p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CCCc2occc2C1 | Cc1ccc(NC(=O)[C@@H]2CC(=O)Nc3nc(N4[C@H](C)CCC[C@@H]4C)[nH]c(=O)c32)cc1 | 0.644399 |
Cc1nn(C)cc1C[C@H](NC(=O)c1cc(Cn2ccc3ccc(Br)cc32)oc1C)C(=O)O | O=C(Nc1ccnc(Cc2ccccc2)n1)N[C@H]1COc2c(F)cc(F)cc2C1 | 0.644889 |
CC[C@@H](OC(=O)c1ccc(N2CCCS2(=O)=O)cc1)C(=O)Nc1cc(C)on1 | CC(=O)N1CCc2c(sc(NC(=O)c3cccc(F)c3)c2C#N)C1 | 0.612159 |
CSc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc1 | Cc1ccc(-c2nnc(CCC(=O)N3CCC[C@@H]3c3nc4ccccc4s3)o2)cc1 | 0.590526 |
Cc1c(C(=O)N2CCSCC2)cnn1-c1cc(-c2nc(C3CC3)no2)ccn1 | CN(C)CC[C@H]1CN(Cc2ccccc2F)Cc2ccnn21 | 0.59728 |
O=C(NCc1ccc(-n2ccnc2)cc1)[C@H]1CN(S(=O)(=O)Cc2ccccc2)c2ccccc2O1 | Cc1nn2c3c(nnc2c1-c1ccc(F)cc1)C(=O)C[C@H](c1ccco1)C3 | 0.761905 |
CCN1CCN(C(=O)[C@@]2(C)Oc3ccc(Cl)cc3NC2=O)CC1 | CC1(C)c2ccccc2C2(OC(=O)c3ccccc32)c2ccccc21 | 0.519252 |
CCCN1C[C@H](NC(=O)c2nc3ccccc3[nH]c2=O)CC1=O | COc1ccccc1/N=C1\S[C@H](CC(=O)Nc2cccc(C(C)=O)c2)C(=O)N1C | 0.53224 |
COCCOC(=O)C1=C(C)NC2=C(C(=O)[C@H](C(=O)OC)[C@H](C)C2)[C@@H]1c1ccc(OC)cc1 | CCOc1ccc(/C=C2\Oc3cc(OC(=O)N(CC)CC)ccc3C2=O)cc1 | 0.616736 |
CCc1nn(C)cc1CNS(=O)(=O)c1ccc(OC)c(F)c1C | C=CCN(c1cc(C)ccc1C)S(=O)(=O)c1ccc(NC(C)=O)cc1 | 0.530093 |
O=C(c1cscn1)N1CCC[C@@]2(CCN(c3ncc(F)cn3)C2)C1 | Cc1ccc(C(=O)NCCn2ncc(-c3cnccn3)c2-c2cccs2)c(=O)n1C | 0.577551 |
CCS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2cccc(I)c2)n1 | CC(=O)NCc1ccc(-c2csc(NC(=O)[C@H](C)NC(=O)c3cccs3)n2)o1 | 0.526824 |
Cn1c(=O)n(C)c2cc(NC(=O)c3cc4c(ccc5ccccc54)o3)ccc21 | COc1nc(-c2cn(-c3ccc4c(c3)C(=O)N([C@@H]3CCC(=O)NC3=O)C4)nn2)sc1C | 0.654894 |
O=C(Cc1csc(-c2ccccn2)n1)N[C@@H]1CCOc2ccccc21 | COCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc(-c2ccccc2C(=O)OC)o1 | 0.706587 |
Cc1cn2nc(N3CCN(C(=O)C4CC4)CC3)ccc2n1 | Cc1ccccc1-c1noc([C@H](C)NC(=O)c2ccnn2C(C)C)n1 | 0.500538 |
CCOc1cc(/C=C2/SC(=O)N([C@H](C)C(=O)OC)C2=O)ccc1OCc1cccc([N+](=O)[O-])c1 | COc1ccc(CN2CCn3cc(CN4CCOCC4)nc3C2)cc1 | 0.551983 |
CC(C)(C)c1ccccc1OC[C@H](O)CN1CCN(S(=O)(=O)c2ccccc2F)CC1 | CN(C)C[C@@H]1CCn2ncc(C(=O)NCCc3cscn3)c2C1 | 0.503834 |
