smiles
stringlengths 15
56
|
|---|
NC(=O)c1csc(C(=O)OCC(F)(F)F)c1 |
NC(=O)c1csc(C(=O)OCCCc2ccccc2)c1 |
NC(=O)c1csc(C(=O)OCc2ccccc2F)c1 |
NC(=O)c1csc(C(=O)OCc2ccccc2Cl)c1 |
O=C(OCc1cccnc1)c1ccnc(OCc2ccccc2)c1 |
Cc1ccc(N2CCC(C(=O)OCc3cccnc3)C2=O)cc1C |
O=C(OCc1cccnc1)C1CCN(c2cc(F)cc(F)c2)C1=O |
Cc1ccc(N2CCC(C(=O)OCc3cccnc3)C2=O)cc1 |
NC(=O)c1csc(C(=O)OCc2cccnc2)c1 |
CC(C)(C)CC(=O)NCC(=O)OCc1cccnc1 |
O=C(OCc1cccnc1)C1CCN(c2ccc(Cl)cc2)C1=O |
Cc1sc(=O)n(CC(=O)OCc2ccc3c(c2)OCO3)c1C |
NC(=O)c1csc(C(=O)OCc2ccc(F)cc2)c1 |
Cc1sc(=O)n(CC(=O)OC(C)c2ccc(Cl)cc2)c1C |
CC(OC(=O)c1cc(C(N)=O)cs1)c1ccc(Cl)cc1 |
Cc1sc(=O)n(CC(=O)OCCNC(=O)c2ccncc2)c1C |
Cn1cc(C(=O)OCCNC(=O)c2ccncc2)c(C(F)(F)F)n1 |
CCc1cc(C(=O)OCCNC(=O)c2ccncc2)n[nH]1 |
CC(C)=CC1C(C(=O)OCCNC(=O)c2ccncc2)C1(C)C |
CC(=O)c1cc(C(=O)OCCNC(=O)c2ccncc2)n(C)c1 |
Cc1csc(=O)n1CC(=O)OCCNC(=O)c1ccncc1 |
O=C(Cn1c(=O)[nH]c2ccccc21)OCCNC(=O)c1ccncc1 |
O=C(NCCOC(=O)c1n[nH]c2c1CCCC2)c1ccncc1 |
Cc1sc(=O)n(CC(=O)OCCCC(C)C)c1C |
CC(C)CCCOC(=O)c1cc(C(N)=O)cs1 |
CC(C)CCCOC(=O)c1cn(C)nc1C(F)(F)F |
Cc1sc(=O)n(CC(=O)OCCCc2ccncc2)c1C |
NC(=O)c1csc(C(=O)OCCCc2cccnc2)c1 |
Cc1ccc(CC(=O)OCC2COc3ccccc3O2)s1 |
CCOC(CC)C(=O)OCC1COc2ccccc2O1 |
CCc1nc(CC(=O)OCC2COc3ccccc3O2)cs1 |
COC(=O)CCc1ncc(-c2ccccc2Br)o1 |
CC(OC(=O)c1cc(C(N)=O)cs1)c1nc2ccccc2s1 |
CC(OC(=O)CNC(=O)CC(C)(C)C)c1nc2ccccc2s1 |
CC(OC(=O)c1cnn(C(C)(C)C)c1)c1nc2ccccc2s1 |
CCc1cc(C(=O)OC(C)c2nc3ccccc3s2)n[nH]1 |
NC(=O)c1csc(C(=O)OCC2CCCCC2)c1 |
CCc1nc(CC(=O)OCCc2nc3ccccc3s2)cs1 |
Cc1sc(=O)n(CC(=O)OCCc2nc3ccccc3s2)c1C |
NC(=O)c1csc(C(=O)OCCc2nc3ccccc3s2)c1 |
NC(=O)c1csc(C(=O)OCc2ccc(-n3cccn3)cc2)c1 |
NC(=O)COC(=O)C1CC1c1ccc(OC(F)(F)F)cc1 |
Cc1sc(=O)n(CC(=O)OCC#Cc2ccccc2)c1C |
Cn1cc(C(=O)OCC#Cc2ccccc2)c(C(F)(F)F)n1 |
CCc1cc(C(=O)OCC#Cc2ccccc2)n[nH]1 |
O=C(COc1cccc(N2CCCC2=O)c1)OCC#Cc1ccccc1 |
NC(=O)COc1ccc(C(=O)OCC#Cc2ccccc2)cc1 |
CC(=O)c1cc(C(=O)OCC#Cc2ccccc2)n(C)c1 |
CNS(=O)(=O)c1ccc(C(=O)OCC#Cc2ccccc2)cc1 |
O=C(CSc1ccncc1)OCC#Cc1ccccc1 |
NC(=O)C1CCC(C(=O)OCC#Cc2ccccc2)CC1 |
CCOC(=O)N1CCCC(C(=O)OCC#Cc2ccccc2)C1 |
