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<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]<mask_1:3>CCCO2)ccc1NC[C@H]1CCCO1<mask_1:3> | 1 | 28 | 3 | 2 | 3 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CNCCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | 2CN |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]<mask_1:3>CCCO1<mask_1:3> | 1 | 46 | 3 | 1 | 3 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | 1CC |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O<mask_1:4>@@H]2CCCO2)ccc1NC[C@H]1CCCO1<mask_1:4> | 5 | 19 | 4 | )NC[C | 4 | O=C(O)c1cc(S(=O)(=O)C[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | )C[C |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)<mask_1:6>[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1<mask_1:6> | 2 | 20 | 6 | NC | 6 | O=C(O)c1cc(S(=O)(=O)N(CCO)[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | N(CCO) |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C<mask_1:7>CCCO1<mask_1:7> | 4 | 43 | 7 | @H]1 | 7 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@@H]1COCCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | @@H]1CO |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]<mask_1:7>CCCO2)ccc1NC[C@H]1CCCO1<mask_1:7> | 1 | 28 | 7 | 2 | 7 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2C[C@H]CCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | 2C[C@H] |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1N<mask_1:3>C@H]1CCCO1<mask_1:3> | 2 | 40 | 3 | C[ | 3 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NCC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | CC[ |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)<mask_1:4>C[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1<mask_1:4> | 1 | 20 | 4 | N | 4 | O=C(O)c1cc(S(=O)(=O)N(C)C[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | N(C) |
<|startoftext|><L>O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO<mask_1:7>c1NC[C@H]1CCCO1<mask_1:7> | 4 | 33 | 7 | 2)cc | 7 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)c(F)cc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | 2)c(F)c |
<|startoftext|><L>O=C(O)<mask_1:6>(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1<mask_1:6> | 4 | 6 | 6 | c1cc | 6 | O=C(O)COc1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | O=C(O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1NC[C@H]1CCCO1 | COc1cc |
<|startoftext|><L>C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc<mask_1:6>1<mask_1:6> | 4 | 42 | 6 | (C)c | 6 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C#N)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | (C#N)c |
<|startoftext|><L>C=CCn1c(COc2ccccc2O<mask_1:7>nc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:7> | 3 | 19 | 7 | C)n | 7 | C=CCn1c(COc2ccccc2OC(C)C)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C(C)C)n |
<|startoftext|><L><mask_1:5>Cn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:5> | 3 | 0 | 5 | C=C | 5 | CC(C)Cn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | CC(C) |
<|startoftext|><L>C<mask_1:6>Cn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:6> | 2 | 1 | 6 | =C | 6 | COC(=O)Cn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | OC(=O) |
<|startoftext|><L>C=CCn1c(COc2cccc<mask_1:6>OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:6> | 2 | 16 | 6 | c2 | 6 | C=CCn1c(COc2cccc(OC)c2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | (OC)c2 |
<|startoftext|><L>C=CCn1c(C<mask_1:2>c2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:2> | 1 | 9 | 2 | O | 2 | C=CCn1c(COCc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | OC |
<|startoftext|><L>C=CCn1c(COc2ccccc2OC)nnc1SC<mask_1:3>=O)Nc1cc(C)cc(C)c1<mask_1:3> | 2 | 27 | 3 | C( | 3 | C=CCn1c(COc2ccccc2OC)nnc1SCCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | CC( |
<|startoftext|><L>C=CCn1c(COc2ccccc2OC)nnc1SCC(=O<mask_1:7>)Nc1cc(C)cc(C)c1<mask_1:7> | 0 | 31 | 7 | 7 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)NCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | )NCC(=O |
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<|startoftext|><L>C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc<mask_1:1>cc(C)c1<mask_1:1> | 6 | 34 | 1 | 1cc(C) | 1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | 1 |
