p1
stringlengths 9
246
| p2
stringlengths 10
231
| similarity
float64 0.09
1
|
|---|---|---|
CCN1CCN(c2ccccc2NC(=O)c2cc(C)nc3ccccc23)CC1 | Cc1cc(-c2nn3c(-c4ccccn4)nnc3s2)nn1C | 0.542231 |
CCOc1ccc(-c2noc([C@H]3CC(=O)N(c4ccc5c(c4)OCO5)C3)n2)cc1 | Cc1ncsc1CN(C)[C@H](C)c1ncc(C(C)(C)C)o1 | 0.523707 |
CCOC(=O)[C@H](NC(C)=O)[C@H](OC(C)=O)c1cccc(N(CCO)CCO)c1 | Cc1cnc(CN2C[C@@]3(CCCN(c4ccncc4C)C3)CCC2=O)cn1 | 0.534247 |
Cc1cccc2nc(CN3C(=O)NC(c4ccccc4)(c4ccccc4)C3=O)cc(=O)n12 | O=C(c1nccc2ccccc12)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 | 0.651452 |
COc1ccc(-c2csc(NC(=O)c3ccc(S(=O)(=O)N4CCCCCC4)cc3)n2)cc1 | CCOC(=O)[C@@H](Cc1ccc(/N=C/c2ccccc2)cc1)N1C(=O)c2ccccc2C1=O | 0.525164 |
Cc1cc(C)n(-c2cccc(NS(=O)(=O)c3ccc(F)c(C(=O)O)c3)c2)n1 | COc1ccc(F)cc1S(=O)(=O)N1CCC(C(=O)Nc2cc(C)ccc2C)CC1 | 0.580931 |
COc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccc(C)cc1Br | CCN1C(=O)/C(=C\c2cc(OC)c(OC)cc2Cl)S/C1=N/c1ccc(OC)cc1 | 0.536692 |
CCC[C@H]1C(C#N)(C#N)[C@@]2(C#N)C(=N)O[C@@]1(C)O[C@@H]2C(C)C | Cc1sc2nc(CN3CCCC3)nc(N3CCc4ccc(O)cc4CC3)c2c1C | 0.567568 |
CO[C@H]1CN(C(C)C)C[C@@H]1NC(=O)Nc1cc(-n2cnnn2)ccc1F | Cc1ccc(C#N)cc1N1C(=O)CN(Cc2ccc(Cl)s2)C1=O | 0.579117 |
C[C@H](OC(=O)c1cc2c([nH]c1=O)CCC(C)(C)C2)c1nccs1 | COc1cc2ccncc2cc1OCc1noc(-c2ccoc2)n1 | 0.500544 |
CN1C(=O)C([C@@H]2Cc3cc4c(cc3CC23C(=O)N(C)C(=O)N(C)C3=O)OCO4)C(=O)N(C)C1=O | COc1ccc([C@H]2C3=C(CC(C)(C)CC3=O)Oc3cc4c(cc32)OCO4)c(OC)c1 | 0.678534 |
COC(=O)[C@@H](C)Sc1nc2sc3c(c2c(=O)n1-c1ccc(OC)cc1)CCCS3 | Cc1ccc(C(=O)COC(=O)[C@@H]2CS[C@H](c3cccc4[nH]ccc34)N2)cc1 | 0.674395 |
CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccccc1[N+](=O)[O-] | Cc1nc(CNC(=O)c2cnn(-c3ccccc3Cl)c2)cs1 | 0.579055 |
O=C(Cn1c(=O)cnc2ccccc21)N1CCC[C@H]2CCCC[C@H]21 | O=C(N[C@H]1CCCNC1=O)c1ccc(-c2cccs2)[nH]c1=O | 0.522652 |
Cn1c(=O)c2c(ncn2CC(=O)N2CCOCC2)n(C)c1=O | Cc1ccc(F)c(S(=O)(=O)N2CCC3(CC2)C[C@@H]3c2nnc(-c3ccccc3)o2)c1 | 0.5919 |
Cn1cc([C@H]2CN(S(=O)(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)cn1 | Cc1ccc(CNc2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)C[C@H](C)C3)n2)cc1 | 0.566058 |
