p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CCCCCCCC(=O)N1[C@H]2C[C@@H]3CC[C@]2(CS1(=O)=O)C3(C)C | CN(C)C(=O)COC(=O)c1ccccc1-c1nc2ccccc2s1 | 0.521081 |
COCCNC(=O)c1sc2ncccc2c1[C@@H]1CN(C(=O)c2c[nH]nc2C)CCO1 | CCOC(=O)[C@@H]1[C@@H](c2ccc(OC(F)F)cc2)NC(=O)N[C@@]1(O)C(F)(F)F | 0.7667 |
CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cccn1Cc1ccco1 | COc1ccc(S(=O)(=O)NC2CC2)cc1NS(=O)(=O)c1cnc(-c2ccccc2)s1 | 0.639511 |
Cc1cc(OCC(=O)Nc2ccc(F)cc2Cl)c2c3c(c(=O)oc2c1)CCC3 | COc1ccc(NC(=O)CCn2cnc3scc(-c4ccc(C)cc4)c3c2=O)cn1 | 0.71501 |
COc1ccccc1-c1cc(C(F)(F)F)n2ncc(C(=O)N3CCC[C@H]3c3cc(C)no3)c2n1 | O=C(Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)c1cccnc1O | 0.560682 |
COc1ccc(CC(=O)N2CCc3nn4ccc(N5CCCC5)nc4c3C2)cc1F | Cc1cc2cc3c(cc2nc1SCC(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1)OCCO3 | 0.695786 |
Cc1ccc2oc(C(=O)N3CCO[C@@H]4COCC[C@@H]43)cc2n1 | CCn1c(Cc2cccnc2)nnc1N(C)[C@H]1CCc2ccccc21 | 0.667345 |
CCOC(=O)CCc1c(C)c2cc(Cl)c(OCC(=O)OC(C)(C)C)cc2oc1=O | O=C(C[C@@H]1CCOC1)NCc1cc(-c2ccccc2F)no1 | 0.518112 |
Cc1ccc([C@]23C[C@@H]2CN(C(=O)NCCc2ccn(C(C)C)n2)C3)cc1 | O=C1C[C@@H](N2CCN(Cc3ccc4c(c3)OCO4)CC2)C(=O)N1c1cccc(Cl)c1 | 0.536773 |
Cc1ccc(S(=O)(=O)N[C@@H](CC(=O)Nc2ccc(C)c(C)c2)c2ccccc2)cc1 | NC(=O)c1c(NC(=O)COC(=O)c2cc(Cl)c3c(c2)OCO3)sc2c1CCCC2 | 0.570248 |
COc1cccc(-c2nnn(Cc3nc(-c4ccc(Cl)cc4)no3)n2)c1 | CC(=O)N[C@@]1(C2(C)OCCO2)CCc2c(O)c3c(c(O)c2C1)C(=O)c1ccccc1C3=O | 0.573922 |
Cc1nc2ccc(Br)cc2c(=O)n1N=Cc1c(C)n(CC#N)c2ccccc12 | COc1ccc([C@@H]2C3=C(CCCC3=O)Nc3nc(-c4cc(OC)c(OC)c(OC)c4)nn32)cc1 | 0.788746 |
C=CC(=O)N1CCC(C(=O)N[C@H](C)c2ccc(OC)cc2)(c2ccccc2)CC1 | CCOc1ccc(CC(=O)Nc2ccc3nc(C)n(-c4ccc(F)cc4)c(=O)c3c2)cc1 | 0.537378 |
CC(C)n1cnc([C@@H]2CN(C)C[C@@]23CCN(Cc2cccnc2)C3=O)c1 | C[C@@H](NC(=O)c1sc2cccc(F)c2c1Cl)c1ccncn1 | 0.642857 |
CSc1cnc2ccccc2c1N1CC[C@H](CO)[C@@H](O)C1 | CCN(CC)S(=O)(=O)c1ccc(S[C@@H](C)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)nc1 | 0.594173 |
C=CCN1C[C@@]2(C(=O)O)CN(Cc3cccc(-c4ccco4)c3)C[C@H]2C1=O | O=c1c2c3c(sc2ncn1/N=C/c1ccccc1)CCCC3 | 0.573822 |