C[C@@H](COc1ccc(F)cc1)NC(=O)NCc1cccnc1-n1cncn1 | O=C(NC1CCN(c2ncnc3[nH]cnc23)CC1)c1cccc(F)c1 | 0.516347 |
COc1ccccc1-n1c(=O)[nH]c(C(=O)O)c(CN(C)C)c1=O | N#Cc1cccc(C(=O)N2Cc3ccnn3[C@@H](CC(=O)NCCc3ccncc3)C2)c1 | 0.691675 |
COc1cc2c(cc1OC)[C@@]13CC[C@@H]4C[C@@H]1[C@H]1[C@H]5C(=CCO[C@@H]6CC(=O)N2[C@H]3[C@@H]56)CN41 | CCn1nc(C)cc1-c1nn2c(Cc3ccccc3C)nnc2s1 | 0.779744 |
Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)c2cc(-c3ccco3)nc3ccccc23)CC1 | CCc1nnc(-n2ccc3c(nnc4c(-c5ccc(OC)cc5)c(C)nn43)c2=O)[nH]1 | 0.795025 |
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccn(-c2ccccc2F)n1 | COc1ccc(Cl)cc1[C@@H](C)NC[C@H]1CC(C(N)=O)=NO1 | 0.505006 |
O=C(N[C@@H]1CCN(C(=O)Nc2ccccc2)C1)[C@@H]1Cc2cc(Br)ccc2O1 | Cc1cccc(OCC(=O)Nc2ccc3c(c2)nc(CN2CCN(C(=O)C(C)C)CC2)n3C)c1 | 0.604096 |
O=C(NS(=O)(=O)c1cc(F)cc(OC(F)F)c1)[C@H]1CC=CCN1 | O=C1N[C@@]2(C[C@@H]3CC[C@H]2C[C@@H]3C(=O)NC2CC2)Nc2ccccc21 | 0.525084 |
O=C(c1cc(=O)c2ccccc2o1)N1CCC(Cn2cccn2)CC1 | Cc1cc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)n(C)n1 | 0.566304 |
O=C(O)[C@@H]1CN(c2nnnn2-c2ccc(Oc3ccccc3)cc2)CCN1 | O=C(c1[nH]nc2c1CCCC2)N1CCS[C@H]2COCC[C@H]21 | 0.54818 |
CCn1c(N2CCCCCC2)nc2c1c(=O)[nH]c(=O)n2C | CCCN1CCCC[C@@H]1c1cccnc1N(C)C(=O)OC(C)(C)C | 0.61466 |
Cc1ccc(C(=O)NC[C@@H](c2cccnc2)S(=O)(=O)c2ccc(F)c(C)c2)cc1C | Cc1cccnc1OCC1CCN(C(=O)[C@H]2CCc3ccccc3O2)CC1 | 0.525109 |
O=C(NCCc1c[nH]c2ccccc12)c1ccc(S(=O)(=O)N2CCOCC2)cc1 | CCOC(=O)c1c(C)[nH]c(C(=O)N(Cc2nnc(-c3ccccc3)o2)C(C)C)c1C | 0.566946 |
Cc1ccc(C(=O)N[C@H](C(N)=O)c2nnc(-c3ccccc3)o2)cc1 | CCCn1cc(C(=O)N[C@H]2C[C@H](c3nnc(CO)n3CC)C2)c(C)n1 | 0.578261 |
Cc1cc(Br)ccc1NC(=O)[C@@H]1Cc2ccccc2O1 | CCSc1nc2c(c(=O)n1CCc1ccccc1)S[C@H](C)C2 | 0.501068 |
C[C@@H](OC(=O)c1cccc([C@]2(C)NC(=O)NC2=O)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 | Cc1nc2n(c(=O)c1C)[C@H](CC(=O)N1CC[C@@H](CF)C1)CS2 | 0.609504 |
CCOC(=O)CCC1=CCCN(c2cc(Nc3ncc(C)s3)ncn2)C1 | CC(C)c1cc(C(F)(F)F)n2nc([C@@H]3CCN(CC(C)(C)CN4CCCC4)C3)cc2n1 | 0.549578 |
