smiles
stringlengths 15
246
| p1
stringlengths 3
183
| p2
stringlengths 3
174
|
|---|---|---|
COCc1ccc(C(=O)NCCO[C@H]2CCCC[C@@H]2C)cc1 | COCc1ccccc1 | CC1CCCCC1 |
Cn1ccnc1CN1CC[C@@]2(C1)Cn1c(nnc1CC(NS(C)(=O)=O)c1ccccc1Cn1cccn1)CO2 | Cn1ccnc1CN1CC[C@@]2(C1)Cn1c(CCc3ccccc3)nnc1CO2 | CS(=O)(=O)NCc1ccccc1Cn1cccn1 |
CC(C)OCCNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O | Cn1cc(N2CC[C@H](N)C2=O)cn1 | CC(C)OCCNC(=O)N[C@H]1CCNC1=O |
CC(C)[C@H](C)NC(=O)CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O | CN(c1ccc2c(c1)OCCO2)S(C)(=O)=O | CC(C)[C@H](C)NC(=O)CNS(C)(=O)=O |
O=C1NC(=O)[C@H](CCC(=O)N2CCN(c3ncnc4ccccc34)CC2)N1 | O=C1CNC(=O)N1 | c1ccc2ncncc2c1 |
C[C@H](C(=O)O)C(=O)N1CCN(c2cc(C3CC3)n[nH]2)CC1 | CCC(=O)O | c1cc(C2CC2)n[nH]1 |
O=C(NCCSc1ccc(Br)cc1)c1ccc(Cl)cc1 | Brc1ccccc1 | Clc1ccccc1 |
Cc1noc(C)c1CN(C)[C@H](C)C(=O)NC[C@@H]1CCCO1 | Cc1noc(C)c1C | C[C@@H]1CCCO1 |
CCN1CCN(C(=O)CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(F)cc2)CC1 | CCN1CCN(C=O)CC1 | O=[SH](=O)c1ccc(F)cc1 |
Cc1cc(N/C=C2\C(=O)NC(=O)N(c3ccc(Br)c(C)c3C)C2=O)ccc1[N+](=O)[O-] | Cc1c(Br)ccc(N2C(=O)NC(=O)/C(=C\N)C2=O)c1C | Cc1cc(NC=C2C(=O)NC(=O)NC2=O)ccc1[N+](=O)[O-] |
N#Cc1cccc(S(=O)(=O)n2c(COc3ccc(Cl)cc3)nc3ccccc32)c1 | N#Cc1cccc([SH](=O)=O)c1 | COc1ccc(Cl)cc1 |
Cc1noc([C@H](C)N[C@H]2CCN(S(=O)(=O)C(C)C)C[C@H]2C)n1 | CC(C)S(=O)(=O)N1CCC[C@H](C)C1 | Cc1noc([C@H](C)N[C@H]2CCNC[C@H]2C)n1 |
COc1c(F)cc(C(NC(=O)c2cc(C)nn2C)C2CC(O)C2)c2[nH]cc(CC(=O)Nc3nccs3)c12 | O=C(Cc1c[nH]c2ccccc12)Nc1nccs1 | COc1ccc([C@@H](NC(=O)c2cc(C)nn2C)[C@H]2C[C@@H](O)C2)cc1F |
CN(Cc1ccccc1N1CCCC1)S(=O)(=O)N1CCCCCC1 | CNS(=O)(=O)N1CCCCCC1 | CN(Cc1ccccc1N1CCCC1)[SH](=O)=O |
COC(=O)c1cn(C(=O)[C@H]2CN(S(=O)(=O)Cc3ccccc3)c3ccccc3O2)c2ccccc12 | COC(=O)c1c[nH]c2ccccc12 | O=[SH](=O)Cc1ccccc1 |
O=C(NCc1cccs1)[C@H]1CCCN(c2cnccn2)C1 | c1cnc(N2CCCCC2)cn1 | O=C(NCc1cccs1)[C@H]1CCCNC1 |
CC(=O)c1cccc(OC(C(=O)Nc2ccc(C(=O)N(C)C)cc2F)n2nc3c(-c4nc(-c5ccc(Cl)cc5)no4)cccn3c2=O)c1 | CC(=O)c1cccc(OCC(=O)Nc2ccc(C(=O)N(C)C)cc2)c1 | O=C(Cn1nc2c(-c3nc(-c4ccc(Cl)cc4)no3)cccn2c1=O)Nc1ccccc1F |