COC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1C | COc1ccc(Cc2nnc(S[C@@H](C)C(=O)Nc3ccc4c(c3)OCO4)n2C)cc1 | 0.550976 |
COc1cc(NC(=O)N2CCn3cccc3[C@@H]2c2ccc(F)c(F)c2)cc(OC)c1OC | CCOC(=O)[C@@H](NC(C)=O)[C@H](O)c1cccc(N)c1 | 0.502174 |
CN(C(=O)Cc1coc2cc3c(cc12)CCC3)c1cnccn1 | CCCn1cnc2cc(NC(=O)c3cc(OC)c(OC)c(OC)c3)ccc21 | 0.527716 |
Cc1cc(C)cc(NC(=O)N2CCN(c3cc(C)nc(N4CCOCC4)n3)CC2)c1 | Cc1oc2ccc(O)c(CN3CCC(C)CC3)c2c1C(=O)NC1CCCC1 | 0.541353 |
CCN(CC)c1ccc(Nc2cc3n(c(=O)n2)CCc2cc(OC)c(OC)cc2-3)cc1 | CCOc1c(Cl)cc(/C=N/Nc2ncccc2[N+](=O)[O-])cc1Cl | 0.559322 |
CCC(=O)N1CCc2c(nc([C@@H]3CCCCN3C(=O)c3cccs3)[nH]c2=O)C1 | CN(Cc1csc(C23CC4CC(CC(C4)C2)C3)n1)[C@H]1CS(=O)(=O)C[C@@H]1O | 0.624738 |
O=C1CN(C(=O)COc2ccc3c4c(c(=O)oc3c2)CCCCC4)CCN1 | CSc1ccccc1NC(=O)CN(C)CC(=O)N1CCc2ccccc2C1 | 0.534169 |
CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2c2nc(N)ncc2-c2ccc(F)cc2)cc1 | Cc1nn(-c2ccc(O)nn2)c2c1[C@@H](c1cc(Cl)ccc1F)CC(O)=N2 | 0.768924 |
CCCN1C(=O)/C(=C\c2ccc(OC)cc2)C(=O)N(c2ccccc2)C1=S | CC(C)[C@@H]1C(=O)NCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 | 0.603412 |
c1cncc(-c2cc(CN3CCN(C4CCSCC4)CC3)on2)c1 | N#Cc1c(-c2ccco2)nc2n(c1=O)CN(c1ccc(Cl)cc1)CS2 | 0.509336 |
COc1cccc([C@H]2c3[nH]c4ccccc4c3CCN2C(=O)CN(C)Cc2cccnc2)c1 | O=S(=O)(Nc1ccccc1-c1cccs1)c1c[nH]c2ncccc12 | 0.620654 |
Cc1occc1C(=O)N1CCC(N2CCC[C@@H](C(=O)NCc3ccccn3)C2)CC1 | Cc1ccc(NC(=S)N(C)Cc2cc3ccccc3n(C)c2=O)cc1 | 0.505251 |
CCSCCOC(=O)C1=C(C)NC2=C(C(=O)[C@H](C(=O)OC)[C@H](C)C2)[C@@H]1c1ccc2c(c1)OCO2 | O=C(Cn1cnc2ccccc21)N1[C@H]2CC[C@H]1CC(n1cccn1)C2 | 0.611955 |
COC(=O)[C@H]1C[C@@H]2CCCC[C@@H]2N1Cc1cc(=O)oc2cc(C)ccc12 | CC(=O)N1CCc2c(sc3nc(C)[nH]c(=O)c23)C1 | 0.629591 |
COc1ccc(OC)c(N(CC(=O)NCCCOC(C)C)S(C)(=O)=O)c1 | Cc1cc(C)n(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)n1 | 0.526432 |
CN(C)c1oc(-c2ccco2)nc1S(=O)(=O)c1ccc2c(c1)OCCO2 | Cc1nc2c(cnn2C(C)C)cc1C(=O)N[C@@]1(CNC(=O)OC(C)(C)C)CCCC[C@H]1C | 0.7001 |
Cc1ccc(OC[C@@H]2CO[C@@H]3CN(Cc4ccco4)C[C@H]23)cn1 | Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1N1CCN(C(=O)c2cn(C)nn2)CC1 | 0.565079 |