<|startoftext|><L><mask_1:7>=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1<mask_1:7> | 1 | 0 | 7 | C | 7 | NC(=O)C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | C=CCn1c(COc2ccccc2OC)nnc1SCC(=O)Nc1cc(C)cc(C)c1 | NC(=O)C |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc(-c4ccsc4)<mask_1:4>2[nH]1<mask_1:4> | 5 | 30 | 4 | n3)cc | 5 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | n3)cc |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc<mask_1:5>(-c4ccsc4)n3)cc2[nH]1<mask_1:5> | 0 | 20 | 5 | 5 | O=c1[nH]c2ccc(-c3csc(=O)c(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | (=O)c |
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<|startoftext|><L>O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)<mask_1:5>]1<mask_1:5> | 6 | 33 | 5 | cc2[nH | 6 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | cc2[nH |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc<mask_1:1>1<mask_1:1> | 5 | 35 | 1 | 2[nH] | 1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc21 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | 2 |
<|startoftext|><L>O=c1[nH]c2c<mask_1:6>(-c3csc(-c4ccsc4)n3)cc2[nH]1<mask_1:6> | 2 | 11 | 6 | cc | 6 | O=c1[nH]c2cc(=O)n(-c3csc(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | c(=O)n |
<|startoftext|><L><mask_1:6>1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1<mask_1:6> | 3 | 0 | 6 | O=c | 6 | C[C@H]1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | C[C@H] |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc(-<mask_1:4>4)n3)cc2[nH]1<mask_1:4> | 6 | 22 | 4 | c4ccsc | 4 | O=c1[nH]c2ccc(-c3csc(-C4CC4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | C4CC |
<|startoftext|><L>O=c1[nH]c2c<mask_1:4>-c3csc(-c4ccsc4)n3)cc2[nH]1<mask_1:4> | 3 | 11 | 4 | cc( | 4 | O=c1[nH]c2ccc(N-c3csc(-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | cc(N |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc<mask_1:4>c4ccsc4)n3)cc2[nH]1<mask_1:4> | 2 | 20 | 4 | (- | 4 | O=c1[nH]c2ccc(-c3csc(NCCc4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | (NCC |
<|startoftext|><L>O=c1[nH]c2ccc(-c3csc<mask_1:3>-c4ccsc4)n3)cc2[nH]1<mask_1:3> | 1 | 20 | 3 | ( | 3 | O=c1[nH]c2ccc(-c3csc(NC-c4ccsc4)n3)cc2[nH]1 | O=c1[nH]c2ccc(-c3csc(-c4ccsc4)n3)cc2[nH]1 | (NC |
<|startoftext|><L>Cc1<mask_1:6>c1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1<mask_1:6> | 3 | 3 | 6 | ncs | 6 | Cc1nn(C)nc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | nn(C)n |
<|startoftext|><L>Cc1ncsc1<mask_1:5>cc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1<mask_1:5> | 4 | 8 | 5 | -c1c | 5 | Cc1ncsc1COc1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | COc1c |
<|startoftext|><L>Cc1nc<mask_1:5>c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1<mask_1:5> | 4 | 5 | 5 | sc1- | 5 | Cc1ncsc1COc1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | sc1CO |
<|startoftext|><L>Cc1ncsc1-c1c<mask_1:4>C(=O)[C@@H]2COCCN2CC(F)F)cc1<mask_1:4> | 5 | 12 | 4 | cc(CN | 4 | Cc1ncsc1-c1ccc(NC(=O)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | cc(N |
<|startoftext|><L>Cc1ncsc1-c1ccc(CNC<mask_1:5>@@H]2COCCN2CC(F)F)cc1<mask_1:5> | 6 | 18 | 5 | (=O)[C | 5 | Cc1ncsc1-c1ccc(CNCCOC[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | COC[C |
<|startoftext|><L>Cc1ncsc1-c1ccc(CNC(=<mask_1:6>)[C@@H]2COCCN2CC(F)F)cc1<mask_1:6> | 1 | 20 | 6 | O | 6 | Cc1ncsc1-c1ccc(CNC(=O)CN(C)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | O)CN(C |
<|startoftext|><L>Cc1ncsc1-c1ccc(CN<mask_1:5>(=O)[C@@H]2COCCN2CC(F)F)cc1<mask_1:5> | 1 | 17 | 5 | C | 5 | Cc1ncsc1-c1ccc(CNS(=O)(=O)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | S(=O) |
<|startoftext|><L>Cc1ncsc1-c1ccc(CN<mask_1:2>[C@@H]2COCCN2CC(F)F)cc1<mask_1:2> | 5 | 17 | 2 | C(=O) | 2 | Cc1ncsc1-c1ccc(CNCC[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | CC |
<|startoftext|><L>Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2<mask_1:3>2CC(F)F)cc1<mask_1:3> | 5 | 29 | 3 | COCCN | 3 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2CCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | CCN |
