smiles
stringlengths 15
56
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CCC(C)OC(=O)CCc1nc2ccccc2s1 |
CCC(C)OC(=O)C1CCN(C(=O)COc2ccccc2)CC1 |
CCC(C)OC(=O)CNC(=O)Cc1cccc(F)c1 |
CCC(C)OC(=O)c1cnn(Cc2ccccc2)c1C |
CCC(C)OC(=O)C1CC(=O)N(c2ccc(OC)cc2)C1 |
CCC(C)OC(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 |
CCC(C)OC(=O)c1cc(-c2ccccc2OC)[nH]n1 |
CCC(C)OC(=O)CCn1cnc2sc(C)c(C)c2c1=O |
CCC(C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 |
CCC(C)OC(=O)CN1C(=O)C(C)Oc2ccccc21 |
CCC(C)OC(=O)CCn1cnc2c(C)cccc2c1=O |
CCC(C)OC(=O)Cn1c(=O)n(CC)c2ccccc21 |
CCC(C)OC(=O)c1ccc(S(=O)(=O)N(C)C(C)C)cc1 |
CCC(C)OC(=O)CCN1C(=O)COc2ccccc21 |
CCC(C)OC(=O)Cn1c(=O)c2c(ncn2C)n(C)c1=O |
CCC(C)OC(=O)CCNC(=O)c1ccc(Br)cc1 |
CCC(C)OC(=O)C(NC(=O)c1ccccc1)C(C)C |
CCC(C)OC(=O)Cn1ncc2ccccc2c1=O |
CCC(C)OC(=O)c1ccc2c(=O)n(C)c(=O)n(C)c2n1 |
CCC(C)OC(=O)c1cnc2c(cnn2Cc2ccccc2)c1 |
CCC(C)OC(=O)CSc1nncn1-c1ccc(C)cc1 |
CCCC(=O)N1CCCC(C(=O)OC2CCCC2)C1 |
O=C(OC1CCCC1)C1CCN(CC(F)(F)F)CC1 |
Cc1nn(C)c(C)c1-c1cc(C(=O)OC2CCCC2)[nH]n1 |
C#CCNS(=O)(=O)c1ccc(C(=O)OC2CCCC2)cc1 |
CNS(=O)(=O)c1ccc(C(=O)OC2CCCC2)cc1 |
N#CCCNS(=O)(=O)c1ccc(C(=O)OC2CCCC2)cc1 |
CCNS(=O)(=O)c1cccc(C(=O)OC2CCCC2)c1 |
CCNS(=O)(=O)c1ccc(C(=O)OC2CCCC2)cc1 |
C=CCNS(=O)(=O)c1ccc(C(=O)OC2CCCC2)cc1 |
CCNS(=O)(=O)c1ccc(C)c(C(=O)OC2CCCC2)c1 |
Cc1ccc(S(=O)(=O)NC(C)C(=O)OC2CCCC2)cc1 |
COc1ccccc1-c1cc(C(=O)OC2CCCC2)n[nH]1 |
O=C(Cn1c(=O)[nH]c2ccccc21)OC1CCCC1 |
O=C(CCC(=O)N1CCOCC1)OC1CCCC1 |
Cc1cc(C(=O)OC2CCCC2)c(C)n1Cc1ccccn1 |
O=C(CCNS(=O)(=O)c1cccnc1)OC1CCCC1 |
O=C(OC1CCCC1)c1cccc(S(=O)(=O)NCC2CC2)c1 |
COc1ccccc1-c1cc(C(=O)OC2CCCC(OC)C2)n[nH]1 |
COC1CCCC(OC(=O)Cn2c(=O)[nH]c3ccccc32)C1 |
O=C(CCC(=O)N1CCOCC1)OC1CCCCCC1 |
O=C(CCNS(=O)(=O)c1cccnc1)OC1CCCCCC1 |
CC(=O)Nc1nc(C(=O)OC2CCC(C(C)(C)C)CC2)cs1 |
Cc1csc(=O)n1CC(=O)OCC1=CCC2CC1C2(C)C |
CC1(C)C2CC=C(COC(=O)c3cnc4ccccn4c3=O)C1C2 |
CC1(C)C2CC=C(COC(=O)C3CCC(C(N)=O)CC3)C1C2 |
CC1(C)C2CC=C(COC(=O)CCn3ccccc3=O)C1C2 |
Cc1nn(C)c(C)c1-c1cc(C(=O)OC2CCCC(C)C2)[nH]n1 |
CC1CCCC(OC(=O)Cc2cc3ccccc3[nH]c2=O)C1 |
CNS(=O)(=O)c1ccc(C(=O)OC2CCCC(C)C2)cc1 |