Cc1ccc(O[C@@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)C2)nc1 | Cc1ccc(NC(=O)CSc2nnc(N3CCCC3)n2C2CC2)cc1C | 0.546908 |
COc1ccc2c(c1)OC[C@H](CNC(=O)c1ccccc1-c1ncc[nH]1)C2 | CC1=CC(C)(C)N2C(=O)[C@]3(SCC(=O)N3c3ccc(O)cc3)c3cc(C)cc1c32 | 0.651917 |
C[C@H](C(=O)Nc1cccc(Cl)c1Cl)N(c1ccc2c(c1)OCCO2)S(C)(=O)=O | O=C(NCc1ccc(Cl)cc1)c1nc(Cc2c[nH]c3ccccc23)no1 | 0.534653 |
CCOC(=O)c1c(NC(=O)CN2CCCCC2)sc2c1CCCC2=O | O=C(C[C@@]1(COc2ccccc2)CCCN(C(=O)c2cccnc2Cl)C1)N1CCCCC1 | 0.626178 |
CC(C)(C)NC(=O)CSc1[nH]c(-c2ccccc2)nc1S(=O)(=O)c1ccccc1 | Cc1cc(C)n(C[C@@H](C)NC(=O)c2c[nH]nc2-c2ccccc2)n1 | 0.516866 |
CCc1cc(C(=O)NCc2cccnc2-n2cncn2)[nH]n1 | COc1cccc(Cl)c1CNC(=O)NCc1cn2c(C)cccc2n1 | 0.508753 |
Cc1ccccc1C1(NS(=O)(=O)Cc2ccc(C(=O)O)cc2)CC1 | N#Cc1c(NC(=O)C2(c3ccccc3)CCCC2)sc2c1CCCC2 | 0.527869 |
COC(=O)Nc1ccc(S(=O)(=O)NCCn2cc(-c3ccco3)cn2)cc1 | Cc1ccc(S(=O)(=O)N2CCN(c3oc(C4CC4)nc3C#N)CC2)cc1C | 0.566964 |
NS(=O)(=O)c1ccc2c(c1)N(Cc1ccn(-c3cccc(F)c3)n1)CCC2 | COc1ccc2[nH]c(=O)c(CN(C(=O)c3cccnc3)c3ccccc3C)cc2c1 | 0.634225 |
O=C(NCCc1nc2c(c(C(F)(F)F)n1)CCCC2)c1cc(=O)c2ccccc2o1 | COc1ccccc1[C@H]1C2=C(C[C@H](C)CC2=O)Nc2nc(C)nn21 | 0.745527 |
COc1ccc(-c2noc([C@@](C)(O)C3CC3)n2)nc1Br | CCCN1CCCC[C@H]1c1cnc(N2CCOCC2)cc1C | 0.548004 |
CCOc1ccc([N+](=O)[O-])cc1N[C@H]1CCN(c2cnn(C)c2)C1=O | Cn1c(SCc2csc(-c3ccc(F)cc3)n2)nnc1-c1ccc2c(c1)OCO2 | 0.591006 |
O=C(Cn1c(=O)n2nc(-c3ccccc3)nc2c2c3c(sc21)CCC3)c1ccc(Cl)cc1 | COc1cc2c3nc4n(c(=O)c3n(C)c2cc1OC)CCS4 | 0.800198 |
COCCNC(=O)c1cc(S(=O)(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)ccc1C | Cc1cnn(CCNCC(=O)N2CC[C@H](C)Sc3ccccc32)c1 | 0.539665 |
Cc1noc(C)c1C(=O)N1CC[C@@H](C(=O)NCCc2ccccc2)C1 | COC(=O)c1cc2cc(NC(=O)[C@@H]3CCCN(S(C)(=O)=O)C3)ccc2s1 | 0.503911 |
Nc1ccc(N2CCN(C(=O)c3ccccc3Cl)CC2)c(-n2cnnc2)c1 | C=C(C)CN1C(=O)[C@](O)(CC(=O)c2ccc3ccccc3c2)c2ccccc21 | 0.601042 |
Cc1ccc(-n2nnc(-c3nc(-c4ccc(Cl)cc4)no3)c2N)cc1C | Cc1cc(S(=O)(=O)N2CCCCCC2)c(C)n1S(=O)(=O)c1ccccc1 | 0.648205 |
CC(=O)c1cccc(NC(=O)c2nc(-c3ccccc3)oc2C)c1 | CO[C@@]1(c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c2C(=O)C1(O)O | 0.621762 |