<|startoftext|><L>Cc1ncsc1-c1ccc(CNC(<mask_1:6>)[C@@H]2COCCN2CC(F)F)cc1<mask_1:6> | 2 | 19 | 6 | =O | 6 | Cc1ncsc1-c1ccc(CNC(=O)N(C)[C@@H]2COCCN2CC(F)F)cc1 | Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2COCCN2CC(F)F)cc1 | =O)N(C |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1cc<mask_1:4>(N)=O)nc1<mask_1:4> | 3 | 32 | 4 | c(C | 4 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(NC(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | c(NC |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C<mask_1:2>)Nc1ccc(C(N)=O)nc1<mask_1:2> | 3 | 23 | 2 | (=O | 2 | Cc1ccsc1[C@H]1C[C@@H]1C(N)Nc1ccc(C(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | (N |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)<mask_1:1>1<mask_1:1> | 2 | 41 | 1 | nc | 1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)s1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | s |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(<mask_1:3>c1ccc(C(N)=O)nc1<mask_1:3> | 4 | 24 | 3 | =O)N | 3 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)c1ccc(C(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | =O) |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)<mask_1:1>nc1<mask_1:1> | 3 | 38 | 1 | =O) | 1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N))nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | ) |
<|startoftext|><L>Cc1cc<mask_1:6>@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1<mask_1:6> | 5 | 5 | 6 | sc1[C | 6 | Cc1ccccc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | ccc1[C |
<|startoftext|><L>Cc1ccsc1[C@H]1<mask_1:6>@@H]1C(=O)Nc1ccc(C(N)=O)nc1<mask_1:6> | 3 | 14 | 6 | C[C | 6 | Cc1ccsc1[C@H]1OCCC[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | OCCC[C |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc<mask_1:6>(C(N)=O)nc1<mask_1:6> | 4 | 29 | 6 | 1ccc | 6 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1[nH]c(C(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | 1[nH]c |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc<mask_1:3>C(N)=O)nc1<mask_1:3> | 1 | 33 | 3 | ( | 3 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(OCC(N)=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | (OC |
<|startoftext|><L>Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(<mask_1:1>=O)nc1<mask_1:1> | 4 | 34 | 1 | C(N) | 1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C=O)nc1 | Cc1ccsc1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(N)=O)nc1 | C |
<|startoftext|><L>COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc<mask_1:7>H](C)OC<mask_1:7> | 5 | 48 | 7 | 1[C@@ | 6 | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1C[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | 1C[C@@ |
<|startoftext|><L>COC[C@@<mask_1:8>=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:8> | 9 | 7 | 8 | H](C)N(C( | 8 | COC[C@@](C)(NC(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | ](C)(NC( |
<|startoftext|><L>COC[C@@H](C)<mask_1:3>CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:3> | 7 | 12 | 3 | N(C(=O) | 3 | COC[C@@H](C)N(CCSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | N(C |
<|startoftext|><L>COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1<mask_1:8>C@@H](C)OC<mask_1:8> | 1 | 49 | 8 | [ | 8 | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1C(=O)NC[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | C(=O)NC[ |
<|startoftext|><L>COC[C@@H](<mask_1:9>N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:9> | 2 | 10 | 9 | C) | 9 | COC[C@@H](C)NC(=O)CN(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | C)NC(=O)C |
<|startoftext|><L>COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C<mask_1:9>)cccc1[C@@H](C)OC<mask_1:9> | 0 | 43 | 9 | 9 | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)n(C(C)=O)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | )n(C(C)=O |
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<|startoftext|><L>COC[C@@H](C)N(<mask_1:1>1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:1> | 8 | 14 | 1 | C(=O)CSc | 1 | COC[C@@H](C)N(c1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | c |
<|startoftext|><L>COC[C@@H]<mask_1:6>=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:6> | 7 | 9 | 6 | (C)N(C( | 6 | COC[C@@H](CCNC(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | (CCNC( |
<|startoftext|><L>COC[C@@H](C)N(C(=O)CSc1n<mask_1:1>nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:1> | 9 | 24 | 1 | c2ccccc2[ | 1 | COC[C@@H](C)N(C(=O)CSc1n[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | [ |
<|startoftext|><L>COC[C@@H](<mask_1:1>CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC<mask_1:1> | 9 | 10 | 1 | C)N(C(=O) | 1 | COC[C@@H](NCSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | COC[C@@H](C)N(C(=O)CSc1nc2ccccc2[nH]1)c1c(C)cccc1[C@@H](C)OC | N |