CC(C)[C@H](CNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)N1CCOCC1 | COc1ccc(C(=O)Nc2cccc(C(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1OC | 0.532058 |
CCOC(=O)c1c(NC(=O)c2cc(-c3ccc(C)cc3)on2)sc2c1CCC2 | Cn1cc(CN2CC(=O)N(C3CCCCC3)C[C@@H](OCc3ccccc3)C2)cn1 | 0.533951 |
O=S(=O)(c1ccccc1C(F)(F)F)N1CC[C@@H](O)C1 | COc1ccc(CNC(=O)C(=O)NC[C@H]2OCCN2S(=O)(=O)c2ccc(F)cc2)cc1 | 0.55198 |
CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(OCc3ccccc3)cc1)C(C(=O)OC)=C(C)N2 | C[C@H](NC(=O)c1ccc(COc2ccccc2[N+](=O)[O-])o1)c1ccccc1 | 0.601434 |
CCOc1ccccc1CNC(=O)[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1 | CC(C)(C)CN1C[C@]23C=C[C@H](O2)[C@H](C(=O)N2CCN(S(C)(=O)=O)CC2)[C@@H]3C1=O | 0.54505 |
COc1ccc(C(=O)O[C@@H]2C[C@@H](C)OC2=O)cc1S(=O)(=O)NC1CC1 | Cc1nc2scc(C)n2c(=O)c1S(=O)(=O)NCc1ccccc1Cl | 0.606438 |
COc1ccc(/C=N/N=C2/NC(=O)[C@@H](Cc3ccc(Cl)c(Cl)c3)S2)cc1OC | C[C@H]1CN(C(=O)CCc2nc3cc(S(=O)(=O)N(C)C)ccc3n2C)CCO1 | 0.521445 |
CC[C@@H]1OCCC[C@@H]1C(=O)NCc1nc2cc(OC)ccc2n1C | O=C(Cn1c(=O)c(F)cn([C@H]2CCCO2)c1=O)Nc1ccccc1Sc1ccc(Cl)cc1 | 0.572038 |
CN1C(=O)C[C@@H](CNC(=O)Nc2cnn(C)c2)[C@@H]1c1ccccc1 | O=C(Nc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 | 0.549041 |
CN1CCCN(c2ccc(-c3noc([C@H]4Cc5ccccc54)n3)cc2Cl)CC1 | COc1ccccc1N(CC(=O)NCc1ccccc1C)S(C)(=O)=O | 0.551913 |
COC(=O)c1ccc([C@H]2c3c(-c4ccccc4)nnc(O)c3Nc3nnnn32)cc1 | O=C(c1cc(-c2ccccc2)[nH]n1)N1CCN(S(=O)(=O)c2ccccc2F)CC1 | 0.677612 |
Cn1c(-c2ccccc2)nn(CCNC(=O)c2cc(=O)c3ccccc3o2)c1=O | O=C(O)CN(CCc1ccccc1)C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 | 0.55235 |
Cc1nc([C@@H]2CCCN2C(=O)c2cc3c(C)nn(C)c3s2)no1 | O=C(CCC(=O)N1CCN(C(=O)[C@@H]2COc3ccccc3O2)CC1)c1ccc2c(c1)OCCCO2 | 0.579651 |
Cc1cc(C)n2nc(C)c(C(=O)N3CC[C@H]([C@H](F)C(=O)O)C3)c2n1 | CC[C@H](C)N(CC(=O)O)C(=O)c1cccc(COc2ccc(C)nc2)c1 | 0.514317 |
COC(=O)c1c(NC(=O)C(F)(F)F)sc2c1CC[C@@H](C(C)(C)C)C2 | C[C@H]1CC(=O)c2cnc(Nc3ccccc3)nc2C1 | 0.554832 |
Cc1ccc(N(Cc2ccco2)C(=O)Cc2cn3ccsc3n2)cc1 | CNC(=O)c1cc(/N=C2\C=C(O)NC2)ccc1-n1cccn1 | 0.544768 |
O=C(NC[C@H]1CN(c2ccc(C(F)(F)F)cn2)[C@H]2CCN1C2)c1cc(Cl)c[nH]1 | COc1ccc(CN2C(=O)N(c3ccccc3)C(=O)[C@@H]2CC(=O)Nc2ccccc2)cc1 | 0.63714 |