Cc1oc(C2CC2)nc1C(=O)N[C@@H]1C[C@H](Cn2ccnc2)C[C@H]1O | COc1ccc(C)cc1NC(=O)N1CCN(c2cc(-n3cccn3)nc(C)n2)CC1 | 0.599791 |
Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)COc1ccccc1 | COc1ccc(-c2c(C)nn3c2ncc2c(=O)n(-c4ccccc4F)ccc23)cc1 | 0.610082 |
Cc1nc2c(C)cccn2c(=O)c1NC(=O)c1ccc([N+](=O)[O-])cc1 | O=C(c1cccc2c1OCCO2)N1CC2(C[C@@H](OCC3CC3)CS2)C1 | 0.592275 |
CCc1ccc(OCCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)cc1 | O=C(c1ccon1)N1CC[C@@H]2OCC(=O)N(c3ccccc3)C[C@H]2C1 | 0.511654 |
Cc1c([C@@H](C)NC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)oc2ccccc12 | O=C(CSc1cn(Cc2ccccc2Cl)c2ccccc12)NC[C@H]1CCCO1 | 0.594187 |
O=C(CCn1c(CO)nc2ccccc21)NCc1[nH]nc2ncccc12 | CCOc1ccccc1[C@@H]1CC(=O)NC(C)=C1C(=O)OCC1CCCCC1 | 0.61157 |
COc1cccc(NC(=O)N2CCCCC[C@H]2c2cccc(F)c2)c1 | CCn1nc(-c2ccc(C(=O)N3CCOCC3)cc2)nc1N(C)C | 0.516393 |
Cc1cc(N2CCC[C@@H](c3nc(N)n[nH]3)C2)nc(-c2ccccn2)n1 | CCOc1ccc(-c2cccc(NS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)c2)nn1 | 0.587738 |
COc1ccc(S(=O)(=O)NC[C@]2(N(C)C)CCC[C@H](C)C2)cc1OC | O=C(NCc1cccs1)c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc(F)cc1)N2 | 0.528067 |
CCc1ccc(CCC(=O)N(Cc2ccc(F)cc2)[C@H](CC)C(=O)NC)cc1 | COCCCN1C(=O)CC[C@H](C(=O)O)[C@H]1c1csc2ccccc12 | 0.529954 |
COc1cc2c(cc1OC)C1(CCN(Cc3cnc(N)nc3)CC1)OCC2 | CCS(=O)(=O)N1C[C@H](C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)Oc2ccccc21 | 0.646937 |
O=C(c1ccc2nc[nH]c2n1)N1CC[C@@](c2nc(-c3cccnc3)no2)(C(F)(F)F)C1 | COC(=O)c1ccoc1COC(=O)COc1ccc(Cl)cc1Br | 0.544606 |
Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N[C@@]3(C)CCS(=O)(=O)C3)c12 | Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NCc1nnc2ccccn12 | 0.681587 |
CN1CCN(c2ccc(-c3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)nn2)CC1 | Cc1ccc(NC(=O)Cn2c(=O)c(N3CCCCC3)nc3ccccc32)c(Cl)c1 | 0.565124 |
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CC[C@]2(C1)C(=O)Nc1ccccc12 | Cc1cc(C(=O)CSc2nnc(C3CC3)n2C)c(C)n1CCc1cccs1 | 0.710101 |
C=CCOc1ccc([C@@H]2CN(C)[C@]3(C(=O)Nc4ccccc43)[C@H]2[N+](=O)[O-])cc1OC | CCC[C@]1(O)C[C@@H](c2ccc(OC)cc2)N[C@H](c2ccc(OC)cc2)[C@@H]1C | 0.541877 |