CN(Cc1ccc(F)cc1F)C(=O)c1cn(-c2ccc3c(c2)C(=O)N([C@@H]2CCC(=O)NC2=O)C3)nn1 | CSc1cc2c(cc1NC(=O)N[C@H](C)c1ccncc1)OCCO2 | 0.584293 |
Cc1nnc2n1C[C@H](Cn1ccnc1-c1cccc3ccnn13)C2 | CC(=O)c1ccc(Sc2nnc3sc4ccccc4n23)c([N+](=O)[O-])c1 | 0.682281 |
COc1ccc([C@H]2Nn3c(C)nnc3S[C@H]2C(=O)NCc2ccc(C)cc2)cc1Br | O=C1NC(=O)[C@H](Cc2nc(-c3cccc(CN4CCCCC4)c3)no2)N1 | 0.610187 |
CCCn1c(SCC(=O)Nc2sccc2C(N)=O)nnc1-c1ccncc1 | O=C(CCSCc1nc(-c2cccs2)no1)N1CCc2ccccc21 | 0.593985 |
CN(C)c1cccc(CNC(=O)Nc2cc(C3CCC3)nn2C)n1 | Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1-n1ccnc1-c1ncc[nH]1 | 0.601911 |
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2)n2c(nc3ccccc32)N1 | O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@@H](c2ccn[nH]2)C1 | 0.521649 |
CCCC(=O)N1CC[C@H](c2nc(O)c3c(n2)CCN(Cc2ccc(OC)cc2)C3)C1 | CC(C)c1ocnc1C(=O)N[C@@H]1C[C@H]1NC(=O)c1cn2c(n1)CCC2 | 0.617428 |
Cc1noc(-c2cccnc2NCc2c(C)cc(C)[nH]c2=O)n1 | CC(C)c1nnc([C@H]2CN(C(=O)NCc3cccc4cccnc34)CCO2)o1 | 0.601512 |
CCOc1ccc(CN(C)C(=O)COC(=O)c2c(-c3ccccc3)noc2C)cc1 | Cc1oc(-c2ccccc2Cl)nc1C[S@](=O)CC(=O)NCc1cccs1 | 0.585576 |
CCN(CC)S(=O)(=O)CC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 | CC(C)CCn1c(=O)n(C[C@@H]2CCCN(C)C2)c2cc(C(=O)O)cnc21 | 0.564263 |
CCOC(=O)c1nc(NC[C@H](c2ccccc2Cl)N(CC)CC)ncc1Cl | COc1ccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1S(=O)(=O)N(C)C | 0.54738 |
Cc1ccsc1[C@@H]1c2c(nc(N3CCC(C)CC3)[nH]c2=O)NC(=O)[C@@H]1C#N | CCn1c(SCC(=O)N(Cc2ccccc2)Cc2ccccc2)nc2cc(S(N)(=O)=O)ccc21 | 0.662663 |
CCOCCCn1/c(=N/C(=O)c2ccc3c(n2)CCCC3)[nH]c2ccccc21 | CC(=O)Nc1ccc(F)c(NC(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)c1 | 0.65213 |
O=C(CCn1ncc(=O)c2ccccc21)N1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 | C[C@H]1CCN(c2cc(N)c([N+](=O)[O-])c(C#N)c2)C[C@H]1n1ccnc1 | 0.599791 |
CCOc1ccc(C(=O)N[C@H](C(=O)N2CCN(Cc3ccco3)CC2)C(C)C)cc1 | Cc1cccc(CN[C@H]2CC(=O)N(CCc3cccc(Cl)c3)C2)n1 | 0.501359 |
COc1ccc(-c2noc([C@@H](C)S(=O)(=O)c3ccc(C)cc3)n2)cc1 | COc1ccc(C(=O)N2CC[C@H](C)C[C@@H]2c2ccco2)c(OC)c1 | 0.542918 |
Cn1nnnc1[C@H]1CN(c2ncccc2C#N)CCO1 | COC(=O)/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1nc2ccccc2[nH]1 | 0.528446 |
CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1cccnc1 | COc1cc(C(=O)N[C@H]2CC(C)(C)Cc3c2cnn3Cc2ccccc2)cc(OC)c1OC | 0.628192 |
COc1ccc2nc(NC(=O)CN3CCN(c4cccc(C(F)(F)F)c4)CC3)sc2c1 | O=C1NC(=O)/C(=C\c2cc(Br)ccc2OCc2cccc([N+](=O)[O-])c2)N1 | 0.535147 |
Cc1nn(C)c2ncc(NC(=O)[C@@H](N)Cc3ccccc3)cc12 | CCCn1cc(CNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)c(C)n1 | 0.570431 |
CC(C)c1ccc(Nc2nc(N)c(C#N)c(CC#N)c2C#N)cc1 | Cc1cc(C)nc(SC2=C(Nc3cccc(C)c3C)C(=O)N(CCc3ccccc3)C2=O)n1 | 0.548832 |
CCCC[C@@H]1CN(C(=O)c2ccn3nccc3c2)C[C@H](C(C)C)O1 | COc1ccc(-c2ccc(C)c(NC(=O)c3ccnc4c3ncn4C)c2)cn1 | 0.539631 |
CN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)C[C@@H](O)c1ccc(Cl)cc1 | COCCCN1CCC[C@H](c2nnc(Cn3ccnc3C)n2C)C1 | 0.555556 |
COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)CN1Cc2ccccc2C1=O | Cc1nc2ccccn2c1C(=O)NC[C@H](c1ccc2c(c1)CCO2)N(C)C | 0.533259 |
N[C@H](CNS(=O)(=O)c1cccc2nonc12)c1ccccc1 | C[C@H]1[C@H](C)CCC[C@H]1N(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)Cc1ccc2c(c1)OCO2 | 0.527877 |
O=C1c2cccc3cccc(c23)C(=O)N1CCC(=O)N1CCCc2ccccc21 | O=C([C@@H]1CCCN(c2ncccn2)C1)N1CC[C@H]1c1ccccc1 | 0.566351 |
CCn1nccc1NC(=O)c1ccccc1CSc1nc2nc(C)cc(C)n2n1 | O=C(O)c1cc(-c2ccc(/C=C3/NC(=O)N(Cc4ccccc4)C3=O)o2)ccc1Cl | 0.638974 |
COc1ccccc1/C=C1\SC(=S)N(/C=C2\C(=O)Oc3ccccc3C2=O)C1=O | CCNC(=O)[C@@H](C)N(Cc1ccccc1C)C(=O)CN(c1ccccc1)S(C)(=O)=O | 0.591942 |
Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2c(C)n[nH]c2C)ncc1C(=O)N1CCCCC1 | O=S(=O)(N[C@H]1[C@@H]2CC[C@H]1CN(C[C@@H]1CCOC1)C2)c1c(F)cccc1F | 0.53212 |
COCCn1cc(-c2ccccc2)nc1Cc1ccc(O)c(O)c1 | COC(=O)c1c(NC(=O)c2ccc(OC)c(OC)c2)sc(C(=O)Nc2ccccc2C)c1C | 0.558237 |
Cc1nc(CN(Cc2scnc2C)C[C@H]2CCNC2)oc1C | COc1ccccc1-c1nc(C(=O)N[C@]2(C#N)CCSC2)cs1 | 0.502838 |
CCOC(=O)COc1c(OC)cc(C=NN2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C2)cc1OC | COc1ccc(-c2noc([C@H](C)O)c2C(=O)N2CCN(C)CC2)cc1OC | 0.587368 |
NCC(=O)Nc1nn(-c2cccc(F)c2)c2cccc(Oc3cccnc3)c12 | Cn1c(C(=O)Nc2ccccc2)cc2occc21 | 0.582726 |
O=C(NCc1ccccc1)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1C2=O | CCOc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)Nc3ccc(F)c(Cl)c3)C2)cc1 | 0.516234 |
