p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
Cc1cccc(C(=O)Nc2nc(C)c(C(=O)Nc3ccc4c(c3)CCC4)s2)c1 | CCn1cc(-c2cc(NCC3(c4cccc(F)c4)CCOCC3)nc(C)n2)cn1 | 0.596567 |
OC1(Cc2cc(-c3ccccc3)no2)CCN(Cc2ccc([C@H]3CCCCO3)o2)CC1 | CC(=O)N1C[C@H](C(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)Oc2ccccc21 | 0.641372 |
CC1(C)CCc2c(c(Cl)cc3c4c(c(=O)oc23)CCCC4)O1 | C[C@H](OC(=O)c1n[nH]c2ccccc12)C(=O)c1ccc(F)cc1 | 0.546695 |
CC(C)N(C)C(=O)c1ccc(-n2cncn2)nc1 | CN(Cc1cc(-c2ccccn2)no1)C(=O)[C@H]1[C@@H]2C=C[C@@]3(CN(C4CCCC4)C(=O)[C@@H]13)O2 | 0.512397 |
CCc1nc(-c2ccc(C(=O)N3CCCN(S(C)(=O)=O)CC3)cc2)n[nH]1 | O=C(Nc1nc2c(s1)CCCC2)[C@@H]1Cc2ccccc2S1 | 0.530878 |
N#CCCN(C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)c1ccccc1 | COc1cccc2c1CCc1sc(N)nc1-2 | 0.512514 |
COc1ccc([C@@H]2CC(=O)c3cc(C(=O)O)c(=O)[nH]c3C2)cc1 | Cc1onc(-c2ccccc2Cl)c1C(=O)/N=c1\sccn1C | 0.634576 |
CCOC(=O)C1=C(C)NC2=C(C(=O)CCC2)[C@@H]1c1ccc(Cl)cc1Cl | CCCNC(=O)CN(CCC)C(=O)[C@H](c1cnn(C)c1)N(C)C(=O)OC(C)(C)C | 0.572165 |
N#CCC[C@@H](C#N)CSc1nnc(N2CCOCC2)n1C1CC1 | COCCn1c(SCC(=O)Nc2ccc(C)c(F)c2)nc2ncccc2c1=O | 0.547901 |
COC(=O)C1=CN(Cc2cccs2)C=C(C(=O)OC)C1c1cccs1 | CCCc1nc(SCC(=O)Nc2cccc(F)c2)c2c(=O)n(C)c(=O)n(C)c2n1 | 0.5842 |
O=C(CSc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1)Nc1cccc(C(F)(F)F)c1 | Cn1nnnc1Sc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)c1ccc(Cl)s1 | 0.556054 |
CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NC(C)(C)C)c1 | Cn1c(COc2cccnc2[N+](=O)[O-])cc(=O)n(C)c1=O | 0.533769 |
CC[C@H](C)C(=O)/N=C1/S[C@@H]2CS(=O)(=O)C[C@H]2N1c1c(C)cccc1C | COC(=O)CCNC(=O)c1nn(CC2CC2)c2c1CN(Cc1ccc(-c3ccccc3Cl)o1)CC2 | 0.769076 |
Cc1ccc(N([C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)S(C)(=O)=O)cc1C | CC(C)CCN1CC(=O)N(c2ccc(C(C)C)cc2)[C@@H]2CS(=O)(=O)C[C@@H]21 | 0.592062 |
O=C1NCCC[C@@H]1C(=O)N[C@@H]1C[C@]12CCCc1ccccc12 | O=C(NC1CCN([C@@H]2CC(=O)N(CCc3ccccc3)C2=O)CC1)c1ccc(F)cc1 | 0.503741 |
CCN1C(=O)C(C)(C)COc2cc(NC(=O)Nc3cccc(C)c3)ccc21 | CCOC(=O)c1sc(NC(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)c(C(=O)OCC)c1C | 0.563501 |