<|startoftext|><L>Cc1nc<mask_1:3>C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:3> | 2 | 5 | 3 | ([ | 3 | Cc1nc(C[C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | (C[ |
<|startoftext|><L>Cc1nc([C@H<mask_1:7>CCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:7> | 3 | 10 | 7 | ]2C | 7 | Cc1nc([C@H]2CN(C)CCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | ]2CN(C) |
<|startoftext|><L>Cc1nc([C@<mask_1:5>N2C(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:5> | 6 | 9 | 5 | H]2CCC | 5 | Cc1nc([C@H]2CCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | H]2CC |
<|startoftext|><L>Cc1nc([C@H]<mask_1:1>(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:1> | 7 | 11 | 1 | 2CCCN2C | 1 | Cc1nc([C@H]C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | C |
<|startoftext|><L>Cc1nc([C@H]2CCCN2C(=O)c2cccc<mask_1:4>=O)=O)c2)no1<mask_1:4> | 7 | 28 | 4 | (CS(C)( | 4 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(S(C=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | (S(C |
<|startoftext|><L>Cc1nc([C@H]2CCCN2C(=O<mask_1:4>cc(CS(C)(=O)=O)c2)no1<mask_1:4> | 5 | 21 | 4 | )c2cc | 4 | Cc1nc([C@H]2CCCN2C(=O)c2scc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | )c2s |
<|startoftext|><L>Cc1nc([C@H]2CCCN<mask_1:3>(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:3> | 2 | 16 | 3 | 2C | 3 | Cc1nc([C@H]2CCCN2CC(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | 2CC |
<|startoftext|><L>C<mask_1:5>([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:5> | 4 | 1 | 5 | c1nc | 5 | CCc1cc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1cc |
<|startoftext|><L>C<mask_1:7>c([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1<mask_1:7> | 3 | 1 | 7 | c1n | 7 | CC(C)c1cc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | C(C)c1c |
<|startoftext|><L>Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O<mask_1:6>=O)c2)no1<mask_1:6> | 1 | 37 | 6 | ) | 6 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c(=O)c2)no1 | Cc1nc([C@H]2CCCN2C(=O)c2cccc(CS(C)(=O)=O)c2)no1 | )=O)c( |
<|startoftext|><L>C<mask_1:13>)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:13> | 12 | 1 | 13 | [C@H](CCC(=O | 13 | CC[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O |
<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[<mask_1:7>12C<mask_1:7> | 11 | 73 | 7 | C@H]3CC[C@] | 7 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C@H]3CC |
<|startoftext|><L>C[C@H](<mask_1:6>C(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:6> | 2 | 7 | 6 | CC | 6 | C[C@H](NC(=O)C(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | NC(=O) |
<|startoftext|><L>C[C@H](C<mask_1:5>CC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:5> | 7 | 8 | 5 | CC(=O)N | 5 | C[C@H](C(=O)OCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | (=O)O |
<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H]<mask_1:5>CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:5> | 3 | 59 | 5 | (O) | 5 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)C=CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | (O)C= |
<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[<mask_1:2>H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:2> | 3 | 54 | 2 | C@@ | 2 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C@ |
<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C<mask_1:6>O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:6> | 12 | 48 | 6 | @H]4C[C@@H]( | 6 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C(O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | @H]4C( |
<|startoftext|><L>C[<mask_1:7>C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:7> | 0 | 2 | 7 | 8 | C[C@H](O)[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C@H](O)[ |
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<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C<mask_1:8>[C@]12C<mask_1:8> | 9 | 71 | 8 | )[C@H]3CC | 8 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3C[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | )[C@H]3C |
<|startoftext|><L>C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C<mask_1:9>CC[C@]12C<mask_1:9> | 7 | 71 | 9 | )[C@H]3 | 9 | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CCCC[C@]12C | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | )[C@H]3CC |
