c0-b2f2-73c4fb609147,59,8310
1522,1839.0,24296-H17-4,BRD-K29582677-001-02-7,24296,H17,4,SA82072,flunarizine,INN,Fc1ccc(cc1)C(N1CCN(C\C=C\c2ccccc2)CC1)c1ccc(F)cc1,SMANXXCATUTDDT-QPJJXVBHSA-N,cdp2bioactives_h17_s4_w274b90dd7-bbe8-46f3-aa7a-924689a8880d,cdp2bioactives_h17_s4_w3ca42365b-4f59-4264-a953-3a61fc3e598e,cdp2bioactives_h17_s4_w12da5a188-b009-4783-a8c6-00de596b4b62,cdp2bioactives_h17_s4_w526d83035-243a-428f-88f5-ffb7b9c58d73,cdp2bioactives_h17_s4_w47d069878-ce7e-4c0c-98df-3afee58c68cd,105,383
1523,13235.0,25414-D04-3,BRD-K14398941-001-05-8,25414,D04,3,SA1854171,BRD-K14398941,BROAD_CPD_ID,Cc1ccc(NC(S)=Nc2ccccn2)cc1C,SMDWBSIOSQLAMA-UHFFFAOYSA-N,cdp2w10_d04_s3_w2169ef8d7-cd0b-4c49-93f6-5698e529c619,cdp2w10_d04_s3_w3507ae148-685a-4ac8-a6a9-ac271d4387f7,cdp2w10_d04_s3_w1c0c4e3ef-6a5b-42d7-96a8-4730e1d9227c,cdp2w10_d04_s3_w51608f2a7-30f4-4635-bc31-d4158f0f765a,cdp2w10_d04_s3_w40c26ae0b-18e3-4659-bf1e-994c3d47a011,33,4331
1524,49334.0,26126-K09-6,BRD-K31656904-001-05-3,26126,K09,6,SA1861549,BRD-K31656904,BROAD_CPD_ID,CN(C(=O)c1ccc(NC(=O)c2ccco2)cc1)c1ccccc1,SMGFONHDSCMGHG-UHFFFAOYSA-N,cdp2w9x2_k09_s6_w24cf9d7e1-c2b7-47c5-b5ad-015d06ab37d0,cdp2w9x2_k09_s6_w3a104b8ef-fdda-4b67-9f9e-59fb603db19d,cdp2w9x2_k09_s6_w1299c97db-4bb7-43be-87dd-e7f56e6f320e,cdp2w9x2_k09_s6_w5068a3156-ac8a-4533-a1f2-c4f10ca4b7aa,cdp2w9x2_k09_s6_w4a88cbc31-ebfa-4dcb-8979-bfb66c033220,59,4040
1525,28126.0,25599-O20-2,BRD-K78074905-001-05-2,25599,O20,2,SA1854186,BRD-K78074905,BROAD_CPD_ID,COc1ccccc1CNC(=O)c1ccc2c(OCC=C)n(C)nc2c1,SMLYCPBSJLOVPD-UHFFFAOYSA-N,cdp2w11_o20_s2_w214aadbbb-c109-41e9-835f-acce364c5902,cdp2w11_o20_s2_w3463b00e0-5094-42fe-844c-690dff19e66a,cdp2w11_o20_s2_w170aafb43-c111-4b7e-bcce-1681f6bbb28a,cdp2w11_o20_s2_w514aff937-252e-43d7-bb2b-c247ffeb6cd7,cdp2w11_o20_s2_w44be08e89-7250-4b10-bd99-e183c302eb68,77,8751
1526,38399.0,25726-G09-3,BRD-K47785560-001-05-7,25726,G09,3,SA1858357,BRD-K47785560,BROAD_CPD_ID,Cc1n[nH]c(SCC(=O)N2CCCCCC2)c1[N+]([O-])=O,SMOCXLQUTOULJW-UHFFFAOYSA-N,cdp2w12_g09_s3_w25a2209fe-aa2d-47a0-944e-ba30410585ee,cdp2w12_g09_s3_w357bd23ed-7567-43cf-b467-4615c16427ea,cdp2w12_g09_s3_w1619a2a23-ff53-4882-8530-601f57773a0b,cdp2w12_g09_s3_w54921b526-c5fb-4a73-bc6a-a6b55a195b67,cdp2w12_g09_s3_w4dfa3fa4f-8388-4aa4-a4e9-6f4da92d1c55,72,8978
1527,47990.0,26110-M14-6,BRD-K76617730-001-05-1,26110,M14,6,SA1852158,BRD-K76617730,BROAD_CPD_ID,CSc1ccc(cc1)\C=C(/C#N)C(=O)NC1CCCCC1,SMPUOPSPJOHYOK-SDNWHVSQSA-N,cdp2w9x2_m14_s6_w2efa26b86-b6fa-4896-978f-6894c3790f70,cdp2w9x2_m14_s6_w37d8f4f7e-d589-459a-a0a2-5fe634aac9df,cdp2w9x2_m14_s6_w16fb8ffc8-1c08-4578-8983-41b0e4ce529d,cdp2w9x2_m14_s6_w5f6e5c65e-b93a-4299-a3c1-3e4e268bfac9,cdp2w9x2_m14_s6_w44d7c639c-492a-403c-84e7-0c381bb2294f,70,4956
1528,30752.0,25665-D11-6,BRD-K74281619-001-05-4,25665,D11,6,SA1859693,BRD-K74281619,BROAD_CPD_ID,Cc1ccccc1-c1nc(C#N)c(NCc2ccco2)o1,SMTUPGSVCXEPHW-UHFFFAOYSA-N,cdp2w12_d11_s6_w2d8d1fa7b-6274-4713-936e-e1dd54a6ea20,cdp2w12_d11_s6_w3c6611017-1c4e-4dcb-8588-816285f1ae3e,cdp2w12_d11_s6_w1a3dd7964-414c-441e-a8e6-620b0179784b,cdp2w12_d11_s6_w5bba1d3e1-bf6b-4e92-a410-83244b49ada9,cdp2w12_d11_s6_w4c4145ab2-de73-44cf-b227-35c6ef234772,55,2758
1529,38494.0,25726-L16-2,BRD-K24896421-001-05-8,25726,L16,2,SA1859392,BRD-K24896421,BROAD_CPD_ID,CC(=O)NC(=C(Cl)Cl)S(=O)(=O)c1ccccc1,SMVUYUWPKIKFKE-UHFFFAOYSA-N,cdp2w12_l16_s2_w254546015-88da-4de4-924d-ffb6295b992e,cdp2w12_l16_s2_w32d0625e5-b4b2-4e58-a2d6-ac874e0bbc01,cdp2w12_l16_s2_w137ae4cd5-7a29-42ec-bc0a-d075b1e4f91b,cdp2w12_l16_s2_w5bc8c2510-38b4-491d-93e9-db2c51368973,cdp2w12_l16_s2_w4d22da3ff-1738-4c07-955b-92dfcc0d2189,38,7475
1530,49202.0,26126-D22-6,BRD-K36913136-001-04-6,26126,D22,6,SA1852214,BRD-K36913136,BROAD_CPD_ID,O=C1CN(CC(=O)N1CCc1ccccc1)c1nc2ccccc2n2cnnc12,SMWBUXZLLHGKHV-UHFFFAOYSA-N,cdp2w9x2_d22_s6_w2520eca06-6c6d-42e1-9e0b-731f431becfa,cdp2w9x2_d22_s6_w3d2dcf47a-7dec-48ed-b0c9-b478e9e24d05,cdp2w9x2_d22_s6_w17bb0c6f5-6f78-40d0-b8fc-c2154f3ad9d1,cdp2w9x2_d22_s6_w5d674886c-fc75-426f-bbc7-0899e91d0a66,cdp2w9x2_d22_s6_w4e1e2bd4b-f703-45e4-9983-6d36157a37c3,90,2437
1531,18970.0,25503-J21-2,BRD-K65731773-001-05-1,25503,J21,2,SA1852381,BRD-K65731773,BROAD_CPD_ID,Cc1ccc(Nc2nc(nc3ccccc23)-c2ccncc2)cc1,SMWKEUKJWUQZTR-UHFFFAOYSA-N,cdp2w11-au00029680_j21_s2_w2cd6d5395-9701-4fb7-8e24-f5a937d85af1,cdp2w11-au00029680_j21_s2_w3a40a5a98-ae67-4201-b0fb-f62001a2e3e3,cdp2w11-au00029680_j21_s2_w128540a89-bcc3-48cf-a98e-ada0a593c7cb,cdp2w11-au00029680_j21_s2_w58940eb70-894a-45bc-94d4-14ed913fa2c5,cdp2w11-au00029680_j21_s2_w453483925-9757-48b4-bf15-1432ad443dd5,70,4905
1532,17487.0,25485-C21-1,BRD-K70318282-001-04-7,25485,C21,1,SA1853999,BRD-K70318282,BROAD_CPD_ID,Cc1cc(C(=O)Nc2ccc(Cl)cc2)n(Cc2ccc(C)cc2)n1,SMYCVOZVZYQMFD-UHFFFAOYSA-N,cdp2w10-au00024355_c21_s1_w2805ac562-607d-49af-a041-0647b0d09703,cdp2w10-au00024355_c21_s1_w37315e2d3-9c08-43b8-8c4c-246d6f783b90,cdp2w10-au00024355_c21_s1_w19f09721c-5d5c-46d1-83c4-3fcbd4dc93f3,cdp2w10-au00024355_c21_s1_w5df7cacf9-fa9c-4c01-a405-b5d08deb64a5,cdp2w10-au00024355_c21_s1_w4741e46a1-f02d-407d-8650-937173f05d7f,47,4585
1533,537.0,24278-K21-4,BRD-K92860374-001-02-5,24278,K21,4,SA58714,"2,4,5-trichlorophenoxyacetic acid",primary-common,OC(=O)COc1cc(Cl)c(Cl)cc1Cl,SMYMJHWAQXWPDB-UHFFFAOYSA-N,cdp2bioactives_k21_s4_w2f79345ef-295f-4c81-88db-28e76a24ea24,cdp2bioactives_k21_s4_w3e11f4603-1b35-4a0a-9a0d-5c02718a2b7d,cdp2bioactives_k21_s4_w159de2a30-1dd2-415e-9143-c6b172a85fe9,cdp2bioactives_k21_s4_w596b05fb4-3000-466a-9c72-e1d9a841d54b,cdp2bioactives_k21_s4_w4dc24d6ad-d0ee-49f1-96dd-bcec11a86c7f,120,967
1534,36866.0,25704-M22-6,BRD-K23474839-001-06-9,25704,M22,6,SA1860607,BRD-K23474839,BROAD_CPD_ID,COc1cc(Cn2c(nc3ccccc23)-c2nonc2N)ccc1C,SNAHHWCKTZHBIF-UHFFFAOYSA-N,cdp2w12_m22_s6_w2fc41b30b-1da0-42c6-b50e-92c6a0634a53,cdp2w12_m22_s6_w3ce9b560d-314e-41b9-b63f-bb3ed547de3a,cdp2w12_m22_s6_w1ab4d7f6b-0f5c-4717-85bf-73fc20e6219f,cdp2w12_m22_s6_w5470fbaa5-40b1-492d-9dd2-84e1e034ee57,cdp2w12_m22_s6_w41881c1e6-9149-4e14-a2ee-6beff1f92112,25,5470
1535,52775.0,26203-P03-3,BRD-A58987482-001-04-5,26203,P03,3,SA1852988,BRD-A58987482,BROAD_CPD_ID,NC1=C(C(=O)C2CCc3ccccc3N12)c1ccc(Br)cc1,SOAYNLAFYDGCPV-UHFFFAOYSA-N,cdp2w9x2-au00026617_p03_s3_w2aaf616e6-6c49-4a5a-b6df-559fc29c0abd,cdp2w9x2-au00026617_p03_s3_w3b811abdd-b157-4f3f-9299-423da3e4f54a,cdp2w9x2-au00026617_p03_s3_w16a3d3b30-1746-4415-9821-d3b5de72a955,cdp2w9x2-au00026617_p03_s3_w5ed5928cc-d6c5-4dc1-8373-5a3f20b34ec8,cdp2w9x2-au00026617_p03_s3_w4737d665f-256f-4fc2-9b76-d24311b3c29a,65,7790
1536,13743.0,25416-P04-1,BRD-K95635973-001-06-4,25416,P04,1,SA1852739,BRD-K95635973,BROAD_CPD_ID,O=C(Nc1cccnc1)c1noc2CCCCCc12,SODSBCFRVVPIKS-UHFFFAOYSA-N,cdp2w10_p04_s1_w2509f4ed5-6bde-4647-ac72-4c2d7b52b86b,cdp2w10_p04_s1_w3d4c0a426-82ea-4430-a13c-80b9599cec4a,cdp2w10_p04_s1_w115ba8c93-f863-4031-93c2-e65a9cf646c5,cdp2w10_p04_s1_w555a5b636-d3ef-4b94-bb1f-385426340d5b,cdp2w10_p04_s1_w4041999a1-60ea-454a-9a5f-3481d3251801,45,5848
1537,38112.0,25725-H22-4,BRD-K60022045-001-06-0,25725,H22,4,SA1858710,BRD-K60022045,BROAD_CPD_ID,CCS(=O)(=O)N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(=O)NC1C2CC3CC(C2)CC1C3,SODWQJIRWLTZRX-UHFFFAOYSA-N,cdp2w12_h22_s4_w2860add13-25e7-4e0b-a39d-eba3edcb143a,cdp2w12_h22_s4_w379ef8433-d9e4-408c-8c51-2b1f47bb8f97,cdp2w12_h22_s4_w117c761db-ba50-4299-928e-6c14ab1a60d7,cdp2w12_h22_s4_w5a2d19e81-5f5b-4c01-b9ac-5b639ed7f7e1,cdp2w12_h22_s4_w463371941-b1e5-4f80-b084-7a5f9904f3d4,44,5354
1538,56351.0,26753-H05-3,BRD-K25379780-001-01-8,26753,H05,3,SA1017350,BRD-K25379780,BROAD_CPD_ID,CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1ccncc1)C(=O)NCc1ccccc1F,SOFJTHGIOAEHFZ-VELXTTODSA-N,cdp2w13_h05_s3_w2a815c478-34cd-4ee0-8a12-34300ba8095a,cdp2w13_h05_s3_w3425ecdff-e0c0-4c99-a7f2-7e2ce0186694,cdp2w13_h05_s3_w1316c846b-9965-4e63-89b4-ad05e041fa0d,cdp2w13_h05_s3_w5bf5db83a-86f4-44ae-bd9f-e436fec4aa36,cdp2w13_h05_s3_w421275e88-407b-4381-a627-a815adeeb50a,63,10538
1539,50398.0,26138-B18-2,BRD-K94629607-001-05-4,26138,B18,2,SA1854165,BRD-K94629607,BROAD_CPD_ID,CCOC(=O)C1=C(O\C(S1)=C(\C(=O)OC)C(F)(F)F)c1ccccc1,SOIAWOQSOUAHMP-XNTDXEJSSA-N,cdp2w9x2_b18_s2_w27d60f10b-6182-47e2-a4cc-bc52e003fb7e,cdp2w9x2_b18_s2_w3129ffd3f-a8b1-42ed-99f2-64eaf44cde97,cdp2w9x2_b18_s2_w14a9f03ce-d2e4-4e2e-866c-74821963c3ca,cdp2w9x2_b18_s2_w5d7376043-bf2d-4502-a538-37490e931529,cdp2w9x2_b18_s2_w4805abc5e-51d8-43de-a5d8-f6bdf4a0e950,83,3730
1540,50934.0,26140-J05-4,BRD-A55408860-001-06-2,26140,J05,4,SA1857019,BRD-A55408860,BROAD_CPD_ID,Clc1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1S(=O)(=O)N1CCOCC1,SOXGIBOLZDEWNB-UHFFFAOYSA-N,cdp2w9x2_j05_s4_w29c97b708-5a20-43cd-98af-f8d56a0abc69,cdp2w9x2_j05_s4_w34116da43-0560-45cf-a854-28808ade023b,cdp2w9x2_j05_s4_w1e2afa74c-2d39-4e85-bd7d-8fed0023d20b,cdp2w9x2_j05_s4_w59ed6fd9b-fd82-41a7-828c-97f068f8dcd6,cdp2w9x2_j05_s4_w492623bdb-98e1-4b5f-b62d-a796d7ee3337,61,8503
1541,5369.0,24312-F13-6,BRD-K47639036-003-03-3,24312,F13,6,SA83428,flavoxate,INN,Cc1c(oc2c(cccc2c1=O)C(=O)OCCN1CCCCC1)-c1ccccc1,SPIUTQOUKAMGCX-UHFFFAOYSA-N,cdp2bioactives_f13_s6_w20336274f-401a-4af4-9d6d-3dc45dabcacb,cdp2bioactives_f13_s6_w398609a6e-fbfd-4571-a8e1-7cfc971513c6,cdp2bioactives_f13_s6_w167d4cbc8-d13b-4275-b3bc-1008c28b998a,cdp2bioactives_f13_s6_w578047549-aee3-455d-93b3-07f10cf71596,cdp2bioactives_f13_s6_w4e392f45c-e064-46d8-bcb3-b9e5340be8c6,77,1085
1542,9950.0,25374-E17-6,BRD-K57624505-001-05-3,25374,E17,6,SA1857290,BRD-K57624505,BROAD_CPD_ID,CCOC(=O)c1ccc(NC(S)=NNC(=O)COC)cc1,SPIWIONSMQIGRJ-UHFFFAOYSA-N,cdp2w10_e17_s6_w2351df066-5589-47e3-8fcd-9c45c18d04cb,cdp2w10_e17_s6_w342353f40-3d60-40c0-b6fe-da9bf46da1da,cdp2w10_e17_s6_w15bb0ddf3-449e-4b1e-b5f3-da53a9acdf41,cdp2w10_e17_s6_w51bf17fb9-397e-4da2-9a6a-78a08421bb32,cdp2w10_e17_s6_w417697712-f0c2-48e7-810d-724be2263449,61,6405
1543,38375.0,25726-F10-3,BRD-K63861371-001-05-4,25726,F10,3,SA1853007,BRD-K63861371,BROAD_CPD_ID,Clc1ccc2oc(nc2c1)-c1cccnc1NCc1ccccc1,SPSQGDIGJAIYSM-UHFFFAOYSA-N,cdp2w12_f10_s3_w2ed2474e1-2bf4-406b-bd57-45f473e8a01d,cdp2w12_f10_s3_w30c523533-568a-4b81-a893-63692f9f95cc,cdp2w12_f10_s3_w131b15fe6-0cdc-459e-b5f1-7bbb341da4e5,cdp2w12_f10_s3_w54271e1e8-30b8-42c6-83d1-4ed99a475a44,cdp2w12_f10_s3_w4da429ba5-d00f-4496-bbdd-3b4f15931d35,66,8783
1544,25863.0,25588-H14-1,BRD-A11225902-001-05-5,25588,H14,1,SA1861717,BRD-A11225902,BROAD_CPD_ID,O=C(Nc1nnc(s1)C1CC1)C1CN(C(=O)C1)c1ccc2OCCOc2c1,SQDCKOMKGRKKFQ-UHFFFAOYSA-N,cdp2w11_h14_s1_w2485d1020-2b93-4f58-9e5f-2e2ac95b6403,cdp2w11_h14_s1_w364e2450e-f5fd-401d-b152-82c01bc009a7,cdp2w11_h14_s1_w1e9932167-cdc3-4713-a70f-afd542bb8ef3,cdp2w11_h14_s1_w5078d78fb-2d2f-40eb-ae00-5e227bf562b7,cdp2w11_h14_s1_w4e7b41b35-96cf-4ddc-bd60-ecc229bdb130,88,8260
1545,54950.0,26247-P09-6,BRD-K97602563-001-02-7,26247,P09,6,SA81904,methanandamide,primary-common,CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)N[C@H](C)CO,SQKRUBZPTNJQEM-FQPARAGTSA-N,cdp2w9x2_p09_s6_w249d2747e-7f92-45df-8cc9-c2ccd0e7ea3b,cdp2w9x2_p09_s6_w3e47875ab-dda1-4a6d-8183-7fe02b183553,cdp2w9x2_p09_s6_w179cc0bdc-88c1-46fd-81c4-c6943affa0ed,cdp2w9x2_p09_s6_w50c5ab677-917f-45a2-aab0-00017be7841b,cdp2w9x2_p09_s6_w4f062e042-1fb2-4c1f-acd9-830e973e757d,50,799
1546,40345.0,25945-M21-5,BRD-A85234536-001-04-5,25945,M21,5,SA792602,N6-Cyclopentyladenosine,to-be-curated,OCC1OC(C(O)C1O)n1cnc2c(NC3CCCC3)ncnc12,SQMWSBKSHWARHU-UHFFFAOYSA-N,cdp2w8x2_m21_s5_w24c6326dd-0ca1-4904-86bd-827baee7b176,cdp2w8x2_m21_s5_w328deca31-177c-4d9a-bd8d-2bbc99e855db,cdp2w8x2_m21_s5_w1c7dad060-8003-4ec1-8219-9ae7915ce2f0,cdp2w8x2_m21_s5_w5007d3093-fc23-421b-85c6-274e2cc44d1f,cdp2w8x2_m21_s5_w45452524a-6dee-4fd8-a6c6-484e3caa6072,20,144
1547,14273.0,25420-O08-3,BRD-K61046611-001-06-2,25420,O08,3,SA1859570,BRD-K61046611,BROAD_CPD_ID,Cc1onc(c1C(=O)Nc1ccc(C)c(F)c1)-c1c(F)cccc1Cl,SQTJRHRZARGCIW-UHFFFAOYSA-N,cdp2w10_o08_s3_w2c2ef87e1-dbba-4b28-8048-5e295de5a162,cdp2w10_o08_s3_w39dc905f1-10fb-480a-8ddd-69b4d3e5cc9b,cdp2w10_o08_s3_w161ec3799-fc06-4332-85aa-f55e8ed5695c,cdp2w10_o08_s3_w5f8bfced1-eec0-41c3-863d-5fadc8a7ce56,cdp2w10_o08_s3_w40d4dbca9-a8eb-4749-b363-bb4984db4c58,20,4145
1548,47857.0,26110-G21-5,BRD-K10105458-001-06-4,26110,G21,5,SA1858131,BRD-K10105458,BROAD_CPD_ID,CCn1c(C)c(C(C)=O)c(nc1=S)N1CCN(CC1)c1ccc(F)cc1,SRAPOMLXLUOQRF-UHFFFAOYSA-N,cdp2w9x2_g21_s5_w2bccbfddb-aa98-477c-82ea-8727cde46c16,cdp2w9x2_g21_s5_w3639bea8c-c59e-4681-ae90-70b078f12c76,cdp2w9x2_g21_s5_w1323a5012-79f6-4f91-b76e-f36d242ddea4,cdp2w9x2_g21_s5_w5598a21ba-298a-463a-a390-8e18b3ad6d12,cdp2w9x2_g21_s5_w4dec5ac1e-8181-4178-ad60-edb7b9bca4d0,41,9658
1549,32580.0,25678-G03-4,BRD-K96724187-001-05-9,25678,G03,4,SA1855584,BRD-K96724187,BROAD_CPD_ID,C(CC1=CCCCC1)Nc1nnnn1-c1ccccc1,SREKFVYWFHWCJD-UHFFFAOYSA-N,cdp2w12_g03_s4_w21e3114a4-b633-4253-b483-76ec29028011,cdp2w12_g03_s4_w3ff961b96-9004-4a26-a3e7-05c102d0188e,cdp2w12_g03_s4_w1ef840da9-92a0-4fbb-938b-19e1a8d7ebfb,cdp2w12_g03_s4_w5d7ed38e8-c173-4edc-a4e5-525a930657d0,cdp2w12_g03_s4_w4a43620f2-b3a6-4172-a412-d78bbe0238d0,75,8577
1550,37962.0,25725-B19-4,BRD-K38456289-001-05-6,25725,B19,4,SA1856296,BRD-K38456289,BROAD_CPD_ID,Cc1nc(NC(=O)c2ccc(Cl)cc2)nc2cc3OCOc3cc12,SSMDPFIXUPMLQC-UHFFFAOYSA-N,cdp2w12_b19_s4_w24b22c702-af68-4dac-9fbb-d06e3bacd926,cdp2w12_b19_s4_w3fdf53ae2-86b0-4d6b-ac3e-207b753af5ff,cdp2w12_b19_s4_w1ed1bb2e3-6c49-4e6e-a05e-3cbbf728b601,cdp2w12_b19_s4_w5b4907b75-ea6a-449a-8f48-ba1f62ed389c,cdp2w12_b19_s4_w4e0c40b20-b8aa-42d3-9965-c3b1d089f428,49,2140
1551,19327.0,25553-K22-5,BRD-K35208305-001-05-4,25553,K22,5,SA1861021,BRD-K35208305,BROAD_CPD_ID,COc1ccc(NC(=O)c2ccc(o2)-c2ccccc2Cl)cc1,SSWSMOFPKKPGBV-UHFFFAOYSA-N,cdp2w11-au00029679_k22_s5_w2d7095528-5250-478a-b64c-4928ee016533,cdp2w11-au00029679_k22_s5_w357707c43-9274-4135-9e89-571e468752ae,cdp2w11-au00029679_k22_s5_w13060ef70-5443-4704-97ba-513826202d11,cdp2w11-au00029679_k22_s5_w51c16f132-1a60-43be-b66b-d8428d5e2433,cdp2w11-au00029679_k22_s5_w46ca638a6-1be6-48f7-b4fd-5a1584f40a23,64,8179
1552,53020.0,26204-L10-2,BRD-K05510364-001-04-0,26204,L10,2,SA1857095,BRD-K05510364,BROAD_CPD_ID,Cc1c(OCc2nn[nH]n2)ccc2c(C)c(Cc3ccccc3)c(=O)oc12,STBUDKIRLAIWSI-UHFFFAOYSA-N,cdp2w9x2-au00026617_l10_s2_w21b020509-d6bd-4203-945f-fca7174f2a12,cdp2w9x2-au00026617_l10_s2_w348c7f1ec-a384-429c-b12a-1b0c174b57eb,cdp2w9x2-au00026617_l10_s2_w105beee7d-bf9e-4dce-be19-95b42ba18504,cdp2w9x2-au00026617_l10_s2_w5619df451-89c4-47a9-9365-a169b9b2bc69,cdp2w9x2-au00026617_l10_s2_w497af640b-f5a8-4d72-8c7b-33c5a7495a42,48,3853
1553,24032.0,25580-J20-6,BRD-A07245571-001-06-7,25580,J20,6,SA1852670,BRD-A07245571,BROAD_CPD_ID,CCC(C)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N(CCc1ccc(OC)c(OC)c1)Cc1cccs1,STGROPKKZNMECS-UHFFFAOYSA-N,cdp2w11_j20_s6_w2c81fa64a-0d93-4732-8788-7413a69238f4,cdp2w11_j20_s6_w3a0872938-5a66-4eda-9bab-d03de1049d0b,cdp2w11_j20_s6_w1224a5192-6fa5-46c5-96ce-e7c1179242c4,cdp2w11_j20_s6_w56ac4465f-3abb-47e8-9946-5f3a9849b4d7,cdp2w11_j20_s6_w4fb1ab834-d66d-4578-aa13-1e6685b46e1f,82,1813
1554,28677.0,25638-K17-1,BRD-K35491869-001-05-4,25638,K17,1,SA1854833,BRD-K35491869,BROAD_CPD_ID,CC(C)CNC(=S)NC(=O)c1ccc(Cl)cc1,STHGYDPUKPWQSD-UHFFFAOYSA-N,cdp2w12_k17_s1_w2d5d7e367-574c-4773-a10b-00fed8880c96,cdp2w12_k17_s1_w3315709cb-c011-440f-aa95-d9eab28d49a5,cdp2w12_k17_s1_w1c9fb1a60-7cf5-4808-bca7-b630a26bd5e0,cdp2w12_k17_s1_w521a0f660-6df8-4797-a485-88bf9f38d7bc,cdp2w12_k17_s1_w458335620-289a-441d-bdd5-5b117ee53818,73,6462
1555,15028.0,25426-G14-2,BRD-K41920118-001-05-3,25426,G14,2,SA1858927,BRD-K41920118,BROAD_CPD_ID,Cn1ccnc1SCC(=O)Nc1nc2ccccc2s1,STNJLOFRUPHKGE-UHFFFAOYSA-N,cdp2w10_g14_s2_w283cceac7-5eb3-4ffc-9c28-c77aa55fe8e4,cdp2w10_g14_s2_w323c5fbee-c6a8-4f91-a746-36433d5ada71,cdp2w10_g14_s2_w1c87642a5-2ec9-42d8-8b9a-cbb9a70f86de,cdp2w10_g14_s2_w581ebf36e-c447-4a25-84d2-68dd3c69d679,cdp2w10_g14_s2_w421a51365-a2d3-4f9a-a4aa-e8045f66a924,87,7436
1556,10022.0,25374-J18-6,BRD-K86758689-001-05-2,25374,J18,6,SA1862078,BRD-K86758689,BROAD_CPD_ID,CCc1cccc(NC(=O)NC2CCCCC2)c1,STXMSUGVXDMHKL-UHFFFAOYSA-N,cdp2w10_j18_s6_w29c97d6d8-99f8-421a-90a5-d5de74f29095,cdp2w10_j18_s6_w3859bf53e-3499-4936-9f99-1eb6d33ee97c,cdp2w10_j18_s6_w140ca7d43-7d96-4de4-8d50-28e8ce9a79d6,cdp2w10_j18_s6_w534c8ebcd-614b-499f-86c5-3d3eac036126,cdp2w10_j18_s6_w4694fcf06-bb0f-4b3e-ad40-2871758fa157,72,7294
1557,17892.0,25488-G04-4,BRD-A82460631-001-06-8,25488,G04,4,SA1858641,BRD-A82460631,BROAD_CPD_ID,COCC(C)n1c(C)cc(C(=O)COC(=O)c2ccc3SCC(=O)Nc3c2)c1C,SUFFQJSFEGGTBK-UHFFFAOYSA-N,cdp2w10-au00024357_g04_s4_w2c0a11950-9603-4214-994f-d07148ef95ba,cdp2w10-au00024357_g04_s4_w3d617bcb8-a400-434d-9037-2ddb4304b8bf,cdp2w10-au00024357_g04_s4_w1321f10b9-6145-4928-b999-7554f0d62f34,cdp2w10-au00024357_g04_s4_w583db8b4d-83ee-412b-ac2e-7e6184681647,cdp2w10-au00024357_g04_s4_w4aaf84da0-9f3c-4e9d-8218-45b752a9989d,46,2531
1558,4201.0,24308-H18-2,BRD-K29668683-300-01-4,24308,H18,2,SA792194,BD-1063,common,CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1,SUIZRDJCBVPASY-UHFFFAOYSA-N,cdp2bioactives_h18_s2_w2c3a39734-ed34-4b9f-94be-a57463776101,cdp2bioactives_h18_s2_w3b34ea354-007b-4ed2-ac7b-1bdf0c720857,cdp2bioactives_h18_s2_w1c80268e2-d685-448b-bf1d-7608b55b0573,cdp2bioactives_h18_s2_w56814d668-d5a7-492c-a80b-450ba5c0bd9c,cdp2bioactives_h18_s2_w4a07b3f07-5075-43cc-848e-cd39719818ed,153,659
1559,55383.0,26577-M12-1,BRD-K13691358-001-01-2,26577,M12,1,SA801775,BRD-K13691358,BROAD_CPD_ID,C[C@@H](NC(=O)C[C@H]1C[C@H]2[C@H](Oc3ccc(NS(=O)(=O)c4ccc(F)cc4)cc23)[C@H](CO)O1)c1ccccc1,SUQCIPRCFCPKOO-CPKADCMZSA-N,cdp2w7x2_m12_s1_w2c86b1c6c-df89-4002-b022-fa1e684cbd6a,cdp2w7x2_m12_s1_w360e6d5ee-0c8a-4d8a-9bfc-e58d9ee9f0ac,cdp2w7x2_m12_s1_w12a8bf407-227d-4169-a3da-7838e08d654f,cdp2w7x2_m12_s1_w5b5e98863-a1e6-44c8-bb3d-c37eadcef194,cdp2w7x2_m12_s1_w4cbf71bc5-6080-4aa8-ab1a-78e541f0d05d,62,10125
1560,28630.0,25638-J06-2,BRD-K98601267-001-05-0,25638,J06,2,SA1852610,BRD-K98601267,BROAD_CPD_ID,Nc1ccc(Nc2nc(cs2)-c2cc3ccccc3oc2=O)cc1,SUUGUKZPDTXTBW-UHFFFAOYSA-N,cdp2w12_j06_s2_w2a97d5fa1-87ca-4a0a-bfdc-254d9fefd50f,cdp2w12_j06_s2_w3e1c02e32-503b-4b03-93b6-86fa102fe478,cdp2w12_j06_s2_w1b9f671d1-7748-4556-9deb-23104865d9fb,cdp2w12_j06_s2_w59bff049e-8b0b-4d26-b13f-ea30d690799d,cdp2w12_j06_s2_w4f2b307d8-b11e-43f0-b0ad-f8978df11f84,57,8158
1561,37183.0,25707-K17-5,BRD-A61868010-001-04-3,25707,K17,5,SA1853573,BRD-A61868010,BROAD_CPD_ID,CC(C)(C)C1CCc2n[nH]c(C(O)=O)c2C1,SUXLFEALYPIVJT-UHFFFAOYSA-N,cdp2w12_k17_s5_w259072d99-2bc8-4996-8d51-86daaa93a9a7,cdp2w12_k17_s5_w33964e340-ccc4-46af-8453-8a1cc4447b69,cdp2w12_k17_s5_w1e1b80247-b2b1-471f-a93f-4c27e9b65e76,cdp2w12_k17_s5_w554795472-88f0-4b7a-81d3-899b32481892,cdp2w12_k17_s5_w4a0473ab7-b180-40d4-b0dc-daef1fe326c8,70,9597
1562,5327.0,24312-C17-6,BRD-K44309363-003-01-3,24312,C17,6,SA792350,dexniguldipine,primary-common,COC(=O)C1=C(C)NC(C)=C([C@@H]1c1cccc(c1)[N+]([O-])=O)C(=O)OCCCN1CCC(CC1)(c1ccccc1)c1ccccc1,SVJMLYUFVDMUHP-MGBGTMOVSA-N,cdp2bioactives_c17_s6_w2a53ea0d7-6328-4b6d-ae26-5a8db242a95d,cdp2bioactives_c17_s6_w300995914-af58-4d95-8d51-3613a76455e9,cdp2bioactives_c17_s6_w1f83afccf-a545-44d1-99f9-54b89a94253a,cdp2bioactives_c17_s6_w5529cf2ca-d5dc-4e23-9edb-f197087f1d1f,cdp2bioactives_c17_s6_w4c2725a28-5edc-4c9c-ae05-1072fcbbc9e4,15,10563
1563,37939.0,25725-A16-5,BRD-K96448807-001-05-5,25725,A16,5,SA1859722,BRD-K96448807,BROAD_CPD_ID,NC(=O)c1ccc(N\C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1,SWGSNYQISNHHMF-JYRVWZFOSA-N,cdp2w12_a16_s5_w2bcba2169-ce01-4237-9ab8-46409d49e053,cdp2w12_a16_s5_w3a4d63157-9fbe-428d-8329-98d3d3d7a041,cdp2w12_a16_s5_w1680c3c8e-a621-4c18-b4a0-e5a8a630aaeb,cdp2w12_a16_s5_w55e8ef5ac-7d7c-4afa-baed-6e7e2ea937bc,cdp2w12_a16_s5_w4e501735e-713f-475e-8c9a-d7cf788b6f77,53,8234
1564,19375.0,25553-M14-5,BRD-K23481990-001-05-1,25553,M14,5,SA1854034,BRD-K23481990,BROAD_CPD_ID,Cc1ccc(Nc2nnc(o2)-c2ccc3OCOc3c2)c(C)c1,SWIUQBFXLZSMJW-UHFFFAOYSA-N,cdp2w11-au00029679_m14_s5_w2b95e5550-724b-42cc-8e20-012ce6be2b52,cdp2w11-au00029679_m14_s5_w3d42c3ec7-b203-4af5-a28f-3ebff86239aa,cdp2w11-au00029679_m14_s5_w12cb3811f-77b7-4c6e-9ab0-fae9da75a1ad,cdp2w11-au00029679_m14_s5_w5985d01f6-0d70-42fd-bf45-9172e216a24c,cdp2w11-au00029679_m14_s5_w4cb981875-880b-4d8f-90f9-ec31a5c7d662,41,6538
1565,10714.0,25380-G19-2,BRD-K01031165-001-05-9,25380,G19,2,SA1861517,BRD-K01031165,BROAD_CPD_ID,Sc1nnc(Nc2cccc(Cl)c2)s1,SWLINHYKFUPWGE-UHFFFAOYSA-N,cdp2w10_g19_s2_w2b8fb1d8a-56c2-4e8e-b705-eefe1de76616,cdp2w10_g19_s2_w3ec63ec66-8ceb-4e88-82ad-ba962179c509,cdp2w10_g19_s2_w19c6edf32-75b3-407d-b4ef-ebfce3be5336,cdp2w10_g19_s2_w5b4af7202-4c26-4aa4-8bd4-c665820b8f25,cdp2w10_g19_s2_w4978d145e-90a0-40d8-8f77-b4e9167b33a9,56,1585
1566,28142.0,25599-O22-6,BRD-K30963311-001-05-1,25599,O22,6,SA1856005,BRD-K30963311,BROAD_CPD_ID,CN(CCC#N)C(=S)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1,SWUCYXHWVXHDMP-UHFFFAOYSA-N,cdp2w11_o22_s6_w23259b286-2a36-426e-b817-5bfbfedb0d76,cdp2w11_o22_s6_w3dd826fc2-4bd4-4132-b3bf-be751d7faae2,cdp2w11_o22_s6_w12bf86f0e-ab8f-4cdc-b64e-0d09f75c5851,cdp2w11_o22_s6_w5905b7d6d-99f1-4fed-86c3-7f6e28be7ffa,cdp2w11_o22_s6_w4e2f47eb2-456c-41dd-b2df-e7eb5390a10e,68,7666
1567,12740.0,25408-L22-6,BRD-K03810962-001-05-9,25408,L22,6,SA1854925,BRD-K03810962,BROAD_CPD_ID,COc1ccccc1-c1nc(C#N)c(o1)N1CCN(CC1)C(c1ccccc1)c1ccccc1,SWVMNYNUQYEVGK-UHFFFAOYSA-N,cdp2w10_l22_s6_w2903778c4-225e-4853-be3a-1e952612f590,cdp2w10_l22_s6_w3b1b7fbaf-4f6c-4d50-aae1-00283cd8d705,cdp2w10_l22_s6_w1ffb2f5ae-816d-4743-ac8f-64ce57982b88,cdp2w10_l22_s6_w5ca4f60f1-e3db-4e06-887c-5b2f6a5c9452,cdp2w10_l22_s6_w49e33905c-d5a7-4be9-bc43-b5faa82a490b,55,4024
1568,21849.0,25571-K03-1,BRD-K27496085-001-06-9,25571,K03,1,SA1860500,BRD-K27496085,BROAD_CPD_ID,CC(C)(C)c1cc(NCc2ccccn2)n2ncc(-c3ccc(Cl)cc3)c2n1,SWXVTPFMCSJUME-UHFFFAOYSA-N,cdp2w11_k03_s1_w21d92b404-166e-4b19-b08f-5b4081e1e3d0,cdp2w11_k03_s1_w35e7939c8-2c92-4b5d-8908-951dc531f767,cdp2w11_k03_s1_w16602c994-60b6-4af5-a344-e4e89c6cd3d5,cdp2w11_k03_s1_w5e2cada31-fd0a-4726-9d7c-60520c68ea4e,cdp2w11_k03_s1_w46129126a-56a7-4e7a-8035-0dfe773bbb4f,48,4897
1569,48542.0,26118-G09-6,BRD-K48276916-001-05-7,26118,G09,6,SA1858460,BRD-K48276916,BROAD_CPD_ID,CCc1c(C)scc1C(=O)NN=C(S)NCCc1ccccc1,SXBJYYWZXKGNLH-UHFFFAOYSA-N,cdp2w9x2_g09_s6_w2be6dc53c-9355-488f-bb04-f0a9ae1bec03,cdp2w9x2_g09_s6_w39bc93a75-b377-42bd-b284-f1b2ee1fe792,cdp2w9x2_g09_s6_w184206857-67d0-4b72-b008-4fb1d8d99885,cdp2w9x2_g09_s6_w5c0e60628-aa49-49a2-935e-a9894d0dd2d7,cdp2w9x2_g09_s6_w43107b23d-576f-45af-b5f7-eddbdd86991d,82,8301
1570,28559.0,25638-E09-3,BRD-K56336567-001-05-0,25638,E09,3,SA1858696,BRD-K56336567,BROAD_CPD_ID,CN(c1ccccc1)P(=O)(N(C)c1ccccc1)N(C)c1ccccc1,SXDAZEJYDNATRB-UHFFFAOYSA-N,cdp2w12_e09_s3_w28cc4e8d4-fce6-4377-98be-d88e148194df,cdp2w12_e09_s3_w3982d331a-e61f-4130-874a-b9e47a2ece49,cdp2w12_e09_s3_w14be6f37c-af86-49de-90ae-d416bb436102,cdp2w12_e09_s3_w5824352eb-3c17-4bb0-9f1d-40302e1ef278,cdp2w12_e09_s3_w419f75b83-8a33-44bf-867d-d01e183850dd,94,6716
1571,52526.0,26202-P18-6,BRD-K78374611-001-05-1,26202,P18,6,SA1853978,BRD-K78374611,BROAD_CPD_ID,CCc1ccc(cc1)-c1nnn(CCC(=O)OC)n1,SXESLUJHEBYPFX-UHFFFAOYSA-N,cdp2w9x2-au00026617_p18_s6_w2ab160d15-d595-4452-8268-52f2d2085565,cdp2w9x2-au00026617_p18_s6_w38c6a69e2-d730-4b19-be14-aa76d93c37af,cdp2w9x2-au00026617_p18_s6_w11b0e2457-9b39-4580-9aaf-64934ddf23ce,cdp2w9x2-au00026617_p18_s6_w5789b6910-1416-472b-8cbf-248962dd6b69,cdp2w9x2-au00026617_p18_s6_w4f5ef2b04-c049-4a60-bbe3-946849acd416,81,8413
1572,37337.0,25708-C10-3,BRD-K64336474-001-06-0,25708,C10,3,SA1854307,BRD-K64336474,BROAD_CPD_ID,CCOC(=O)c1nn(-c2ccccc2C)c(=O)c2c(N)scc12,SXGQRQVITZAZLR-UHFFFAOYSA-N,cdp2w12_c10_s3_w2a5ee7a89-5eeb-4da5-82f8-abfb6b8dd79b,cdp2w12_c10_s3_w3b931a6f5-8b32-42fb-a9bd-8823549d187e,cdp2w12_c10_s3_w160e61b2c-4f94-4604-bc32-008a1029964a,cdp2w12_c10_s3_w5cd730094-0b9b-4143-9269-9c818eae0a8c,cdp2w12_c10_s3_w415a4eb8f-c1b7-43b5-b254-4ac2f6aaa7c1,46,7181
1573,25391.0,25585-L13-3,BRD-K10809028-001-06-2,25585,L13,3,SA1856190,BRD-K10809028,BROAD_CPD_ID,CCC1=C\C(=C\N(C)c2ccccc2)C(=O)S1,SXHJFACKRQUEPO-KHPPLWFESA-N,cdp2w11_l13_s3_w2ea7674bb-17b2-4527-b313-dfcee83c1d4d,cdp2w11_l13_s3_w334ebebbf-5b50-4d59-b854-7428a0f627b0,cdp2w11_l13_s3_w14f05aea3-1ebb-49e0-802f-19702abab368,cdp2w11_l13_s3_w51f08fbf8-9c5a-4e6f-9cc5-90fc971583eb,cdp2w11_l13_s3_w4bdf33a63-e4b6-4b61-a8ef-3e587dc10ebe,62,1624
1574,19753.0,25565-A05-5,BRD-A20114232-001-06-9,25565,A05,5,SA1856263,BRD-A20114232,BROAD_CPD_ID,CC1CCCCN1CCNC(=O)CCn1nc(ccc1=O)-c1ccc(C)cc1,SXORXEDYBXYZMG-UHFFFAOYSA-N,cdp2w11_a05_s5_w21bb4a5e4-254a-4f4a-8509-29c471674b68,cdp2w11_a05_s5_w32d02f33c-31e2-47a0-9db3-ddae326bf236,cdp2w11_a05_s5_w170d454ff-ec8c-40ee-8f04-1c133b226df3,cdp2w11_a05_s5_w51b138d2d-410b-492d-9fa3-b852afc3deb0,cdp2w11_a05_s5_w414e94a6c-edb6-4f32-8293-37d44e1b1348,72,2353
1575,26157.0,25590-K05-1,BRD-K81174269-001-04-8,25590,K05,1,SA1857868,BRD-K81174269,BROAD_CPD_ID,CCOc1ccccc1-n1c(SCC(=O)Nc2ccc(CC)cc2)nc2nnc(C)c2c1N,SXPOYFMLXFUVSN-UHFFFAOYSA-N,cdp2w11_k05_s1_w2069d08b7-759e-440c-910e-f496f715b87b,cdp2w11_k05_s1_w3a5f8c1f8-b442-43b6-bffb-f1ed5f2952d3,cdp2w11_k05_s1_w16b961407-d72e-4104-b4ec-0add7c0b664a,cdp2w11_k05_s1_w5b7733228-c58d-4c9c-8563-e1e5de2ffbee,cdp2w11_k05_s1_w421480451-f59a-4b3b-acab-ecc284e6d8a5,1,7708
1576,21856.0,25571-K07-2,BRD-K27845439-001-05-2,25571,K07,2,SA1859317,BRD-K27845439,BROAD_CPD_ID,CN1CCC\C1=C/C=C1/N(C)C(=S)N(C)C1=O,SXRPCRZFBUCPSR-KZZDLZNXSA-N,cdp2w11_k07_s2_w2fc91b02b-0c72-4a7f-8945-c87216ca6dc8,cdp2w11_k07_s2_w30cdedc8f-3ce9-43aa-acc9-0c4176932889,cdp2w11_k07_s2_w1dbe3a84e-4588-4eea-b960-5646cc91e307,cdp2w11_k07_s2_w51b7db878-4a05-4da3-8026-0ea5464ad0f0,cdp2w11_k07_s2_w4795c3d95-7e6d-49fd-afe1-016b11cd9913,79,2600
1577,13690.0,25416-L22-2,BRD-K93743095-001-05-3,25416,L22,2,SA1854260,BRD-K93743095,BROAD_CPD_ID,Cc1ccc(C)n1CCN1CCN(CC1)C(=O)CSc1nc2ccccc2nc1N1CCOCC1,SYHDAUHOTVVALH-UHFFFAOYSA-N,cdp2w10_l22_s2_w25b12a989-6dc1-4acf-9aa8-019c97dcc3f2,cdp2w10_l22_s2_w368b989db-238a-4caa-9e56-7effdec7d9d7,cdp2w10_l22_s2_w1773a0fb3-930e-4a88-ae11-b2be83905fd4,cdp2w10_l22_s2_w55d5d4dcb-5a5c-43f1-b684-36f4005b7bf2,cdp2w10_l22_s2_w4371ef021-ea04-47c4-9893-f9820a09e2ee,54,4096
1578,30190.0,25663-H08-2,BRD-K36412733-001-05-3,25663,H08,2,SA1852301,BRD-K36412733,BROAD_CPD_ID,Cc1cc(C(=O)COc2ccc(cc2)-c2nnco2)c(C)n1Cc1ccccc1,SYXAIJGEZLTDRA-UHFFFAOYSA-N,cdp2w12_h08_s2_w223088785-e997-45cc-b068-60a40a57bbd8,cdp2w12_h08_s2_w3d1b60215-b037-487b-a5dd-e29f3b4d9c1e,cdp2w12_h08_s2_w114118eec-5fd0-4ed3-8e4e-91e765d1e03f,cdp2w12_h08_s2_w5d84f402d-b94c-4ee3-a10d-eac84b55f074,cdp2w12_h08_s2_w4d8e06ddf-e966-4cf6-a7e3-3dd1ad4c98ed,85,6685
1579,3345.0,24306-C02-4,BRD-K01902415-001-03-4,24306,C02,4,SA792427,pirinixic acid,INN,Cc1cccc(Nc2cc(Cl)nc(SCC(O)=O)n2)c1C,SZRPDCCEHVWOJX-UHFFFAOYSA-N,cdp2bioactives_c02_s4_w2b7a56f67-d1ac-444b-a89a-27f7090587ca,cdp2bioactives_c02_s4_w30166f43e-95b3-4e86-ac1f-c7204d0fd0dc,cdp2bioactives_c02_s4_w1c4995f2b-f3f2-47f3-a00e-8e5c6cdc4e0f,cdp2bioactives_c02_s4_w543491a2b-9b1b-4c56-8216-eda821b4eee2,cdp2bioactives_c02_s4_w470cbd0be-c485-4ce0-8742-859c191eeead,86,484
1580,3766.0,24307-F23-5,BRD-K06854232-001-03-3,24307,F23,5,SA792134,AM-580,common,CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)Nc1ccc(cc1)C(O)=O,SZWKGOZKRMMLAJ-UHFFFAOYSA-N,cdp2bioactives_f23_s5_w2c550e931-deac-442e-8c3a-2b28679f5f46,cdp2bioactives_f23_s5_w3aa8a2066-bee8-434f-82d4-d93a5f39a633,cdp2bioactives_f23_s5_w13db9690d-b745-4039-8d27-62c66edd0498,cdp2bioactives_f23_s5_w5bc0a6d85-7253-4449-b48e-3a173501f032,cdp2bioactives_f23_s5_w47145fde8-0a2a-4d19-8d37-5735dd024e70,82,632
1581,18220.0,25490-F15-2,BRD-K60332514-001-05-7,25490,F15,2,SA1858863,BRD-K60332514,BROAD_CPD_ID,O=C(NC1CCCCC1)Nc1ccc2OCCOc2c1,SZYOOVNTPYBCFG-UHFFFAOYSA-N,cdp2w10-au00024359_f15_s2_w25dfde6d5-63cd-4cd7-959b-b6e4c2442668,cdp2w10-au00024359_f15_s2_w3306fc352-6af1-420f-a89d-9fd32f81fa7a,cdp2w10-au00024359_f15_s2_w1cb21b0f1-1b49-45c2-ba6b-0f34f25e71db,cdp2w10-au00024359_f15_s2_w52c83da45-b955-45a2-bd1f-16fa7f8cde26,cdp2w10-au00024359_f15_s2_w43b1b95b4-ced3-49bd-af06-f6a72c72b2dc,97,7383
1582,3219.0,24305-L21-4,BRD-K13261168-001-01-4,24305,L21,4,SA82614,"LY-163,502",to-be-curated,CCCN1CCC[C@@H]2Cc3nc(N)ncc3C[C@@H]12,TUFADSGTJUOBEH-ZWNOBZJWSA-N,cdp2bioactives_l21_s4_w29c409096-7402-4a2a-a8f1-6e44f02f0db1,cdp2bioactives_l21_s4_w328f8d47a-589d-4b63-95fc-126d755ef1fb,cdp2bioactives_l21_s4_w14614adbb-6b9e-483d-9b14-3820af053af8,cdp2bioactives_l21_s4_w53860a80b-e37a-4f9b-a68d-4cc533f4dc75,cdp2bioactives_l21_s4_w4a27a9c7f-cbf8-4fe2-9a22-a1f589cd1b10,123,899
1583,32930.0,25679-G18-6,BRD-K07240145-001-05-5,25679,G18,6,SA1856801,BRD-K07240145,BROAD_CPD_ID,NC(=O)c1ccccc1NC(=S)NC(=O)c1ccc(Br)o1,TUPOAJAVVZVLFC-UHFFFAOYSA-N,cdp2w12_g18_s6_w2b6d74814-6f23-4d23-80dc-bba4a5e9ed93,cdp2w12_g18_s6_w31ecad6f2-096f-4e60-aea8-6a472827e467,cdp2w12_g18_s6_w1ed130a0e-c614-4bdb-bd3e-4a0443cecc32,cdp2w12_g18_s6_w538c71003-a940-4853-a714-f29384c0e52a,cdp2w12_g18_s6_w4d7826816-f534-4773-84c2-c676e7cb8296,52,6457
1584,18026.0,25488-N03-6,BRD-A35987488-001-05-4,25488,N03,6,SA1860886,BRD-A35987488,BROAD_CPD_ID,CCOc1ccccc1NC(=O)C(OC(=O)c1ccc(CC)cc1)c1ccccc1,TUULDXYKDUVHPC-UHFFFAOYSA-N,cdp2w10-au00024357_n03_s6_w2163ba5bd-0755-4dec-980d-62bbcc11dbad,cdp2w10-au00024357_n03_s6_w38b17ccb6-888b-402e-950f-e076bd9b1a77,cdp2w10-au00024357_n03_s6_w11359caff-c727-439f-9239-9c42c5ada75b,cdp2w10-au00024357_n03_s6_w596b83a25-7088-4431-8503-ed9ad48029f9,cdp2w10-au00024357_n03_s6_w42c60daf2-0c96-4c4b-a9c9-fda01e01ac3a,52,6498
1585,19791.0,25565-C14-1,BRD-K07177450-001-05-8,25565,C14,1,SA1859457,BRD-K07177450,BROAD_CPD_ID,COC(=O)c1[nH]c2cc(C)ccc2c1NC(=O)CN1CCN(CC1)C(=O)c1ccco1,TVUZUPRVECIGSD-UHFFFAOYSA-N,cdp2w11_c14_s1_w216e9738e-c5f0-418c-b6a8-3e201ac1e6dc,cdp2w11_c14_s1_w3f575c568-96eb-48d1-934c-7aef9892c332,cdp2w11_c14_s1_w16363d99a-3319-42c4-b962-7e77edd51525,cdp2w11_c14_s1_w51741eb71-ca19-402a-a988-c4544f9cc6da,cdp2w11_c14_s1_w44a4870b6-8834-4d07-9198-10f7ec90c6ea,86,3848
1586,42392.0,25968-D20-6,BRD-K24526313-001-08-6,25968,D20,6,SA792454,levcromakalim,to-be-curated,CC1(C)Oc2ccc(cc2[C@H]([C@@H]1O)N1CCCC1=O)C#N,TVZCRIROJQEVOT-CABCVRRESA-N,cdp2w8x2_d20_s6_w2f0b8a230-1d74-46f9-8e91-131db63e15c7,cdp2w8x2_d20_s6_w338a8b087-ff3b-4a71-928a-aee23acd36a6,cdp2w8x2_d20_s6_w10f1c1a5b-b29e-432a-9ae2-6b141a767241,cdp2w8x2_d20_s6_w5a1aea38a-c21e-4558-9f03-3a502750221e,cdp2w8x2_d20_s6_w46d4ded1c-b116-4896-8efd-7a892d956026,58,184
1587,48187.0,26115-G10-5,BRD-K33773774-001-05-1,26115,G10,5,SA1858144,BRD-K33773774,BROAD_CPD_ID,CCN1CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1,TWFBQVYJVVPGEV-UHFFFAOYSA-N,cdp2w9x2_g10_s5_w2dc114370-65fe-4a18-88d8-001c7c8089ae,cdp2w9x2_g10_s5_w39c97b6c6-91d8-445d-98d6-016f66fd65a2,cdp2w9x2_g10_s5_w1be1c633b-3ec2-47cc-aa22-6fae8fcd461c,cdp2w9x2_g10_s5_w543a8cf8e-b6f0-476a-a8ad-89dad9004867,cdp2w9x2_g10_s5_w40caf2870-1cb8-4c98-acb6-fb5e50a1127b,43,1534
1588,49298.0,26126-H16-6,BRD-K46264154-001-05-6,26126,H16,6,SA1858160,BRD-K46264154,BROAD_CPD_ID,CN(C)CCCNC(=O)C(\NC(=O)c1ccccc1)=C/c1ccc(o1)-c1cccc(c1)[N+]([O-])=O,TWRPZXXICFBNEP-OQKWZONESA-N,cdp2w9x2_h16_s6_w2227db12b-9c54-4c1a-b278-d946bf6de865,cdp2w9x2_h16_s6_w3afcb8fa8-0ebe-4dc7-a8a8-40a43c3e05ef,cdp2w9x2_h16_s6_w11499afe4-d135-4bd4-9135-8cdcdeacefcd,cdp2w9x2_h16_s6_w5df61652e-5fdc-437d-8ddc-1be5d1ea5ed5,cdp2w9x2_h16_s6_w4354cfc3f-ea3a-40fb-afa8-8c65c8220ce7,89,7900
1589,49778.0,26133-B19-6,BRD-K66352426-001-05-6,26133,B19,6,SA1859539,BRD-K66352426,BROAD_CPD_ID,CCOc1ccc2nc(SCc3ccc(F)cc3)sc2c1,TWVLWRDAHHQANL-UHFFFAOYSA-N,cdp2w9x2_b19_s6_w2a10838a4-dd2a-4d29-98d6-9b9e95f21c73,cdp2w9x2_b19_s6_w36ae1d8f2-eeb5-4ae3-b063-90c85103b3b8,cdp2w9x2_b19_s6_w18a1aea27-750f-4825-bc6f-1320e3598a1d,cdp2w9x2_b19_s6_w5e9f75bd2-7519-4029-99cf-eb620dcdd704,cdp2w9x2_b19_s6_w4b8ab1a52-1ea0-4df0-9b6b-04f54a11a493,65,2434
1590,8373.0,24641-K03-1,BRD-K00328666-001-02-1,24641,K03,1,SA859560,BRD-K00328666,BROAD_CPD_ID,COc1cccc(c1)-c1ccc2c(O[C@H](CN(C)C(=O)c3ccccc3F)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1,TXBXSWUOPNBBNR-SEXOINJZSA-N,cdp2w3_k03_s1_w2c7fdcd9f-d156-4408-9162-4ad44e95b8f4,cdp2w3_k03_s1_w301f075d4-7c9e-44f1-8172-c33c9b4c8698,cdp2w3_k03_s1_w172134725-a21f-4ad1-b4e3-c9ccf186509a,cdp2w3_k03_s1_w538a9a733-78ea-467f-9ab4-ecce8eaad04b,cdp2w3_k03_s1_w4e0efcef6-925c-41db-9a6f-11652b0870d9,91,9835
1591,37773.0,25724-H21-1,BRD-K05956735-001-06-2,25724,H21,1,SA1860441,BRD-K05956735,BROAD_CPD_ID,Cc1c(-c2ccco2)[n+]([O-])c(-c2ccccc2)c(C)[n+]1[O-],TXQSLPNOAMHPEH-UHFFFAOYSA-N,cdp2w12_h21_s1_w2a551a16d-cdc1-4392-820e-008e12ee2ffc,cdp2w12_h21_s1_w31e5813dc-4b13-46ea-b1d9-9862f01e3798,cdp2w12_h21_s1_w1e026376d-b0f3-4000-8241-96ff84679fee,cdp2w12_h21_s1_w545d0d58b-a4bb-4468-b6cb-7eb79351df1f,cdp2w12_h21_s1_w472fac7f1-ddbb-4807-a116-23b281d30248,73,8273
1592,2018.0,24296-P16-3,BRD-K39746403-084-02-3,24296,P16,3,SA59345,erythromycin estolate,USAN,CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2OC(=O)CC)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O,TYQXKHPOXXXCTP-CSLYCKPJSA-N,cdp2bioactives_p16_s3_w2c26b33ce-37a0-47b9-a765-9742da6e60b9,cdp2bioactives_p16_s3_w3305f6013-9226-4b43-bd0d-ad2423fbc87c,cdp2bioactives_p16_s3_w10ece75c9-9b0e-47bb-a3a7-e6ad22f43fd7,cdp2bioactives_p16_s3_w5cc415468-b229-4b0c-913a-d05685ba652c,cdp2bioactives_p16_s3_w4f0d5249e-7ba4-435f-aa1f-85b799e2d861,64,10103
1593,33380.0,25680-L15-6,BRD-K38424085-001-05-0,25680,L15,6,SA1854865,BRD-K38424085,BROAD_CPD_ID,C\C=C\Cn1c(SCc2ccccc2)nc2n(C)c(=O)[nH]c(=O)c12,TZABDFYHNLGMHW-ONEGZZNKSA-N,cdp2w12_l15_s6_w2ebe01aca-33ff-4731-b235-c7dfffff23fa,cdp2w12_l15_s6_w3cd8f6061-04c8-4198-99f8-6c1f50228b7e,cdp2w12_l15_s6_w1b982f290-7fe6-4874-a893-1922af83958d,cdp2w12_l15_s6_w5b5febb79-bff0-4d7c-bdff-b2d0436d0bde,cdp2w12_l15_s6_w424955700-43c3-4bed-b348-c8e946a0f18e,58,5302
1594,45074.0,25991-B05-6,BRD-K43797669-001-02-3,25991,B05,6,SA36891,genistein,primary-common,Oc1ccc(cc1)-c1coc2cc(O)cc(O)c2c1=O,TZBJGXHYKVUXJN-UHFFFAOYSA-N,cdp2w8x2_b05_s6_w2d8ef4081-6836-4240-b2b3-69c851f35a82,cdp2w8x2_b05_s6_w3e5b211fb-e7a4-4ca4-9ae2-22f4365a264a,cdp2w8x2_b05_s6_w187d7b879-03b0-4ada-8ce6-80cd04510cd4,cdp2w8x2_b05_s6_w5293469e1-d34a-440b-b9d8-f82ea4440a39,cdp2w8x2_b05_s6_w4eb53445e-7d97-4e33-b0d7-83ef4ad7dd76,40,72
1595,10260.0,25376-J08-4,BRD-K90376138-001-05-4,25376,J08,4,SA1852042,BRD-K90376138,BROAD_CPD_ID,CC1CCN(CC(=O)n2c(C)c(C)c3ccccc23)CC1,TZDKNVWAMSXZSM-UHFFFAOYSA-N,cdp2w10_j08_s4_w2ecd7aba7-8ad1-4eb1-8b2d-1be6067c0b16,cdp2w10_j08_s4_w37bee596e-9358-46bf-866f-bf627e17ff79,cdp2w10_j08_s4_w1d580308b-c4a6-4fd3-a679-531f612b8271,cdp2w10_j08_s4_w5f6909685-776b-4b5c-a02b-b6bc938d99c2,cdp2w10_j08_s4_w44c6881e0-8059-4fc8-b6f1-1fdcf7448288,56,9219
1596,48291.0,26115-M17-1,BRD-K92657102-001-05-7,26115,M17,1,SA1854166,BRD-K92657102,BROAD_CPD_ID,O=C(OCCN1C(=O)c2ccccc2C1=O)c1cccs1,TZDQVHLIIZAVBC-UHFFFAOYSA-N,cdp2w9x2_m17_s1_w2b86d7af1-7ebc-413b-be1b-c2e252bacd18,cdp2w9x2_m17_s1_w370c2960b-b9dd-4c97-84be-56f4003d15ce,cdp2w9x2_m17_s1_w191b73f05-dfbb-4c17-8ee2-b8b48ba22c42,cdp2w9x2_m17_s1_w57ecdcd07-ed05-48c5-8170-af547257917f,cdp2w9x2_m17_s1_w442d77d9a-ed3d-4fb3-a4e9-68289f7d060c,51,4932