COc1ccc(Cl)cc1NC(=O)Cn1nc2n(c(=O)c1=O)CCN2c1ccc(C)cc1 | CCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)cc1 | 0.576687 |
Cc1cccc(NC(=O)Cn2cnc3nc(N4CCC(C(=O)NC5CC5)CC4)sc3c2=O)c1C | OCc1cc2n(n1)CCCN(Cc1cccc3nonc13)C2 | 0.619147 |
O=C(NC1=NCCS1)c1ccccc1CSc1nc2ccccc2s1 | C[C@H](c1nc2c3cnn(C)c3ncn2n1)n1nc(C(F)(F)F)cc1C1CC1 | 0.621951 |
CCOC(=O)c1c(C)sc(Sc2ccccc2[N+](=O)[O-])c1OC(C)=O | O=C(N[C@@H]1CCN(Cc2ccccn2)C[C@H]1O)C1(N2CCCC2)CCCC1 | 0.541494 |
O=C1[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1/N=C/c1ccccc1 | O=C(N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)[C@@H]1CCCN(c2nc3ccccc3s2)C1 | 0.639958 |
C[C@@H]1CCC[C@H](C)[C@@]12NC(=O)N(Cc1cccc(OCC(F)(F)F)c1)C2=O | COc1cc2ncnc(N3CCC[C@H](C(=O)O)C3)c2cc1OC | 0.55837 |
CCn1c(SCc2cccc(C)c2)nc2c(c1=O)SCC2 | CCc1cc(C(F)(F)F)n2nc(C3CCN(C(=O)c4ccnc(N(C)C)c4)CC3)cc2n1 | 0.624099 |
CCOC(=O)C1=C(C)N=c2s/c(=C\c3ccccn3)c(=O)n2[C@@H]1c1ccccc1OC(C)C | O=C(Cn1ccc2ccc(F)cc21)N1CC[C@H](Oc2ccccc2F)[C@@H](O)CC1 | 0.626233 |
C[C@H](CCC(=O)N[C@H]1C[C@@H](C)n2ncnc21)c1ccccc1 | COc1ccc2c(c1)[C@@H](C)CC(C)(C)N2[C@@H](C)C(=O)O | 0.526198 |
O=C(Cc1csc2ccc(Cl)cc12)N=c1cc([C@@H]2CCCOC2)[nH][nH]1 | Cc1ccc(-c2nc(CS(=O)(=O)CC(=O)O)c(C)o2)cc1 | 0.504972 |
CN1CCN(C(=O)c2cnn3c(C(F)F)cc(C4CC4)nc23)CC1 | CCS(=O)(=O)c1ccc(N2CCC[C@@H](n3cccn3)C2)cc1 | 0.529158 |
NCCN1C(=O)CC[C@H]2CN(Cc3cccn3-c3nccs3)CC[C@H]21 | Cc1c(N(CC(=O)N[C@@H](C)c2ccc3c(c2)CCC3)S(C)(=O)=O)cccc1[N+](=O)[O-] | 0.558635 |
COc1ccc([C@@H]2[C@@H](N)C(=O)N2Cc2ccccc2)cc1OC | Cc1ccc([N+](=O)[O-])cc1NC(=O)Cn1nc(COc2ccccc2C)oc1=S | 0.516237 |
COCCn1ccc2c(NC(=O)CCc3ccccc3OC)cccc21 | CCn1nc(C)c2c(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)cc(C)nc21 | 0.567118 |
CC[C@@H](c1nnc(SCCN)n1-c1ccc(OC)cc1)N(C)C | Cc1cc(S(=O)(=O)NC(C)C)ccc1OCC(=O)N[C@@H]1CCCc2ccccc21 | 0.524324 |
CC(C)[S@](=O)c1ccc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)cc1 | CC(=O)N1CCCC[C@@H]2CN(C(=O)c3cnco3)CC[C@H]21 | 0.504988 |
CCOC(=O)C1=C(C)N=c2s/c(=C/c3cn(C)nc3C)c(=O)n2[C@H]1c1ccc(N(CC)CC)cc1 | COc1cc(/C=C2\S/C(=N/c3ccc(N4CCOCC4)cc3)N(C)C2=O)ccc1O[C@@H](C)C(=O)O | 0.724951 |