CCn1c(-c2ccncc2)nn(CN2CCC([C@H](C)O)CC2)c1=S | C[C@@H](NC(=O)N1CCCNC(=O)C1)c1nc(-c2ccncc2)no1 | 0.527313 |
CN(C)CCN1C[C@H]2N(C(=O)c3cccc(C#N)c3)CC[C@]2(c2ccccc2)CCC1=O | CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O | 0.704801 |
CCc1nn(C[C@H](O)c2ccc(F)cc2)c(=O)c(C#N)c1CC | COC(=O)C1=C(C)NC2=C(C(=O)[C@@H](C(=O)OC)[C@@H](c3cccs3)C2)[C@H]1c1ccc(SC)cc1 | 0.707921 |
COc1ccc(Br)cc1C(=O)CCC(=O)OCC(=O)Nc1nc(C)c(C)s1 | Cc1ccc(C)c(CN2C(=O)[C@@](O)(CC(=O)c3ccccc3O)c3ccccc32)c1 | 0.643443 |
O=C(c1ccc(O)cn1)N1CCC[C@@H](N2CCN(c3cccc(Cl)c3)CC2)C1 | Cn1c(=O)c2c(ncn2[C@@H]2COC3(CCN(C(=O)[C@@H]4CCCNC4)CC3)C[C@@]2(C)O)n(C)c1=O | 0.58635 |
O=C(NCc1noc([C@@H]2CCC(=O)N2Cc2ccc(OC(F)(F)F)cc2)n1)C1CCOCC1 | O=C1Nc2ccccc2CC[C@H]1N1CCC2(CCC2)S(=O)(=O)CC1 | 0.588298 |
COc1ccc([C@@H]2C[C@H](c3ccccc3)n3nc(N4C(=O)[C@@H]5CC=CC[C@H]5C4=O)nc3N2)cc1 | Cc1csc(=O)n1CCCC(=O)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21 | 0.7332 |
Cc1cc(C=NN2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C2)c(C)n1-c1cccc2ccccc12 | CC(=O)NN1C(=O)/C(=C2\C(=O)N(C)c3ccccc32)SC1=S | 0.689899 |
COC(=O)c1c(NC(=O)Cc2ccc3c(c2)OCO3)sc2c1CC[C@@H](C)C2 | CSc1ccccc1C(=O)N[C@@H]1CC(=O)N(CCCc2ccccc2)C1 | 0.50053 |
Cc1nc2n(n1)CCC[C@H]2NC(=O)C1(c2cccc(C#N)c2)CC1 | CC1=NNC(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1cc2ccccc2o1 | 0.684422 |
CCN(C(=O)c1nn(-c2cccc(C(F)(F)F)c2)cc1OC)C1CCCC1 | COc1ncccc1C(=O)Nc1ccc2nn(C)nc2c1 | 0.557395 |
CCOC(=O)c1cccc(N2CCN(C(=O)OC(C)(C)C)CC2)n1 | Cc1cccc(Oc2nccnc2[C@H]2CCCN(C(=O)c3ccccc3Cn3cccn3)C2)c1 | 0.529475 |
CCCCn1nc(C(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)ccc1=O | Cc1nc2c(s1)[C@@H](N[C@H]1CCCN(C)C1)CCC2 | 0.574446 |
CS(=O)(=O)c1cccc(NC(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)c1 | O=C(NCc1cc[nH]n1)[C@@H]1CCCN1S(=O)(=O)c1cccs1 | 0.512 |
C[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)O1 | CCOc1cc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)c(C)cc1OC | 0.554455 |
COc1cc(Cn2cnc3cc(F)ccc3c2=O)ccc1OC(F)F | CCCc1ncc(-c2ccncc2C)c([C@@H]2CCCN2C(=O)c2c(C)c(CC)nn2C)n1 | 0.602851 |
C[C@H]1CN(C(=O)c2cccc(F)c2C#N)c2cccnc2O1 | C[C@H](C(=O)Nc1ccc(F)c(F)c1)N1CCN([C@@H](C)c2nc(-c3ccc(Cl)cc3)no2)CC1 | 0.606157 |
