smiles_a string | smiles_b string | smiles string | label int64 |
|---|---|---|---|
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | c1cc(cnc1)C(=O)N | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.c1cc(cnc1)C(=O)N | 1 |
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | c1cc(cnc1)C(=O)O | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.c1cc(cnc1)C(=O)O | 0 |
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | C(=O)(C(=O)O)O | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.C(=O)(C(=O)O)O | 0 |
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | C1=CC=C2C(=C1)C(=O)NS2(=O)=O | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.C1=CC=C2C(=C1)C(=O)NS2(=O)=O | 0 |
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | c1ccc(c(c1)C(=O)O)O | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.c1ccc(c(c1)C(=O)O)O | 0 |
CC(=O)NC1=NN=C(S1)S(=O)(=O)N | C(CC(=O)O)C(=O)O | CC(=O)NC1=NN=C(S1)S(=O)(=O)N.C(CC(=O)O)C(=O)O | 0 |
C(CCC(=O)O)CC(=O)O | C[C@@H]([C@@H](c1ccccc1)O)NC | C(CCC(=O)O)CC(=O)O.C[C@@H]([C@@H](c1ccccc1)O)NC | 1 |
C(CCC(=O)O)CC(=O)O | c1ccc2c(c1)CCN3[C@@H]2CN(CC3=O)C(=O)C4CCCCC4 | C(CCC(=O)O)CC(=O)O.c1ccc2c(c1)CCN3[C@@H]2CN(CC3=O)C(=O)C4CCCCC4 | 1 |
C(CCC(=O)O)CC(=O)O | C1=NN=C(S1)N | C(CCC(=O)O)CC(=O)O.C1=NN=C(S1)N | 1 |
C(CCC(=O)O)CC(=O)O | Cc1cc(nc(n1)N)C | C(CCC(=O)O)CC(=O)O.Cc1cc(nc(n1)N)C | 1 |
C(CCC(=O)O)CC(=O)O | Cc1cccc2c1nc(s2)N | C(CCC(=O)O)CC(=O)O.Cc1cccc2c1nc(s2)N | 1 |
C(CCC(=O)O)CC(=O)O | Cc1ccc2c(c1)sc(n2)N | C(CCC(=O)O)CC(=O)O.Cc1ccc2c(c1)sc(n2)N | 1 |
C(CCC(=O)O)CC(=O)O | CC1=NC=CN1 | C(CCC(=O)O)CC(=O)O.CC1=NC=CN1 | 1 |
C(CCC(=O)O)CC(=O)O | C1=CC(=O)NC=C1 | C(CCC(=O)O)CC(=O)O.C1=CC(=O)NC=C1 | 1 |
C(CCC(=O)O)CC(=O)O | c1cnccc1N=Nc2ccncc2 | C(CCC(=O)O)CC(=O)O.c1cnccc1N=Nc2ccncc2 | 1 |
C(CCC(=O)O)CC(=O)O | C1=CC(=O)NC=C1Cl | C(CCC(=O)O)CC(=O)O.C1=CC(=O)NC=C1Cl | 1 |
C(CCC(=O)O)CC(=O)O | c1cc(ccc1c2nc(nc(n2)N)N)Cl | C(CCC(=O)O)CC(=O)O.c1cc(ccc1c2nc(nc(n2)N)N)Cl | 1 |
C(CCC(=O)O)CC(=O)O | C(CCCC(=O)O)CCCC(=O)O | C(CCC(=O)O)CC(=O)O.C(CCCC(=O)O)CCCC(=O)O | 0 |
C(CCC(=O)O)CC(=O)O | c1ccc(cc1)c2nc(nc(n2)N)N | C(CCC(=O)O)CC(=O)O.c1ccc(cc1)c2nc(nc(n2)N)N | 1 |
C(CCC(=O)O)CC(=O)O | CN1C=NC2=C1C(=O)N(C(=O)N2C)C | C(CCC(=O)O)CC(=O)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C | 1 |
C(CCC(=O)O)CC(=O)O | c1ccc2c(c1)C=Cc3ccccc3N2C(=N)O | C(CCC(=O)O)CC(=O)O.c1ccc2c(c1)C=Cc3ccccc3N2C(=N)O | 1 |
C(CCC(=O)O)CC(=O)O | c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4 | C(CCC(=O)O)CC(=O)O.c1ccc(cc1)C(c2ccccc2)(c3ccccc3Cl)n4ccnc4 | 1 |
C(CCC(=O)O)CC(=O)O | C1=C(NC(=O)N=C1)N | C(CCC(=O)O)CC(=O)O.C1=C(NC(=O)N=C1)N | 1 |
C(CCC(=O)O)CC(=O)O | Cc1cc(cc(c1Oc2c(c(nc(n2)Nc3ccc(cc3)C#N)N)Br)C)C#N | C(CCC(=O)O)CC(=O)O.Cc1cc(cc(c1Oc2c(c(nc(n2)Nc3ccc(cc3)C#N)N)Br)C)C#N | 1 |