CN(CC(N)=O)C(=O)N1CCOCC1 | CNC(=O)N1CCOCC1 | CN(C=O)CC(N)=O |
CCN(CCN1CCOCC1)C(=O)c1[nH]nc(C(F)(F)F)c1CCC(=O)NCCn1ccc2ccoc2c1=O | Cc1n[nH]c(C)c1CCC(=O)NCCn1ccc2ccoc2c1=O | CCN(CCN1CCOCC1)C(=O)c1cc(C(F)(F)F)n[nH]1 |
CCOc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NCc3ccco3)c(Cl)c2)c2c1OCC(C(C)NC(=O)CCN1CCOCC1)O2 | CCOc1ccc(NS(=O)(=O)c2ccc(OCC(=O)NCc3ccco3)c(Cl)c2)cc1 | C[C@H](NC(=O)CCN1CCOCC1)[C@H]1COc2ccccc2O1 |
Cc1cc(N2CCOCC2)nc(N2CCN(C(=O)C3CCCCC3)CC2)n1 | C1COCCN1 | O=CC1CCCCC1 |
CCCc1nnc(NC(=O)[C@@H](CC)Oc2ccccc2)s1 | CC[C@@H](Oc1ccccc1)C(N)=O | CCCC(=O)Nc1nnc(CCC)s1 |
CCn1cc(S(=O)(=O)N2CCC[C@H](C(=O)NCc3c(C)nn(-c4ccccc4)c3C)C2)c(C)n1 | CCn1cc([SH](=O)=O)c(C)n1 | Cc1cc(C)n(-c2ccccc2)n1 |
O=C([C@@H]1C[C@H]1c1ccccc1F)N1CC[C@H](Oc2ccncc2)C1 | Fc1ccccc1C1CC1 | Oc1ccncc1 |
Nc1cc2c(nn1)CCN(C(=O)c1cc(-c3ccc(F)cc3)n[nH]1)C2 | O=Cc1cc(-c2ccc(F)cc2)n[nH]1 | Nc1cc2c(nn1)CCN(C(=O)c1ccn[nH]1)C2 |
NC(N)=Nc1nc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)cs1 | O=S(=O)(c1ccccc1)N1CCOCC1 | NC(N)=Nc1nc(-c2ccccc2)cs1 |
O=C(CCNC(=O)NC1CCCCC1)Nc1nc(-c2ccc3c(c2)OCCO3)cs1 | O=CNC1CCCCC1 | c1ccc2c(c1)OCCO2 |
CC(C)[C@H](NC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)c1ccc(Cl)cc1 | FC(F)(F)c1nnc2ccc(N3CCCCC3)nn12 | Clc1ccccc1 |
Cc1cc(F)c(Oc2ccc(Cl)cc2NC(=O)COC(=O)Cn2nc(O)c3ccccc3c2=O)cc1N1CCC[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)C1 | Cc1cc(F)ccc1N1CCC[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)C1 | O=C(COC(=O)Cn1nc(O)c2ccccc2c1=O)Nc1cc(Cl)ccc1Oc1ccccc1 |
Cc1ccc(N2CCC(C(=O)Nc3ccc4c(c3)OCCO4)CC2)cc1 | Cc1ccccc1 | c1ccc2c(c1)OCCO2 |
C[C@H](C(=O)OC(C)(C)C)N(C)c1ncnc2cc(Cl)ccc12 | C[C@H](C=O)N(C)c1ncnc2cc(Cl)ccc12 | CN[C@H](C)C(=O)OC(C)(C)C |
COc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2)cc(N2C(=O)[C@@H]3C4c5ccccc5C(c5ccccc54)[C@H]3C2=O)c1 | Cc1cccc(N2C(=O)[C@@H]3C4c5ccccc5C(c5ccccc54)[C@H]3C2=O)c1 | COc1cccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2)c1 |
C[C@@H](Cn1cncn1)NS(=O)(=O)c1cnn(-c2ccccc2)c1 | CCCn1cncn1 | c1ccccc1 |