Cc1nccn1-c1ccc(CNC(=O)N2CCOCC2)cc1F | COc1ccc([C@@H](c2nnnn2C[C@H]2CCCO2)N2CCN(c3ccccc3F)CC2)cc1 | 0.505435 |
COC(=O)c1ccc([C@@H]2C3=C(O)N(C(C)=O)CC3=Nc3cccc4c3c2cn4C)cc1 | Cc1cc(C)cc(C(=O)NCC(=O)OCc2cc(F)cc3c2OCOC3)c1 | 0.537131 |
Cc1[nH]c2ccccc2c1NC(=O)CC(C)(C)C | O=C(c1cc(-c2cccnc2)nc2ccccc12)N1CCN(C[C@@H]2CCCO2)CC1 | 0.511574 |
O=C(c1cccc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c1)N1CCC[C@@H](O)C1 | CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)N1CC[C@H]([C@@H](C)O)C1 | 0.530752 |
CCOC(=O)CSc1ncnc2c1sc1nc(C)c3c(c12)CCCC3 | CCN(CCNc1cc(=O)n(-c2ccccc2)c(C)n1)Cc1cc(Cl)cc(Cl)c1 | 0.621704 |
O=C(O)c1cccc(-c2ccc([C@@H]3[C@H](c4ccccn4)NC(=S)N3C[C@H]3CCCO3)o2)c1 | COc1ccc(OC)c([C@@H](C)NC(=O)[C@H](C)Oc2ccccc2C)c1 | 0.521069 |
O=C1C[C@H](C(=O)N2CCC3(CC2)c2nc[nH]c2CCN3C(=O)C2CCC2)CN1 | CC(C)c1cc(C(=O)NC2(c3cccc(F)c3)CCOCC2)n[nH]1 | 0.606125 |
CN1C(=O)N(C)C2(CCN(c3cc([C@H]4C[C@@H](O)C4)ncn3)CC2)C1=O | Cc1csc([C@H](NC(=O)c2snc(O)c2Cl)C(F)(F)F)n1 | 0.567625 |
CN(C)Cc1c(O)ccc2c(=O)c(-c3ccc4c(c3)OCCO4)c(C(F)(F)F)oc12 | Cc1nn2c(c1-c1ccc(F)cc1)N=CC[C@@H]2c1ccccc1 | 0.724798 |
CS(=O)(=O)c1ccc2nc(NC(=O)Cn3cccn3)sc2c1 | CN(c1ccc(F)cc1)c1ccc2ccc(C(=O)N3CCC[C@@H](O)C3)cn12 | 0.561346 |
COc1ccc(OC)c([C@H]2/C(=C(\O)c3ccco3)C(=O)C(=O)N2CCCN(C)C)c1 | O[C@@H](COc1ccc2c(c1)CCC2)CN1CCN(c2ccccc2F)CC1 | 0.525773 |
COC(=O)c1c(NC(=S)N(C)Cc2cn(C)nc2C)sc2c1CC[C@@H](C)C2 | O=C1C[C@H]([C@@H]2CCCN(C(=O)c3cnc4ccccn4c3=O)C2)Oc2ccc(Cl)cc21 | 0.768844 |
CC(C)CCN1CCC[C@]2(CC(C(=O)N3CC(F)(C4CC4)C3)=NO2)C1 | O=C(O)[C@H]1CC2(CCN(C(=O)c3cc[nH]n3)CC2)CN1C(=O)C1CC1 | 0.505389 |
Cc1nc(C)c(-c2csc(CC3CC3)n2)o1 | CCN1C(=O)c2cc(Cl)ccc2N[C@H]1c1[nH]cnc1C | 0.554011 |
Cn1cc(CN2CC[C@]3(C2)Cn2c(-c4cccs4)cnc2CO3)cn1 | C[C@H]1CN(c2cc(CNc3ncccc3Cl)ccn2)CCO1 | 0.507903 |
COc1cccc(CN2CCC([C@@H](NC(=O)C(C)(C)C)c3nccs3)CC2)c1 | CC(=O)C[C@@H]1[C@@]2([N+](=O)[O-])CN(CCO)C[C@@]1([N+](=O)[O-])c1ccccc1C2=O | 0.61332 |
CCc1ccc(O)c(C(=O)N[C@@H](C)c2cn(-c3ccccc3)nn2)c1 | Cc1cnc(OC2CCN(C(=O)C[C@@H]3CSc4ncc(C)c(=O)n43)CC2)nc1 | 0.565124 |