1597,31991.0,25676-F09-3,BRD-K11875614-001-05-4,25676,F09,3,SA1856663,BRD-K11875614,BROAD_CPD_ID,CC(C)Nc1nc(Cl)nc(n1)N(CN1C(=O)c2ccccc2S1(=O)=O)C#N,TZYLZLJCFUDOTG-UHFFFAOYSA-N,cdp2w12_f09_s3_w2dee576bd-d163-4e84-a197-0f80cb07ac83,cdp2w12_f09_s3_w333fb7b3b-d770-4d05-a21c-2c7b3cd6cb37,cdp2w12_f09_s3_w14099f99c-2266-4bba-9458-1de0adfca65c,cdp2w12_f09_s3_w568a68f6f-0be4-40c3-93ee-886fc360045b,cdp2w12_f09_s3_w435a6cd2f-6c3b-4bd9-bc9c-551b90289fb3,70,1604
1598,36657.0,25704-D22-1,BRD-K07741505-001-05-6,25704,D22,1,SA1861392,BRD-K07741505,BROAD_CPD_ID,CCc1ccc(OCc2ccc(o2)C(=O)NCc2ccccn2)cc1,UAUHBRCHPWJVAK-UHFFFAOYSA-N,cdp2w12_d22_s1_w286cbd32b-f4d2-47cc-a783-428c302e277b,cdp2w12_d22_s1_w3d729fc99-6032-44cb-93f3-6958b3a4a5fe,cdp2w12_d22_s1_w1ab5dee3f-0b1b-4e92-8682-ef48d9c0c053,cdp2w12_d22_s1_w58ad3bd9f-c4e2-44de-bb5b-faa99e9946c5,cdp2w12_d22_s1_w4b7743b76-8bae-45ad-ac4e-1a252f7d6a40,72,2084
1599,26911.0,25593-E07-5,BRD-K10191318-001-06-4,25593,E07,5,SA1856793,BRD-K10191318,BROAD_CPD_ID,[O-][N+](=O)c1ccc(Oc2cccc(F)c2)c2ccncc12,UBIKCGCGHYJMJW-UHFFFAOYSA-N,cdp2w11_e07_s5_w212fe7c45-8ee7-40a0-978e-3d82f3a00f34,cdp2w11_e07_s5_w342a607d5-5f83-4490-94e0-c62d3e162cf0,cdp2w11_e07_s5_w1fa7dc259-9fca-4902-9c94-62dbb64d83fb,cdp2w11_e07_s5_w50fb31212-560a-4b3b-b1c1-19b44e97f87d,cdp2w11_e07_s5_w44ab184c5-6fae-47f8-a369-e6cf8d9f076e,78,6595
1600,15478.0,25428-O11-2,BRD-K25864174-001-05-4,25428,O11,2,SA1858750,BRD-K25864174,BROAD_CPD_ID,COc1ccc(cc1)C(=O)\C=C/N1CCOCC1,UBJDFKYEOFOQTO-SREVYHEPSA-N,cdp2w10_o11_s2_w25d2e0d46-6269-4147-ab6b-c58d2527dd02,cdp2w10_o11_s2_w361e053cc-cb51-4d12-89c8-f54f43429d52,cdp2w10_o11_s2_w17c293df3-b9b7-4902-b4b3-0af856f68cac,cdp2w10_o11_s2_w59e61acab-15b2-4c9a-b3b5-97bed6cddb8f,cdp2w10_o11_s2_w4aeb5fe98-03e5-4b26-9522-95e6d7b058fe,71,9507
1601,14206.0,25420-K17-2,BRD-A39089577-001-05-7,25420,K17,2,SA1855286,BRD-A39089577,BROAD_CPD_ID,COc1ccc(cc1CN1CCOCC1)C1Nc2ccccc2C(=O)N1Cc1ccccc1,UBJVSEFSDIKCAH-UHFFFAOYSA-N,cdp2w10_k17_s2_w2d4fa0b1c-ca23-4add-9e92-14e7f30498a0,cdp2w10_k17_s2_w39c3a6568-0d42-4b26-a4e3-33567c661768,cdp2w10_k17_s2_w174f159ee-2508-405e-81a2-2f980562c6e7,cdp2w10_k17_s2_w515fc4c1a-f20f-46a6-8de9-65bb6d223499,cdp2w10_k17_s2_w4f23405b3-dd82-4627-81e2-f04cabd74824,70,5558
1602,26060.0,25590-B18-6,BRD-K98654959-001-05-2,25590,B18,6,SA1858691,BRD-K98654959,BROAD_CPD_ID,Cc1nn(-c2ccc(F)cc2)c2nc(N)c(C#N)c(-c3cccs3)c12,UBLCHLNCMIOPPV-UHFFFAOYSA-N,cdp2w11_b18_s6_w2678b5517-ed38-4837-ae2e-d0f4066ceb35,cdp2w11_b18_s6_w36eba382c-69c9-4e7e-9f78-2c9d684632f1,cdp2w11_b18_s6_w15f86e217-e369-4579-9415-459c9329beb4,cdp2w11_b18_s6_w5c70c139b-0ed0-4603-b33e-de26907e9b26,cdp2w11_b18_s6_w4b38b6f25-a1ec-4ae5-9fc4-208f86cf9028,77,8149
1603,31326.0,25674-A17-4,BRD-A31650268-001-05-8,25674,A17,4,SA1862154,BRD-A31650268,BROAD_CPD_ID,CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(Cn3cc(Cl)cn3)o2)sc2CC(C)CCc12,UBMMPWIYJFDHNY-UHFFFAOYSA-N,cdp2w12_a17_s4_w2dca81e65-e6c6-4e48-8838-f92118b7a08f,cdp2w12_a17_s4_w39aa07fa3-08f0-411f-9e34-6800df6fc13c,cdp2w12_a17_s4_w1530bab05-c106-417f-93f6-1c9e2a33e3d1,cdp2w12_a17_s4_w56c39dc15-d868-4263-9550-d8a90ad06532,cdp2w12_a17_s4_w455fdedd3-c2e4-4eb1-a615-e8f12e3d5aab,34,9513
1604,41746.0,25966-I16-2,BRD-K09821361-066-05-0,25966,I16,2,SA83496,deferoxamine,INN,CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN,UBQYURCVBFRUQT-UHFFFAOYSA-N,cdp2w8x2_i16_s2_w294b830df-f7a7-4283-a619-c5ff85bea07f,cdp2w8x2_i16_s2_w3d1ece42f-a4d4-4f00-a8d8-8f6648a6df32,cdp2w8x2_i16_s2_w16b8265e9-f3e7-4bbb-a08a-fbeb7dfb59a2,cdp2w8x2_i16_s2_w5a0bd0c25-7923-4422-ba62-dadfe1685aa7,cdp2w8x2_i16_s2_w4ccf43d89-b9e5-46b4-a377-8c9c380d1d4f,41,213
1605,7797.0,24566-G22-4,BRD-K47461610-001-01-4,24566,G22,4,SA430484,BRD-K47461610,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)OCCCC[C@H](C)Oc2ccc(cc2C1=O)N(C)C,UBYZDEGPUXBRQE-FMALNZMYSA-N,cdp2bioactives-au00026722_g22_s4_w275db875e-e6d9-4456-9c6f-16058ef67167,cdp2bioactives-au00026722_g22_s4_w304dcd99e-fe50-403c-9fb0-4f5fe656a635,cdp2bioactives-au00026722_g22_s4_w16863f8c4-7a92-4169-8c5b-c85b200d83b6,cdp2bioactives-au00026722_g22_s4_w5315e3380-8024-4ae4-8249-568fbe7096db,cdp2bioactives-au00026722_g22_s4_w45c7edf6f-269b-41a9-8209-30a0b4bdb9b8,93,10261
1606,46524.0,26071-C18-4,BRD-K57251296-001-05-8,26071,C18,4,SA1858594,BRD-K57251296,BROAD_CPD_ID,CC(=O)c1ccccc1NC(=O)Cn1c2ccccc2ncc1=O,UCTDQEXXVKXCRS-UHFFFAOYSA-N,cdp2w9x2_c18_s4_w2fce7aeaa-98bc-4152-a0ef-9d30acbafa21,cdp2w9x2_c18_s4_w34b9dd39d-6e95-4ff1-939e-3bd02f7cf714,cdp2w9x2_c18_s4_w1d97d3133-a47e-4656-9855-611d83799621,cdp2w9x2_c18_s4_w58324cba6-42b6-4321-b19e-d0411a3eb699,cdp2w9x2_c18_s4_w45e6f8a9a-8c33-4f43-96f9-96ff3149c5a2,53,5658
1607,23438.0,25578-J10-6,BRD-A72832265-001-06-3,25578,J10,6,SA1859505,BRD-A72832265,BROAD_CPD_ID,Cc1n[nH]c2OC(N)=C(C#N)C(c12)c1c(C)nn(c1C)-c1ccccc1,UDAHNFVDPRZCCX-UHFFFAOYSA-N,cdp2w11_j10_s6_w2d58786ed-d11b-4f5d-b580-0bd992b12ec4,cdp2w11_j10_s6_w3ff21a761-c183-4aa1-9a0a-524c78ee5631,cdp2w11_j10_s6_w16a5d9161-49f4-4f3a-b21f-ac7891451a25,cdp2w11_j10_s6_w51f6c4827-1712-45a3-a566-10aca873034a,cdp2w11_j10_s6_w406a0f2a9-3bad-4604-b60a-e82b1ee69422,68,3553
1608,15043.0,25426-H03-5,BRD-K62723829-236-05-7,25426,H03,5,SA1860363,BRD-K62723829,BROAD_CPD_ID,OC(=O)CSc1cccc2cccnc12,UDBABHVKOSPWKD-UHFFFAOYSA-N,cdp2w10_h03_s5_w2ed1a4dcd-98b5-432c-a36d-3f74acec5582,cdp2w10_h03_s5_w381c056a5-f4ff-496e-84af-48fa4131c524,cdp2w10_h03_s5_w1320c7918-114b-47f7-b71a-6dd83e371c93,cdp2w10_h03_s5_w54f124258-3a1c-40d9-9042-565b8eb4a4c7,cdp2w10_h03_s5_w42fa7c3ff-6956-49f0-ae60-e9f7ec6ed9b8,60,2983
1609,21067.0,25569-B21-5,BRD-A32792984-001-05-0,25569,B21,5,SA1857977,BRD-A32792984,BROAD_CPD_ID,CNC(=O)c1ccccc1S(=O)c1ccccc1C#N,UDBPAUXJOZLTKP-UHFFFAOYSA-N,cdp2w11_b21_s5_w265be339e-549c-4960-bb0a-fdd79674c4cf,cdp2w11_b21_s5_w39613cc11-a0c4-430f-bb2e-b08164782c0a,cdp2w11_b21_s5_w153e77624-b806-47f7-af24-4dc9fcd0914f,cdp2w11_b21_s5_w5d92da4c5-c32e-4fba-b065-702a70bf6d56,cdp2w11_b21_s5_w4fb9cacec-c906-46f4-a9a3-868cd53d92b5,86,5163
1610,55127.0,26271-G22-3,BRD-K76125116-001-05-9,26271,G22,3,SA1860367,BRD-K76125116,BROAD_CPD_ID,CCCCCn1c(=O)[nH]c2cc(ccc2c1=O)C(=O)NCCCN1CCCCC1,UDCNDFMYRPWAQZ-UHFFFAOYSA-N,cdp2w9x2-au00026606_g22_s3_w201b5e8ef-fa8c-4161-9d35-525e1b2d611e,cdp2w9x2-au00026606_g22_s3_w3a59b6724-be84-43ae-a4eb-62b4001e983e,cdp2w9x2-au00026606_g22_s3_w1229eaa05-326e-4d44-9656-f3661f0cd416,cdp2w9x2-au00026606_g22_s3_w5fbb89fe0-1201-45fa-a48f-318ad17bfcf9,cdp2w9x2-au00026606_g22_s3_w4ca03acb8-c5ec-42c1-8649-9c9c51cea185,84,5843
1611,37449.0,25708-H10-1,BRD-K54613724-001-05-4,25708,H10,1,SA1852480,BRD-K54613724,BROAD_CPD_ID,Oc1cc(O)nc(SCC(=O)Nc2ccc3CCCc3c2)n1,UDEGUSADZDFQHJ-UHFFFAOYSA-N,cdp2w12_h10_s1_w22279960d-42a2-4157-bee9-038360c1687b,cdp2w12_h10_s1_w3f02b86b2-1c47-4fc8-918c-75ae431fd360,cdp2w12_h10_s1_w1cf4dc797-8b10-4148-a072-b0b7fd6f53a6,cdp2w12_h10_s1_w5986f8be4-bcd8-4db5-b690-6d16e9885494,cdp2w12_h10_s1_w447c18ff6-0a93-4fb6-8d1e-c1c08f3970f7,54,3227
1612,48484.0,26118-E10-2,BRD-K80885084-001-07-6,26118,E10,2,SA1861624,BRD-K80885084,BROAD_CPD_ID,Cc1ccc(\C=C2\Sc3ccc(cc3NC2=O)C(=O)N2CCN(CC2)c2ccccn2)cc1,UDSNFGLUSKDPJU-XQNSMLJCSA-N,cdp2w9x2_e10_s2_w2c4318f0b-bc3f-4e7c-a420-8a912a4c2885,cdp2w9x2_e10_s2_w3c0ca256e-3d46-42dd-8518-f3796981a65a,cdp2w9x2_e10_s2_w1c2a59913-dab3-4f5a-9a30-cff212358b85,cdp2w9x2_e10_s2_w5fb6ab1bd-a814-49fd-8db8-9f7205de3308,cdp2w9x2_e10_s2_w44c4e6f09-708b-4fad-9e61-c0d518138ca0,72,8870
1613,22521.0,25573-J13-1,BRD-K45988237-001-08-6,25573,J13,1,SA1857547,BRD-K45988237,BROAD_CPD_ID,[O-][N+](=O)c1ccc(s1)\C=C\C(=O)N1CCCC1,UDSVOHWDGMFOHN-HWKANZROSA-N,cdp2w11_j13_s1_w28a20c0f8-30dc-4c56-8dcc-5639d19f4952,cdp2w11_j13_s1_w385677f49-2a76-4ed0-a583-6868055febb9,cdp2w11_j13_s1_w1d19f7fce-a915-4338-9d3f-105c475092e3,cdp2w11_j13_s1_w5ae92e299-31a4-4817-8fad-def6fa476ef2,cdp2w11_j13_s1_w4968d1642-e714-4208-8eb0-1680922b93b2,63,6037
1614,10141.0,25376-B10-5,BRD-K31436159-001-05-2,25376,B10,5,SA1855526,BRD-K31436159,BROAD_CPD_ID,CCCn1c2ccccc2c(O)c(C(=O)NCc2ccc(OC)c(OC)c2)c1=O,UEFBBMRZSJITOF-UHFFFAOYSA-N,cdp2w10_b10_s5_w2c3ad2189-c4b2-49ec-84d8-5025d3a74a50,cdp2w10_b10_s5_w3ba2a193f-c6d0-4b65-9e48-8dc771d09886,cdp2w10_b10_s5_w16c3404f7-e9a2-43b9-9d6f-3b738336f341,cdp2w10_b10_s5_w5e9af0264-5bf1-49e2-bee8-309f353ba441,cdp2w10_b10_s5_w4374d9c60-ba6b-4465-b573-7d40f92321cb,43,7526
1615,2468.0,24301-O20-3,BRD-A93255169-001-06-9,24301,O20,3,SA82349,thalidomide,INN,O=C1N(C2CCC(=O)NC2=O)C(=O)c2ccccc12,UEJJHQNACJXSKW-UHFFFAOYSA-N,cdp2bioactives_o20_s3_w241629146-89bb-4db4-bebf-18d5696c7e4d,cdp2bioactives_o20_s3_w398439623-ec76-48a1-aaa8-714e9227e4ae,cdp2bioactives_o20_s3_w12e997aea-93ab-41a2-ace6-b1975de4fd4f,cdp2bioactives_o20_s3_w589ae4ff8-2429-4f1c-ac20-14e8c6d9af2e,cdp2bioactives_o20_s3_w415e08fbd-46b4-4401-8e3e-364eef167ad1,115,107
1616,22258.0,25572-N08-2,BRD-A60443603-001-05-6,25572,N08,2,SA1861777,BRD-A60443603,BROAD_CPD_ID,O=C(NC1CC1)C1CCCN1C(=O)NC1CCCCC1,UESJQIUZGYHHIC-UHFFFAOYSA-N,cdp2w11_n08_s2_w2005915bc-d1b9-4ba1-a95b-ac21705a1073,cdp2w11_n08_s2_w325a98b13-69c6-4206-9f03-194675ed8e34,cdp2w11_n08_s2_w10ac7cebb-cbcf-4552-af63-abcab7542d5d,cdp2w11_n08_s2_w5eea007e4-6d87-4427-99e9-3639dfbe402d,cdp2w11_n08_s2_w4319cde8e-e590-40e8-b5b4-a5271326b7cd,86,1893
1617,35014.0,25689-H12-2,BRD-K20324289-001-05-6,25689,H12,2,SA1855725,BRD-K20324289,BROAD_CPD_ID,COc1ccc(cc1)-n1c(C)cc(C(=O)COc2ccc(C)nc2[N+]([O-])=O)c1C,UESVFZUIBJDQDX-UHFFFAOYSA-N,cdp2w12_h12_s2_w2df2d3d30-aff0-4c37-8973-9c5826289d68,cdp2w12_h12_s2_w3295856c3-0a1e-4b95-a973-6a25dd15e64f,cdp2w12_h12_s2_w1f85963d2-837c-4fa3-97f6-346e1ebfc314,cdp2w12_h12_s2_w5244ac0d4-87b7-4fda-b1d4-bf8c144164c6,cdp2w12_h12_s2_w485e6cefb-1093-41b5-bd16-44d888a6dce8,34,8270
1618,36370.0,25700-E09-2,BRD-K79581798-001-03-0,25700,E09,2,SA1859939,BRD-K79581798,BROAD_CPD_ID,Clc1ccc2[nH]c3c(ncnc3c2c1)N1CCC2(CC1)OCCO2,UEXINIASTXLPIV-UHFFFAOYSA-N,cdp2w12_e09_s2_w2698e3218-d335-447a-9aef-3a5840b78084,cdp2w12_e09_s2_w3fa6ccd15-132f-4df2-801e-1fc69c68c49c,cdp2w12_e09_s2_w139a6b6a5-7ffd-4fe0-88c9-ef19b83a1890,cdp2w12_e09_s2_w53fe81d20-31dd-4407-ab7f-c8248e2919d8,cdp2w12_e09_s2_w4a3cac874-d64d-4133-ae38-546e3351d588,36,2217
1619,22912.0,25575-O18-2,BRD-K89438694-001-06-9,25575,O18,2,SA1856886,BRD-K89438694,BROAD_CPD_ID,CC1CCN(CC1)C(=O)c1ccc2c(Cl)c3CCCCc3nc2c1,UEXPGQPSJGWVRA-UHFFFAOYSA-N,cdp2w11_o18_s2_w2710b8dc0-6672-4f5d-822e-3302c98beedc,cdp2w11_o18_s2_w398406284-756e-4588-9e35-91f9ef8d9440,cdp2w11_o18_s2_w106c670c8-ddf6-415a-b46b-532ff099803c,cdp2w11_o18_s2_w56ce22d59-495e-447b-8981-64469ccc59ea,cdp2w11_o18_s2_w4ec598624-25c1-4af0-867f-e6505c17e94d,56,6007
1620,33318.0,25680-K03-4,BRD-K51493793-001-05-0,25680,K03,4,SA1856813,BRD-K51493793,BROAD_CPD_ID,Fc1ccc(cc1)C(=O)CSc1ccccn1,UFEDGNOFTXHLIN-UHFFFAOYSA-N,cdp2w12_k03_s4_w2c0403839-71e8-4f2e-8986-04a802178c97,cdp2w12_k03_s4_w320f42358-51bd-4df9-91b8-d572ce129275,cdp2w12_k03_s4_w142e2183b-376c-4143-85cf-e9117f501ccc,cdp2w12_k03_s4_w51ee186e6-a6f3-44d9-9cb2-7d7f2925209a,cdp2w12_k03_s4_w44c441385-2893-4b41-a923-659751ebfb56,77,3804
1621,48299.0,26115-N05-3,BRD-K07617524-001-07-1,26115,N05,3,SA1862063,BRD-K07617524,BROAD_CPD_ID,Sc1ncnc2c(C#N)c3CCCCCn3c12,UFOBHGWLEPTLSI-UHFFFAOYSA-N,cdp2w9x2_n05_s3_w2fa0219a2-4522-4f73-bab7-af694a19af48,cdp2w9x2_n05_s3_w3dec6108f-8305-4bd1-955f-d1d32467a511,cdp2w9x2_n05_s3_w1bf6c528d-9fb8-4ad5-bbc2-780c584c2153,cdp2w9x2_n05_s3_w5ac0c868b-61ea-4724-aa00-b7a165f450d2,cdp2w9x2_n05_s3_w4a32f1103-b80b-4eae-a429-3594f78bde70,57,4570
1622,21753.0,25571-E18-1,BRD-K53698438-001-07-9,25571,E18,1,SA1859576,BRD-K53698438,BROAD_CPD_ID,CCc1ccc(cc1)-n1nnnc1SCC(=O)Nc1ccc(NC(C)=O)cc1,UFQMMFCIGWSKDO-UHFFFAOYSA-N,cdp2w11_e18_s1_w2566cc777-b72b-4412-a7fa-cd5019a0262e,cdp2w11_e18_s1_w3ece17943-24af-4342-82ab-af08d314dce1,cdp2w11_e18_s1_w16749ba30-bdd0-4bc3-b991-dee724098cc4,cdp2w11_e18_s1_w5908775b5-460a-42ab-ac9f-d0159c4aa578,cdp2w11_e18_s1_w4e9c6d579-581e-4c0b-99f5-faaaeb4bc56d,75,3725
1623,36031.0,25694-P22-5,BRD-K87424856-001-05-7,25694,P22,5,SA1855613,BRD-K87424856,BROAD_CPD_ID,CN(c1ccccc1)S(=O)(=O)c1cccc(NC(=O)c2cncc(Br)c2)c1,UGHPSGHYSHXLSK-UHFFFAOYSA-N,cdp2w12_p22_s5_w2248dd343-a152-43f7-b3b4-17da74915ce1,cdp2w12_p22_s5_w3fb738a44-57aa-4baa-a3ea-d1e1c420613e,cdp2w12_p22_s5_w175ca13ef-88ec-4eb6-ad13-b9873ae82d4c,cdp2w12_p22_s5_w537a083a4-02ef-4780-adf9-e774cec4c420,cdp2w12_p22_s5_w4539fd44f-9ebf-4de6-8d05-370e14e318c5,63,4773
1624,47619.0,26107-K07-1,BRD-K20624967-001-05-8,26107,K07,1,SA1856615,BRD-K20624967,BROAD_CPD_ID,O=C(NNC(=S)NC1CCCCC1)c1cccs1,UGMCLDASMRDHHT-UHFFFAOYSA-N,cdp2w9x2_k07_s1_w242b53de7-020d-47a5-b185-00589bc7c61b,cdp2w9x2_k07_s1_w333cbc195-e000-435a-bc96-1bd15255f78e,cdp2w9x2_k07_s1_w1a5d8596d-dffd-449d-91ca-8a1cf19287ce,cdp2w9x2_k07_s1_w58065b293-78ac-4c69-9e6f-c3cd3e5061a1,cdp2w9x2_k07_s1_w43b872a44-74c5-424f-ab28-37663b0c9ad4,54,7600
1625,25246.0,25585-E13-2,BRD-K17024845-001-06-2,25585,E13,2,SA1859481,BRD-K17024845,BROAD_CPD_ID,CCOC(=O)N1CCN(CC1)c1[nH]cnc2c1nc1ccc(F)cc21,UGPDILCTUXQXNZ-UHFFFAOYSA-N,cdp2w11_e13_s2_w20507f4a1-5381-4fb9-9f50-e6c7e76f0876,cdp2w11_e13_s2_w3de080e96-1993-48ca-801b-906978d87cab,cdp2w11_e13_s2_w1234b12e4-b1da-4493-8ea0-dd5ffbd317ec,cdp2w11_e13_s2_w5670f2462-ffd4-4d10-a154-da0acf2932c0,cdp2w11_e13_s2_w401e472dc-7932-40aa-8575-ed2a867ae979,66,2596
1626,21617.0,25570-N06-3,BRD-A23173246-001-05-8,25570,N06,3,SA1860911,BRD-A23173246,BROAD_CPD_ID,CC1=C(C(NC(=O)N1CCCC(O)=O)c1ccc(Cl)cc1Cl)C(=O)OCc1ccccc1,UHBVLBSCOSTTAV-UHFFFAOYSA-N,cdp2w11_n06_s3_w25b0406c3-e09b-494d-8ba0-3898f203ed87,cdp2w11_n06_s3_w363d421e5-d7de-4191-9570-6ad3c06e4375,cdp2w11_n06_s3_w19bad6e2c-af70-435e-91e7-2eb64253dc7b,cdp2w11_n06_s3_w55ef4086f-68bb-4c4a-acf9-d723de8c4c77,cdp2w11_n06_s3_w4791712ac-3c61-4ebc-9d92-ad7c2360f2a5,102,4224
1627,37929.0,25725-A12-1,BRD-K78122650-001-05-6,25725,A12,1,SA1858300,BRD-K78122650,BROAD_CPD_ID,COc1ccc(cc1NC(=S)NC(=O)c1ccc(o1)-c1ccc(Cl)cc1)C(O)=O,UHEGZSZRLPTCPP-UHFFFAOYSA-N,cdp2w12_a12_s1_w2c2d8ed0f-6857-4922-8931-e21e28d648a7,cdp2w12_a12_s1_w3fda5f367-8ed8-4762-936d-d0c0c4e1d595,cdp2w12_a12_s1_w14402e4c4-81ce-433e-9a9a-93e5c0e8d27e,cdp2w12_a12_s1_w5cc252cc5-c1ef-4287-9c10-3c91e85943bf,cdp2w12_a12_s1_w45f99bb2b-b2c5-436b-9450-c710093492b1,87,5677
1628,14792.0,25424-K09-6,BRD-K54725510-001-07-0,25424,K09,6,SA1858304,BRD-K54725510,BROAD_CPD_ID,[O-][N+](=O)c1ccc-2c(c1)C(=O)c1cccnc-21,UHKGMCVBCVDFKM-UHFFFAOYSA-N,cdp2w10_k09_s6_w2ec060693-d9b9-4dfa-8071-7061b1c4b9b2,cdp2w10_k09_s6_w397bc7bca-c809-4070-89c0-7c7e9686d042,cdp2w10_k09_s6_w1f813c4d8-c0c3-4b7b-b92f-15d2390f4226,cdp2w10_k09_s6_w5afc8b8a9-8075-463a-891b-4b955554718d,cdp2w10_k09_s6_w45d9df323-929c-44ab-bc85-c1f03229841b,32,8922
1629,46066.0,26060-I07-2,BRD-A61014366-001-06-9,26060,I07,2,SA1859454,BRD-A61014366,BROAD_CPD_ID,CCCCCn1c2ccccc2c(O)c(C(=O)NC(C)c2ccccc2)c1=O,UHOZNJWKHZFOCI-UHFFFAOYSA-N,cdp2w9x2_i07_s2_w25fde133b-4e82-4ae5-b81f-30934712180c,cdp2w9x2_i07_s2_w33b9ac2eb-8f61-4378-90b6-bf5006821537,cdp2w9x2_i07_s2_w1cb75c727-7891-4b81-86d7-1a97e7252d62,cdp2w9x2_i07_s2_w5516be496-0323-4fc0-af24-5d209526d3f4,cdp2w9x2_i07_s2_w45c4bfa08-cbd1-41da-a8fa-9a3aeea31437,46,8269
1630,53076.0,26204-O04-4,BRD-K80567579-001-05-6,26204,O04,4,SA1857877,BRD-K80567579,BROAD_CPD_ID,COc1ccc(\C=C\C(=O)OCC(=O)NCc2ccco2)cc1OC,UHPXVJSRPCHXBM-SOFGYWHQSA-N,cdp2w9x2-au00026617_o04_s4_w27b40694c-c6d0-45d2-8cc6-282f927f4b6b,cdp2w9x2-au00026617_o04_s4_w3085b28cf-c103-4b34-beb6-a05bdbdf1fe5,cdp2w9x2-au00026617_o04_s4_w17d0cbeab-ddf1-41e6-975f-54b4072a7fab,cdp2w9x2-au00026617_o04_s4_w5ea03195e-e6c6-4882-80f1-2fefa868a954,cdp2w9x2-au00026617_o04_s4_w40a6690f7-1572-4831-ae6e-1eedefa6c9c1,76,1387
1631,50664.0,26138-N14-4,BRD-K47084999-001-06-4,26138,N14,4,SA1857098,BRD-K47084999,BROAD_CPD_ID,Cc1ccc(Nc2nc(=O)c3cccnc3s2)cc1,UHVSTJKUHPUVGN-UHFFFAOYSA-N,cdp2w9x2_n14_s4_w25e57f492-e5b5-4ee9-b611-0648dc6e348b,cdp2w9x2_n14_s4_w3229f3779-dac9-4ace-8f20-acec4ae6b39e,cdp2w9x2_n14_s4_w13db17135-6816-4022-9911-9b8a2ddbc581,cdp2w9x2_n14_s4_w5ce6205e8-9619-4dfb-96fa-cc1aa927b6a9,cdp2w9x2_n14_s4_w48988f70a-de17-4f6d-842a-122b9dca497b,68,6161
1632,12895.0,25410-C05-5,BRD-K94683388-001-05-6,25410,C05,5,SA1858372,BRD-K94683388,BROAD_CPD_ID,COCCCn1c(CCC(O)=O)ccc1-c1cccs1,UHWDVVGLOOPKRS-UHFFFAOYSA-N,cdp2w10_c05_s5_w23d3243a6-0a66-47f1-ac01-c51b55e215ff,cdp2w10_c05_s5_w3d0ab38ae-8e9b-401a-9009-944351103ac2,cdp2w10_c05_s5_w14107ef47-e514-424d-b57f-9e0ad3430592,cdp2w10_c05_s5_w50ac90340-861a-4d49-a5b9-9ded2817de1a,cdp2w10_c05_s5_w4f15a3617-1015-4600-9328-a990bafa75f7,55,4782
1633,40247.0,25945-D20-3,BRD-A58048407-001-06-3,25945,D20,3,SA82090,nimodipine,INN,COCCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC(C)C,UIAGMCDKSXEBJQ-UHFFFAOYSA-N,cdp2w8x2_d20_s3_w24ec9ca63-a9eb-4d1d-89ae-aafb9d3d3f86,cdp2w8x2_d20_s3_w39db5cd66-e137-49a2-b3e6-72f2ff75626d,cdp2w8x2_d20_s3_w1b1a3f7df-2823-419b-9e9f-ebbfce67cf26,cdp2w8x2_d20_s3_w5c00d4a84-3a25-4a69-8804-39de26a7e591,cdp2w8x2_d20_s3_w4b334f844-0aa3-4e1b-a201-94c44723ddd0,50,1001
1634,54151.0,26224-L22-5,BRD-K94144010-001-05-5,26224,L22,5,SA82838,cotinine,INN,CN1[C@@H](CCC1=O)c1cccnc1,UIKROCXWUNQSPJ-VIFPVBQESA-N,cdp2w9x2_l22_s5_w284363c96-b4cc-4865-9bd2-6136a6975738,cdp2w9x2_l22_s5_w3013c3c14-c5a1-4515-a8fe-71fbb7ea056b,cdp2w9x2_l22_s5_w1531dbbae-442a-430a-a741-1095929ad04d,cdp2w9x2_l22_s5_w5019bdd09-521a-4d68-a20d-8a24534a44cf,cdp2w9x2_l22_s5_w476de179b-d031-4349-8ada-41279dc4ea15,33,1278
1635,37129.0,25707-I14-5,BRD-K81339550-001-06-0,25707,I14,5,SA1853929,BRD-K81339550,BROAD_CPD_ID,Cc1nn(CC(=O)c2ccccc2Cl)c(C)c1[N+]([O-])=O,UITVJAJUEDURGU-UHFFFAOYSA-N,cdp2w12_i14_s5_w2700a6039-aefc-497d-875d-70f0880e6460,cdp2w12_i14_s5_w38502df96-4906-47f7-a714-59912d106907,cdp2w12_i14_s5_w1e7e4ab5c-8e89-4673-84ad-73346e857a48,cdp2w12_i14_s5_w50ee39dbd-182c-4553-adab-c63c4d3b4074,cdp2w12_i14_s5_w4ee7e76dc-cd5f-4c08-8c07-70a50054538d,77,7323
1636,14557.0,25422-N19-5,BRD-A08703841-001-05-0,25422,N19,5,SA1854436,BRD-A08703841,BROAD_CPD_ID,O=C(NC1CCCC1)C(N(Cc1cccs1)C(=O)CNC(=O)c1ccco1)c1ccncc1,UJEGVGXAONEETB-UHFFFAOYSA-N,cdp2w10_n19_s5_w271fc87e6-0172-4d5c-a592-aecdee479abb,cdp2w10_n19_s5_w36a0c0778-eae8-423a-83f7-c5aff8ff4c7a,cdp2w10_n19_s5_w150b87b60-eb92-48e3-9fa4-cad24fcabe3e,cdp2w10_n19_s5_w572a0fe1d-53a1-4758-a4ea-f46ce77561ce,cdp2w10_n19_s5_w45338a7bb-15f5-4922-8b73-eed8d794e755,65,7131
1637,9964.0,25374-F08-2,BRD-K77692744-001-05-7,25374,F08,2,SA1860244,"N-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)-2-hydroxybenzamide",to-be-curated,Oc1ccccc1C(=O)NC(=O)c1ccc2OCCc2c1,UJHGHNWTOKTBFN-UHFFFAOYSA-N,cdp2w10_f08_s2_w2bcb5d7d5-c5b4-47fe-9bee-2902786d8f2d,cdp2w10_f08_s2_w392e22cc5-8493-4980-af82-790760d2436c,cdp2w10_f08_s2_w180018868-a365-4f4e-ad43-0fcf06b7df6d,cdp2w10_f08_s2_w5a3e335ec-36cb-41d8-968d-479e29cc1baa,cdp2w10_f08_s2_w472103cff-054f-4677-b847-94cd58b59774,64,5168
1638,38706.0,25738-E12-4,BRD-K06419593-001-07-9,25738,E12,4,SA1856635,BRD-K06419593,BROAD_CPD_ID,COc1ccc(NS(=O)(=O)c2ccc3N[C@@H]([C@@H]4CC=C[C@@H]4c3c2)c2ccc(cc2)C(O)=O)cc1,UJLSMINJLZJZEX-SGIRGMQISA-N,cdp2w12_e12_s4_w270d22665-ba9e-4d7c-b828-e6e35a657b05,cdp2w12_e12_s4_w3a61b028e-0754-4b70-ab55-d73780c30d48,cdp2w12_e12_s4_w118c8d09a-7d0a-41b4-a549-6c58cd28ad41,cdp2w12_e12_s4_w515ef0afc-10f8-47bb-afba-cfd1db11ac52,cdp2w12_e12_s4_w48414bbd7-801a-4e32-be41-341b92791196,42,3402
1639,49163.0,26126-C09-3,BRD-K38279663-001-05-8,26126,C09,3,SA1852969,BRD-K38279663,BROAD_CPD_ID,CCc1nnc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)s1,UKRYSXLSWSVBHE-UHFFFAOYSA-N,cdp2w9x2_c09_s3_w26cc8ebac-71ad-4fe6-a39d-81d969e0b69a,cdp2w9x2_c09_s3_w304bb76ef-d9e2-4e19-a83c-1d5b156986c6,cdp2w9x2_c09_s3_w14c9f6f7f-90bd-46f3-8c43-6c2e9c9437e4,cdp2w9x2_c09_s3_w557abeda0-2fc8-43e4-8833-df8404a6709f,cdp2w9x2_c09_s3_w49e7ff229-a892-4e66-9252-9ee5c63dff10,77,5443
1640,16501.0,25435-D09-5,BRD-K08900543-001-07-7,25435,D09,5,SA1856962,BRD-K08900543,BROAD_CPD_ID,Cc1c(Cc2ccccc2)c(=O)oc2cc(O)cc(O)c12,UKYMHVBZOSPIOA-UHFFFAOYSA-N,cdp2w10_d09_s5_w2b04138fc-9d47-43fd-87e7-44ded9eb14fe,cdp2w10_d09_s5_w3ee958f4d-14a6-4284-a373-3fd34cf350ee,cdp2w10_d09_s5_w1541219e3-85d1-43ab-b449-134c5f91cab1,cdp2w10_d09_s5_w5d53a6bad-2c33-4fdf-afea-676bc434c9b5,cdp2w10_d09_s5_w466d8e8b1-c483-415b-aa47-5052cfc509dc,62,1234
1641,12594.0,25408-D09-4,BRD-K78971503-001-06-3,25408,D09,4,SA1858993,BRD-K78971503,BROAD_CPD_ID,O=S(=O)(N1CCOCC1)n1c(Cc2ccccc2)nc2ccccc12,ULFFECNMOAPKDI-UHFFFAOYSA-N,cdp2w10_d09_s4_w2c17f83bf-6332-4ce2-b3b5-f4f3b0d58462,cdp2w10_d09_s4_w3710fe81e-ad99-4a0c-9eed-3cf1da399212,cdp2w10_d09_s4_w1493f99bb-2cd1-4bdd-ab85-b242fcc55cba,cdp2w10_d09_s4_w55443ce64-ac4d-4442-9865-a599dc6ff1f0,cdp2w10_d09_s4_w45eca0745-d165-4fd2-82e0-a9e48663ebe1,48,5274
1642,16223.0,25434-F21-3,BRD-A02907341-001-04-1,25434,F21,3,SA1861146,BRD-A02907341,BROAD_CPD_ID,O=C(Cn1nc(Cc2cccnc2)c2ccccc2c1=O)NCC1CCCO1,ULGYIQDOQSDSMQ-UHFFFAOYSA-N,cdp2w10_f21_s3_w202068660-b5a6-46e5-b386-9cc4069ea94e,cdp2w10_f21_s3_w31838968d-a862-47a0-a461-54452f61500d,cdp2w10_f21_s3_w127b82bac-a657-471d-b8ed-d681e9feb747,cdp2w10_f21_s3_w54403ee57-08e8-4393-b52b-127e7bee35f1,cdp2w10_f21_s3_w4f03424be-b195-4302-87a3-79258d8a382f,58,6398
1643,8288.0,24637-K01-6,BRD-K38965110-001-01-0,24637,K01,6,SA433829,BRD-K38965110,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C)OCCCC[C@H](C)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O,ULMVXXWMSACXHE-HSGJQSDISA-N,cdp2w3_k01_s6_w26155f9ea-8632-48b3-af15-4faaadc38a6b,cdp2w3_k01_s6_w3c96fa90b-c826-4d8b-8366-3933ff2ec5e3,cdp2w3_k01_s6_w1e49050c3-69e9-431b-87d8-ae38818f642f,cdp2w3_k01_s6_w54b748435-9584-4a1d-b284-e2bf7669f2a7,cdp2w3_k01_s6_w42d4c617e-7ddb-4f3c-9c9f-68da0264af37,100,10212
1644,26442.0,25591-K08-4,BRD-K23236192-001-05-5,25591,K08,4,SA1853306,BRD-K23236192,BROAD_CPD_ID,CC(C)(C)OC(=O)NN=C(S)NC1CCCCC1,ULNFIZHMSLIIMT-UHFFFAOYSA-N,cdp2w11_k08_s4_w21b6dbd88-3dc2-4e12-8dae-12f08e823caf,cdp2w11_k08_s4_w3c320b1de-897d-4b6c-afd9-284c838e3e79,cdp2w11_k08_s4_w1a603c699-acc2-4330-95e1-04b4144b8338,cdp2w11_k08_s4_w5369e5e97-acf2-47d4-b16e-7c6fc7fad10e,cdp2w11_k08_s4_w45aa6fff3-c69b-4725-ae86-bf8cff055c7d,85,1435
1645,42366.0,25968-D05-4,BRD-K23583188-001-05-6,25968,D05,4,SA82277,lavendustin A,common,OC(=O)c1cc(ccc1O)N(Cc1ccccc1O)Cc1cc(O)ccc1O,ULTTYPMRMMDONC-UHFFFAOYSA-N,cdp2w8x2_d05_s4_w27d619c50-8924-4f42-8a56-14cd771044d8,cdp2w8x2_d05_s4_w3da0037fa-8ece-482f-9302-aa753e6a6afa,cdp2w8x2_d05_s4_w16d3c7142-4722-4a7b-82f3-25b7d9179836,cdp2w8x2_d05_s4_w516d36d8a-bad3-41da-bd44-ce143c91f329,cdp2w8x2_d05_s4_w4226b9de7-0376-4bc9-a3f2-c31e334f4e63,69,746
1646,33386.0,25680-L17-6,BRD-K81447963-001-06-2,25680,L17,6,SA1857535,BRD-K81447963,BROAD_CPD_ID,C(CNc1nc(nc2sc3CCCc3c12)-c1cccnc1)CN1CCOCC1,ULZHKRNCZPNKDI-UHFFFAOYSA-N,cdp2w12_l17_s6_w239b5703b-001b-4bb9-84da-2e92eb9fd7ff,cdp2w12_l17_s6_w314d2b068-092a-4fa9-979c-957df175b890,cdp2w12_l17_s6_w1e64996d0-9777-4bcb-a977-71639ee6d89a,cdp2w12_l17_s6_w53ad3daf7-41ee-40f3-b540-5e056838f926,cdp2w12_l17_s6_w4e863a8cb-0a08-40e5-8893-4443c6167083,45,7159
1647,40863.0,25955-P15-1,BRD-K17743697-066-01-0,25955,P15,1,SA63329,KB-R7943,primary-common,NC(=N)SCCc1ccc(OCc2ccc(cc2)[N+]([O-])=O)cc1,UMJUNUMSJDTYTM-UHFFFAOYSA-N,cdp2w8x2_p15_s1_w2b1f56e3a-4df4-427e-ad4b-c1be7a636783,cdp2w8x2_p15_s1_w33428d5f8-6326-4e0f-bfab-914715aad46e,cdp2w8x2_p15_s1_w16fd3dd80-bab4-46e7-8967-8f130f746e94,cdp2w8x2_p15_s1_w59e7144e0-63ee-48c6-931c-c4787f01d3fe,cdp2w8x2_p15_s1_w462efd0a9-82b5-4305-a76d-b20d86400e84,6,5003
1648,24840.0,25584-A19-4,BRD-A61666925-001-09-4,25584,A19,4,SA1853529,BRD-A61666925,BROAD_CPD_ID,NC(=O)C1CCN(CC1)C1CC(=O)N(C1=O)c1ccc(F)c(Cl)c1,UMMYLBGDOPRQOH-UHFFFAOYSA-N,cdp2w11_a19_s4_w2af1faecc-7066-4976-8148-59509d12f318,cdp2w11_a19_s4_w3d6bd1a2a-7967-4655-94ec-b64e71868347,cdp2w11_a19_s4_w170d9f5ae-8fe9-4c24-86eb-cdcbc190d616,cdp2w11_a19_s4_w57a17de0e-0d3f-4e32-a49b-d2bdbb7f9955,cdp2w11_a19_s4_w46605c98d-1ae6-463d-8407-771979e1090a,52,9403
1649,7456.0,24512-J09-5,BRD-A50170005-001-05-1,24512,J09,5,SA1858108,BRD-A50170005,BROAD_CPD_ID,O=C(NC(=S)N1CCOCC1)C12CC3CC(CC(C3)CC1)C2,UMSXWPSYLFTPBQ-UHFFFAOYSA-N,cdp2w10_j09_s5_w245ae92d2-8435-4edb-8c54-751cf1dca6d1,cdp2w10_j09_s5_w3431f82b5-b693-472d-8a64-4c010fed9716,cdp2w10_j09_s5_w13bc464ae-9163-4b29-a5ba-f0769905dcf0,cdp2w10_j09_s5_w5e5076342-485b-4bca-bd90-8e19b8d593b6,cdp2w10_j09_s5_w4f0ceed1f-838c-4a7d-b9db-35ea6e062d91,50,1507
1650,20395.0,25566-P21-5,BRD-A72651344-001-05-4,25566,P21,5,SA1860732,BRD-A72651344,BROAD_CPD_ID,O=C1CSC(N1Cc1ccco1)c1cn(nc1-c1ccccc1)-c1ccccc1,UNEPQNSJOQNWJW-UHFFFAOYSA-N,cdp2w11_p21_s5_w2b41fd277-67ea-40f7-8a30-d628eda556c2,cdp2w11_p21_s5_w365bef5c2-2643-45f0-9e7c-f75199d9589e,cdp2w11_p21_s5_w1aea73d52-9620-4f08-b6e3-bbb571911fb7,cdp2w11_p21_s5_w55cda5aef-2672-44a6-bfd5-82ad63542230,cdp2w11_p21_s5_w4b0db37d7-04b1-441c-bc98-cf5df804f7c0,53,4605
1651,50594.0,26138-J12-6,BRD-K93491540-001-07-6,26138,J12,6,SA1854107,BRD-K93491540,BROAD_CPD_ID,CC(C)(C)[C@H]1CCN(CC[C@H](Sc2ccccc2)c2ccccc2)C(=O)CC1,UODHBKAFNBRALE-GGAORHGYSA-N,cdp2w9x2_j12_s6_w2efa0e7da-ff3d-450e-bff7-266d166b1385,cdp2w9x2_j12_s6_w3947872ae-5efd-4bf7-8af5-1306521d07b2,cdp2w9x2_j12_s6_w16a93c502-85d7-4aff-b628-679192e857d8,cdp2w9x2_j12_s6_w577f9f044-9075-42be-95cd-ef0a3b4671e5,cdp2w9x2_j12_s6_w405ae9f45-d96f-49b6-9a1a-bbb838f084b2,40,8049
1652,36091.0,25695-E20-5,BRD-K61168850-001-05-6,25695,E20,5,SA1858086,BRD-K61168850,BROAD_CPD_ID,CCn1c(SCC(=O)N2CCN(CC2)c2ccc(Cl)cc2)nc2ccccc2c1=O,UOHJTTYUBKMUAQ-UHFFFAOYSA-N,cdp2w12_e20_s5_w27f7cd005-15b4-4a3c-b59e-1f42ec654249,cdp2w12_e20_s5_w35cf972e0-e7a5-409a-956c-c4a5a5e1df7d,cdp2w12_e20_s5_w11499278c-a93a-45f6-9f90-fc8d1e361120,cdp2w12_e20_s5_w52e5bda3b-30d5-4189-a468-b06c2260f9a7,cdp2w12_e20_s5_w46a33c857-9a20-45f3-aa61-dd3188f36b4d,61,8164
1653,12384.0,25406-J19-4,BRD-K35573624-001-07-1,25406,J19,4,SA1859450,BRD-K35573624,BROAD_CPD_ID,Oc1cc([nH]n1)-c1ccc(cc1)C1CCCCC1,UPDLUMMMYBRYMJ-UHFFFAOYSA-N,cdp2w10_j19_s4_w2967bf589-17c0-49e0-b08c-d2da465d09c8,cdp2w10_j19_s4_w3b5c1afa5-734c-4b2d-a9b0-a545aba9acbc,cdp2w10_j19_s4_w1c30614d6-a510-4a44-8757-452540875345,cdp2w10_j19_s4_w5c98fdbf1-9d8f-43e7-ad28-c29527ca10ce,cdp2w10_j19_s4_w42288e048-7ddc-4b81-a029-48452920ddbd,69,1898
1654,45938.0,26058-P20-6,BRD-K10404799-001-05-1,26058,P20,6,SA1854375,BRD-K10404799,BROAD_CPD_ID,CCCn1nnc(NC(=O)c2ccc(o2)-c2cc(Cl)ccc2Cl)n1,UPKZDJZOSFGVMT-UHFFFAOYSA-N,cdp2w9x2_p20_s6_w293c996f6-b39c-4d4c-a674-67503ec86afa,cdp2w9x2_p20_s6_w37c9c802c-4818-4e74-9dbb-7526c61c6735,cdp2w9x2_p20_s6_w1fc2bde52-4f6f-48ab-8521-2269312fbe1a,cdp2w9x2_p20_s6_w534bfd093-eab0-49db-b2ce-5b54b5a35471,cdp2w9x2_p20_s6_w4c40a6bdd-3a24-4d0b-b88b-c266fea533b4,79,4374
1655,21096.0,25569-D10-4,BRD-K50700495-001-05-0,25569,D10,4,SA1857690,BRD-K50700495,BROAD_CPD_ID,CN(C)c1ccc(cc1)C(=O)Nc1cc(ccc1-n1cncn1)C(F)(F)F,UPNQBCUWBKQRGE-UHFFFAOYSA-N,cdp2w11_d10_s4_w2ea25fe66-283a-44bb-80bc-c7a575309ff9,cdp2w11_d10_s4_w36beb2725-8b82-4374-8be1-cb23449c7468,cdp2w11_d10_s4_w1a7cd74a6-2622-4a8d-a0a6-b79919d99477,cdp2w11_d10_s4_w5108d294f-0d1b-480a-a9eb-cb80f6424144,cdp2w11_d10_s4_w41e0464cf-b4f4-4663-bafb-0743805cf604,88,7881
1656,26703.0,25592-K07-1,BRD-A50771566-001-06-5,25592,K07,1,SA1862107,BRD-A50771566,BROAD_CPD_ID,CCOC(=O)c1c(NC(=O)CNC2CCCc3ccccc23)sc(C(N)=O)c1C,UPSNFRPKQDUYOE-UHFFFAOYSA-N,cdp2w11_k07_s1_w28f6a18bf-26eb-43ea-88d7-154c23541558,cdp2w11_k07_s1_w346a74c0a-df52-408b-91f6-317250d58e07,cdp2w11_k07_s1_w1b3829e15-4437-4fa5-a109-166b50785e49,cdp2w11_k07_s1_w54a1d76c5-e9a4-498b-b057-1105afbc904f,cdp2w11_k07_s1_w438069c9c-028d-455f-b488-33df2fe7ad38,86,7053
1657,22718.0,25575-F10-6,BRD-A04829586-001-06-4,25575,F10,6,SA1856820,BRD-A04829586,BROAD_CPD_ID,COc1ccc(cc1OC)C1NC(S)=NC2=C1CCc1ccccc21,UPWWMFGRFVAGGJ-UHFFFAOYSA-N,cdp2w11_f10_s6_w2b976b748-fba4-4ef1-99da-36c182b406fe,cdp2w11_f10_s6_w37a913cc5-c56d-456d-ae9f-675d3d4d2fe3,cdp2w11_f10_s6_w1fe278be3-5d7c-49ab-be10-4caac4441ec7,cdp2w11_f10_s6_w585489a70-4159-4806-a803-fb3d5fe2fb4a,cdp2w11_f10_s6_w441d1deaf-206f-41e5-9caf-f87e32c793e6,63,3814
1658,55430.0,26579-A16-6,BRD-K22002407-001-01-2,26579,A16,6,SA798280,BRD-K22002407,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@H]3[C@H](C[C@H](CC(=O)NCc4ccccc4F)O[C@@H]3CO)c2c1,UQAGOAYYXRCKNS-GUSOMZPTSA-N,cdp2w7x2_a16_s6_w277dffd33-4e3f-479a-94de-00c9ec209792,cdp2w7x2_a16_s6_w3dee2e635-fec5-422b-b5d9-1ee2629ede77,cdp2w7x2_a16_s6_w1ac564690-eb8e-4000-8b62-b3eff593b4f6,cdp2w7x2_a16_s6_w52e639a07-3727-401a-8d23-5f551c138b8f,cdp2w7x2_a16_s6_w4ab7ab55d-5bad-44e1-84ba-e6de887c0d94,54,10151
1659,22703.0,25575-D22-3,BRD-A93754807-001-04-4,25575,D22,3,SA1859856,BRD-A93754807,BROAD_CPD_ID,CCOC(=O)Cc1csc(NC(=O)C2CCCN(C2)S(=O)(=O)c2c[nH]cn2)n1,UQISEIMHWNPEJV-UHFFFAOYSA-N,cdp2w11_d22_s3_w283162c60-7eeb-47de-b459-85e9808124ce,cdp2w11_d22_s3_w394ea3e6e-c730-4056-aa5a-285fd8ce16de,cdp2w11_d22_s3_w1c228ea51-ebb3-4514-8853-2bb94f28ab64,cdp2w11_d22_s3_w5d5067899-67d2-4dbc-b06b-d1a78d7f6bb6,cdp2w11_d22_s3_w41dda72ed-4da5-4b2c-9bea-bb8326ed5ab5,67,7196
1660,28217.0,25605-B10-3,BRD-K42978373-001-05-0,25605,B10,3,SA1852097,BRD-K42978373,BROAD_CPD_ID,CC(C)(C)NC(=O)C(=O)NNC(=O)c1cccc(c1)[N+]([O-])=O,URXYMNAGVPADIN-UHFFFAOYSA-N,cdp2w11-au00029692_b10_s3_w25abfc37d-9813-4ef1-a6b2-1c64fe67696e,cdp2w11-au00029692_b10_s3_w3b874bd93-6034-4db3-b6e4-c26ab54e8d89,cdp2w11-au00029692_b10_s3_w191e0a016-d43b-499e-8b43-f28c6f99d378,cdp2w11-au00029692_b10_s3_w56ec11a2e-e931-4adf-b067-34e7957843ac,cdp2w11-au00029692_b10_s3_w4a911e3e7-c95a-4a14-8efb-32a71a72aae0,67,8187
1661,43704.0,25985-P13-4,BRD-K60184833-001-02-3,25985,P13,4,SA63239,tyrphostin 46,primary-common,NC(=O)C(=C\c1ccc(O)c(O)c1)\C#N,USOXQZNJFMKTKJ-XVNBXDOJSA-N,cdp2w8x2_p13_s4_w2d1c4458e-5df0-4ca3-8069-25a349ff8d54,cdp2w8x2_p13_s4_w37201ad82-69d7-4315-a5c9-4082ed6dffe2,cdp2w8x2_p13_s4_w17f84a5c9-3adf-464b-874b-0bde3958613a,cdp2w8x2_p13_s4_w5b097e624-61b2-4339-8472-b06f8347802f,cdp2w8x2_p13_s4_w4059d35fd-1e1d-41a2-95de-14f0f01f35c6,46,514
1662,11524.0,25391-J12-2,BRD-K13861175-001-05-3,25391,J12,2,SA1855510,BRD-K13861175,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)NCCSCc1ccco1,USPLJRSUCIQBTC-UHFFFAOYSA-N,cdp2w10_j12_s2_w223e02bc0-de75-4ba8-a61b-afb1c2bcec64,cdp2w10_j12_s2_w34e05b36c-f80b-4cc6-99fa-72eb5411e373,cdp2w10_j12_s2_w11af9beac-6305-4e74-9b9d-1263a99cee26,cdp2w10_j12_s2_w5f6e6d937-4044-4fc2-9aff-e7d61d8cee4a,cdp2w10_j12_s2_w46a668e23-8876-4c56-a3b4-3fa46df93094,53,3379
1663,36352.0,25700-D09-2,BRD-K53867059-001-05-2,25700,D09,2,SA1854521,BRD-K53867059,BROAD_CPD_ID,Cc1ccc2nc(NC(=O)c3ccc(Cn4cc(Cl)cn4)o3)sc2c1,USUXXCCOZZWEJK-UHFFFAOYSA-N,cdp2w12_d09_s2_w210142006-ad1a-410d-a1b4-4849950c7332,cdp2w12_d09_s2_w3127a8b98-2556-4a2a-8108-2698cfd3d6d2,cdp2w12_d09_s2_w15290e6e0-7625-40ad-b84e-ce0c6cf0c200,cdp2w12_d09_s2_w5ee5b3af8-79d9-4e31-a2b3-1d9cc8ee7144,cdp2w12_d09_s2_w4b5974002-d464-4beb-8646-4068794c6577,75,5486
1664,9479.0,24751-I01-3,BRD-K39185798-001-02-1,24751,I01,3,SA667008,BRD-K39185798,BROAD_CPD_ID,COC(=O)N(C)C[C@@H]1OCc2cn(CCCC(=O)N(C[C@H]1C)[C@@H](C)CO)nn2,UUDITCQIVHGHRN-YCPHGPKFSA-N,cdp2w5_i01_s3_w259d0e49b-7e4e-45bc-9a41-03ff417007a1,cdp2w5_i01_s3_w393c4ce28-778c-4bc7-a7c9-a69e4ac24bdf,cdp2w5_i01_s3_w1ca3230af-d83f-4710-98aa-b3dcd6517004,cdp2w5_i01_s3_w50c668f47-26bf-4450-b536-746884a971a8,cdp2w5_i01_s3_w4ab36a4d5-3a03-4755-80c7-1b2a2303c8ca,45,10029
1665,16861.0,25436-E12-5,BRD-K49505282-001-05-4,25436,E12,5,SA1858432,BRD-K49505282,BROAD_CPD_ID,Cc1ccc(Nc2ccccc2N)cc1,UUFIHEBXYDLWTO-UHFFFAOYSA-N,cdp2w10_e12_s5_w284b7665c-61c4-4f93-9135-c519c476ea02,cdp2w10_e12_s5_w32e49d0e9-fc23-449c-a83f-dd21deaee138,cdp2w10_e12_s5_w172c654d7-0ed8-4c19-9abc-ec3c832221ea,cdp2w10_e12_s5_w5db1e4c28-a9ab-4b00-95fa-6bd9d2a9e814,cdp2w10_e12_s5_w4fe6aa990-5d9e-4e63-821b-67d738e3f765,35,9230
1666,28414.0,25605-J11-2,BRD-A68941917-001-05-2,25605,J11,2,SA1860991,BRD-A68941917,BROAD_CPD_ID,CN1C(=O)N(C)C(=O)C(=CNC2C3CCC(C)(C2=O)C3(C)C)C1=O,UULMCFPTNUQDHR-UHFFFAOYSA-N,cdp2w11-au00029692_j11_s2_w2c7f5fdfe-ff59-4883-bc59-32f761aae65d,cdp2w11-au00029692_j11_s2_w3b746cc24-3eda-4bf4-bc00-72e1c5f4d7d7,cdp2w11-au00029692_j11_s2_w1745988c4-3b0a-4532-b0b6-6625a60da484,cdp2w11-au00029692_j11_s2_w5d0add5d7-95b1-4827-b020-5bd4578edfd2,cdp2w11-au00029692_j11_s2_w4e9d38cbb-e721-462b-a080-184183abeb84,67,6559
1667,22951.0,25576-B08-5,BRD-K58094029-001-05-5,25576,B08,5,SA1852532,BRD-K58094029,BROAD_CPD_ID,FC(F)(F)c1cccc(NC(=O)n2cc(c(n2)N2CCOCC2)-c2ccccn2)c1,UUSYTIHURXSSDR-UHFFFAOYSA-N,cdp2w11_b08_s5_w27cdf113f-876c-4c51-8df6-54845b9f0977,cdp2w11_b08_s5_w317931733-ba68-40d4-aba5-0e9249ce342a,cdp2w11_b08_s5_w1bd58e8ac-feaa-458a-a3fa-6d604b52e45a,cdp2w11_b08_s5_w5973d3cb0-3ff0-4bdc-aaf5-b591e886bc43,cdp2w11_b08_s5_w4589a9483-b191-47c2-814a-5be820ca7c25,80,6244
1668,48673.0,26118-N11-5,BRD-K40765561-001-05-5,26118,N11,5,SA1852562,BRD-K40765561,BROAD_CPD_ID,Cc1ccc(C)c(c1)-n1c(S)nnc1-c1ccc2OCOc2c1,UUUBHSDLUIDMLH-UHFFFAOYSA-N,cdp2w9x2_n11_s5_w2231f670c-ce71-4f8e-ab1f-41a2799fab97,cdp2w9x2_n11_s5_w3ac39bd41-4ff7-499d-92f0-e8e7508815ad,cdp2w9x2_n11_s5_w14ab31471-a5b4-4b81-818b-b181ad19dbfd,cdp2w9x2_n11_s5_w5c55f290f-f5b0-4002-af81-11f03d41e9ed,cdp2w9x2_n11_s5_w46a531087-a5cc-4947-8c9f-4c7a2ce3c97c,75,7780
1669,31657.0,25675-D03-5,BRD-K61802148-001-05-2,25675,D03,5,SA1860045,BRD-K61802148,BROAD_CPD_ID,COC(=O)c1[nH]c2cccc(Cl)c2c1NC(=O)CN1CCN(CCO)CC1,UVBVXUHABUKTAY-UHFFFAOYSA-N,cdp2w12_d03_s5_w259db0fb3-2f19-412c-a9af-9090d2ce6818,cdp2w12_d03_s5_w36a27c786-6199-4560-8cc9-75ff8d9e3d87,cdp2w12_d03_s5_w11ba46a29-ea63-4957-acdd-f86cd9a6c09a,cdp2w12_d03_s5_w50b857ed9-fbe6-491b-a471-bf0a711107ff,cdp2w12_d03_s5_w4a6f8ac40-b687-469d-b96b-68f349a38dd5,65,2441
1670,46586.0,26071-E16-6,BRD-K77892972-001-06-4,26071,E16,6,SA1855517,BRD-K77892972,BROAD_CPD_ID,Cc1cn2c(nc(=O)c3cccnc23)s1,UVMANZGFIFOIDD-UHFFFAOYSA-N,cdp2w9x2_e16_s6_w24235be17-b6f8-4312-9652-eb676faf8aab,cdp2w9x2_e16_s6_w3332c6d6d-21e3-44ea-a3fd-3355afdc83e0,cdp2w9x2_e16_s6_w1bd37e939-0060-45bb-8324-bab3edd422ea,cdp2w9x2_e16_s6_w5df0a7853-e67f-477d-a3b1-d511350ef613,cdp2w9x2_e16_s6_w43903f2f2-aee8-43af-b220-41675f9defc1,58,1940
1671,45686.0,26058-B07-6,BRD-K04219533-001-05-2,26058,B07,6,SA1858319,BRD-K04219533,BROAD_CPD_ID,[O-][N+](=O)c1cc(ccc1Oc1ccccc1C(=O)Nc1ccccc1)C(F)(F)F,UVRSRDSBVCZOIT-UHFFFAOYSA-N,cdp2w9x2_b07_s6_w275ff9158-9f0f-497a-928c-2db57ebb69e4,cdp2w9x2_b07_s6_w30e705e4d-496a-4362-a507-8e434ec1d866,cdp2w9x2_b07_s6_w15da5fb83-9c19-422c-8e24-afaf14b4b625,cdp2w9x2_b07_s6_w558521780-0a2d-49a2-8ab8-99bc1ce5afc8,cdp2w9x2_b07_s6_w4c84b29f6-8e76-4595-9235-44d4e4b8b22a,53,9012
1672,18313.0,25490-K04-5,BRD-K00748382-001-05-6,25490,K04,5,SA1852409,BRD-K00748382,BROAD_CPD_ID,COc1cnc(nc1Oc1ccc(cc1)C(C)(C)C)-c1ccccc1,UVTPQMAVSUAXIZ-UHFFFAOYSA-N,cdp2w10-au00024359_k04_s5_w2afa00e72-7c91-4cca-b43e-39edd3948236,cdp2w10-au00024359_k04_s5_w3ca7069dc-99b0-4d9d-9b6c-837668d96156,cdp2w10-au00024359_k04_s5_w137fea53e-144e-4863-a87b-422d9deb8389,cdp2w10-au00024359_k04_s5_w513f4f20c-8f2c-4e90-99bd-7ab6c59baecc,cdp2w10-au00024359_k04_s5_w403d70c4a-ea24-43e8-ae7a-d488193bc45c,61,8190