O=C(Cn1c(=O)[nH]c2ccccc21)OCC#Cc1ccccc1 |
O=C(CCNS(=O)(=O)c1cccnc1)OCC#Cc1ccccc1 |
O=C(OCC#Cc1ccccc1)c1n[nH]c2c1CCCC2 |
Cn1c(=O)c2cc(C(=O)OCC#Cc3ccccc3)cnc2n(C)c1=O |
Cc1sc(=O)n(CC(=O)OCC2CCCC2)c1C |
NC(=O)c1csc(C(=O)OCC2CCCC2)c1 |
CCC=CCCOC(=O)Cn1c(C)c(C)sc1=O |
CCC=CCCOC(=O)c1cc(NC(C)=O)ccc1F |
CCC=CCCOC(=O)c1ccc(F)c(NC(C)=O)c1 |
CCC=CCCOC(=O)c1cc(C(N)=O)cs1 |
CCC=CCCOC(=O)c1cn(C)nc1C(F)(F)F |
O=C(OCC1CCOC1)c1cnn(-c2ccc(Cl)cc2Cl)c1 |
CC(=CC(=O)OCC1CCOC1)c1ccccc1F |
Cc1ccc(NC(=O)COC(=O)c2cc(C(N)=O)cs2)cc1 |
Cc1ccc(NC(=O)COC(=O)c2n[nH]c3c2CCCC3)cc1 |
Cc1ccc(NC(=O)COC(=O)c2n[nH]c3ccc(C)cc23)cc1 |
NC(=O)c1csc(C(=O)OCCCc2nc3ccccc3s2)c1 |
CCC(C)OC(=O)Cn1nc(-c2ccccc2)ccc1=O |
CCC(C)OC(=O)c1ccc(N2CCOC2=O)cc1 |
CCC(C)OC(=O)CCn1cnc2sc3c(c2c1=O)CCCC3 |
CCC(C)OC(=O)Cn1cnc2c(C)cccc2c1=O |
CCC(C)OC(=O)c1ccc(N2CCCS2(=O)=O)cc1 |
CCC(C)OC(=O)Cn1nnc2ccccc2c1=O |
CCC(C)OC(=O)CCc1c(C)nc2nc(C(F)(F)F)nn2c1C |
CCC(C)OC(=O)CCn1ncc(=O)c2ccccc21 |
CCC(C)OC(=O)c1cnn(Cc2ccccc2)c1 |
CCC(C)OC(=O)C1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 |
CCC(C)OC(=O)Cn1cnc2c(oc3ccccc32)c1=O |
CCC(C)OC(=O)c1ccc(NC(=O)c2ccco2)cc1 |
CCC(C)OC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1C |
CCC(C)OC(=O)CCNC(=O)c1ccsc1 |
CCC(C)OC(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O |
CCC(C)OC(=O)c1cc(C)c(C)c(S(=O)(=O)NC)c1 |
CCC(C)OC(=O)Cc1csc(NC(=O)c2ccccc2)n1 |
CCC(C)OC(=O)CCNC(=O)c1ccc(F)cc1F |
CCC(C)OC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 |
CCC(C)OC(=O)CCNC(=O)c1cccs1 |
CCC(C)OC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)C)c1 |
CCC(C)OC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1 |
CCNS(=O)(=O)c1ccc(C(=O)OC(C)CC)cc1 |
CCNS(=O)(=O)c1ccc(C)c(C(=O)OC(C)CC)c1 |
CCC(C)OC(=O)c1cccc(S(=O)(=O)NC(C)C)c1 |
CCC(C)OC(=O)CCCc1nc2ccccc2c(=O)[nH]1 |
CCC(C)OC(=O)C(C)NC1=NS(=O)(=O)c2ccccc21 |
CCC(C)OC(=O)c1ccc(S(=O)(=O)C(F)F)cc1 |
CCC(C)OC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 |
CCC(C)OC(=O)c1cc(NC(C)=O)cc(NC(C)=O)c1 |
CCC(C)OC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 |