Cc1occc1-c1nnc(SCC(=O)Nc2cccc3nsnc23)o1 | CCc1ccccc1NC(=O)[C@@H]1O[C@@H]2OC(C)(C)O[C@@H]2[C@H]2OC(C)(C)O[C@@H]21 | 0.589418 |
Cc1csc(C(=O)N2CC[C@H](Oc3cncc(N(C)C)n3)C2)c1 | Cc1ccccc1-c1noc(CN[C@H](Cn2cccn2)c2ccccc2)n1 | 0.521595 |
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1 | Cc1c(C(=O)Nc2ccccc2)sc2ncn(CC(=O)N3CCCC3)c(=O)c12 | 0.650456 |
CCN1C(=O)/C(=C2\SC(=S)N([C@H](C)C(=O)O)C2=O)c2ccccc21 | COC(=O)CCCCCNC(=O)CCc1c(C)nc2nc(SC)nn2c1C | 0.652568 |
O=C(NCc1[nH]nc2ncccc12)c1ccc2c(c1)CCO2 | Cc1c(NC(=O)CN(C)C[C@@H]2COc3ccccc3O2)cccc1[N+](=O)[O-] | 0.507567 |
Cc1cccc(Nc2ncnc3sc4c(c23)CCCC4)c1 | COc1cc(C)ccc1S(=O)(=O)N1CCC(O)(c2ccc(C)cn2)CC1 | 0.636837 |
C[C@@H](CC(=O)N1CCC[C@H]1Cn1cc(C(=O)O)nn1)c1ccc(F)cc1 | CC[C@H](C)NC(=O)[C@@H](C)N(Cc1ccccc1Cl)C(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 | 0.515323 |
O=C(COC(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1nc(-c2ccc(F)cc2)cs1 | CCCn1ncc([C@@H]2C[C@H]3CN(c4cccc(OC)c4)C(=O)[C@]34CCCN24)c1C | 0.650905 |
Cc1cc(-c2ccccc2)n(-c2nc3ccccc3s2)n1 | Cn1c(=O)c2c(ncn2CCCC(=O)Nc2sccc2C#N)n(C)c1=O | 0.636826 |
CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(Cl)c(S(=O)(=O)NC2CC2)c1 | Cc1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1S(=O)(=O)N1CCCCC1 | 0.608209 |
O=C(CSc1ncnc2c1cnn2-c1ccc(F)cc1)Nc1cccc(C(F)(F)F)c1 | CCc1ccccc1N(CC(=O)N[C@H](C)c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 | 0.592476 |
COc1cc2c(cc1OC)[C@@H](c1cc(C)no1)N(C(=O)CCC1CCCC1)CC2 | CCn1nccc1-c1cccc([C@H]2CCCN2C)n1 | 0.630322 |
CCOC(=O)c1sc(NC(=O)c2cnc3ccccn23)cc1C | Nc1cccc2cnn([C@@H]3CCCCO3)c12 | 0.546347 |
CN1CCN(C)[C@@H](CNC(=O)N(CCc2ccccc2)Cc2cccnc2)C1 | CCn1nc(C)c(CNC(=O)N(C2CC2)[C@H](C)c2ccco2)c1C | 0.503695 |
C[C@]1(O)CC2(CCN(C(=O)c3cccc(OCC(=O)O)c3)CC2)OC[C@@H]1n1ccc(O)nc1=O | CC[C@@H](C(=O)O)N(C(=O)OCC1c2ccccc2-c2ccccc21)C1CN(C(=O)OC(C)(C)C)C1 | 0.599362 |
CNC(=O)[C@H]1CN(S(=O)(=O)c2ccccc2)[C@@H]2CCO[C@H]12 | Cc1noc(-c2ccc(NC(=O)N(C)Cc3noc(C4CCC4)n3)cc2)n1 | 0.513455 |
