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molecule_smiles
stringlengths
1
3.53k
CNC(CCOCCC(C)C)CC(F)(F)F
COCC(C)(Sc1ccccc1N)C(=O)O
CN1CCc2cc(CS(=O)(=O)Cl)ccc21
CCC(CC)(C(=O)O)N1CCOC2CCCC21
COCC(C)(C(=O)O)N(C)c1cccc(F)c1
CCCC(C)(C(=O)O)N1CCOC2CCCC21
Cc1cc(C)cc(C(O)CNc2ccccc2)c1
CCC(C)(C(=O)O)N1CCOC2CCCCC21
COCC(C)(NCCc1nccn1C)C(=O)O
CCc1ccccc1C(O)CNc1ccccc1
CCOc1ccc(C)cc1C(=O)c1cccnc1
NCCC(OCc1ccccc1)c1ccccc1
Cc1ccc(C(C)(O)CNc2ccccc2)cc1
c1ccc(CCOCCNc2ccccc2)cc1
CCC(O)(CNc1ccccc1)c1ccccc1
CC(C)(C)CC(C)(C)NC1(C(=O)O)CCCC1
CCCNC(CCOC(C)C)CC(F)(F)F
CC(N)(CCOc1ccccc1)c1ccccc1
CC(C)CCC(N)CCCOCC(F)(F)F
NC(c1ccccc1)c1nc(C2CCCC2)c[nH]1
NCC1CCCCCC1OCC1CCOCC1
Cc1cccc(C(C)(O)CNc2ccccc2)c1
CCC(CC)(NC(C)C1CCCCC1)C(=O)O
Cc1cccnc1C(=O)CCOc1ccccc1
CC1CCC(CN)C(OCC2CCOCC2)C1
CCCN(C)C1(C(=O)O)CCC(C(C)C)CC1
CC1CCN(C2(C(=O)O)CCOCC2)C(C)C1
CC(c1ccccc1)C(O)CNc1ccccc1
CC(C)CC(C)(C(=O)O)N1CCC(C)CC1C
Cc1ccccc1C(C)(O)CNc1ccccc1
CCC(C)CNC1(C(=O)O)CCCCCCC1
CCC(NC(C)(CC)C(=O)O)C1CCCCC1
CCCNC(CCOC(C)C)c1cccs1
CCCCCCCC(C)(NC1CCC1)C(=O)O
CCCNC(CCOC(C)C)c1ccsc1
CC(C)C1CCC(NC(C)(C)C)(C(=O)O)CC1
CC(C)C1CCC(C(=O)O)(N(C)C(C)C)CC1
CC(C)(C)CC(C)(C)NC(C)(C(=O)O)C1CC1
CCNC(CCOC(C)C)Cc1cccs1
CCNCCC(C)OC1CC(C)CC(C)(C)C1
CC(C)CCOCCC(N)Cc1cccs1
c1ccc(NCc2nc(C3CCCC3)c[nH]2)cc1
CC(C)CNCCC(C)OC1CCCC(C)C1
CNC(CCOCCC(C)C)c1ccsc1
Cc1cccc(C(O)CNc2ccccc2)c1C
CCCCCCCCOC(C)CCNC1CC1
CCCCCCC(C)OC(C)CCNC1CC1
CCCCOCCC(Cc1cccs1)NC
CCCCOCCC1(N)CC(C)CC(C)(C)C1
CNC(CCOCCC(C)C)c1cccs1
CNC(CCOCCC(C)C)C1CCCCC1
CCC(C)CNC1(C(=O)O)CCC(CC)CC1
CCCCOCCC(NCC)c1ccsc1
CC(C)CCOCCC(N)C1CCC(C)CC1
CCNC(CCOCCC(C)C)C1CCCC1
CCCCCCCC(C)(O)CNC1CCCC1
CCCCOCCC(NC)C1CCCC(C)C1
Cc1cc(Sc2cnnc(Cl)n2)n(C)n1
CCCCCCCC(O)CNC1CCCCC1
CN1CCCC(N(C)c2cnnc(Cl)n2)C1
CC(C)OCCC1(N)CCCCC1C(C)(C)C
CC1CCC(C(C)C)C(N)(CCOC(C)C)C1
CC(C)OCCC(C)(N)c1cccc(Cl)c1
CCOCCC1(N)CCC(C(C)(C)CC)CC1
CCCCOCCC(NC)C1CCC(C)CC1
CCCCCCC(C)(O)CNC1CCCCC1
CCCCOCCC(N)c1cccc(Cl)c1
CC(C)CNCC(C)COC1CCCC(C)C1
CNC(CCOC(C)C)c1ccc(Cl)cc1
CCC(C)CC(O)(CC)CNC1CCCCC1
CC(C)OCCC(C)(N)c1ccc(Cl)cc1
CCCCOCCC(NCCC)C1CCCC1
O=C(O)C1(Oc2cc(F)cc(F)c2)CCCC1
CCCCOCCC(N)c1ccc(Cl)cc1
CC(Oc1cc(F)cc(F)c1)(C(=O)O)C1CC1
CNC(CCOC(C)C)c1ccccc1Cl
CC(C)CC(Nc1c[nH]nc1[N+](=O)[O-])C(=O)O
CCNCCC(C)Oc1ccc(C)cc1Cl
CCNCCC(C)OCc1ccccc1Cl
OC(CCOCC(F)(F)F)CC1CCCO1
CC1CCCC(OC(C)CCNC(C)(C)C)C1
CC(C)OCCC(=O)Cc1cc(F)cc(F)c1
CCCCOCCC(=O)c1cc(F)cc(F)c1
CCCCCCCC(C)(NC1CC1C)C(=O)O
[H]N=C(N)c1nccnc1OCCc1ccccc1
CCCCOCCC(N)c1ccccc1Cl
CCCCOCCC(=O)c1ccc(F)c(F)c1
COC(=O)C(Nc1c[nH]nc1[N+](=O)[O-])C(C)C
COCC(C)(Sc1ccccc1O)C(=O)O
CC(C)CCOCCC(N)C1CCCC(C)C1
CCCCC(CC)COC(C)CCNC1CC1
CC(C)CCC(O)CCCOCC(F)(F)F
COCC(C)(CN)N(CC(F)(F)F)C(C)C
COCC(C)(Sc1ccncc1N)C(=O)O
COCC(C)(OCC1CC=CCC1C)C(=O)O
CC(C)OCCC(C)(N)c1ccccc1Cl
COCC(C)(Sc1nccc(C)n1)C(=O)O
COCC(C)(Sc1ccc(N)nc1)C(=O)O
O=C(O)C1(NCCN2CCCC2)CCOCC1
COCC(C)(C(=O)O)N1CCN(C2CC2)CC1