N#Cc1ccc(O[C@@H]2COCC[C@H]2NC(=O)CCN2CCCCC2)cc1 | N#Cc1ccccc1 | CCN1CCCCC1 |
CCOc1cc(C(=O)OC)cc(NC(=S)Nc2ccc(F)cc2Cl)c1OCC | CCOc1cccc(NC(=S)Nc2ccc(F)cc2Cl)c1OCC | CCOc1ccc(C(=O)OC)cc1OCC |
CCOC(=O)C1=C(C)NC2=C(C(=O)C(C(=O)OC)C(C)C2)C1c1ccc(C)c(OCc2nnc(SCC(=O)Nc3ccc(OCC)cc3)o2)c1Cl | CCOc1ccc(NC(=O)CSc2nnc(COc3ccccc3C)o2)cc1 | CCOC(=O)C1=C(C)NC2=C(C(=O)[C@H](C(=O)OC)[C@@H](C)C2)[C@H]1c1ccccc1Cl |
CC[C@H](C(=O)NC(C)(C)C)N(Cc1ccc(Cl)cc1)C(=O)Cc1cc(C)c(OCC(=O)Nc2ccccc2N2CCOCC2)c2ncccc12 | CC[C@H](C(=O)NC(C)(C)C)N(Cc1ccc(Cl)cc1)C(=O)Cc1cccc(C)c1 | O=C(COc1cccc2cccnc12)Nc1ccccc1N1CCOCC1 |
O=C1NC(=O)N(c2ccc(OCc3ccc(Cl)cc3Cl)cc2)C(=O)/C1=C\c1cccc(O)c1 | O=C1NC(=O)C(=Cc2cccc(O)c2)C(=O)N1 | O=C1CC(=O)N(c2ccc(OCc3ccc(Cl)cc3Cl)cc2)C(=O)N1 |
Cc1ccc(N([C@@H](C)C(=O)N2CCN(C)CC2)S(C)(=O)=O)cc1Cl | Cc1ccccc1Cl | CN1CCNCC1 |
O=C(Nc1ccc(-n2cnnn2)cc1)c1c[nH]nc1-c1ccccc1Cl | O=Cc1c[nH]nc1-c1ccccc1Cl | O=C(Nc1ccc(-n2cnnn2)cc1)c1cn[nH]c1 |
COc1cc2c(cc1OC)[C@@H](C1CC1)N(C(=O)Cc1ccoc1)CC2 | COc1cc2c(cc1OC)CN(C(=O)Cc1ccoc1)CC2 | COc1cc2c(cc1OC)[C@@H](C1CC1)NCC2 |
CC[C@H](C(=O)NC1(c2ccccc2C)CC1)N1CCOCC1 | Cc1ccccc1C1CC1 | C1COCCN1 |
CCOc1cc(/C=C2/SC(=O)N(CC(=O)Nc3ccc(C)cc3C)C2=O)ccc1O | CCOc1cc(C)ccc1O | Cc1ccc(N)c(C)c1 |
COc1cc(C2CCCN2C(=O)NCc2ccccn2)c(OC)c2c(C=c3sc4n(c3=O)CCN=4)cccc12 | O=c1c(=Cc2cccc3ccccc23)sc2n1CCN=2 | COc1ccc(OC)c([C@H]2CCCN2C(=O)NCc2ccccn2)c1 |
CCN(C(=O)CN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O)[C@H]1CCS(=O)(=O)C1 | CCN[C@H]1CCS(=O)(=O)C1 | c1ccc2c(c1)OCO2 |
Cn1ccnc1CNC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1 | O=CCNC(=O)c1ccc(C(F)(F)F)cc1 | Cn1ccnc1CNC(=O)CNC=O |
CN(C)c1ncccc1CNC(=O)c1ccc(Br)o1 | CNC(=O)c1ccc(Br)o1 | CN(C)c1ncccc1CNC=O |
CN(C(=O)CN(c1ccccc1F)S(C)(=O)=O)C1CCCC1 | CNC1CCCC1 | Fc1ccccc1 |
CCNC(=O)c1cn(C(CNC(=O)CCn2c3c(c4ccccc42)CCN2C(=O)c4ccccc4N(C)C32)c2ccc(F)cc2)cc(C(=O)N(C)Cc2csc(-c3cccs3)n2)c1=O | CCNC(=O)c1cn(Cc2ccccc2)cc(C(=O)N(C)Cc2csc(-c3cccs3)n2)c1=O | CN1c2ccccc2C(=O)N2CCc3c(n(CCC(=O)NCCc4ccc(F)cc4)c4ccccc34)[C@@H]21 |
CN(C)c1ccc(-c2cccc(C(=O)N(C)C3Cc4ccccc4C3)c2)nn1 | CN(C)c1cccnn1 | c1ccc2c(c1)CCC2 |