1673,11219.0,25387-H21-3,BRD-K20419492-001-05-7,25387,H21,3,SA1861287,BRD-K20419492,BROAD_CPD_ID,Cc1ccc(cc1)C1=Nc2c(c(=O)[nH]c(=O)n2-c2ccc(F)cc2)C(N1)(C(F)(F)F)C(F)(F)F,UVWNKIZDVOMCKS-UHFFFAOYSA-N,cdp2w10_h21_s3_w2a0aa233f-fcde-498c-9a1c-0f15c3e53162,cdp2w10_h21_s3_w390d58431-aaf9-42ed-85fc-8744fdd2839a,cdp2w10_h21_s3_w1af570528-3a08-487f-b318-0e904ce327af,cdp2w10_h21_s3_w58e23619b-46a2-44d4-9311-e6abb0b7f669,cdp2w10_h21_s3_w4e5e9c684-a4d0-4c75-9eae-4d1c1e44105e,37,3796
1674,18239.0,25490-G16-3,BRD-K79200350-001-06-0,25490,G16,3,SA1852989,BRD-K79200350,BROAD_CPD_ID,Nc1c(sc2nc(cc(c12)C(F)(F)F)-c1cccs1)C(=O)C1CC1,UWBCHNUFEKEGCH-UHFFFAOYSA-N,cdp2w10-au00024359_g16_s3_w292191760-f238-4bb2-9928-e6ffd791b8da,cdp2w10-au00024359_g16_s3_w3c2f0e9c5-f66c-445d-ab63-f813c8320fe4,cdp2w10-au00024359_g16_s3_w1770e2c80-d788-4c5b-89ab-e027f6732202,cdp2w10-au00024359_g16_s3_w5c4af6668-d5c9-4000-af22-66650a42da49,cdp2w10-au00024359_g16_s3_w496c199e3-5c2c-44f5-abab-a7f23ab1d930,92,9144
1675,2421.0,24301-L22-4,BRD-A83326220-001-02-6,24301,L22,4,SA58034,brazilin,primary-common,Oc1ccc2C3c4cc(O)c(O)cc4CC3(O)COc2c1,UWHUTZOCTZJUKC-UHFFFAOYSA-N,cdp2bioactives_l22_s4_w2304102ad-0948-44fc-9ad7-9c016595a1e6,cdp2bioactives_l22_s4_w375d1cad5-69d1-43b5-9c86-3d5b949cdc90,cdp2bioactives_l22_s4_w1d6c8656b-3e19-4294-aa50-291b1cfbb2d6,cdp2bioactives_l22_s4_w56601fcf5-e58d-4e7a-b6a3-3ca40fb81d26,cdp2bioactives_l22_s4_w4930095d7-b897-4b53-b104-8887bd598d43,57,3259
1676,35736.0,25692-P18-4,BRD-K44461009-001-05-7,25692,P18,4,SA1862265,BRD-K44461009,BROAD_CPD_ID,[O-][N+](=O)c1ccc2[nH]c(SCC(=O)NC3CCCCCC3)nc2c1,UXAHGCRRTODSNS-UHFFFAOYSA-N,cdp2w12_p18_s4_w27518d480-2188-4536-a36d-930d2e92be0c,cdp2w12_p18_s4_w33c96eaf7-bc21-484c-b881-167c87e84047,cdp2w12_p18_s4_w1e1948aee-7979-40b8-81a3-2a2527618788,cdp2w12_p18_s4_w5b016d872-879e-4515-bbe5-6b44094ee179,cdp2w12_p18_s4_w4b0f6fa92-ce84-4514-9d27-9c565a010d99,94,2543
1677,19048.0,25503-N04-2,BRD-K72628262-001-06-6,25503,N04,2,SA1860648,BRD-K72628262,BROAD_CPD_ID,CC(C)c1ccc(cc1)C(=O)Nc1cccnc1,UXPRVYXRHDMOPP-UHFFFAOYSA-N,cdp2w11-au00029680_n04_s2_w21d94710c-b7fd-4813-b062-0c7b0dd7dbea,cdp2w11-au00029680_n04_s2_w3af0b7d40-c2f9-430d-a6c7-5eadb8225bfa,cdp2w11-au00029680_n04_s2_w1482b0565-3aeb-4233-ac60-35d6651193e5,cdp2w11-au00029680_n04_s2_w583080b80-0335-473c-9e54-e6a2653470b9,cdp2w11-au00029680_n04_s2_w49d930f75-dbeb-4499-a2fe-18acae00a6c1,70,8545
1678,45837.0,26058-K14-1,BRD-K38240683-001-05-6,26058,K14,1,SA1861192,BRD-K38240683,BROAD_CPD_ID,CCn1ccc(n1)C(=O)NC1=C(CCC1)C#N,UXRZWQHCEIXAAF-UHFFFAOYSA-N,cdp2w9x2_k14_s1_w2b986f90a-66d7-45c7-beea-171e58a6d471,cdp2w9x2_k14_s1_w34bcd8ee8-5ead-409e-9725-41532a65c950,cdp2w9x2_k14_s1_w19347f4cf-be69-4757-b3d0-5e396944bbfd,cdp2w9x2_k14_s1_w5ee1e4383-6201-4f4d-aadc-6b0b7e8cc93b,cdp2w9x2_k14_s1_w46bb6431a-e02a-4ab2-a6e8-50a95666051a,83,5283
1679,31313.0,25674-A06-3,BRD-K96711684-001-07-0,25674,A06,3,SA1858141,BRD-K96711684,BROAD_CPD_ID,Cc1c(oc2ccccc12)-c1nc(N)nc(Nc2ccc(F)cc2)n1,UXYJKRZHUCDGEH-UHFFFAOYSA-N,cdp2w12_a06_s3_w2bfc38396-afa0-41e1-841e-0ebaaaf43702,cdp2w12_a06_s3_w3f26ab0c1-23ac-40a9-8f97-b32e88319275,cdp2w12_a06_s3_w12d530fa8-8f6d-45b3-83a2-b140c1fab8c6,cdp2w12_a06_s3_w5d48b0eb5-c234-4532-9ece-94bd1f29ba6b,cdp2w12_a06_s3_w4e07586aa-5263-40e1-a469-6077e3f904e3,36,3997
1680,45266.0,25991-N20-6,BRD-K75855670-001-02-7,25991,N20,6,SA58350,diiodohydroxyquinoline,INN,Oc1c(I)cc(I)c2cccnc12,UXZFQZANDVDGMM-UHFFFAOYSA-N,cdp2w8x2_n20_s6_w25202a36f-9488-449a-b5c6-88bdb2f92cad,cdp2w8x2_n20_s6_w3bfd49cc8-a16b-407b-aa89-7c338807c321,cdp2w8x2_n20_s6_w1e404452e-29eb-4b73-bfba-7a46c5c462de,cdp2w8x2_n20_s6_w504c12b40-3631-4e01-a24e-0c98d7e1333c,cdp2w8x2_n20_s6_w464a756c9-6cab-483f-8e59-0bc2bc9762cf,45,697
1681,28019.0,25599-J21-3,BRD-K10684867-001-05-5,25599,J21,3,SA1853018,BRD-K10684867,BROAD_CPD_ID,COc1cc(cc(c1OC)S(=O)(=O)NCCO)\C=C\C(O)=O,UYHIQEDZRDRQEH-ONEGZZNKSA-N,cdp2w11_j21_s3_w2436ba1dc-b9f2-4c4e-a5b4-83cb08741387,cdp2w11_j21_s3_w3fdd8af46-ccd6-4684-b422-a31b95e07dd7,cdp2w11_j21_s3_w10f9c3282-1631-438f-866e-adf184c662d7,cdp2w11_j21_s3_w5d4c12453-00fa-491d-bdcc-da1f9cceef73,cdp2w11_j21_s3_w48d9533b4-6aae-45e0-bab0-b831881d7679,79,8720
1682,26945.0,25593-G05-3,BRD-K72310865-001-06-2,25593,G05,3,SA1855230,BRD-K72310865,BROAD_CPD_ID,Oc1cc(=O)n(-c2ccccc2)c(SCC(=O)NC2CCCCC2)n1,UYSVZHGIVDFCEO-UHFFFAOYSA-N,cdp2w11_g05_s3_w23b255c0c-c795-453a-8fc7-5bf22d5e9ab5,cdp2w11_g05_s3_w3f4846fcb-3a64-49e6-9a93-7f3ed1331cc1,cdp2w11_g05_s3_w1c68ecec5-4a59-4a00-acb0-883b82aad116,cdp2w11_g05_s3_w53d76097d-8364-4816-ab15-00cb8e4d10d9,cdp2w11_g05_s3_w4f6f00f70-4ea2-4305-bd04-373245adeb87,90,3004
1683,19836.0,25565-D13-4,BRD-K79257366-001-07-0,25565,D13,4,SA1860654,BRD-K79257366,BROAD_CPD_ID,[O-][N+](=O)c1cnc(NC(=O)COc2ccc(Cl)cc2)s1,UYTYUPKOCVMOCG-UHFFFAOYSA-N,cdp2w11_d13_s4_w21484e3fc-1df9-4bc0-8bbe-0ce422e4a612,cdp2w11_d13_s4_w348008936-a6de-4758-90de-54e0b4259602,cdp2w11_d13_s4_w1fa1e5d1b-a9d1-4844-b7e5-3c6bd4998da7,cdp2w11_d13_s4_w59d844c35-a137-4532-9b9b-3c03b1159215,cdp2w11_d13_s4_w43f4b0d20-50cc-4df0-a509-abc4491eb7db,75,2403
1684,16047.0,25432-N04-1,BRD-K57604515-001-07-9,25432,N04,1,SA1859649,BRD-K57604515,BROAD_CPD_ID,Oc1cccc(c1)N1C(=O)c2cccc3c(ccc(C1=O)c23)N1CCCCC1,UZAAGXXNSDUWGE-UHFFFAOYSA-N,cdp2w10_n04_s1_w201de17fd-2fdd-47cc-93e9-2fca32376cce,cdp2w10_n04_s1_w391192787-3e61-444d-8769-07308179a0b8,cdp2w10_n04_s1_w15f82e680-5736-40e5-9250-e8f44bc9350d,cdp2w10_n04_s1_w53a7886df-a567-41c1-9f24-1a2bca3f583d,cdp2w10_n04_s1_w4a45f1580-851d-48a9-a1f4-ea511ce89fb0,46,8912
1685,28512.0,25638-C13-4,BRD-K55638368-001-05-1,25638,C13,4,SA1861927,BRD-K55638368,BROAD_CPD_ID,CC(C)Cn1c2ncn(CCN3CCOCC3)c(=O)c2c2nc3ccccc3nc12,UZEDOLZGHXNXQZ-UHFFFAOYSA-N,cdp2w12_c13_s4_w2c4d5d266-e968-4f4c-a743-f3ef7cb8e3bd,cdp2w12_c13_s4_w3ec4d08e6-5817-4da2-9fa3-bb8291f17bbb,cdp2w12_c13_s4_w1fc61be41-3078-4ef2-90e7-725e8435df83,cdp2w12_c13_s4_w55e2352ee-eebe-4334-a387-1fe569aa5d69,cdp2w12_c13_s4_w4eff85b23-ef6c-4656-a713-13278e500642,58,4669
1686,22268.0,25572-N15-6,BRD-K68253392-001-05-4,25572,N15,6,SA1852929,BRD-K68253392,BROAD_CPD_ID,COc1ccc(OC)c(Nc2nc(cs2)-c2sc(C)nc2C)c1,UZPBLLFTUZJQMD-UHFFFAOYSA-N,cdp2w11_n15_s6_w2635e245a-0b96-478c-a63e-7dfa35ee7be6,cdp2w11_n15_s6_w3d036e176-828d-4121-bb7c-af9f6f956141,cdp2w11_n15_s6_w1b02d9c55-fc9d-495c-a616-e9b30c53a232,cdp2w11_n15_s6_w5f3801270-7128-4875-b0f4-8a10a26f9fb0,cdp2w11_n15_s6_w4b7c4595e-86d2-4f2f-bc15-a54fa9488fb9,110,2296
1687,33389.0,25680-M06-3,BRD-K15528357-001-05-6,25680,M06,3,SA1856505,BRD-K15528357,BROAD_CPD_ID,CCCc1nnc(NC(=O)CSc2nc3ccccc3[nH]2)s1,UZUHXOZGUNACKA-UHFFFAOYSA-N,cdp2w12_m06_s3_w25666f55e-4fc9-4da9-ab7f-a5f387eaa14a,cdp2w12_m06_s3_w3dfc52b0e-99e8-4cea-bad2-8f14216aabbf,cdp2w12_m06_s3_w15fdcc932-96e8-4f10-930c-8e205d62bb14,cdp2w12_m06_s3_w514c5fa37-0df8-4c88-b056-fa87e108abba,cdp2w12_m06_s3_w47963881f-d395-4dcc-80af-675c50ce4aa6,73,4852
1688,29086.0,25639-P17-2,BRD-A35294449-001-05-3,25639,P17,2,SA1858986,BRD-A35294449,BROAD_CPD_ID,CC1CN(CC(C)O1)c1cc(-c2ccccc2)c2ccccc2n1,UZXIGSNSCQTFTO-UHFFFAOYSA-N,cdp2w12_p17_s2_w250c8c6a4-8850-4509-9790-37f56b9d7f2a,cdp2w12_p17_s2_w3a2b53046-d9f7-427b-8406-812606d4fd7f,cdp2w12_p17_s2_w133e81e21-721c-4ab2-88b0-74928af3a1fc,cdp2w12_p17_s2_w5695604ee-45dd-4af0-946c-3a9de7559318,cdp2w12_p17_s2_w486af8583-56a0-4e47-85b4-ce06f26369d9,66,8785
1689,43144.0,25984-D13-2,BRD-K24132293-001-02-0,25984,D13,2,SA37589,piperlongumine,primary-common,COc1cc(cc(OC)c1OC)\C=C\C(=O)N1CCC=CC1=O,VABYUUZNAVQNPG-BQYQJAHWSA-N,cdp2w8x2_d13_s2_w226b74aa7-aa00-43ac-a2e2-258688feb523,cdp2w8x2_d13_s2_w3a579743e-96e4-475b-b737-183be1ecdffd,cdp2w8x2_d13_s2_w1cb425fc0-b2f0-48ee-a3b8-2ba2bcd315ac,cdp2w8x2_d13_s2_w52f44c391-d4b8-4c33-81f1-51432ed4edcb,cdp2w8x2_d13_s2_w4fd2c44fc-46c9-4509-8a67-8ea8203a9ce7,15,1181
1690,37342.0,25708-C20-2,BRD-K05847686-001-04-7,25708,C20,2,SA1852293,BRD-K05847686,BROAD_CPD_ID,Cc1cccc2sc(NC(=O)Cn3cccc3)nc12,VBSQAXQRPWSQEY-UHFFFAOYSA-N,cdp2w12_c20_s2_w25db5646e-413b-4bb0-a738-8f7b0258d25d,cdp2w12_c20_s2_w340855eba-0119-4277-927a-58de18207324,cdp2w12_c20_s2_w123304ba8-7ba0-4f5c-ae84-4bd6794dd515,cdp2w12_c20_s2_w502bb05f9-14c1-4271-9878-52245ba7f1c5,cdp2w12_c20_s2_w4e17985d1-df4e-47a5-9127-a1e9d392eb34,60,8658
1692,19292.0,25553-J11-6,BRD-K18092493-001-05-5,25553,J11,6,SA1856456,BRD-K18092493,BROAD_CPD_ID,Fc1cccc(Cl)c1Cn1cccc(NC(=O)NCc2ccccc2)c1=O,VCHQEEWIDVWHMW-UHFFFAOYSA-N,cdp2w11-au00029679_j11_s6_w2f29950c3-3b47-4fec-ba4c-a8f8fc2a5d23,cdp2w11-au00029679_j11_s6_w3e4a197d9-f541-462a-b08c-d710eb6e0540,cdp2w11-au00029679_j11_s6_w1dfb547ba-9e81-467b-9d2a-e21e62e20043,cdp2w11-au00029679_j11_s6_w5577a4fa5-ce4b-46ce-b0fa-bc988ee31a4a,cdp2w11-au00029679_j11_s6_w41485eb05-2cd6-42b3-8d97-50004d86c1f3,46,6678
1693,20328.0,25566-M14-4,BRD-A71467562-001-05-1,25566,M14,4,SA1852111,BRD-A71467562,BROAD_CPD_ID,COC(=O)c1c(NC(=O)CN2CCOCC2)sc2CC(C)CCc12,VCOFQHYEUCQCLG-UHFFFAOYSA-N,cdp2w11_m14_s4_w297cf06fe-e641-4078-a31f-11dc5a1e348f,cdp2w11_m14_s4_w35fe3f01a-2ef9-4ad9-be03-27c43e9944da,cdp2w11_m14_s4_w10fb72e28-afc6-49cd-8e21-fa67a855cc0b,cdp2w11_m14_s4_w534ddfede-cbce-435a-95f6-fb59beed21f9,cdp2w11_m14_s4_w4cdca32f5-d80b-49ed-9e81-2c5418ae1f04,74,7678
1694,53013.0,26204-L09-1,BRD-K05565683-001-05-5,26204,L09,1,SA1855815,BRD-K05565683,BROAD_CPD_ID,[O-][N+](=O)c1ccc(F)c(NC(=O)Nc2ccccc2)c1,VCRWTSUAWNVEPD-UHFFFAOYSA-N,cdp2w9x2-au00026617_l09_s1_w250152246-3b6e-4117-bb54-9ae63691a3c0,cdp2w9x2-au00026617_l09_s1_w32b8871f9-4e16-409a-9bd1-912c1c4260d2,cdp2w9x2-au00026617_l09_s1_w1259c2518-7d58-4cae-ac4d-71f00340e227,cdp2w9x2-au00026617_l09_s1_w5626f0205-c780-4bd9-970d-fa998bc4df09,cdp2w9x2-au00026617_l09_s1_w4e3a36c77-a733-40a9-86eb-bea33e5f3ade,66,6354
1695,29927.0,25643-K08-3,BRD-K44412224-001-05-9,25643,K08,3,SA1860613,BRD-K44412224,BROAD_CPD_ID,Cc1c(Cl)cccc1N=C(S)NCc1ccc2OCOc2c1,VDACVOARPDKQHL-UHFFFAOYSA-N,cdp2w12_k08_s3_w2ec5ca603-6418-4991-aa57-4efac58097e6,cdp2w12_k08_s3_w37662a6d3-cf5b-455d-a2a0-ea9eeb7b480d,cdp2w12_k08_s3_w1f2008616-d91a-406d-a24d-7d5b2d45d9f1,cdp2w12_k08_s3_w5ae43151c-a94d-4136-acb7-fbdd72930072,cdp2w12_k08_s3_w47b872ab2-9ffd-4a51-8330-bee77f390bc9,59,7998
1696,32300.0,25677-H06-6,BRD-K24557107-001-05-7,25677,H06,6,SA1856056,BRD-K24557107,BROAD_CPD_ID,CN1C(=O)c2cccc(NCCCN3C(=O)c4ccccc4C3=O)c2C1=O,VDIAQKCISZOWEH-UHFFFAOYSA-N,cdp2w12_h06_s6_w2f913ed7d-3961-4993-a7d1-7484498a7313,cdp2w12_h06_s6_w35ad96f86-d17d-4b50-a6c0-bb520f5879ce,cdp2w12_h06_s6_w1f663aaa1-7626-4526-ba01-c51205d5e947,cdp2w12_h06_s6_w5b4ab3496-3350-425b-bfdf-240c12155596,cdp2w12_h06_s6_w4568c5686-0348-41ff-a079-3248051ea8f5,46,5193
1697,51932.0,26174-N17-6,BRD-A67565174-001-06-6,26174,N17,6,SA1860913,BRD-A67565174,BROAD_CPD_ID,CCc1ccc(cc1)C(=O)NC(CCSC)C(=O)OC,VDOITQPDRSEOGY-UHFFFAOYSA-N,cdp2w9x2-au00026617_n17_s6_w20aadb61b-4d05-43d0-89f5-e537dbee2f0a,cdp2w9x2-au00026617_n17_s6_w3ffbb8556-9358-4cfd-9713-b928813c0429,cdp2w9x2-au00026617_n17_s6_w160917272-df4f-4e0f-bc40-98a687a85633,cdp2w9x2-au00026617_n17_s6_w5ba1bad85-ccc1-4384-ab91-3112c116d335,cdp2w9x2-au00026617_n17_s6_w42bed60a1-8833-464d-a3bc-c4be3380125a,50,1771
1698,19281.0,25553-J07-1,BRD-K56068834-001-05-6,25553,J07,1,SA1853541,BRD-K56068834,BROAD_CPD_ID,COc1ccccc1Sc1nc(ncc1OC)-c1ccccc1,VDPSZTZMXHJHPN-UHFFFAOYSA-N,cdp2w11-au00029679_j07_s1_w2731755ab-8334-4df2-9d4d-b79056cb5bcf,cdp2w11-au00029679_j07_s1_w346c7fd55-1f82-4a79-a321-4af045200950,cdp2w11-au00029679_j07_s1_w155c4fd08-a346-4e9b-8f9e-500b78a501c6,cdp2w11-au00029679_j07_s1_w5a5411ab9-1c16-44c9-b38d-f787dc424921,cdp2w11-au00029679_j07_s1_w443e0e596-e5fb-480c-bf56-ea629926a768,87,1508
1699,14820.0,25424-L15-4,BRD-K91979367-001-05-6,25424,L15,4,SA1858781,BRD-K91979367,BROAD_CPD_ID,CCc1c([nH]c2ccc(Br)cc12)C(O)=O,VDWBOEDWXSJGGH-UHFFFAOYSA-N,cdp2w10_l15_s4_w2f028e05e-855b-4c75-8605-b5f91c076817,cdp2w10_l15_s4_w3ad8dd4ce-02d8-4f47-ac57-48e4b813bfe1,cdp2w10_l15_s4_w12ac4db1d-b161-4d9a-b1f9-301b90a02831,cdp2w10_l15_s4_w528fbd1b6-314e-49cf-a033-1f097d4b7541,cdp2w10_l15_s4_w4ae9ff9ac-6b78-415a-a946-4adf76693eca,35,5704
1700,29037.0,25639-M22-1,BRD-A60513937-001-06-1,25639,M22,1,SA1853815,BRD-A60513937,BROAD_CPD_ID,CCOc1ccc(NC(=O)CC2N(Cc3ccccn3)C(=S)N(C2=O)c2ccccc2)cc1,VEGBESMCQDBMTD-UHFFFAOYSA-N,cdp2w12_m22_s1_w2693c946f-2664-4e5a-add5-92a10a3deab3,cdp2w12_m22_s1_w32df2ea78-e73a-4abf-beab-97797def71cd,cdp2w12_m22_s1_w1cb4a0758-9263-47d1-9eba-73c5127e9708,cdp2w12_m22_s1_w5024ca850-01f8-48bc-8b4f-ff8f65e67aa2,cdp2w12_m22_s1_w4b7a797ee-6af8-4898-b6ce-fcdf51816395,43,7945
1701,11832.0,25392-K18-4,BRD-K15352874-001-04-8,25392,K18,4,SA1858965,BRD-K15352874,BROAD_CPD_ID,CN(C)C(=O)N(CCCN1CCOCC1)Cc1cccc2ccccc12,VEMRWNJNCOGHAG-UHFFFAOYSA-N,cdp2w10_k18_s4_w270231baa-2260-4807-b55e-56a5724bc864,cdp2w10_k18_s4_w378928b15-084a-432d-9ce6-020ee3812e30,cdp2w10_k18_s4_w1b6458a34-a0da-496d-a2eb-fbd3ea3eb99b,cdp2w10_k18_s4_w541dc83b6-f194-47e5-be17-3cbba0a959b2,cdp2w10_k18_s4_w4bdf068aa-e2fc-4a49-8cfa-29307895351d,96,6827
1702,27401.0,25594-M05-3,BRD-K90956468-001-05-3,25594,M05,3,SA1861206,BRD-K90956468,BROAD_CPD_ID,Fc1cccc(c1)-c1nnc(SCC(=O)Nc2nncs2)o1,VEPLLMTXNHFDMM-UHFFFAOYSA-N,cdp2w11_m05_s3_w2de8d2307-9635-4ccd-ae5a-00678b262f22,cdp2w11_m05_s3_w3b40c8c30-1af6-42d7-878c-ecd6168e560a,cdp2w11_m05_s3_w1d1fc71be-b195-48ef-ba98-42186d8bad3f,cdp2w11_m05_s3_w5976fcb00-902a-452a-a23d-218dfca8790a,cdp2w11_m05_s3_w4071ee413-16a0-4b83-8d8f-1458bc0f6c0d,92,6636
1703,1227.0,24293-I15-4,BRD-K89930444-001-01-9,24293,I15,4,SA63264,AG 592,primary-common,Oc1ccc(cc1O)\C=C(/C#N)C(=O)NC1CCC(CC2CCC(CC2)NC(=O)C(\C#N)=C\c2ccc(O)c(O)c2)CC1,VEPQEAOWDILSHB-KOJZRSEWSA-N,cdp2bioactives_i15_s4_w2aaf44f27-6518-43ae-9bdd-329dcb46bca4,cdp2bioactives_i15_s4_w37e692966-f162-4e4e-9329-9d0e9417abe6,cdp2bioactives_i15_s4_w1129ce98b-536b-41c4-a345-d901dfe68829,cdp2bioactives_i15_s4_w5df8e67bd-6786-47f8-a375-9e4a9f0c1983,cdp2bioactives_i15_s4_w4e6c32a77-0d83-4efc-96e9-484a974c8e4c,65,867
1704,43346.0,25984-M07-6,BRD-K35430135-003-01-5,25984,M07,6,SA792524,SR 59230A,to-be-curated,CCc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2ccccc12,VFDHMSXXELYMRW-ICSRJNTNSA-N,cdp2w8x2_m07_s6_w2d08e95b9-a0d3-4600-936a-1974f542979b,cdp2w8x2_m07_s6_w346d9a161-55e5-4547-8c69-c7b4e0306bb6,cdp2w8x2_m07_s6_w1d02d1cb6-5ddd-4b63-8fec-318a90acdde4,cdp2w8x2_m07_s6_w591076db6-bbc9-4f8b-bede-1c3b9c3b3b4c,cdp2w8x2_m07_s6_w45d1bcb33-95d1-4df5-8fcc-4d7f873bc3ca,76,2133
1705,22859.0,25575-M11-3,BRD-A66672006-001-06-5,25575,M11,3,SA1853183,BRD-A66672006,BROAD_CPD_ID,Cc1ccc(cc1)N1C(NC(=O)C(C#N)=C1S)c1ccco1,VFIRJYJMECEAGF-UHFFFAOYSA-N,cdp2w11_m11_s3_w2101ee5a3-b9c8-42e1-ac25-de2eae8f978a,cdp2w11_m11_s3_w3a8f971b3-c13b-4b5d-a747-8638603944bb,cdp2w11_m11_s3_w1a99e7760-3fb9-430e-a714-57194d13a19c,cdp2w11_m11_s3_w56352b171-3757-412d-8018-b3ed80450c98,cdp2w11_m11_s3_w41d4372e6-3d81-4fe5-8b10-e2566e5a7301,73,7281
1706,54743.0,26247-C13-3,BRD-K81623406-004-03-4,26247,C13,3,SA792185,ethiron,primary-common,CCSC(N)=N,VFIZBHJTOHUOEK-UHFFFAOYSA-N,cdp2w9x2_c13_s3_w21568a8c2-55b7-4f14-853a-f2bb52e60867,cdp2w9x2_c13_s3_w3ccf37872-5b86-4fc3-a2f1-19357d40f359,cdp2w9x2_c13_s3_w1009fdbfc-48ea-4493-8f0d-6fc8809a8399,cdp2w9x2_c13_s3_w57e6e51a6-cbd6-469f-b29a-82df59d5d018,cdp2w9x2_c13_s3_w4625e79df-14eb-42a8-beba-9ba55694dc2e,38,757
1707,26025.0,25590-A14-1,BRD-K38340366-001-10-8,25590,A14,1,SA1856285,ML280,common,COc1cc(ccc1O)\C=C1/SC(Nc2ccccc2OC)=NC1=O,VFLCEEKFNGVMNQ-YBEGLDIGSA-N,cdp2w11_a14_s1_w2ea5ed2fe-5843-4f70-92ea-d5b1b107feee,cdp2w11_a14_s1_w39e2bef49-e50d-4cf9-affe-b18d882653ad,cdp2w11_a14_s1_w105821981-773a-4c29-8ed1-d630b5552db3,cdp2w11_a14_s1_w59c653802-81d9-41c1-b18b-1c71e2055d8c,cdp2w11_a14_s1_w4868a17ae-487a-490e-87f8-00bccfb6c0f8,71,6658
1708,3444.0,24306-G12-1,BRD-K07572174-001-02-2,24306,G12,1,SA59870,curcumin,primary-common,COc1cc(ccc1O)\C=C\C(=O)CC(=O)\C=C\c1ccc(O)c(OC)c1,VFLDPWHFBUODDF-FCXRPNKRSA-N,cdp2bioactives_g12_s1_w219475ff5-878c-4895-a28b-0a16a17d2a29,cdp2bioactives_g12_s1_w35a4ba370-ec23-42f1-a79d-bf4ba9e5059f,cdp2bioactives_g12_s1_w1cdf881f6-9d9a-404a-8975-f817dc2c427b,cdp2bioactives_g12_s1_w576f906ec-cb12-4459-8758-279bd2c56b64,cdp2bioactives_g12_s1_w4188f8421-f71f-42b3-9bcc-9a0ba40bb91c,50,343
1709,55731.0,26670-D22-1,BRD-K58129723-001-01-7,26670,D22,1,SA1625562,BRD-K58129723,BROAD_CPD_ID,CN(C)CCCNC(=O)[C@H]1[C@H](CO)[C@H]2Cn3c(ccc(C4=CCCC4)c3=O)[C@H]2N1CCC(F)(F)F,VFQPYNAQKZTJPV-KRXUUXHPSA-N,cdp2w13_d22_s1_w2b19a6600-1d67-43ca-ae4e-972485d5bc0a,cdp2w13_d22_s1_w3f30c8d85-442f-43f0-a779-a0d68bf6ce99,cdp2w13_d22_s1_w1d8dd4318-54b6-4ee6-a30d-386e6dfd508c,cdp2w13_d22_s1_w53dafb6b3-b552-42fb-9862-62d9670030ba,cdp2w13_d22_s1_w40be05935-842e-46e6-963f-47cb965fd089,75,10275
1710,30892.0,25665-I17-2,BRD-M24734294-001-05-3,25665,I17,2,SA1853805,BRD-M24734294,BROAD_CPD_ID,C1COCCO1.Cc1ccc2nc(Nc3nc(C)cc(n3)-c3ccccc3)nc(O)c2c1,VGKWJLZBOAMQAY-UHFFFAOYSA-N,cdp2w12_i17_s2_w2afb4aefc-cde1-429b-9970-b6148a30a7ed,cdp2w12_i17_s2_w32d0e3651-175e-4e1d-8be5-2ff7fe3d25b7,cdp2w12_i17_s2_w1895303fe-0369-47bd-8aea-58064002836c,cdp2w12_i17_s2_w51706aadf-f920-498c-b029-c20fe625e78a,cdp2w12_i17_s2_w46d4f7d0b-82e0-4556-beb8-b6b942441c15,42,6043
1711,39196.0,25855-F06-2,BRD-K96688934-001-01-1,25855,F06,2,SA787300,BRD-K96688934,BROAD_CPD_ID,COc1ccccc1S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21,VHDWJFVGOVHSLC-BOSRLCDASA-N,cdp2w6x2_f06_s2_w222fdcc25-ef35-4727-a897-9656baa670b5,cdp2w6x2_f06_s2_w3904f352b-129a-4de6-af82-0c6df4fa84b4,cdp2w6x2_f06_s2_w113c062da-01eb-42ac-9aa5-ba9662595df1,cdp2w6x2_f06_s2_w5cdd165f8-edc9-4662-8d02-f6436e17ba6f,cdp2w6x2_f06_s2_w4c1385645-4903-49b8-96e8-b1e11c6a8647,88,10430
1712,39260.0,25856-F12-6,BRD-K70243592-001-01-8,25856,F12,6,SA791377,BRD-K70243592,BROAD_CPD_ID,COc1ccccc1S(=O)(=O)N(C)C[C@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@@H](C)CO)n(C)c1ccccc21,VHDWJFVGOVHSLC-SBZVUBOMSA-N,cdp2w6x2_f12_s6_w23d0c081d-6670-4212-bd0b-f9484b6bb3bf,cdp2w6x2_f12_s6_w34923aabb-36ca-4e11-a43f-f01d162cba60,cdp2w6x2_f12_s6_w11277bfda-7da9-459a-9d09-13571f58e958,cdp2w6x2_f12_s6_w5b795b604-3146-4774-8522-a11aacdfac11,cdp2w6x2_f12_s6_w4b0b16b92-1adc-43a0-8615-d37fdd2b84dd,77,10421
1713,31482.0,25674-I05-4,BRD-K13111496-001-06-3,25674,I05,4,SA1854898,BRD-K13111496,BROAD_CPD_ID,Cc1ccc(O)c(c1)-c1cc([nH]n1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(C)n1,VHKNTWVPKWHNTB-UHFFFAOYSA-N,cdp2w12_i05_s4_w2720de8a0-6fdd-4eec-b08b-527c4ad59af2,cdp2w12_i05_s4_w3365707a6-ea38-4f0f-9c96-a64298ff5f0e,cdp2w12_i05_s4_w1daae4905-86ef-4d77-9211-b5ec531889ab,cdp2w12_i05_s4_w53e8a2ce8-dff7-41cc-bbab-812a49d80924,cdp2w12_i05_s4_w4e632ff29-e46a-403d-88d4-1fad48c21624,64,3637
1714,34763.0,25688-K19-3,BRD-A80327103-001-06-0,25688,K19,3,SA1854103,BRD-A80327103,BROAD_CPD_ID,CC1Cc2cc(ccc2N1S(C)(=O)=O)-c1csc(NC(=O)Cc2cccs2)n1,VHTWQMIWARETAV-UHFFFAOYSA-N,cdp2w12_k19_s3_w211b45faf-4037-4fe0-99da-b940b4331078,cdp2w12_k19_s3_w34b4394fe-6382-4145-9b36-0a0be54ed363,cdp2w12_k19_s3_w15063bcbb-d16e-4bfd-bfa0-8b9f5b119eba,cdp2w12_k19_s3_w5811d496c-6b5b-4a3e-aaff-84f3f55dc994,cdp2w12_k19_s3_w46108edba-bdd3-4ddd-80a5-e3e69f4adf5a,57,2649
1715,4951.0,24310-M06-2,BRD-K55529781-236-02-0,24310,M06,2,SA58666,furegrelate,INN,OC(=O)c1cc2cc(Cc3cccnc3)ccc2o1,VHWFITPGPFLBGT-UHFFFAOYSA-N,cdp2bioactives_m06_s2_w2659d64c1-cb18-44f4-bd0c-0f6e1f12a496,cdp2bioactives_m06_s2_w34892780f-40b9-448b-aaab-aae22be4ef00,cdp2bioactives_m06_s2_w14225aaa3-057e-40e8-80e0-510c30ce29e6,cdp2bioactives_m06_s2_w55e4e7850-caad-4f8c-aa65-bec4ecfb3696,cdp2bioactives_m06_s2_w4cf9a89d4-8e7c-40b1-a560-ff21773c2631,108,1381
1716,21138.0,25569-F19-4,BRD-K68936031-001-05-1,25569,F19,4,SA1857357,BRD-K68936031,BROAD_CPD_ID,Clc1ccc(cc1S(=O)(=O)N1CCCCCC1)C(=O)Nc1nc[nH]n1,VHYZTYARFPXAMM-UHFFFAOYSA-N,cdp2w11_f19_s4_w2e00c47a2-952e-4591-a142-503e35dbccfa,cdp2w11_f19_s4_w35906122e-5e55-4965-b530-1d55d47b6752,cdp2w11_f19_s4_w1ddaa61ce-f551-47c7-9e8d-eb6d4bc54ad2,cdp2w11_f19_s4_w58ab8af6e-5564-48d4-a3dc-052e9dfd69fc,cdp2w11_f19_s4_w485efcbe0-14e9-4e43-ac67-181ce4a016c5,88,3045
1717,29494.0,25642-F21-2,BRD-A91891312-001-05-1,25642,F21,2,SA1857854,BRD-A91891312,BROAD_CPD_ID,CCOc1ccc(cc1)N1C(=O)CC(\C=C2\N(C)c3ccccc3C2(C)C)C1=O,VHZKNCQLDVENIL-KGENOOAVSA-N,cdp2w12_f21_s2_w230559dc5-ea06-4260-b690-dc0e73f87b6a,cdp2w12_f21_s2_w372f34837-e921-41ef-ba3f-cf8b0141e1c9,cdp2w12_f21_s2_w1f132b6a2-a39f-4b7a-8581-9bf0904e646a,cdp2w12_f21_s2_w5785c163a-6a0a-4562-b599-f77f0c5780aa,cdp2w12_f21_s2_w49fc12aca-8989-42b4-b382-e663270edfd7,56,3467
1718,27015.0,25593-K03-1,BRD-K13807637-001-04-1,25593,K03,1,SA1853778,BRD-K13807637,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)N=C1NCN(CN1)C1CCN(Cc2ccccc2)CC1,VIDKBODSYYBQMG-UHFFFAOYSA-N,cdp2w11_k03_s1_w24bf1e8f1-4bf9-4a47-a3bf-07bbcdc8fb65,cdp2w11_k03_s1_w371ea676e-2537-4426-a432-6d895caba456,cdp2w11_k03_s1_w1ec472ce7-33f9-4e00-825a-925fd54fb8f7,cdp2w11_k03_s1_w55056765e-91b0-41da-b6d2-63478173dc59,cdp2w11_k03_s1_w4692fbe61-504a-497f-bf71-ef3369973295,75,9736
1719,29414.0,25642-A21-6,BRD-K21588993-001-06-0,25642,A21,6,SA1853975,BRD-K21588993,BROAD_CPD_ID,Cc1cc(Cl)ccc1OCc1cn2cccnc2n1,VIEYBSQJYOJUSR-UHFFFAOYSA-N,cdp2w12_a21_s6_w20f418ada-e1aa-4797-9cc5-485bdf367058,cdp2w12_a21_s6_w384bed2d7-626e-4f24-a684-04c31bd48d92,cdp2w12_a21_s6_w187d036b6-3bf5-4714-b856-504a58e596d4,cdp2w12_a21_s6_w5d226b063-cc2b-43a4-a813-91b3c1dba5a9,cdp2w12_a21_s6_w44e40dee9-677b-49e0-94c1-e5fad73c1cb2,75,1779
1720,50280.0,26135-M18-4,BRD-K29218981-001-05-2,26135,M18,4,SA1858810,BRD-K29218981,BROAD_CPD_ID,[O-][N+](=O)c1ccc(s1)C(=O)OCC(=O)NCc1ccccc1,VIEYFPWEDRGBIV-UHFFFAOYSA-N,cdp2w9x2_m18_s4_w21bb980ee-cfe2-41e9-b8fe-75f341b8dcb7,cdp2w9x2_m18_s4_w3b20897a6-65b6-4be3-bea1-86be135c6002,cdp2w9x2_m18_s4_w1490ea404-7984-42de-a7b8-1d783fd24a31,cdp2w9x2_m18_s4_w5931dc216-3e14-49e6-af74-f46d24906a9f,cdp2w9x2_m18_s4_w49c97e08d-6485-44b0-8217-19fac147468e,68,4120
1721,27678.0,25598-J11-4,BRD-K05086663-001-05-6,25598,J11,4,SA1852482,BRD-K05086663,BROAD_CPD_ID,COc1cccc(c1)C(=O)ONC(=N)c1ccc(cc1)[N+]([O-])=O,VJBZAAZOQSCECH-UHFFFAOYSA-N,cdp2w11_j11_s4_w2472de321-beb7-4788-87b8-15f67cbdd2d3,cdp2w11_j11_s4_w3bf7df198-3615-4681-ba60-97b102cf6970,cdp2w11_j11_s4_w1514a46aa-a193-4e35-86fb-981cae95083e,cdp2w11_j11_s4_w5f0142cfe-ab73-477b-a687-250e6b36b0a0,cdp2w11_j11_s4_w4adcdb792-ea23-4aae-916c-d91549ac0b93,58,2445
1722,38255.0,25725-N19-3,BRD-K25864844-001-06-2,25725,N19,3,SA1862039,BRD-K25864844,BROAD_CPD_ID,CC(=O)c1ccc(NC(=O)COC(=O)c2c3CCC\C(=C\c4cccs4)c3nc3ccccc23)cc1,VJGDROGPTBOECG-SILNSSARSA-N,cdp2w12_n19_s3_w2d3ed6d55-62b2-43c3-b3e2-d0bde10af710,cdp2w12_n19_s3_w3bd83eea0-050a-4ff5-bcca-a7698b198f37,cdp2w12_n19_s3_w14b9fc2d4-e9d7-41c4-8cbb-ab2c93f6fac7,cdp2w12_n19_s3_w53d2f029a-2d22-4bdb-9069-dd92a6106fcf,cdp2w12_n19_s3_w40a91bdd3-031e-4603-b73b-95fefa867a05,82,4777
1723,46446.0,26061-N20-4,BRD-K69252983-001-05-0,26061,N20,4,SA1854161,6-(4-chlorophenyl)-2-hydroxy-4-(methylthio)nicotinonitrile,to-be-curated,CSc1cc(nc(O)c1C#N)-c1ccc(Cl)cc1,VJOADGFNWKRPBG-UHFFFAOYSA-N,cdp2w9x2_n20_s4_w2f1909699-2f23-4312-8700-112e1d170442,cdp2w9x2_n20_s4_w3c9b66468-328d-4b75-9933-43498e82fa0c,cdp2w9x2_n20_s4_w1867fa6e0-f5d0-4ced-af3c-66a4f10fc0af,cdp2w9x2_n20_s4_w5868e7981-fd3c-4d6c-9e8f-3c30fde9aed2,cdp2w9x2_n20_s4_w409441830-115e-49bc-85df-ac610bd213fa,103,3423
1724,51252.0,26159-L20-4,BRD-K74329400-001-05-4,26159,L20,4,SA1855325,BRD-K74329400,BROAD_CPD_ID,CCS(=O)(=O)C1=NN2C(S1)=NC(=O)\C(=C\c1ccc(O)c(OC)c1)C2=N,VJQIYEAWOKQGCL-OCFSITRASA-N,cdp2w9x2-au00026617_l20_s4_w2a60d264b-4d69-4a3b-ac5f-790d7747047d,cdp2w9x2-au00026617_l20_s4_w32748b55d-a125-4a2a-9e02-cc1cc7a561f9,cdp2w9x2-au00026617_l20_s4_w13a9717eb-cbd0-4863-8f83-471a4ff98685,cdp2w9x2-au00026617_l20_s4_w59bc46430-b7fe-4b07-87a6-d2d7a8934c4e,cdp2w9x2-au00026617_l20_s4_w495bb1f8b-d505-40dd-b40f-c80471f93665,76,5726
1725,33573.0,25681-F16-1,BRD-K45034322-001-05-1,25681,F16,1,SA1852275,BRD-K45034322,BROAD_CPD_ID,Clc1ccc(Cl)c2c3CCNC(=O)c3[nH]c12,VJUGVVOGVWAGRV-UHFFFAOYSA-N,cdp2w12_f16_s1_w2ba3f73ec-830f-4340-8778-c62e5337a062,cdp2w12_f16_s1_w34de6ef4f-e3fc-49be-b6bb-7cfdac94cd4b,cdp2w12_f16_s1_w1208acba7-16ee-48ad-b288-565875b80800,cdp2w12_f16_s1_w5d63e184c-1996-4778-a161-af9c03442ac9,cdp2w12_f16_s1_w472b62932-7886-4652-a349-ca58faa4436a,41,2691
1726,30904.0,25665-J13-2,BRD-A96219290-001-06-4,25665,J13,2,SA1859529,BRD-A96219290,BROAD_CPD_ID,COc1ccccc1C(=O)N(CCC1CCCN1C)c1nc2ccccc2s1,VJWZYBFEWVNBCF-UHFFFAOYSA-N,cdp2w12_j13_s2_w2d962d263-e404-440d-bc45-4e94cc3e0cf4,cdp2w12_j13_s2_w39f8ee769-7507-40ec-9506-f6a20c16661c,cdp2w12_j13_s2_w14104bbe9-c528-4f1c-976e-12d073e49651,cdp2w12_j13_s2_w555ced55a-fe32-408e-8966-4038aa0eb812,cdp2w12_j13_s2_w4bae93a89-61cd-45b2-b472-1943788350aa,61,8840
1727,27190.0,25594-B14-2,BRD-A75087829-001-05-2,25594,B14,2,SA1856903,BRD-A75087829,BROAD_CPD_ID,COc1ccc(N2C(=O)CC(Sc3ccccc3C(O)=O)C2=O)c(c1)[N+]([O-])=O,VJYWONMCFNDWOF-UHFFFAOYSA-N,cdp2w11_b14_s2_w20cd09a1d-af57-450b-a55c-635758d00b4a,cdp2w11_b14_s2_w331eb5899-7819-4414-b80a-90d71a3b09cf,cdp2w11_b14_s2_w1491b8ff1-2af7-4d77-a127-6da236d9c1ab,cdp2w11_b14_s2_w5789d4a27-c6fb-439b-976b-09c3502e4a97,cdp2w11_b14_s2_w4e54f154f-01f6-4566-9fe4-6125769d0b7c,77,5559
1728,17300.0,25438-I22-6,BRD-K01289574-001-05-8,25438,I22,6,SA1858280,BRD-K01289574,BROAD_CPD_ID,CCCN1C(=S)S\C(=C/c2c[nH]nc2-c2ccccc2)C1=O,VKBUYHLFYCQFIJ-LCYFTJDESA-N,cdp2w10_i22_s6_w2bc35ffff-1877-409e-a347-5c890742f89c,cdp2w10_i22_s6_w3a41ff0ef-1d3a-4106-a00b-f19bcc4dcfef,cdp2w10_i22_s6_w1c4396441-ae55-4757-9cae-72c3ca87a3c2,cdp2w10_i22_s6_w5bb400db6-c3b4-4e1c-97c5-dc112a6f9a96,cdp2w10_i22_s6_w4b365b4a4-fe14-44c2-80a3-5bc6b80653e8,90,5227
1729,22084.0,25572-F11-2,BRD-A89170710-001-04-5,25572,F11,2,SA1853618,BRD-A89170710,BROAD_CPD_ID,CN(C)c1ccc(CNCCC2(O)CCOC(C)(C)C2)cc1,VKVFYAGMEATUGN-UHFFFAOYSA-N,cdp2w11_f11_s2_w28bb11d57-6ec3-48fe-bd4c-73c75234bcad,cdp2w11_f11_s2_w3eee51f37-90a5-4393-9c15-c852647ec45a,cdp2w11_f11_s2_w1bb58db8c-188e-43dc-8429-18516f60ecc0,cdp2w11_f11_s2_w5c57a9e6f-adae-45d8-ab8c-6444bd32e09c,cdp2w11_f11_s2_w4511dc9a1-bfd9-47c4-8054-a09ab83c1272,94,4470
1730,18135.0,25490-C22-1,BRD-K48978360-001-05-9,25490,C22,1,SA1856009,BRD-K48978360,BROAD_CPD_ID,CCOC(=O)c1cnc(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)nc1N,VLJAIEKCUCADNF-UHFFFAOYSA-N,cdp2w10-au00024359_c22_s1_w25931831f-67e9-4b69-accc-a27dc45b5735,cdp2w10-au00024359_c22_s1_w37034f660-db24-48d8-a0a4-350a16e16172,cdp2w10-au00024359_c22_s1_w178f1e2eb-2b4b-49b7-b8ac-1bc2398a0f55,cdp2w10-au00024359_c22_s1_w5166c3c60-e8c9-423f-a92a-19f771587ef5,cdp2w10-au00024359_c22_s1_w47c600ec4-d742-4f89-b34b-666fd39085e3,54,4326
1731,51076.0,26159-C13-2,BRD-K29178949-001-05-9,26159,C13,2,SA1853745,BRD-K29178949,BROAD_CPD_ID,CCOc1ccc(NC(S)=Nc2cccc3cnccc23)cc1,VLNSVTSRPOFHBE-UHFFFAOYSA-N,cdp2w9x2-au00026617_c13_s2_w233adc7bf-bbf8-4a11-997d-e87a6722ad1f,cdp2w9x2-au00026617_c13_s2_w375cec525-1f20-4011-9b14-9d69a0c01958,cdp2w9x2-au00026617_c13_s2_w103c84327-5946-4990-8a47-bf6fe6d2dca9,cdp2w9x2-au00026617_c13_s2_w5d5db36df-03ab-4639-9c20-ff1320e01f79,cdp2w9x2-au00026617_c13_s2_w459fe633c-e121-4f22-83dd-95141f4e7ec4,68,6371
1732,10181.0,25376-D21-3,BRD-K80009100-001-05-7,25376,D21,3,SA1859443,BRD-K80009100,BROAD_CPD_ID,COc1ccc(NC(=O)C2(CCCC2)c2ccc(NC(=O)c3ccc(OC)cc3)cc2)cc1,VLSCYHLDGQJLAC-UHFFFAOYSA-N,cdp2w10_d21_s3_w2dd012532-5613-4d9a-a899-40af8a5591ae,cdp2w10_d21_s3_w3856791f5-bae0-49ab-aab7-7c1e393e84f9,cdp2w10_d21_s3_w19df5c5c6-fb8a-4c87-8087-663deb49393a,cdp2w10_d21_s3_w5a3d76eb6-6a81-4c64-bcb5-7f0ecffd7f14,cdp2w10_d21_s3_w491958238-8cc4-4917-bc07-bcf74901191b,59,7845
1733,30568.0,25664-I20-2,BRD-K31701661-001-05-0,25664,I20,2,SA1854819,BRD-K31701661,BROAD_CPD_ID,COc1cccc(c1)-c1cc(no1)C(=O)NCc1ccco1,VLTZRGPEWQWHCK-UHFFFAOYSA-N,cdp2w12_i20_s2_w2ba6e859b-4e71-4cb9-b4be-61c2f160d7b2,cdp2w12_i20_s2_w3263903bc-ad20-4464-8620-f980c88c997c,cdp2w12_i20_s2_w1ebd741ac-ba18-4427-b34e-f87909c50160,cdp2w12_i20_s2_w5ff0c5e63-4c9c-4843-badd-11d56b120d06,cdp2w12_i20_s2_w4c58d1223-75f6-4ece-a50a-3f1a9f91687b,77,8579
1734,34395.0,25686-K14-1,BRD-K85771899-001-05-2,25686,K14,1,SA1855759,BRD-K85771899,BROAD_CPD_ID,Cc1cc2cc(CNC(=O)c3ccc(Br)o3)ccc2n1C,VLWUKKOYMKMSNY-UHFFFAOYSA-N,cdp2w12_k14_s1_w26df51200-a276-4deb-a944-68b1d6d3ed4a,cdp2w12_k14_s1_w34d1e6074-5cae-4b9a-8fce-181ba706ae04,cdp2w12_k14_s1_w1db831cb6-fc4c-420e-a6e0-f5fd45653609,cdp2w12_k14_s1_w5f84c904f-d0ee-439a-8ba3-f3707bcd83a0,cdp2w12_k14_s1_w41a3c286a-10bc-4f92-bc61-f433207f94c4,53,7765
1735,34702.0,25688-I07-2,BRD-K32891515-001-05-6,25688,I07,2,SA1858564,BRD-K32891515,BROAD_CPD_ID,CCC(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12,VLYSKKBXAFTPKA-UHFFFAOYSA-N,cdp2w12_i07_s2_w250b63b4e-7592-441b-88fc-b0df84047bf6,cdp2w12_i07_s2_w37590086b-cff3-428d-bb16-22a907077854,cdp2w12_i07_s2_w18e23f82b-c6b1-42fc-8eba-cf842c8e5f68,cdp2w12_i07_s2_w5b078ad9d-2683-45dc-bd88-866a5e32e32d,cdp2w12_i07_s2_w4a97b3286-6d3e-4c5f-bb51-afd423828008,73,9722
1736,52723.0,26203-L21-5,BRD-K26647922-001-05-7,26203,L21,5,SA1853190,BRD-K26647922,BROAD_CPD_ID,CC(=O)Nc1ccc(N\C=C2/C(=O)NC(=O)N(Cc3ccco3)C2=O)cc1,VMBOTZDBDOQIBW-OQLLNIDSSA-N,cdp2w9x2-au00026617_l21_s5_w265e2ce83-e531-442a-877e-b993070c76f0,cdp2w9x2-au00026617_l21_s5_w351c16d1f-4835-4ee7-b787-62c4fb406dcf,cdp2w9x2-au00026617_l21_s5_w17b3cc86d-5f10-4cb9-93e9-59292911d34e,cdp2w9x2-au00026617_l21_s5_w592d69fe2-2385-4bfa-80f7-2a10de922fc2,cdp2w9x2-au00026617_l21_s5_w4fe6cbf56-d8dc-4699-9e92-faa472126b24,60,2967
1737,31586.0,25674-P07-6,BRD-K67882163-001-05-8,25674,P07,6,SA1853863,BRD-K67882163,BROAD_CPD_ID,CCN(CC)S(=O)(=O)c1cccc(NC(=O)\C=C\c2cccc(c2)[N+]([O-])=O)c1,VMORIEVVOUHSNW-VAWYXSNFSA-N,cdp2w12_p07_s6_w267f5ae77-d8d6-451c-b86a-f62d823f79a6,cdp2w12_p07_s6_w3173d8068-8196-47ba-a23f-8178095d3387,cdp2w12_p07_s6_w1a2ee1491-b436-40b0-9b51-54c700810ff2,cdp2w12_p07_s6_w5d63ca4f4-ca85-4d50-9afb-5ee98429ea47,cdp2w12_p07_s6_w44fced131-3fd2-4148-a7f9-d8085419ca80,54,7450
1738,31831.0,25675-M16-5,BRD-K47119189-001-05-0,25675,M16,5,SA1860642,BRD-K47119189,BROAD_CPD_ID,CC(=O)c1cccc(NC(=S)NC(=O)c2cncc(Br)c2)c1,VMVAQKZYRKXDJB-UHFFFAOYSA-N,cdp2w12_m16_s5_w21ac1cea2-26f1-46dc-93ed-ed97a3f4e5fc,cdp2w12_m16_s5_w3a7f54ecf-ae6c-4dad-b0e7-c2afd22fff2a,cdp2w12_m16_s5_w13769426f-5033-4e3b-99c0-dd54174ebe42,cdp2w12_m16_s5_w59a627087-bc3e-4487-be1d-795617d58a7a,cdp2w12_m16_s5_w4dffe46a7-a947-4d0a-9843-6eb63ea279ef,80,3567
1739,3268.0,24305-O05-5,BRD-K15916496-001-04-8,24305,O05,5,SA58239,clotrimazole,INN,Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1,VNFPBHJOKIVQEB-UHFFFAOYSA-N,cdp2bioactives_o05_s5_w28b03aedd-c02f-4e36-b763-901a6df5692b,cdp2bioactives_o05_s5_w3e69056d1-5781-4940-b09e-e8a0b1b1f1ce,cdp2bioactives_o05_s5_w17f469370-8166-4d64-9d10-99627b149050,cdp2bioactives_o05_s5_w5aa620659-d753-432e-96ac-7c2733de0ecc,cdp2bioactives_o05_s5_w435b506b4-556e-421f-829f-2aec4c84a7de,41,193
1740,11875.0,25392-N11-5,BRD-K54117412-001-04-6,25392,N11,5,SA1857049,BRD-K54117412,BROAD_CPD_ID,Oc1nc(SCC(=O)Nc2ccccc2)nc(-c2ccccc2)c1C#N,VNGPFKQOTPZXFR-UHFFFAOYSA-N,cdp2w10_n11_s5_w2742dca7c-56d2-4840-8fd1-65274309b921,cdp2w10_n11_s5_w3305aa013-47dc-4af3-b181-9d231767c9bf,cdp2w10_n11_s5_w1ca24f561-7484-4903-a795-ef917abe00a8,cdp2w10_n11_s5_w5fba6d741-8f69-456c-99df-1ad3087a5b3f,cdp2w10_n11_s5_w4cb968944-da2b-40c4-9e61-22c02be70f20,63,7824
1741,11191.0,25387-G15-5,BRD-A24572753-001-11-3,25387,G15,5,SA1852577,BRD-A24572753,BROAD_CPD_ID,CCC1(NN(C(S)=N1)c1ccc(C)c(C)c1)c1ccccc1,VNHWKVLJCWGPDC-UHFFFAOYSA-N,cdp2w10_g15_s5_w2ef3f8dd5-a046-426f-ab24-84c6e275ae97,cdp2w10_g15_s5_w34b431ff3-b915-428a-8ece-a00233dfa938,cdp2w10_g15_s5_w10d5e5d52-bb41-4d97-9fff-f02cfe08b3b5,cdp2w10_g15_s5_w5c607b6fc-eb17-4500-9f62-b21782dc0a02,cdp2w10_g15_s5_w45332bf2d-dc16-4f37-be8b-1f5c314e58d8,74,6880
1742,12333.0,25406-G14-1,BRD-K36612931-001-06-6,25406,G14,1,SA1861858,BRD-K36612931,BROAD_CPD_ID,NC1=C(C(=O)CN1c1ccccc1)c1nc2ccccc2s1,VNPXKXSKKUVBEM-UHFFFAOYSA-N,cdp2w10_g14_s1_w2debdf137-2b86-4999-b9a7-3f7208198218,cdp2w10_g14_s1_w314fdafb2-6836-4ff6-9de1-9798e17b5c68,cdp2w10_g14_s1_w1449dbef7-1dec-4e29-8219-698a77e31716,cdp2w10_g14_s1_w50d13115e-d55d-47dd-8dea-1b6233a0fb1e,cdp2w10_g14_s1_w4f25517e1-f560-4ef3-911e-1ed045e27254,72,6429
1743,7974.0,24602-E13-1,BRD-K60984759-001-01-8,24602,E13,1,SA796090,BRD-K60984759,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccccn2)Oc2cc(Br)ccc2S1(=O)=O,VNTYMDDKAMTNEX-FTRWYGJKSA-N,cdp2w3_e13_s1_w2c3124967-488e-4f3d-8ad2-7135f22f3f34,cdp2w3_e13_s1_w316a751c9-0bd2-4c6a-83cb-a1a267992d73,cdp2w3_e13_s1_w146683e96-ef54-4b2f-beb3-fb4cd1af2ab6,cdp2w3_e13_s1_w59949c6f5-1212-4422-94e0-ddfa2602aab5,cdp2w3_e13_s1_w4ed554604-5691-4ccb-82df-ec90ba51774e,127,9793
1744,39115.0,25853-I24-5,BRD-K17139610-001-01-2,25853,I24,5,SA787213,BRD-K17139610,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2C#N)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,VOTKEIORIBNPMA-BOSRLCDASA-N,cdp2w6x2_i24_s5_w2162f6a66-816a-486f-8953-36399723d35a,cdp2w6x2_i24_s5_w317110d73-2674-45ad-ad44-9cd283f58b96,cdp2w6x2_i24_s5_w1da373582-d65e-458f-9933-2b23a72592ce,cdp2w6x2_i24_s5_w55b1b4581-95d5-4ee2-9b58-8fda41fb7417,cdp2w6x2_i24_s5_w4d9774cb0-cfbf-42d7-a3ca-90873de1bbfe,61,10478
1745,30736.0,25665-C22-2,BRD-K17676574-001-05-8,25665,C22,2,SA1853118,BRD-K17676574,BROAD_CPD_ID,Cc1ccc2N(C(=O)CN3C(=O)c4ccccc4C3=O)C(C)(C)C=C(C)c2c1,VOVIPIOGQBXGFC-UHFFFAOYSA-N,cdp2w12_c22_s2_w23480baa5-e156-4291-b7f2-8694df791b5c,cdp2w12_c22_s2_w387653839-b682-454a-9e82-c43f0be4c970,cdp2w12_c22_s2_w13b46ca3b-92da-49cb-9d8a-47e50d1d217f,cdp2w12_c22_s2_w573c9699a-2a47-44ef-aca1-60a69e9248c5,cdp2w12_c22_s2_w4c542e555-6026-4c3e-89dc-aea45916244d,42,2834
1746,22946.0,25576-B05-6,BRD-K22375845-001-05-3,25576,B05,6,SA1854576,BRD-K22375845,BROAD_CPD_ID,Cc1nc2cc(NC(=O)COc3ccc(cc3)C#N)ccc2n1-c1ccccc1,VOZIDHJWRZYZLG-UHFFFAOYSA-N,cdp2w11_b05_s6_w27e0e5008-1be0-4027-9ce1-944a890dd2d8,cdp2w11_b05_s6_w3e472ff0a-25ea-4549-9d1d-2382051eb99a,cdp2w11_b05_s6_w18e35752b-c9fe-48d6-b141-d7144c73a7a4,cdp2w11_b05_s6_w5c9e86c9a-7bb3-4911-b3d0-fb5f1eeba05d,cdp2w11_b05_s6_w48a964944-efcb-4b24-ad95-5dee4a098635,91,5852
1747,55261.0,26271-M14-5,BRD-K12925598-001-05-6,26271,M14,5,SA1861682,BRD-K12925598,BROAD_CPD_ID,COc1cccc(c1)-n1ccnc1SCC(=O)Nc1cc(C)on1,VPVUPMJTXCFVSR-UHFFFAOYSA-N,cdp2w9x2-au00026606_m14_s5_w2871fd7af-4d59-42a4-af35-4958ed68746c,cdp2w9x2-au00026606_m14_s5_w342939520-78b4-4b16-993b-0ad40da4b8d7,cdp2w9x2-au00026606_m14_s5_w1a33ea363-54b3-48a6-937e-ab147dd5dbbe,cdp2w9x2-au00026606_m14_s5_w50e461a71-5ce9-4437-8626-9e6256d1d95d,cdp2w9x2-au00026606_m14_s5_w406d84e26-f24f-471e-a1ff-b6545b5c6510,41,9192
1748,49174.0,26126-C22-2,BRD-K10991081-001-06-2,26126,C22,2,SA1860557,BRD-K10991081,BROAD_CPD_ID,COc1ccc(cc1)S(=O)(=O)Nc1cc2c3c(CC(C)(C)CC3=O)oc2c2ccccc12,VQIHVNJYEXYLGL-UHFFFAOYSA-N,cdp2w9x2_c22_s2_w2bdeb7a55-61ef-45e5-a05d-4e90b214bcec,cdp2w9x2_c22_s2_w3ef21bef0-ab29-4ce6-b199-ffc82d5f821e,cdp2w9x2_c22_s2_w146c9406b-1613-4c2a-b955-73d1e541bb6e,cdp2w9x2_c22_s2_w595038bc3-8fc8-48b2-9b5d-862885dfc971,cdp2w9x2_c22_s2_w4fa72d153-6ee7-4807-88ac-9df2afcd6990,72,5361