CO[C@H](c1ccccc1F)[C@H](C)NC(=O)N[C@H](C)c1ccccn1 | COc1ccccc1[C@@H](C)N(C)Cc1nc(Cc2ccccc2Cl)no1 | 0.507092 |
COc1ccc(NS(=O)(=O)c2cccc(C(=O)NCc3csc(-c4ccccc4)n3)c2)cc1 | COC(=O)COc1ccc(/C=C2/C(=O)N(c3ccc(Cl)cc3)C(=S)N=C2O)cc1OC | 0.611285 |
O=C(Cn1c(=O)[nH]c2ccccc21)NCc1nn(-c2ccccc2)c2c1CCC2 | Cc1nn(C(C)C)c(C)c1CN1CCN(C2CCCC2)[C@@H](CCO)C1 | 0.556257 |
CCCOC(=O)c1c(NC(=O)Cc2ccc(OC)cc2)sc2c1CCCC2 | COCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cc(Cl)cc2c1OCC2 | 0.742944 |
Cc1nc(N2CC[C@@H](NC(=O)c3ccccc3)[C@H](O)C2)nc2c1CCCC2 | CC(C)c1ccc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)cc1 | 0.547297 |
COc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)C(=O)NC2=S)cc1 | CN1N=C(N)c2cn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C]3O)c3ncnc1c23 | 0.699605 |
O=c1[nH]nc(CCc2ccccc2O)n1C1CCCCC1 | COCc1c(C(=O)N2C[C@@H](OC)C[C@H]2C(N)=O)oc2ccccc12 | 0.502123 |
Cn1nc(-c2ccccc2)c2c1CCN(C(=O)CCCc1cn[nH]c1)CC2 | Cc1cc(-c2nnc(S)n2/N=C/c2cccc(F)c2)[nH]n1 | 0.548634 |
COC(=O)c1ccc(Cl)cc1NC(=O)c1cc(Br)ccc1-n1cnnn1 | COc1ccc(C2=NO[C@H](C(=O)Nc3ccc4c(c3)OCCO4)C2)c(OC)c1 | 0.601064 |
Cn1ccnc1[C@H](NC(=O)CCNS(=O)(=O)c1ccc2c(c1)CCCC2)c1ccc(Cl)cc1 | Cc1ccc(CNc2nc(NCc3ccccc3)c3cnn(C)c3n2)cc1 | 0.537099 |
O=C(CN[C@H]1CCc2ncnn2C1)N1CCc2ccccc21 | N#Cc1ccc(S(=O)(=O)N2CC3(CC(=O)N(Cc4ccccc4)O3)C2)cc1 | 0.566058 |
Cc1cc(C(F)(F)F)c2c(C3CC3)noc2n1 | CCn1cnc2c1CCN(c1cc(=N)[nH]c3cc(Br)ccc13)C2 | 0.609278 |
CC[C@@]1(c2ccccn2)NC(=O)NC1=O | O=S1(=O)C[C@H](NCCc2cccs2)[C@@H](S(=O)(=O)c2cccs2)C1 | 0.588424 |
O=C(Nn1cnc2ccccc21)c1ccc(Br)cc1Cl | O=C1NCc2ccc(NCc3nn(-c4ccccc4)c4c3CCC4)cc21 | 0.520263 |
COc1ccc2c(C)c(CCC(=O)NCc3cccc(Cl)c3)c(=O)oc2c1 | C[C@@H]1Cc2ccccc2N1C(=O)[C@@]1(F)CCNC1 | 0.562092 |
CC(C)(C#N)C(=O)N1Cc2cc3c(cc2C2(CCCC2)C1)OCCO3 | Cc1ccc(NC(=O)c2ccc(Cl)cc2)cc1OCc1cc(=O)n2ccccc2n1 | 0.567861 |
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c1ccc(OC)cc1 | Cc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(C(=O)Nc4c(Cl)cccc42)N2CCC[C@@H]32)cc1 | 0.511375 |
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