CC[C@H](NC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1)c1noc(C)n1 | COc1ccc2[nH]c3c(c2c1)CCC[C@@H]3NC(=O)Cc1ccc2c(c1)OCCCO2 | 0.589608 |
COc1cc(C)cnc1C(=O)N1CCOC[C@H]1c1c(C)n[nH]c1C | Cc1cc(C)cc(O[C@H](C)C(=O)N[C@@H]2CCCc3ccccc32)c1 | 0.53532 |
Cc1cc(NC(=O)NC[C@@H]2CCC3(CCC3)CO2)cnc1C(F)F | Cc1nn(C)c(Cl)c1S(=O)(=O)NC[C@H]1CCn2ccnc2C1 | 0.50933 |
CNC(=O)[C@H]1CCCC[C@@H]1NCc1cc2ccccc2nc1OC | CCOC(=O)C1=C(c2ccccc2)NC(=O)N[C@@H]1c1ccc(-c2ccc(C(=O)O)c(Cl)c2)o1 | 0.580711 |
COc1cccc(CN2CCNC(=O)[C@H]2CC(=O)NCCc2nc(C)c(C)s2)c1OC | O=C(CN1CCC(c2ccccc2)CC1)NCc1n[nH]c2c1CCCCC2 | 0.523973 |
CCN1c2ncccc2C(=O)NC12CCN(Cc1cccn1C)CC2 | Cc1ccccc1[C@@H](NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1)c1ccccc1 | 0.536201 |
CC(C)(C)CC(=O)[C@@H](C#N)c1nnc2n1CCCCC2 | CCn1ccc(C(=O)N2CCC[C@]3(CCc4cnc(C)nc43)C2)cc1=O | 0.527897 |
Cc1c(Cl)cccc1S(=O)(=O)N1CCO[C@]2(CNCCOC2)C1 | C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)Nc2ncc(Cc3ccccc3)s2)C1=O | 0.606472 |
Cc1nc(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)cs1 | COc1ccc(CC(=O)Nc2cnc3c(c2)c(C)nn3C)c(OC)c1OC | 0.51844 |
CC(=O)Nc1ccc2c(COC(=O)c3cccc([N+](=O)[O-])c3C)cc(=O)oc2c1 | O=c1c(C(F)(F)F)cc(-c2ccccc2)nn1C[C@H](O)COc1ccc(Br)cc1 | 0.576596 |
COc1cccc([C@@H](CNC(=O)[C@@H]2COc3ccccc3O2)c2c[nH]c3ccccc23)c1OC | CS[C@@H](C)C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1=O | 0.508143 |
CCOc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCc3ccco3)C2)cc1Cl | COc1cccc(C[C@H]2[C@H]3C[C@H](CN(C(=O)c4cnc(C)[nH]4)C3)c3cccc(=O)n32)c1 | 0.669371 |
CCCCN1C[C@H](C(=O)Nc2ccc(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2)CC1=O | Cc1c(C)c(C)c(S(=O)(=O)N2CCN(C(=O)C[C@H](c3ccc(O)cc3)C3CC3)CC2)c(C)c1C | 0.544937 |
O=C(Nc1ccc(N2CCOCC2)cc1)[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1 | CC1(C)C[C@H]2C[C@](C)(CN2[C@H](C(=O)O)c2c[nH]c3cc(Br)ccc23)C1 | 0.599581 |
CCc1c(C(=O)Nc2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3)oc2ccccc12 | COc1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1C#N | 0.579111 |
COCCOCCCNc1ccc2nnc(C(F)(F)F)n2n1 | CC(C)C[C@@H](C(=O)NCc1ccc(-n2cncn2)nc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O | 0.540659 |
CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2cn(CC(N)=O)c3ccccc23)C1=O | COc1ccc(C)cc1NC(=O)N1CCC[C@H]1c1cc(C(C)C)on1 | 0.70679 |
Cc1cncc(/C(O)=N/S(=O)(=O)c2cc(C)oc2C)c1 | CCC(C)(C)n1nnnc1[C@H](c1cccc(OC)c1OC)N1CCN(c2ccc(F)cc2)CC1 | 0.549578 |
O=C(N[C@@H](c1ccccn1)C(F)(F)F)c1nnc(O)c2ccccc12 | O=C1c2ccccc2-c2c1c1ccccc1n2S(=O)(=O)c1ccccc1 | 0.67003 |
c1ccc(CN2CCO[C@@H]3[C@H](Cn4ccnc4)CC[C@H]32)nc1 | Nn1c(SCC(=O)NCCc2c[nH]c3ccccc23)nnc1-c1ccco1 | 0.527174 |
Cc1c(C(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)cnn1-c1ccccc1F | CC(C)N(C)C(=O)[C@H]1CCc2[nH]nc(C(F)(F)F)c2C1 | 0.538382 |
Cc1c(Br)ccc(NC(=O)COC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)c1C | CC[C@@H](Sc1nnc(N)s1)C(=O)N[C@@H](CSCc1ccccc1)C(=O)OC | 0.516018 |
C[C@H](NS(=O)(=O)c1c(Cl)nc2ccccn12)c1ccc(Cl)cn1 | C[C@H]1C[C@H](N)CCN1C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 | 0.523344 |
Cc1sc2nc(CCNCc3cc(C#N)n(C)c3C)nc(O)c2c1C | O=C(CCn1ccnn1)N[C@@H]1C[C@H](C(=O)O)c2ccccc21 | 0.587987 |
CC(C)CC(=O)Nc1ccc(OCC(=O)O)c(-c2nc3ccccc3s2)c1 | COc1cc(N2CC[C@]3(O)CCN(S(=O)(=O)N(C)C)C[C@@H]3C2)ncn1 | 0.533188 |
C[C@H](c1ccncn1)N(C)C(=O)c1cc(Cl)ccc1OCCN | C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F | 0.545147 |
COc1cc2nc(N3CCC(CN4CCN(C)CC4)CC3)cc(C)c2cc1OC | COc1cccc(C(=O)N2CCCN(CCc3nccn3C)CC2)c1C | 0.500582 |
CC(C)Cc1n[nH]c(/N=C(\O)C[C@@H]2NC(=O)c3ccccc3N=C2O)n1 | CC[C@H](NC(=O)CN(c1cccc(C)c1)S(=O)(=O)c1ccccc1)c1ccccc1 | 0.55688 |
Cc1c(NC(=O)N2CCC[C@H](COc3ccccc3)C2)c(C(F)F)nn1C | COc1ccc(C(C)(C)C)cc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Cl | 0.529345 |
CCCN1C(=O)/C(=C2\SC(N3CCOCC3)=NC2=O)c2ccccc21 | Cc1cc(-c2csc(N)n2)c(C)n1C[C@@H]1COc2ccccc2O1 | 0.708963 |
Cc1cc(C[C@@H]2CN(C(=O)c3cn(C)c4ccccc34)C[C@@H]2O)n[nH]1 | CCOC(=O)N1N(C)P(=O)(Oc2ccccc2)N(C)N(C(=O)OCC)S1=O | 0.658084 |
Cc1nc2ccc(Cl)cc2cc1C(=O)NCCc1cccs1 | O=C(OCc1cn2ccccc2n1)c1cc(-c2ccco2)nc2ccccc12 | 0.54495 |
COCc1nc2cccnc2n1C1CCN([C@@H](C)CCc2ccc(O)cc2)CC1 | O=C1CCCN1c1cccc(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2)c1 | 0.547027 |