1749,50325.0,26135-O21-1,BRD-K77354492-001-05-8,26135,O21,1,SA1856460,BRD-K77354492,BROAD_CPD_ID,CN1C(=O)c2ccc(NC(=O)c3cccc(c3)N3C(=O)CCC3=O)cc2C1=O,VRCAFJHRQGTCBG-UHFFFAOYSA-N,cdp2w9x2_o21_s1_w2765a55e0-380a-4be7-8c52-8460fc7282be,cdp2w9x2_o21_s1_w312f2b65d-e319-4123-9b90-4c6723f8542a,cdp2w9x2_o21_s1_w1a89ec091-1999-4a0e-824b-c9be10a21ac1,cdp2w9x2_o21_s1_w5b2a76088-14ce-4c28-85b1-caa25f3115e1,cdp2w9x2_o21_s1_w44fae7179-c2d9-4ba8-9a3e-6878816f048d,55,9373
1750,51046.0,26140-P18-2,BRD-A51540388-001-05-1,26140,P18,2,SA1857474,BRD-A51540388,BROAD_CPD_ID,COCCCNCC1C(Oc2ccc(Cl)cc2)C(=O)N1c1ccccc1C,VRJHWQQXRLCCET-UHFFFAOYSA-N,cdp2w9x2_p18_s2_w27c9e022d-3b20-40c0-b7ef-12580a6d56c9,cdp2w9x2_p18_s2_w37619f224-65c5-4830-a7f3-e9f7a1a82304,cdp2w9x2_p18_s2_w1f465f9b7-ae62-44df-8f08-baf93490eeb3,cdp2w9x2_p18_s2_w58255f6cb-302d-465e-9eca-71f624db3526,cdp2w9x2_p18_s2_w47d984e3d-553b-4a68-8803-0e8122dfa75b,43,5674
1751,12275.0,25406-D11-3,BRD-A94736485-001-07-2,25406,D11,3,SA1858880,BRD-A94736485,BROAD_CPD_ID,FC(F)(F)c1ccc(N\C=C2\SC3CCC(=O)N3C2=O)cc1,VRONHBPHCJBRMR-JXMROGBWSA-N,cdp2w10_d11_s3_w2d67f2d3b-d38d-4a22-ad5a-d09ca9b7e524,cdp2w10_d11_s3_w393e2a5cb-d600-43c8-8bfc-36fe273d3b2f,cdp2w10_d11_s3_w1805bae1a-503a-4230-85f3-7cca4c2a5ecd,cdp2w10_d11_s3_w5e317be6b-d0cd-4043-a497-ab26807bcc2b,cdp2w10_d11_s3_w434f707d5-b771-4302-956a-5dae6c18f77a,62,2819
1752,28490.0,25638-A14-6,BRD-K83336425-001-05-9,25638,A14,6,SA1861954,BRD-K83336425,BROAD_CPD_ID,Cc1ccccc1OCC(=O)NC1=NCCS1,VTDBLIGOEROGEY-UHFFFAOYSA-N,cdp2w12_a14_s6_w2e598e2fa-6f81-49b8-8d6e-4846e8872685,cdp2w12_a14_s6_w35cebb4c4-80f7-49af-a126-48c035fc3968,cdp2w12_a14_s6_w13a843902-1927-464c-be60-d5709a3adb30,cdp2w12_a14_s6_w5b58a18d6-bb00-453c-b73e-4fb32f5c3e79,cdp2w12_a14_s6_w453868b38-eaa0-409a-acae-c8fee69ee346,109,2619
1753,5408.0,24312-H06-3,BRD-K49657628-001-02-3,24312,H06,3,SA63217,tyrphostin AG 18,primary-common,Oc1ccc(C=C(C#N)C#N)cc1O,VTJXFTPMFYAJJU-UHFFFAOYSA-N,cdp2bioactives_h06_s3_w223d8df3b-0a4e-451f-8a0c-20004a8d88da,cdp2bioactives_h06_s3_w3218bd55b-dfa9-4a0c-bda2-6ad494912d5b,cdp2bioactives_h06_s3_w1d2f7ee5c-6751-4305-a75f-fe7be81eda7d,cdp2bioactives_h06_s3_w594ab7be9-5199-4c73-94ff-6776b1798bec,cdp2bioactives_h06_s3_w4343be700-04cb-48ff-b608-e42038916dde,120,668
1754,13666.0,25416-K04-2,BRD-K35805682-001-05-0,25416,K04,2,SA1856896,BRD-K35805682,BROAD_CPD_ID,CCOc1ccccc1-c1nnc(S)o1,VTXLLACKNPVAJW-UHFFFAOYSA-N,cdp2w10_k04_s2_w27ab38bd5-d61f-4d34-b423-394e5be588c7,cdp2w10_k04_s2_w3cf104d5b-210d-4a18-985d-40ad826f4276,cdp2w10_k04_s2_w17a14577b-182d-4755-8969-c24966329486,cdp2w10_k04_s2_w506cd6fc4-d512-456b-be8e-6a1e9f87af29,cdp2w10_k04_s2_w4b2934b71-ced6-4f38-ab60-70cd52a28459,53,9327
1755,8937.0,24731-I17-1,BRD-K86194107-001-02-1,24731,I17,1,SA666921,BRD-K86194107,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc(F)c2)OCc2cn(CCCC1=O)nn2,VTXUSJLMEZRIOV-LZJOCLMNSA-N,cdp2w5_i17_s1_w21c7966a4-67f0-4a00-8584-f34afcd29f47,cdp2w5_i17_s1_w3e331a12b-1ae4-4887-80c7-c54864e83029,cdp2w5_i17_s1_w16b641e27-1ffa-4ebd-a999-23950c2c2b4d,cdp2w5_i17_s1_w5707b8c84-85e2-4702-a5da-efe1bac161ff,cdp2w5_i17_s1_w48da1ba19-f4cb-4068-aa1a-0ad800fb6f86,35,9719
1756,4700.0,24309-N02-3,BRD-K36258877-001-01-5,24309,N02,3,SA792746,AZ-10417808,to-be-curated,[O-][N+](=O)c1cc(C(=O)NCC=C)c2nc(Nc3ccc(Cl)c(Cl)c3)[nH]c(=O)c2c1,VUBILPOZTRGZJK-UHFFFAOYSA-N,cdp2bioactives_n02_s3_w2405751ba-1d47-4fe7-80ea-38d6ce083f75,cdp2bioactives_n02_s3_w38a7fc768-57b7-4044-9fda-54157fa80089,cdp2bioactives_n02_s3_w1ac42af3f-b37c-45f5-affa-57daf7fc1c9d,cdp2bioactives_n02_s3_w5b8a0dbdd-baf6-42d3-86ff-5eaa40c1ca9d,cdp2bioactives_n02_s3_w46d4d1efd-77d6-4496-b1e4-e9b836726ec2,84,1271
1757,37645.0,25708-P03-5,BRD-K00882705-001-06-1,25708,P03,5,SA1856995,BRD-K00882705,BROAD_CPD_ID,Cc1ccc(C)c(OCCn2cc(\C=C(/C#N)C(=O)NCc3ccco3)c3ccccc23)c1,VUFLSYNVLFSVIG-RCCKNPSSSA-N,cdp2w12_p03_s5_w26bd41335-030a-4a91-a351-e43022ed178a,cdp2w12_p03_s5_w3f0bf8563-3328-43f6-bd34-73df2f210928,cdp2w12_p03_s5_w1bbd667b7-4aba-4f32-bd77-f5d2a5a06322,cdp2w12_p03_s5_w55f1bc59e-5743-4da9-be2a-f10aec35a330,cdp2w12_p03_s5_w4da1103f9-f444-4b96-8896-e5046ef14b49,44,6956
1758,39085.0,25852-O24-5,BRD-K59848706-001-01-2,25852,O24,5,SA791668,BRD-K59848706,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(cc2)C(F)(F)F)OCc2ccccc2-c2ccccc2C1=O,VUGFGKFGZUURHO-CZBREUMFSA-N,cdp2w6x2_o24_s5_w2f3814815-af4b-417c-b02a-7b00793cec95,cdp2w6x2_o24_s5_w35b2bc287-573e-42d3-a7b7-52d9b21d1cb6,cdp2w6x2_o24_s5_w13a753c83-ee52-4fcf-b210-2a66cc5b36ac,cdp2w6x2_o24_s5_w5bf2ff2ac-9f47-4c95-a6d2-625c08c8d4fe,cdp2w6x2_o24_s5_w4c772ada1-6ad6-461e-9351-e6b32cf7c6f4,75,10227
1759,31290.0,25667-O16-4,BRD-K34009558-001-05-1,25667,O16,4,SA1858198,BRD-K34009558,BROAD_CPD_ID,NC1=C(C#N)C2(CCCC2)C(C#N)=C(N1)SCC(=O)c1ccccc1,VURXCZVXMSCVOT-UHFFFAOYSA-N,cdp2w12_o16_s4_w26cd39725-7559-4dfa-91d9-943c9b109037,cdp2w12_o16_s4_w39b6299cf-3835-48a1-8ab1-c5c79556ee23,cdp2w12_o16_s4_w15a539006-3551-499d-8905-8c9eac6804b9,cdp2w12_o16_s4_w586d2cf1f-522b-43c8-a839-4f6ac4e55c3b,cdp2w12_o16_s4_w4a0102011-a89f-4e95-8e7f-c34a77721b0c,74,1847
1760,3836.0,24307-I15-3,BRD-K09778810-001-01-5,24307,I15,3,SA82578,FGIN-1-27,common,CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccccc12)-c1ccc(F)cc1,VUWXAQFLTSBUDB-UHFFFAOYSA-N,cdp2bioactives_i15_s3_w2528568bd-c277-477e-8f03-379939f026c4,cdp2bioactives_i15_s3_w3141649b0-e254-4a7e-b5b6-35f8ea5b1e71,cdp2bioactives_i15_s3_w107a6f296-3779-46de-bbd6-6e6403af6621,cdp2bioactives_i15_s3_w510258465-2e7e-4665-8a6f-f91190d49f80,cdp2bioactives_i15_s3_w475908bb4-5e94-45e2-8f89-5f25b9a42151,107,620
1761,33570.0,25681-F13-4,BRD-A71200869-001-05-6,25681,F13,4,SA1856906,BRD-A71200869,BROAD_CPD_ID,O=C(CN1C(=O)c2cccc3cccc1c23)NCC1CCCO1,VVKPUAPJGHWAIV-UHFFFAOYSA-N,cdp2w12_f13_s4_w2e2c4f6c3-296c-4ef6-861c-3e99e46ef45c,cdp2w12_f13_s4_w38e970f83-e3c3-49ae-a743-5ef85c8285da,cdp2w12_f13_s4_w18f34f946-c9c1-4dfd-bd57-2a4702dc1755,cdp2w12_f13_s4_w5d277e0fa-208d-4136-b063-e0715cef6229,cdp2w12_f13_s4_w439ec2844-6d55-459c-bf13-447b67767ee6,78,4625
1762,38928.0,25740-A03-4,BRD-K07161233-001-07-2,25740,A03,4,SA1901300,BRD-K07161233,BROAD_CPD_ID,CNc1nc(N)c(c(Nc2cccc(F)c2)n1)[N+]([O-])=O,VVVWGFVAXRWEMB-UHFFFAOYSA-N,cdp2w12_a03_s4_w2322a9a28-a2c5-4307-9325-a6fadd496c77,cdp2w12_a03_s4_w31c594b8e-1db1-4fa8-aac9-17f8159ff7b1,cdp2w12_a03_s4_w11db58663-2aa3-41c2-9f7a-74d8497c5ddf,cdp2w12_a03_s4_w531bb5e08-f454-46b5-b8a0-6533b775ae47,cdp2w12_a03_s4_w414980166-0202-4334-9490-ebd8b208839e,57,6811
1763,10936.0,25382-G10-2,BRD-K19650815-001-05-0,25382,G10,2,SA1854141,BRD-K19650815,BROAD_CPD_ID,O=C1N(NS(=O)(=O)c2ccccc2)C(=S)S\C1=C/c1cccs1,VWAZCVPSBKHJKM-XFXZXTDPSA-N,cdp2w10_g10_s2_w222abc97c-cfff-465f-95cf-8a1204d3a81e,cdp2w10_g10_s2_w3543a35a1-a6af-471e-839f-633c93d46bea,cdp2w10_g10_s2_w1bb62bcfb-4a27-414e-b5b1-3aae37e2ae9b,cdp2w10_g10_s2_w5f300fb68-a8bf-4970-b923-4ac85789400d,cdp2w10_g10_s2_w4012432e3-adc8-4ee2-8675-7364a64df86f,89,7602
1764,27185.0,25594-B10-3,BRD-K59491389-001-05-6,25594,B10,3,SA1855589,BRD-K59491389,BROAD_CPD_ID,OCC1(CCOc2ccccc2)CCN(CC2=Cc3cc(Cl)ccc3OC2)CC1,VWDKYMHHRGVWMZ-UHFFFAOYSA-N,cdp2w11_b10_s3_w2e2ac3854-ee74-4c76-b759-e35e18395900,cdp2w11_b10_s3_w3db75e081-e5fe-42ce-a3fc-31e02af653e0,cdp2w11_b10_s3_w1597bfb0e-6aed-4114-b1b5-effe12823bf6,cdp2w11_b10_s3_w5b6267f43-8886-4fd4-afce-f733362e103c,cdp2w11_b10_s3_w4ce5048e6-359e-46d5-8895-11f8d4763467,63,7987
1765,30776.0,25665-F04-6,BRD-K40218785-001-05-5,25665,F04,6,SA1856640,BRD-K40218785,BROAD_CPD_ID,Fc1ccc(cc1)-c1nnc(o1)-c1ccc(Cl)cc1,VWMVJTUMOMXODY-UHFFFAOYSA-N,cdp2w12_f04_s6_w228d528b6-327a-40ea-a7f9-2e95b9fca804,cdp2w12_f04_s6_w3264f5c1f-58d0-40df-88f6-998d31493054,cdp2w12_f04_s6_w184f299b3-ff8a-47f7-a836-f4f4844f6ab7,cdp2w12_f04_s6_w581f3b597-f178-4efc-94cd-5d1a21629901,cdp2w12_f04_s6_w454f81e8c-94bf-45c1-bcfd-6646526f7761,66,8452
1766,24392.0,25581-L16-6,BRD-K83659333-001-05-5,25581,L16,6,SA1852804,BRD-K83659333,BROAD_CPD_ID,Cc1nc(NCc2ccco2)c2c3CCCc3sc2n1,VWSFKHFDPRSPLA-UHFFFAOYSA-N,cdp2w11_l16_s6_w24db4a546-1e55-4457-b916-fc03d177b7ae,cdp2w11_l16_s6_w35bb5158a-0148-45e3-8a60-88b1388019ce,cdp2w11_l16_s6_w187773c53-142c-45a0-850a-c83ad905a655,cdp2w11_l16_s6_w5f3ce9ad5-e31f-41af-b3c8-41484e329d86,cdp2w11_l16_s6_w413d2dabb-5250-4f71-97de-3ee7a9b443d8,59,8644
1767,13576.0,25416-D19-2,BRD-K77732949-001-05-4,25416,D19,2,SA1859429,BRD-K77732949,BROAD_CPD_ID,Clc1ccc2c(NCc3ccco3)ncnc2c1,VWTCONAFMPUDRV-UHFFFAOYSA-N,cdp2w10_d19_s2_w2106bf3d0-b62e-4c35-9b25-b44a23d645aa,cdp2w10_d19_s2_w312d918c7-783f-4d42-a61f-40d8aa1226ec,cdp2w10_d19_s2_w1c5b57d87-e938-46f1-981e-886d92f1ad35,cdp2w10_d19_s2_w536eeee76-097a-4a09-ba87-bbfa190d2654,cdp2w10_d19_s2_w4251ad6d2-b3fb-4782-9277-9a51a1efffb6,46,1528
1768,37202.0,25707-L15-6,BRD-A64728896-001-05-2,25707,L15,6,SA1861679,BRD-A64728896,BROAD_CPD_ID,COc1ccccc1CNC(=O)C(C)NS(=O)(=O)c1ccccc1,VXPWJDQRTSEQBX-UHFFFAOYSA-N,cdp2w12_l15_s6_w2582b177d-622d-4e20-922d-6f44702ca3a2,cdp2w12_l15_s6_w3d19db23b-c8fb-4f49-b1e6-4288936f5282,cdp2w12_l15_s6_w1f5032e8e-817e-44d4-8609-ef4acea0addb,cdp2w12_l15_s6_w5dadea431-24ae-41a8-b51d-b91c9499c2a2,cdp2w12_l15_s6_w478cc24ec-bac4-4ad8-a3dd-f5f37d92209d,63,6291
1769,32919.0,25679-G15-1,BRD-A31192417-001-11-9,25679,G15,1,SA1857168,BRD-A31192417,BROAD_CPD_ID,OC(=O)C1CSC(N1)c1ccco1,VYGBVPOHBURDGB-UHFFFAOYSA-N,cdp2w12_g15_s1_w2f965e157-b453-43b8-b41b-25e14ccf5707,cdp2w12_g15_s1_w3425df12b-6744-4bb7-9347-338948e1e28d,cdp2w12_g15_s1_w1b56d8011-768f-415c-8811-c0d9b2da85e3,cdp2w12_g15_s1_w552733c79-0a31-4bae-bf43-b7c892238bee,cdp2w12_g15_s1_w4a1e871c4-e4fc-416a-a4d2-2452e0d6e7ad,60,2583
1770,36406.0,25700-F15-2,BRD-K66102950-001-05-9,25700,F15,2,SA1858051,BRD-K66102950,BROAD_CPD_ID,CCNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1,VYGXGDJJDIBRJI-UHFFFAOYSA-N,cdp2w12_f15_s2_w27e607ff0-ccee-4a51-8085-2de7df399343,cdp2w12_f15_s2_w3ad960d2c-7d36-41e5-91fe-6842911f29f3,cdp2w12_f15_s2_w1bf9e951d-0d7c-4e58-9b6b-939358913463,cdp2w12_f15_s2_w5a11ab945-54b2-4997-81b6-876cf1cd3dd8,cdp2w12_f15_s2_w4f6ee3cc7-d12e-4fb3-9278-b8595ee95a38,57,5459
1771,50992.0,26140-M04-2,BRD-K97921950-001-04-8,26140,M04,2,SA1855850,BRD-K97921950,BROAD_CPD_ID,COc1ccc(CCNc2oc(COc3ccccc3F)nc2C#N)cc1OC,VZRIPUUFFWSBSB-UHFFFAOYSA-N,cdp2w9x2_m04_s2_w2291534fa-e2c2-412a-a109-331b5386a712,cdp2w9x2_m04_s2_w3c673c4e1-193f-41bb-b86a-9ce3a3267895,cdp2w9x2_m04_s2_w19e6a810a-ab31-4a88-aa14-757beacad0fa,cdp2w9x2_m04_s2_w5266350de-c638-4ca3-b002-e6186f2d7ec4,cdp2w9x2_m04_s2_w42eb4f7fd-8119-4ca5-a9e7-3bf9e97702f5,69,4295
1772,48390.0,26118-A08-4,BRD-A41298308-001-04-9,26118,A08,4,SA1860743,BRD-A41298308,BROAD_CPD_ID,C(Oc1ccccc1)c1nnc2sc(nn12)C1COc2ccccc2O1,VZTALPISVQFMIG-UHFFFAOYSA-N,cdp2w9x2_a08_s4_w28665d4de-e3f0-436e-ad7c-a28fc7f0d7e1,cdp2w9x2_a08_s4_w365121a27-a5b0-4215-8b49-efad88c82827,cdp2w9x2_a08_s4_w1cc151c33-eda2-4ff9-9f02-a8e2d5282ef4,cdp2w9x2_a08_s4_w5259e3670-f260-44a8-9ec1-2994a4bafcb0,cdp2w9x2_a08_s4_w4a198ef4e-41d9-43f0-b301-b6690544654e,61,6156
1773,40275.0,25945-H22-1,BRD-A69950438-001-01-1,25945,H22,1,SA27148,canadine,primary-common,COc1ccc2CC3N(CCc4cc5OCOc5cc34)Cc2c1OC,VZTUIEROBZXUFA-UHFFFAOYSA-N,cdp2w8x2_h22_s1_w2d33d5308-fb91-4f09-a12b-4639380a73c6,cdp2w8x2_h22_s1_w346fd4948-d5ec-46b4-b63d-435087ceba4f,cdp2w8x2_h22_s1_w18c9b7b28-a0ac-4085-9856-72b5a95f4d52,cdp2w8x2_h22_s1_w571f7304f-d414-4efb-bdf1-cb05851e9828,cdp2w8x2_h22_s1_w4c1dc4f21-de2c-42d0-92cc-dd21575a35f3,34,153
1774,28279.0,25605-D11-5,BRD-K49413990-001-11-2,25605,D11,5,SA1853942,BRD-K49413990,BROAD_CPD_ID,Cc1cc(OCC(=O)C(C)(C)C)c2c(C)c(C)c(=O)oc2c1,WADWDCTUKOOASN-UHFFFAOYSA-N,cdp2w11-au00029692_d11_s5_w26f8f6be0-5279-42c3-bbdf-808ce84703a8,cdp2w11-au00029692_d11_s5_w3d8d177a9-3059-4223-9ee0-5f4598d30b44,cdp2w11-au00029692_d11_s5_w157f05a2c-86ae-4019-a5d3-6301cc465a5d,cdp2w11-au00029692_d11_s5_w54b2f8641-6786-4f5a-86f1-9748856058ac,cdp2w11-au00029692_d11_s5_w422449b11-d094-4707-8263-2defdca4fa30,65,3181
1775,55579.0,26607-F13-5,BRD-K24156533-001-01-1,26607,F13,5,SA929879,BRD-K24156533,BROAD_CPD_ID,COc1ccccc1NC(=O)N[C@@H]1C=C[C@H](CC(=O)N[C@H](C)c2ccccc2)O[C@H]1CO,WADXMENNSPGANR-ZLLBNUPZSA-N,cdp2w7x2_f13_s5_w2ac121b4f-a89e-4c08-a25f-9da023532a2d,cdp2w7x2_f13_s5_w3f0d8bfaf-3d96-40fe-9599-43bdd492828c,cdp2w7x2_f13_s5_w1ba6a7002-734d-487e-b7d8-b70fc0f5e3bf,cdp2w7x2_f13_s5_w5a3399844-4e27-4edc-8525-3175565592de,cdp2w7x2_f13_s5_w4ae0b0cea-2c16-4a3e-bca8-40da0cf54aa7,79,10119
1776,54059.0,26224-H02-3,BRD-K88544581-001-01-2,26224,H02,3,SA792770,CI-976,common,CCCCCCCCCCC(C)(C)C(=O)Nc1c(OC)cc(OC)cc1OC,WAFNZAURAWBNDZ-UHFFFAOYSA-N,cdp2w9x2_h02_s3_w2d39af217-e62b-42bf-910e-429e376f3cd4,cdp2w9x2_h02_s3_w3d6c793ae-856e-4099-b20d-00a93daca651,cdp2w9x2_h02_s3_w1cc1a2a87-ec5c-4756-ae4f-b6a3874ccfb3,cdp2w9x2_h02_s3_w5a9b62904-db31-4d59-81d7-aba46a5ff778,cdp2w9x2_h02_s3_w457164c35-bd52-40dd-b5dd-c136ae219a05,46,331
1777,46518.0,26071-B11-4,BRD-A25993094-001-05-0,26071,B11,4,SA1858252,BRD-A25993094,BROAD_CPD_ID,COCCNC(=O)C(N(C(=O)Cn1nnc2ccccc12)c1cccnc1)c1ccc(Cl)cc1,WAURPAZAKAXOIR-UHFFFAOYSA-N,cdp2w9x2_b11_s4_w25e27079a-e6cd-4529-87aa-d651da2f44bf,cdp2w9x2_b11_s4_w3e703b396-03ad-48e1-b926-ab93e9d6dc28,cdp2w9x2_b11_s4_w14650b260-3932-49dc-884d-b1eda4eb957b,cdp2w9x2_b11_s4_w523eb283a-a836-407a-9088-8a388ec5ded8,cdp2w9x2_b11_s4_w4e9adf633-b502-4aa2-9243-96539e44206c,83,6969
1778,40559.0,25955-B20-3,BRD-K01624546-001-02-8,25955,B20,3,SA81992,DOCOSATRIENOIC ACID (22:3 n-3),to-be-curated,CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCC(O)=O,WBBQTNCISCKUMU-PDBXOOCHSA-N,cdp2w8x2_b20_s3_w232c2a253-c093-4b41-bb95-d630fcc69fbb,cdp2w8x2_b20_s3_w3c484d6a9-a95c-4c49-baab-c3296ef0c3d1,cdp2w8x2_b20_s3_w14bcf3a25-942f-49ed-89c6-690695f23141,cdp2w8x2_b20_s3_w5bee25f13-7d7b-44ee-a413-b836b99cc7e0,cdp2w8x2_b20_s3_w405767a0b-3708-4c66-90a4-866eb144a83d,28,7018
1779,50765.0,26140-C08-3,BRD-K44426506-001-05-8,26140,C08,3,SA1853575,BRD-K44426506,BROAD_CPD_ID,Cc1ccc(cc1)-n1nc2cc(C)c(NC(=O)c3cccnc3)cc2n1,WBWNVYGBLGETIH-UHFFFAOYSA-N,cdp2w9x2_c08_s3_w2ad8b1c5f-aa83-4311-9910-a02a68bdea3f,cdp2w9x2_c08_s3_w327470763-e84a-417c-a906-89b21967fdd5,cdp2w9x2_c08_s3_w1c3cf4d6c-af9a-4e77-9aa7-b3036dbff263,cdp2w9x2_c08_s3_w55a071364-8fea-4af8-8207-695a50134092,cdp2w9x2_c08_s3_w4fd3d46de-4ab1-4dd7-842f-1359ddb3470c,52,3321
1780,24340.0,25581-I22-2,BRD-K42873364-001-05-4,25581,I22,2,SA1856419,BRD-K42873364,BROAD_CPD_ID,CCn1cc(C(=O)N2CCN(CC2)C2CCCCC2)c2cc(OC)c(OC)cc2c1=O,WCADNCMCYOUSPD-UHFFFAOYSA-N,cdp2w11_i22_s2_w2b8b36a2f-b73d-4c5a-87e5-bfa51da97c62,cdp2w11_i22_s2_w357b5dff0-eaa8-41e2-85a4-f473fe72325d,cdp2w11_i22_s2_w17e764c66-8e2b-46ed-8453-76dff1c6bbb7,cdp2w11_i22_s2_w58d93fadc-33f9-45fe-9a07-d719ecc3373c,cdp2w11_i22_s2_w480e14f35-7306-4a62-a458-989909589869,71,9407
1781,22919.0,25575-O21-3,BRD-K74329576-001-05-2,25575,O21,3,SA1859125,BRD-K74329576,BROAD_CPD_ID,O=C(NCc1cccnc1)c1cn(nc1-c1cccs1)-c1ccccc1,WCGGCAPGLNZRIM-UHFFFAOYSA-N,cdp2w11_o21_s3_w2a963f618-a6e3-4a55-91ef-3cc4d2f2e3b3,cdp2w11_o21_s3_w3dfa0bc07-23f9-470a-b955-8f6d216b0c1c,cdp2w11_o21_s3_w14a092181-1446-467d-afc9-5237e2d34286,cdp2w11_o21_s3_w515254357-343a-48bf-b13d-fbe1ed493bb2,cdp2w11_o21_s3_w443e7c0ad-fd63-4495-a657-a757802af5af,41,5956
1782,11578.0,25391-M19-2,BRD-K08773075-001-05-8,25391,M19,2,SA1858424,BRD-K08773075,BROAD_CPD_ID,CCCC(=O)Nc1ccc2oc(nc2c1)-c1cncc(Br)c1,WCGGEMRZKQQJKK-UHFFFAOYSA-N,cdp2w10_m19_s2_w270c30761-3e8f-4ddf-a119-33462a9cc543,cdp2w10_m19_s2_w34c4fa867-7ac7-44ce-b639-6ebfd3175122,cdp2w10_m19_s2_w1f74ea684-ba62-4804-a60a-2f9f579754cc,cdp2w10_m19_s2_w5d7c52616-cc24-44e7-b042-8399ffb5dc9d,cdp2w10_m19_s2_w4de518d44-a58c-4534-a5f7-d95f9c495986,63,6917
1783,12621.0,25408-E20-1,BRD-A55849588-001-05-0,25408,E20,1,SA1855306,BRD-A55849588,BROAD_CPD_ID,CCOC(=O)C1Cn2c(S1)nc1-c3ccccc3CC(C)(CC)c1c2=O,WCHYMZBLYFSEHW-UHFFFAOYSA-N,cdp2w10_e20_s1_w27a2994fb-b8bb-44e7-acfd-66f1a29d0513,cdp2w10_e20_s1_w38825e446-e35b-41c1-8738-3bc694c12add,cdp2w10_e20_s1_w11d4d7d8b-af66-4a4e-92bc-4acef4d24af2,cdp2w10_e20_s1_w505c5ea99-b506-4b2d-b2be-d93974951872,cdp2w10_e20_s1_w4dffec191-e647-40aa-ad30-c6ac2b2245a8,57,5373
1784,13515.0,25416-B17-1,BRD-A80267939-001-05-0,25416,B17,1,SA1858251,BRD-A80267939,BROAD_CPD_ID,CC(NC(=O)c1ccco1)C(=O)Nc1nc(cs1)-c1ccccn1,WCQJJOIGIVFMKQ-UHFFFAOYSA-N,cdp2w10_b17_s1_w24ce2a8f0-0258-4f65-bbfd-5be71054ae95,cdp2w10_b17_s1_w38103916c-05c6-41ef-b94b-0dd849756fc1,cdp2w10_b17_s1_w1ca0aef9d-cffa-4af0-9729-4f1be66d34b4,cdp2w10_b17_s1_w5a86ed9c3-33d3-4ca0-961b-edad7ca1aa86,cdp2w10_b17_s1_w4ede0db28-1ae3-4e77-aea0-dbf35028b8a2,26,4499
1785,14540.0,25422-N08-6,BRD-K87226979-001-06-6,25422,N08,6,SA1855205,BRD-K87226979,BROAD_CPD_ID,CCn1c2cc(C)c(cc2n(CC)c1=O)S(=O)(=O)Nc1ccccc1C,WCRQIQPTWOLLQK-UHFFFAOYSA-N,cdp2w10_n08_s6_w2b807a845-0cfa-40ce-8d39-6b8135c40ac4,cdp2w10_n08_s6_w369ae076a-424e-4e03-b8f5-398c2145000a,cdp2w10_n08_s6_w1fb99cf4a-9d8c-4831-a8c9-210580d56851,cdp2w10_n08_s6_w526667b6b-96b3-408f-8f67-0d07dff0f2dc,cdp2w10_n08_s6_w4cbe65963-bc1e-47f2-827a-27c9c8eb32ce,21,4445
1786,33321.0,25680-K04-1,BRD-A79149747-001-04-8,25680,K04,1,SA1861390,BRD-A79149747,BROAD_CPD_ID,CC(C)COC(=O)C1=C(C)N(C)C(=O)NC1c1ccccc1Cl,WCWVXPGDIKVTPC-UHFFFAOYSA-N,cdp2w12_k04_s1_w2086ede65-cf80-4f5a-9076-03177688625b,cdp2w12_k04_s1_w3eb7c4006-b674-44dd-bf3e-d2e6bcf5a147,cdp2w12_k04_s1_w16bcddede-04eb-4233-ab10-dc5ff6eae696,cdp2w12_k04_s1_w5330da476-c1f6-4a2b-a2b4-3564ad9b3f74,cdp2w12_k04_s1_w4c1bce299-e7e6-44a6-9336-53794377fce6,54,2418
1787,25735.0,25587-O19-5,BRD-A30348862-001-05-0,25587,O19,5,SA1856158,BRD-A30348862,BROAD_CPD_ID,CN(C)CCN(Cc1cc2cc3OCOc3cc2nc1O)C(S)=NCC1CCCO1,WDKMWWJAYFRUHV-UHFFFAOYSA-N,cdp2w11_o19_s5_w27a12785d-0bf2-4bae-bf6d-6b9dd1151cc3,cdp2w11_o19_s5_w333b60c53-618e-4d85-97d6-ce9d623dadd7,cdp2w11_o19_s5_w1ef934bed-e935-45d6-bdc7-3d059ec71a05,cdp2w11_o19_s5_w5d4545514-f33a-4548-ac99-9767c697170f,cdp2w11_o19_s5_w4120dce07-2f5c-47fa-8f03-234a1dba9b94,77,5041
1788,14851.0,25424-N13-5,BRD-K93059446-001-05-0,25424,N13,5,SA1858200,BRD-K93059446,BROAD_CPD_ID,SC1=NC(=NCN1c1ccc(Cl)cc1)c1ccccc1,WDLGORJQXRPGSB-UHFFFAOYSA-N,cdp2w10_n13_s5_w2f0f87734-f9f2-4139-a655-ee0738f793a4,cdp2w10_n13_s5_w3073b523c-4fbb-4c62-ac3f-88cd7563852d,cdp2w10_n13_s5_w139c6eac0-f3c6-4dcf-a1fe-80a894b2c1d2,cdp2w10_n13_s5_w51e98f522-b809-4d1a-8ed4-109dcedabe26,cdp2w10_n13_s5_w4f0bb5aab-524d-406e-8547-3475cfbf760b,37,4010
1789,35555.0,25692-G15-3,BRD-A29757134-001-05-7,25692,G15,3,SA1858515,BRD-A29757134,BROAD_CPD_ID,CC(N=C(S)Nc1cccc(c1)C(F)(F)F)C(C)(C)C,WDOSJUOKMFKKIP-UHFFFAOYSA-N,cdp2w12_g15_s3_w2975287b9-9233-4607-bc72-cafcf51ef408,cdp2w12_g15_s3_w3b4826ad0-9bf6-40e4-8909-1c9fa2dc19d8,cdp2w12_g15_s3_w1e32bc3ec-4dd6-4eb5-bcf1-076425d477b9,cdp2w12_g15_s3_w5de419ede-2f4c-42a4-ab63-b2c9a9e0b645,cdp2w12_g15_s3_w4907ee4d8-839b-49fd-b8d4-560b7080403c,83,6492
1790,18592.0,25492-G22-2,BRD-K46433551-001-05-6,25492,G22,2,SA1857621,BRD-K46433551,BROAD_CPD_ID,COC(=O)c1cc2c(C)c(C)c3ccccn3c2c1C(=O)OC,WEBZFFLTBUZLOY-UHFFFAOYSA-N,cdp2w10-au00024360_g22_s2_w2da42f3f4-778b-4a52-8e2d-e83c86850fda,cdp2w10-au00024360_g22_s2_w308618019-036b-4bc2-8b51-9899c667f82a,cdp2w10-au00024360_g22_s2_w1b87a854b-d54d-4d2e-8083-09ec8c4ab907,cdp2w10-au00024360_g22_s2_w596911249-9df2-45e4-9c0d-4b30b9f74533,cdp2w10-au00024360_g22_s2_w4a55c59ae-a23f-4bc0-bfec-c4ce3356fa9f,59,2231
1791,10227.0,25376-G21-1,BRD-K89568673-001-06-8,25376,G21,1,SA1861769,BRD-K89568673,BROAD_CPD_ID,CC\C(NNc1ccccc1)=C1\C(=O)NC(=O)N(C1=O)c1ccccc1,WEEBEFKOVKCSKD-FOCLMDBBSA-N,cdp2w10_g21_s1_w2e43f39e2-7105-44c0-8d2e-03762f184696,cdp2w10_g21_s1_w3c92fce01-c41a-405e-8ec0-f4d50aa7abb6,cdp2w10_g21_s1_w1c84a64ae-08fe-489a-b490-b1f977a8272b,cdp2w10_g21_s1_w5fa91a1e7-922a-4b13-af87-207901b0a8f0,cdp2w10_g21_s1_w401193abc-c5d6-4d61-a874-a4f59eecd526,51,7799
1792,37133.0,25707-I20-3,BRD-K20679253-001-05-5,25707,I20,3,SA1859049,BRD-K20679253,BROAD_CPD_ID,Cc1nc(NC(=O)COc2ccccc2)sc1C(=O)Nc1ccccc1,WEQYSAYUKCUIJQ-UHFFFAOYSA-N,cdp2w12_i20_s3_w2c00f0e18-d0c7-4157-b70e-87935b7cb2f1,cdp2w12_i20_s3_w3f8889469-8426-49f0-9146-d746b7a89283,cdp2w12_i20_s3_w1c8827711-af9b-46b6-8d19-d5eabe8d9388,cdp2w12_i20_s3_w57942a4e3-7f07-45ff-9dde-34562f94302f,cdp2w12_i20_s3_w4b9973b8e-b87e-43b6-a495-fe8d6c0af71c,75,4684
1793,21350.0,25569-P15-6,BRD-K39687892-001-08-8,25569,P15,6,SA1860597,BRD-K39687892,BROAD_CPD_ID,Fc1cccc(Nc2nc(nc3ccccc23)-c2ccncc2)c1,WEUMWAVTQBJRNN-UHFFFAOYSA-N,cdp2w11_p15_s6_w2ab77f0a8-45ea-4203-bca9-e67fb4d5c77f,cdp2w11_p15_s6_w36f7af609-7708-43eb-b4ca-c5b20d72c1cf,cdp2w11_p15_s6_w1c9ad7a80-3417-46d0-88a8-565d6f5b1f5f,cdp2w11_p15_s6_w5d88e520c-efcc-41cf-a969-150fdad71324,cdp2w11_p15_s6_w4a880f421-0ec5-40f3-827c-3e3d14d976c7,75,8405
1794,40028.0,25943-P22-6,BRD-A44448661-001-02-2,25943,P22,6,SA59663,pentobarbital,INN,CCCC(C)C1(CC)C(=O)NC(=O)NC1=O,WEXRUCMBJFQVBZ-UHFFFAOYSA-N,cdp2w8x2_p22_s6_w218a7dada-6842-405f-a856-4eb6060435fb,cdp2w8x2_p22_s6_w3b2be9feb-4150-42a1-ba89-cbb7fbeccc22,cdp2w8x2_p22_s6_w188aa9764-5866-4aaf-ae0c-bc3793f61358,cdp2w8x2_p22_s6_w55419888d-9c3d-4019-bbae-f8105b52601c,cdp2w8x2_p22_s6_w461bc7735-68f6-4d94-a158-2725b2116785,52,67
1795,22631.0,25575-A21-3,BRD-K08746927-001-05-4,25575,A21,3,SA1859523,BRD-K08746927,BROAD_CPD_ID,CCCC(=O)Nc1sc(C(=O)Nc2cccc(N)c2)c(C)c1C(=O)OC,WFNIXDMUVPMPSZ-UHFFFAOYSA-N,cdp2w11_a21_s3_w2bce18fef-2ca8-4f1d-837c-a014b1264af4,cdp2w11_a21_s3_w368d14cf0-6faf-4033-b958-3b319ac762e3,cdp2w11_a21_s3_w1a346a11d-aa89-47a3-aaf1-64cc123ed0e7,cdp2w11_a21_s3_w5b835935e-c73f-42fb-a387-4c0329fc379c,cdp2w11_a21_s3_w4e3b5384b-497d-4586-aec3-1b1aefe612a4,71,2204
1796,53064.0,26204-N15-4,BRD-K49061478-001-06-0,26204,N15,4,SA1859736,BRD-K49061478,BROAD_CPD_ID,OC(=O)c1cccc(NC2=Nc3cccc4cccc2c34)c1,WFWFLOQMEVXRRK-UHFFFAOYSA-N,cdp2w9x2-au00026617_n15_s4_w24fcc5005-7601-4a8c-894b-27733ee5c859,cdp2w9x2-au00026617_n15_s4_w3efc36c01-0bc1-4491-a520-f9be7255f909,cdp2w9x2-au00026617_n15_s4_w1a85d4c94-4ddd-4601-8e86-fd20b0c6304e,cdp2w9x2-au00026617_n15_s4_w50de2bf1e-a8b8-4d28-8b39-5c4dbd909502,cdp2w9x2-au00026617_n15_s4_w483c00fee-1435-460f-9d17-1cee934bf498,68,5642
1797,22189.0,25572-K12-5,BRD-K75328969-001-05-8,25572,K12,5,SA1860327,BRD-K75328969,BROAD_CPD_ID,Clc1ccc(NC(=S)N2CCCCC2)c(Cl)c1,WFWNEUHFWIIRIP-UHFFFAOYSA-N,cdp2w11_k12_s5_w28087da77-6fa5-469f-aeb2-bc246d898350,cdp2w11_k12_s5_w328ce1715-672a-4210-b1e0-f163cbef93aa,cdp2w11_k12_s5_w1767831f1-7590-4855-926d-2a2c04b71edf,cdp2w11_k12_s5_w507b03675-0240-4e35-93dd-0d44a118481e,cdp2w11_k12_s5_w47c227b64-cea9-499d-ae0d-d722ad2e0e2c,84,6905
1798,19154.0,25553-B19-6,BRD-K03978601-003-05-7,25553,B19,6,SA1856947,BRD-K03978601,BROAD_CPD_ID,CCN(CC)CCOc1ccc2nc(sc2c1)N(C)C,WGMYEOIMVYADRJ-UHFFFAOYSA-N,cdp2w11-au00029679_b19_s6_w2b2ebd8ba-3afd-4726-a946-19ac5e5dfb49,cdp2w11-au00029679_b19_s6_w317a7d02c-0b9c-49bd-aee4-4ec1a246d137,cdp2w11-au00029679_b19_s6_w1605f12fb-9c03-4428-92d2-12394981962d,cdp2w11-au00029679_b19_s6_w542b520db-20aa-4ca3-b1d2-dc676acb3764,cdp2w11-au00029679_b19_s6_w4caf8d851-b386-415e-aba4-4c50c814a48c,63,1337
1799,51811.0,26174-H17-5,BRD-K00877464-001-03-9,26174,H17,5,SA1859181,BRD-K00877464,BROAD_CPD_ID,O=C(Nc1ccc(cc1)S(=O)(=O)N1CCOCC1)c1ccc(CN2CCc3ccccc3C2)cc1,WGQPJPGVHXXIAT-UHFFFAOYSA-N,cdp2w9x2-au00026617_h17_s5_w2286d37f8-cf6c-4848-b5b9-0235ba1a782f,cdp2w9x2-au00026617_h17_s5_w3d0d169b8-f6f2-4fee-acd8-6f884e73eb0d,cdp2w9x2-au00026617_h17_s5_w149bc2103-05e2-4c93-8abf-fab9046e3ed8,cdp2w9x2-au00026617_h17_s5_w5ab206748-96e6-4475-8427-158370b788c5,cdp2w9x2-au00026617_h17_s5_w4e0e753f7-98ed-481e-af75-9df45274b780,48,4338
1800,28750.0,25638-N17-2,BRD-K76543697-001-05-0,25638,N17,2,SA1860614,BRD-K76543697,BROAD_CPD_ID,O=C(Nc1nccs1)C(=C\c1cccs1)\C#N,WGUFNWHDWQOIHD-SOFGYWHQSA-N,cdp2w12_n17_s2_w2281a7678-0f25-4be3-b633-c7513b3966ee,cdp2w12_n17_s2_w341ca7091-690c-4083-bbea-eb8fb69b6996,cdp2w12_n17_s2_w1eb17706f-88cc-47c5-9dd5-296557dc0df4,cdp2w12_n17_s2_w5ea775d0d-98ef-4043-a37c-ee737a37db44,cdp2w12_n17_s2_w4525a0b19-01e7-4c00-a25e-2bb03487098a,84,3050
1801,31625.0,25675-B19-3,BRD-K58481857-001-04-4,25675,B19,3,SA1857219,BRD-K58481857,BROAD_CPD_ID,CCOC(=O)c1oc2ccc(Br)cc2c1NC(=O)CN1CCN(C)CC1,WGXCYXOTZCPXPU-UHFFFAOYSA-N,cdp2w12_b19_s3_w25f86c2c8-e4e1-461d-b8f8-40d90dc03aca,cdp2w12_b19_s3_w32d4c4150-eadb-4515-b662-611187bf7ad3,cdp2w12_b19_s3_w17c45c65f-c9cb-42bd-9fa6-53f575ec4d13,cdp2w12_b19_s3_w52c9b1175-d682-41ff-806a-e8d3c984f36b,cdp2w12_b19_s3_w48e3f1084-c827-46cc-b10b-1293b79f914f,70,4945
1802,16799.0,25436-B13-3,BRD-K00119882-001-05-5,25436,B13,3,SA1860555,BRD-K00119882,BROAD_CPD_ID,CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1,WGZZKVRMBFIFGD-UHFFFAOYSA-N,cdp2w10_b13_s3_w24eb03f6c-db74-45e8-aaa7-c234d596337f,cdp2w10_b13_s3_w34e80f22b-5586-493c-9537-3eca40d9a824,cdp2w10_b13_s3_w17f01da55-70f1-4c16-aa99-37ace1bd4b69,cdp2w10_b13_s3_w5298070fc-b97e-4818-a1cb-7d855d812509,cdp2w10_b13_s3_w43c8c63d8-f8e7-4042-b630-b9b5d4d42e26,60,9350
1803,19828.0,25565-D11-2,BRD-K94872534-001-06-6,25565,D11,2,SA1856773,BRD-K94872534,BROAD_CPD_ID,COc1ccccc1CCNC1CCC(CC1)C(C)(C)C,WHIGUJZLRRODIW-UHFFFAOYSA-N,cdp2w11_d11_s2_w2e2fbe257-e8a6-4fda-b9b3-e2d4204c05e6,cdp2w11_d11_s2_w3ceaae32f-8468-4d1b-81d9-51dd2c2cda2a,cdp2w11_d11_s2_w12a65d414-07f2-4a2e-8411-23921261e38e,cdp2w11_d11_s2_w536ce37d8-4b85-475d-a773-34c8eadd1579,cdp2w11_d11_s2_w443f894d2-929c-4db4-bb95-de18856d4b3d,74,4422
1804,15072.0,25426-J06-4,BRD-K60277684-001-12-4,25426,J06,4,SA1854717,BRD-K60277684,BROAD_CPD_ID,CCN1C(=O)S\C(=C\c2c[nH]c3ccccc23)C1=O,WHLQDPQWTKIGLW-KPKJPENVSA-N,cdp2w10_j06_s4_w2d64728d5-448e-441a-9cca-41d39bf43ac9,cdp2w10_j06_s4_w3c01d95b4-8de7-4d69-a825-2a3435d1a69f,cdp2w10_j06_s4_w1ae401c3c-967c-448c-80ae-5583faf8f75e,cdp2w10_j06_s4_w5005559ea-f7cc-47cf-a8fd-08bede92a627,cdp2w10_j06_s4_w4a67cfaf8-cfd3-4d59-91ec-53c3edb13aa0,66,5603
1805,40195.0,25944-O08-5,BRD-A91699651-316-04-2,25944,O08,5,SA58221,chloroquine,INN,CCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12,WHTVZRBIWZFKQO-UHFFFAOYSA-N,cdp2w8x2_o08_s5_w299abe6aa-a798-419b-afaa-357e927a0671,cdp2w8x2_o08_s5_w36b11c184-4011-4e1f-ace9-5edc203ddc68,cdp2w8x2_o08_s5_w1fb9bdd93-5c9c-4fec-9bcc-b29799ad3696,cdp2w8x2_o08_s5_w50d6ef858-67f3-4647-9228-96760e059af9,cdp2w8x2_o08_s5_w486e27c6c-4d3d-4aaf-b227-9fd6a01a175b,28,124
1806,29665.0,25642-N13-5,BRD-K98731550-001-05-1,25642,N13,5,SA1854502,BRD-K98731550,BROAD_CPD_ID,CCc1ccc(cc1)C(=O)COC(=O)c1cccnc1Cl,WIHTVZXBANYSJS-UHFFFAOYSA-N,cdp2w12_n13_s5_w27f5d82b1-1de5-48d3-8224-90034d462105,cdp2w12_n13_s5_w34a1d3b2f-397a-4277-baea-4a945ce3693b,cdp2w12_n13_s5_w1703ee431-5a82-4be9-a5a8-2ab764c56468,cdp2w12_n13_s5_w5e5155727-40f3-46ae-b777-925d0afb1ff7,cdp2w12_n13_s5_w43f0cff07-4f56-406f-bb8b-024d8b41392a,75,1450
1807,27565.0,25598-D07-5,BRD-K08723967-001-06-2,25598,D07,5,SA1861117,BRD-K08723967,BROAD_CPD_ID,CN(c1cccc(NC(=O)COc2ccccc2)c1)S(C)(=O)=O,WIIXNBWAIWINKE-UHFFFAOYSA-N,cdp2w11_d07_s5_w2fa82bcf0-8421-4181-a02f-40584ff44f2b,cdp2w11_d07_s5_w36ad67072-9fc9-4b50-b57c-a5ef2719dbce,cdp2w11_d07_s5_w112cf8019-c6a0-4e44-ab9e-e9cb693f883c,cdp2w11_d07_s5_w5e8d8c6bd-64f6-4aa1-b0c1-7709ac4bd3bd,cdp2w11_d07_s5_w491f18c47-15b6-4881-8b0b-14f7a59c0b29,66,1819
1808,29484.0,25642-E17-4,BRD-A47615980-001-06-8,25642,E17,4,SA1852930,BRD-A47615980,BROAD_CPD_ID,COc1cc(cc(OC)c1OC(=O)N1CCOCC1)C1C(C#N)=C(N)OC2=C1C(=O)CCC2,WIKGFSQXRKPATH-UHFFFAOYSA-N,cdp2w12_e17_s4_w2f71582c9-0941-4350-9488-947d5bc18aca,cdp2w12_e17_s4_w336add4e1-c3b8-4cce-b209-615ce163a2d7,cdp2w12_e17_s4_w1336197c1-934c-4759-9817-8918060747f8,cdp2w12_e17_s4_w51103bcc6-233b-4f5e-8b90-f1b95d52c78e,cdp2w12_e17_s4_w40334f9d9-ca91-4ccc-b54b-821282e9f7a9,88,8435
1809,19974.0,25565-M03-4,BRD-K58108432-001-05-4,25565,M03,4,SA1860124,BRD-K58108432,BROAD_CPD_ID,O=C(COC(=O)c1cnccn1)Nc1ccc2OCOc2c1,WILPFGPWGSQYHR-UHFFFAOYSA-N,cdp2w11_m03_s4_w26b13106d-5ec6-4bd6-ad95-69cd998db520,cdp2w11_m03_s4_w3d19b9eff-3b73-42ce-bedc-a4a186a5802c,cdp2w11_m03_s4_w1e84bdbc4-1637-4a2c-8321-716a93513970,cdp2w11_m03_s4_w5984197bc-b219-40ee-9193-c38c2e35eab7,cdp2w11_m03_s4_w4ca5c9728-1204-4c57-aa05-77722e5bb213,72,2234
1810,9233.0,24736-O20-3,BRD-K95105171-001-02-7,24736,O20,3,SA666330,BRD-K95105171,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)Oc2cccc3ccccc23)OCc2cnnn2CCCC1=O,WIMCLPXWPPGBKL-UMEGOILYSA-N,cdp2w5_o20_s3_w223650dcc-9a37-448b-ad66-074a3f9bcc1b,cdp2w5_o20_s3_w375d756df-2563-47f2-bee1-f0f640457282,cdp2w5_o20_s3_w1f9463882-af5d-42ba-b27c-604ae54140e8,cdp2w5_o20_s3_w56c90dbd0-e873-447e-a236-b8bc15c5b653,cdp2w5_o20_s3_w400e1efd4-2478-4ce1-9b73-f1638730cb99,63,9893
1812,9257.0,24739-I18-3,BRD-K49676673-001-02-7,24739,I18,3,SA667119,BRD-K49676673,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc(cc2)N2CCCCC2)OCc2cnnn2CCCC1=O,WJAIMBKFVIKGAD-DRLORSAXSA-N,cdp2w5_i18_s3_w298ed59da-ad4a-48dd-b991-352cb41ee99b,cdp2w5_i18_s3_w319451f35-6e28-4565-9aa5-6ed88799f7f6,cdp2w5_i18_s3_w10f9838ab-134c-4f3f-a376-d16dfd4d9e6c,cdp2w5_i18_s3_w5f99fcf0d-1c58-4b75-a7cc-94bd2042f951,cdp2w5_i18_s3_w4b0a060aa-cfc6-49bd-9d1e-50f84c6f3cca,60,9942
1813,22112.0,25572-H09-6,BRD-A50921700-001-05-5,25572,H09,6,SA1861487,BRD-A50921700,BROAD_CPD_ID,CC(Oc1ccc(F)cc1F)C(=O)NN=C(S)NCC1CCCO1,WJKOSFMUFKSVNQ-UHFFFAOYSA-N,cdp2w11_h09_s6_w2be49d1df-44df-4ec2-870d-eee0d515b760,cdp2w11_h09_s6_w367740c7b-02d3-41e0-9e8e-d58388b60736,cdp2w11_h09_s6_w1391d7963-5224-4c25-8080-f80c2f89f57f,cdp2w11_h09_s6_w57a0084d0-b085-4f93-bfcb-e1b9224e91be,cdp2w11_h09_s6_w4ddaa3537-90d6-4e8c-ad74-32eb76e0a019,91,4289
1814,12123.0,25403-K21-1,BRD-A58898935-001-05-4,25403,K21,1,SA1861416,BRD-A58898935,BROAD_CPD_ID,CC(NC(=O)Nc1ccc(Cl)c(Cl)c1)C(N1CCOCC1)c1ccccc1,WJMIMXYRGJRXJX-UHFFFAOYSA-N,cdp2w10_k21_s1_w20fc7bf6e-a8a5-4b7c-bb66-c7f329d28edf,cdp2w10_k21_s1_w3201bc97c-9b87-40e5-91ca-a2b33ebff9d8,cdp2w10_k21_s1_w1d0a02f67-628f-43fb-9576-a3481d86c1d1,cdp2w10_k21_s1_w51aceb0d1-e292-4565-9c3e-839929c797fa,cdp2w10_k21_s1_w4ca1172da-a807-408d-9c41-31271c3a6a5f,51,8871
1815,18484.0,25492-D13-2,BRD-K16619620-001-05-3,25492,D13,2,SA1857717,BRD-K16619620,BROAD_CPD_ID,FC(F)(F)c1ccc(NC(=O)c2cc(nc3ccc(Br)cc23)-c2cccnc2)cc1,WJQVUVPLOIOXNA-UHFFFAOYSA-N,cdp2w10-au00024360_d13_s2_w2790e8ae9-d647-4b04-b771-d057122e08cd,cdp2w10-au00024360_d13_s2_w3ef30acde-03b1-415e-aede-47c6e42137d2,cdp2w10-au00024360_d13_s2_w1e1639eb3-df74-421f-956f-94d2964be860,cdp2w10-au00024360_d13_s2_w5bb495896-a4a8-424d-81e7-8b90cbd82723,cdp2w10-au00024360_d13_s2_w453aab410-c151-429c-9a2f-42b18b23ffa2,71,2072
1816,39049.0,25852-A04-5,BRD-K32559936-001-01-9,25852,A04,5,SA787369,BRD-K32559936,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,WKBGSUAXJVLQSN-KHCICDEESA-N,cdp2w6x2_a04_s5_w28d7cc287-37a4-4118-a731-afdeb068b60b,cdp2w6x2_a04_s5_w33ad3d888-131e-4c99-a8f2-7c8b21caf84f,cdp2w6x2_a04_s5_w10c8325a2-1238-4416-8acf-349e0bbbd753,cdp2w6x2_a04_s5_w5c68ffbf9-b850-49c7-b24d-07b7c912b57c,cdp2w6x2_a04_s5_w41f4f58d3-17ff-4595-a113-6c853dc92c8c,119,10224
1817,47693.0,26107-O14-3,BRD-K56384677-001-05-7,26107,O14,3,SA1858975,BRD-K56384677,BROAD_CPD_ID,COC(=O)c1cc2COc3ccc(F)cc3-c2s1,WKUSYBGGANBUCI-UHFFFAOYSA-N,cdp2w9x2_o14_s3_w25f011e09-e8f8-47a1-ad7d-924d043aed4a,cdp2w9x2_o14_s3_w32d372745-1d33-40c3-92a3-b5658694b2f0,cdp2w9x2_o14_s3_w1e3503404-037e-49d0-a347-2f5e7430b63b,cdp2w9x2_o14_s3_w5b96775fa-d90f-4bbf-841b-57f3a42a50a3,cdp2w9x2_o14_s3_w4b4512bb1-6233-4d92-9386-576dd7095ad4,35,3350
1818,17056.0,25436-O18-2,BRD-K18119614-001-05-0,25436,O18,2,SA1855655,BRD-K18119614,BROAD_CPD_ID,COc1ccc(cc1)C1(CCCC1)C(=O)Nc1nncs1,WKXOWZIRSJGNSU-UHFFFAOYSA-N,cdp2w10_o18_s2_w27eed2f05-66ef-44b3-9ce1-e71c1e907126,cdp2w10_o18_s2_w3501af4cc-ffbb-4cd3-a29b-7f071af1a0a9,cdp2w10_o18_s2_w1af131664-d124-4960-96b6-5d86fc13f16f,cdp2w10_o18_s2_w5b48e853c-b34e-4826-a357-f8623f18c73d,cdp2w10_o18_s2_w46f0e8353-041c-4a51-a676-3d8a54ffbd24,35,5058
1819,28269.0,25605-D07-1,BRD-K11205484-001-05-1,25605,D07,1,SA1853440,BRD-K11205484,BROAD_CPD_ID,[O-][N+](=O)c1cccc(c1)-c1nc2ccccc2c(=O)o1,WKYQIWUAPDQQRV-UHFFFAOYSA-N,cdp2w11-au00029692_d07_s1_w279890362-69fc-43cd-b01e-27db3f511186,cdp2w11-au00029692_d07_s1_w305e77b77-fa49-4ba6-b3db-c8ef564927d0,cdp2w11-au00029692_d07_s1_w194e44067-f5c1-4e27-bb09-db3ee9e851a7,cdp2w11-au00029692_d07_s1_w5b6b953b4-ce1f-49f6-8649-19f6a54075d7,cdp2w11-au00029692_d07_s1_w4014d50a1-8fb6-4c45-bcbe-6284754d6865,68,863
1820,768.0,24279-K06-1,BRD-K92382976-001-01-4,24279,K06,1,SA82472,5-carboxamidotryptamine,primary-common,NCCc1c[nH]c2ccc(cc12)C(N)=O,WKZLNEWVIAGNAW-UHFFFAOYSA-N,cdp2bioactives_k06_s1_w2ee423705-f0c5-487f-b317-7a4bc5d09fde,cdp2bioactives_k06_s1_w39d51bf2d-c82b-459a-a96a-e852d26f45c5,cdp2bioactives_k06_s1_w131f9a4cb-8d47-49af-8dcc-b54c2aa515b1,cdp2bioactives_k06_s1_w5c8b73c46-d16b-48b3-bef9-5522b7fe0041,cdp2bioactives_k06_s1_w4dae5b49f-e8ba-46e5-8691-42a1063d1cc9,118,264
1821,52284.0,26202-B15-4,BRD-K76188740-001-07-7,26202,B15,4,SA1854379,BRD-K76188740,BROAD_CPD_ID,[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)-c1nc2nc3ccccc3nc2n1CCc1ccccc1,WLAPZCBPXKAQTR-UHFFFAOYSA-N,cdp2w9x2-au00026617_b15_s4_w246c47aa4-ab3f-47d5-8b52-7a334319c4d4,cdp2w9x2-au00026617_b15_s4_w30122d532-06f4-47d9-8c38-c60354e8716c,cdp2w9x2-au00026617_b15_s4_w1d501cf96-b8da-4cae-b2da-a43b1931970e,cdp2w9x2-au00026617_b15_s4_w5d4d419a9-273e-4266-9081-2cb75bb1c83c,cdp2w9x2-au00026617_b15_s4_w4ea63a5a2-fdfe-40fc-8fce-0b36b41047fc,20,9109
1822,10345.0,25376-O16-5,BRD-K13679039-001-07-1,25376,O16,5,SA1853656,BRD-K13679039,BROAD_CPD_ID,FC(F)(F)c1cccc(c1)N1C(=O)c2cccc3c(ccc(C1=O)c23)C(=O)N1CCN(Cc2ccccc2)CC1,WLFBEAMGIJRBPQ-UHFFFAOYSA-N,cdp2w10_o16_s5_w20df75217-bdc4-476d-87c9-3bf0725aafc8,cdp2w10_o16_s5_w38061a3a3-7b3d-4526-9171-54b44d066717,cdp2w10_o16_s5_w1739b5c69-bfb6-4b9c-aab0-df0d1d1a7163,cdp2w10_o16_s5_w523857738-163f-4789-903b-c4b6ff7c2ca9,cdp2w10_o16_s5_w494f26202-c6fb-40d5-9ed4-d1262db19141,25,8942
1823,38864.0,25738-N10-6,BRD-K30133833-001-05-0,25738,N10,6,SA1854037,BRD-K30133833,BROAD_CPD_ID,Clc1ccc(NC(=O)c2ccc(Br)o2)c(Cl)c1,WLGDEQDNCRILHR-UHFFFAOYSA-N,cdp2w12_n10_s6_w21a097c83-90ff-4e09-8ce4-6eba5820c0f0,cdp2w12_n10_s6_w32f4161ef-09b6-487b-ace9-d7ec9baaa921,cdp2w12_n10_s6_w194b6f22d-0bbc-4667-800a-675b090fd271,cdp2w12_n10_s6_w503750092-3a2f-4bd1-a30c-924bc850a53f,cdp2w12_n10_s6_w4f1a69445-1659-4dea-ac53-a43675881634,52,4719
1824,26105.0,25590-F14-3,BRD-K09302236-001-05-1,25590,F14,3,SA1860242,"1-(4-amino-3-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}thieno[2,3-c]isothiazol-5-yl)-1-ethanone",to-be-curated,CC(=O)c1sc2nsc(SCCN3CCCC3)c2c1N,WLGMOXHXQGODFR-UHFFFAOYSA-N,cdp2w11_f14_s3_w27944c2d9-2519-4e17-ba58-e9492c2ba4bb,cdp2w11_f14_s3_w3cb5ce105-7ec9-4cd8-8ca7-11748f47be32,cdp2w11_f14_s3_w1fd58ca43-508a-4fd0-845d-7638a2ea26af,cdp2w11_f14_s3_w50036d41e-8f71-44ca-8444-5745b6ed0560,cdp2w11_f14_s3_w48a9fcf7e-473f-416e-af31-0c1523759a7b,60,4572
1825,21504.0,25570-I09-4,BRD-K58726840-001-05-9,25570,I09,4,SA1852754,BRD-K58726840,BROAD_CPD_ID,COC(=O)c1ccc(NC(=O)CN2CCN(CC2)c2ccc(Cl)cc2)cc1,WLIODTVOCGVXFW-UHFFFAOYSA-N,cdp2w11_i09_s4_w2928fe0c1-8928-442e-9701-f17f3fef7768,cdp2w11_i09_s4_w34ca43c27-dc27-4af1-8e8d-20fc237af353,cdp2w11_i09_s4_w182852f18-90b0-498a-85ea-679921f38d75,cdp2w11_i09_s4_w5e3d5177b-7367-4faf-83ec-9b6ea2d11022,cdp2w11_i09_s4_w41f33820a-02d3-4b32-bb95-f66e87d6d792,65,4229