Cc1nc(S(=O)(=O)NCc2cc(O[C@H]3CCNC3)ccn2)cn1C | Cc1c(C(F)(F)F)nn(C)c1NC(=O)N1CCC[C@@H](CCC(=O)O)C1 | 0.533927 |
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(O[C@H](C)C(=O)OCC)cc1 | Cn1c2c(c(=O)n(C)c1=O)[C@H](c1cccc(Br)c1)[C@H]1C(=O)c3ccccc3C1=N2 | 0.728981 |
CSc1ccc(S(=O)(=O)NCCOc2ccc(C)c(Cl)c2)cc1C(=O)N1CCC(C)CC1 | Fc1cccc(C2(c3nc(C4CCCC4)no3)CCOCC2)c1 | 0.565027 |
COc1cc(OC)c(Nc2ncnc3sccc23)cc1Cl | CCc1cccc(NC(=O)Cn2c(=O)n(Cc3ccc(F)cc3)c(=O)c3sccc32)c1 | 0.611849 |
Cn1ccnc1[C@@H](NC(=O)CCCn1cc(C(C)(C)C(=O)O)nn1)c1ccccc1F | COc1ccc(N2C(=O)NC(=O)[C@H](C=Nc3ccc(C)cc3C)C2=O)cc1 | 0.571128 |
Cc1ccc2[nH]c(C)c(CC(=O)n3ncc(C#N)c3N)c2c1 | CC(C)c1noc([C@H](C)N2CCO[C@H](c3ccc(F)cc3)C2)n1 | 0.507151 |
O=C(CCN1C(=O)CCC1=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 | CC(C)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H]1N2C(=O)c3ccccc3[C@@H]2SC1(C)C | 0.541667 |
N#Cc1c(-c2ccccc2)nc(N2CCOCC2)c(C#N)c1N | CN1C(=O)[C@H](S(=O)(=O)c2ccc(C(C)(C)C)cc2)[C@H]2C[C@@]1(C)Oc1ccc(Br)cc12 | 0.7167 |
CC(C)c1nnc(N2C(=O)c3oc4ccccc4c(=O)c3[C@@H]2c2cccs2)s1 | C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)OC(=O)CCCNC1=NS(=O)(=O)c2ccccc21 | 0.71076 |
CC(C)c1ncsc1C(=O)NCc1nc2cccc(F)c2[nH]1 | C[C@@H]1CC(=O)C2=C(C1)Nc1nc(C(F)(F)F)nn1[C@H]2c1cccc(F)c1 | 0.593812 |
CN(C)c1ccc(C(=O)N2CC[C@@H](c3nccn3C)C2)cn1 | COc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2\SC(=O)NC2=O)c1C | 0.543408 |
Cc1cc(C(=O)n2c(C)c(C=O)c3ccccc32)ccc1[N+](=O)[O-] | Cc1ccc(OC2CCN(C(=O)Cn3cnc4c(cnn4C)c3=O)CC2)nc1 | 0.60666 |
Cc1ccc(C(=O)O)cc1NC(=O)c1cccnc1C(=O)O | CCc1cn[nH]c1[C@H]1CCCN(C(=O)c2conc2-c2ccccc2)C1 | 0.537217 |
C[C@@H](Sc1nnc(Cc2cccs2)n1C)C(=O)Nc1ccc(Br)cc1 | N[C@H]1CCc2ncc(NC(=O)Cc3coc4ccc(F)cc34)cc2C1 | 0.576799 |
Cn1c(N)c(C(=S)NC(=O)C2CCCC2)c(=O)n(C)c1=O | COC[C@@H](C)n1ccc(NC(=O)N2CCC[C@@H](C(=O)OC)C2)n1 | 0.534753 |
O=C(c1cnccn1)N1CCC2(CC[C@@H](C(=O)N3CCCC3)O2)CC1 | CCOC(=O)[C@@H]1C(=O)C2=C(C[C@H]1c1ccccc1)NC(=O)C[C@@H]2c1cccc(OC)c1 | 0.547445 |
O=C(c1cccnc1)N1CCN(c2c3c(nc4cc(C5CCOCC5)nn24)CCCC3)CC1 | Cc1noc(C)c1S(=O)(=O)Nc1ccc(-c2ccccc2)cc1 | 0.542973 |