CC[C@@H](C)[C@H](NC(=O)N1CCc2nc[nH]c2[C@H]1c1ccc(Cl)cc1)C(=O)OC | NC(=O)N1CCc2nc[nH]c2[C@H]1c1ccc(Cl)cc1 | CC[C@@H](C)[C@H](NC(=O)N1CCc2nc[nH]c2C1)C(=O)OC |
CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2cc(C)c(Cl)c([N+](=O)[O-])c2CN2CCC(C(C)NC(C)=O)CC2)cc1 | CCOc1ccc(NC(=O)C2=C(C)NC(=O)N[C@H]2c2ccc(Cl)c([N+](=O)[O-])c2)cc1 | CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C)c(Cl)c2)CC1 |
Cc1ccc(C(C)(C)OC(=O)N(C)C2CCN(C(=O)CN)C2)c(O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 | Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 | CN(C(=O)OCc1ccccc1)[C@H]1CCN(C(=O)CN)C1 |
CN(CCC#N)CC(=O)Nc1ccccc1[N+](=O)[O-] | CN(C)CCC#N | O=[NH+][O-] |
CCn1nc(CC(C)C)cc1-c1nc(C)nn1CC | CCn1nccc1-c1nc(C)nn1CC | CCn1ccc(CC(C)C)n1 |
C[C@@H](NC(=O)c1ccc(NC(=O)c2cccnc2)cc1)c1ccccc1 | CCc1ccccc1 | NC(=O)c1cccnc1 |
CCN(CC)C(=O)CN1C(=O)S/C(=C\c2ccccc2O)C1=O | O=C1NC(=O)/C(=C/c2ccccc2O)S1 | CCN(CC)C(=O)CN1C(=O)CSC1=O |
CCOC(=O)N1CCN(C(=O)[C@@H]2CC(=O)N(CCc3ccc(OC)c(OC)c3)C2)CC1 | COc1ccc(CCN2C[C@H](C=O)CC2=O)cc1OC | CCOC(=O)N1CCN(C(=O)[C@H]2CNC(=O)C2)CC1 |
COc1cncc(C(=O)N2CCN(C3CC3)c3cc(Cl)ccc32)n1 | COc1cncc(C=O)n1 | C1CC1 |
Cc1nn(C)c(C)c1/C(O)=C1\C(=O)C(=O)N(CCN2CCOCC2)[C@@H]1c1ccccc1 | O=C1C[C@@H](c2ccccc2)N(CCN2CCOCC2)C1=O | Cc1nn(C)c(C)c1/C(O)=C1/CN(CCN2CCOCC2)C(=O)C1=O |
O=C(c1csc(C2CC2)n1)N1C[C@H](O)C[C@@H]1CO | C1CC1 | OC[C@H]1C[C@@H](O)CN1 |
Cc1ccc(C(=O)NC(=S)Nc2ccc(F)cc2)c(C)c1 | Cc1cccc(C)c1 | Fc1ccccc1 |
CN1C(=O)CC[C@H](C(=O)NCc2cccs2)[C@H]1c1cccc(F)c1 | CN1C(=O)CCC[C@H]1c1cccc(F)c1 | CN1C[C@@H](C(=O)NCc2cccs2)CCC1=O |
Cc1ccc(CNC(=O)CCNC(=O)[C@@H]2C[C@H]2C)s1 | C[C@@H]1C[C@H]1C(=O)NCCC(N)=O | Cc1ccc(CNC(=O)CCN)s1 |
Cc1cnc2c(S(=O)(=O)N(C)Cc3nc4ccsc4c(=O)[nH]3)c(C(=O)N(C)Cc3ccc(C(=O)NCC(F)(F)F)cc3)cc(Br)c2c1 | Cc1cnc2c(S(=O)(=O)N(C)Cc3nc4ccsc4c(=O)[nH]3)cccc2c1 | CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)c1cccc(Br)c1 |
Clc1ccccc1OCc1nc(-c2cccs2)no1 | Clc1ccccc1 | c1ccsc1 |
COCC(=O)N[C@H](c1ccccc1)c1ccc(Br)c(C2CN(C3CCN(S(C)(=O)=O)CC3)CCN2C)c1F | COCC(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1F | CN1CCN(C2CCN(S(C)(=O)=O)CC2)C[C@@H]1c1ccccc1 |