1826,50773.0,26140-C14-5,BRD-K22418614-001-06-8,26140,C14,5,SA1857508,BRD-K22418614,BROAD_CPD_ID,O=C(COC(=O)Cc1cn2ccsc2n1)Nc1nc2ccccc2s1,WMAPLAQDQVQJKH-UHFFFAOYSA-N,cdp2w9x2_c14_s5_w2672b082d-9846-4e31-bc39-1cd5f746394f,cdp2w9x2_c14_s5_w34ba84565-ea46-43bb-b69c-ed9113afb97e,cdp2w9x2_c14_s5_w17f4ee725-be6e-4d5d-8e9c-3cb9318fbab9,cdp2w9x2_c14_s5_w5a4a8b33b-0d43-4d3d-b447-34192429266b,cdp2w9x2_c14_s5_w490ddb1a4-c737-498c-9877-7c8de63105b5,15,5150
1827,53539.0,26207-I04-5,BRD-K03505622-001-06-5,26207,I04,5,SA1857395,BRD-K03505622,BROAD_CPD_ID,[O-][N+](=O)c1ccc2c(OCc3nnc(o3)-c3ccccc3Br)ncnc2c1,WMBXXLUVJAZNPC-UHFFFAOYSA-N,cdp2w9x2-au00026617_i04_s5_w231e12662-2e08-4f2e-bea7-dcbd83fdca17,cdp2w9x2-au00026617_i04_s5_w39acd24cf-3b78-498c-8482-6c99a568aca9,cdp2w9x2-au00026617_i04_s5_w16133b773-c868-418c-ab30-1c8ac50c8a9d,cdp2w9x2-au00026617_i04_s5_w5e508a8ab-97ba-46ec-82f7-154fdc026ba8,cdp2w9x2-au00026617_i04_s5_w4b1a6854d-1de1-45e7-9c9a-3dc635d02e7d,66,5764
1828,29934.0,25643-K11-4,BRD-A05717240-001-05-0,25643,K11,4,SA1857382,BRD-A05717240,BROAD_CPD_ID,CCc1ccc(cc1)-c1ccc(SCC(=O)NCC2CCCO2)nn1,WMEDXYJJTCMFFP-UHFFFAOYSA-N,cdp2w12_k11_s4_w2133a63c4-00e1-452b-bdc2-468f44909a18,cdp2w12_k11_s4_w3ec45483a-e07b-4b2c-872d-6ff7ee314981,cdp2w12_k11_s4_w15372bf16-1825-4d0c-aaca-18364bd503ba,cdp2w12_k11_s4_w57b4e4911-dc95-4d07-b665-27c1076ecba5,cdp2w12_k11_s4_w4dddb5591-3029-441a-a8d6-b0aba8e01622,92,6554
1829,22191.0,25572-K17-1,BRD-K26813487-001-05-2,25572,K17,1,SA1858753,BRD-K26813487,BROAD_CPD_ID,COc1ccc(cc1)-c1nnc(o1)-c1cccnc1,WMIQKYZPVJCIPR-UHFFFAOYSA-N,cdp2w11_k17_s1_w22bfcaf54-b193-4190-8c67-4dfe8793e2b6,cdp2w11_k17_s1_w3b36d0778-6901-4f77-bf06-2787342130b9,cdp2w11_k17_s1_w193e4bcf0-dc5f-4245-9720-7ca66ef624a2,cdp2w11_k17_s1_w5353ad501-4b42-434f-bece-f8ab5a85ce03,cdp2w11_k17_s1_w410b1181d-ba2d-4d3d-b898-71fe24b381aa,72,3688
1830,22854.0,25575-M06-4,BRD-K87311322-001-05-2,25575,M06,4,SA1857815,BRD-K87311322,BROAD_CPD_ID,NNC(=O)c1ccc2[nH]c3CCCCc3c2c1,WMOBXLDPECZNAT-UHFFFAOYSA-N,cdp2w11_m06_s4_w21c2d6801-cc07-498e-8313-235d51628d3d,cdp2w11_m06_s4_w3bc6295a6-9528-4382-8827-4c90f84ac0e4,cdp2w11_m06_s4_w1a80341e4-68e2-469f-bd4b-723f5ef488d2,cdp2w11_m06_s4_w52d791917-2f99-4d3d-89ca-c72fc5328605,cdp2w11_m06_s4_w4b68fb3b4-4140-4357-9d3e-5ffa94c4e107,56,8700
1831,27171.0,25594-B04-1,BRD-K77490065-001-05-7,25594,B04,1,SA1852827,BRD-K77490065,BROAD_CPD_ID,CCCCN=C(S)Nc1ccc(Oc2ccccc2)cc1,WMUMMRQASOQEKE-UHFFFAOYSA-N,cdp2w11_b04_s1_w2814c4c9c-9702-4cc2-a5c9-24507987b8f5,cdp2w11_b04_s1_w3f073b6a6-9002-4a82-b258-dbbc8f79337e,cdp2w11_b04_s1_w17eac2087-f64e-416a-8196-c5f9955b313e,cdp2w11_b04_s1_w5bc2b5f39-4780-4fb6-abb9-b9879effbe4c,cdp2w11_b04_s1_w4d98b4e2f-b954-4462-8b30-507e3d538529,52,4772
1832,44856.0,25990-E07-4,BRD-K63979671-001-03-6,25990,E07,4,SA83392,etifenin,INN,CCc1cccc(CC)c1NC(=O)CN(CC(O)=O)CC(O)=O,WNIDXAKKFOKNEF-UHFFFAOYSA-N,cdp2w8x2_e07_s4_w23b823fb9-7e21-44e7-8b64-4cf502cf841a,cdp2w8x2_e07_s4_w378927339-e9cb-46e3-81fa-e6dc296170fc,cdp2w8x2_e07_s4_w1e10fde35-2eb1-4daf-98a6-96a45de25a06,cdp2w8x2_e07_s4_w5e229768c-81db-40c4-a734-9554eddafef4,cdp2w8x2_e07_s4_w400ae9764-3839-495a-aa95-65e1a51302e6,65,2048
1833,15213.0,25428-A06-1,BRD-A91937838-001-06-5,25428,A06,1,SA1859102,BRD-A91937838,BROAD_CPD_ID,CN1CC(c2ccccc2)C2(SC(=S)N(Cc3ccco3)C2=O)C11C(=O)Nc2ccccc12,WNNPRGGVTYMKOL-UHFFFAOYSA-N,cdp2w10_a06_s1_w24161cf2d-df95-4a54-813c-63ba2c68c36e,cdp2w10_a06_s1_w3d6dc7a87-644e-4497-8db1-045bc0921ac2,cdp2w10_a06_s1_w1c3774444-3b42-4ebc-bec1-d15bf9560685,cdp2w10_a06_s1_w5ad6055aa-27e2-4a1f-817b-aa82e2132071,cdp2w10_a06_s1_w4fe2666ee-dd55-42f1-8b02-b96ee29984e7,42,7716
1834,14092.0,25420-E13-2,BRD-A43658783-001-05-3,25420,E13,2,SA1856599,BRD-A43658783,BROAD_CPD_ID,CC(OC(=O)c1cc2sccc2n1C)C(=O)NCCc1ccccc1,WNQHXXVAJMZPFF-UHFFFAOYSA-N,cdp2w10_e13_s2_w25ad58023-8fe6-419c-a307-430ac06624dd,cdp2w10_e13_s2_w35df1f414-e5bc-4814-8699-862ea92e1af1,cdp2w10_e13_s2_w1db16799a-2891-463c-ae0e-e70f91e44e16,cdp2w10_e13_s2_w57efb84b5-9c00-4173-a5ad-a9e1c48fbf21,cdp2w10_e13_s2_w44eec2ce0-5bbe-4f75-8c6e-8ac94cd32f33,68,6691
1835,35160.0,25689-P12-4,BRD-K11795918-001-05-7,25689,P12,4,SA1858112,BRD-K11795918,BROAD_CPD_ID,CS(=O)(=O)N1CCC(CC1)C(=O)N1CCOCC1,WNVPROALADAWPB-UHFFFAOYSA-N,cdp2w12_p12_s4_w22a860caf-78b8-4bbc-a445-d59328862333,cdp2w12_p12_s4_w38a3352b5-0abb-4dc6-a1db-562f143015e0,cdp2w12_p12_s4_w1b874ff8b-19c7-45d6-a33c-e23c1856d231,cdp2w12_p12_s4_w5e6c7d36f-7405-4b10-953f-9e37b60a6d57,cdp2w12_p12_s4_w4fb65e158-cee6-4e9c-a0ef-c7f7065863b5,92,10556
1836,9663.0,25372-B22-1,BRD-A93694989-001-05-9,25372,B22,1,SA1854880,BRD-A93694989,BROAD_CPD_ID,CC1=CN2C(C=C1)=NC(=O)CC2(C)C(=O)N(CC(=O)NC1CCCC1)c1ccccc1C,WNZNCZMJONTKTP-UHFFFAOYSA-N,cdp2w10_b22_s1_w2129cff11-18a4-4d32-bb20-e898091ab129,cdp2w10_b22_s1_w300dd85e6-315a-4d59-b9df-8653b124c846,cdp2w10_b22_s1_w10adf1657-d3fa-4293-9946-3d2b8d13d4e3,cdp2w10_b22_s1_w5ae13375e-57cc-4c4b-8582-0e196a3f4628,cdp2w10_b22_s1_w464a35225-5705-4cc6-a9d7-bb0e5379a1f4,16,9345
1837,32809.0,25679-A12-5,BRD-K12123091-001-05-0,25679,A12,5,SA1859638,BRD-K12123091,BROAD_CPD_ID,Cc1nn(c(C)c1-c1nnc(o1)-c1c(C)nn(c1C)-c1ccccc1)-c1ccccc1,WOASUTLIZIBWDW-UHFFFAOYSA-N,cdp2w12_a12_s5_w28044142c-2e5b-4e86-9300-f5d9dce15eff,cdp2w12_a12_s5_w389f6a21b-0952-4abb-86a2-464d89609191,cdp2w12_a12_s5_w152f47d9c-afb5-4d13-b7f9-0d6add38eb54,cdp2w12_a12_s5_w5b730fd6e-fb30-40ef-85a9-31691006b0ca,cdp2w12_a12_s5_w4c39afef5-a96d-4aa7-955f-aea3727b9c43,90,8736
1838,20662.0,25567-M21-2,BRD-K84023600-001-05-9,25567,M21,2,SA1854780,BRD-K84023600,BROAD_CPD_ID,Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCOCC1)C(=O)Nc1ccc(C)c(C)c1,WOFAMZWZAGNJDE-UHFFFAOYSA-N,cdp2w11_m21_s2_w2e71cfb0b-df4a-419f-9d11-e4795a8b60dc,cdp2w11_m21_s2_w38851faa4-b5f3-4310-b7cb-abe36ab359fa,cdp2w11_m21_s2_w15f6b3cad-58b5-433a-89d0-1dac8653eb41,cdp2w11_m21_s2_w5c77c27ad-f87b-419e-8ad7-c08891ccb70f,cdp2w11_m21_s2_w4899648f0-475d-4d69-a72d-e71421a8429d,68,9190
1839,25612.0,25587-G09-2,BRD-K18942494-001-05-0,25587,G09,2,SA1853425,BRD-K18942494,BROAD_CPD_ID,COc1ccc(cc1)N1CCN(CC1)C(=O)CSc1nc2cc(OC)c(OC)cc2cc1C#N,WOJRATVIFYWXPQ-UHFFFAOYSA-N,cdp2w11_g09_s2_w283906dc6-ecc5-40dd-8509-e8bce85f3d2a,cdp2w11_g09_s2_w33136730b-4b4f-43af-8a9e-500b0ff52c70,cdp2w11_g09_s2_w12fc53ec4-3608-4d9c-b0c9-d0a9c84acddc,cdp2w11_g09_s2_w5560e7f74-6296-4bdf-a985-0106cd804d54,cdp2w11_g09_s2_w476e42ac4-a473-47ba-bef3-6832f576b7fd,51,2375
1840,20346.0,25566-N06-4,BRD-A60306743-001-05-6,25566,N06,4,SA1858752,BRD-A60306743,BROAD_CPD_ID,Oc1nc2cc3OCCOc3cc2cc1CN(CC1CCCO1)S(=O)(=O)c1ccc(Cl)cc1,WOQBEMQFEMPSLJ-UHFFFAOYSA-N,cdp2w11_n06_s4_w28055ef1b-ea5c-4e9e-8ee5-55dc1843edd4,cdp2w11_n06_s4_w357742edb-d06b-4702-8f4e-4b86c11f1594,cdp2w11_n06_s4_w1827f8e77-deb4-430d-900a-b4b262ea1b95,cdp2w11_n06_s4_w5757a2c2f-88e2-4ade-bad9-12c31db46012,cdp2w11_n06_s4_w4bdf2f206-11c0-45b5-bd85-6f5d48a5cdb0,52,8959
1841,30427.0,25664-E06-5,BRD-K07068495-001-06-4,25664,E06,5,SA1856373,BRD-K07068495,BROAD_CPD_ID,Nc1ccc2C=Cc3ccccc3Oc2c1,WPLLFHWVTWVHAF-UHFFFAOYSA-N,cdp2w12_e06_s5_w27201ec31-1b00-4b4a-840e-904516631884,cdp2w12_e06_s5_w3e6f841ab-3e23-4e7a-bd10-e200021fc37e,cdp2w12_e06_s5_w133f7b9ae-5ed2-4129-994b-aa8946e7c741,cdp2w12_e06_s5_w5e0b1b430-f9c3-4407-afad-c9d883f831eb,cdp2w12_e06_s5_w4b52f2f6c-3317-489f-82e8-67c7fc8e8b39,61,6238
1842,32639.0,25678-I22-3,BRD-A86600680-001-05-7,25678,I22,3,SA1855772,BRD-A86600680,BROAD_CPD_ID,CN(C)C(CN=C(S)Nc1cccc(Cl)c1)c1ccccc1,WPWDZSOOCOBLJC-UHFFFAOYSA-N,cdp2w12_i22_s3_w243044f47-7a77-4d38-a1a9-4256abd7dea3,cdp2w12_i22_s3_w305cf2fb8-4cdf-4431-b241-0990f0c9bf41,cdp2w12_i22_s3_w17011d050-4d74-4300-9b22-af216c725d58,cdp2w12_i22_s3_w564c28de6-18cb-44b3-bc3f-2a76c7a52711,cdp2w12_i22_s3_w40dd95c16-00a7-423a-90ae-4f26ce12808a,58,4472
1843,49152.0,26126-B20-4,BRD-K13424486-001-05-4,26126,B20,4,SA1859196,BRD-K13424486,BROAD_CPD_ID,CCCCOc1nc2ccccc2c(=O)n1-c1ccccc1,WPWUMAZTBQXSIV-UHFFFAOYSA-N,cdp2w9x2_b20_s4_w2401f9cee-ea1c-4908-b674-ae96bdee9b4f,cdp2w9x2_b20_s4_w3fa2ff917-2991-45f9-94b6-6eadaaa33dcd,cdp2w9x2_b20_s4_w1665fa037-5f31-4963-bb79-3e44274bfe09,cdp2w9x2_b20_s4_w5bf97df3f-7763-41c2-acd7-01aeb0ca0619,cdp2w9x2_b20_s4_w429d3fb37-6378-4069-8ace-62cc84029a50,123,2954
1844,10004.0,25374-I22-6,BRD-A52775498-001-06-7,25374,I22,6,SA1859189,BRD-A52775498,BROAD_CPD_ID,COc1ccc(cc1OC)C(C)N=C(S)NC1CCCCC1,WQIFQWLLUTYTOX-UHFFFAOYSA-N,cdp2w10_i22_s6_w2b751e2d2-9377-42d4-b319-6e24a3f78e9f,cdp2w10_i22_s6_w39d971491-6f87-4fc4-b611-0acf0e0949e4,cdp2w10_i22_s6_w107206a58-6a80-4942-a1a2-e14958e73b62,cdp2w10_i22_s6_w5f5bfc5ed-5160-4651-8ab9-6680463d33b6,cdp2w10_i22_s6_w44c854968-cd2d-448b-99a3-f0008645adcc,47,2766
1845,52407.0,26202-K15-1,BRD-K26330968-001-06-3,26202,K15,1,SA1852494,BRD-K26330968,BROAD_CPD_ID,Oc1ccc2nc(oc(=O)c2c1)-c1ccc(cc1)[N+]([O-])=O,WQJHISQILHXRNW-UHFFFAOYSA-N,cdp2w9x2-au00026617_k15_s1_w2dad4b3b3-d419-4f61-99c9-fc653bc4d8a0,cdp2w9x2-au00026617_k15_s1_w36e9c7316-5263-4914-8035-7b921e0051af,cdp2w9x2-au00026617_k15_s1_w1338df0fe-072e-42b3-85bc-b5ba8390f1d7,cdp2w9x2-au00026617_k15_s1_w53f0da4a8-51f5-4055-997a-188136a73230,cdp2w9x2-au00026617_k15_s1_w474e0576c-5156-4a5f-a8f1-2d136afe0c8d,23,5887
1846,31701.0,25675-F08-1,BRD-K46758233-001-05-2,25675,F08,1,SA1861375,BRD-K46758233,BROAD_CPD_ID,CC(C)(C)c1cc(NC(=O)c2cccc(c2)[N+]([O-])=O)no1,WQPXBACBBSRAAI-UHFFFAOYSA-N,cdp2w12_f08_s1_w2461233cb-291d-4515-8c5f-e00d3eb112b3,cdp2w12_f08_s1_w3f410be2d-985c-4661-ae5b-8522171e535b,cdp2w12_f08_s1_w1fca1a30e-ca5f-4184-95b2-8306df33e9c8,cdp2w12_f08_s1_w521d4e66d-602a-4a88-b182-e0a68b19e128,cdp2w12_f08_s1_w4276eafcd-e647-418d-a5a3-90f305870b30,44,5687
1847,12055.0,25403-F21-5,BRD-K46932325-001-05-2,25403,F21,5,SA1858758,BRD-K46932325,BROAD_CPD_ID,FC(F)(F)c1cc(=O)n(nc1C(=O)c1ccccc1)-c1ccccc1,WQTJIKOELXSWGM-UHFFFAOYSA-N,cdp2w10_f21_s5_w29227e22d-48af-4f2e-a412-0f1e539865be,cdp2w10_f21_s5_w3a11e83a1-4e89-496d-a863-6ed873c93f39,cdp2w10_f21_s5_w1bce1c3e0-5184-49b1-b53c-f6b049932582,cdp2w10_f21_s5_w57e21f2c8-a8c4-46d8-88e2-83bd86984985,cdp2w10_f21_s5_w402c70d54-cddd-47a1-8ac8-4ad06fdeb879,26,2343
1848,11958.0,25403-B15-4,BRD-A54152388-001-05-2,25403,B15,4,SA1858763,BRD-A54152388,BROAD_CPD_ID,CCOC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccc(OC)c(OC)c1,WQUZEDLZKAXQDZ-UHFFFAOYSA-N,cdp2w10_b15_s4_w2393491a8-f245-4a36-8dc3-559813854c38,cdp2w10_b15_s4_w367b159ce-4577-4b3e-bf5b-a6401bf3695c,cdp2w10_b15_s4_w15b3f6b0c-79dc-429f-981d-525d91201d8c,cdp2w10_b15_s4_w549f60e10-f825-437f-a74d-a8514eb697eb,cdp2w10_b15_s4_w4238483a6-02c2-4850-993c-2402b8dc173c,35,1638
1849,17685.0,25485-M17-1,BRD-K26501704-001-06-8,25485,M17,1,SA1858528,BRD-K26501704,BROAD_CPD_ID,Cn1cc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)cn1,WQVVNESXOJZMTN-UHFFFAOYSA-N,cdp2w10-au00024355_m17_s1_w25950dfc6-8791-4bfa-8745-e5cc12f9ab79,cdp2w10-au00024355_m17_s1_w38188973c-b076-4dc1-9c6d-dfbc1cdd456a,cdp2w10-au00024355_m17_s1_w12114d169-d6e6-4e02-9537-1b1a611be0c9,cdp2w10-au00024355_m17_s1_w5ddfc1b67-df44-4f12-8165-9dd6612d6526,cdp2w10-au00024355_m17_s1_w419a9ebba-500d-4185-b06b-e868211ca2c8,34,4639
1850,21114.0,25569-E15-4,BRD-K82907505-001-05-1,25569,E15,4,SA1857695,BRD-K82907505,BROAD_CPD_ID,COc1ccc(cc1OC)C1(CCCC1)C(=O)NC(C)C,WRRAZMNKERJOCO-UHFFFAOYSA-N,cdp2w11_e15_s4_w2f18195a1-be4e-429f-b534-64d64e1a5a6a,cdp2w11_e15_s4_w32f5e43d1-a433-4969-a4fc-ae7f3268cf61,cdp2w11_e15_s4_w1bf773307-1b10-4722-8870-3d5ca64331d7,cdp2w11_e15_s4_w5d56defe9-fd0c-4c62-9102-415a3dcca7e4,cdp2w11_e15_s4_w4bd459d91-7508-4b8f-adbc-0464ec8b96ab,83,5921
1851,52740.0,26203-N04-4,BRD-K90689171-001-05-8,26203,N04,4,SA1860064,BRD-K90689171,BROAD_CPD_ID,COc1ccc(cc1OC)-n1nnnc1SCC(=O)Nc1ccc2OCCOc2c1,WRRGFFYTLWGXFT-UHFFFAOYSA-N,cdp2w9x2-au00026617_n04_s4_w2ad8636d2-cd5d-43da-b611-6511a86c44f5,cdp2w9x2-au00026617_n04_s4_w3fdc01468-5760-4750-9fb0-c27965125b07,cdp2w9x2-au00026617_n04_s4_w1fee29222-0b40-4cce-8a99-4c365797a96d,cdp2w9x2-au00026617_n04_s4_w55bece7fe-d7e8-4c0d-8ef4-f35e43ab3bb0,cdp2w9x2-au00026617_n04_s4_w48e40fc50-ae08-45d1-aece-5de66c837c7a,122,7981
1852,48347.0,26115-P13-3,BRD-K28979265-001-06-5,26115,P13,3,SA1855112,BRD-K28979265,BROAD_CPD_ID,CN(C)c1ncnc2SC3=C(CC(C)(C)CC3=Nc12)NCCCC(O)=O,WSFNMZBBWZWOCD-UHFFFAOYSA-N,cdp2w9x2_p13_s3_w294780d49-5c0a-4d3c-a931-6fafb18b22ed,cdp2w9x2_p13_s3_w32c2e82b3-a3f9-4b81-a142-9775e4ef0da8,cdp2w9x2_p13_s3_w1d523778d-2b33-4fa8-9f69-77df8a7beca7,cdp2w9x2_p13_s3_w57f4bfaf6-bc9e-4a4b-b281-1d70b1bf29ba,cdp2w9x2_p13_s3_w404d5824a-0772-4246-9b0f-068945bef7d0,58,7629
1853,13460.0,25414-O22-6,BRD-K95611884-001-05-5,25414,O22,6,SA1856771,BRD-K95611884,BROAD_CPD_ID,COc1cc(SC)ccc1C(=O)Nc1ncc(Cl)cc1Cl,WSHNWWOIVODKOD-UHFFFAOYSA-N,cdp2w10_o22_s6_w2baa42ca1-f30a-482a-8360-75a09f76ba8f,cdp2w10_o22_s6_w3bb4628ed-f001-409f-9b6a-d48d4333092b,cdp2w10_o22_s6_w132e5701e-3ca8-441b-be18-ce8bf507f517,cdp2w10_o22_s6_w5bbe469e7-62a1-464d-ad75-2b3cde64d411,cdp2w10_o22_s6_w45a0edf8f-cb5d-45d5-a662-f2378a2c09f8,45,4375
1854,7981.0,24602-F24-2,BRD-K60143275-001-01-6,24602,F24,2,SA796060,BRD-K60143275,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc3OCOc3c2)Oc2cc(Br)ccc2S1(=O)=O,WSJCKGXDVCNJDF-WJONJSRFSA-N,cdp2w3_f24_s2_w2cb4f0425-79af-4c1a-920d-f6b287267275,cdp2w3_f24_s2_w3d7c90462-4c1c-48ef-9bd1-b5ccd01a3047,cdp2w3_f24_s2_w1175cdafd-8e94-43a1-8093-76f8ceb89232,cdp2w3_f24_s2_w580058e05-840f-4802-849c-edcd3996644e,cdp2w3_f24_s2_w44c6710c9-c988-4422-92fa-075374191417,115,9677
1855,26934.0,25593-F20-4,BRD-A54769817-001-05-4,25593,F20,4,SA1854434,BRD-A54769817,BROAD_CPD_ID,CCOC(=O)C(C)Oc1ccccc1C1NC(=O)NC(C)=C1C(=O)Nc1ccc(C)c(C)c1,WSTFXSAIFZIREN-UHFFFAOYSA-N,cdp2w11_f20_s4_w283c21108-7ca8-407f-84a4-7fd7a7961b69,cdp2w11_f20_s4_w33d6e17a8-7879-4382-b278-3fca05974c27,cdp2w11_f20_s4_w163b16130-c306-4aeb-8c79-09f17a2c5bae,cdp2w11_f20_s4_w52f883f12-86b0-4a88-a702-f78164c74b03,cdp2w11_f20_s4_w474124e6c-e5f4-4835-bf54-58e1924dfe4a,58,7733
1856,50609.0,26138-K06-3,BRD-A53463743-001-06-2,26138,K06,3,SA1859659,BRD-A53463743,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)-c1nc(NCC2CCCO2)c2ccccc2n1,WSTYMFXGRCOWBC-UHFFFAOYSA-N,cdp2w9x2_k06_s3_w2077f2f31-5a2e-47fd-aacb-4701e4e60e50,cdp2w9x2_k06_s3_w362963ca6-2253-4688-87fe-e5a698b0a1a6,cdp2w9x2_k06_s3_w1d17bc073-96d5-4c79-8021-225f76c1d021,cdp2w9x2_k06_s3_w52beb22f1-4841-49f9-834b-096e2ccc8029,cdp2w9x2_k06_s3_w41e20500a-b346-464e-a66b-c44bd5f6f5ef,78,9503
1857,35907.0,25694-L06-1,BRD-K64422077-001-04-4,25694,L06,1,SA1861410,BRD-K64422077,BROAD_CPD_ID,Cc1nc(CC(=O)n2cc(cn2)C(=O)c2cc(C)ccc2O)cs1,WTAJHNPXWRFBGT-UHFFFAOYSA-N,cdp2w12_l06_s1_w23c6ec9ba-b94c-44be-9c73-9c45cb5e5a34,cdp2w12_l06_s1_w351f13cb1-a246-495c-aca3-2154b6df4217,cdp2w12_l06_s1_w1b9b7a267-fbd8-454a-aa21-b524b69dbf8f,cdp2w12_l06_s1_w5cc35f668-7e75-4500-add0-f79f290edd70,cdp2w12_l06_s1_w44657a594-a01f-40d6-a3b7-ed5a500da1cd,47,8382
1858,35416.0,25690-O08-2,BRD-K28709496-001-06-7,25690,O08,2,SA1860717,BRD-K28709496,BROAD_CPD_ID,Cc1ccc(cc1)-n1cc(CNCCCn2cccn2)c(n1)-c1cccc(C)c1,WTEOAHRLJGTWRZ-UHFFFAOYSA-N,cdp2w12_o08_s2_w231c09b8f-89ba-440c-8b34-eac8d80aacbc,cdp2w12_o08_s2_w30eeb348c-8b21-4666-8b24-25778b4592e4,cdp2w12_o08_s2_w18f033182-a483-41fd-80f5-fe27a1e0cb34,cdp2w12_o08_s2_w55f9e6f3a-eb99-4762-8cd1-bde271e70d92,cdp2w12_o08_s2_w4ba10a96f-35a5-4256-a5bc-bb33b0ba6fe4,0,9479
1859,34268.0,25686-E09-6,BRD-K68275232-001-05-1,25686,E09,6,SA1857533,BRD-K68275232,BROAD_CPD_ID,CCCSc1nnc(Cn2c3ccccc3sc2=O)n1-c1ccccc1,WTGJIGYDGCMYAE-UHFFFAOYSA-N,cdp2w12_e09_s6_w2052f1b26-0a3a-4a1f-8d52-78f2e7f4a3d3,cdp2w12_e09_s6_w3e31661f4-7c14-4ace-b796-f0f54b070e94,cdp2w12_e09_s6_w1961196b5-0218-4c30-bbf1-9637eef15aa4,cdp2w12_e09_s6_w5a5750b69-5347-4e7c-988e-cd0c4f68bbed,cdp2w12_e09_s6_w4af6fe211-0b4b-40d1-8da7-220d413dcd78,78,6322
1860,28502.0,25638-B08-6,BRD-A91461229-001-06-3,25638,B08,6,SA1857651,BRD-A91461229,BROAD_CPD_ID,OCc1nc2ccccc2n1CC(O)Cn1ccc2ccccc12,WTGSVBSOJQMRQK-UHFFFAOYSA-N,cdp2w12_b08_s6_w210d29bbf-8744-4e6e-b2bc-313d4dfabfd3,cdp2w12_b08_s6_w300c4aa80-19f6-4c75-9b2b-1dce202c7d1b,cdp2w12_b08_s6_w1e6418eec-5532-4b39-9247-6c93a8566855,cdp2w12_b08_s6_w52134933d-49f5-46cf-ae89-7d883fcd13c4,cdp2w12_b08_s6_w4a5377c2f-7514-4acb-b01d-236633c9bdb1,59,8401
1861,23815.0,25579-N21-5,BRD-K50835094-001-05-9,25579,N21,5,SA1856501,BRD-K50835094,BROAD_CPD_ID,CN(C)S(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc2[nH]c3CCCCc3c2c1,WTHZORIKKRRNKJ-UHFFFAOYSA-N,cdp2w11_n21_s5_w214803a88-acaf-4c60-8ad2-f1d7581183b8,cdp2w11_n21_s5_w33a2abd96-466e-44b0-8c04-1bfd18ff435d,cdp2w11_n21_s5_w19a141a4c-526a-41c1-a49f-26ccc46e3057,cdp2w11_n21_s5_w5c9ef770d-994c-435a-bee6-1f17541ceb37,cdp2w11_n21_s5_w4aff66a6a-7ae3-48e4-97c8-e02660a53d89,83,4558
1862,47956.0,26110-L13-2,BRD-A46566149-001-05-4,26110,L13,2,SA1858592,BRD-A46566149,BROAD_CPD_ID,CCOC(=O)c1ccc(NC2N(C(=O)c3ccccc23)c2cccnc2)cc1,WUNLPTYESRFQGA-UHFFFAOYSA-N,cdp2w9x2_l13_s2_w253a8382f-6783-43a7-a700-ebbafdddd194,cdp2w9x2_l13_s2_w3e236c991-e8af-4392-9fd6-5d0e822e259c,cdp2w9x2_l13_s2_w1a222435a-ae0f-42a5-a8a5-9348247089b9,cdp2w9x2_l13_s2_w561ec6da4-7ac6-471f-a044-8e16415888a0,cdp2w9x2_l13_s2_w459066ce4-5e35-497e-addf-5093c672ce88,58,7626
1863,52157.0,26181-L13-3,BRD-A40812237-001-05-1,26181,L13,3,SA1857555,BRD-A40812237,BROAD_CPD_ID,Cc1ccc(CNC(=O)C2CN(C(=O)C2)c2ccc(C)cc2)n1C,WUSZFGNXLYQDHA-UHFFFAOYSA-N,cdp2w9x2-au00026617_l13_s3_w280dea116-5caa-41e7-b736-66aef7cf4e2f,cdp2w9x2-au00026617_l13_s3_w3746b9dc3-2bee-4c72-b209-27a0497fa11f,cdp2w9x2-au00026617_l13_s3_w1bcfd2a76-a1ff-4fd9-9852-513a790c9a18,cdp2w9x2-au00026617_l13_s3_w50ed33495-c4ed-4fd5-a7e5-688ccfa107bf,cdp2w9x2-au00026617_l13_s3_w468a3a874-1b20-469d-9db1-24298e55256c,71,9511
1864,46366.0,26061-I22-2,BRD-K45714931-001-06-9,26061,I22,2,SA1852805,BRD-K45714931,BROAD_CPD_ID,Clc1ccc2nc(SCN3C(=O)c4ccccc4C3=O)n(CC=C)c(=O)c2c1,WUWFPTBGJDWSIG-UHFFFAOYSA-N,cdp2w9x2_i22_s2_w2ea3b8768-29cb-440a-b212-9f9a8ff17858,cdp2w9x2_i22_s2_w34e08daab-eb27-42fd-a073-b1dd763c9d17,cdp2w9x2_i22_s2_w13191ef1e-7e03-472f-96f9-c6bed7ff66a1,cdp2w9x2_i22_s2_w56599a5a0-4ab5-4e70-9741-905933636a1b,cdp2w9x2_i22_s2_w4d0554a1d-3313-4506-a84d-2e6c6ef0b996,61,6920
1865,55667.0,26662-J15-3,BRD-K61788733-001-01-3,26662,J15,3,SA1455819,BRD-K61788733,BROAD_CPD_ID,O[C@@H]1COC[C@@H]2O[C@@H](CC(O)=O)CC[C@H]2N(C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1,WUYMKGAOXGWOLL-MQYXYMALSA-N,cdp2w13_j15_s3_w21be94e20-1cb5-400e-b0fc-ed233ed38346,cdp2w13_j15_s3_w3f0f038a6-3c66-40da-a73a-a7ad4a480acd,cdp2w13_j15_s3_w1a78506a0-6825-4b8a-a2b7-5fd1e3442098,cdp2w13_j15_s3_w52388b60a-085c-48ff-adde-6e9feab97126,cdp2w13_j15_s3_w4c3a2e47e-dd82-44da-b6e4-a0207578d985,107,10455
1866,34212.0,25686-C12-4,BRD-K79213734-001-05-2,25686,C12,4,SA1858547,BRD-K79213734,BROAD_CPD_ID,Clc1cccc(NC(=S)Nc2ccc3OCCOc3c2)c1,WVEBVYOXGIJPLM-UHFFFAOYSA-N,cdp2w12_c12_s4_w269c697d9-9968-49c9-9572-fbfc24cd48db,cdp2w12_c12_s4_w3ce5526d6-bfa6-404f-b36d-e414607466bb,cdp2w12_c12_s4_w161d4975c-327b-4611-95da-6d265f6cbef1,cdp2w12_c12_s4_w529d6e2b1-14da-4c5e-bae2-0d84f043df9d,cdp2w12_c12_s4_w468387fef-e1b6-4196-ab38-8cf4ce576dd1,44,3540
1867,41315.0,25965-F16-3,BRD-K06439119-001-02-3,25965,F16,3,SA58553,N-Methylanthranilic acid,primary-common,CNc1ccccc1C(O)=O,WVMBPWMAQDVZCM-UHFFFAOYSA-N,cdp2w8x2_f16_s3_w2fd80827b-4a47-44de-a56d-bc9b65173bd4,cdp2w8x2_f16_s3_w3864966d2-d14a-4d60-a8fb-63dc09fdfd1a,cdp2w8x2_f16_s3_w19c418e47-5eb2-4a90-ad65-27867f8e0908,cdp2w8x2_f16_s3_w571d0a5ea-b0da-4c52-96ef-22d312a2eecb,cdp2w8x2_f16_s3_w48db9eb99-562f-430b-945f-03874f84e4b1,79,7379
1868,41358.0,25965-G15-4,BRD-K08078237-001-04-0,25965,G15,4,SA58539,tetrandrine,primary-common,COc1ccc2C[C@@H]3N(C)CCc4cc(OC)c(OC)c(Oc5cc6[C@H](Cc7ccc(Oc1c2)cc7)N(C)CCc6cc5OC)c34,WVTKBKWTSCPRNU-KYJUHHDHSA-N,cdp2w8x2_g15_s4_w292dde81a-5cda-4759-afaa-3099ba0d0f19,cdp2w8x2_g15_s4_w31a2b34ab-5e4a-4ec0-973c-4de33c1ee317,cdp2w8x2_g15_s4_w1d84775f9-b037-4cf2-89a9-d6610de5ac2a,cdp2w8x2_g15_s4_w53062932a-7fc0-456d-9c0d-9a2d7040cb2f,cdp2w8x2_g15_s4_w4a44dfe00-e754-4bcf-804c-dde7e1f2bc04,46,928
1869,32116.0,25676-M17-2,BRD-A96470865-001-05-0,25676,M17,2,SA1852987,BRD-A96470865,BROAD_CPD_ID,CC(=O)C1=C(N=C(S)NC1c1ccc(O)c(O)c1)c1ccccc1,WVYIAAZJUCFFLU-UHFFFAOYSA-N,cdp2w12_m17_s2_w22c6e5c96-8b17-4025-b4ed-b1e78fc910a1,cdp2w12_m17_s2_w340e6556a-140e-4e9e-9d1d-ffd7140238dc,cdp2w12_m17_s2_w1e1aaa9e5-8f1c-4429-b4e3-34a5de76c763,cdp2w12_m17_s2_w529b13f2f-1cce-4dfe-9c69-7e0c83741b52,cdp2w12_m17_s2_w4795572cc-40bf-4881-86c5-5636edcc38c5,60,7619
1870,44093.0,25987-I19-3,BRD-K51541829-001-01-3,25987,I19,3,SA792557,Ro 25-6981,to-be-curated,C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1,WVZSEUPGUDIELE-HTAPYJJXSA-N,cdp2w8x2_i19_s3_w2e6662978-e82a-40c1-b5f7-14a8b2d5a68d,cdp2w8x2_i19_s3_w32dfa0bf4-1d69-4146-bd0d-18d822c22600,cdp2w8x2_i19_s3_w1fde1a8f5-201f-413b-8902-66dbdd7078f4,cdp2w8x2_i19_s3_w5b36124d5-be16-4a76-9b49-68328a00f120,cdp2w8x2_i19_s3_w4dc6773fe-c54e-4f08-8bb3-45c2d05bfdeb,69,630
1871,4224.0,24308-I20-1,BRD-K31611373-001-02-7,24308,I20,1,SA81999,fluprostenol,INN,O[C@@H](COc1cccc(c1)C(F)(F)F)\C=C\[C@H]1[C@H](O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O,WWSWYXNVCBLWNZ-QIZQQNKQSA-N,cdp2bioactives_i20_s1_w26fec9f7c-3907-4bab-be09-564ff7d08b73,cdp2bioactives_i20_s1_w3748b1a41-136c-44f7-a921-1fb6deb95f97,cdp2bioactives_i20_s1_w1155b4709-f8bb-41da-b437-9354ffef5f9e,cdp2bioactives_i20_s1_w5770498a4-89c8-49bf-9d80-bbfb45444d96,cdp2bioactives_i20_s1_w4b5c33fe4-2f46-42a9-a681-31368218194b,102,1379
1872,24693.0,25583-L05-1,BRD-K80717167-001-05-5,25583,L05,1,SA1855508,BRD-K80717167,BROAD_CPD_ID,CC(C)Cn1c(nc2ccccc12)-c1cccs1,WWVYTOAJWOLNPK-UHFFFAOYSA-N,cdp2w11_l05_s1_w210a0c199-3463-4e2b-8943-7398ca22ef43,cdp2w11_l05_s1_w3fcece2d8-ba7f-4968-9f30-4384cf8b0c7a,cdp2w11_l05_s1_w1875d4c95-0503-42e5-9c0b-64037d5819b0,cdp2w11_l05_s1_w5a90522bd-8cd8-48c2-a656-2131fcd70ce8,cdp2w11_l05_s1_w447a3f5d8-df86-44a1-81bc-7363d2ee69d4,65,8934
1873,28955.0,25639-J17-3,BRD-A17902629-001-06-3,25639,J17,3,SA1858701,BRD-A17902629,BROAD_CPD_ID,CCC1Oc2ccc(C)cc2N(CC(=O)N(Cc2ccc(C)o2)Cc2cccnc2)C1=O,WWYFUGXRLQKAHQ-UHFFFAOYSA-N,cdp2w12_j17_s3_w227517a34-50e1-4087-9b35-7dceffe3a376,cdp2w12_j17_s3_w3f9242a42-648b-41c6-86c6-79db2085f845,cdp2w12_j17_s3_w121e48196-493f-44b1-b13a-5583242baad2,cdp2w12_j17_s3_w5ce8f4b9a-77a4-48c2-bd6e-9b82ac6150f5,cdp2w12_j17_s3_w41c7eb032-540f-42d1-9068-6f58ac47a7a7,86,6836
1874,56753.0,26795-L19-3,BRD-K33481868-001-01-7,26795,L19,3,SA418082,BRD-K33481868,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)C2CC2)OCc2cnnn2CCCC1=O,WXHQIOUFBAEATF-IIDMSEBBSA-N,cdp2w13_l19_s3_w251a2f901-3f65-40e4-99b1-54f228b9545b,cdp2w13_l19_s3_w3e14b2d58-4b19-4da9-9827-ed516ed33ff8,cdp2w13_l19_s3_w147d3be12-8d07-41fb-bae9-a9c78e731fe7,cdp2w13_l19_s3_w5a951eabe-0556-434e-a7cc-deb91c77f460,cdp2w13_l19_s3_w48d51e7f2-49bf-40d2-8d1d-eb302b2f12fd,93,9705
1875,17997.0,25488-M07-1,BRD-K31479951-001-06-0,25488,M07,1,SA1857157,BRD-K31479951,BROAD_CPD_ID,COC(=O)c1cc(NC(=O)c2cc(oc2C(F)(F)F)-c2ccc(Cl)cc2)ccc1N1CCOCC1,WXNZOBPUSXPFAB-UHFFFAOYSA-N,cdp2w10-au00024357_m07_s1_w28aab3a76-2711-44a8-9b1a-d40d2bba7cb5,cdp2w10-au00024357_m07_s1_w33ef1b61c-d0ea-4e9c-a870-51555d638062,cdp2w10-au00024357_m07_s1_w146c9e10c-c4b8-4b13-a4ec-6472528b7df3,cdp2w10-au00024357_m07_s1_w5a20577f1-f188-47b4-879b-cd476c29a97d,cdp2w10-au00024357_m07_s1_w4f78b5079-619b-481a-a7f1-c6a419a052e8,51,7889
1876,44156.0,25987-M15-6,BRD-K55927371-001-02-0,25987,M15,6,SA59206,gentisic acid,primary-common,OC(=O)c1cc(O)ccc1O,WXTMDXOMEHJXQO-UHFFFAOYSA-N,cdp2w8x2_m15_s6_w27bc0a347-318a-447b-8421-e5f77c2d94cc,cdp2w8x2_m15_s6_w3bde9c017-3b98-4a33-aa7b-a25821e6719d,cdp2w8x2_m15_s6_w1c290e7ce-6355-4ca5-9155-233e9682295e,cdp2w8x2_m15_s6_w518db9c3c-a9bc-48dc-9f49-0a34d4d0cde0,cdp2w8x2_m15_s6_w4404465a2-afe8-4378-b3ca-703a46299f31,58,1040
1877,45361.0,25992-B22-5,BRD-K61496577-001-03-8,25992,B22,5,SA82932,flumetasone,INN,C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO,WXURHACBFYSXBI-GQKYHHCASA-N,cdp2w8x2_b22_s5_w2516e7945-47fd-46cb-bc4e-5e584df54ba8,cdp2w8x2_b22_s5_w3ce59f4ec-840d-449a-8ec2-1217b3166abc,cdp2w8x2_b22_s5_w17b3d06ae-a346-415c-a45b-31ea253d9841,cdp2w8x2_b22_s5_w5ed87b554-1528-4b7f-ae42-ac7449a78899,cdp2w8x2_b22_s5_w4e25f0632-97a3-4c1b-af9c-684c2d3686e6,54,1380
1878,52151.0,26181-L05-3,BRD-K93709973-001-05-1,26181,L05,3,SA1855736,BRD-K93709973,BROAD_CPD_ID,CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccc2n(C)c(C)cc2c1,WXVMMMZUPCYHGP-UHFFFAOYSA-N,cdp2w9x2-au00026617_l05_s3_w23d4dff3c-8e3f-48c7-9761-5b1f746808bc,cdp2w9x2-au00026617_l05_s3_w3706830eb-4f8e-4c19-b2db-e56eef3f66da,cdp2w9x2-au00026617_l05_s3_w1bfa642f3-58a0-43a4-8a92-57ca73515600,cdp2w9x2-au00026617_l05_s3_w5c5e22563-f643-41b6-a997-05945d28fe68,cdp2w9x2-au00026617_l05_s3_w45351b074-5d88-490b-a32c-163916b0f9e3,37,3458
1879,33366.0,25680-L08-4,BRD-K48954171-001-06-7,25680,L08,4,SA1856539,BRD-K48954171,BROAD_CPD_ID,COc1cc(cc(OC)c1OC)-c1nnc(S)n1CC=C,WYCLSGGCWPZUKL-UHFFFAOYSA-N,cdp2w12_l08_s4_w2de0d6132-8d33-4726-a54d-16c1dc8533ed,cdp2w12_l08_s4_w3914fea41-34e2-441e-ba8f-a77ea9d9c7bb,cdp2w12_l08_s4_w12a60867a-d8f3-4b75-ad5e-ff1cdfeec22f,cdp2w12_l08_s4_w5b6642904-f0d3-4fa4-be9b-686c6e66215e,cdp2w12_l08_s4_w44e2583c9-6b72-4a7d-b068-293fc869183a,62,3362
1880,51966.0,26174-P17-4,BRD-K71902827-001-05-6,26174,P17,4,SA1856669,BRD-K71902827,BROAD_CPD_ID,CCCCc1n[nH]c(SCC(=O)Nc2ccc(cc2)S(N)(=O)=O)n1,WYQAGVGFMRRUEE-UHFFFAOYSA-N,cdp2w9x2-au00026617_p17_s4_w2dcb23db2-657b-473d-849c-87e577f1d108,cdp2w9x2-au00026617_p17_s4_w3c87a18e3-c78a-4189-a234-08c881a09163,cdp2w9x2-au00026617_p17_s4_w119eb8522-9eb1-4de7-a2bc-7dd10cb2c202,cdp2w9x2-au00026617_p17_s4_w595c98313-edc5-4741-8f43-78f1ba956d4b,cdp2w9x2-au00026617_p17_s4_w493f1eef4-cfc2-4704-8639-55c582b16815,68,5383
1881,7556.0,24512-O15-3,BRD-A35141474-001-05-4,24512,O15,3,SA1854385,BRD-A35141474,BROAD_CPD_ID,COc1ccc(cc1)C1C=C(Nc2nnnn12)c1ccccc1,WYRNEYAZTKWHPI-UHFFFAOYSA-N,cdp2w10_o15_s3_w205d7e336-aa82-4db7-8c8b-e03d77967b0f,cdp2w10_o15_s3_w304c05cfe-a5a8-48c4-b423-4e6442f8a480,cdp2w10_o15_s3_w1b31c0837-5b70-4875-a5df-f7fc7188bd08,cdp2w10_o15_s3_w5a9a3c0e9-eeb4-4fe7-ac02-cc80b4061c97,cdp2w10_o15_s3_w4b24eb47d-c537-4469-a694-ecaa06afb685,32,1987
1882,7314.0,24512-B10-1,BRD-K31788464-001-05-6,24512,B10,1,SA1854918,BRD-K31788464,BROAD_CPD_ID,COc1ccccc1N1CCN(Cc2ccsc2)CC1,WYWZGBZCYGPUTL-UHFFFAOYSA-N,cdp2w10_b10_s1_w22834e601-eb4b-41ba-830c-2f24d48964fd,cdp2w10_b10_s1_w31284d6b7-913c-4a6b-8344-d60fae17641f,cdp2w10_b10_s1_w1d9bf49f2-3f85-4f9b-99e3-6c5474bed57b,cdp2w10_b10_s1_w53f23a48c-0410-4267-975f-d0601e28a371,cdp2w10_b10_s1_w4a05892e4-2772-4843-aa10-909b2f5266fb,36,3431
1883,48693.0,26118-O19-1,BRD-K83097268-001-06-5,26118,O19,1,SA1854889,BRD-K83097268,BROAD_CPD_ID,CSc1nsc(SCC(=O)Oc2ccc(NC(C)=O)cc2)n1,WYXLBPTZZJUUSF-UHFFFAOYSA-N,cdp2w9x2_o19_s1_w2c9d30cec-63f4-434f-8381-ef87f1a674cd,cdp2w9x2_o19_s1_w3b04de371-19be-4bb7-90b3-c9381379eb71,cdp2w9x2_o19_s1_w18ccd6126-b3ee-4738-ad0a-b2502bdd4e2c,cdp2w9x2_o19_s1_w5edfb5601-0e6c-44f1-9909-117536580db7,cdp2w9x2_o19_s1_w45e3a9be1-ef6d-4c31-843c-dac7d48a560e,63,6419
1884,27731.0,25598-M04-3,BRD-K40001470-001-05-5,25598,M04,3,SA1857147,BRD-K40001470,BROAD_CPD_ID,COc1cccc(c1)C(=O)Nc1ccc(F)cc1F,WZBHDZAZWSMBDF-UHFFFAOYSA-N,cdp2w11_m04_s3_w2e8e37105-835e-429f-b3fb-d17ac6931fff,cdp2w11_m04_s3_w3595a1e4a-156b-46c7-999b-e982cd35f09f,cdp2w11_m04_s3_w19a5fbe7f-6097-432b-9703-8c5b333cbe8c,cdp2w11_m04_s3_w5f33b6169-7ee7-4922-9c91-0a20576a2e88,cdp2w11_m04_s3_w4b5530fc6-8a3c-4e6f-81f8-f74e8497caba,79,7129
1885,37883.0,25724-O04-3,BRD-K52316915-001-06-3,25724,O04,3,SA1860029,BRD-K52316915,BROAD_CPD_ID,Cc1c(NCc2cc(Cl)cc(Cl)c2O)c(=O)n(-c2ccccc2)n1C,WZSRQXOFFNGVLZ-UHFFFAOYSA-N,cdp2w12_o04_s3_w282bef7de-c8dd-4130-a43c-6621c39768cc,cdp2w12_o04_s3_w3ed326555-e57f-47aa-bce4-29bb366893a4,cdp2w12_o04_s3_w1f18438c0-f3f4-48f3-be45-48b49b790025,cdp2w12_o04_s3_w53bc74e70-e413-4e15-8fcf-2335b77e5ac3,cdp2w12_o04_s3_w48a8dfb3e-966c-4d2b-98f1-96fdb2521dc8,23,4039
1886,25828.0,25588-F03-2,BRD-K20756798-001-05-3,25588,F03,2,SA1859892,BRD-K20756798,BROAD_CPD_ID,Cc1nn2c(N)c(cnc2c1-c1ccccc1)C#N,XAFYBKNNHLDYKS-UHFFFAOYSA-N,cdp2w11_f03_s2_w2f2d5cfed-02cb-415e-836a-4511b8ddcbf6,cdp2w11_f03_s2_w3b906ce3c-340b-4200-9f6c-65e39a5addf9,cdp2w11_f03_s2_w100242ad4-8871-4acf-bf69-dd14e0af26ed,cdp2w11_f03_s2_w56713ae97-5501-4fd0-9652-fc5f7d6a18e7,cdp2w11_f03_s2_w4811d52c6-82fa-4b45-a6dc-54cbfcfbd9ea,99,8293
1887,46541.0,26071-D11-3,BRD-K97298761-001-05-7,26071,D11,3,SA1858931,BRD-K97298761,BROAD_CPD_ID,COc1ccc(CC(=O)Nc2ccc(cc2)-c2noc(n2)-c2cc(OC)c(OC)c(OC)c2)cc1,XANXVUBMCHUEIU-UHFFFAOYSA-N,cdp2w9x2_d11_s3_w2dbde04b6-537f-477e-b96d-cd092c6ce115,cdp2w9x2_d11_s3_w301e2d9d5-001d-4a58-8274-669fb0b401aa,cdp2w9x2_d11_s3_w18caa9119-8e72-45c1-823f-d9812fae4ef4,cdp2w9x2_d11_s3_w50defefa7-2347-4ea9-a073-0901db99bb81,cdp2w9x2_d11_s3_w4c2819caa-40e2-4bd9-9a71-5ce60173fa19,58,7413
1888,26044.0,25590-B04-2,BRD-K06479861-001-06-0,25590,B04,2,SA1859235,BRD-K06479861,BROAD_CPD_ID,Nc1nc(CN2CCN(CC2)c2ccccc2)nc(n1)N1CCCc2ccccc12,XAPUHHALCZTLTF-UHFFFAOYSA-N,cdp2w11_b04_s2_w2b2058af8-df96-466d-9d98-cf733d7dbf1d,cdp2w11_b04_s2_w3eda7ad43-0717-4fd0-b630-a3229250a073,cdp2w11_b04_s2_w160f07df1-ae8d-45c9-ad40-73d9d990e14a,cdp2w11_b04_s2_w55251e848-a1df-42b2-91b3-2206387a1a6d,cdp2w11_b04_s2_w452a67778-55d9-42b2-b6bb-8fa2d375e3d9,59,7513
1889,30397.0,25664-C04-5,BRD-K41283208-001-05-7,25664,C04,5,SA1859930,BRD-K41283208,BROAD_CPD_ID,Nc1nc(cs1)-c1cccc(F)c1,XBHHILITQUEDDC-UHFFFAOYSA-N,cdp2w12_c04_s5_w2d516a203-a15f-4368-904b-3cba8e726d0c,cdp2w12_c04_s5_w3322e0873-e89d-4b0b-89cd-ab01efaa83e4,cdp2w12_c04_s5_w188de60af-d992-40f0-9aa4-9409bab93207,cdp2w12_c04_s5_w578f835fb-ffbd-4641-9d06-7929ebc1c29d,cdp2w12_c04_s5_w4e809cbc9-aa46-4de9-a9d6-c5522caa15f6,59,1735
1890,48160.0,26115-F13-2,BRD-K86163796-001-05-5,26115,F13,2,SA1855370,BRD-K86163796,BROAD_CPD_ID,CCCc1ncc(C(=O)c2ccc(OC)cc2)n1C,XBWPIZLRRZNKAD-UHFFFAOYSA-N,cdp2w9x2_f13_s2_w24b7a019f-1b8a-45a3-bbc9-ca01d3599760,cdp2w9x2_f13_s2_w385d6354b-02bd-4b1d-bae1-5b90e9e305c5,cdp2w9x2_f13_s2_w16f9a074e-0ad2-4a61-a00e-d369e48de655,cdp2w9x2_f13_s2_w5d46b8b19-3357-4819-8234-15871e598d3f,cdp2w9x2_f13_s2_w4c6853976-8711-4916-b377-a46345807ece,61,6784
1891,12069.0,25403-G10-1,BRD-K77981296-001-05-6,25403,G10,1,SA1857301,BRD-K77981296,BROAD_CPD_ID,Cc1cc2ncn(c2cc1C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N1CCOCC1,XCJFOMBEECLTFB-UHFFFAOYSA-N,cdp2w10_g10_s1_w22e5f79f0-941b-44d0-9738-814be4e87b11,cdp2w10_g10_s1_w3a062f318-2f5f-4d57-9771-8e8bb0ea0492,cdp2w10_g10_s1_w114db12da-f0c7-4c67-8833-060f758780d8,cdp2w10_g10_s1_w5faac1e96-2583-4423-8085-c625b1562856,cdp2w10_g10_s1_w4363afc47-bd0c-47d5-bead-a9641914fd71,70,10559
1892,18921.0,25503-H20-1,BRD-K58497506-001-05-2,25503,H20,1,SA1853853,BRD-K58497506,BROAD_CPD_ID,C(Sc1nnc2ccccn12)c1ncc(o1)-c1ccccc1,XDFCSTPYQSTIRQ-UHFFFAOYSA-N,cdp2w11-au00029680_h20_s1_w212a5b6a1-66de-482b-aba8-008775af4f22,cdp2w11-au00029680_h20_s1_w3b3a5b8a7-0c7d-4764-a663-b605b2d35065,cdp2w11-au00029680_h20_s1_w1bc523161-46d7-40d0-9341-4f7a155e294f,cdp2w11-au00029680_h20_s1_w5f81de896-a1de-440b-8e3c-efa8e279f1aa,cdp2w11-au00029680_h20_s1_w4af7b3a74-85b5-4997-b2ea-21dc5b66cfc6,75,4596
1893,35629.0,25692-J20-5,BRD-K12180028-001-08-2,25692,J20,5,SA1853371,BRD-K12180028,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C(OC(=O)c1ccccc1[N+]([O-])=O)(C(F)(F)F)C(F)(F)F,XDJWAOUGFANZTF-UHFFFAOYSA-N,cdp2w12_j20_s5_w2d708456d-d0d2-46b6-acbf-cadac93160af,cdp2w12_j20_s5_w3eb0b48b5-3c58-43f6-9b07-81071e627038,cdp2w12_j20_s5_w1699ee674-a7dd-4b53-9290-db29574466c5,cdp2w12_j20_s5_w5f3fc43cb-ea4a-474c-aadc-3181066211d9,cdp2w12_j20_s5_w44cd52f64-a399-4f5f-879c-5b92d19d873c,76,9482
1894,50050.0,26133-P18-2,BRD-K39396484-001-05-6,26133,P18,2,SA1854748,BRD-K39396484,BROAD_CPD_ID,Cc1c(oc2ccc(cc12)S(=O)(=O)N1CCC2(CC1)OCCO2)C(=O)Nc1cccc(Cl)c1,XDUJAEWHWWAHGJ-UHFFFAOYSA-N,cdp2w9x2_p18_s2_w25f05e64d-9cc0-4e7c-89a1-978df9a04ba4,cdp2w9x2_p18_s2_w30cff434c-d0ff-405d-b50f-49b098aae47a,cdp2w9x2_p18_s2_w1ceec7ba1-ad74-486c-90df-1a18bd6c6281,cdp2w9x2_p18_s2_w514e421ff-4c7b-43b3-a0cf-e0d11660327f,cdp2w9x2_p18_s2_w4d683948b-03a6-447f-b70d-8c275d439959,35,6803
1895,17736.0,25485-O22-4,BRD-K25135854-001-05-6,25485,O22,4,SA1856950,BRD-K25135854,BROAD_CPD_ID,CCOC(=O)c1oc2ccccc2c1NC(=O)c1cccc(OC)c1,XEFIJHMTCVALFO-UHFFFAOYSA-N,cdp2w10-au00024355_o22_s4_w26a17e4a7-6f54-4da3-8783-7eec366f5ec8,cdp2w10-au00024355_o22_s4_w33dfde0e8-6bb7-42b6-a849-903bae28e910,cdp2w10-au00024355_o22_s4_w17d1d008c-040a-4fab-a693-1a18da9ef14a,cdp2w10-au00024355_o22_s4_w59560d791-ba0c-4a4d-9ce3-1dc96b8b9084,cdp2w10-au00024355_o22_s4_w4128d19cf-a372-434d-b7df-7e74fdd3d9f2,54,6878
1896,17278.0,25438-H16-2,BRD-A44350857-001-06-5,25438,H16,2,SA1857492,BRD-A44350857,BROAD_CPD_ID,COc1ccc(cc1OC)-c1nnc(SC(C(=O)c2c[nH]c3ccccc23)c2ccccc2)n1N,XEMJLSFPVMSMKU-UHFFFAOYSA-N,cdp2w10_h16_s2_w27192e805-c253-46e1-8079-05a9a1e251ae,cdp2w10_h16_s2_w339a8033a-a5df-480e-b3a1-63fc71a97304,cdp2w10_h16_s2_w1aa1f80ae-cc85-4f7c-aaee-43df4e14010c,cdp2w10_h16_s2_w56c0fb524-94f9-466c-87d3-95fa5cab8d83,cdp2w10_h16_s2_w4c0e48792-6106-410d-bf65-c654810926a6,76,6858
1897,47548.0,26107-H07-2,BRD-A41199690-001-05-2,26107,H07,2,SA1859777,BRD-A41199690,BROAD_CPD_ID,CCOC(=O)CN1C(=O)NC(C)(C1=O)c1ccc(OC(F)F)cc1,XEVPABXQPFRQRU-UHFFFAOYSA-N,cdp2w9x2_h07_s2_w257621e51-e0b0-4963-baea-d17b8f507c5a,cdp2w9x2_h07_s2_w3b8f7a44a-92a1-41d7-901a-ec94d393cb38,cdp2w9x2_h07_s2_w133651eb6-66a8-425f-9f01-f0c210d2c8b1,cdp2w9x2_h07_s2_w5f4e7ac0e-3103-4d38-b058-e75780ac2923,cdp2w9x2_h07_s2_w47334e139-2ca2-4e0b-b048-5e3052c7de67,91,9692
1898,38887.0,25738-O15-5,BRD-K98801667-001-05-2,25738,O15,5,SA1852313,BRD-K98801667,BROAD_CPD_ID,COc1ccc2-c3onc(C(=O)N4CCOCC4)c3CCc2c1,XFEFQRWGQSMSCB-UHFFFAOYSA-N,cdp2w12_o15_s5_w2f5185558-a453-4c0c-abbf-a52a914b1978,cdp2w12_o15_s5_w31c45fd90-75a9-4733-b55f-c430ec0665fe,cdp2w12_o15_s5_w1075793ee-a274-49a5-9c48-508de431f095,cdp2w12_o15_s5_w5f42704aa-ea68-418b-b455-04acc2ee05ba,cdp2w12_o15_s5_w4d2902067-d1a0-4b3b-bd95-53b335308eb9,65,3613
1899,34673.0,25688-G04-3,BRD-K38842393-001-05-0,25688,G04,3,SA1861701,BRD-K38842393,BROAD_CPD_ID,COc1ccccc1C(=O)n1nc(nc1N)-c1ccccc1,XFOFNRPAKUBICP-UHFFFAOYSA-N,cdp2w12_g04_s3_w2f9191793-53b8-4ad8-b374-647689b53679,cdp2w12_g04_s3_w35647c863-d70e-4b58-87de-1a4207ea7432,cdp2w12_g04_s3_w1d2b9866c-3f68-4a9a-9158-e72e208c6db3,cdp2w12_g04_s3_w58d6710f2-63ef-4d6e-aaa0-0277a48be6e1,cdp2w12_g04_s3_w4656ba7b3-467d-410d-afee-6251a60359cd,44,8169
1900,39279.0,25856-P18-1,BRD-K35885715-001-01-2,25856,P18,1,SA786720,BRD-K35885715,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,XFTZCOPLMXQWPM-GNMOFYLKSA-N,cdp2w6x2_p18_s1_w28e77c138-67a3-442a-86a5-f958204c4b2d,cdp2w6x2_p18_s1_w3eeb00336-49b9-442d-ba28-507b782e4de6,cdp2w6x2_p18_s1_w13f9d70d0-b79a-4824-989a-55d924e1aa44,cdp2w6x2_p18_s1_w546a3b9c9-b76b-4551-a673-4cd91031a77a,cdp2w6x2_p18_s1_w413bf3808-ed7d-419e-9a18-f180384d4718,62,10477
1901,39288.0,25856-P24-4,BRD-K87357593-001-01-6,25856,P24,4,SA791422,BRD-K87357593,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2ccsc2)OCc2ccccc2-c2c(C1=O)n(C)c1ccccc21,XFTZCOPLMXQWPM-NOMHHCBYSA-N,cdp2w6x2_p24_s4_w2aaaa94aa-8539-4ec4-90f5-862f317d8222,cdp2w6x2_p24_s4_w3cc33b863-4f5e-48a5-9761-0aa99d056bed,cdp2w6x2_p24_s4_w1d61281b7-b4f3-40dd-a0cc-4078a0d9d92f,cdp2w6x2_p24_s4_w540707e12-e352-4cf7-8b11-902d6e778f2e,cdp2w6x2_p24_s4_w4dcffabc2-2be6-45fb-a2c7-7e38e49077e5,72,10214
