text
stringlengths 4
580
| label
int64 0
1
|
|---|---|
Nc1ccc(C=Cc2ccc(N)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1
| 0
|
O=S(=O)(O)CCS(=O)(=O)O
| 0
|
CCOP(=O)(Nc1cccc(Cl)c1)OCC
| 0
|
O=C(O)c1ccccc1O
| 0
|
O=[N+]([O-])c1ccc(SSc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1
| 0
|
O=[N+]([O-])c1ccccc1SSc1ccccc1[N+](=O)[O-]
| 0
|
CC(C)(CCC(=O)O)CCC(=O)O
| 0
|
O=C(O)Cc1ccc(SSc2ccc(CC(=O)O)cc2)cc1
| 1
|
O=C(O)c1ccccc1SSc1ccccc1C(=O)O
| 0
|
CCCCCCCCCCCC(=O)Nc1ccc(SSc2ccc(NC(=O)CCCCCCCCCCC)cc2)cc1
| 0
|
Sc1cccc2c(S)cccc12
| 0
|
CCOP(N)(=O)c1ccccc1
| 0
|
NNP(=S)(NN)c1ccccc1
| 1
|
c1ccc2c(c1)Sc1ccccc1S2
| 0
|
CC(C)CCS(=O)(=O)O
| 0
|
Cc1ccccc1NC(=N)Nc1ccccc1C
| 0
|
CCCNP(=S)(NCCC)NCCC
| 0
|
CCCCCCCCCCCCNP(=S)(NCCCCCCCCCCCC)NCCCCCCCCCCCC
| 0
|
O=C1OC(=O)c2c1ccc1ccccc21
| 0
|
Clc1ccnc2c1ccc1c(Cl)ccnc12
| 0
|
c1ccc2nsnc2c1
| 0
|
S=C1NCCS1
| 0
|
CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1
| 0
|
[N-]=[N+]=CC(=O)OCC(N)C(=O)O
| 0
|
Nc1nc(O)c2nn[nH]c2n1
| 0
|
CS(=O)(=O)OCCCCOS(C)(=O)=O
| 0
|
Nc1nc(S)c2nc[nH]c2n1
| 0
|
Sc1ncnc2[nH]cnc12
| 0
|
COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1C(NC(C)=O)CC2
| 0
|
CN(CCCl)CCCl
| 0
|
CS(C)=O
| 0
|
CCCCOB(OCCCC)OCCCC
| 0
|
CCCCCOB(OCCCCC)OCCCCC
| 0
|
Clc1ccc(Cl)c(SSc2cc(Cl)ccc2Cl)c1
| 0
|
CN(C)c1ccc(SSc2ccc(N(C)C)cc2)cc1
| 0
|
Brc1ccc(SSc2ccc(Br)cc2)cc1
| 0
|
Cc1ccc(SSc2ccc(C)cc2)cc1
| 0
|
COc1ccc(SSc2ccc(OC)cc2)cc1
| 0
|
NC1(C(=O)O)CCCC1
| 0
|
CC(C)(Br)C(=O)C(Br)Br
| 0
|
CCOC(=S)SCCSC
| 0
|
CCOCC(C)(CO)CC(C)CO
| 0
|
O=C(O)C1CC1
| 0
|
O=C(O)C1(O)CC(O)C(O)C(O)C1
| 0
|
Nc1c(Cl)cc(Cl)cc1C(=O)O
| 0
|
CCCCCOC(=S)S
| 0
|
O=C(O)c1ccc([N+](=O)[O-])cc1S(=O)(=O)O
| 0
|
NC(=O)c1cc(O)c(O)c(O)c1
| 0
|
Nc1cc(Cl)c(S(=O)(=O)O)cc1Cl
| 0
|
CC12CCC(C(Br)C1=O)C2(C)CS(=O)(=O)O
| 0
|
CCC(C)(C(=O)O)C(=O)O