COC(=O)c1ccc(OC[C@@H](O)CN2C(=O)C(C)(C)N=C2O)cc1 | Cc1cc(O[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)ccc1Cl | 0.516129 |
O=C(c1cc2c(nc1O)CCC2)N1C[C@@H](Cc2cnccn2)[C@H](O)C1 | c1cn(-c2ccc3[nH]ncc3c2)c(-c2cc3n(n2)CCNC3)n1 | 0.648454 |
CC(C)[C@@H]1C[C@H](Nc2ccc3c(=O)n(C)c(=O)n(C)c3c2)CS1 | CC(C)c1nnc2n1C[C@@H](NC(=O)Nc1ccccc1)CC2 | 0.526796 |
C=CCNC(=O)CN1CCN(C(=O)Cc2c(C)nn(-c3ccccc3)c2C)CC1 | COc1ccc(NC(=O)[C@@H]2CC(=O)Nc3nc(N4CCc5ccccc5C4)[nH]c(=O)c32)c(OC)c1 | 0.593011 |
COC(=O)c1cc(CNC(=O)Cc2ccc(Br)cc2)oc1C | N#Cc1cnn2c1N[C@H](c1ccccc1)C[C@@H]2C(F)F | 0.513935 |
CC(C)(C)N1C[C@H](C(=O)N2CCc3ncccc3C2)CC1=O | Cc1nnc2n1C[C@H](C(=O)N1CCC(Cn3cccn3)CC1)N(C)C2 | 0.535593 |
COc1cc(OC)c(OC)cc1CNC(=O)c1cccc2cccnc12 | Cc1[nH]c2ccccc2c1CCNC(=O)NCc1ccoc1 | 0.509677 |
CCCCCCCCN1C(=O)C(O)=C(C(C)=O)[C@@H]1c1ccccn1 | COc1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C(O)C(=O)N2c2cccc(C(=O)O)c2)cc1 | 0.786869 |
COc1ccc(NC(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(OC)c(OC)c2)cc1 | C[C@@H](SCc1csc(-c2ccccc2)n1)C(=O)N[C@@H]1CCS(=O)(=O)C1 | 0.542056 |
COCc1cccc(NC(=O)[C@H]2CN(S(C)(=O)=O)c3cc(C(C)(C)C)ccc3O2)c1 | COc1ccc([C@@H]2CCCN2Cc2nc(-c3ccccc3)no2)c(OC)c1 | 0.59597 |
CCOC(=O)c1sc(NS(=O)(=O)c2ccc(OCC(=O)N(C)C)c(C)c2)nc1C | Cc1ccc(-c2noc([C@@H]3CCN(S(=O)(=O)c4cnn(C)c4C)C3)n2)cc1 | 0.661157 |
O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cncc2sccc12 | O=C(c1ccc(Cl)cc1F)N1CC=C(c2c[nH]c3ccccc23)CC1 | 0.607821 |
COCC(=O)N1CCN(C(=O)Nc2ccccc2)C[C@@H]1C(=O)N[C@H](Cc1cccnc1)C(=O)OC | COc1cc(C(=O)/N=c2\sc(C)c(-c3ccc(Cl)cc3)n2C)cc(OC)c1OC | 0.577202 |
C#CCN1C(=O)[C@](O)(CC(=O)/C=C/c2ccco2)c2ccccc21 | O=C(C1=C(N2CCc3ccccc32)c2ccccc2S1(=O)=O)N1CCOCC1 | 0.819444 |
C#CCCC1(CCNC(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)N=N1 | Cc1ccc(NC(=O)N2CCC[C@@H]2C(=O)N2CCOCC2)cc1[N+](=O)[O-] | 0.5623 |
COC(=O)c1ccc(OC(=O)[C@@H]2CC(=O)N(c3cccc(Cl)c3Cl)C2)cc1 | Cc1c(Br)c(C(=O)N(C)CCc2nccs2)nn1C | 0.503955 |
O=C1NC2(CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)N=C1c1ccc(F)cc1 | Cc1c(CN2CCc3c(c(C(=O)NCc4ccccc4)nn3C)C2)c(=O)n(-c2ccccc2)n1C | 0.659 |