COc1ccc2nc(CNC(=O)[C@@H]3CCCCn4nnnc43)[nH]c2c1 | CCc1ccc([C@@H](CNS(=O)(=O)c2cc(N3C(=O)CCS3(=O)=O)ccc2C)N(C)C)cc1 | 0.618947 |
COc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccccc2)cc1CN1CCOCC1 | C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1cc(-c2cccnc2)nc2ccccc12 | 0.615784 |
Cc1csc(C(=O)N2C[C@@H]3C[C@H]2C(=O)O3)c1 | Cc1noc(C)c1CN1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1 | 0.50056 |
CCCOc1cccc([C@@H]2/C(=C(\O)c3ccc(C)cc3)C(=O)C(=O)N2CCN(CC)CC)c1 | COCCN(Cc1cnn(C)c1)C(=O)c1c(Cl)cnn1C | 0.569055 |
COC(=O)C[C@@H](c1cccc(O)c1)c1oc(CN2CCc3cc(OC)c(OC)cc3C2)cc(=O)c1O | CCc1cc(=O)oc2cc(OCC(=O)NCCC(=O)O)ccc12 | 0.53838 |
O=C(COC(=O)c1c(Cl)nc2sccn12)Nc1nc(-c2ccc(F)cc2)cs1 | CCOC(=O)c1csc(NC(=O)C[C@@H]2NC(=O)N(CCc3ccccc3)C2=O)n1 | 0.671941 |
CN(C)c1cc([C@@H]2CC(=O)N(c3ccc(F)cc3)C2)nc(CN(C)C2CCCCC2)n1 | Cc1ncc(-c2cc(C(=O)N(C)Cc3csc(C)n3)c3ccc(F)cc3n2)cn1 | 0.651992 |
Cc1nc(-c2ccccn2)sc1C(=O)N1CCC[C@H]1c1ccc(F)cc1 | Cc1ccc([C@H](C)C(=O)N2CC[C@@H](c3nn(CCN)c4ncccc34)C2)cc1 | 0.697154 |
CN(C)c1ccc(C(=O)N[C@H](Cc2ccc(Br)cc2)C(=O)O)nn1 | CN(C)c1ccc([C@@H](CNC(=O)CCCn2c(=O)oc3ccccc32)c2c[nH]c3ccccc23)cc1 | 0.515086 |
Cc1cc(F)ccc1S(=O)(=O)NCC(=O)N(C)[C@@H](C)c1ccncn1 | CC(C)c1nc2ccccc2n1CC(=O)N1CCC[C@H](C2(O)CC2)C1 | 0.50168 |
N#CCCN(C(=O)CSc1ncc(C(=O)O)n1-c1ccc(F)cc1)c1ccccc1F | COc1cc([C@@H](CC(=O)NC2CCN(Cc3ccccc3)CC2)c2oc(C)cc(=O)c2O)ccc1O | 0.669405 |
Cc1cc(-c2ncc(C)s2)nc([C@@H]2CCCCN2C(C)C)n1 | Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)N(Cc2nccn2C)C3)ccc1F | 0.560789 |
C[C@H]1CCCN(c2nc3c(c(=O)[nH]2)CN(C(=O)C2=NNC(=O)CC2)CC3)C1 | COC(=O)Cn1c(-c2ccc(C)cc2)cnc1SCC(=O)N1CCc2ccccc21 | 0.684584 |
CN(C)C(=O)N1CCn2nc(CNc3nc(-c4ccccc4)no3)cc2C1 | CC(=O)Nc1ccc(CNC(=O)c2cnc3ccnn3c2C)cc1 | 0.569742 |
Cc1ccc(N(CC(=O)N[C@@H](C)CCc2ccccc2)S(=O)(=O)c2ccccc2)cc1 | Cc1ccc(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)cc1S(C)(=O)=O | 0.515777 |
CS(=O)(=O)N1C[C@]2(CCNC2)c2ncccc21 | CCOc1ccc(S(=O)(=O)NCC2CCN(c3ccccn3)CC2)cc1F | 0.570811 |
CC(C)c1cc(C(F)(F)F)c2c([C@@H]3CCCN(C(=O)[C@@H]4C[C@H]4C)C3)noc2n1 | Cc1cn(-c2ccccc2)nc1NC(=O)c1coc(Br)c1 | 0.598318 |