CCCOc1ccc(C(=O)Nc2cc(S(=O)(=O)N3CCCCCC3)ccc2OC)cc1OCC | O=C1C[C@@H]2CCN(C3COC3)C[C@@H]2CCOc2ccc(-c3cccnc3)cc2N1 | 0.576967 |
COc1cc([C@H]2NN=C(c3ccccc3)S2)cc(Br)c1OCC(=O)O | Cn1c(=O)c(CCC(=O)N2CCC(O)(c3ccc(Cl)cc3)CC2)nc2ccccc21 | 0.538793 |
O=C(CCC1CCN(C(=O)c2cccc3c2C(=O)c2cc(Cl)ccc2-3)CC1)NC1CC1 | O=C(Nc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc2c(c1)OCCO2 | 0.591772 |
O=C(Nc1ccccc1)[C@H]1CCN1S(=O)(=O)c1ccc2c(c1)OCCO2 | O=C(CCCN1C(=O)/C(=C/c2cccc(F)c2)SC1=S)N[C@H]1C=CS(=O)(=O)C1 | 0.535484 |
COc1ccc(N2C[C@@H](c3nc(-c4ccccc4C)no3)CC2=O)cc1OC | O=C([C@@H]1CC(c2c(F)cccc2F)=NO1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 | 0.696502 |
Cc1nc2c([nH]1)CN(c1n[nH]c(=N)s1)CC2 | Cc1nn(C)c2sc(C(=O)N[C@@H](C)C(=O)N3CC(C)(C)C3(C)C)cc12 | 0.553191 |
O=C([C@@H](OCC1CCCC1)c1ccccc1)N1CCc2c[nH]nc2C1 | CC(C)c1nnc2n1CCN(C(=O)c1cnc3c(c1)ncn3C)[C@@H]2C | 0.623431 |
Cc1ccc2nc(C)cc(C(=O)NCCOc3nonc3C)c2c1 | Cc1ccc(C(=O)N2C[C@@H](CNC(=O)c3cc4cc(Cl)ccc4[nH]3)C[C@@H]2C)o1 | 0.576174 |
C=CCn1c(SCC(=O)NC(=O)c2cccc([N+](=O)[O-])c2)nnc1C1CCCCC1 | O=C(O)[C@@H](Cc1c[nH]c2ccccc12)N1CCS(=O)(=O)CC1 | 0.525442 |
Cc1c(Cl)cccc1NCC(=O)N(c1ccccc1)[C@@H]1CCS(=O)(=O)C1 | C[C@@H](NC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1)C1CC1 | 0.517442 |
COC(=O)c1ccc2c(=O)[nH]c(COC(=O)c3sc4nc5n(c(=O)c4c3C)CCC5)nc2c1 | O=C(c1ccc(CO)o1)N1C[C@H]2CC[C@@H]1CN(C1Cc3ccccc3C1)C2 | 0.668008 |
C=CCC(C(=O)OC)(C(=O)OC)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] | CCOc1cccc(OCCOCCn2c(-c3ccc(OC)cc3)nc3ccccc3c2=O)c1 | 0.521127 |
O=C(c1cc(Cl)ccc1Cl)N1CCN(Cc2cc(=O)n3ccsc3n2)CC1 | CCS(=O)(=O)N1CCC[C@@H]1C(=O)NS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 | 0.609342 |
O=C1[C@@H]2[C@@H]3C=C[C@@](CO)(O3)[C@@H]2C(=O)N1c1cccc2ccccc12 | O=C(NCc1ccco1)[C@@H]1CCCN1c1cnccn1 | 0.556645 |
COc1cc(S(=O)(=O)N2C[C@H]3CCCN3C(=O)[C@H]2C)c(OC)cc1Cl | O=C1NC(=O)C(=NNc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)C(=O)N1 | 0.592873 |
C[C@H](C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21)N(c1ccc(F)c(F)c1)S(C)(=O)=O | CC(=O)Nc1c(NC(C)(C)C)c2ccccc2oc1=O | 0.531579 |
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