CCc1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 | C[C@@H]1CN([SH](=O)=O)C[C@@H](C)O1 | CCc1ccc(OC)c([SH](=O)=O)c1 |
O=[N+]([O-])c1cccnc1N/N=C/c1cn(Cc2ccc(F)cc2)c2ccccc12 | N/N=C/c1cn(Cc2ccc(F)cc2)c2ccccc12 | O=[N+]([O-])c1cccnc1N/N=C/c1c[nH]c2ccccc12 |
O=C(c1cc(Br)ccc1Cl)N1CCCN(S(=O)(=O)c2c[nH]cn2)CC1 | O=S(=O)(c1c[nH]cn1)N1CCCNCC1 | O=C(c1cc(Br)ccc1Cl)N1CCCNCC1 |
O=C(Cc1ccccn1)N1CCC2(CC(NS(=O)(=O)C3CC3)C2)C1 | O=CCc1ccccn1 | NS(=O)(=O)C1CC1 |
COC[C@H](C)NC(=O)c1cc2c(ccc3c(CCC(=O)N4CCCC(n5nc(C)nc5C)C4)c(C)ccc32)oc1=O | COC[C@H](C)NC(=O)c1cc2c(ccc3ccccc32)oc1=O | Cc1nc(C)n([C@H]2CCCN(C(=O)CCc3ccccc3C)C2)n1 |
CC(=O)Nc1ccc(CN2CCC(c3nn(C)c4nccnc34)CC2)cc1 | CN1CCC(c2nn(C)c3nccnc23)CC1 | CC(=O)Nc1ccc(CN2CCCCC2)cc1 |
CCC(=O)Nc1ccc(NC(=O)[C@@H](c2ccc(F)cc2)N2CCCCC2)c(C)c1 | NC(=O)[C@@H](c1ccc(F)cc1)N1CCCCC1 | CCC(=O)Nc1ccc(NC(=O)CN2CCCCC2)c(C)c1 |
Cc1cc(CN2CCN(CC(=O)Nc3nccs3)CC2)on1 | Cc1ccon1 | Nc1nccs1 |
Cc1cc(S(=O)(=O)NC[C@H](O)c2cccs2)ccc1OC(C)C1CCC(C)N(C(=O)c2cc3nc(-c4ccco4)cc(C(F)(F)F)n3n2)C1 | CCOc1ccc(S(=O)(=O)NC[C@H](O)c2cccs2)cc1C | C[C@@H]1CC[C@H](C)N(C(=O)c2cc3nc(-c4ccco4)cc(C(F)(F)F)n3n2)C1 |
COc1ccc(CCN(C)S(=O)(=O)c2cccc(C(F)(F)F)c2)cc1OC | CN(C)S(=O)(=O)c1cccc(C(F)(F)F)c1 | COc1ccc(CCN(C)[SH](=O)=O)cc1OC |
Cc1cc(C)c(S(=O)(=O)N[C@@H](C)c2ccc(Br)cc2)c(C)c1 | Cc1cc(C)cc(C)c1 | CCc1ccc(Br)cc1 |
CO[C@H]1CCN([C@H]2CCC[C@H]2N(C)C(=O)COC2CCCC2)C1 | CN(C(=O)COC1CCCC1)C1CCCC1 | CN[C@@H]1CCC[C@@H]1N1CC[C@H](OC)C1 |
Cc1c(C(=O)Nc2cccc(S(=O)(=O)NC3=NCCC3)c2)nnn1-c1cccc2ncccc12 | O=[SH](=O)NC1=NCCC1 | c1ccc2ncccc2c1 |
CC[C@H]1CO[C@]2(C1)CC(CCC(=O)NC(C)Cc1ccsc1)(Cc1ccc(Cl)cc1)N(C(=O)CCS(C)(=O)=O)C2=O | CC[C@H]1CO[C@@]2(CCN(C(=O)CCS(C)(=O)=O)C2)C1 | C[C@H](Cc1ccsc1)NC(=O)CC[C@]1(Cc2ccc(Cl)cc2)CCC(=O)N1 |
CCOc1ccc([C@@H]2C[C@H]2C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)cc1 | O=CNC[C@H](c1ccc(Cl)cc1)N1CCOCC1 | CCOc1ccc([C@@H]2C[C@H]2C(=O)NCCN2CCOCC2)cc1 |
CCn1c(CC(=O)Nc2ccc(C)cc2)nnc1SCc1ccc(Br)cc1 | Cc1ccc(N)cc1 | SCc1ccc(Br)cc1 |