CS(=O)(=O)[C@@H]1[C@@H](c2ccc(Cl)cc2)[C@]1(N)C(=O)O | O=C(Nc1ccncc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl | 0.522404 |
C[C@H](Oc1ccc(F)cc1)C(=O)Nc1sc2c(c1C(N)=O)CCC2 | C[C@@H](Sc1nncn1-c1cccc(Cl)c1)c1nc(N)nc(Nc2ccccc2)n1 | 0.542373 |
CCN(C)C(=O)c1ccc(N2CCC[C@H](c3nccn3CC3CC3)C2)nc1 | Cc1cnn(C[C@H]2CCCN2C(=O)CCc2c[nH]c3ccccc23)c1 | 0.574094 |
CO[C@H](C(=O)NS(=O)(=O)c1ccc2c(c1)oc1ccccc12)[C@@H]1CCOC1 | Cc1nn2c(Nc3ccncc3)cc(C(C)C)nc2c1-c1ccccc1 | 0.577755 |
CCn1c(SCC(=O)OCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)nnc1-c1cccs1 | CCN(C(=O)/C=C/c1ccc(-c2ccccc2Cl)s1)[C@@H]1CCS(=O)(=O)C1 | 0.574812 |
Cc1ccc(-c2nccn2-c2cnn(CCCC(N)=O)c2)cc1Cl | COc1ccc(NC(=O)Cn2cc(C(=O)c3ccc(C)cc3)c(=O)c3ccc(C)nc32)cc1Cl | 0.552116 |
COc1ccc(-c2nc(NC(=O)[C@H]3Cc4cc(Cl)ccc4O3)sc2C)cc1 | O=C(O)COc1ccccc1CN1C[C@@H](O)[C@@]2(C1)[C@H](CO)[C@H]2c1ccccc1 | 0.647992 |
COc1cc(C(=O)N2CC[C@@]3(CN(C)C(=O)CO3)C2)ccc1OCCN | COc1ccc(N2CN(CCO)Cn3c2nc(C)c(C)c3=O)cc1 | 0.600622 |
O=C(C1=C(O)C(=O)N(Cc2ccco2)[C@H]1c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 | Cc1cc(-c2cnc(N3CCN(C)CC3)nc2[C@H]2CCCN(Cc3ccc(O)cc3)C2)on1 | 0.757968 |
CN(C)S(=O)(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CCCC3)cc1 | CC(C)(C)C(=O)/C=C1\SCC(=O)N1Cc1cccc2cccnc12 | 0.589305 |
Cc1ccc(/N=C2\NC(=O)/C(=C/c3ccc(N4CCOCC4)cc3)S2)cc1C | Cc1nnc([C@@H](C)Sc2nnc([C@@H](C)N(C)C)n2-c2ccc(Cl)cc2)o1 | 0.519618 |
C[C@@H](N[C@H](c1ccccc1)C1CC1)C(=O)Nc1cc(F)ccc1F | CCCN1CCN(C(=O)CN2CC[C@]3(CCC2=O)NC(=O)c2ccccc2O3)CC1 | 0.503448 |
O=C(CCc1nc2ccccc2s1)N1CCc2nc([C@@H]3CCCN3)ncc2C1 | CCC1(CC)C[C@H](NS(=O)(=O)Cc2ccccc2C)c2ccccc2O1 | 0.56962 |
CC(C)(C)c1ccc(C(=O)Nc2cccc3c(O)n[nH]c(=O)c23)cc1 | COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)CC[C@@H]1Cc2ccccc2NC1=O | 0.544576 |
COc1ccc([C@@H]2CC(=O)Oc3c2c(C)cc2oc(=O)cc(-c4ccccc4)c32)cc1OCC(N)=O | Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NC[C@@H](c3ccccc3)N3CCCC3)c2)cc1 | 0.586489 |
O=C(c1ccc(-c2ccc(Cl)cc2)o1)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1 | COc1ncc(-c2ccc3c(c2)C(=O)C[C@@H]3C)cc1C | 0.549438 |
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