1902,54969.0,26271-A12-1,BRD-A44990218-001-07-0,26271,A12,1,SA1858481,BRD-A44990218,BROAD_CPD_ID,Cc1ccc(NC(=O)C2CCCN(C2)c2ncccn2)cc1F,XFYWTKXMRZBBIT-UHFFFAOYSA-N,cdp2w9x2-au00026606_a12_s1_w2b6803a1a-9de7-4186-9e46-df5f041c34bf,cdp2w9x2-au00026606_a12_s1_w3cc0024bd-8ed4-460f-8b45-ec4af744c186,cdp2w9x2-au00026606_a12_s1_w10e0e99ea-bcfc-436e-b2b9-fbed152b5994,cdp2w9x2-au00026606_a12_s1_w50edc2c16-462e-4c12-aac9-779562c635b6,cdp2w9x2-au00026606_a12_s1_w4ddc5e12c-cb2e-4e39-a0e2-e951c56331c4,44,5651
1903,3508.0,24306-J12-5,BRD-K10870738-001-02-4,24306,J12,5,SA82378,CDC,primary-common,Oc1ccc(\C=C(\C#N)C(=O)OC\C=C\c2ccccc2)cc1O,XGHYFEJMJXGPGN-CHLGNXTCSA-N,cdp2bioactives_j12_s5_w29d5c9a87-5de7-4f70-8a1c-fb92610e9347,cdp2bioactives_j12_s5_w38f2088fb-2b14-4401-b760-5ade7e324524,cdp2bioactives_j12_s5_w1235101c1-8b42-4560-9721-604c3d55c261,cdp2bioactives_j12_s5_w593e352ad-a528-4460-ac1d-527458ce319d,cdp2bioactives_j12_s5_w40984199a-020b-4168-9ca6-83c7f1c2ee17,96,8052
1904,19344.0,25553-L17-4,BRD-K35044141-001-05-1,25553,L17,4,SA1855048,BRD-K35044141,BROAD_CPD_ID,O=C(CCCc1cccs1)Nc1nc2CCCCc2s1,XGJKXIQPTYXYCS-UHFFFAOYSA-N,cdp2w11-au00029679_l17_s4_w2d492829d-407f-4a45-bbcd-339e83268262,cdp2w11-au00029679_l17_s4_w36c324718-d6a3-4441-ba1c-0a6e1c256c8b,cdp2w11-au00029679_l17_s4_w1d45fc076-029a-48df-b023-2c7a8f2d535c,cdp2w11-au00029679_l17_s4_w5c0cce29f-48c2-4b92-8be1-cdbc3ed7bb5e,cdp2w11-au00029679_l17_s4_w4b6559920-2d9a-4822-8d41-9bafbc06d7a4,72,5191
1905,38345.0,25726-C21-3,BRD-K67896714-001-05-2,25726,C21,3,SA1861328,BRD-K67896714,BROAD_CPD_ID,Cn1c(NCc2cccnc2)ncc1-c1ccc(Br)cc1,XGRDDAXHCITUGZ-UHFFFAOYSA-N,cdp2w12_c21_s3_w2165f26e7-572c-42d9-bc83-bdea96bf400f,cdp2w12_c21_s3_w3d868af01-b52f-45f2-a161-d1cd970ca459,cdp2w12_c21_s3_w1c4124a3d-2473-4484-b3e6-32bafc0bf907,cdp2w12_c21_s3_w5abb20cc8-d5b3-4a2f-8230-de142fb19745,cdp2w12_c21_s3_w4e99c8cf4-d204-4af3-97b4-755d3af0e693,109,2948
1906,23857.0,25579-P20-5,BRD-A65898531-001-05-3,25579,P20,5,SA1856634,BRD-A65898531,BROAD_CPD_ID,CC12CC(CC(C)(C)C1)N(C2)C(=O)COC(=O)c1ccc(Cl)cc1N,XGWYJHQRZQXMAE-UHFFFAOYSA-N,cdp2w11_p20_s5_w23b8166da-afd9-4149-acb5-25e53d240f96,cdp2w11_p20_s5_w36a3d7d5a-d1c2-46bc-a289-7e7176102cd8,cdp2w11_p20_s5_w1e6cb174b-c5b8-4e8b-be8c-2742dd4c1bdf,cdp2w11_p20_s5_w5d0dfbfd8-f02e-4796-84e8-818d875eca1d,cdp2w11_p20_s5_w49edbb8f4-6323-42d0-af18-fac697cf990e,60,6102
1907,38785.0,25738-K06-5,BRD-K40861126-001-05-0,25738,K06,5,SA1860820,BRD-K40861126,BROAD_CPD_ID,Cc1cc(C)n2nc(cc2n1)-c1ccc(Br)cc1,XGZDOQBNVMZASH-UHFFFAOYSA-N,cdp2w12_k06_s5_w2022b3ca9-0ed2-4174-ade2-a5226bae96b9,cdp2w12_k06_s5_w3859bc583-abbc-4531-ad1c-7d27fd947aea,cdp2w12_k06_s5_w1d22905a4-854a-4111-b465-437e222e44e3,cdp2w12_k06_s5_w574957c52-3008-4dd1-86a3-bfd518f92823,cdp2w12_k06_s5_w4c5fdd9a2-e296-477e-a377-4fdd4e4228dc,75,4163
1908,34630.0,25688-E16-2,BRD-K38526395-001-05-7,25688,E16,2,SA1855054,BRD-K38526395,BROAD_CPD_ID,Sc1nnc(Cn2ncc3ccccc3c2=O)n1-c1ccccc1Cl,XHBITWULKPSTLW-UHFFFAOYSA-N,cdp2w12_e16_s2_w26eece916-3720-4cd0-a3ea-a22c3a926386,cdp2w12_e16_s2_w3e23ab605-c1e1-4b7a-aa14-be36732c2073,cdp2w12_e16_s2_w135790592-28ea-4fc7-84f2-8873b5b293a9,cdp2w12_e16_s2_w5717173a9-9213-47da-a7f7-ffb221d81f3b,cdp2w12_e16_s2_w49f623407-b340-4d60-bf49-cc14dda4943d,53,1742
1909,45759.0,26058-F16-1,BRD-K11554989-001-05-2,26058,F16,1,SA1855396,BRD-K11554989,BROAD_CPD_ID,CN(C(C)=O)c1ccc(NC(=O)Nc2ccc(C)c(C)c2)cc1,XHDCZQFZTVJPFF-UHFFFAOYSA-N,cdp2w9x2_f16_s1_w2ee6fa32a-55d1-41f3-a43b-0745a3c6b286,cdp2w9x2_f16_s1_w3f7677ead-b8b1-427c-8e35-b9720353cf47,cdp2w9x2_f16_s1_w1a2b153e5-a303-4329-bf0d-166ca29a2c10,cdp2w9x2_f16_s1_w53afca30c-a473-4415-a684-d87e312314ad,cdp2w9x2_f16_s1_w4a8d7e1df-a9a3-45cf-a12a-6e2a98398de1,66,7771
1910,49462.0,26128-B08-2,BRD-K80233876-001-05-5,26128,B08,2,SA1856140,BRD-K80233876,BROAD_CPD_ID,[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)NCCc1nc2ccccc2[nH]1,XHFWWPFWSUJCDP-UHFFFAOYSA-N,cdp2w9x2_b08_s2_w29a28611b-8333-4893-a68c-ff69e7aaaf5a,cdp2w9x2_b08_s2_w3d31a6322-d222-42ac-982d-956e6a4aa876,cdp2w9x2_b08_s2_w1a91d9936-b34b-4f74-a8ed-33ff46d427f8,cdp2w9x2_b08_s2_w5def7a28a-7005-44a7-a93b-8f705e3ed3e6,cdp2w9x2_b08_s2_w477746516-5234-499d-8c9e-c17bc3855f24,97,4164
1911,56103.0,26688-A08-1,BRD-K64299311-001-02-6,26688,A08,1,SA796520,BRD-K64299311,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)Nc1ccc2O[C@@H]3[C@@H](C[C@@H](CC(=O)NCc4ccc(Cl)cc4)O[C@H]3CO)c2c1,XHFXJTPXFPIUNX-IXQFDHPPSA-N,cdp2w13_a08_s1_w2474dc5ca-a1f6-4f73-9813-0aa5125880cd,cdp2w13_a08_s1_w3d2c926a4-ebac-44df-aedb-51179dc7a2ac,cdp2w13_a08_s1_w18e54373d-755c-4a1d-8f2a-3713ec089774,cdp2w13_a08_s1_w5a11a37c6-1012-4292-9058-66b046247f79,cdp2w13_a08_s1_w4fdb3e50a-ae0b-47cd-a0ae-82893dc1fdaa,24,9815
1912,46825.0,26081-B08-5,BRD-K10433727-001-05-7,26081,B08,5,SA1859754,BRD-K10433727,BROAD_CPD_ID,O=S(=O)(NCc1ccc2OCOc2c1)c1cccc2cccnc12,XHGMGANVHATTCQ-UHFFFAOYSA-N,u00026613_b08_s5_w201b722fc-1125-4810-bd16-edd3c606be67,u00026613_b08_s5_w382dad374-01e2-4fdf-bbec-c6f2350a64c8,u00026613_b08_s5_w1195cff79-a990-473d-97f0-86849c51436f,u00026613_b08_s5_w5d7795146-7695-42cd-920e-0108aebe9900,u00026613_b08_s5_w40874bce2-fafe-4247-b145-b85f42527739,74,6399
1913,16042.0,25432-N03-2,BRD-K30267495-001-06-3,25432,N03,2,SA1859528,BRD-K30267495,BROAD_CPD_ID,CC(=O)n1c(Cl)c(NC(=O)CCl)c2ccccc12,XHRPFARAFYNEMH-UHFFFAOYSA-N,cdp2w10_n03_s2_w21263aec7-dabf-433e-8089-041e507fdc59,cdp2w10_n03_s2_w35fdcb943-7ede-45d4-a8d4-877742a23101,cdp2w10_n03_s2_w1840b25f8-75c2-4f2a-aac3-264a0f802be2,cdp2w10_n03_s2_w5b3c33ad2-9f54-4556-bedd-dd3461d1b52a,cdp2w10_n03_s2_w477f4647f-eb95-4b7e-81da-52208dee1587,18,3317
1914,27716.0,25598-L04-6,BRD-K05392698-001-05-7,25598,L04,6,SA1860406,BRD-K05392698,BROAD_CPD_ID,CCOC(=O)N1CCC(CC1)NC(=O)c1cccc2CN(C(=O)c12)c1ccc(OC)cc1,XINSMRKQRPCGCW-UHFFFAOYSA-N,cdp2w11_l04_s6_w24f9c81a6-52b7-49c1-94c8-1e29fe19e30c,cdp2w11_l04_s6_w3a58e8657-8eb0-48f2-84d8-cfe0370800c3,cdp2w11_l04_s6_w1ff6eceb9-5c30-4103-825c-0388e224b3aa,cdp2w11_l04_s6_w5cbe8c97b-9a33-44de-899f-59d4999e5101,cdp2w11_l04_s6_w4c0b0a8f9-a971-42b8-bd28-f7d00772d2dc,71,1908
1915,18836.0,25503-C06-6,BRD-K34676668-001-05-4,25503,C06,6,SA1857208,BRD-K34676668,BROAD_CPD_ID,CCOC(=O)N1CCC(CC1)n1c(SCC(=O)NCc2ccccc2)nc2ccccc2c1=O,XIUIRBACTBFYRV-UHFFFAOYSA-N,cdp2w11-au00029680_c06_s6_w21cc3b821-f962-4c97-a5b1-03c75f728ed3,cdp2w11-au00029680_c06_s6_w3566c9a00-aa1b-4af6-8551-ad916e1ebb1f,cdp2w11-au00029680_c06_s6_w1dc09778e-5bff-4947-91fb-56c31ef68096,cdp2w11-au00029680_c06_s6_w595b0b68b-8a72-471f-b665-d21023b4570e,cdp2w11-au00029680_c06_s6_w4d6dddc7f-13f9-4e5b-b13d-50261860a6ee,75,6454
1916,4995.0,24310-O07-4,BRD-K58787433-001-04-7,24310,O07,4,SA59125,santonin,JAN,C[C@H]1[C@@H]2CC[C@@]3(C)C=CC(=O)C(C)=C3[C@H]2OC1=O,XJHDMGJURBVLLE-BOCCBSBMSA-N,cdp2bioactives_o07_s4_w20d6d38cc-c3a4-45bf-9d5c-341d1aef6c8f,cdp2bioactives_o07_s4_w3811a9394-af85-4b80-a9f4-9e258435b020,cdp2bioactives_o07_s4_w14a7a7817-e137-4227-890a-03db812cf327,cdp2bioactives_o07_s4_w5aa1cf90f-9c64-40c6-876e-a09106e43312,cdp2bioactives_o07_s4_w4ecb3f42f-1f33-4a19-a376-9df3ceaf6255,115,1146
1917,19243.0,25553-G13-5,BRD-A98248982-001-08-0,25553,G13,5,SA1854537,ML158,common,COc1ccc(CCN(C)C(=O)C2CCCN(Cc3ccc(OC)c(OC)c3)C2)cc1OC,XJJDWEDQSMGTCV-UHFFFAOYSA-N,cdp2w11-au00029679_g13_s5_w2b9471e04-89d5-4f4a-9999-1875373559fd,cdp2w11-au00029679_g13_s5_w36a736cc2-7cf4-467e-a8be-9d80084afe03,cdp2w11-au00029679_g13_s5_w14090465f-9841-4daf-8390-55f78e609226,cdp2w11-au00029679_g13_s5_w587e45c54-8e06-4074-92ad-cb5337580e47,cdp2w11-au00029679_g13_s5_w4a10d7349-1943-4736-be58-87900e0af292,90,2201
1918,35688.0,25692-N13-4,BRD-K47645297-001-05-3,25692,N13,4,SA1861175,BRD-K47645297,BROAD_CPD_ID,CC(C)CCNC(=O)NC(=O)COC(=O)c1cc(ccc1N1CCCCC1)S(=O)(=O)N1CCOCC1,XJJZJGLIVVMNRP-UHFFFAOYSA-N,cdp2w12_n13_s4_w267d3ebb4-b0be-416f-9db1-2d2314e2e298,cdp2w12_n13_s4_w353653ae7-5edf-4271-b3ea-a091bb89deb7,cdp2w12_n13_s4_w1cda549b1-46af-46ab-9a43-6217de7fbed7,cdp2w12_n13_s4_w56aa41208-6184-4dcc-91ea-efb2aaa4a88d,cdp2w12_n13_s4_w4d60f523f-4238-4a41-ac18-cca6b75b038c,55,4775
1919,53789.0,26216-F08-3,BRD-K03159241-001-05-4,26216,F08,3,SA1861484,BRD-K03159241,BROAD_CPD_ID,CCOC(=O)CSc1nnc(o1)-c1ccc(Cl)cc1Cl,XJUATJBQCZPMSW-UHFFFAOYSA-N,cdp2w9x2_f08_s3_w2ff1fd990-e504-475b-9050-dfec5f226cfb,cdp2w9x2_f08_s3_w39a61376e-f55c-4eb9-a4fd-16cb5dbec355,cdp2w9x2_f08_s3_w186c8f793-4f33-41ce-94e4-26d97888a9b3,cdp2w9x2_f08_s3_w5b93520e1-51a4-424d-8d61-c19ed9dd06c1,cdp2w9x2_f08_s3_w42161ca6c-7b68-4c09-ae0e-43446bd075e0,41,9305
1920,7287.0,24512-A16-4,BRD-K06961060-001-05-8,24512,A16,4,SA1853701,BRD-K06961060,BROAD_CPD_ID,Cc1ccc(C(=O)CSc2nnc3ccccn23)c(C)c1,XJYUZJBGRSNVKZ-UHFFFAOYSA-N,cdp2w10_a16_s4_w2f26694af-39b5-4b60-8500-4bd285232d9e,cdp2w10_a16_s4_w3f10c932d-f233-487a-98dd-c14f9432316e,cdp2w10_a16_s4_w1d8d6510c-ffd5-49b0-850a-f119e4fd41bb,cdp2w10_a16_s4_w5d5088715-c93b-4c1f-a2a4-0dc90f1610f3,cdp2w10_a16_s4_w443f728f3-7d3e-4a45-8447-91c9afa43ca4,45,6642
1921,51797.0,26174-H07-3,BRD-K04642395-001-05-2,26174,H07,3,SA1857116,BRD-K04642395,BROAD_CPD_ID,Cc1ccc(cc1)S(=O)(=O)NCc1ccncc1,XKDJGAPHTFVILP-UHFFFAOYSA-N,cdp2w9x2-au00026617_h07_s3_w2b99276dc-e4b7-4349-9d41-fb31eb205d1d,cdp2w9x2-au00026617_h07_s3_w3352fd6b4-dae9-4372-a14e-9ab2314baa44,cdp2w9x2-au00026617_h07_s3_w1917ca758-cd16-4987-a73a-f6f9672da7a7,cdp2w9x2-au00026617_h07_s3_w527d428c9-5526-49ed-8cc5-0bcee2b059e8,cdp2w9x2-au00026617_h07_s3_w47e3811ca-1fdd-41be-b42b-43a8723f9b70,45,9152
1922,54145.0,26224-L10-5,BRD-K93332168-001-03-2,26224,L10,5,SA83613,isocarboxazid,INN,Cc1cc(no1)C(=O)NNCc1ccccc1,XKFPYPQQHFEXRZ-UHFFFAOYSA-N,cdp2w9x2_l10_s5_w28cd68732-324a-43f2-a4d2-f6c67941b737,cdp2w9x2_l10_s5_w37b621375-59f7-49f6-8bf2-54dc8b2247c2,cdp2w9x2_l10_s5_w19c358cfe-741e-46b1-a09a-d376869a161b,cdp2w9x2_l10_s5_w5247997c3-1579-49e0-b11c-64568bba1878,cdp2w9x2_l10_s5_w4c1a8b2fc-5d68-466e-bb00-1b2e2e700fd0,53,1370
1923,36166.0,25695-J14-2,BRD-K79005256-001-06-8,25695,J14,2,SA1852265,BRD-K79005256,BROAD_CPD_ID,COC(=O)C1=C(C)N(\C(=C\c2ccco2)C1=O)c1ccccc1,XKSZXIXQQVPLER-RVDMUPIBSA-N,cdp2w12_j14_s2_w23e665dfb-70b7-463f-a253-8aa08ddba4bf,cdp2w12_j14_s2_w358cab3b8-235c-4b98-bd62-5e2f67620966,cdp2w12_j14_s2_w1b9b33a33-117c-4114-b2ff-1c5f715993bd,cdp2w12_j14_s2_w51430c7cf-9d1f-44e2-a612-cb7fad5d61cc,cdp2w12_j14_s2_w4ad2d438a-51fe-4bc1-8bc8-4e0fb38da8ff,37,4060
1924,38501.0,25726-L22-3,BRD-K14800843-001-05-2,25726,L22,3,SA1858283,BRD-K14800843,BROAD_CPD_ID,NC1=C(C#N)C2(CCN(CC2)C(=O)OCc2ccccc2)C2=C(CCCC2=O)O1,XKUOZATYGGNDNY-UHFFFAOYSA-N,cdp2w12_l22_s3_w26acf91cd-6744-4368-8e85-a610e064f9dd,cdp2w12_l22_s3_w35cbbb7dd-d81c-44c7-aa6d-d68b501d49dd,cdp2w12_l22_s3_w1583e3f8a-91e5-4cb8-a7a2-474f5b1e3443,cdp2w12_l22_s3_w52bfa524d-7f61-4539-b4dd-5643a92c1869,cdp2w12_l22_s3_w44f25ffd5-45ea-47d9-8869-41c136ab2234,91,2165
1925,30449.0,25664-F08-3,BRD-K46160960-001-05-0,25664,F08,3,SA1856697,BRD-K46160960,BROAD_CPD_ID,Cn1nc(c(c1C(=O)Nc1ccc(Br)cc1)[N+]([O-])=O)C(C)(C)C,XLJFYJSUESXBDS-UHFFFAOYSA-N,cdp2w12_f08_s3_w23c29a600-0fa6-4f3b-8762-2f6e2da42054,cdp2w12_f08_s3_w39bb68232-b1be-4a15-9127-05af7af129f9,cdp2w12_f08_s3_w132b67439-cdd5-46d6-af9b-3aee40eaa1a3,cdp2w12_f08_s3_w5d52bbd74-c16a-41a9-b636-0fc8eb90dc7f,cdp2w12_f08_s3_w407eb0f23-12c1-4cf1-be76-4c74d0b49907,38,1989
1926,5941.0,24319-F19-2,BRD-K65786282-001-02-6,24319,F19,2,SA792526,CGP-7930,primary-common,CC(C)(CO)Cc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C,XLWJPQQFJNGUPA-UHFFFAOYSA-N,cdp2bioactives_f19_s2_w235eef002-8264-471c-9a95-a147890489f8,cdp2bioactives_f19_s2_w3527c1f0a-7817-4f52-8b05-d7c30ea8d7b0,cdp2bioactives_f19_s2_w1aa4907f5-ce8f-48a5-a2b0-7460eb6221e9,cdp2bioactives_f19_s2_w54c7e0ae3-43d4-4082-8f89-76e6cac239b9,cdp2bioactives_f19_s2_w4ba797ea9-c884-44e0-88aa-84265139ec8a,70,1414
1927,26071.0,25590-C19-5,BRD-K44041571-001-06-3,25590,C19,5,SA1856488,BRD-K44041571,BROAD_CPD_ID,NC(=O)c1c(NC(=O)Cc2ccccc2)scc1-c1ccc(Cl)cc1Cl,XMGIGDNDRCSVQI-UHFFFAOYSA-N,cdp2w11_c19_s5_w2fbc824dc-141d-4172-b935-f1847be502f2,cdp2w11_c19_s5_w37412e75a-a6f1-4c12-baf5-52127c6f87ab,cdp2w11_c19_s5_w1bc1f6f35-2333-4e16-b488-8a0e266023b6,cdp2w11_c19_s5_w5b48e2fb6-f2df-4ddb-a060-115e326d3b5f,cdp2w11_c19_s5_w4e5bcd527-aef6-44ab-b029-7dbb7ff60a52,52,5240
1928,13932.0,25418-K21-4,BRD-K13306274-001-05-9,25418,K21,4,SA1855902,BRD-K13306274,BROAD_CPD_ID,CCOC(=O)c1ccc(NC(=O)Nc2ccc3N(CC)C(=O)c4cccc2c34)cc1,XMJIRJQSDSUUTG-UHFFFAOYSA-N,cdp2w10_k21_s4_w2d8131370-4942-4e5f-9d5a-8eeebab312d4,cdp2w10_k21_s4_w3b04e8d56-4f6f-4563-8073-fb9a74369125,cdp2w10_k21_s4_w149272c90-bc8e-4eee-8dde-cba324cc8070,cdp2w10_k21_s4_w58966d92e-044c-4b8f-91a2-54afdcea2039,cdp2w10_k21_s4_w4b2c7f349-1bda-46e7-b952-afbc15a82600,25,4739
1929,161.0,24277-G05-6,BRD-K27529556-001-02-6,24277,G05,6,SA58128,epigallocatechin,primary-common,O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1,XMOCLSLCDHWDHP-IUODEOHRSA-N,cdp2bioactives_g05_s6_w2ec8779be-89db-4588-8408-7c5b4690af51,cdp2bioactives_g05_s6_w3e8688fe9-fbdb-417f-977d-6aa4505d64ca,cdp2bioactives_g05_s6_w12898a8f0-f486-4b47-b0b6-cbb8edb2317c,cdp2bioactives_g05_s6_w58b67d9c3-22b8-4c16-a790-46ddf088300c,cdp2bioactives_g05_s6_w4903c10a0-71c3-47b5-9268-0b106a85bc67,90,508
1930,45588.0,26006-F08-4,BRD-K75775113-001-01-4,26006,F08,4,SA798028,BRD-K75775113,BROAD_CPD_ID,COc1ccc(NC(=O)Nc2ccc3O[C@H]4[C@H](C[C@H](CC(=O)N5CCc6ccccc6C5)O[C@@H]4CO)c3c2)cc1,XMRNAPLDHHXMNZ-UPQWRWMQSA-N,cdp2w8x2_f08_s4_w2fe4ba09f-7964-4c90-8445-dec6090b6d14,cdp2w8x2_f08_s4_w35cdf02ec-e0a5-4752-ad7f-5804fab4bd92,cdp2w8x2_f08_s4_w19f5f48ad-dd98-43a1-8963-fe4bfc1dbe94,cdp2w8x2_f08_s4_w5fd9988d0-d118-46e3-8535-98e66cfa920e,cdp2w8x2_f08_s4_w4eaf7ee07-0dae-43d4-b40e-dc90b39254ba,68,10515
1931,33100.0,25679-O08-2,BRD-K27559589-001-06-5,25679,O08,2,SA1861229,BRD-K27559589,BROAD_CPD_ID,Clc1ccc(cc1)C(=O)NNC(=O)c1cnccn1,XMRUGQJFSZJSKG-UHFFFAOYSA-N,cdp2w12_o08_s2_w27edb5456-e9de-4d8a-93b7-a5b8e3568d43,cdp2w12_o08_s2_w343177b57-50e7-43e3-aeeb-15091464fef1,cdp2w12_o08_s2_w1fa210bab-2dae-4c1a-88e5-0190a9d03f91,cdp2w12_o08_s2_w59946bf4e-aba4-4dd1-9c67-b0b07c17d438,cdp2w12_o08_s2_w435c6f894-fa73-495a-a630-6cfc40331cb4,36,7518
1932,15575.0,25430-D20-3,BRD-K30652426-001-06-0,25430,D20,3,SA1854398,BRD-K30652426,BROAD_CPD_ID,CCc1nnc(NC(=O)CSc2ccc(cn2)-c2nc3ccccc3[nH]2)s1,XNFITKQJNDDRLR-UHFFFAOYSA-N,cdp2w10_d20_s3_w27cd9f765-cdf2-4ef4-8f6c-f3f7744bad62,cdp2w10_d20_s3_w32bc16681-dbeb-45f9-8107-4793ae1475a3,cdp2w10_d20_s3_w1d82bb857-fb88-4432-8c44-1529a934da0c,cdp2w10_d20_s3_w59c0ed246-3aab-4501-af06-185d7410b885,cdp2w10_d20_s3_w4f2a31f00-e703-4377-a539-542ef8185e8d,58,7378
1933,54277.0,26232-F11-5,BRD-K85883481-001-02-6,26232,F11,5,SA38533,prednisone,INN,C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO,XOFYZVNMUHMLCC-ZPOLXVRWSA-N,cdp2w9x2_f11_s5_w28029e1c5-b378-4eaa-88b4-afdef50004dc,cdp2w9x2_f11_s5_w36bbabc15-e35e-4340-8f1d-20bbbb088060,cdp2w9x2_f11_s5_w13caace0f-9289-4f12-9610-4a56bda9d8dd,cdp2w9x2_f11_s5_w5b8502a95-079d-4bae-8bd6-143cd91f40f3,cdp2w9x2_f11_s5_w4bb302e07-6b45-4c98-a31b-b4ca0d2259f4,73,300
1934,43163.0,25984-E06-3,BRD-K25280080-001-02-3,25984,E06,3,SA81900,"4-quinazolinamine, N-(3-ethynylphenyl)-6,7-dimethoxy-",to-be-curated,COc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OC,XOTGKYTUNDYTBS-UHFFFAOYSA-N,cdp2w8x2_e06_s3_w2ed543927-c232-4eb8-b252-bb5c0ed4f742,cdp2w8x2_e06_s3_w3898fd086-3303-4134-a95c-1e09c3be604f,cdp2w8x2_e06_s3_w130e3690d-3b8b-41eb-bd38-3958fba81e47,cdp2w8x2_e06_s3_w5433a1416-baad-40a1-becf-93342da261bc,cdp2w8x2_e06_s3_w478219a36-6e94-4a45-81db-5090502b24b3,70,617
1935,23503.0,25578-N20-5,BRD-K29027586-001-05-6,25578,N20,5,SA1856398,BRD-K29027586,BROAD_CPD_ID,O=C(CCC1CCCC1)Nc1ccccc1-c1ccccc1,XOZIVFWTMYSICP-UHFFFAOYSA-N,cdp2w11_n20_s5_w2517747dc-f4b7-424b-9132-b8ecf2663d1e,cdp2w11_n20_s5_w392de8e82-f695-426e-af35-e4a26ec20b7b,cdp2w11_n20_s5_w1633902b0-e55e-4d75-8458-1edc2f15bf7d,cdp2w11_n20_s5_w5e5447af5-8dac-4918-a08d-b1a39e04bfdc,cdp2w11_n20_s5_w4581174e2-ab86-491b-aa30-f965f59287ef,78,1868
1936,20010.0,25565-M16-4,BRD-K08434989-001-06-0,25565,M16,4,SA1856783,BRD-K08434989,BROAD_CPD_ID,O=C1NC(=O)\C(=C/Nc2ccc(CN3CCOCC3)cc2)C(=O)N1Cc1ccccc1,XPPNZOBEJLLGSI-XSFVSMFZSA-N,cdp2w11_m16_s4_w295fe1944-8fd3-4304-9dc9-5cffbcf8a0e9,cdp2w11_m16_s4_w37170cad2-6ab9-4319-b7db-db391c1c990e,cdp2w11_m16_s4_w144008463-5dd5-4786-b6fc-546504de21d5,cdp2w11_m16_s4_w5ab56e8dc-4b1f-4594-ac29-d746517f86cc,cdp2w11_m16_s4_w41827e1dd-c7fc-488d-a796-042dc1c672eb,83,8980
1938,12420.0,25406-L20-4,BRD-K50080712-001-05-4,25406,L20,4,SA1859119,BRD-K50080712,BROAD_CPD_ID,COc1ccc2C(=O)CCc2c1OC,XQODIRIVQXQUFN-UHFFFAOYSA-N,cdp2w10_l20_s4_w2eefa0aff-4e06-4f83-9bf7-c7b6b9d52d73,cdp2w10_l20_s4_w35bfd33e9-f3d9-4c5d-8376-3c556a31bc86,cdp2w10_l20_s4_w14e04aade-b56c-431a-981f-7b32f221744a,cdp2w10_l20_s4_w54ef0ee78-397d-4635-a20e-9901df51c9f7,cdp2w10_l20_s4_w477712d88-18d7-4456-9b14-dd5556c6c443,67,9015
1939,10361.0,25376-P20-3,BRD-K47843573-001-05-9,25376,P20,3,SA1857720,BRD-K47843573,BROAD_CPD_ID,O=C(\C=C\Nc1ccccc1Oc1ccccc1)c1ccco1,XQSBWXOTJCKMTA-OUKQBFOZSA-N,cdp2w10_p20_s3_w2ad87ed7c-61c9-4d2f-9194-947ca30bfa93,cdp2w10_p20_s3_w378c95691-c799-459f-a503-0bb56093bcdd,cdp2w10_p20_s3_w14b349308-5cea-4fbe-8b63-421b6e14e346,cdp2w10_p20_s3_w5636966eb-9ce3-428d-9411-be6a2b9aceaa,cdp2w10_p20_s3_w48f2221c6-cd0b-430b-9822-6f18b47e082e,51,3691
1940,10079.0,25374-M22-3,BRD-K39781787-001-08-7,25374,M22,3,SA1860844,BRD-K39781787,BROAD_CPD_ID,COc1ccc(CNC(=O)c2c(C)oc3c2C(=O)c2ccccc2C3=O)cc1,XQTWWQCHTYENDU-UHFFFAOYSA-N,cdp2w10_m22_s3_w2fb575444-34e3-49ec-95a2-ee92e57eb2d7,cdp2w10_m22_s3_w345004e10-3eac-41a0-910b-573975a799e4,cdp2w10_m22_s3_w125fd6afc-ace1-454a-b904-ffe61837936d,cdp2w10_m22_s3_w5b9866762-1e19-4231-808f-1d54b3b459ea,cdp2w10_m22_s3_w4f1427ef7-9744-4534-9168-7b78c216a049,24,2487
1941,38470.0,25726-K21-2,BRD-K47020481-001-06-3,25726,K21,2,SA1859386,BRD-K47020481,BROAD_CPD_ID,COc1cccc(NC(=O)CNC(=O)c2ccc(C)cc2)c1,XRJPKMPRLKPPJI-UHFFFAOYSA-N,cdp2w12_k21_s2_w2c5c3454e-2cd4-4153-9136-034336ae055a,cdp2w12_k21_s2_w3c7898f88-aea3-4792-968c-ec583950d88b,cdp2w12_k21_s2_w1150a2e09-f64d-4f56-8596-f3c0b8f763c7,cdp2w12_k21_s2_w5fb179d4c-68c7-48b9-960d-3a64a4dfc7cd,cdp2w12_k21_s2_w4db37de94-1b62-45be-a19b-c34059c8a2d5,64,5617
1942,27638.0,25598-G14-6,BRD-K07160586-001-07-7,25598,G14,6,SA1857179,BRD-K07160586,BROAD_CPD_ID,OC(=O)COc1c(oc2ccccc2c1=O)-c1ccccc1,XRNYYUDRVWPOKG-UHFFFAOYSA-N,cdp2w11_g14_s6_w2c18cf7b9-49c5-495e-8543-a5352c0b8a2f,cdp2w11_g14_s6_w3129f53e6-2f54-44ab-b6c1-a05cb5866352,cdp2w11_g14_s6_w1f45054bc-3dde-4a7b-a070-987979c57bfc,cdp2w11_g14_s6_w504b3a88a-1fc3-4d6c-bcd7-dc0b50d5ab2e,cdp2w11_g14_s6_w4860438a6-08dc-4506-932a-652606aa70fa,76,2186
1943,15037.0,25426-G18-5,BRD-K24198990-001-05-0,25426,G18,5,SA1855424,BRD-K24198990,BROAD_CPD_ID,COc1ccccc1N1CN(Cc2ccccc2)CN=C1S,XRORQPYKVYMLRB-UHFFFAOYSA-N,cdp2w10_g18_s5_w2e98833de-b205-46b2-848a-1b23f4707d9c,cdp2w10_g18_s5_w3c3c1b32c-cb80-4ff4-ac4e-7f47a3e3652f,cdp2w10_g18_s5_w14e3b2c31-3c99-4421-ab56-af096c19748c,cdp2w10_g18_s5_w5f85796f0-b369-4495-bc8a-d9147a2f283d,cdp2w10_g18_s5_w4da9e8f2a-608c-4bf4-a411-eed81bd5c6df,61,2502
1944,31021.0,25665-P12-5,BRD-K63675182-003-16-0,25665,P12,5,SA1855000,trifluopromazine,INN,CN(C)CCCN1c2ccccc2Sc2ccc(cc12)C(F)(F)F,XSCGXQMFQXDFCW-UHFFFAOYSA-N,cdp2w12_p12_s5_w2fd81883a-a737-4327-b0e6-d69cee8993c4,cdp2w12_p12_s5_w3d4f66c00-5952-41f3-a76e-3ecee34c4af3,cdp2w12_p12_s5_w1766d36dc-e8b9-4afd-bee7-8d4848847ea0,cdp2w12_p12_s5_w51604f45b-7590-46ff-aca4-4955987474c4,cdp2w12_p12_s5_w4c8e8b9c1-8e85-4946-a0ad-d9003f1540bf,88,232
1945,24795.0,25583-O14-1,BRD-K18917286-001-04-7,25583,O14,1,SA1860031,BRD-K18917286,BROAD_CPD_ID,O=C(NNc1nc2ccccc2o1)c1ccccc1,XSCYPIMTGGCJGO-UHFFFAOYSA-N,cdp2w11_o14_s1_w2e5d4ac01-90ea-43a9-a07b-de22c5787adc,cdp2w11_o14_s1_w370041e00-5ff1-4241-9775-7d2a9df990c3,cdp2w11_o14_s1_w1e3c95f1f-94d5-4dbd-b3d2-5a11896025ee,cdp2w11_o14_s1_w5120e94c1-efdd-4816-80fa-3c94fea3f9ce,cdp2w11_o14_s1_w41d7a3c71-03b7-413f-b8de-a404cc830268,66,3214
1946,50678.0,26138-N22-6,BRD-K83690550-001-05-6,26138,N22,6,SA1853058,BRD-K83690550,BROAD_CPD_ID,Cc1ccccc1Cn1c(O)c(N=NC(S)=Nc2ccccc2F)c2ccccc12,XSJVYXNQHHZDJN-UHFFFAOYSA-N,cdp2w9x2_n22_s6_w28fcb07fd-dfef-4757-bfae-a8aa58260def,cdp2w9x2_n22_s6_w3e232d697-ff5f-4d35-80db-633da74f88b6,cdp2w9x2_n22_s6_w1813e3d7b-0d5c-4997-b769-3f4c952504f8,cdp2w9x2_n22_s6_w506a88489-e879-486d-bdd2-dd8141059942,cdp2w9x2_n22_s6_w40c5628db-c071-406d-af9e-58f95d41ebf1,48,9193
1947,48503.0,26118-E19-3,BRD-K32423284-001-05-7,26118,E19,3,SA1856156,BRD-K32423284,BROAD_CPD_ID,CCc1cc2c(N=Nc3c(O)[nH]c4ccccc34)ncnc2s1,XSUZDTDXCBFOBM-UHFFFAOYSA-N,cdp2w9x2_e19_s3_w2360136c9-c84e-48a8-b4eb-4e6cf0fdbaf2,cdp2w9x2_e19_s3_w32c7106af-353b-49a9-9fc6-6a74dc10f144,cdp2w9x2_e19_s3_w11e2c2caa-1614-4a61-aaf7-f9d1b1a833f0,cdp2w9x2_e19_s3_w5f4f842f5-14f0-4692-b86e-e31efd81adb0,cdp2w9x2_e19_s3_w47c1510b5-cee5-47de-9fc8-3e8b22274125,57,9419
1948,27027.0,25593-K08-1,BRD-K73523821-001-05-4,25593,K08,1,SA1854290,BRD-K73523821,BROAD_CPD_ID,COc1ccc(\C=C2/SC(=S)N(CCC(=O)NC3=NCCS3)C2=O)cc1OC,XTEVMDVJWSDMHG-UVTDQMKNSA-N,cdp2w11_k08_s1_w2b6e9da97-9dfd-428f-b618-60ebe7856e6c,cdp2w11_k08_s1_w3498c73ba-e87b-4e1c-9ebc-1535464bdfdc,cdp2w11_k08_s1_w10d062388-e81e-4fd5-a065-d9c8af5005f9,cdp2w11_k08_s1_w534d649dc-1b00-4260-83fa-d927e09eaa91,cdp2w11_k08_s1_w4da63f36f-bf72-4cc9-a36c-1f3db3c4cc4c,80,4397
1949,28461.0,25605-N10-1,BRD-K12624245-001-05-2,25605,N10,1,SA1858542,BRD-K12624245,BROAD_CPD_ID,COc1ccc2N(C(=O)CSc3nnc(o3)-c3ccc(C)cc3)C(C)(C)C=C(C)c2c1,XTWMSZMFOLXMFC-UHFFFAOYSA-N,cdp2w11-au00029692_n10_s1_w20927a62f-9d33-4251-819c-8bf2d34a81f8,cdp2w11-au00029692_n10_s1_w32e0530c0-1da5-464b-b7b1-43b0202194d9,cdp2w11-au00029692_n10_s1_w1c9f654e7-c9c6-4592-abc9-7139f01dcb4d,cdp2w11-au00029692_n10_s1_w5565c83b3-144e-4b20-8405-433349fd0a12,cdp2w11-au00029692_n10_s1_w4883ef549-b9c5-49ab-a949-c147291fef89,64,1285
1950,8663.0,24651-M17-3,BRD-K66703091-001-02-1,24651,M17,3,SA847574,BRD-K66703091,BROAD_CPD_ID,C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(F)cc2)Oc2ncc(cc2C1=O)C#Cc1cccnc1,XTWZIVUPDNYJMX-IZVMNLJQSA-N,cdp2w3_m17_s3_w263806608-dee9-4b37-ae28-4b5a5d506f33,cdp2w3_m17_s3_w3bb42ea42-e51f-423f-9b6a-a909e812ff7a,cdp2w3_m17_s3_w13e0d4abc-41d9-43ad-9932-88b0b95999df,cdp2w3_m17_s3_w59a2e0b58-07fd-4795-8069-a8fd4c78414f,cdp2w3_m17_s3_w4e0d2b3ab-d63f-4c23-84f8-0f73d9c9e937,94,9966
1951,7103.0,24357-F23-6,BRD-K66093087-001-01-5,24357,F23,6,SA82579,FGIN-1-43,to-be-curated,CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccc(Cl)cc12)-c1ccc(Cl)cc1,XTZUPNNVXIMWAR-UHFFFAOYSA-N,cdp2bioactives_f23_s6_w2a6499bfd-7e58-439b-a1ee-b07e1c99ebb9,cdp2bioactives_f23_s6_w344cd213a-ef98-4a27-9305-1b4d64146732,cdp2bioactives_f23_s6_w192eb164b-6bb9-4101-b53f-2f83793b55b5,cdp2bioactives_f23_s6_w5a9f45415-464a-404d-9015-dc7ac6feaf3a,cdp2bioactives_f23_s6_w4f1735ecc-f443-42b2-9b83-685fe68fc318,119,741
1952,37092.0,25707-H20-4,BRD-K88578764-001-05-0,25707,H20,4,SA1856737,BRD-K88578764,BROAD_CPD_ID,CCc1cccc(C)c1N=C(S)NCc1cccn1C,XUAZDDKUQXFIIH-UHFFFAOYSA-N,cdp2w12_h20_s4_w2ac320e6a-71a1-4700-92cb-4995db639a77,cdp2w12_h20_s4_w3a19940f2-e161-43a4-80cc-a0787456446f,cdp2w12_h20_s4_w1312dfb66-e212-458a-97a6-5b7eccc63cc4,cdp2w12_h20_s4_w5c662801f-3991-4888-8822-208d54521bc6,cdp2w12_h20_s4_w4b0bbd744-c0fb-4346-b15b-fe0150051d2d,46,4803
1953,2991.0,24305-B06-4,BRD-K00673382-001-04-9,24305,B06,4,SA59307,famotidine,INN,NC(N)=Nc1nc(CSCC\C(N)=N/S(N)(=O)=O)cs1,XUFQPHANEAPEMJ-UHFFFAOYSA-N,cdp2bioactives_b06_s4_w2931fbff7-9999-4592-887c-bc6310d6b78b,cdp2bioactives_b06_s4_w3487cf2a6-5925-44d5-88fd-b7648147958f,cdp2bioactives_b06_s4_w17479b32c-0317-488b-83e0-138f0f586b5d,cdp2bioactives_b06_s4_w5bb0e5ae7-8975-4529-a1ac-47d2bafefb50,cdp2bioactives_b06_s4_w4b37778ff-1bea-43ba-91b1-4af958a5bdb5,113,544
1954,52972.0,26204-J12-2,BRD-K89389568-001-05-9,26204,J12,2,SA1852756,BRD-K89389568,BROAD_CPD_ID,Cc1cc(NC(=O)c2ccc3OCOc3c2)ccc1NC(=O)c1ccccc1,XULWUJNRHNYSSD-UHFFFAOYSA-N,cdp2w9x2-au00026617_j12_s2_w247bac5e5-f25e-4045-bca9-5607000a222e,cdp2w9x2-au00026617_j12_s2_w3d7c82914-94e7-4b2d-80ce-1d884fe6f20e,cdp2w9x2-au00026617_j12_s2_w1b7c22472-698b-46ba-bf19-5263bc7376e9,cdp2w9x2-au00026617_j12_s2_w5ab082513-b730-4b63-a4b0-8112819fc79f,cdp2w9x2-au00026617_j12_s2_w4fde634a5-c8b6-4212-be4b-616f086c6f4b,92,7393
1955,46587.0,26071-E17-1,BRD-K29383520-001-05-2,26071,E17,1,SA1854908,BRD-K29383520,BROAD_CPD_ID,Oc1ccc2occ(C=C3C(=O)NC(=O)NC3=O)c(=O)c2c1,XUPMGKJTBJKYGZ-UHFFFAOYSA-N,cdp2w9x2_e17_s1_w2c41be97d-2357-41d1-9cc3-cdf9c93297e0,cdp2w9x2_e17_s1_w36c8dca95-0b68-48be-b7a5-f0fb5b988848,cdp2w9x2_e17_s1_w175e68251-0be3-475e-b9d9-dc93d8979711,cdp2w9x2_e17_s1_w5428379af-a118-4047-b25b-450b08973bfc,cdp2w9x2_e17_s1_w43abd3dd1-736e-4fa4-a6eb-d93f0282ceb2,62,6551
1956,15229.0,25428-A22-5,BRD-K22729678-001-05-3,25428,A22,5,SA1856691,BRD-K22729678,BROAD_CPD_ID,Cn1c(CSc2ccccc2)c(C#N)c2ccccc12,XUTSPRNFWFULEQ-UHFFFAOYSA-N,cdp2w10_a22_s5_w282d11972-1e48-4a49-bb1c-17722f2c934d,cdp2w10_a22_s5_w39e483e50-48c4-40b2-8794-acb2e8b5b333,cdp2w10_a22_s5_w1b2c9ef19-bf86-4b90-b48b-d849b6c1a30d,cdp2w10_a22_s5_w5100e6f00-9fe2-4eee-8ad1-69226f426875,cdp2w10_a22_s5_w403f4aaa4-8403-4bc4-9df9-dd11921f1cf4,39,4068
1957,10798.0,25380-M19-2,BRD-K24766052-001-05-9,25380,M19,2,SA1852707,BRD-K24766052,BROAD_CPD_ID,CN(c1ccc(cc1)C(=O)NCCSCc1ccc(Cl)cc1)S(=O)(=O)c1ccccc1,XUUBMSFXUIFJBX-UHFFFAOYSA-N,cdp2w10_m19_s2_w2fdd2bbaf-43c2-4afc-b231-0a858d2f3e37,cdp2w10_m19_s2_w33a50263d-c679-4ff8-996d-bdace5b8775a,cdp2w10_m19_s2_w139a11849-51a7-4bd4-830c-3500e35770a8,cdp2w10_m19_s2_w5ad173200-977f-4357-996b-ce33399d833f,cdp2w10_m19_s2_w4a3febf97-10ed-48e4-892a-51c87c942e0a,54,3659
1958,22710.0,25575-E18-4,BRD-K46818361-001-05-8,25575,E18,4,SA1852902,BRD-K46818361,BROAD_CPD_ID,CCOC(=O)CSc1ncnc2n(ncc12)-c1ccc(C)cc1,XUVHWWHRMKGYMV-UHFFFAOYSA-N,cdp2w11_e18_s4_w2dc09a628-1ee0-4f92-82d9-2af3b3e4b39b,cdp2w11_e18_s4_w32de49749-7658-4efa-a618-fae56f4e031b,cdp2w11_e18_s4_w1837ae317-0fcd-4aeb-bfbe-b5e8c9cf37c1,cdp2w11_e18_s4_w5c7d65d38-c82a-419c-bd81-36ac8a5c2977,cdp2w11_e18_s4_w4ef5641b6-027d-4f65-ab26-40564568e593,82,7874
1959,52140.0,26181-K19-4,BRD-K02328763-001-05-4,26181,K19,4,SA1856708,BRD-K02328763,BROAD_CPD_ID,CCOC(=O)C(\C#N)=C1\C=CN(C=N\1)c1ccccc1,XUZZXSRZRBGXHG-YPKPFQOOSA-N,cdp2w9x2-au00026617_k19_s4_w2f3bedfb7-9366-4655-a770-6fc305c8dfd6,cdp2w9x2-au00026617_k19_s4_w343adbd0b-ac2d-469b-9fcb-a2c3c5c5f041,cdp2w9x2-au00026617_k19_s4_w12e0f9cc1-1ed1-49c3-9b87-53e7de4b4966,cdp2w9x2-au00026617_k19_s4_w53ef55159-71ac-41f1-8cfd-43d1024e4faa,cdp2w9x2-au00026617_k19_s4_w4a3415d83-d85b-4bdd-b06c-50bc3d590c15,54,6312
1960,22308.0,25572-P17-4,BRD-K30625361-001-05-5,25572,P17,4,SA1862135,BRD-K30625361,BROAD_CPD_ID,Fc1cccc2sc(Nc3nc4c(F)cccc4s3)nc12,XWIBJZAZVONZEX-UHFFFAOYSA-N,cdp2w11_p17_s4_w24ab23b9d-ddd8-4d96-a9e6-89fedc322948,cdp2w11_p17_s4_w34f5dc5ee-c091-4855-8afa-16589dbee6cd,cdp2w11_p17_s4_w1bbda2ebe-ea51-4e38-8399-948feb0943fb,cdp2w11_p17_s4_w5fe2284d8-3ef1-4b15-b1f2-c2d5fdfdab24,cdp2w11_p17_s4_w467d2311f-a232-4a76-9b05-e68002e676d2,70,3075
1961,12355.0,25406-I09-5,BRD-K94106078-001-05-3,25406,I09,5,SA1859723,BRD-K94106078,BROAD_CPD_ID,Cc1cc(NC(=O)NC(=O)c2cccc(OC(F)(F)C(F)F)c2)[nH]n1,XWJGHYGODJVHOT-UHFFFAOYSA-N,cdp2w10_i09_s5_w24efa0037-25a2-4761-87f9-ac98898eafb5,cdp2w10_i09_s5_w3ebbb857e-693d-4737-8056-51a556a541de,cdp2w10_i09_s5_w132f7a865-2728-4acc-a2f1-ffa29d3144b0,cdp2w10_i09_s5_w5a92d22b8-8cf5-44d0-91d8-7a1d2f055166,cdp2w10_i09_s5_w4e9698172-318d-49d5-988d-a8b4af56b2dd,53,8264
1962,53125.0,26205-C05-5,BRD-K05640578-001-05-4,26205,C05,5,SA1858243,BRD-K05640578,BROAD_CPD_ID,CC(C)P(=O)(Cc1cccc(c1)C#N)C(C)C,XWXLGRKZBVPABR-UHFFFAOYSA-N,cdp2w9x2-au00026617_c05_s5_w23cc1c846-0b7e-43a0-9073-9509bb684698,cdp2w9x2-au00026617_c05_s5_w3614919db-20f6-418f-98ad-e551ff91a3b4,cdp2w9x2-au00026617_c05_s5_w105652811-4376-4247-a9b2-632e49bc67c1,cdp2w9x2-au00026617_c05_s5_w59615e8a6-010c-4201-9e76-be15299deb6d,cdp2w9x2-au00026617_c05_s5_w434166086-7fdc-44c8-9844-608c858b824d,71,5738
1963,24148.0,25580-O04-2,BRD-K07254242-001-05-8,25580,O04,2,SA1860600,BRD-K07254242,BROAD_CPD_ID,COc1cc(N2CCCC2)c(OC)cc1\C=C1/SC(=O)N(C)C1=O,XXLXNBVPIJNYMH-DHDCSXOGSA-N,cdp2w11_o04_s2_w2f5f53a42-298a-45e6-b135-162b0bd6dd6a,cdp2w11_o04_s2_w3b3297ce7-f292-4e2c-b6ac-bb362cbe18c9,cdp2w11_o04_s2_w171281a8f-679c-400f-8695-91d6cf1f2a76,cdp2w11_o04_s2_w5f97c2379-90c0-484f-b195-62206676d496,cdp2w11_o04_s2_w4fe0a7b39-b2f8-42ec-b4d4-e3071b8bf9ff,46,7803
1964,55230.0,26271-K17-4,BRD-K11275619-001-04-5,26271,K17,4,SA1861715,BRD-K11275619,BROAD_CPD_ID,Cn1cccc1Cc1nnc(SCC(=O)Nc2ccc3OCCOc3c2)n1-c1ccc(F)cc1,XXNSCVDJXOAZKG-UHFFFAOYSA-N,cdp2w9x2-au00026606_k17_s4_w284eedda9-b706-42fa-9a79-f33f7139cf3b,cdp2w9x2-au00026606_k17_s4_w3b70ab8bb-ec75-421e-be20-6998475c4dc2,cdp2w9x2-au00026606_k17_s4_w1824f3a14-d458-4938-8e87-07ae2a9134c0,cdp2w9x2-au00026606_k17_s4_w5241255e1-49d8-4e01-845b-0a2d36ba1a8b,cdp2w9x2-au00026606_k17_s4_w40881751a-e065-41aa-9d65-3c5a30070817,40,7707
1965,2258.0,24300-K04-3,BRD-A29644307-050-04-8,24300,K04,3,SA58843,nomifensine,INN,CN1CC(c2ccccc2)c2cccc(N)c2C1,XXPANQJNYNUNES-UHFFFAOYSA-N,cdp2bioactives_k04_s3_w25d6476bf-e38a-4618-ae18-7f71c8c83302,cdp2bioactives_k04_s3_w30c2094d5-32e4-44b4-8480-11e02f9959b3,cdp2bioactives_k04_s3_w15beca749-fbeb-4118-b545-7e5b46ed7106,cdp2bioactives_k04_s3_w51ee1ef63-d018-4849-9eb6-579f0dd92462,cdp2bioactives_k04_s3_w4e1c6f464-b44c-4218-8eb1-205b1b4a8f55,112,216
1966,47165.0,26092-D20-3,BRD-K32476586-001-05-0,26092,D20,3,SA1854708,BRD-K32476586,BROAD_CPD_ID,ON1N(c2cc([nH]n2)-c2ccccc2)C(=O)Nc2ccccc12,XXQRNOQRMWRZTA-UHFFFAOYSA-N,cdp2w9-au00026609_d20_s3_w2683c939a-0790-477d-8f88-7252e2ec73db,cdp2w9-au00026609_d20_s3_w3d5a9bc48-f8b3-4460-8ffd-5781294038b0,cdp2w9-au00026609_d20_s3_w14a1eacd9-5847-4d84-ba41-171847c86c54,cdp2w9-au00026609_d20_s3_w52d583e1e-af3f-4c48-8e7c-295a64e625b4,cdp2w9-au00026609_d20_s3_w47b465df8-dac4-409a-8e02-516771e5fc65,79,2477
1967,19275.0,25553-I22-1,BRD-K79431521-001-05-7,25553,I22,1,SA1861967,BRD-K79431521,BROAD_CPD_ID,CCc1ccc(cc1)-n1c(C)nc2cc(ccc12)C(=O)NCc1cccnc1,XYXJYESAJITLHX-UHFFFAOYSA-N,cdp2w11-au00029679_i22_s1_w2cd92eaa1-b2a6-40f7-8d1e-ced223c1db15,cdp2w11-au00029679_i22_s1_w3bf7eac6c-6da8-40ee-a890-0b32f284302b,cdp2w11-au00029679_i22_s1_w1bdaf3aa0-7962-428a-95bd-9973edb5181d,cdp2w11-au00029679_i22_s1_w5ca546f6c-4003-464a-b833-77096e213ac5,cdp2w11-au00029679_i22_s1_w45784fb2c-8ed3-4606-87de-3262f1ece98a,85,9294
1968,15063.0,25426-I19-1,BRD-A91821072-001-06-6,25426,I19,1,SA1853377,BRD-A91821072,BROAD_CPD_ID,CCCc1n[nH]c(O)c1C(C(C#N)C#N)c1cccc(Cl)c1,XZBNCNIMVWBANH-UHFFFAOYSA-N,cdp2w10_i19_s1_w2eb5afe59-aa5f-4a42-9b46-757b1a76e534,cdp2w10_i19_s1_w30a9d07e2-4261-410e-90f0-a61ac35f343e,cdp2w10_i19_s1_w181429450-6193-4453-947a-a269b180aa83,cdp2w10_i19_s1_w5247727ba-a054-49c6-bcd0-366b7f2921b0,cdp2w10_i19_s1_w4b453acac-d303-4adf-9da7-9e43c459f430,53,6360
1969,42446.0,25968-G02-6,BRD-K27499107-001-02-6,25968,G02,6,SA81978,carbacyclin,to-be-curated,CCCCC[C@H](O)\C=C\[C@H]1[C@H](O)C[C@@H]2C\C(C[C@H]12)=C/CCCC(O)=O,XZFRIPGNUQRGPI-WBQKLGIQSA-N,cdp2w8x2_g02_s6_w2254320ce-8824-4539-8b0c-9463a6a2e20e,cdp2w8x2_g02_s6_w3a7308321-1c29-44a5-8c51-8a48a4037b31,cdp2w8x2_g02_s6_w1cb4802ab-46a9-48d8-8d8a-4f45d8ab1af0,cdp2w8x2_g02_s6_w5b5c5b225-a541-46af-ab9a-0e8a6ac6a1ba,cdp2w8x2_g02_s6_w46b1da548-be07-46a0-977c-4059d88445c0,56,905
1970,55131.0,26271-H06-1,BRD-A80035237-001-06-8,26271,H06,1,SA1860959,BRD-A80035237,BROAD_CPD_ID,OC(=O)CC1SC(=O)N(Cc2ccccc2)C1=O,XZHWHTSOQTXOTL-UHFFFAOYSA-N,cdp2w9x2-au00026606_h06_s1_w24fec869c-c31a-4d78-aef5-395d021eddf8,cdp2w9x2-au00026606_h06_s1_w3a039f667-b6a5-450e-b85f-f5cd93a28d78,cdp2w9x2-au00026606_h06_s1_w1253d1433-6854-4651-8546-7f2c0fca1e1a,cdp2w9x2-au00026606_h06_s1_w526ac9f25-ef1a-49c9-8673-a287a6e69e2e,cdp2w9x2-au00026606_h06_s1_w40c39b9c6-a2ce-4c4b-997f-12e050610d89,74,10555
1971,34262.0,25686-D22-6,BRD-K06805435-001-05-5,25686,D22,6,SA1861233,BRD-K06805435,BROAD_CPD_ID,CCCCCc1ccc(CC(O)=O)cc1,YAAVVJAWWNQMCY-UHFFFAOYSA-N,cdp2w12_d22_s6_w23a4edad8-d95e-486e-99b7-0882af7776aa,cdp2w12_d22_s6_w3dbb2f94b-8b17-4a9b-b3d9-e8ad126449ba,cdp2w12_d22_s6_w18f04e5c5-dcdd-4c1a-9fc0-23d5904a4419,cdp2w12_d22_s6_w53b29ea6e-5fee-4925-99e5-c6a9e0e93c7a,cdp2w12_d22_s6_w464a8e4d8-75b4-4697-aab2-d0c104f85620,104,5948
1972,8234.0,24625-L09-6,BRD-K72394925-001-01-5,24625,L09,6,SA858537,BRD-K72394925,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1,YAJYINBQFXCAPI-RZIGYZOXSA-N,cdp2w3_l09_s6_w2a198cf7c-c555-4a1d-be2e-51d584f73748,cdp2w3_l09_s6_w394cf9dc2-7e86-4ad9-a328-5e0e35c21012,cdp2w3_l09_s6_w1c737edc7-8321-4da7-bb40-78fa3112d35e,cdp2w3_l09_s6_w5a71c721e-b6d6-46aa-a37c-b21d527bcddb,cdp2w3_l09_s6_w45546d1c3-c906-4abf-a1fe-e5a51a421a8b,102,10572
1973,8227.0,24624-P02-5,BRD-K21216961-001-01-7,24624,P02,5,SA852469,BRD-K21216961,BROAD_CPD_ID,C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2cc(ccc2S1(=O)=O)C#Cc1cccc(F)c1,YAJYINBQFXCAPI-TYPXCFOJSA-N,cdp2w3_p02_s5_w2f9aaeb70-03b3-4456-98a8-63ad3310c07e,cdp2w3_p02_s5_w32d694853-5c9a-4cb2-b6fd-ca8ed2eec7d6,cdp2w3_p02_s5_w1177e70a6-3074-4168-b331-a151f6aa4957,cdp2w3_p02_s5_w565f4f923-52b3-4a8d-9b57-60a4966c14a3,cdp2w3_p02_s5_w477de4a29-4873-47d2-8acf-b9eefa74a17c,79,10166
1974,14213.0,25420-L10-3,BRD-K39399785-001-05-6,25420,L10,3,SA1861155,BRD-K39399785,BROAD_CPD_ID,Nc1cccnc1Sc1cc(Cl)c(Cl)cc1Cl,YAOQBIXSQAUGGK-UHFFFAOYSA-N,cdp2w10_l10_s3_w226f0e8c4-d76e-43c8-98a7-873a1fa85c5a,cdp2w10_l10_s3_w3e6e85c5b-c35c-4d23-b03e-431940cf2dc5,cdp2w10_l10_s3_w19e26a94d-5d84-4e6f-836d-e7b5bad7172c,cdp2w10_l10_s3_w54e36312f-8e1a-4ed2-973b-8392274c3511,cdp2w10_l10_s3_w432094388-e651-43ad-835d-25246fa1fd86,75,6418
1975,46875.0,26081-D19-1,BRD-A08363225-001-05-9,26081,D19,1,SA1857785,BRD-A08363225,BROAD_CPD_ID,CC(C)CN(CCNC(=O)CS(=O)Cc1nc(oc1C)-c1ccc(C)cc1)CC(C)C,YAQVZKXUXBRCQA-UHFFFAOYSA-N,u00026613_d19_s1_w25ee97448-2f4f-43e5-b4b5-a22d91bc678b,u00026613_d19_s1_w3fa078c94-44b3-42b1-8a61-98df260bb11e,u00026613_d19_s1_w18562a0c3-f6a5-488c-a386-4ab6df4210f6,u00026613_d19_s1_w555206075-9e72-431a-9ac5-3e8730fbde65,u00026613_d19_s1_w404e564f9-1077-4e95-a26e-a366bf9d18be,107,8346
1976,32465.0,25677-P03-3,BRD-A82307057-001-05-8,25677,P03,3,SA1857692,BRD-A82307057,BROAD_CPD_ID,CCC(C)N=C(S)N(CCc1ccccc1)Cc1cc2cc(OC)c(OC)cc2nc1O,YAZOIIMRVUPEOT-UHFFFAOYSA-N,cdp2w12_p03_s3_w231d0b3ee-9579-4462-b4cb-adab2a9a9fd8,cdp2w12_p03_s3_w3abea44b1-8ef0-4569-bf02-63602e681830,cdp2w12_p03_s3_w1c0651dca-7837-45d6-843d-54bc521ef7de,cdp2w12_p03_s3_w50f0da02b-95e8-4921-a167-22dd2ff8f5c6,cdp2w12_p03_s3_w4c1ca0a53-bac4-4884-bf69-57f1efa31ff4,37,1472
1977,24067.0,25580-L09-5,BRD-K19274991-001-05-5,25580,L09,5,SA1855201,BRD-K19274991,BROAD_CPD_ID,COc1nc(ccc1-c1noc(n1)-c1cccnc1)-c1ccc(C)cc1,YAZZRSRSFPKDSY-UHFFFAOYSA-N,cdp2w11_l09_s5_w29e98f072-db2c-4d5f-9dff-4c380969c696,cdp2w11_l09_s5_w3fbd621b4-2528-46e5-89ad-ce91cffd0337,cdp2w11_l09_s5_w1a8308fed-3661-4a70-9244-124b1c6a1661,cdp2w11_l09_s5_w56b98927c-d7a5-4dfd-ac56-07d65b7b0d5c,cdp2w11_l09_s5_w48b74034e-8d6d-4386-b730-8a8893c955ad,50,8368