COc1cc(CCNC(=O)CCNC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC | COc1ccc([N+](=O)[O-])cc1OC | CNC(=O)OC(C)(C)C |
COCCn1cnnc1SCc1noc(-c2ccc(OC)cc2)n1 | COc1ccc(-c2nc(CS)no2)cc1 | COCCn1cnnc1SCc1ncon1 |
COc1ccc(CNC(=O)Cc2ccc(Cl)cc2Cl)cc1 | CNC(=O)Cc1ccc(Cl)cc1Cl | COc1ccc(CNC(C)=O)cc1 |
Cc1nc(CN2CCN(C(=O)[C@@H](c3cc(F)c(NS(=O)(=O)c4ccc5c6c(cccc46)C(=O)N5C)c(Cl)c3)N(C)C)CC2)cs1 | Cc1nc(CN2CCN(C(=O)[C@@H](c3cccc(F)c3)N(C)C)CC2)cs1 | CN1C(=O)c2cccc3c(S(=O)(=O)Nc4c(F)cccc4Cl)ccc1c23 |
O=C(/C=C/c1ccccc1)c1cccc(OC(F)(F)F)c1 | C=Cc1ccccc1 | OC(F)(F)F |
CC(CC1CCc2c(sc(NC(=O)C3CCCO3)c2C#N)C1)CN1C(=O)C(=O)N([C@H]2CCN(CC(F)(F)F)C2=O)C1=O | CC(C)CN1C(=O)C(=O)N([C@H]2CCN(CC(F)(F)F)C2=O)C1=O | CCC[C@H]1CCc2c(sc(NC(=O)[C@H]3CCCO3)c2C#N)C1 |
Cc1ccc(C(=O)Nc2nnc(S(=O)(=O)Nc3nnc(SC(C)C)s3)s2)cc1 | CC(C)Sc1nnc(NS(=O)(=O)c2nncs2)s1 | Cc1ccc(C(=O)Nc2nnc([SH](=O)=O)s2)cc1 |
COc1cc(Cl)c(C)cc1NC(=O)c1c(C)nc(C(C)C)nc1SC | COc1cc(Cl)c(C)cc1N | CCC |
COC(=O)c1ccc(C)c(NC(=O)c2cccc(S(=O)(=O)Nc3ccccc3C)c2)c1 | Cc1ccccc1NS(=O)(=O)c1cccc(C(N)=O)c1 | COC(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 |
CN1CCCc2cc([C@H](CNC(=O)C(=O)NCc3ccccc3Cl)N3CCCC3)ccc21 | O=C(NCCN1CCCC1)C(=O)NCc1ccccc1Cl | CN1CCCc2cc([C@H](CNC=O)N3CCCC3)ccc21 |
COC1CCCOC12CCN(C(=O)c1ccc(C)c(F)c1-c1nc(C#N)c(NCc3ccccc3Cl)o1)CC2 | N#Cc1nc(-c2ccccc2F)oc1NCc1ccccc1Cl | CO[C@H]1CCCOC12CCN(C(=O)c1ccc(C)c(F)c1)CC2 |
Cc1ccnc(N2CCN(c3ncnc4c3ncn4C)CC2)n1 | Cc1ccncn1 | Cn1cnc2cncnc21 |
O=C([C@H]1CN(c2ccc3nncn3n2)CCO1)N1CCCC1 | c1cc2nncn2nc1N1CCOCC1 | O=C([C@H]1CNCCO1)N1CCCC1 |
CCCNC(=O)CN(c1cc(-c2cncc(C[C@H]3CCCN(S(C)(=O)=O)C3)n2)c(CC)cc1F)S(=O)(=O)c1ccccc1 | CS(=O)(=O)N1CCC[C@H](Cc2cncc(-c3ccc(F)cc3)n2)C1 | CCCNC(=O)CN(c1ccc(CC)cc1)S(=O)(=O)c1ccccc1 |
CCCOc1ccc(/C=C/C(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1OC | CCCOc1ccccc1OC | c1ccc2c(c1)OCCO2 |
O=C(O)[C@@H]1CCCN(CCCc2ccccc2)C1 | c1ccc(CCCN2CCCCC2)cc1 | CN1CCC[C@@H](C(=O)O)C1 |
Cn1cnnc1[C@@H]1CN(/C(O)=N/[C@@H]2COc3ccccc32)CCO1 | Cn1cnnc1 | c1ccc2c(c1)CCO2 |
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