CC1CCCC(OC(=O)C2CCC(C(N)=O)CC2)C1 |
CC1CCCC(OC(=O)CCC(=O)N2CCOCC2)C1 |
CC1CCCC(OC(=O)CCNS(=O)(=O)c2cccnc2)C1 |
CC(=O)Nc1nc(C(=O)OC2CCCC(C)C2)cs1 |
CC(COc1ccccc1)OC(=O)c1cnn(C(C)(C)C)c1 |
CCc1cc(C(=O)OC(C)COc2ccccc2)n[nH]1 |
CC(=O)c1cc(C(=O)OC(C)COc2ccccc2)n(C)c1 |
CC(COc1ccccc1)OC(=O)c1cnn(C)c1 |
CC(COc1ccccc1)OC(=O)c1cccnc1 |
CC(COc1ccccc1)OC(=O)C1CCC(C(N)=O)CC1 |
Cc1ccc2ncc(C(=O)OC(C)COc3ccccc3)c(=O)n2c1 |
CC(COc1ccccc1)OC(=O)c1cnn(C)c1-n1cccc1 |
CC(COc1ccccc1)OC(=O)Cn1nc2ccccn2c1=O |
CC(COc1ccccc1)OC(=O)c1ccc(N2CCNC2=O)cc1 |
CC(=O)Nc1nc(C(=O)OC(C)COc2ccccc2)cs1 |
Cc1cccc(C(=O)OC(C)COc2ccccc2)n1 |
CC(COc1ccccc1)OC(=O)C1CC(=O)Nc2cc(F)ccc21 |
Cc1sc(=O)n(CC(=O)OC2CCCc3ccccc32)c1C |
O=C(CCc1nc(-c2ccccn2)no1)OC1CCCc2ccccc21 |
O=C(Cc1cc2ccccc2[nH]c1=O)OC1CCCc2ccccc21 |
O=C(CCOCC1CCCO1)OC1CCCc2ccccc21 |
CCOCCCC(=O)OC1CCCc2ccccc21 |
O=C(CCn1ccccc1=O)OC1CCCc2ccccc21 |
CC(=O)Nc1nc(C(=O)OC2CCCc3ccccc32)cs1 |
CC1C(OC(=O)C2CCC(C(N)=O)CC2)CC2CC1C2(C)C |
CC1(COC(=O)c2cnn(Cc3ccccc3)c2)COC1 |
COc1ccccc1-c1cc(C(=O)OCC2(C)COC2)n[nH]1 |
CC1(COC(=O)Cn2c(=O)[nH]c3ccccc32)COC1 |
CC1(COC(=O)c2cc(-c3ccccc3Cl)[nH]n2)COC1 |
CC1(COC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)COC1 |
Cc1onc(-c2ccccc2)c1C(=O)OCC1(C)COC1 |
CC1(COC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)COC1 |
CC1(COC(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)COC1 |
CC1(COC(=O)C2CC(=O)Nc3cc(F)ccc32)COC1 |
Cc1cc(NC(=O)C2CC2)sc1C(=O)OCC1(C)COC1 |
CNS(=O)(=O)c1ccc(C(=O)OC(C)CC(C)C)cc1 |
CC(C)CC(C)OC(=O)Cn1c(=O)[nH]c2ccccc21 |
CC(C)CC(C)OC(=O)C1CC(=O)Nc2cc(F)ccc21 |
CC(C)CC(C)OC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C |
COC1CCCCC1OC(=O)c1cnn(C(C)(C)C)c1 |
COC1CCCCC1OC(=O)c1cc(-c2c(C)nn(C)c2C)n[nH]1 |
COC1CCCCC1OC(=O)Cc1cc2ccccc2[nH]c1=O |
CCc1cc(C(=O)OC2CCCCC2OC)n[nH]1 |
COC1CCCCC1OC(=O)CCC(=O)c1ccc(F)cc1 |
COC1CCCCC1OC(=O)C1CCC(C(N)=O)CC1 |
COC1CCCCC1OC(=O)C(C)NC(=O)c1ccco1 |
COC1CCCCC1OC(=O)c1cc(C)n(Cc2ccccn2)c1C |
COC1CCCCC1OC(=O)c1n[nH]c2c1CCCC2 |
COC1CCCCC1OC(=O)c1n[nH]c2ccc(C)cc12 |
COC1CCCCC1OC(=O)C(C)NC(=O)C(C)(C)C |