SMILES for Eukaryotic translation initiation factor 4E

324 SMILES Strings for Eukaryotic translation initiation factor 4E

Compound Name

SMILES String

BDBM167303

CC(=O)N1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167305

CC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167366

CC(=O)c1ccc(Cl)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167368

CC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167364

CC(=O)c1cccc(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167365

CC(=O)c1ccccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167367

CC(=O)c1sccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50525090

CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@](C)(CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(C)=O |r,c:25|

BDBM50525092

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(C)=O)C(N)=O |r|

BDBM50525089

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(C)=O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|

BDBM50525091

CC(C)C[C@H](NC(=O)[C@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(C)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(N)=O |r,c:13|

BDBM50410172

CC(C)OC1C(COP([O-])=O)OC(C1OC(C)C)n1c[n+](C)c2c1nc(N)[n-]c2=O

BDBM50165119

CC(C)O[C@H]1[C@@H](CO)O[C@H](C1OC(C)C)n1c[n+](C)c2c1nc(N)[nH]c2=O

BDBM50165118

CC(C)O[C@H]1[C@@H](CO)O[C@H](C1OC(C)C)n1c[n+](Cc2ccccc2)c2c1nc(N)[nH]c2=O

BDBM50165127

CC(C)O[C@H]1[C@@H](CO)O[C@H](C1OC(C)C)n1cnc2c1nc(N)[nH]c2=O

BDBM50165135

CC(C)O[C@H]1[C@@H](COP([O-])(=O)NC(C([O-])=O)C(=O)c2ccccc2)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

BDBM50165141

CC(C)O[C@H]1[C@@H](COP([O-])(=O)NC(Cc2c[nH]c3ccccc23)C([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

BDBM50165142

CC(C)O[C@H]1[C@@H](COP([O-])(=O)NCC([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

BDBM50165122

CC(C)O[C@H]1[C@@H](COP([O-])(=O)NCCC([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

BDBM50410174

CC(C)O[C@H]1[C@@H](COP([O-])=O)O[C@H](C1OC(C)C)n1c[n+](Cc2ccccc2)c2c1nc([NH-])[nH]c2=O

BDBM50410171

CC(C)O[C@H]1[C@@H](COP([O-])=O)O[C@H](C1OC(C)C)n1c[n+](Cc2ccccccccc2)c2c1nc([NH-])[nH]c2=O

BDBM50165117

CC(C)O[C@H]1[C@@H](COP([O-])=O)O[C@H](C1OC(C)C)n1c[nH+]c2c1nc(N)[nH]c2=O

BDBM50597677

CC(C)Oc1cc(F)ccc1Nc1ncnc2cc(C(=O)NCC3CCNCC3)n(C)c12

BDBM50597671

CC(C)Oc1cc(F)ccc1Nc1ncnc2cc(C(=O)NCCCN(C)C)n(C)c12

BDBM50597681

CC(C)Oc1cc(F)ccc1Nc1ncnc2sc(nc12)C(=O)NCC1CCNCC1

BDBM50597680

CC(C)Oc1cc(F)ccc1Nc1ncnc2sc(nc12)C(=O)NCCN1CCNCC1

BDBM50597672

CC(C)Oc1cc(ccc1Nc1ncnc2ccn(C)c12)C#N

BDBM167346

CC(C)c1ncncc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167330

CC(NC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1)c1ccccc1

BDBM50597686

CC1(C)CN(c2ccccc12)c1ncnc2sc(nc12)C(=O)NCC1CCNCC1

BDBM164243

CC1(C)NC(=O)c2ccc(Nc3ccncn3)c(=O)n12

BDBM50386774

CC1(C)O[C@@H]2[C@@H](COP(O)([O-])=O)O[C@H]([C@@H]2O1)n1c[n+](CCOc2ccc(Cl)cc2)c2c1nc(N)[nH]c2=O |r|

BDBM167299

CCN(C)CCCNC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167298

CCN(CC)CCCNC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50386778

CCOP(=O)(OCC)c1ccc(cc1)-c1nc2nc(NC)[nH]c(=O)c2n1CCOc1ccc(Cl)cc1

BDBM50386779

CCOP(O)(=O)c1ccc(cc1)-c1nc2nc(NC)[nH]c(=O)c2n1CCOc1ccc(Cl)cc1

BDBM167339

CCOc1ccc(c(Cl)c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167332

CCOc1ncc(cn1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50525088

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)CNC(C)=O)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r|

BDBM50525087

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)CNC(C)=O)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(N)=O |r,c:79|

BDBM50565476

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50565475

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H]1CCCCNC(=O)CC[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50410173