C(CCC(=O)O)CC(=O)O | C(CC(=O)O)CC(=O)O | C(CCC(=O)O)CC(=O)O.C(CC(=O)O)CC(=O)O | 0 |
C(CCC(=O)O)CC(=O)O | C1CNC(=O)N1 | C(CCC(=O)O)CC(=O)O.C1CNC(=O)N1 | 1 |
C(CCC(=O)O)CC(=O)O | CC(C)Cn1cnc2c1c3ccccc3nc2N | C(CCC(=O)O)CC(=O)O.CC(C)Cn1cnc2c1c3ccccc3nc2N | 1 |
C(CCC(=O)O)CC(=O)O | c1cnccc1C(=O)NN | C(CCC(=O)O)CC(=O)O.c1cnccc1C(=O)NN | 1 |
C(CCC(=O)O)CC(=O)O | CC[C@@H](C(=O)N)N1CCCC1=O | C(CCC(=O)O)CC(=O)O.CC[C@@H](C(=O)N)N1CCCC1=O | 0 |
C(CCC(=O)O)CC(=O)O | c1(nc(nc(n1)N)N)N | C(CCC(=O)O)CC(=O)O.c1(nc(nc(n1)N)N)N | 1 |
C(CCC(=O)O)CC(=O)O | C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O | C(CCC(=O)O)CC(=O)O.C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O | 1 |
C(CCC(=O)O)CC(=O)O | CC(=O)NCc1ccncc1 | C(CCC(=O)O)CC(=O)O.CC(=O)NCc1ccncc1 | 1 |
C(CCC(=O)O)CC(=O)O | CC(=NNC(=O)C1=CN=CC=C1)C | C(CCC(=O)O)CC(=O)O.CC(=NNC(=O)C1=CN=CC=C1)C | 1 |
C(CCC(=O)O)CC(=O)O | c1ccnc(c1)NC(=O)c2ccncc2 | C(CCC(=O)O)CC(=O)O.c1ccnc(c1)NC(=O)c2ccncc2 | 1 |
C(CCC(=O)O)CC(=O)O | c1ccnc(c1)NC(=O)c2cccnc2 | C(CCC(=O)O)CC(=O)O.c1ccnc(c1)NC(=O)c2cccnc2 | 1 |
C(CCC(=O)O)CC(=O)O | c1ccc2ccccc2c1 | C(CCC(=O)O)CC(=O)O.c1ccc2ccccc2c1 | 0 |
C(CCC(=O)O)CC(=O)O | c1cc(cnc1)C(=O)N | C(CCC(=O)O)CC(=O)O.c1cc(cnc1)C(=O)N | 1 |
C(CCC(=O)O)CC(=O)O | c1cc(cnc1)C(=O)NN | C(CCC(=O)O)CC(=O)O.c1cc(cnc1)C(=O)NN | 1 |
C(CCC(=O)O)CC(=O)O | CCCCCCCCCCCCCCCCCC(=O)O | C(CCC(=O)O)CC(=O)O.CCCCCCCCCCCCCCCCCC(=O)O | 0 |
C(CCC(=O)O)CC(=O)O | c1cnc(cn1)N | C(CCC(=O)O)CC(=O)O.c1cnc(cn1)N | 1 |
C(CCC(=O)O)CC(=O)O | c1cnccn1 | C(CCC(=O)O)CC(=O)O.c1cnccn1 | 1 |
C(CCC(=O)O)CC(=O)O | C(CCCC(=O)O)CCC(=O)O | C(CCC(=O)O)CC(=O)O.C(CCCC(=O)O)CCC(=O)O | 0 |
C(CCC(=O)O)CC(=O)O | C(=O)(N)N | C(CCC(=O)O)CC(=O)O.C(=O)(N)N | 1 |
C(CCCC(=O)O)CCCC(=O)O | CC(C)(CC(=O)O)C(=O)O | C(CCCC(=O)O)CCCC(=O)O.CC(C)(CC(=O)O)C(=O)O | 0 |
C(CCCC(=O)O)CCCC(=O)O | CC(C(C(=O)O)C)C(=O)O | C(CCCC(=O)O)CCCC(=O)O.CC(C(C(=O)O)C)C(=O)O | 0 |
C(CCCC(=O)O)CCCC(=O)O | Cc1ccc2c(c1)sc(n2)N | C(CCCC(=O)O)CCCC(=O)O.Cc1ccc2c(c1)sc(n2)N | 1 |
C(CCCC(=O)O)CCCC(=O)O | C1=CC=C2C(=C1)N=C(S2)N | C(CCCC(=O)O)CCCC(=O)O.C1=CC=C2C(=C1)N=C(S2)N | 1 |
C(CCCC(=O)O)CCCC(=O)O | C1=CC(=O)NC=C1 | C(CCCC(=O)O)CCCC(=O)O.C1=CC(=O)NC=C1 | 1 |
C(CCCC(=O)O)CCCC(=O)O | CC(CCCC(=O)O)CC(=O)O | C(CCCC(=O)O)CCCC(=O)O.CC(CCCC(=O)O)CC(=O)O | 0 |
C(CCCC(=O)O)CCCC(=O)O | c1cnccc1CCc2ccncc2 | C(CCCC(=O)O)CCCC(=O)O.c1cnccc1CCc2ccncc2 | 1 |
C(CCCC(=O)O)CCCC(=O)O | c1cc(cnc1)C(=O)N | C(CCCC(=O)O)CCCC(=O)O.c1cc(cnc1)C(=O)N | 1 |
C(CCCC(=O)O)CCCC(=O)O | c1cnc(cn1)N | C(CCCC(=O)O)CCCC(=O)O.c1cnc(cn1)N | 1 |
C(CCCC(=O)O)CCCC(=O)O | C(CCCCC(=O)O)CCCC(=O)O | C(CCCC(=O)O)CCCC(=O)O.C(CCCCC(=O)O)CCCC(=O)O | 0 |
C(CCCC(=O)O)CCCC(=O)O | C(CCCC(=O)O)CCC(=O)O | C(CCCC(=O)O)CCCC(=O)O.C(CCCC(=O)O)CCC(=O)O | 0 |