COc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NC(C)C)C2)cc1C | COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2-c1cccc(OC)c1 | 0.546218 |
COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)CCn2cccn2)cc1 | O=S(=O)(Nc1cc(C(F)(F)F)ccc1N1CCOCC1)c1cnc2n1CCC2 | 0.603158 |
C[C@H]1CN(C(=O)c2n[nH]c3ccccc3c2=O)C[C@H](C)N1 | C=CC(=O)Nc1cccc(C(=O)N2CCC[C@@H](n3ccc(C(F)(F)F)n3)C2)c1 | 0.550114 |
CCOc1ccc(NC(=O)C2CCN(c3ccc4nncn4n3)CC2)cc1OCC | C[C@@H](C(=O)Nc1ccc(O)c(C(=O)O)c1)N1CCc2ccccc2C1 | 0.534025 |
CCc1ccc2oc(=O)cc(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 | Cc1cccc(C[C@H](CO)NC(=O)c2nc(C)n(-c3n[nH]c(C(F)(F)F)n3)n2)c1 | 0.654004 |
O=C(O)[C@@H]1CCCN(C(=O)Nc2ccc(F)cc2-c2nc(C3CC3)no2)C1 | CCc1nccn1CCC(=O)N1CC[C@]2(CCCN(CC3CC3)C2=O)C1 | 0.520857 |
CCn1/c(=N/C(=O)c2cccc(F)c2)sc2c(OC)ccc(OC)c21 | O=C1N[C@@]2(CCc3ccccc32)C(=O)N1CC(=O)N(Cc1ccccc1F)C1CC1 | 0.767302 |
Cc1c[nH]ccc1=NCCNC(=O)[C@H]1OCC(=O)N(C2CC2)[C@@H]1c1cccnc1 | C[C@@H]1c2cccn2CCN1CCc1ccncc1 | 0.50275 |
Cn1c(=O)sc2cc(S(=O)(=O)NCc3nc(-c4ccc(Cl)cc4)no3)ccc21 | C[C@@H](CN1CCc2ccccc2C1)NC(=O)c1nc(Cl)n(C)n1 | 0.525296 |
COc1ccc(C(=O)NCCc2ccc(-c3csc(C)n3)s2)c(OC)c1 | CCOc1ccc(-c2nonc2NC(=O)Cc2ccc(Cl)cc2)cc1C | 0.538631 |
CCCCc1ccc(N2CC[C@@H](CN)S2(=O)=O)cc1 | CCOc1cc([C@@H]2C(C(=O)OC)=C(N)OC3=C2C(=O)CCC3)cc(I)c1OC | 0.525667 |
CC[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cn(C)c(=O)c2ccccc12 | CN(C)C(=O)Cc1nc(CN2CCCC[C@H]2Cn2cncn2)cs1 | 0.518354 |
CCn1nnc2cc(C(=O)OCc3c(F)cccc3Cl)ccc21 | N=C1S/C(=C\c2ccc(O)cc2O)C(=O)[C@@H]1c1nccs1 | 0.545958 |
COc1ccc(C)cc1CN(C)C(=O)Nc1cc(C)on1 | O=C(c1ccc(F)cc1)[C@@H]1[C@H](c2ccc(Cl)cc2)c2sc(=O)[nH]c2S[C@H]1C(=O)O | 0.501033 |
CCCCCNC(=O)CN(c1cc(Cl)ccc1OC)S(=O)(=O)c1ccc(C)cc1 | Cn1cc[nH]c(=NC[C@@H]2CCCO[C@H]2c2cc[nH]n2)c1=O | 0.57265 |
O=C([C@@H]1[C@@H]2C=C[C@@]3(CN(C4CCCCCC4)C(=O)[C@@H]13)O2)N1C[C@@H]2[C@H](C1)[C@H]1CC[C@@H]2O1 | CS(=O)(=O)Nc1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)ccc1F | 0.594049 |
COc1c(C(=O)NC(=S)Nc2nnn(CC(C)C)n2)cc2ccccc2c1Br | Cc1nn(CC(=O)O)c(C)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1 | 0.515017 |
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