1978,22214.0,25572-L10-6,BRD-K47550819-001-05-4,25572,L10,6,SA1856146,BRD-K47550819,BROAD_CPD_ID,CN1C(=S)NC(=O)\C(=C/c2cc(C)n(C3CCCCC3)c2C)C1=O,YBBPQSODVBZFET-XNTDXEJSSA-N,cdp2w11_l10_s6_w27b048f3b-e131-4537-b50a-7d53b37edfd5,cdp2w11_l10_s6_w3bea47177-0429-4ea0-a292-a5d0a2f5ce9d,cdp2w11_l10_s6_w1e65c6067-00b4-4419-93e0-83a4acc8f8fd,cdp2w11_l10_s6_w5a329ab84-cbc3-49a1-82d1-eab41751fc21,cdp2w11_l10_s6_w48f211026-92e4-468c-a6bd-5cf2fdff5a23,80,7056
1979,56383.0,26765-D01-5,BRD-K01594626-001-01-8,26765,D01,5,SA1017504,BRD-K01594626,BROAD_CPD_ID,CC(C)(C)[S@](=O)N1Cc2cc(nc(c2[C@@H]1CCO)-c1cccc(c1)-c1cncnc1)C(=O)NCc1ccccc1F,YBJDMCPYPJWKRF-JNGYJVBXSA-N,cdp2w13_d01_s5_w2a7360111-a1ec-48d8-8daf-45c7359899f2,cdp2w13_d01_s5_w39ebffe50-3e27-4fda-aeae-9eb15a0504a7,cdp2w13_d01_s5_w1a05940ea-41e2-46a4-95d3-22fd471c5d3f,cdp2w13_d01_s5_w5ad21a78e-12bb-4b33-ac4c-2cad83697f4a,cdp2w13_d01_s5_w4d5595560-5104-45f0-9a29-b7937085c38e,53,10359
1980,13369.0,25414-L04-5,BRD-K38356122-001-06-7,25414,L04,5,SA1856980,BRD-K38356122,BROAD_CPD_ID,CCn1c(SCC(=O)OC)nnc1-c1ccncc1,YBPFZJMRZBVTBK-UHFFFAOYSA-N,cdp2w10_l04_s5_w2881f6f5a-ad85-4305-8dd3-651653adb53c,cdp2w10_l04_s5_w382ae2496-fccc-48f1-bc84-f60f074910ce,cdp2w10_l04_s5_w15b460d6e-a417-4bde-a3f6-4b864719170d,cdp2w10_l04_s5_w5b1d79396-fd8c-4994-8da0-c74a11d0e99a,cdp2w10_l04_s5_w40f74d5ec-fdc9-4a9c-8b0c-af6f6674a055,81,4043
1981,10226.0,25376-F22-6,BRD-K31713127-001-05-3,25376,F22,6,SA1857712,BRD-K31713127,BROAD_CPD_ID,Cc1ccc(\C=C2\NC(=O)N(Cc3ccccc3F)C2=O)o1,YBPHTKMACUYNBI-RIYZIHGNSA-N,cdp2w10_f22_s6_w29c46f975-3225-465b-930a-6719deeb8b21,cdp2w10_f22_s6_w33448ea22-261f-4dce-abf0-05a471a89e42,cdp2w10_f22_s6_w1f59ca693-f2bb-4740-89f8-2a0b5ff94c22,cdp2w10_f22_s6_w54a6a9d2f-9d7b-4c34-8320-e7bb1ed834ff,cdp2w10_f22_s6_w4759113b0-fb54-44ab-839e-382f3fbe7f3f,30,8035
1982,23285.0,25578-C12-3,BRD-K11045750-001-05-8,25578,C12,3,SA1858318,BRD-K11045750,BROAD_CPD_ID,COc1ccc(cc1)-c1nc(SC)n(n1)S(=O)(=O)c1ccccc1,YBRGSFBFGNUDDE-UHFFFAOYSA-N,cdp2w11_c12_s3_w2fdba762c-d537-469a-aa41-1f8d16e0af20,cdp2w11_c12_s3_w3d675d893-67f0-4a80-be24-9f048944fb2c,cdp2w11_c12_s3_w1dc9e4cda-ee4b-4691-943d-873eb171167b,cdp2w11_c12_s3_w5c1b6c7d1-c40d-4903-8322-ee418fcc830f,cdp2w11_c12_s3_w42e283448-5da5-40ab-8606-a52646707fb7,75,3168
1983,49970.0,26133-M09-6,BRD-A09988375-001-05-0,26133,M09,6,SA1853258,BRD-A09988375,BROAD_CPD_ID,Fc1ccccc1C(N(Cc1ccco1)C(=O)Cn1nnc2ccccc12)C(=O)NC1CCCCC1,YCQRDFYHFNERSC-UHFFFAOYSA-N,cdp2w9x2_m09_s6_w2555aa038-36d0-44d0-bd8e-170da47abc7f,cdp2w9x2_m09_s6_w31a80f081-a8ef-48c5-9393-99d465397151,cdp2w9x2_m09_s6_w18175f88f-c9ba-40b3-abee-fa6ae0e39bd2,cdp2w9x2_m09_s6_w533036a4a-855f-4dd3-99be-ae5a442c86c1,cdp2w9x2_m09_s6_w4e9de3df1-285b-476f-a783-eb643d28491d,82,6777
1984,6253.0,24320-H23-2,BRD-K68188368-001-03-7,24320,H23,2,SA83419,nifuroxazide,INN,Oc1ccc(cc1)C(=O)N\N=C\c1ccc(o1)[N+]([O-])=O,YCWSUKQGVSGXJO-NTUHNPAUSA-N,cdp2bioactives_h23_s2_w2d973956f-19b5-4547-8cb7-f1a5296044ee,cdp2bioactives_h23_s2_w3f7f2447d-5db0-440c-a341-285db4143a80,cdp2bioactives_h23_s2_w1576e9b7f-308f-41a7-8db7-f1d1c8f48b9e,cdp2bioactives_h23_s2_w5552b3004-1240-4f13-aded-72ceda68d0d0,cdp2bioactives_h23_s2_w4a8997363-b59f-4046-b2fa-5fddefbccba3,127,1034
1985,9169.0,24735-E11-5,BRD-K52240583-001-02-5,24735,E11,5,SA666904,BRD-K52240583,BROAD_CPD_ID,C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccccc2)OCc2cnnn2CCCC1=O,YDFSFENEUSKTIZ-OPYAIIAOSA-N,cdp2w5_e11_s5_w2a314b23f-e473-4a0c-8d8c-f9b32840576d,cdp2w5_e11_s5_w3e2639ae2-f8a9-4880-83be-1871fd4bc9ae,cdp2w5_e11_s5_w100c8f4e4-9e0f-4a5a-a597-fe3171cc1858,cdp2w5_e11_s5_w59b917d05-3be6-4bc5-bc76-aaac8ff2b1c9,cdp2w5_e11_s5_w4419b1d19-d206-431b-9ee3-06d7fa0c32da,61,9873
1986,17530.0,25485-F03-2,BRD-K56181586-001-08-1,25485,F03,2,SA1859578,BRD-K56181586,BROAD_CPD_ID,CN(C)CCCNc1ccc(cn1)-c1cc(Nc2cccc(Cl)c2)ncn1,YDJIFKISSQNAIS-UHFFFAOYSA-N,cdp2w10-au00024355_f03_s2_w262f0215e-f1ee-4c24-b747-deaaa9370eec,cdp2w10-au00024355_f03_s2_w3613302e6-f117-43d4-942e-212a016f0a47,cdp2w10-au00024355_f03_s2_w194f71719-cb22-4798-bcb5-8a7c80717cdc,cdp2w10-au00024355_f03_s2_w589f3488a-6ebf-438e-bac6-e51cbc268213,cdp2w10-au00024355_f03_s2_w407457427-d854-4863-af60-5649774dd823,29,2568
1987,11632.0,25391-P19-2,BRD-K94041209-001-05-4,25391,P19,2,SA1860686,BRD-K94041209,BROAD_CPD_ID,CC(C)(C)c1ccc(NC(S)=NCc2cccnc2)cc1,YDKKJFPEPKBMPC-UHFFFAOYSA-N,cdp2w10_p19_s2_w2e32ba05b-74e6-40ea-b5c1-92bfefbbc369,cdp2w10_p19_s2_w38f5cae54-2fa5-46bf-86e3-d2b571cb84ba,cdp2w10_p19_s2_w1e632cef6-8dad-44e8-99fe-b4b54a803867,cdp2w10_p19_s2_w5fc9d12a0-f70b-448c-8f69-3c0c914cbb57,cdp2w10_p19_s2_w44b5ed988-34f6-46b6-b97e-d145d1eeca99,41,9264
1988,43951.0,25986-O20-5,BRD-K59332007-300-01-9,25986,O20,5,SA792694,linopirdine,primary-common,O=C1N(c2ccccc2C1(Cc1ccncc1)Cc1ccncc1)c1ccccc1,YEJCDKJIEMIWRQ-UHFFFAOYSA-N,cdp2w8x2_o20_s5_w2985c7d76-0058-4152-9c03-44e72685e1c4,cdp2w8x2_o20_s5_w34e2c61cd-64aa-4cf6-b1bb-35bec6aa0399,cdp2w8x2_o20_s5_w145af17c6-108a-4da9-85a2-4d82c84bab2d,cdp2w8x2_o20_s5_w5b9beddc0-0d1c-4e80-91ff-4530ec30c53c,cdp2w8x2_o20_s5_w4fd70d4e0-e718-485d-b756-74b7e5ba26bc,52,740
1989,35496.0,25692-D05-4,BRD-K95631895-001-05-0,25692,D05,4,SA1853180,BRD-K95631895,BROAD_CPD_ID,COc1cccc(c1)-c1cc(nc(n1)N1CCOCC1)C(F)(F)F,YEQOIPOXVQAWPR-UHFFFAOYSA-N,cdp2w12_d05_s4_w2ef018928-0ffa-417a-844b-2dd308ece33e,cdp2w12_d05_s4_w3b13f2af3-75dd-4789-920b-3948b7e1c6ab,cdp2w12_d05_s4_w102005e3e-e82a-4d1e-a11b-e03ed3ab6667,cdp2w12_d05_s4_w5f77ca6ce-a270-4950-a447-e3f78ddc93f3,cdp2w12_d05_s4_w412de3634-55a6-4270-b9d3-55aad106ec80,45,6746
1990,15766.0,25430-N09-2,BRD-K01770318-001-05-8,25430,N09,2,SA1852280,BRD-K01770318,BROAD_CPD_ID,Cc1cc2c(cc(=O)oc2c2CCCNc12)C(F)(F)F,YEVSVVJFZFNNOU-UHFFFAOYSA-N,cdp2w10_n09_s2_w24e74c93d-6e34-4e39-9369-3dc4a691d41a,cdp2w10_n09_s2_w388b53595-dc89-403c-921d-63750eb4e0f3,cdp2w10_n09_s2_w1085d9172-3a16-4755-8524-8dba9ebeb759,cdp2w10_n09_s2_w55f3b5f9b-a1c1-4412-ae0c-508a16cb8859,cdp2w10_n09_s2_w4dfc22cdb-ef15-41f8-98ba-c46fd89fb664,56,8878
1991,48892.0,26124-F22-2,BRD-K45711183-001-05-2,26124,F22,2,SA1859112,BRD-K45711183,BROAD_CPD_ID,OC(=O)CCC(=O)Nc1ccc(cc1)C(=O)OC1CCCCC1,YFICWXXIIZUJIY-UHFFFAOYSA-N,cdp2w9x2_f22_s2_w242b61ae2-8468-43dc-b7dd-0794176de703,cdp2w9x2_f22_s2_w3d73f18fd-99cc-4536-8ef0-fd9d664cf4d9,cdp2w9x2_f22_s2_w178ab58fb-24f9-44bb-a9e5-9c157595963e,cdp2w9x2_f22_s2_w5fc6c8ec9-a677-47cd-941b-99bd6e9db7b9,cdp2w9x2_f22_s2_w45db4ee65-6dff-4ce8-9aa0-d6220619687e,87,6377
1992,24792.0,25583-O11-4,BRD-K58803272-001-04-6,25583,O11,4,SA1859706,BRD-K58803272,BROAD_CPD_ID,Cc1ccc2nc(NC(=O)Cn3cc4CCCCCc4n3)sc2c1,YFILQGOSMMYHAX-UHFFFAOYSA-N,cdp2w11_o11_s4_w2d576b01e-6bab-4390-84c5-c530f1bfd5ee,cdp2w11_o11_s4_w3aa553d19-b91e-4db4-9fa2-e04becc96d65,cdp2w11_o11_s4_w1f7abda3f-51d0-4c0b-86eb-770b2ec51544,cdp2w11_o11_s4_w543f6ef1a-9f94-4a11-a26e-81323e30eab2,cdp2w11_o11_s4_w49e27ff4e-4ca8-4181-a31c-299d20ea3f52,76,8682
1993,29704.0,25642-P20-2,BRD-K79678951-001-07-8,25642,P20,2,SA1852759,BRD-K79678951,BROAD_CPD_ID,CCN(CC)c1ccc(N\C=C2\C(=O)NC(=O)N(C2=O)c2ccccc2C)cc1,YFRDTLCUPHRUGB-JXAWBTAJSA-N,cdp2w12_p20_s2_w2af3c8182-da38-4f6b-8de5-556d8801202e,cdp2w12_p20_s2_w3dc18ef60-d246-405f-b7c5-658ef8a6b744,cdp2w12_p20_s2_w1e4566f1d-b794-4d22-8cc5-b65dc92d06d7,cdp2w12_p20_s2_w5b30d8778-6913-4b6a-9c5e-452c4d27b8c7,cdp2w12_p20_s2_w463d0ee78-74b2-45cb-baec-91992e2196c6,58,7234
1994,37063.0,25707-G11-5,BRD-A10330238-001-06-7,25707,G11,5,SA1858254,BRD-A10330238,BROAD_CPD_ID,Clc1ccc(cc1)N1C(=O)C2C3OC(CNS(=O)(=O)c4ccccc4)(C=C3)C2C1=O,YGAKRXYRDKCSCD-UHFFFAOYSA-N,cdp2w12_g11_s5_w2358248ff-892b-41eb-9309-463bbcd77b9a,cdp2w12_g11_s5_w3506f1cdc-aa62-4a5f-ac69-069991bd2a96,cdp2w12_g11_s5_w1a0301988-50f2-4158-8948-131e44be964e,cdp2w12_g11_s5_w5dd693cad-6c2a-4dfb-89f4-3a15aeb288dd,cdp2w12_g11_s5_w4a018c56d-6555-45bf-b190-2824b51cd8e4,50,7776
1995,32713.0,25678-L05-5,BRD-K83133240-001-06-1,25678,L05,5,SA1855967,BRD-K83133240,BROAD_CPD_ID,Fc1ccc(NC(=S)NC(=O)c2ccc3OCCOc3c2)cc1,YGFFRSMVZBWZAC-UHFFFAOYSA-N,cdp2w12_l05_s5_w27f294e06-b4ae-47b6-a435-a726aca35215,cdp2w12_l05_s5_w3b5376d66-8cf3-432b-9a39-ec62ddeeb7e9,cdp2w12_l05_s5_w17b2ec0d3-c44c-45e6-9ad3-712380bec8fc,cdp2w12_l05_s5_w5c7be6bc6-4ea2-40eb-b73a-f7acb7160f7b,cdp2w12_l05_s5_w465d67661-b004-45f0-a870-3a98bfee763a,21,9485
1996,42820.0,25983-F15-2,BRD-K27141178-001-01-0,25983,F15,2,SA82513,SB 203186,to-be-curated,O=C(OCCN1CCCCC1)c1c[nH]c2ccccc12,YGKPIROTKVQCCU-UHFFFAOYSA-N,cdp2w8x2_f15_s2_w2bf88593e-701e-4fdd-ab4c-5f6273f51f3e,cdp2w8x2_f15_s2_w38d4f31d6-c106-4788-a239-6b85c6ae3769,cdp2w8x2_f15_s2_w1adda4572-f688-48ab-8e0a-e4edc0ffac78,cdp2w8x2_f15_s2_w5f79bec45-bbc2-4b6a-9c4a-f4615cb93bd3,cdp2w8x2_f15_s2_w4a562f609-6e6c-43a7-95fb-7d48e821813d,62,1405
1997,31319.0,25674-A07-3,BRD-K34526507-001-05-6,25674,A07,3,SA1858744,BRD-K34526507,BROAD_CPD_ID,Cc1ccc(NC(S)=NCc2ccc3OCOc3c2)cc1,YHPFMNQEQIJIQS-UHFFFAOYSA-N,cdp2w12_a07_s3_w21bb9bc32-86dd-45ac-9009-1e0f41200946,cdp2w12_a07_s3_w392ef6311-0a5b-4416-b3e8-07bbf4a416ab,cdp2w12_a07_s3_w15a763f62-d783-4b11-81b3-7b978d4c81b7,cdp2w12_a07_s3_w5bd479779-5477-4df2-9880-e32834b3fa7b,cdp2w12_a07_s3_w4291c0a6f-b7fb-4695-9aed-1a4cc60d2859,52,4592
1998,43521.0,25985-F21-1,BRD-K47869605-001-04-9,25985,F21,1,SA58786,podophyllotoxin,BAN,COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@@H](O)c2cc3OCOc3cc12,YJGVMLPVUAXIQN-XVVDYKMHSA-N,cdp2w8x2_f21_s1_w2eb4f05b5-5963-4aa6-b466-af24c1dc1e17,cdp2w8x2_f21_s1_w36901b88a-140f-456d-bfc7-378b346ac7f4,cdp2w8x2_f21_s1_w120136286-eabf-4e66-8d2e-fe552b2bc131,cdp2w8x2_f21_s1_w5880ce234-e90a-4831-9a98-ff6066f315a1,cdp2w8x2_f21_s1_w49ac57d94-a0c6-4e1c-8586-8e4f18585aef,6,104
1999,32375.0,25677-K21-3,BRD-K55873363-001-06-7,25677,K21,3,SA1856942,BRD-K55873363,BROAD_CPD_ID,CN(C)c1ccc(Nc2ncnc3ccc(Br)cc23)cc1,YJXQXNMNLWGBKZ-UHFFFAOYSA-N,cdp2w12_k21_s3_w2f52256d6-c132-4ace-bee2-8549ca05668c,cdp2w12_k21_s3_w341b9decc-9c7a-44c3-a171-ee219cc511b6,cdp2w12_k21_s3_w16ebbe8a4-a740-4ec1-9709-7a7d61a8fc9d,cdp2w12_k21_s3_w51cb9f813-ba74-4682-bd1a-b8d12c944ad0,cdp2w12_k21_s3_w47fbfdeb6-5e8b-4fa1-968a-705c7bc66a7f,72,4006
2000,23863.0,25580-A03-5,BRD-K27871068-001-05-6,25580,A03,5,SA1854031,BRD-K27871068,BROAD_CPD_ID,CCOC(=O)c1sc(NC(=O)c2ccc(CC)s2)nc1C,YKFSPCPAAYVRLV-UHFFFAOYSA-N,cdp2w11_a03_s5_w2c759d7ff-e195-4db8-9e84-959822c2c889,cdp2w11_a03_s5_w35b6f7d75-5175-417c-8ce4-0c15e789ae0a,cdp2w11_a03_s5_w1be5a2183-6c37-4896-8695-9306cdabdaf9,cdp2w11_a03_s5_w5e7c27082-9c54-4422-83c3-be823e3f004e,cdp2w11_a03_s5_w4bfa84c23-b0f2-4c20-8674-1b4177a5110b,71,8339
2001,12961.0,25410-G04-5,BRD-K60421635-001-05-2,25410,G04,5,SA1853709,BRD-K60421635,BROAD_CPD_ID,Oc1nc2ccccc2c(O)c1C(=O)Nc1cccc(c1)C(F)(F)F,YKKFQSZQLFCFDP-UHFFFAOYSA-N,cdp2w10_g04_s5_w2abd77fd0-0304-423c-bd85-fb8c3620f42c,cdp2w10_g04_s5_w38e1c49d4-d5e9-405b-a408-761e7b0fce09,cdp2w10_g04_s5_w1f9778136-e0b1-42a1-b0f2-9cd99dc5042b,cdp2w10_g04_s5_w5bd7db092-f02c-4c2b-a89b-f68da3f394c3,cdp2w10_g04_s5_w49d730851-f005-4acd-adb8-1205acd4e6df,60,4887
2002,38332.0,25726-C11-2,BRD-K27980004-001-05-2,25726,C11,2,SA1857242,BRD-K27980004,BROAD_CPD_ID,COc1ccc(cc1)C(=O)NNC(=O)CSc1nnc(C)n1C,YLTHTTDLKLECTK-UHFFFAOYSA-N,cdp2w12_c11_s2_w2d5c86cb3-bf2c-4813-ae51-5e95858a0ec7,cdp2w12_c11_s2_w395d0c862-6c72-4148-94e7-9943cfed6e30,cdp2w12_c11_s2_w1e53d87b8-0c85-4eab-ade4-5934cbe67036,cdp2w12_c11_s2_w5b621ddd8-bc08-4fbe-b952-4443b9f47efb,cdp2w12_c11_s2_w4505adaab-f17b-4dcc-a0ba-937e12740faf,81,2043
2003,35353.0,25690-J21-5,BRD-K05577975-001-05-7,25690,J21,5,SA1860307,BRD-K05577975,BROAD_CPD_ID,Cn1c2ccccc2n2c1c(C#N)c(-c1ccccc1)c(Cl)c2=O,YMEAAIMKOVPHEM-UHFFFAOYSA-N,cdp2w12_j21_s5_w287c95df5-bc3d-4b2d-b401-5fc9b5ff4d31,cdp2w12_j21_s5_w368e8bdbc-90a1-4190-9147-1569eb7635cf,cdp2w12_j21_s5_w1a5a25a37-a6da-45f3-8d1d-a1531cce0385,cdp2w12_j21_s5_w5e2149b67-0ca7-4b94-92a0-3631a3254a74,cdp2w12_j21_s5_w42eb85daf-4f33-400d-a0ce-82f7584c3048,69,8464
2004,27327.0,25594-I18-1,BRD-K15620114-001-05-5,25594,I18,1,SA1859186,BRD-K15620114,BROAD_CPD_ID,Cc1ccc(C(=O)NC(=S)Nc2ccc3OCCOc3c2)c(C)c1,YMGUVTJMZDLHAP-UHFFFAOYSA-N,cdp2w11_i18_s1_w2251056ec-305b-4594-ac6e-d7b6cffaf9bc,cdp2w11_i18_s1_w3ab08df15-8ff4-44c9-b6bb-76a2774cb8e3,cdp2w11_i18_s1_w17c8c8196-8f24-469f-b317-73f5d7b5fe77,cdp2w11_i18_s1_w5147c2af6-e7e4-47f3-a8e5-98a9731e9d19,cdp2w11_i18_s1_w4a8d3d5c9-cbb3-4e63-8f42-e4b6efb6bc7c,59,8453
2005,37172.0,25707-K10-6,BRD-A62548643-001-05-2,25707,K10,6,SA1859057,BRD-A62548643,BROAD_CPD_ID,Brc1ccc(s1)S(=O)(=O)NCC1CCCO1,YMSHOOSWNDOXNW-UHFFFAOYSA-N,cdp2w12_k10_s6_w28c0152f7-6e60-4069-a807-bf47142c3dca,cdp2w12_k10_s6_w3153a0c57-3832-4661-9877-66ffe9f6d01e,cdp2w12_k10_s6_w1e0180847-6d63-49d8-aaf2-0cb51e22a053,cdp2w12_k10_s6_w5bd8a41f5-0e1f-42a1-a26d-3edc0f10cc41,cdp2w12_k10_s6_w482716a7c-937b-4485-b209-1e9ca2c12484,66,7419
2006,9751.0,25372-I11-5,BRD-K04657604-001-05-7,25372,I11,5,SA1854486,BRD-K04657604,BROAD_CPD_ID,O=C(Nc1ccccc1-c1ccccc1)c1cnccn1,YMUZIYQTUCGSNI-UHFFFAOYSA-N,cdp2w10_i11_s5_w22001b675-4674-429b-98dc-17c35ba59e6c,cdp2w10_i11_s5_w34004bc99-dfd1-458b-8b12-a2a1b994ea33,cdp2w10_i11_s5_w16f34d63d-8792-4655-a72b-d837b1c49b07,cdp2w10_i11_s5_w55a0565a9-6438-4026-a5b9-510772c7f4ab,cdp2w10_i11_s5_w475bb8dda-440d-495d-be36-6a01693fa8ce,48,4450
2007,55343.0,26562-A23-3,BRD-K22390389-001-01-3,26562,A23,3,SA931550,BRD-K22390389,BROAD_CPD_ID,C[C@H](NC(=O)C[C@H]1CC[C@@H](NC(=O)Cc2ccccn2)[C@@H](CO)O1)c1ccccc1,YNMAXJORQBUKHH-LLUDDFSJSA-N,cdp2w7x2_a23_s3_w2f16e7ab5-fda4-4d10-9b8e-b6474712f898,cdp2w7x2_a23_s3_w302a479cb-b982-4383-ac0e-6a30c8752833,cdp2w7x2_a23_s3_w130b510e2-8a98-403b-8fe1-3653a2af7833,cdp2w7x2_a23_s3_w583d90525-5fd3-4a75-ac8d-2070f1247680,cdp2w7x2_a23_s3_w43248612b-dc4d-4a45-9682-b346ab8e915c,65,10242
2008,11018.0,25382-K09-6,BRD-K39355539-001-05-7,25382,K09,6,SA1855741,BRD-K39355539,BROAD_CPD_ID,O=C(NCc1ccco1)c1cc(c(s1)N1CCOCC1)-c1ccccc1,YNQKTIWLJRLBMK-UHFFFAOYSA-N,cdp2w10_k09_s6_w27f2bab80-77eb-4af6-9804-c49854dfeb63,cdp2w10_k09_s6_w36b3d458a-4ab2-4c12-95f0-878a39244e52,cdp2w10_k09_s6_w127e2a4de-6eb8-43bd-8928-8bc28561aec7,cdp2w10_k09_s6_w51fe74738-6da7-42b0-81b3-a07fd36be37d,cdp2w10_k09_s6_w425ec3e80-32f1-4a56-b18d-759c74562151,55,6849
2009,53726.0,26216-C16-6,BRD-K41362826-001-06-9,26216,C16,6,SA1857962,BRD-K41362826,BROAD_CPD_ID,COc1cc(cc(OC)c1OC)C(=O)NNC(=S)NC(=O)c1ccccc1C,YPQWJFBDNDFKGF-UHFFFAOYSA-N,cdp2w9x2_c16_s6_w23a3befb0-80a2-4541-b905-86779d297c17,cdp2w9x2_c16_s6_w39d282032-9611-4b2a-837c-01b2317ccd71,cdp2w9x2_c16_s6_w1d845b954-9a8a-4af8-9788-171ce9c45a5e,cdp2w9x2_c16_s6_w51071b8fb-80cf-40ea-a8d3-acbc61d3962d,cdp2w9x2_c16_s6_w4c8a679d9-6d5d-46ed-a571-5c60024bcb2e,18,6054
2010,37163.0,25707-J19-3,BRD-K94087238-001-05-2,25707,J19,3,SA1861025,BRD-K94087238,BROAD_CPD_ID,COc1cccc(c1)C(=O)NC(=S)Nc1ccccc1N1CCCC1,YQJXMBLPZUBEAU-UHFFFAOYSA-N,cdp2w12_j19_s3_w2e8b15f86-5b0c-41bd-8746-6c90490233ca,cdp2w12_j19_s3_w3ca0243ef-a356-4902-9eab-d47c38fffb31,cdp2w12_j19_s3_w1d02e4749-2aec-4afe-ab25-52aed49e9f27,cdp2w12_j19_s3_w592d254fb-19c2-4415-875e-81c6693457dc,cdp2w12_j19_s3_w4e5f13ac8-9bef-40bf-a095-b79667796cb2,48,1613
2011,12966.0,25410-G05-4,BRD-A22481213-001-05-5,25410,G05,4,SA1855006,BRD-A22481213,BROAD_CPD_ID,CCc1ccccc1N(C1CS(=O)(=O)C=C1)C(=O)c1cccs1,YQLDWBIGLBQWAP-UHFFFAOYSA-N,cdp2w10_g05_s4_w2f52986d3-ac33-4dfe-9e17-a0816dbaa7d6,cdp2w10_g05_s4_w369c8f399-f7b5-45d9-bc51-8c01dec07da9,cdp2w10_g05_s4_w1ee1d697e-382d-46dd-8098-7a091bfaddf6,cdp2w10_g05_s4_w52afe7e5c-baf6-44ca-a5ce-8d3f342d8623,cdp2w10_g05_s4_w49416eee2-78f2-4429-b99b-88a72e3feeb9,61,6721
2012,43819.0,25986-I09-5,BRD-K50841342-001-01-6,25986,I09,5,SA792932,PAC 1,to-be-curated,Oc1c(CC=C)cccc1C=NNC(=O)CN1CCN(Cc2ccccc2)CC1,YQNRVGJCPCNMKT-UHFFFAOYSA-N,cdp2w8x2_i09_s5_w2475de895-7066-4858-b428-4b9dc6ff117f,cdp2w8x2_i09_s5_w3d7d7e649-8f7c-4aff-8b33-81241500cadc,cdp2w8x2_i09_s5_w19b223a5d-6c63-4023-a883-3046fb1aa96c,cdp2w8x2_i09_s5_w5e0b84ec6-adc3-46ed-a525-32f90ddae6fc,cdp2w8x2_i09_s5_w40cf2cd56-32a2-4978-8280-ba96a5614da6,30,10411
2013,16588.0,25435-I06-2,BRD-K41365318-001-07-5,25435,I06,2,SA1859729,BRD-K41365318,BROAD_CPD_ID,COC(=O)c1ccccc1NC(=O)CSc1nnnn1-c1ccc(C)cc1C,YRPXOLGFWXYTOU-UHFFFAOYSA-N,cdp2w10_i06_s2_w2d9d5f491-42ad-4d0c-8f03-6645c09d4ecb,cdp2w10_i06_s2_w3c00d4fcb-5f81-48aa-bfa2-0965dcab1bf7,cdp2w10_i06_s2_w14727938c-35d3-4895-bc34-f4538f17fbde,cdp2w10_i06_s2_w5c6d1df52-0257-480d-92bb-e1e61dba2a55,cdp2w10_i06_s2_w4f2b394c3-704b-480c-9e57-8711d1cf8786,94,7924
2014,14929.0,25426-B05-5,BRD-K58784344-001-06-7,25426,B05,5,SA1860003,BRD-K58784344,BROAD_CPD_ID,COc1ccc(cc1OC)C(=O)Nc1ccc(OCC(F)(F)C(F)F)c(c1)C(F)(F)F,YRRHKSBORHLKLJ-UHFFFAOYSA-N,cdp2w10_b05_s5_w23e73bac8-0e71-459c-b1b2-f878c64ceacd,cdp2w10_b05_s5_w30d0719c2-685a-42fa-8d57-14b882dcc4bb,cdp2w10_b05_s5_w1e27dbbc2-e1ba-42d7-81be-9e48fcd3ae85,cdp2w10_b05_s5_w563237cf7-4d5a-46c8-83f4-f341762993a6,cdp2w10_b05_s5_w43d99bce9-0015-4635-9f6c-f72a7c080496,41,8759
2015,47299.0,26092-K16-5,BRD-K55795421-001-05-4,26092,K16,5,SA1858191,BRD-K55795421,BROAD_CPD_ID,C(COc1ccc2CCCc2c1)OCCn1cncn1,YRSGXVHTUIVZIX-UHFFFAOYSA-N,cdp2w9-au00026609_k16_s5_w2b86bec3f-87b0-4761-852c-b81a5d78439f,cdp2w9-au00026609_k16_s5_w32b6f73e3-facd-4418-9b01-4129876612a1,cdp2w9-au00026609_k16_s5_w1773d8722-af9e-4880-a0c8-9c185f0ecb2d,cdp2w9-au00026609_k16_s5_w53c4990d8-e987-4f9b-b6b3-8bb480666b0d,cdp2w9-au00026609_k16_s5_w4e3c15820-1d8e-496c-89ed-f6195e86d9d8,87,2947
2016,25916.0,25588-K17-6,BRD-K41357471-001-07-5,25588,K17,6,SA1855272,BRD-K41357471,BROAD_CPD_ID,C(COc1ccccc1)Cc1nc(no1)-c1cccnc1,YSCVJCOXGROLRZ-UHFFFAOYSA-N,cdp2w11_k17_s6_w28b0ef503-9c0d-4a7d-987a-382f05ca8446,cdp2w11_k17_s6_w3d98fc490-fe73-42af-b692-1708ee1e8c5c,cdp2w11_k17_s6_w1e4efa3ce-be5c-4809-9972-4ec73955ce87,cdp2w11_k17_s6_w553b3a065-5a53-4c5b-9b0f-2e87379bb0ef,cdp2w11_k17_s6_w410b4857e-5f1d-44f6-9e06-9d93ee9c0adc,94,8756
2017,21842.0,25571-J03-6,BRD-K58548575-001-07-4,25571,J03,6,SA1854779,BRD-K58548575,BROAD_CPD_ID,Cc1nc(c(s1)C(=O)Sc1ccc(C)cc1)C(F)(F)F,YSFAXDHDPRZXTB-UHFFFAOYSA-N,cdp2w11_j03_s6_w270a90081-1ca2-4208-9b0c-a479e0b5a1c9,cdp2w11_j03_s6_w38fd7ba3e-5c97-4420-abe2-d599397eb00d,cdp2w11_j03_s6_w1474bddce-1069-4b7e-b044-016f5f44c365,cdp2w11_j03_s6_w5f3799b36-7c1d-4a04-a854-820e37b95a29,cdp2w11_j03_s6_w44d24681b-db42-4767-b3bd-554aca8f007b,72,5815
2018,7571.0,24512-O19-6,BRD-K71419333-001-05-8,24512,O19,6,SA1854922,BRD-K71419333,BROAD_CPD_ID,COc1ccc(cc1OC)-c1nc(C#N)c(NCc2ccccc2Cl)o1,YSMQLDBKVHIHFD-UHFFFAOYSA-N,cdp2w10_o19_s6_w206ffc432-dcf6-4fd0-b342-19f31beb5702,cdp2w10_o19_s6_w30a709909-b5b0-4ead-ac6e-681fc6bb0cb3,cdp2w10_o19_s6_w11b1b6811-cddf-481f-8b80-646d06f7a1c7,cdp2w10_o19_s6_w57a91d73a-bf06-4e2d-bbc4-5953593ba323,cdp2w10_o19_s6_w4289217b1-a3d4-40fb-bddb-5b11f7b3b9a4,66,2297
2019,25061.0,25584-K04-3,BRD-K14812948-001-12-7,25584,K04,3,SA1856837,BRD-K14812948,BROAD_CPD_ID,COc1ccc(cc1)-c1noc(CCc2ccccc2)n1,YSXLJBBJOHXUBE-UHFFFAOYSA-N,cdp2w11_k04_s3_w2145c3f85-3b4e-4913-881c-ba3a8c0f01a4,cdp2w11_k04_s3_w3895e9969-df29-49d4-af8b-7a53f46fd805,cdp2w11_k04_s3_w173a4b085-8416-4a5e-8ceb-016d173b09b2,cdp2w11_k04_s3_w573963293-e3c5-45e8-847e-20183e14308a,cdp2w11_k04_s3_w4060ba8f4-d4e0-47ea-91bf-dfd493ac8525,56,2068
2020,7424.0,24512-H03-3,BRD-K35363254-001-05-8,24512,H03,3,SA1853479,BRD-K35363254,BROAD_CPD_ID,CC(C)c1ccccc1NC(=O)Cn1c(nc2ccccc12)-c1ccccc1Cl,YSZNGVHVTOABOS-UHFFFAOYSA-N,cdp2w10_h03_s3_w2da98975e-9dd0-4a7c-bb16-a6cfe0ae3fcd,cdp2w10_h03_s3_w3ff0c2687-cebc-4cc9-97b7-438e02110ef0,cdp2w10_h03_s3_w1fb5d11c6-fd9f-4514-95b8-0accc3c0b0f9,cdp2w10_h03_s3_w5946aa05b-fd7d-45a4-b388-3fee318e5799,cdp2w10_h03_s3_w44dc33b0e-c735-4092-93b9-2ee296513357,66,8294
2021,8160.0,24619-F20-1,BRD-K27735716-001-01-8,24619,F20,1,SA852019,BRD-K27735716,BROAD_CPD_ID,CC(C)C#Cc1ccc2c(O[C@H](CN(C)C(=O)c3ccncc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1,YTUJKVHLLCOJEP-MZLICYQSSA-N,cdp2w3_f20_s1_w21105604d-1e86-403f-a054-e90cd1224289,cdp2w3_f20_s1_w3d357b294-af44-44df-8330-0ba5d9c3ded5,cdp2w3_f20_s1_w1078211dc-4c24-48e4-a5d1-0c6078a488b5,cdp2w3_f20_s1_w594ee7a7d-1e90-4e20-81b9-e5d24fffdd7c,cdp2w3_f20_s1_w47c20e1d9-a36f-42d9-b813-4dcb30ce9d93,140,10069
2022,11147.0,25387-E21-3,BRD-A38811080-001-05-5,25387,E21,3,SA1856909,BRD-A38811080,BROAD_CPD_ID,OC(=O)CC(Sc1nnc(S)s1)C(O)=O,YUMSRJNRCPVTBZ-UHFFFAOYSA-N,cdp2w10_e21_s3_w2bf52e002-44ca-4287-bc23-68b0bd854197,cdp2w10_e21_s3_w3575b85bd-eda4-46c8-8c6b-3039eb0623f3,cdp2w10_e21_s3_w111718778-7f4e-4122-bd1e-ec5306e8f09b,cdp2w10_e21_s3_w52709a8d5-a20b-49d2-9786-04d33d895032,cdp2w10_e21_s3_w4aa61f26b-d553-4e27-92bc-6f8ae8429d16,50,4161
2023,35229.0,25690-E07-1,BRD-K51679460-001-05-6,25690,E07,1,SA1856376,BRD-K51679460,BROAD_CPD_ID,Brc1ccc(s1)C(=O)N1CCN(C\C=C\c2ccccc2)CC1,YUXOQMOFSAGSCF-QPJJXVBHSA-N,cdp2w12_e07_s1_w25e8b6020-932d-46c7-be9c-a1edd223ae2a,cdp2w12_e07_s1_w30963d581-3e12-4946-92b4-0763be580877,cdp2w12_e07_s1_w11aecbd87-ecad-44a7-b32e-d32dbd6af31e,cdp2w12_e07_s1_w5971fa8c0-2e47-4a85-bd6b-de2a3d3bbc7f,cdp2w12_e07_s1_w41a692ed9-2f90-4444-978e-eb6ab398158f,76,5388
2024,55175.0,26271-I05-3,BRD-K53095870-001-05-7,26271,I05,3,SA1857130,BRD-K53095870,BROAD_CPD_ID,CCCn1c2ccccc2c(O)c(C(=O)NCCc2ccc(Cl)cc2)c1=O,YUYSPVNHYRIDBV-UHFFFAOYSA-N,cdp2w9x2-au00026606_i05_s3_w2c86f768f-277a-4506-a327-96596fb924fc,cdp2w9x2-au00026606_i05_s3_w3953c2fe9-1b9d-459e-a64a-704968ee6617,cdp2w9x2-au00026606_i05_s3_w1da3aa445-7984-4ca5-8aae-9c5aa6acec79,cdp2w9x2-au00026606_i05_s3_w58538616c-abf4-46ca-b163-4d8116cb9776,cdp2w9x2-au00026606_i05_s3_w499bb3d44-3d2d-4ec8-b1ab-6b646626d2f8,51,4247
2025,34285.0,25686-F10-5,BRD-K36578176-001-06-3,25686,F10,5,SA1853129,BRD-K36578176,BROAD_CPD_ID,COc1ccc(NC(=O)CCC(=O)Nc2nnc(s2)C(F)(F)F)c(OC)c1,YVBKAHRBBICCLR-UHFFFAOYSA-N,cdp2w12_f10_s5_w239953926-adb5-43a2-8f49-bbe0b4ccf72b,cdp2w12_f10_s5_w369d90057-cad5-4d4a-a993-0bc485c39712,cdp2w12_f10_s5_w151f6c943-2353-4be7-8fcb-e70aaa03507e,cdp2w12_f10_s5_w5a4437b8c-70cb-4e65-bb9e-f215c5416db6,cdp2w12_f10_s5_w40d09feda-29d7-4dff-a291-318b631fa2e0,69,7183
2026,21917.0,25571-M07-3,BRD-K97673946-001-05-9,25571,M07,3,SA1858745,BRD-K97673946,BROAD_CPD_ID,Cc1noc(NS(=O)(=O)c2ccc(N\C=C/C(=O)c3ccc(F)cc3)cc2)c1C,YVTROUKQHMBWRO-QXMHVHEDSA-N,cdp2w11_m07_s3_w288649062-a734-4765-86b3-37705335a40d,cdp2w11_m07_s3_w3676f5565-21c8-4622-a096-32b6714c3f56,cdp2w11_m07_s3_w18a8c8ef6-1039-4a06-981f-486f177e7ede,cdp2w11_m07_s3_w5a1a60390-110a-4b8c-9907-9c55275d9a7c,cdp2w11_m07_s3_w4be89cfd0-2a5f-460d-9320-5c4c06aef403,75,8683
2027,8357.0,24640-N18-3,BRD-K68009914-001-01-8,24640,N18,3,SA858442,BRD-K68009914,BROAD_CPD_ID,COc1ccccc1-c1ccc2c(O[C@H](CN(C)Cc3ccc4OCOc4c3)[C@H](C)CN([C@@H](C)CO)S2(=O)=O)c1,YWADXHNDBHGHLS-HNMNOHOESA-N,cdp2w3_n18_s3_w21da23cae-11c5-4142-aee6-ef769b4906f4,cdp2w3_n18_s3_w32b9a1318-3501-4d6c-a119-80222f4bf347,cdp2w3_n18_s3_w161293d9a-ea3e-4a67-b7c2-fabe7497cff1,cdp2w3_n18_s3_w51e9b45ad-8124-4a29-8d56-df444f7c41db,cdp2w3_n18_s3_w4ddec433d-fc5c-49a0-9b6c-3cb0dc753060,70,10249
2028,27785.0,25598-O08-3,BRD-K71514806-001-05-4,25598,O08,3,SA1857379,BRD-K71514806,BROAD_CPD_ID,CCN(CC)S(=O)(=O)c1cc(ccc1NNC(=O)Nc1ccc(F)cc1)[N+]([O-])=O,YWFRZQVGZLTZHX-UHFFFAOYSA-N,cdp2w11_o08_s3_w2d3f27511-6e77-4756-b97b-11de07a01489,cdp2w11_o08_s3_w33dbdbb0f-edb6-41d0-b59c-41dfd5215720,cdp2w11_o08_s3_w17aead896-95a9-419c-b84e-b55868869a39,cdp2w11_o08_s3_w53acbc338-beae-46f6-b24b-9b60386be199,cdp2w11_o08_s3_w497919637-fc40-40e6-85da-6858a540a84d,84,7114
2029,47851.0,26110-G17-5,BRD-K79712504-001-05-1,26110,G17,5,SA1858611,BRD-K79712504,BROAD_CPD_ID,CCOC(=O)C1CCN(CC1)C(=O)Cc1cccs1,YWUSFSDLDXNEKF-UHFFFAOYSA-N,cdp2w9x2_g17_s5_w2d15856a0-4fc8-4071-adfe-a231822e04e2,cdp2w9x2_g17_s5_w3df5cf237-408b-4c19-bb9f-78bb51c99807,cdp2w9x2_g17_s5_w1faae3e9d-2355-4cac-87cc-6df0ae06464e,cdp2w9x2_g17_s5_w5139cc037-7a05-46fb-a52d-e2ab39201dab,cdp2w9x2_g17_s5_w4d0d609fc-007d-4d03-b4e3-3d693fc0af77,43,3043
2030,5461.0,24312-L20-2,BRD-K55160477-001-02-1,24312,L20,2,SA59545,2-mercaptobenzothiazole,primary-common,Sc1nc2ccccc2s1,YXIWHUQXZSMYRE-UHFFFAOYSA-N,cdp2bioactives_l20_s2_w2059f8bc0-9c56-488d-aa9b-f01c845d0635,cdp2bioactives_l20_s2_w37cff800c-a2d4-4b34-b084-c920aef85d62,cdp2bioactives_l20_s2_w1f58339d2-ff78-4de6-b93d-1a7d027fefe3,cdp2bioactives_l20_s2_w5e457fb09-d257-4f24-b151-609c78ebecdf,cdp2bioactives_l20_s2_w451e62b0c-1867-4c94-acc5-bf4a76b5317e,81,771
2031,21905.0,25571-L20-3,BRD-K95401717-001-05-4,25571,L20,3,SA1858697,BRD-K95401717,BROAD_CPD_ID,CCOC(=O)Cn1nc(\C=C\c2ccccc2)ccc1=O,YXLIKPYHIMEPBQ-CMDGGOBGSA-N,cdp2w11_l20_s3_w244a3c6e8-e75b-49b2-b02f-4041294e50ba,cdp2w11_l20_s3_w3f78b24b0-1421-40a4-8617-bb60969d796b,cdp2w11_l20_s3_w1e18ac8d2-df23-4ab2-a25f-6f3b3d731a00,cdp2w11_l20_s3_w5f4f58449-f62a-4834-abd7-02acbc384f72,cdp2w11_l20_s3_w4c7b5c5c5-1b5b-4ce6-a067-6fe9ce9bdaf8,64,2232
2032,18285.0,25490-H20-1,BRD-K20808438-001-05-8,25490,H20,1,SA1856381,BRD-K20808438,BROAD_CPD_ID,COc1ccc(CN(Cc2ccc(cc2)C(O)=O)C(S)=Nc2ccc(C)cc2)cc1OC,YXXZISODYHJJAV-UHFFFAOYSA-N,cdp2w10-au00024359_h20_s1_w25aa61306-f73c-4304-ae1e-f9c5134a7a9c,cdp2w10-au00024359_h20_s1_w38de247bf-2f2f-49fd-af02-27f9d8843d57,cdp2w10-au00024359_h20_s1_w1fb151c64-4e92-4815-85a8-48d81f3a0a4e,cdp2w10-au00024359_h20_s1_w54e7617a4-b2ff-4fd3-b286-6ec28bed3d2d,cdp2w10-au00024359_h20_s1_w47a8a4129-e3c2-481b-91c0-e89ac2a39199,63,4198
2033,19602.0,25564-I12-4,BRD-K57066058-001-05-8,25564,I12,4,SA1853798,BRD-K57066058,BROAD_CPD_ID,O=C(CCc1c[nH]c2ccccc12)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1,YYKGAEDBHFUANW-UHFFFAOYSA-N,cdp2w11_i12_s4_w2b15c0dca-6df9-403d-96e8-4fd0e55400df,cdp2w11_i12_s4_w30efbe964-f2c9-499e-a2cc-dc160271cb7c,cdp2w11_i12_s4_w10ebf848a-3c59-4aa3-983f-3b94c8c72662,cdp2w11_i12_s4_w5665a6acc-ab4b-4b89-8a7c-63d88b27a2fe,cdp2w11_i12_s4_w4612c5154-4aab-402f-afa5-ef9cb250e7a7,75,6867
2034,12573.0,25408-C10-1,BRD-K98531780-001-05-7,25408,C10,1,SA1858505,BRD-K98531780,BROAD_CPD_ID,CSc1ccc(cc1)\C=C(/C#N)C(=O)Nc1cccc(C)c1,YYQVQZHCKQIBBF-RVDMUPIBSA-N,cdp2w10_c10_s1_w27ff624bf-0e5f-4f34-bb0e-a0df7905cfce,cdp2w10_c10_s1_w3f0dc5378-3569-4834-a5df-a1c99b7499ca,cdp2w10_c10_s1_w153e1565e-766d-406e-800d-1734f7e94cd8,cdp2w10_c10_s1_w5ce55d582-847c-4dda-ae1f-6afc50935e34,cdp2w10_c10_s1_w4b89ba03b-e589-47f2-a78a-494828c800f9,40,4938
2035,46627.0,26071-G12-5,BRD-K42296822-001-05-4,26071,G12,5,SA1853516,BRD-K42296822,BROAD_CPD_ID,Clc1ccc(COc2ccc(cc2)-c2nc(C#N)c(NCCCn3ccnc3)o2)cc1,YZHDZFLNWPDUAT-UHFFFAOYSA-N,cdp2w9x2_g12_s5_w2ddcdde35-9ad2-48a8-9b2b-03ae9a17fa44,cdp2w9x2_g12_s5_w37d2c58d7-a085-4258-905d-ecf9d70b2f80,cdp2w9x2_g12_s5_w106f4f739-a45e-4b1b-a248-51dc822d40f9,cdp2w9x2_g12_s5_w57aefba25-7866-4f2b-bcb8-865929b85029,cdp2w9x2_g12_s5_w477bf039f-031f-4fa2-b78c-7d258d4296cb,53,5757
2036,33873.0,25683-D06-1,BRD-K69559673-001-05-3,25683,D06,1,SA1858811,BRD-K69559673,BROAD_CPD_ID,Cn1nccc1C(=O)N1CCN(CC1)c1ccc(F)cc1,YZZCPCGURLBDPK-UHFFFAOYSA-N,cdp2w12_d06_s1_w2e314ffa6-5218-4874-aba9-92cbcf8901dd,cdp2w12_d06_s1_w3b07a7dd2-f70e-4eec-a9a0-727379ee33e3,cdp2w12_d06_s1_w1d3e62811-5a86-4192-a4c1-3b426b6c74c6,cdp2w12_d06_s1_w531953683-9c38-4b75-91f6-8c60c9ca2300,cdp2w12_d06_s1_w4a1d88cce-cab0-4ccb-b2fa-e261510c3568,64,2473
2037,30708.0,25665-A11-4,BRD-A37531650-001-07-6,25665,A11,4,SA1860682,BRD-A37531650,BROAD_CPD_ID,COc1cc(CN2CCCC(CO)(Cc3cccc(Cl)c3)C2)cc2OCOc12,ZAGAYOJZYQAPMC-UHFFFAOYSA-N,cdp2w12_a11_s4_w22f0a571e-df68-4cbb-a701-06036333060a,cdp2w12_a11_s4_w37f33bd0b-a9f0-4eb4-9dca-17352f4e0659,cdp2w12_a11_s4_w1356ad10f-8070-4c98-a7d0-22742f6e86ee,cdp2w12_a11_s4_w50f0f5818-0ae2-4450-8066-68ecfb973c46,cdp2w12_a11_s4_w4d0b5b11d-04b6-49b3-b289-4523ff737b68,53,8265
2038,45768.0,26058-F21-4,BRD-K34044309-001-05-0,26058,F21,4,SA1861627,BRD-K34044309,BROAD_CPD_ID,COc1ccc(cc1OC)-c1cc(C(O)=O)c2sc(nc2n1)N1CCCCC1,ZBLKPNYMTKPSHR-UHFFFAOYSA-N,cdp2w9x2_f21_s4_w284a6cc5a-cf11-416b-aa00-15deadc963e9,cdp2w9x2_f21_s4_w3297fbeb5-f58f-4665-94aa-adf34cdb6f66,cdp2w9x2_f21_s4_w129137fe8-b44c-4921-bdf3-3f381b4734a1,cdp2w9x2_f21_s4_w54d7c6294-7aa3-4300-9423-2c5371f2fa1c,cdp2w9x2_f21_s4_w4f578136c-ce17-4516-9b5d-08663b47bdc6,76,5772
2039,3231.0,24305-M11-4,BRD-K14200658-001-02-6,24305,M11,4,SA83079,syrosingopine,INN,CCOC(=O)Oc1c(OC)cc(cc1OC)C(=O)O[C@@H]1C[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@H]3C[C@@H]2[C@@H]([C@H]1OC)C(=O)OC,ZCDNRPPFBQDQHR-SSYATKPKSA-N,cdp2bioactives_m11_s4_w283d49902-5c78-4673-9863-08fc1226de9f,cdp2bioactives_m11_s4_w37fed8983-a6c8-4372-978f-40df569e65e4,cdp2bioactives_m11_s4_w1177a2da3-ea81-483d-9369-0811329e149b,cdp2bioactives_m11_s4_w50f6c09a1-7180-49bc-b5ce-520e6dfb9d49,cdp2bioactives_m11_s4_w42a100cba-da9b-426c-bf40-5d041e9a39ea,116,3986
2040,29044.0,25639-N06-2,BRD-K27554804-001-05-7,25639,N06,2,SA1854691,BRD-K27554804,BROAD_CPD_ID,[O-][N+](=O)c1ccc(cc1)-c1cn(c(S)n1)-c1ccccc1,ZCEPBEJOXQFEHJ-UHFFFAOYSA-N,cdp2w12_n06_s2_w290d4ad1f-5aba-4aef-9696-5c0d596bea79,cdp2w12_n06_s2_w355fcd0d8-ad50-4745-adfa-fae906e95e61,cdp2w12_n06_s2_w1a1527b73-0452-43e2-b843-d8be624bc2a5,cdp2w12_n06_s2_w5f3caaf10-fb3a-460f-8f6b-a5661085bf87,cdp2w12_n06_s2_w4f450a3dd-bfa7-4191-94de-7f2c6bd3c61e,36,5183
2041,12942.0,25410-D17-4,BRD-K29671198-001-05-1,25410,D17,4,SA1856312,BRD-K29671198,BROAD_CPD_ID,CCc1ccc2nc3sc(cc3cc2c1)C(O)=O,ZCIFZNUDMJXZDI-UHFFFAOYSA-N,cdp2w10_d17_s4_w23c4dc492-768a-48b6-bdcc-ba842f08d940,cdp2w10_d17_s4_w364cd1d80-1713-487a-bc13-d28cabf32f6c,cdp2w10_d17_s4_w1eae08351-4cbd-4dd9-8b43-bcad056f93df,cdp2w10_d17_s4_w5cb049750-a3fd-4080-bc6e-628816db4505,cdp2w10_d17_s4_w4a1d89063-c7d6-4f49-868d-a4db41b19ef0,60,8439
2042,42501.0,25968-I14-1,BRD-K31273080-001-01-2,25968,I14,1,SA63457,diacylglycerol kinase inhibitor II,primary-common,Fc1ccc(cc1)C(c1ccc(F)cc1)=C1CCN(CCn2c(=S)[nH]c3ccccc3c2=O)CC1,ZCNBZFRECRPCKU-UHFFFAOYSA-N,cdp2w8x2_i14_s1_w2619c5205-c0b8-4369-b1de-81ee87cf724e,cdp2w8x2_i14_s1_w3afe2026f-3346-4693-9bdc-7568baddbeac,cdp2w8x2_i14_s1_w1a5daa469-7f21-4234-ac18-b15f9b187cb7,cdp2w8x2_i14_s1_w5714f9350-5cdd-4a96-98cd-1004581a29cf,cdp2w8x2_i14_s1_w46ac0e1ac-73c1-4e35-b3d9-be7976dec9f8,66,1123
2043,5845.0,24319-A12-2,BRD-A36151937-001-01-2,24319,A12,2,SA63240,genistin,primary-common,OCC1OC(Oc2cc(O)c3c(c2)occ(-c2ccc(O)cc2)c3=O)C(O)C(O)C1O,ZCOLJUOHXJRHDI-UHFFFAOYSA-N,cdp2bioactives_a12_s2_w266e2ea8c-176d-4cba-9caf-8d66919fb53c,cdp2bioactives_a12_s2_w3db7b2692-86ab-4a0c-9416-f786a598bd9a,cdp2bioactives_a12_s2_w1fb5e846b-18f1-49fc-bdc8-639bac732422,cdp2bioactives_a12_s2_w5902268ae-45df-432d-9e92-72ecee2e853b,cdp2bioactives_a12_s2_w476f0cbcc-0135-41e5-bdec-cc23af25d6e4,68,3083
2044,38409.0,25726-H03-1,BRD-K54607456-001-05-0,25726,H03,1,SA1861150,BRD-K54607456,BROAD_CPD_ID,Cc1ccc(cc1C)-n1ncc2c1ncn(CC(=O)Nc1cccc(Cl)c1)c2=O,ZCWDKCQSVXFIKL-UHFFFAOYSA-N,cdp2w12_h03_s1_w24a6177e7-1b31-4984-ba40-4ec0c293666d,cdp2w12_h03_s1_w39b6340c3-f803-43ee-9a14-24de44045a5b,cdp2w12_h03_s1_w108c6dad5-06ee-442a-905b-f7d3f597b4fe,cdp2w12_h03_s1_w5f879c020-0a2e-41d5-b535-8e41337766fa,cdp2w12_h03_s1_w430e12d07-5a4d-4187-af88-2763f7ac064b,48,4834
2045,23620.0,25579-D18-2,BRD-K09701277-001-05-4,25579,D18,2,SA1855960,BRD-K09701277,BROAD_CPD_ID,O=C(CCn1c(=O)n(Cc2cc(=O)n3ccccc3n2)c2ccccc2c1=O)NCc1ccco1,ZDJYRFMZJIEMPW-UHFFFAOYSA-N,cdp2w11_d18_s2_w2db822f64-c37e-4f73-aca0-37b05e341a67,cdp2w11_d18_s2_w35a0580c5-6a89-47cb-a81c-331b6eef1735,cdp2w11_d18_s2_w120c5b3f2-04ad-4094-9ab6-ade6ccba8702,cdp2w11_d18_s2_w5ed781dde-55fd-44df-8563-81cd464153fe,cdp2w11_d18_s2_w4c8d43670-c308-4147-a726-36e5257702df,75,3869
2046,19544.0,25564-E17-6,BRD-K97846172-001-05-6,25564,E17,6,SA1852723,BRD-K97846172,BROAD_CPD_ID,COCc1cc(C)nc2sc(C(=O)N3CCN(CC3)c3ccccc3)c(N)c12,ZEAZJNKPMRTFQD-UHFFFAOYSA-N,cdp2w11_e17_s6_w2d4a0d10c-7f67-4c33-8351-0219c2ccc6f0,cdp2w11_e17_s6_w3306ef516-82a0-4c84-ae6b-76cda046adf7,cdp2w11_e17_s6_w1c852e7a5-33af-4155-8e3c-38aca441a54c,cdp2w11_e17_s6_w538bea08c-011c-462d-9dab-ae5ceba01fa6,cdp2w11_e17_s6_w41471a63f-b0a9-4827-afd2-1467daeef98d,93,5958
2047,21418.0,25570-D15-2,BRD-K97097354-001-05-6,25570,D15,2,SA1855182,BRD-K97097354,BROAD_CPD_ID,COc1ccc(Cn2cccc(NC(=O)Nc3ccc(cc3)C#N)c2=O)cc1,ZENMHPOTIGKQQQ-UHFFFAOYSA-N,cdp2w11_d15_s2_w2a6705433-66d1-46c2-b971-39eb10d0ed55,cdp2w11_d15_s2_w31c71d7cd-0fcd-4ed5-9831-9f1304add03e,cdp2w11_d15_s2_w19bf0bf69-4021-4148-9a1d-07ad98dc2787,cdp2w11_d15_s2_w5ec03a0b4-eba8-4639-83c3-c4ec99dbfb35,cdp2w11_d15_s2_w40f874e49-3f11-46f1-8c08-f3c8979c902c,66,6601
2048,33106.0,25679-O11-2,BRD-A07548752-001-05-7,25679,O11,2,SA1860580,BRD-A07548752,BROAD_CPD_ID,CC(O)Cc1c(C)c2cc(Cl)c(OCC(=O)Nc3cccc(c3)C(C)=O)cc2oc1=O,ZEOTTYLCJGDTHS-UHFFFAOYSA-N,cdp2w12_o11_s2_w2d3a0edf3-e2e1-4da9-ac9b-f21f86bb8163,cdp2w12_o11_s2_w3abd1b845-3d59-4ad9-87ea-f2ce2763d8e5,cdp2w12_o11_s2_w121992e94-dcc6-4c70-9320-718d13838767,cdp2w12_o11_s2_w576b8838a-5012-462f-a494-123e5150588f,cdp2w12_o11_s2_w4480ef2bf-72fc-49a7-8dfc-2ba444532521,50,8134
2049,11411.0,25391-C14-3,BRD-K80132640-001-05-4,25391,C14,3,SA1855128,BRD-K80132640,BROAD_CPD_ID,COc1ccc(CN2C(=O)\C(=C/Nc3ccccc3C(O)=O)c3ccccc3C2=O)cc1,ZERNVEIBAJRATR-STZFKDTASA-N,cdp2w10_c14_s3_w23b3bf67c-c28a-474b-933d-b39301f72b9f,cdp2w10_c14_s3_w334442b0d-0e98-44ab-9573-328c69a299ad,cdp2w10_c14_s3_w128b5c13c-c0a8-47b3-83d4-97ed42f2392a,cdp2w10_c14_s3_w5cfd842fc-fc7f-448f-bc95-4df0dd65ef34,cdp2w10_c14_s3_w4ac3cd295-0832-4af6-bc0c-ece154f4bb57,43,4824
2050,54079.0,26224-I13-5,BRD-K89732114-001-02-6,26224,I13,5,SA82356,trifluoperazine,INN,CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1,ZEWQUBUPAILYHI-UHFFFAOYSA-N,cdp2w9x2_i13_s5_w29c8c2763-9730-48bc-8d47-5941dd51d555,cdp2w9x2_i13_s5_w390b01e83-8cc2-4ecf-a02f-249103b737ad,cdp2w9x2_i13_s5_w16ed909a0-292b-4f39-b089-52f05740503f,cdp2w9x2_i13_s5_w57bda9963-4610-4d94-8f5a-5bbb32699564,cdp2w9x2_i13_s5_w452d876e6-52fe-45a4-8d07-2fa65b83ce40,23,37
2051,50856.0,26140-G08-4,BRD-K34858602-001-05-7,26140,G08,4,SA1857313,BRD-K34858602,BROAD_CPD_ID,Cc1ccc(s1)C(=O)NCCc1ccc(F)cc1,ZFAVQEMLAQFYGJ-UHFFFAOYSA-N,cdp2w9x2_g08_s4_w20ad7be89-d80b-4d38-9a78-601d89e5d8fd,cdp2w9x2_g08_s4_w3400090cb-0ea4-48dd-93b8-20cc0ef73c47,cdp2w9x2_g08_s4_w107c18305-2958-4623-9ea8-ef6d7c087f58,cdp2w9x2_g08_s4_w5d76ea3d1-cba9-4098-b61c-c11910a4c3f9,cdp2w9x2_g08_s4_w4d88ee090-caa8-4d96-982a-a9cbc29e75ea,59,4957
2052,34134.0,25683-P07-4,BRD-K16111035-001-06-8,25683,P07,4,SA1857608,BRD-K16111035,BROAD_CPD_ID,CN(Cc1ccccc1)S(=O)(=O)c1ccc(cc1)C(=O)Nc1nnc(o1)C1CC1,ZFBGQOLXKQLHAG-UHFFFAOYSA-N,cdp2w12_p07_s4_w21a723f0f-4f4b-45aa-a1ae-90a1b87d4192,cdp2w12_p07_s4_w3c55a3a5b-d096-489d-8cd8-cc6a655b3986,cdp2w12_p07_s4_w1647c60ef-d4be-461d-91f9-fec683a27e4b,cdp2w12_p07_s4_w5fee71163-087d-41bb-894d-5865169fb114,cdp2w12_p07_s4_w45659a663-046b-4f21-96f6-98128b2c289e,44,3815
2053,23094.0,25576-I06-4,BRD-K57676691-001-05-7,25576,I06,4,SA1859673,BRD-K57676691,BROAD_CPD_ID,O=C1N(CCc2ccccc2)C(=O)c2cccc3cccc1c23,ZFDSPMWGSWVSQU-UHFFFAOYSA-N,cdp2w11_i06_s4_w2c2213d78-8320-4e30-bb64-53f9a9bd1121,cdp2w11_i06_s4_w3bab7f5d3-f565-4a63-b33b-b08a6f0bb9d3,cdp2w11_i06_s4_w1cd56b19d-d324-48fa-b87b-eaf8f1f6a638,cdp2w11_i06_s4_w5dc7d9812-7319-47a2-acb6-996520bf81a4,cdp2w11_i06_s4_w4860a74e4-3ae5-4a46-afbc-567221c1f4d8,90,8030