c1ccc(cc1)C(=O)N | c1c(cc(c(c1O)C(=O)O)O)O | c1ccc(cc1)C(=O)N.c1c(cc(c(c1O)C(=O)O)O)O | 0 |
c1ccc(cc1)C(=O)N | c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O | c1ccc(cc1)C(=O)N.c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O | 1 |
c1ccc(cc1)C(=O)N | c1cc(c(cc1C(=O)O)[N+](=O)[O-])N | c1ccc(cc1)C(=O)N.c1cc(c(cc1C(=O)O)[N+](=O)[O-])N | 0 |
c1ccc(cc1)C(=O)N | c1cc(c(cc1C(=O)O)[N+](=O)[O-])O | c1ccc(cc1)C(=O)N.c1cc(c(cc1C(=O)O)[N+](=O)[O-])O | 1 |
c1ccc(cc1)C(=O)N | CC1(C(CCC1(C)C(=O)O)C(=O)O)C | c1ccc(cc1)C(=O)N.CC1(C(CCC1(C)C(=O)O)C(=O)O)C | 0 |
c1ccc(cc1)C(=O)N | c1c2c(cc(c1Cl)S(=O)(=O)N)S(=O)(=O)N=CN2 | c1ccc(cc1)C(=O)N.c1c2c(cc(c1Cl)S(=O)(=O)N)S(=O)(=O)N=CN2 | 1 |
c1ccc(cc1)C(=O)N | c1ccc(cc1)/C=C/C(=O)O | c1ccc(cc1)C(=O)N.c1ccc(cc1)/C=C/C(=O)O | 0 |
c1ccc(cc1)C(=O)N | c1ccc(cc1)CS(=O)Cc2ccccc2 | c1ccc(cc1)C(=O)N.c1ccc(cc1)CS(=O)Cc2ccccc2 | 1 |
c1ccc(cc1)C(=O)N | CC(c1ccc(c(c1)F)c2ccccc2)C(=O)O | c1ccc(cc1)C(=O)N.CC(c1ccc(c(c1)F)c2ccccc2)C(=O)O | 1 |
c1ccc(cc1)C(=O)N | C(=C/C(=O)O)\C(=O)O | c1ccc(cc1)C(=O)N.C(=C/C(=O)O)\C(=O)O | 1 |
c1ccc(cc1)C(=O)N | c1(c(c(c(c(c1F)F)F)F)F)C(=O)O | c1ccc(cc1)C(=O)N.c1(c(c(c(c(c1F)F)F)F)F)C(=O)O | 1 |
c1ccc(cc1)C(=O)N | CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O | c1ccc(cc1)C(=O)N.CCCN(CCC)S(=O)(=O)c1ccc(cc1)C(=O)O | 1 |
c1ccc(cc1)C(=O)N | c1ccc(c(c1)C(=O)O)O | c1ccc(cc1)C(=O)N.c1ccc(c(c1)C(=O)O)O | 1 |
c1ccc(cc1)C(=O)N | C(CC(=O)O)C(=O)O | c1ccc(cc1)C(=O)N.C(CC(=O)O)C(=O)O | 1 |
O=C(O)c1ccccc1 | CC(C(C(=O)O)C)C(=O)O | O=C(O)c1ccccc1.CC(C(C(=O)O)C)C(=O)O | 0 |
O=C(O)c1ccccc1 | CC(CCCC(=O)O)CC(=O)O | O=C(O)c1ccccc1.CC(CCCC(=O)O)CC(=O)O | 0 |
O=C(O)c1ccccc1 | C(CCC(=O)O)CC(=O)O | O=C(O)c1ccccc1.C(CCC(=O)O)CC(=O)O | 0 |
O=C(O)c1ccccc1 | C(CC(=O)O)CC(=O)O | O=C(O)c1ccccc1.C(CC(=O)O)CC(=O)O | 0 |
O=C(O)c1ccccc1 | c1cnccc1C(=O)N | O=C(O)c1ccccc1.c1cnccc1C(=O)N | 1 |
O=C(O)c1ccccc1 | O=C(O)CC(O)=O | O=C(O)c1ccccc1.O=C(O)CC(O)=O | 0 |
O=C(O)c1ccccc1 | C(=O)(C(=O)O)O | O=C(O)c1ccccc1.C(=O)(C(=O)O)O | 0 |
O=C(O)c1ccccc1 | C(CCC(=O)O)CCC(=O)O | O=C(O)c1ccccc1.C(CCC(=O)O)CCC(=O)O | 0 |
O=C(O)c1ccccc1 | C(CC(=O)O)C(=O)O | O=C(O)c1ccccc1.C(CC(=O)O)C(=O)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cnccc1CCc2ccncc2 | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cnccc1CCc2ccncc2 | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(cc(c1)C#N)C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(cc(c1)C#N)C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(ccc1C#N)C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(ccc1C#N)C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1ccc2c(c1)cccc2C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1ccc2c(c1)cccc2C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | CCCCCCCCCCCCCCCCO | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.CCCCCCCCCCCCCCCCO | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1ccc2c(c1)cccc2O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1ccc2c(c1)cccc2O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(cc(c1)O)C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(cc(c1)O)C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(cnc1)C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(cnc1)C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(cnc1)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(cnc1)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | C1=CC(=CC=C1C2=CC=C(C=C2)O)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.C1=CC(=CC=C1C2=CC=C(C=C2)O)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cnccc1c2ccncc2 | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cnccc1c2ccncc2 | 1 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc(ccc1C#N)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc(ccc1C#N)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cnccc1C#N | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cnccc1C#N | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1ccc(cc1)c2ccncc2 | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1ccc(cc1)c2ccncc2 | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cc2cnccc2c(c1)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cc2cnccc2c(c1)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | C1=C(C=C(C=C1O)O)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.C1=C(C=C(C=C1O)O)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | C1=CC(=CC(=C1)O)O | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.C1=CC(=CC(=C1)O)O | 0 |
CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O | c1cnccc1/C=C/c2ccncc2 | CC(CS(=O)(=O)c1ccc(cc1)F)(C(=O)Nc2ccc(c(c2)C(F)(F)F)C#N)O.c1cnccc1/C=C/c2ccncc2 | 1 |
CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F | C(CCC(=O)O)CC(=O)O | CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F.C(CCC(=O)O)CC(=O)O | 0 |
CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F | C1CC(=O)NC1 | CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F.C1CC(=O)NC1 | 1 |
CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F | c1cc(cnc1)C(=O)N | CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F.c1cc(cnc1)C(=O)N | 1 |
c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl | c1c(cnc(c1Br)N)Br | c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl.c1c(cnc(c1Br)N)Br | 1 |
c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl | Cc1cc(nc(n1)N)C | c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl.Cc1cc(nc(n1)N)C | 1 |
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