| 0
|
CC(C)C(C(=O)O)C(=O)O
| 0
|
CCOC(=O)C(=O)C1CCCCC1=O
| 0
|
CCOC(=O)CNS(=O)(=O)c1ccccc1
| 0
|
CCN(CC)C(C)(O)CN
| 0
|
Cc1cccc2c(=O)c3ccccc3oc12
| 0
|
CCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCO
| 0
|
C1CN[Co-4]23(N1)(NCCN2)NCCN3
| 0
|
CC(C)OC(=S)SSC(=S)OC(C)C
| 0
|
OCC1OCOC2COCOC12
| 0
|
CC(=O)OC1C(OC(C)=O)C(OC(C)=O)C2(CO2)C(OC(C)=O)C1OC(C)=O
| 0
|
CCN(CC)C(=O)N1CCN(C)CC1
| 0
|
Oc1ncnc2[nH]ncc12
| 0
|
O=Nc1ccc(O)c(N=O)c1O
| 1
|
Oc1ccc(Nc2ccccc2)cc1
| 0
|
CCCCCCc1ccc(O)cc1O
| 0
|
CCCCCCCC[N+]12CN3CN(CN(C3)C1)C2
| 0
|
CC(C)(O)O.CC1(O)C(O)C(O)C1(O)CO
| 0
|
OC1COCOC1C(O)C1OCOCC1O
| 0
|
CN(C)C(=S)SSC(=S)N(C)C
| 0
|
O=[N+]([O-])c1ccc(C=Cc2ccc([N+](=O)[O-])cc2S(=O)(=O)O)c(S(=O)(=O)O)c1
| 0
|
N=c1[nH][nH]c(=N)[nH]1
| 0
|
O=S(=O)(O)CCO
| 0
|
O=C1CSC(=S)N1
| 0
|
C1SCSCS1
| 0
|
CCC(CC)(C(=O)O)C(=O)O
| 0
|
N#CC(=Cc1ccccc1)c1ccccc1
| 0
|
N#CNC(=N)N
| 0
|
O=[N+]([O-])c1cc([As](=O)(O)O)ccc1O
| 0
|
O=C(O)c1ccccc1S
| 0
|
CCOC(=O)C(C(=O)OCC)C(C(=O)OCC)C(=O)OCC
| 0
|
C=C(C)CS(=O)(=O)O
| 0
|
CCSc1ccc(N=[N+]([O-])c2ccc(SCC)c(Cl)c2)cc1Cl
| 0
|
O=C1C(=Cc2ccccc2)CCCC1=Cc1ccccc1
| 0
|
CCCCCCC(O)CCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC(O)CCCCCC)OC(=O)CCCCCCCCCCC(O)CCCCCC
| 0
|
O=S(=O)(O)CO
| 0
|
CCN(CC)CCCCCCNc1cc(OC)cc2c(C)ccnc12
| 0
|
CCCC(O)CNCc1ccc(N(C)C)cc1
| 0
|
CCSC(SCC)C(O)C(O)C(O)C(O)C(O)C(O)CO
| 0
|
O=C(O)C(O)C(O)C(O)C(O)C(O)C(O)CO
| 0
|
Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1
| 0
|
ClP1(Cl)=NP(Cl)(Cl)=NP(Cl)(Cl)=N1
| 0
|
O=S(=O)(O)CCCCBr
| 0
|
c1ccc(SSc2ccccc2)cc1
| 0
|
O=S(=O)(O)CC(S(=O)(=O)O)S(=O)(=O)O
| 0
|
CCOC(=O)C(CCCCS(=O)(=O)O)C(=O)OCC
| 0
|
O=S1(=O)CCc2ccccc2C(Br)C1
| 0
|
CCCCCCCCS(=O)(=O)O
| 0
|
CCOCCCCS(=O)(=O)O
| 0
|
CCOC(C)CCCS(=O)(=O)O
| 0
|
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