<|startoftext|><L><mask_1:1>(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:1> | 2 | 0 | 1 | CC | 1 | C(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | C |
<|startoftext|><L>CC(C)C(=O)N1<mask_1:5>[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:5> | 3 | 12 | 5 | CCC | 5 | CC(C)C(=O)N1CCCCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CCCCC |
<|startoftext|><L>CC(C)<mask_1:6>)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:6> | 4 | 5 | 6 | C(=O | 6 | CC(C)CNC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CNC(=O |
<|startoftext|><L>CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(<mask_1:8>cc3)oc2c1<mask_1:8> | 2 | 44 | 8 | F) | 8 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(NC(=O)O)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | NC(=O)O) |
<|startoftext|><L>C<mask_1:6>(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:6> | 5 | 1 | 6 | C(C)C | 6 | CCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CS(=O) |
<|startoftext|><L>CC(<mask_1:7>)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:7> | 6 | 3 | 7 | C)C(=O | 7 | CC(C)CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | C)CC(=O |
<|startoftext|><L>CC(C)C(=O)N1CCC[C@@H]1C(=O)<mask_1:7>cc2nc(-c3ccc(F)cc3)oc2c1<mask_1:7> | 4 | 27 | 7 | Nc1c | 7 | CC(C)C(=O)N1CCC[C@@H]1C(=O)N(C)c1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | N(C)c1c |
<|startoftext|><L>CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)o<mask_1:7>2c1<mask_1:7> | 1 | 51 | 7 | c | 7 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc(=O)c-2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | c(=O)c- |
<|startoftext|><L>CC(C<mask_1:7>O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:7> | 4 | 4 | 7 | )C(= | 7 | CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | )(C)C(= |
<|startoftext|><L>CC(C)C(=O)N1CCC[C@@H]1C<mask_1:3>1ccc2nc(-c3ccc(F)cc3)oc2c1<mask_1:3> | 6 | 23 | 3 | (=O)Nc | 3 | CC(C)C(=O)N1CCC[C@@H]1CCOc1ccc2nc(-c3ccc(F)cc3)oc2c1 | CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 | COc |
<|startoftext|><L>CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br<mask_1:7>OC)c3)nn12<mask_1:7> | 5 | 35 | 7 | )ccc4 | 7 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OCOC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | )ccc4OC |
<|startoftext|><L>CCc1nnc2<mask_1:5>c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:5> | 4 | 8 | 5 | sc(- | 5 | CCc1nnc2ccc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | ccc(- |
<|startoftext|><L>C<mask_1:4>nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:4> | 3 | 1 | 4 | Cc1 | 4 | CCCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1 |
<|startoftext|><L>CCc1nnc2sc(-c3ccc(C)c(N<mask_1:3>C(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:3> | 0 | 23 | 3 | 3 | CCc1nnc2sc(-c3ccc(C)c(NCCNC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCN |
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<|startoftext|><L>CCc1nnc2sc(-c3ccc(C<mask_1:7>=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:7> | 6 | 19 | 7 | )c(NC( | 7 | CCc1nnc2sc(-c3ccc(Cl)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | l)c(NC( |
<|startoftext|><L>CC<mask_1:2>c2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:2> | 4 | 2 | 2 | c1nn | 2 | CCc1c2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | c1 |
<|startoftext|><L>CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4<mask_1:1>)c3)nn12<mask_1:1> | 2 | 40 | 1 | OC | 1 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4O)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | O |
<|startoftext|><L>CCc1nnc2sc(-c3ccc(<mask_1:7>C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:7> | 0 | 18 | 7 | 7 | CCc1nnc2sc(-c3ccc(NC(=S)NC)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | NC(=S)N |
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<|startoftext|><L>CCc1nnc<mask_1:6>(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12<mask_1:6> | 3 | 7 | 6 | 2sc | 6 | CCc1nnc2n(C)c(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | 2n(C)c |
<|startoftext|><L>CCc1nnc2sc(-c3ccc(C)c(NC(=O<mask_1:7>)c4cc(Br)ccc4OC)c3)nn12<mask_1:7> | 0 | 27 | 7 | 7 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)CNC(=O)c4cc(Br)ccc4OC)c3)nn12 | CCc1nnc2sc(-c3ccc(C)c(NC(=O)c4cc(Br)ccc4OC)c3)nn12 | )CNC(=O |