2054,19096.0,25553-A08-2,BRD-K70838267-001-06-8,25553,A08,2,SA1858812,BRD-K70838267,BROAD_CPD_ID,Cc1c(NC(=O)CN2CCN(CC2)c2ccc(O)cc2)c(=O)n(-c2ccccc2)n1C,ZFIBYOSRRUDOFA-UHFFFAOYSA-N,cdp2w11-au00029679_a08_s2_w25f831053-91cd-40d7-bddd-45a4db1ed497,cdp2w11-au00029679_a08_s2_w379c9c03c-cebf-467a-8b84-d2fca9b0c9d3,cdp2w11-au00029679_a08_s2_w1491f0ad2-4b00-47dd-a55c-4760c936c07c,cdp2w11-au00029679_a08_s2_w52707e721-4c6b-4711-8349-c8b3e048fb9c,cdp2w11-au00029679_a08_s2_w42572ab6f-89f1-4fd9-a469-3c6dba9e9b91,32,2856
2055,20061.0,25565-P05-1,BRD-A93751380-001-11-0,25565,P05,1,SA1861863,BRD-A93751380,BROAD_CPD_ID,Cc1cc(C)cc(c1)N1C(=O)CC(Sc2nc[nH]n2)C1=O,ZFKWFHMKVZEDEN-UHFFFAOYSA-N,cdp2w11_p05_s1_w240569bb7-11ee-4543-a577-0b7a55606d41,cdp2w11_p05_s1_w3dbe56e0c-065b-43e6-a1f6-165bdfe226c1,cdp2w11_p05_s1_w1fe55df89-7cde-4c3b-9828-a6c799c516aa,cdp2w11_p05_s1_w58f157819-f9bd-4a3b-b263-9ffbf17036c9,cdp2w11_p05_s1_w4fb916de5-0ce5-4122-a050-a9574078c89a,77,9435
2056,20367.0,25566-O07-1,BRD-A31237708-001-05-2,25566,O07,1,SA1856500,BRD-A31237708,BROAD_CPD_ID,CCN(CC)S(=O)(=O)c1ccc(NC2N(Cc3ccccc3)C(=O)c3cccnc23)cc1,ZFRCKALEJSTNHE-UHFFFAOYSA-N,cdp2w11_o07_s1_w23b1a444e-a49c-46a0-b030-2d95bd617f53,cdp2w11_o07_s1_w3eabfb8ad-6584-43bf-b374-3bea4e7678d2,cdp2w11_o07_s1_w12106144a-0e86-4631-8412-09242b9117f9,cdp2w11_o07_s1_w5fd9666f6-f968-40e2-9a41-250125eccc95,cdp2w11_o07_s1_w44d1026e8-9a6b-495e-8f80-2ae8497052e7,73,7794
2057,38983.0,25848-H06-5,BRD-K61873274-001-01-8,25848,H06,5,SA786924,BRD-K61873274,BROAD_CPD_ID,COc1cccc(c1)S(=O)(=O)N(C)C[C@@H]1OCc2ccccc2-c2c(C(=O)N(C[C@@H]1C)[C@H](C)CO)n(C)c1ccccc21,ZFRPCBGONKGXGW-BURCIIJTSA-N,cdp2w6x2_h06_s5_w2db6004b1-951b-49d8-b6f4-a2b4b8929a8b,cdp2w6x2_h06_s5_w3715932d0-8635-4ace-b7d7-26033e55aade,cdp2w6x2_h06_s5_w16a2c70d1-b9af-4f3f-bb30-d73298b69026,cdp2w6x2_h06_s5_w53465a6c1-1946-4c6e-b008-d27d12999b3a,cdp2w6x2_h06_s5_w46a20f1c1-c677-426d-b8b8-1f410abbe3ef,90,10286
2058,7512.0,24512-M18-1,BRD-K12883524-001-08-0,24512,M18,1,SA1854796,BRD-K12883524,BROAD_CPD_ID,COc1ccc(\C=C\C(=O)NC(=S)N2CCN(CC2)c2ccccc2OC)cc1,ZGHUHJMSZAYUMP-FMIVXFBMSA-N,cdp2w10_m18_s1_w2659d6ad3-0fa1-454e-aac2-b9950550fb72,cdp2w10_m18_s1_w31b32c202-c911-4fdb-a03b-a2a411f6fac1,cdp2w10_m18_s1_w1568e0282-523a-4178-bac8-97647c5cab71,cdp2w10_m18_s1_w5a4d0f721-fcd8-4f6c-b40e-fa1db3e3c7f1,cdp2w10_m18_s1_w476cec24d-cab5-4b3b-8289-e61d6a4e4b04,70,6579
2059,32333.0,25677-J07-3,BRD-A79706495-001-05-6,25677,J07,3,SA1859233,BRD-A79706495,BROAD_CPD_ID,CCSc1nnc(NC(=O)C(NC(=O)c2ccc(Cl)cc2)C(C)C)s1,ZGIHZAVRVCNZBL-UHFFFAOYSA-N,cdp2w12_j07_s3_w2557651b5-300f-4d2b-a8c9-5413e191d054,cdp2w12_j07_s3_w35a18e6e4-231c-4449-abac-7af596a6f4ba,cdp2w12_j07_s3_w1eed7798e-6c50-4294-b20f-d5eed67ad848,cdp2w12_j07_s3_w58ebdc4d2-d065-4bf0-b7f2-7c7cf1701564,cdp2w12_j07_s3_w477c2db45-c194-4874-877c-4be04e3a0241,57,8117
2060,55460.0,26588-A11-6,BRD-K77125349-001-01-6,26588,A11,6,SA799731,BRD-K77125349,BROAD_CPD_ID,COc1ccccc1CNC(=O)C[C@H]1C[C@@H]2[C@@H](Oc3ccc(NC(=O)Cc4ccncc4)cc23)[C@H](CO)O1,ZGXOXQUBSYKGRY-MJMMSJOPSA-N,cdp2w7x2_a11_s6_w2d2f80c95-d72c-430a-83a7-fca0dd2ec960,cdp2w7x2_a11_s6_w3aff488c9-ef86-4614-ab5b-1438fe7f299f,cdp2w7x2_a11_s6_w1bfe84cae-527b-4f70-b72f-151d956b4d89,cdp2w7x2_a11_s6_w5ba2ab636-e438-475d-86bd-d94a7b7929e5,cdp2w7x2_a11_s6_w4ba66b410-4c61-4127-9606-a31964c645ec,167,10488
2061,51852.0,26174-K14-4,BRD-A62095238-001-05-5,26174,K14,4,SA1859291,BRD-A62095238,BROAD_CPD_ID,CCC1CCCCN1CCCNC(=O)COc1cc(=O)n(C)c2ccccc12,ZHHJXQQMEAKFPB-UHFFFAOYSA-N,cdp2w9x2-au00026617_k14_s4_w2f429aa7a-4722-406d-a2a2-f5245a9a63a3,cdp2w9x2-au00026617_k14_s4_w3eb5e1d29-e810-450f-8807-96fadc92769d,cdp2w9x2-au00026617_k14_s4_w16a2b2fa5-43e2-4fc3-9437-cdf8a930134e,cdp2w9x2-au00026617_k14_s4_w59c5c8bae-6173-4ac7-8a39-3199024fa761,cdp2w9x2-au00026617_k14_s4_w412d10094-9eea-4a91-bff9-ced3331d97b0,62,9634
2062,38933.0,25740-C05-3,BRD-K36591038-001-04-9,25740,C05,3,SA1850602,BRD-K36591038,BROAD_CPD_ID,Clc1nssc1=Nc1nncs1,ZHOOKWSKEFQZOG-UHFFFAOYSA-N,cdp2w12_c05_s3_w270853bf9-472e-4c1c-9d96-4a1ffc1054b7,cdp2w12_c05_s3_w317a3fc5c-f633-42c7-b8b1-fad35354c091,cdp2w12_c05_s3_w1a3951db9-c00b-4128-92d8-053c0d625f32,cdp2w12_c05_s3_w5633e5b10-6750-45be-82b1-a60880f1a6de,cdp2w12_c05_s3_w46997f2bf-c297-496b-88a7-8e06cd983327,44,3961
2063,49630.0,26128-K14-2,BRD-K85636571-001-06-0,26128,K14,2,SA1858659,BRD-K85636571,BROAD_CPD_ID,CCSc1nnc(NC(=O)c2cccc(c2)S(=O)(=O)N(C)c2ccc(C)cc2)s1,ZHXMHIXLYABNRL-UHFFFAOYSA-N,cdp2w9x2_k14_s2_w2654121dc-bbbb-44ed-a4a8-6c5d72088529,cdp2w9x2_k14_s2_w3de3846a9-e442-472d-b6db-437a3f122fe3,cdp2w9x2_k14_s2_w1a57c0719-8e3c-4dd6-9b0f-6e83d601e32a,cdp2w9x2_k14_s2_w5f03a761e-a6ac-4ea5-934b-5dc859dd306b,cdp2w9x2_k14_s2_w4bf5c894f-b5c7-4a57-8892-238fd51c95b6,43,5088
2064,38851.0,25738-M11-5,BRD-K18764540-001-05-2,25738,M11,5,SA1856020,BRD-K18764540,BROAD_CPD_ID,[O-][N+](=O)c1ccc(NC(=O)c2cn(nc2-c2cc3ccccc3o2)-c2ccccc2)cc1,ZISNFUWXYMUHOP-UHFFFAOYSA-N,cdp2w12_m11_s5_w277f03bf2-3cc6-4c75-8c25-398f2c6eaf05,cdp2w12_m11_s5_w3bcb390d0-0475-4347-89a3-5c2666545de1,cdp2w12_m11_s5_w1c0b9e844-f800-49f2-8b71-3d3196e97326,cdp2w12_m11_s5_w5cf873e6c-3c57-4a02-8034-9b6e9b80de07,cdp2w12_m11_s5_w4d7d32712-5de8-46e3-b732-e17d6bf76a76,78,6372
2065,14044.0,25420-B16-2,BRD-K52241838-001-05-9,25420,B16,2,SA1853360,BRD-K52241838,BROAD_CPD_ID,COc1ccc(CCn2c(S)nnc2-c2ccncc2)cc1OC,ZIZZNZDGXGANHZ-UHFFFAOYSA-N,cdp2w10_b16_s2_w2df348f04-e568-4e50-9ba0-337e43518b8c,cdp2w10_b16_s2_w3dc61d594-b7fe-473c-9955-cb5811ae933f,cdp2w10_b16_s2_w1bb47b24f-7f33-48c0-a626-a5cef32263c6,cdp2w10_b16_s2_w58d152363-9a2d-4e4a-950c-75da4393637d,cdp2w10_b16_s2_w4ef806278-05ca-4031-adf7-ea6cff4ba1bf,49,3556
2066,40755.0,25955-K21-1,BRD-K12219985-001-04-8,25955,K21,1,SA82076,glipizide,INN,Cc1cnc(cn1)C(=O)NCCc1ccc(cc1)S(=O)(=O)NC(=O)NC1CCCCC1,ZJJXGWJIGJFDTL-UHFFFAOYSA-N,cdp2w8x2_k21_s1_w2df7279e1-9b1e-4fcd-ba19-0e3634fd2b2a,cdp2w8x2_k21_s1_w396456388-bc20-4c3e-8521-c6dac3e002ac,cdp2w8x2_k21_s1_w187d953c2-95e9-4c0e-a553-fe1ba3c41bb0,cdp2w8x2_k21_s1_w517fc6a08-fcae-4da9-827e-c9a9f2584606,cdp2w8x2_k21_s1_w4250b13de-f9c7-40e1-bd23-fce815a93066,61,699
2067,24820.0,25584-A07-2,BRD-A38849179-001-06-5,25584,A07,2,SA1857825,BRD-A38849179,BROAD_CPD_ID,Cc1ccc(cc1)N1C(=O)C2C3OC(CN=C(S)N4CCN(CC4)c4ccccc4)(C=C3)C2C1=O,ZJKFYWVWCGMLAO-UHFFFAOYSA-N,cdp2w11_a07_s2_w2777723c5-57a5-4463-b880-853efed096cf,cdp2w11_a07_s2_w372b17f49-6338-42b6-a29e-27293fbf457c,cdp2w11_a07_s2_w1649ef56a-cadf-4d40-b240-e12e08e82cbb,cdp2w11_a07_s2_w54b4c0c0f-33a5-4b5c-b213-1a6cc88356eb,cdp2w11_a07_s2_w49fb7deb2-fab0-45e2-bee3-b53d2ad485d4,64,4658
2068,51102.0,26159-E20-4,BRD-K53774433-001-05-7,26159,E20,4,SA1857250,BRD-K53774433,BROAD_CPD_ID,Cc1ccc(CNC(=O)CCS(=O)(=O)c2cc(Br)cc3CCN(C(=O)C4CC4)c23)o1,ZJSBTGFSUSSADM-UHFFFAOYSA-N,cdp2w9x2-au00026617_e20_s4_w2ac0a6e23-5a80-46d2-9947-91302e35ee6c,cdp2w9x2-au00026617_e20_s4_w3a45982b5-b3c8-4722-82e4-01ec0f740da7,cdp2w9x2-au00026617_e20_s4_w1f07a784a-bf9b-4213-a54f-49ca6ed57aa4,cdp2w9x2-au00026617_e20_s4_w566c98c8b-63af-4830-ad3d-ae7c7af67875,cdp2w9x2-au00026617_e20_s4_w4cb90142b-fc06-42d7-a693-7eb9edd56f66,38,9131
2069,10871.0,25382-B03-3,BRD-K29390033-001-06-5,25382,B03,3,SA1856347,BRD-K29390033,BROAD_CPD_ID,OCC1(Cc2cccc(c2)C(F)(F)F)CCN(Cc2cc3ccccc3o2)CC1,ZKLYGKBLLBOTEC-UHFFFAOYSA-N,cdp2w10_b03_s3_w2aa3cb5bc-405b-48c3-925e-660b6fa1ae8e,cdp2w10_b03_s3_w33617aad5-39d3-41ed-86b9-b8444e3d8ad3,cdp2w10_b03_s3_w1087f5b8b-c322-46c3-b95b-0ecb16758e22,cdp2w10_b03_s3_w5771442b7-48c6-4704-9369-c7acb4818fa8,cdp2w10_b03_s3_w475e1d94e-c321-4ebe-98da-a3e9bdf9371b,30,6189
2070,50037.0,26133-P10-1,BRD-K21784579-001-06-7,26133,P10,1,SA1860096,BRD-K21784579,BROAD_CPD_ID,O=C(NCc1ccccc1)C(\C#N)=C1/N=C(NC(=O)c2ccco2)c2ccccc12,ZKTDZLWZNGWASN-ZZEZOPTASA-N,cdp2w9x2_p10_s1_w277de2248-4531-4edd-b34e-b22cd7691b82,cdp2w9x2_p10_s1_w34bd3b088-4b7d-4f21-9d6f-e8955da0cd66,cdp2w9x2_p10_s1_w1b6f18f78-b7f7-43fc-a542-55fe2cb23382,cdp2w9x2_p10_s1_w56e37a2e1-34e8-419f-9e6f-0d10a97cb808,cdp2w9x2_p10_s1_w428968018-1288-435d-809f-21d818e58fb4,50,4072
2071,10928.0,25382-F08-6,BRD-K37197712-001-05-4,25382,F08,6,SA1862003,BRD-K37197712,BROAD_CPD_ID,Cc1cccc(c1)-c1nsc(SCC(=O)c2ccc(Cl)cc2)n1,ZKTYTEORWLGWQU-UHFFFAOYSA-N,cdp2w10_f08_s6_w238b76091-8f95-4b0d-98f8-fbf9899ae336,cdp2w10_f08_s6_w39c1bc9ca-8962-411b-bca8-d0049c0183e0,cdp2w10_f08_s6_w18ab925f7-27e4-44f6-9092-451c232536cd,cdp2w10_f08_s6_w5f46328f7-2b41-488c-8fbe-9ef739b186f9,cdp2w10_f08_s6_w4d7a849f3-011c-47e2-a239-f189b82dff0c,44,4151
2072,32440.0,25677-M21-2,BRD-K40173101-001-05-9,25677,M21,2,SA1857891,BRD-K40173101,BROAD_CPD_ID,Cc1nn2c(ccnc2c1-c1ccccc1)-c1ccccc1,ZLFMVTBYEJFZAI-UHFFFAOYSA-N,cdp2w12_m21_s2_w210be5873-c57b-4928-86d3-e07a43cb308e,cdp2w12_m21_s2_w3ce7c01ef-526b-4668-ba72-4d40c22e022d,cdp2w12_m21_s2_w1df997d87-75ba-4634-b1fb-6042e550efe9,cdp2w12_m21_s2_w5addfa8bc-1ceb-4264-b04b-c520398e6126,cdp2w12_m21_s2_w492a4ba5b-ddbd-4b11-816e-61cffdf2050b,73,7050
2073,53499.0,26207-G10-1,BRD-A50925097-001-05-7,26207,G10,1,SA1852940,BRD-A50925097,BROAD_CPD_ID,CCN1CCCC1CN(Cc1cc2ccc(C)c(C)c2nc1O)C(=O)Nc1ccccc1OC,ZMHVUYNUULKBQA-UHFFFAOYSA-N,cdp2w9x2-au00026617_g10_s1_w20a4f2860-162e-454f-a27d-00aefe1659ae,cdp2w9x2-au00026617_g10_s1_w39b0e3969-c1d9-44a8-9771-ed6203f65947,cdp2w9x2-au00026617_g10_s1_w10e49b808-ca54-4968-826e-1996cd5a4aed,cdp2w9x2-au00026617_g10_s1_w50b046de6-6307-4a67-91d9-09bc6d390c3a,cdp2w9x2-au00026617_g10_s1_w4ace0b944-237a-48d7-84da-f08303609f49,73,7100
2074,45834.0,26058-K05-4,BRD-K76738405-001-05-9,26058,K05,4,SA1855597,BRD-K76738405,BROAD_CPD_ID,COC(=O)c1sc2nc(C)cc(C)c2c1N,ZMZJLJJFYBUPKH-UHFFFAOYSA-N,cdp2w9x2_k05_s4_w267f593d4-eba9-44e1-980d-5d0ffd2dca67,cdp2w9x2_k05_s4_w330b99a53-3c20-4fcf-b1a1-6554a1f2e16b,cdp2w9x2_k05_s4_w160515c8a-fd95-41f1-a711-eeb298f686ca,cdp2w9x2_k05_s4_w5f673f5bf-bdab-4439-b75f-855d6e96e973,cdp2w9x2_k05_s4_w4cdfbcbbe-eaa6-4713-ab1b-d06e11acc2ac,64,4641
2075,25187.0,25585-C03-3,BRD-K86055821-001-07-8,25585,C03,3,SA1859796,BRD-K86055821,BROAD_CPD_ID,Cc1c(cnn1-c1ccc(Cl)cc1)C(=O)N(Cc1cccs1)Cc1ccccc1,ZNQUQWGFIOFWNM-UHFFFAOYSA-N,cdp2w11_c03_s3_w2cceeb3ad-9958-42ff-978f-5714304e5cda,cdp2w11_c03_s3_w33adbf685-c3f5-4761-9948-bad9fc178e2f,cdp2w11_c03_s3_w17c997de3-3a7e-44d9-9c81-b7473c0d79db,cdp2w11_c03_s3_w580c5bc21-59d6-4a6d-b9af-99e6213ddc4f,cdp2w11_c03_s3_w4f5ae3690-4f76-45d7-8391-e543df1558be,83,5135
2076,2761.0,24303-M06-2,BRD-A83859836-001-01-4,24303,M06,2,SA82521,tropisetron,INN,CN1C2CCC1CC(C2)OC(=O)c1c[nH]c2ccccc12,ZNRGQMMCGHDTEI-UHFFFAOYSA-N,cdp2bioactives_m06_s2_w2084002ef-58b3-491a-8c2a-92e727d2721e,cdp2bioactives_m06_s2_w36624812d-6442-44e1-8efc-b12761974ef0,cdp2bioactives_m06_s2_w1354e0a54-f38e-4c36-81da-5c4a85aa5624,cdp2bioactives_m06_s2_w511a8101a-2222-4571-8e29-cc06454454b5,cdp2bioactives_m06_s2_w415eb3443-bfaa-4bb5-9aa1-f7050c9ff62c,107,80
2077,10685.0,25380-G06-3,BRD-K90142941-001-05-7,25380,G06,3,SA1856113,BRD-K90142941,BROAD_CPD_ID,FC(F)(F)c1cccc(c1)-c1ccc(\C=C2/N=C(OC2=O)c2ccco2)o1,ZNSQBTBEQOALTN-UVTDQMKNSA-N,cdp2w10_g06_s3_w2b61526b5-7919-48f8-bfbc-36a1df906b93,cdp2w10_g06_s3_w37c1dadac-39a7-4b08-9cbd-3ab4ac949d9b,cdp2w10_g06_s3_w16638d759-c5fa-4cc8-ad23-282929941436,cdp2w10_g06_s3_w5dd0bfaef-e551-4d56-9322-15b3f3a57f51,cdp2w10_g06_s3_w4dfcc49ce-9cb4-4d0b-8929-3ea2b33ac9d1,69,3141
2078,8591.0,24645-H18-3,BRD-K19601332-001-01-6,24645,H18,3,SA849939,BRD-K19601332,BROAD_CPD_ID,C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(C)cc2)Oc2cc(ccc2S1(=O)=O)C1=CCCC1,ZNXYRHHWSDGXHP-SWYRRKHMSA-N,cdp2w3_h18_s3_w262e5e3cb-60b7-4bc1-aee7-fbe157435f3c,cdp2w3_h18_s3_w3d3b898d0-79e8-484d-bad5-b69a532611db,cdp2w3_h18_s3_w1f8c02429-a241-4e69-b1b2-ff94a0b6f972,cdp2w3_h18_s3_w50a83734d-86c8-484d-be1a-321008a67221,cdp2w3_h18_s3_w474008fa1-1755-475d-8024-26d52a715abf,104,10268
2079,40385.0,25949-B11-3,BRD-A50675702-001-03-0,25949,B11,3,SA82069,fipronil,USP,Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)C(F)(F)F,ZOCSXAVNDGMNBV-UHFFFAOYSA-N,cdp2w8x2_b11_s3_w27fc94e3a-180a-4f0c-b683-92b866f37ba6,cdp2w8x2_b11_s3_w3570c572d-dda0-445d-88e6-2771ef27e096,cdp2w8x2_b11_s3_w1ef47e0ed-8456-439e-9372-fe118e2a7b29,cdp2w8x2_b11_s3_w547d83a34-bfbc-4370-b143-87628cc9a129,cdp2w8x2_b11_s3_w4fcb7e553-c689-43d3-8eee-78ef01762f26,47,742
2080,10566.0,25378-N05-4,BRD-K55419080-001-04-6,25378,N05,4,SA1857983,BRD-K55419080,BROAD_CPD_ID,Cc1cc(=O)oc2cc(OCc3ccc(cc3)C(=O)N3CCN(CC3)c3ccc(cc3)[N+]([O-])=O)ccc12,ZOFSNNLJQCNHOO-UHFFFAOYSA-N,cdp2w10_n05_s4_w269e543b2-d41f-4732-99a2-6a50ea633ca4,cdp2w10_n05_s4_w39cde7e42-94ec-4273-abe8-353a2a704519,cdp2w10_n05_s4_w12126d2d5-36ef-4808-8a55-408976ee5a84,cdp2w10_n05_s4_w5886f25f5-3f40-412d-a408-24fd68f80765,cdp2w10_n05_s4_w42bb3d8f8-a830-47da-a206-17136b1e892c,75,6546
2081,29992.0,25643-O20-2,BRD-K42133523-001-05-1,25643,O20,2,SA1858633,BRD-K42133523,BROAD_CPD_ID,C(Cc1ccccc1)Nc1nc2ccccc2s1,ZONFDQCCZSBEFC-UHFFFAOYSA-N,cdp2w12_o20_s2_w2383412d6-c8d3-4015-90f8-2b26e135d16e,cdp2w12_o20_s2_w3e5e814d9-a87f-495f-a925-5e9815082da1,cdp2w12_o20_s2_w1eabe3b67-a71d-4440-97c8-224c0546d781,cdp2w12_o20_s2_w58c810e67-12e1-4fb1-bfd4-29bd1790f5f0,cdp2w12_o20_s2_w47750ff6c-4c2e-4e16-8ae3-3924bb2e6bda,33,5771
2082,318.0,24277-N06-1,BRD-K36756879-003-04-6,24277,N06,1,SA59305,ethaverine,INN,CCOc1ccc(Cc2nccc3cc(OCC)c(OCC)cc23)cc1OCC,ZOWYFYXTIWQBEP-UHFFFAOYSA-N,cdp2bioactives_n06_s1_w28930a1c3-150d-4601-a16f-3722453f6839,cdp2bioactives_n06_s1_w337184b26-e91c-4984-9561-892037b77ffe,cdp2bioactives_n06_s1_w15c6e3f77-f315-4b81-b0d9-700f525ef373,cdp2bioactives_n06_s1_w5365e4f17-1945-485f-81e6-140d644170e5,cdp2bioactives_n06_s1_w4c94a75aa-89b0-4ce1-b612-ed92451e9b89,54,8066
2083,49410.0,26126-O09-4,BRD-K57901428-001-05-9,26126,O09,4,SA1854326,BRD-K57901428,BROAD_CPD_ID,CN(C1CCN(C)CC1)c1nc(nc2ccccc12)-c1ccc(C)cc1,ZOXGTPAJSZQQQL-UHFFFAOYSA-N,cdp2w9x2_o09_s4_w2c4e051a4-c3e2-499b-a1c8-0e2a784405fb,cdp2w9x2_o09_s4_w33db5081f-4c58-4782-91dc-2895d32d72ac,cdp2w9x2_o09_s4_w1b2510ad4-85ee-437b-84b0-fdcd5a49be87,cdp2w9x2_o09_s4_w58fc7546d-959c-4fd8-b1f0-088f08ff8f96,cdp2w9x2_o09_s4_w49f97cbef-c397-4493-9f65-b001ab4dc6e5,49,6527
2084,32968.0,25679-J03-2,BRD-K35848108-001-05-6,25679,J03,2,SA1860786,BRD-K35848108,BROAD_CPD_ID,CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)c2cccc(OC)c2O)c1,ZOXPMPMPLQXDNO-UHFFFAOYSA-N,cdp2w12_j03_s2_w29cdcffa6-2d47-4487-a023-35efdcde4f68,cdp2w12_j03_s2_w356140878-6fdb-4fab-9c48-59da4b62ea7f,cdp2w12_j03_s2_w18bc78797-65b4-49ef-8ca7-0294e24072db,cdp2w12_j03_s2_w56dfc59bc-6428-4495-ba89-6ef8c0576980,cdp2w12_j03_s2_w405e1304e-a782-4444-8f23-6613d24da0ed,37,9367
2085,54087.0,26224-I16-1,BRD-K89997465-001-02-0,26224,I16,1,SA58226,chlorpromazine,INN,CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12,ZPEIMTDSQAKGNT-UHFFFAOYSA-N,cdp2w9x2_i16_s1_w266afa3b7-4590-4b60-8a80-923b57ecd5f0,cdp2w9x2_i16_s1_w3a9d7e2a8-8284-475b-9158-617eda4a4beb,cdp2w9x2_i16_s1_w14bb5cc4d-caf6-423d-ba75-0722bfe796e9,cdp2w9x2_i16_s1_w506dd4bf6-4710-4bce-b0a4-9b02d0a0f971,cdp2w9x2_i16_s1_w4c5566466-9bbc-4319-abe0-0ec249cbe12c,47,120
2086,38627.0,25732-N11-3,BRD-K15762320-001-05-5,25732,N11,3,SA1861558,BRD-K15762320,BROAD_CPD_ID,COc1ccc(cc1)C(=S)N1CCN(C)CC1,ZQLVMFDFVBMDIK-UHFFFAOYSA-N,cdp2w12_n11_s3_w23abd1702-fd86-44cc-9288-c51c731d4bde,cdp2w12_n11_s3_w3b3e3825a-3792-46d5-9f7d-4d2e5d852f7b,cdp2w12_n11_s3_w18a42b8f1-fff0-45aa-84ea-a514272dbee8,cdp2w12_n11_s3_w5c1b69d80-1150-46b5-9129-7dd03fc2d776,cdp2w12_n11_s3_w4b4dea780-8de5-40c9-bcc4-668422020ebe,58,9245
2087,25126.0,25585-A05-2,BRD-A86381030-001-10-1,25585,A05,2,SA1859817,BRD-A86381030,BROAD_CPD_ID,Oc1c(cc(Cl)c2cccnc12)C(Nc1ccccn1)c1cccnc1,ZQQXRNUVLBLBNW-UHFFFAOYSA-N,cdp2w11_a05_s2_w2e0719671-6b03-4da5-8860-f535edb90a2f,cdp2w11_a05_s2_w3b94741dd-3b68-4392-822a-4fe6cff1e0da,cdp2w11_a05_s2_w1fc21d80c-8616-4a72-873c-17ebf7cbbbd7,cdp2w11_a05_s2_w572737c9c-2dc4-4e1a-9e39-7643e40403ae,cdp2w11_a05_s2_w4c09661f4-001d-4da7-9d32-d57bbc2501b9,32,6700
2088,44523.0,25989-B04-1,BRD-K42095107-001-02-3,25989,B04,1,SA36921,daidzein,primary-common,Oc1ccc(cc1)-c1coc2cc(O)ccc2c1=O,ZQSIJRDFPHDXIC-UHFFFAOYSA-N,cdp2w8x2_b04_s1_w224a42896-b6a6-4f6a-9a51-5365bc9a0508,cdp2w8x2_b04_s1_w31a8a7f09-92e6-4c0a-aa22-f2eb80a142a2,cdp2w8x2_b04_s1_w1418db6ad-a27d-4d87-b16a-fa8039f94095,cdp2w8x2_b04_s1_w506ad6aaa-4292-43a6-ab96-de0881d47f63,cdp2w8x2_b04_s1_w49a1caf8d-5414-44d2-bdad-9312448b5686,35,81
2089,32745.0,25678-M15-1,BRD-K20079322-001-05-5,25678,M15,1,SA1859535,BRD-K20079322,BROAD_CPD_ID,Cc1nc(Nc2ccc(Cl)cc2)c2nnn(Cc3ccccc3)c2n1,ZQWFSYVCIKBQRZ-UHFFFAOYSA-N,cdp2w12_m15_s1_w2742d789e-735e-41d9-ae6c-f48b3ba21133,cdp2w12_m15_s1_w348565873-7f42-4ba1-9da7-979b293fe4ec,cdp2w12_m15_s1_w1c38bcb1d-0ff0-4379-9fc8-82c41255797d,cdp2w12_m15_s1_w5e6ed852b-ef13-430e-ae9d-063f89171d8d,cdp2w12_m15_s1_w45116395c-1ed8-433d-878f-4d4ba903d382,42,4132
2090,51983.0,26181-A11-3,BRD-K64647292-001-05-2,26181,A11,3,SA1857767,BRD-K64647292,BROAD_CPD_ID,CN(c1ccccc1)c1nc(N)c(C#N)c(CC#N)c1C#N,ZRHVVRJSWMFJMC-UHFFFAOYSA-N,cdp2w9x2-au00026617_a11_s3_w2981b167d-39b5-49a5-a888-5fd0f37369a7,cdp2w9x2-au00026617_a11_s3_w30c1a76e7-fd80-46ca-bd63-56c80ec8c063,cdp2w9x2-au00026617_a11_s3_w14e0cbd72-ebbb-4f80-aaaa-1ca0fa93bde2,cdp2w9x2-au00026617_a11_s3_w50157cce3-1627-4a55-a984-089c6430823b,cdp2w9x2-au00026617_a11_s3_w4520d2e64-3db7-4800-942c-192c17030cb8,41,1547
2091,36270.0,25695-M19-4,BRD-A20398558-001-05-6,25695,M19,4,SA1855845,BRD-A20398558,BROAD_CPD_ID,COc1cc(ccc1O)C1Nc2ccccc2C(=O)N1c1ccccc1OC,ZRONGYGNCHSBHS-UHFFFAOYSA-N,cdp2w12_m19_s4_w2c2526c5b-cfeb-4a7f-b8cb-71a6fe4effba,cdp2w12_m19_s4_w35051464a-aed7-4386-ba19-591c254f480e,cdp2w12_m19_s4_w101d87f54-d869-4496-ac3d-d8fae7932d5f,cdp2w12_m19_s4_w5fa9d0cff-d030-44f2-9415-588c4e9c6bc7,cdp2w12_m19_s4_w47e29c921-9572-43bd-a3a1-5c77e7b1c265,44,8182
2092,26319.0,25591-B09-1,BRD-K08932351-001-04-8,25591,B09,1,SA1859686,BRD-K08932351,BROAD_CPD_ID,O=C(N1C(=O)c2cccc3cccc1c23)c1ccco1,ZRZBTHCAIRVGTE-UHFFFAOYSA-N,cdp2w11_b09_s1_w2b30fd49d-bdf2-4469-8f0a-5b9c502c4b1a,cdp2w11_b09_s1_w38bcd2f5d-f0cc-492d-82d2-c1c320e18dfb,cdp2w11_b09_s1_w1cf3c48b4-c40e-4e2a-861e-bd6fb1369599,cdp2w11_b09_s1_w567fa02c3-7b05-4769-b392-f7dbb5fcc522,cdp2w11_b09_s1_w4c2f3b825-4a07-4798-96ae-70b3d52a2a16,77,7227
2093,42271.0,25967-P06-5,BRD-K39160765-003-01-1,25967,P06,5,SA791975,4-chlorophenylguanidine,to-be-curated,NC(=N)Nc1ccc(Cl)cc1,ZSJNJAJDBNFVCA-UHFFFAOYSA-N,cdp2w8x2_p06_s5_w2256b71b2-ff27-48be-bdea-1203ff354d01,cdp2w8x2_p06_s5_w30f3b60ff-ee05-42d4-b9f6-c25d073e389d,cdp2w8x2_p06_s5_w1d63389b2-df6f-4f1d-8177-953cf401bae1,cdp2w8x2_p06_s5_w53be086c3-7e6a-444c-bc9a-a27998a246ee,cdp2w8x2_p06_s5_w497ee680a-15c5-4333-8396-d20e5f325829,18,479
2094,52065.0,26181-G22-1,BRD-K13189410-001-06-2,26181,G22,1,SA1861432,BRD-K13189410,BROAD_CPD_ID,Oc1c(C(=O)NCc2ccc(Cl)cc2)c(=O)n(CC=C)c2ccccc12,ZSPNXMNSMFLTLY-UHFFFAOYSA-N,cdp2w9x2-au00026617_g22_s1_w242e56f47-7b44-4dc3-a65b-ab901a0aeca0,cdp2w9x2-au00026617_g22_s1_w3f7bb891b-24c1-43ea-8d9d-0f68e8d1d041,cdp2w9x2-au00026617_g22_s1_w1fe83590d-027d-4093-8a28-8bd10aac0de3,cdp2w9x2-au00026617_g22_s1_w51a692962-19e3-4ae9-9986-6b2495fab70c,cdp2w9x2-au00026617_g22_s1_w4e964c46c-963e-4835-8b3d-a77bb0f3b8ea,57,6762
2095,24329.0,25581-I05-3,BRD-K89304620-001-07-0,25581,I05,3,SA1860405,BRD-K89304620,BROAD_CPD_ID,CC(C)=C1C(C)=NN(C1=O)c1ccccc1,ZSQBZSXNYJOIQD-UHFFFAOYSA-N,cdp2w11_i05_s3_w27e8fd15a-7d59-43ed-857a-841338c63544,cdp2w11_i05_s3_w3c88197cf-2545-42e3-a6a1-e7ed275eafc7,cdp2w11_i05_s3_w1d9c8e5de-f13f-4e70-8ea5-bb0da649eaa6,cdp2w11_i05_s3_w54d230030-46f0-43f6-927a-318691f6edc4,cdp2w11_i05_s3_w4f4712ce2-3c34-4226-abdc-f4101fff9c90,42,3232
2096,14335.0,25422-B06-5,BRD-K04781025-001-06-4,25422,B06,5,SA1857400,BRD-K04781025,BROAD_CPD_ID,Cc1nn(C)c(C)c1\C=C\C(=O)c1ccc(Cl)cc1Cl,ZTGHPXIQAQTMOD-VOTSOKGWSA-N,cdp2w10_b06_s5_w28499ab3b-d4cf-44f7-9087-4dafb7ecab4e,cdp2w10_b06_s5_w39b144f5a-2c1a-42c0-9416-6ca14b5b7461,cdp2w10_b06_s5_w11e462057-a969-4845-8f96-17219a0180af,cdp2w10_b06_s5_w5bd0001cf-4f67-4d8b-9a12-2f844d5db723,cdp2w10_b06_s5_w45120bd39-98e9-4e3e-b3aa-7a743b737a41,40,1996
2097,51904.0,26174-N03-2,BRD-A25536415-001-05-9,26174,N03,2,SA1854704,BRD-A25536415,BROAD_CPD_ID,CCN(C1CCS(=O)(=O)C1)C(=O)CSc1nnc2ccccn12,ZTLXJMGSTKVYOO-UHFFFAOYSA-N,cdp2w9x2-au00026617_n03_s2_w2b6867fbe-1cf5-4d23-906e-b895e0d0137a,cdp2w9x2-au00026617_n03_s2_w3cb6e90e8-b58d-4d83-bafe-daad67210791,cdp2w9x2-au00026617_n03_s2_w190d253dc-1382-442d-b692-d3334c4c00ea,cdp2w9x2-au00026617_n03_s2_w5a10c256a-d2d2-4f4c-b34e-cfcf94e56ef3,cdp2w9x2-au00026617_n03_s2_w4af04b208-1322-4f9e-84bf-e27528aa2615,97,8258
2098,23904.0,25580-C06-4,BRD-A60657908-001-05-3,25580,C06,4,SA1857194,BRD-A60657908,BROAD_CPD_ID,COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2cc1OC1OC(COC(=O)CC(C)(O)CC(O)=O)C(O)C(O)C1O,ZTLZGWDERZVHNS-UHFFFAOYSA-N,cdp2w11_c06_s4_w2a16d6c7b-8354-4b82-a765-734074ac4deb,cdp2w11_c06_s4_w3c215b7d2-a12b-475f-bc23-6872dcd995da,cdp2w11_c06_s4_w10371569c-04e8-4a0b-bdb3-d213d37b6cdf,cdp2w11_c06_s4_w565e47a78-75e3-4d89-88dc-55f6077ffc73,cdp2w11_c06_s4_w484198ff9-9812-4541-a7a9-74d0ae1db138,88,4565
2099,35594.0,25692-I14-6,BRD-K47117281-001-05-1,25692,I14,6,SA1854473,BRD-K47117281,BROAD_CPD_ID,COc1ccccc1NC(=O)c1sc2ncn(Cc3ccccc3C)c(=O)c2c1C,ZTRWCLRJZHJKAF-UHFFFAOYSA-N,cdp2w12_i14_s6_w273bc15a8-6165-4d4f-8c2f-c7b1a9974e37,cdp2w12_i14_s6_w3443149b0-be0d-44b0-bafa-45c423712b5d,cdp2w12_i14_s6_w1bac3ddf8-c5c3-4bb4-93a1-95c142cabfec,cdp2w12_i14_s6_w53a6fe895-dccf-458b-a38e-6cd15ca7fb58,cdp2w12_i14_s6_w490de5e4d-baae-47f8-84e1-884b6b01b07b,50,6859
2100,14990.0,25426-E11-6,BRD-A69594173-001-06-5,25426,E11,6,SA1856273,BRD-A69594173,BROAD_CPD_ID,CC(C)(C)n1nnnc1C(N1CCCC2(CCCCC2)C1)c1cccs1,ZUDUIVDMNJJWCM-UHFFFAOYSA-N,cdp2w10_e11_s6_w26312dc1b-8f82-4014-a211-e6a51617e130,cdp2w10_e11_s6_w37f992d6a-ea9a-4a13-994a-89b170775766,cdp2w10_e11_s6_w141292514-eb92-4b0b-a637-73065da9abe1,cdp2w10_e11_s6_w58af1d1ee-01a4-43ab-8040-5461c63fb41b,cdp2w10_e11_s6_w4857d6107-062d-4e52-925b-400ec5688376,65,2848
2101,19031.0,25503-L22-3,BRD-K86942182-001-05-4,25503,L22,3,SA1854897,BRD-K86942182,BROAD_CPD_ID,Sc1ncc(-c2ccc(Cl)cc2)n1-c1ccccc1,ZUHUPNVZKHINMK-UHFFFAOYSA-N,cdp2w11-au00029680_l22_s3_w22235304d-55c1-4703-80bb-18f26f6cf9ed,cdp2w11-au00029680_l22_s3_w39d00f235-5424-47d1-abe0-5fbb85db15fd,cdp2w11-au00029680_l22_s3_w1a4b03811-c2b2-4f2d-b59f-83f93e4a2a34,cdp2w11-au00029680_l22_s3_w587155bcc-47aa-4671-a977-1950187e5416,cdp2w11-au00029680_l22_s3_w429d13a79-ce6b-47d5-89b1-df66be3076d9,72,2742
2102,46432.0,26061-N05-2,BRD-K28579021-001-05-0,26061,N05,2,SA1858363,BRD-K28579021,BROAD_CPD_ID,COc1ccc(cc1OC)C1(CCCCC1)C(N)=O,ZUYMXBMGAFZKDR-UHFFFAOYSA-N,cdp2w9x2_n05_s2_w2d8d250ef-e4e4-411f-b744-bfad48165acc,cdp2w9x2_n05_s2_w316422a29-1bf8-49c0-9ae7-09fe9d8b44c6,cdp2w9x2_n05_s2_w1a8fc1e80-9288-461b-8be2-972d230d20c4,cdp2w9x2_n05_s2_w5806af9e5-fdbb-479a-9c94-37023d750e20,cdp2w9x2_n05_s2_w46da0344e-6690-463d-a50c-1d98d1a57b04,57,4410
2103,8724.0,24664-A18-4,BRD-K61220066-001-01-4,24664,A18,4,SA1434455,BRD-K61220066,BROAD_CPD_ID,COCC(=O)Nc1ccc2OC[C@@H](C)N(Cc3cc(F)ccc3F)C[C@@H](C)[C@H](CN(C)C(=O)c2c1)OC,ZVOSTPFCAQQCID-GAKIBJFNSA-N,cdp2w3_a18_s4_w29a7ac43e-6c6f-4dfd-b5f6-40e4deb54ceb,cdp2w3_a18_s4_w367b17824-ec47-49b5-9f99-cbe71fb770a5,cdp2w3_a18_s4_w14d4c242a-7394-482f-81e2-dbbad35012a1,cdp2w3_a18_s4_w52ec4a471-8405-4cd4-97fb-1ca9ce5e4352,cdp2w3_a18_s4_w455e8c815-06c6-4e03-9115-cfe26187e67b,43,10546
2104,10311.0,25376-M07-1,BRD-K80569662-001-05-0,25376,M07,1,SA1856200,BRD-K80569662,BROAD_CPD_ID,Clc1ccccc1OCCn1cnc2ccccc12,ZVOXLAMBONAQPC-UHFFFAOYSA-N,cdp2w10_m07_s1_w20b742ad4-5a3f-4a7a-bcd6-bd0c64f982c8,cdp2w10_m07_s1_w37e16b6d6-7e86-44fe-9bfb-60afda27d310,cdp2w10_m07_s1_w1e4624117-ea16-4ed5-aa7a-4cdb380e1bba,cdp2w10_m07_s1_w520337845-b945-4a23-b1a0-3ae1fda3aa15,cdp2w10_m07_s1_w407492134-3d8a-41da-a829-04817c943f05,79,7606
2105,31518.0,25674-K03-4,BRD-A27762595-001-04-4,25674,K03,4,SA1853773,BRD-A27762595,BROAD_CPD_ID,COc1ccc(Cl)cc1NC(=O)C1CSC(=N1)c1ccncc1,ZVYQJRGMKAGQOG-UHFFFAOYSA-N,cdp2w12_k03_s4_w244997a46-d3ce-432d-a875-7cfed1e981e3,cdp2w12_k03_s4_w30a3cd07f-9a7f-4658-b710-538487f587c0,cdp2w12_k03_s4_w143fedc53-4fa1-43cb-aa21-792b3522ac39,cdp2w12_k03_s4_w5ebd96e84-fc43-49cf-bf82-f3c8f779ff0b,cdp2w12_k03_s4_w4d861c7c0-ee27-4d6e-aabc-382853fb4f04,73,1586
2106,14880.0,25424-O10-4,BRD-K77393308-001-06-8,25424,O10,4,SA1857709,BRD-K77393308,BROAD_CPD_ID,O=C(Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccc(CN2CCc3ccccc3C2)cc1,ZWLIOLNWONUVEB-UHFFFAOYSA-N,cdp2w10_o10_s4_w2cc0838bc-04b0-4023-a58f-c9099415eb36,cdp2w10_o10_s4_w35ed40730-a667-40d3-8ddc-ba1624b50141,cdp2w10_o10_s4_w1caa95b89-ec1b-4566-9c2d-b41ef539058d,cdp2w10_o10_s4_w5ef438d13-b469-4f2b-9cc7-b02960de83b9,cdp2w10_o10_s4_w4c8c0662d-0b8e-40fc-8d08-a18c1d0c8f26,18,9385
2107,31538.0,25674-L07-6,BRD-A15615781-001-06-7,25674,L07,6,SA1857112,BRD-A15615781,BROAD_CPD_ID,COC(=O)C(C)Oc1cc(C)cc2oc(=O)c3CCCCc3c12,ZWNAXHWQBFOLGY-UHFFFAOYSA-N,cdp2w12_l07_s6_w28acd29c2-25b1-4f04-aacf-f2b7b512394a,cdp2w12_l07_s6_w3cf388dd9-d7d7-49ef-858d-e97d3110f040,cdp2w12_l07_s6_w17bae6859-02b6-4962-a567-b8d87956807f,cdp2w12_l07_s6_w593bd68b3-c7e7-40a2-beb8-72c9b13bd87d,cdp2w12_l07_s6_w4176658ea-2b75-45fc-8be0-0f5277db6357,58,7434
2108,29621.0,25642-L20-3,BRD-K58112932-001-05-1,25642,L20,3,SA1858573,BRD-K58112932,BROAD_CPD_ID,COC(=O)c1c2CCCCCc2sc1N=C(S)Nc1ccc(F)cc1[N+]([O-])=O,ZWPGINLNSOSFIM-UHFFFAOYSA-N,cdp2w12_l20_s3_w2c3d2a3c1-7c47-4a31-9489-247c2cffa2ed,cdp2w12_l20_s3_w3c57a33bb-8e55-4118-a413-8b1143857bc2,cdp2w12_l20_s3_w18a248417-9c79-4fc9-af69-c54840db66d7,cdp2w12_l20_s3_w5dc88e3dd-398a-4add-b013-f995b03dca47,cdp2w12_l20_s3_w4a4922121-170c-4e92-8f0d-b5ef89750bec,86,7864
2109,30102.0,25663-E11-4,BRD-K02582347-001-06-9,25663,E11,4,SA1852363,BRD-K02582347,BROAD_CPD_ID,Oc1ccccc1NS(=O)(=O)c1ccc(Cl)nc1,ZXNVTQNRWSYAMZ-UHFFFAOYSA-N,cdp2w12_e11_s4_w2e4b18d52-6fb1-42bd-beef-76c5b41cef98,cdp2w12_e11_s4_w3af6448e4-0634-4981-a7ba-e0be106aed7e,cdp2w12_e11_s4_w127ccf127-93e3-4396-99e8-5d4255e09ddd,cdp2w12_e11_s4_w575e70fdd-f3ee-42aa-9273-aa57f540d334,cdp2w12_e11_s4_w4ea4a4ee9-1d0f-45f7-bf00-5543627d9d35,78,2861
2110,22097.0,25572-H04-3,BRD-K38205896-001-05-2,25572,H04,3,SA1862216,BRD-K38205896,BROAD_CPD_ID,CCOC(=O)N1CCN(CC1)C(=O)COc1ccc2OC3(CCN(CC3)C(C)=O)CC(=O)c2c1,ZYELQBWNTCMLJF-UHFFFAOYSA-N,cdp2w11_h04_s3_w2289b5843-a95a-40fc-9015-fd0495f268a0,cdp2w11_h04_s3_w3534533e4-ce0c-4ddb-b44e-8af45346d79e,cdp2w11_h04_s3_w1d37610a9-4b60-4935-9381-9131ff2ce571,cdp2w11_h04_s3_w5f7e49845-dbc8-4d23-95c7-0f7538dcd323,cdp2w11_h04_s3_w421db0d52-813d-4f40-89dd-c767935ded1a,83,3328
2111,27590.0,25598-E09-6,BRD-K18000429-001-05-7,25598,E09,6,SA1859239,BRD-K18000429,BROAD_CPD_ID,Brc1ccccc1OCc1ccc(cc1)C(=O)N1CCCCC1,ZZLYSPCQPXRIKW-UHFFFAOYSA-N,cdp2w11_e09_s6_w27bfc44ef-d0b2-45d2-b568-aab751e4315b,cdp2w11_e09_s6_w30f4a6ff4-7435-4c36-9624-797ce5aec776,cdp2w11_e09_s6_w110e28e97-48c3-403d-b8e5-880ed360775e,cdp2w11_e09_s6_w542f5dddc-af9a-4e89-910d-7aa637efaa42,cdp2w11_e09_s6_w4161db930-1836-48c7-aa6a-51fc63342835,59,5954
2112,17089.0,25438-A12-5,BRD-A65735348-001-06-8,25438,A12,5,SA1861353,BRD-A65735348,BROAD_CPD_ID,COc1ccc(N=C(S)NC(NC(=O)c2cccc(Cl)c2)C(Cl)(Cl)Cl)c(c1)[N+]([O-])=O,ZZNOGSGZWQWJEL-UHFFFAOYSA-N,cdp2w10_a12_s5_w295e647b9-a4ba-479d-82d4-d20e843af0ad,cdp2w10_a12_s5_w3e789ba6d-80f6-46ed-8ca1-e284ce81ca24,cdp2w10_a12_s5_w1546c0f81-9f9e-42de-bc93-39279ba8ea62,cdp2w10_a12_s5_w50f5cbc4a-7921-4117-afa8-1112d587fb7b,cdp2w10_a12_s5_w49771f841-f339-4bd5-83b8-6d66e285f9fd,68,1756
2113,45216.0,25991-J24-4,BRD-K71125014-001-03-2,25991,J24,4,SA39659,sulfadimethoxine,INN,COc1cc(NS(=O)(=O)c2ccc(N)cc2)nc(OC)n1,ZZORFUFYDOWNEF-UHFFFAOYSA-N,cdp2w8x2_j24_s4_w283bc27ed-3128-497a-af64-5dbdb47dfa1f,cdp2w8x2_j24_s4_w320595b65-d3d8-4752-a82a-11dfc6efe7e4,cdp2w8x2_j24_s4_w12523665f-8286-4bff-9c69-a9d8c2a0058d,cdp2w8x2_j24_s4_w57aef438a-b16e-49ff-b8ca-713e739e89e5,cdp2w8x2_j24_s4_w4837d2118-fbfb-4029-b5ff-8bf488bff8db,53,593
2114,54925.0,26247-O14-5,BRD-K96799727-001-01-7,26247,O14,5,SA792964,pifithrin-mu,primary-common,NS(=O)(=O)C#Cc1ccccc1,ZZUZYEMRHCMVTB-UHFFFAOYSA-N,cdp2w9x2_o14_s5_w21f6ce754-9e4a-4d05-9932-df0f2370cacf,cdp2w9x2_o14_s5_w3a6a71cb5-0471-4cb6-9821-bf23ca5a2fe9,cdp2w9x2_o14_s5_w121ec83c3-60e0-4830-ae56-f4176ffadfa3,cdp2w9x2_o14_s5_w51e50afcc-b628-401c-bc84-2a7430687c4f,cdp2w9x2_o14_s5_w414e5ca87-4290-4e2f-837a-86a2888cdc28,26,1400
0,,25566-P04-2,BRD-K20929305-001-06-0,25566,P04,2,SA1852676,BRD-K20929305,BROAD_CPD_ID,NC1=C(C#N)C2(CCCCC2)C(C#N)=C(N1)SCc1ccc(Br)cc1,AHWXPMSTZOIWOT-UHFFFAOYSA-N,cdp2w11_p04_s2_w2f2f8a3b9-1f41-46f0-b3e3-2c9ad5f9a323,cdp2w11_p04_s2_w3900085dd-5241-4fdc-bc2f-dab8b15ab0e1,cdp2w11_p04_s2_w19de7e759-a60b-4959-a6bf-d81456ed49a3,cdp2w11_p04_s2_w538d42a89-d54e-4481-8c17-51514be410e5,cdp2w11_p04_s2_w44d31d70b-0c04-4ad3-9824-703ee6d0f6a3,75,2803
1,,25565-C18-6,BRD-K82837100-001-05-9,25565,C18,6,SA1861443,BRD-K82837100,BROAD_CPD_ID,Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1CCN(Cc2ccc3OCOc3c2)CC1,CXBSZNOKLYYNQU-UHFFFAOYSA-N,cdp2w11_c18_s6_w28f877668-b3aa-46e2-9273-af2532e32060,cdp2w11_c18_s6_w3a6c74203-2f34-4aba-afe1-60440683e897,cdp2w11_c18_s6_w1b59a0c03-fb43-43fe-8701-5ab495003542,cdp2w11_c18_s6_w54494d15a-f3ae-443d-97ee-181b1bac46b5,cdp2w11_c18_s6_w432235faa-b848-4ae6-a2a4-fbdfc36ba0d8,85,5634
2,,25567-K04-6,BRD-K86231088-001-07-3,25567,K04,6,SA1855629,BRD-K86231088,BROAD_CPD_ID,O=C(N1CCN(CCc2ccccc2)CC1)c1cc2ccccc2oc1=O,DRCGCJBXZNCPEW-UHFFFAOYSA-N,cdp2w11_k04_s6_w23b46552b-e38c-4786-990b-06192f125a0e,cdp2w11_k04_s6_w301025382-4f27-464d-bf13-4e93f4e1b0ec,cdp2w11_k04_s6_w1e9fc9ead-f028-4e2b-864b-591f88722690,cdp2w11_k04_s6_w58058d2b1-3d25-444d-9850-0ff4d6635a92,cdp2w11_k04_s6_w44b53823c-2eb1-4afa-8c37-12d276e7ab37,97,8374
3,,25565-J12-4,BRD-A87545460-001-05-9,25565,J12,4,SA1855293,BRD-A87545460,BROAD_CPD_ID,COc1cc(N=C(S)N2CCCC(C)C2)c(OC)cc1Cl,DWTZCYQJCYKXHX-UHFFFAOYSA-N,cdp2w11_j12_s4_w2780888d2-64bd-4c7f-a0cb-7038c2b4adc4,cdp2w11_j12_s4_w3b0a311ed-d7ca-4ddd-9cfd-484599af1ed8,cdp2w11_j12_s4_w1e01e1816-5fbb-4a35-9337-f5e6405a8691,cdp2w11_j12_s4_w5c2157fa6-f809-4294-a782-1c6682b1ca30,cdp2w11_j12_s4_w47ee270c3-becd-4406-8f3a-b9146776a160,66,6359
4,,25565-M04-3,BRD-K15623320-001-06-7,25565,M04,3,SA1853660,BRD-K15623320,BROAD_CPD_ID,CC(C)Cc1nc2oc3c(Cl)ncnc3c2c2CCCCc12,GJYHXNUFBHVTSK-UHFFFAOYSA-N,cdp2w11_m04_s3_w2f37fe1e4-9811-4305-b538-507e4a0e317a,cdp2w11_m04_s3_w37e64d539-c2ab-4464-bc2b-c515ae87919e,cdp2w11_m04_s3_w10cd3435a-19be-40d5-824f-7471a0e37fb2,cdp2w11_m04_s3_w5681e0b4f-3983-4815-9279-a4125d19e80c,cdp2w11_m04_s3_w4950ad3d4-4cdf-4847-97b4-88c535596da8,29,4982
5,,25565-C13-1,BRD-K81142122-001-18-2,25565,C13,1,SA1860659,BRD-K81142122,BROAD_CPD_ID,Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccn1,HDXJYJIPXWVRSM-UHFFFAOYSA-N,cdp2w11_c13_s1_w28db6720a-efb9-4f18-9938-23c91f541597,cdp2w11_c13_s1_w39c7438d9-7459-4fc8-a309-87bd5d8dd4bd,cdp2w11_c13_s1_w1d06a98ef-b596-4416-9d95-5fef784bcc72,cdp2w11_c13_s1_w5bf7f7015-6f47-41b3-a398-0a32ae7cb1bf,cdp2w11_c13_s1_w4a8b69365-6314-4345-a596-86d01d76d334,0,5745
6,,25565-F15-5,BRD-K02308976-001-05-9,25565,F15,5,SA1853486,BRD-K02308976,BROAD_CPD_ID,CCOP(=O)(OCC)c1nc(oc1N1CCOCC1)-c1cccc2ccccc12,HSFMETJHHSSNFA-UHFFFAOYSA-N,cdp2w11_f15_s5_w2f2d15c08-840c-4092-8d2c-16e9e8baaaed,cdp2w11_f15_s5_w3614751a0-992b-4ec6-8ff7-f6402bcc5d7c,cdp2w11_f15_s5_w12121eb78-1a25-4d45-8f91-f51456a323ae,cdp2w11_f15_s5_w515463b48-1ae8-4ff4-981d-bb562f2da429,cdp2w11_f15_s5_w48376b08d-a17e-4d72-b4ab-986ed0c81ee3,63,6989
7,,25567-D06-3,BRD-K10870310-001-05-3,25567,D06,3,SA1860322,BRD-K10870310,BROAD_CPD_ID,NC(=O)c1cc(sc1NC(=O)Cc1ccc(s1)S(=O)(=O)N1CCOCC1)-c1ccccc1,MSYCTQCXKWCEQM-UHFFFAOYSA-N,cdp2w11_d06_s3_w205df62f6-55b5-40b4-bd41-6b4e3b91f127,cdp2w11_d06_s3_w3619c5f7b-568f-4b2d-80ad-873e4f4f4dee,cdp2w11_d06_s3_w13eba295b-befa-43fd-a267-97d4a33e3663,cdp2w11_d06_s3_w5ea518038-1125-4fcb-a834-396639133bdc,cdp2w11_d06_s3_w4caa8f0c6-e43f-463c-8bf1-4ced117ec5e1,43,6512
8,,25567-J22-4,BRD-K92964966-001-05-2,25567,J22,4,SA1856881,BRD-K92964966,BROAD_CPD_ID,COc1ccc(cc1)-c1oc2ncnc(NCCCO)c2c1-c1ccc(OC)cc1,NPOZFKXPQMRTAM-UHFFFAOYSA-N,cdp2w11_j22_s4_w2b5670026-924c-47cb-8e26-123ecee17010,cdp2w11_j22_s4_w3f5014959-cfdf-4833-ab41-1a4b74ebb6ca,cdp2w11_j22_s4_w168a3084a-0b93-4349-91a2-3adc97fd5d90,cdp2w11_j22_s4_w5cca030de-db54-4eda-aaa8-d7ee489bb576,cdp2w11_j22_s4_w46f7f1131-8d5a-456c-a3cf-903f631d8b96,78,2428
9,,25565-J09-5,BRD-K57247366-001-05-1,25565,J09,5,SA1861744,BRD-K57247366,BROAD_CPD_ID,COc1cc(NC(=O)c2cccs2)c(OC)cc1NC(=O)c1ccco1,OJIWQOKZZYAZAV-UHFFFAOYSA-N,cdp2w11_j09_s5_w2eb9f3011-f4d0-413e-870b-1d6345484903,cdp2w11_j09_s5_w362cea682-084a-42e3-8b8f-a504926eebae,cdp2w11_j09_s5_w12d515bde-1867-4d2f-965c-325db0427f2f,cdp2w11_j09_s5_w55934b4a5-6317-4f0f-948e-2e340e8b8bda,cdp2w11_j09_s5_w47874ee58-f571-45be-9e12-cb63ff8c5098,80,4577
10,,25565-O06-1,BRD-K87303356-001-06-6,25565,O06,1,SA1856972,BRD-K87303356,BROAD_CPD_ID,Brc1cccc(c1)-c1cc(C(=O)NC2=NCCS2)c2ccccc2n1,PSAHNMPLXGWEFE-UHFFFAOYSA-N,cdp2w11_o06_s1_w2ff479fee-b7e5-4fc6-89fd-cea09ad87eb9,cdp2w11_o06_s1_w3735143da-2bd3-42e4-a55a-3d54ff38ec99,cdp2w11_o06_s1_w115c1797b-51a3-4f33-be29-058050bd0c8f,cdp2w11_o06_s1_w56e102bb4-e13a-4d9c-8eb3-84bd1d7eb59d,cdp2w11_o06_s1_w48799e9b3-8877-4008-beb4-8d8ac070d934,98,4097
11,,25565-C22-4,BRD-A31986446-001-05-1,25565,C22,4,SA1854402,BRD-A31986446,BROAD_CPD_ID,CC1Cc2cc(Br)cc(c2N1C(C)=O)S(=O)(=O)NCC1COc2ccccc2O1,SIBRQXJGJMWOEK-UHFFFAOYSA-N,cdp2w11_c22_s4_w21f5b1480-1fa3-4bfa-a5ef-4b07da1d95f7,cdp2w11_c22_s4_w30d4c9c3a-bb41-4f98-98e9-bef2fa241cd4,cdp2w11_c22_s4_w16baf46f2-a35b-44e2-873a-65eb19c8fc09,cdp2w11_c22_s4_w581130cd9-d758-41c8-831e-08351b5e2822,cdp2w11_c22_s4_w4d56031fb-66e5-40c5-9c01-8a677d3c118f,74,1611
12,,25566-N12-1,BRD-K55637053-001-06-1,25566,N12,1,SA1852943,BRD-K55637053,BROAD_CPD_ID,CC(=O)Nc1nc(C)c(s1)-c1csc(Nc2cccc(c2)[N+]([O-])=O)n1,VCGYNRNTEBKAIL-UHFFFAOYSA-N,cdp2w11_n12_s1_w2f5822c85-fd03-4c93-bae0-a8a02c4c86d2,cdp2w11_n12_s1_w3526118d4-1fa2-4809-a09f-70a8a25d77a3,cdp2w11_n12_s1_w17d91502c-ccd5-44ce-a0d7-8f2e4852c4a6,cdp2w11_n12_s1_w588fa9cf0-6bd8-444d-af7b-8399e57f68d9,cdp2w11_n12_s1_w43003fca5-6aad-40b8-9e62-a9c944a942f0,44,6955
13,,25567-B04-1,BRD-K49181073-001-05-7,25567,B04,1,SA1853450,BRD-K49181073,BROAD_CPD_ID,CCN(CC(=O)Nc1cccc(F)c1)Cc1nc(O)c2ccccc2n1,WIRGMXCGXDTZIJ-UHFFFAOYSA-N,cdp2w11_b04_s1_w22513cf26-6c2f-40cd-aa4b-ce1a1885dcb7,cdp2w11_b04_s1_w3c557338c-d899-48a0-961b-8f23d6c46c9a,cdp2w11_b04_s1_w110eb8306-dc4e-4fb9-b9bf-9c55187bd5da,cdp2w11_b04_s1_w522eb2e97-4fcc-4e45-9cf7-16f3ef5a5402,cdp2w11_b04_s1_w417fba168-dcf4-4e6e-b62c-a2105da05871,72,6570
14,,25566-C17-4,BRD-K17057495-001-06-5,25566,C17,4,SA1858393,BRD-K17057495,BROAD_CPD_ID,CN(c1ccccc1)c1ccc(\C=C(/CCC(O)=O)c2nc3ccccc3s2)cc1[N+]([O-])=O,XQILZURWAUDZSB-OBGWFSINSA-N,cdp2w11_c17_s4_w2f55df7bc-6613-44ea-94da-1c2d98303b07,cdp2w11_c17_s4_w352258e3e-93a2-4fba-ac85-819b3d06340c,cdp2w11_c17_s4_w134e7bf63-a2fa-4758-880d-e7c6fa16e97c,cdp2w11_c17_s4_w53280717c-ac0d-47ba-ac46-412901750bd7,cdp2w11_c17_s4_w439ccd3d2-fd49-4917-a417-e33cccd072a6,89,7116