CC[n+]1cn(C2OC(COP([O-])=O)C(OC(C)C)C2OC(C)C)c2nc(N)[n-]c(=O)c12

BDBM50370482

CC[n+]1cn(C2O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50165134

CC[n+]1cn([C@@H]2O[C@H](CO)[C@H](OC(C)C)C2OC(C)C)c2nc(N)[nH]c(=O)c12

BDBM50597676

CN(C)CCCNC(=O)c1cc2ncnc(N3CCc4cc(F)ccc34)c2n1C

BDBM50597682

CN(C)CCCNC(=O)c1nc2c(ncnc2s1)N1CC(C)(C)c2ccccc12

BDBM50597685

CN(C)CCCNC(=O)c1nc2c(ncnc2s1)N1CCc2cc(F)ccc12

BDBM50597683

CN(C)CCCNC(=O)c1nc2c(ncnc2s1)N1CCc2ccccc12

BDBM167300

CN(C)CCNC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50370486

CN(C)c1nc2n(ccc2c(=O)[nH]1)C1O[C@H](CO)[C@@H](O)[C@H]1O |r|

BDBM50597691

CN(Cc1ccon1)Cc1cc(ccc1O)-c1ccnc2cc(Cl)ccc12

BDBM167302

CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167304

CN1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50370483

CN1CN(C2O[C@H](CO)[C@@H](O)[C@H]2O)C2=NC=NC(O)C12 |r,c:16,t:14|

BDBM50370489

CN1CN(C2O[C@H](CO)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=S)c12 |r|

BDBM50597679

CNC(=O)c1nc2c(Nc3ccc(F)cc3OC(C)C)ncnc2s1

BDBM50370493

CNc1nc2n(cnc2c(=O)[nH]1)C1O[C@H](CO)[C@@H](O)[C@H]1O |r|

BDBM50386776

CNc1nc2nc(-c3ccc(CP(O)(O)=O)cc3)n(CCOc3ccc(Cl)cc3)c2c(=O)[nH]1

BDBM50386777

CNc1nc2nc(-c3ccc(cc3)C(F)(F)P(O)(O)=O)n(CCOc3ccc(Cl)cc3)c2c(=O)[nH]1

BDBM50386780

CNc1nc2nc(-c3ccc(cc3)C(O)=O)n(CCOc3ccc(Cl)cc3)c2c(=O)[nH]1

BDBM50386775

CNc1nc2nc(-c3ccc(cc3)P(O)(O)=O)n(CCOc3ccc(Cl)cc3)c2c(=O)[nH]1

BDBM50410169

COC(=O)C(Cc1ccccc1)NP([O-])(=O)OC[C@H]1O[C@H]([C@H](OC(C)C)[C@@H]1OC(C)C)n1cnc2c1nc(N)[nH]c2=O

BDBM451153

COC(=O)c1ccsc1NC(=O)c1cccc(C[n+]2cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c3nc(N)nc([O-])c23)c1 |r|

BDBM451151

COC(=O)c1sccc1NC(=O)c1cccc(C[n+]2cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c3nc(N)nc([O-])c23)c1 |r|

BDBM36609

CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O |c:14,33,t:29,31|

BDBM451146

CO[C@H]1[C@@H](O)[C@H](COP(O)(O)=O)O[C@@H]1n1c[n+](CCOc2ccc(Cl)cc2)c2c([O-])nc(N)nc12 |r|

BDBM451156

COc1cc(ccc1C[n+]1cn([C@H]2O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]2O)c2nc(N)nc([O-])c12)-c1ccccc1 |r|

BDBM50018903

COc1cc2CCc3sc(N\N=C(/Cc4ccccc4[N+]([O-])=O)C(O)=O)nc3-c2cc1OC

BDBM50018923

COc1cc2CCc3sc(N\N=C(\Cc4ccccc4[N+]([O-])=O)C(O)=O)nc3-c2cc1OC

BDBM50018904

COc1cc2OCc3sc(N\N=C(/Cc4ccccc4[N+]([O-])=O)C(O)=O)nc3-c2cc1OC

BDBM50018928

COc1cc2OCc3sc(N\N=C(\Cc4ccccc4[N+]([O-])=O)C(O)=O)nc3-c2cc1OC

BDBM167337

COc1ccc(-c2ccc(cc2C(O)=O)-c2nc(cs2)-c2ccc(Cl)c(Cl)c2)c(c1)C(F)(F)F

BDBM167279

COc1ccc(-c2ccc(cc2C(O)=O)-c2nc(cs2)-c2ccc(Cl)c(Cl)c2)c(c1)[N+]([O-])=O

BDBM167280

COc1ccc(-c2csc(n2)-c2ccc(c(c2)C(O)=O)-c2ccccc2[N+]([O-])=O)c(F)c1

BDBM167315

COc1ccc(CNC(=O)c2ccc(cc2)-c2ccc(cc2C(O)=O)-c2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1

BDBM167343

COc1ccc(Cl)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167344

COc1ccc(c(Cl)c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167283

COc1ccc(cc1)-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM50018926

COc1ccc2-c3nc(N\N=C(/Cc4ccccc4[N+]([O-])=O)C(O)=O)sc3COc2c1OC

BDBM50018934

COc1ccc2-c3nc(N\N=C(\Cc4ccccc4[N+]([O-])=O)C(O)=O)sc3COc2c1OC

BDBM167316

COc1cccc(CNC(=O)c2ccc(cc2)-c2ccc(cc2C(O)=O)-c2nc(cs2)-c2ccc(Cl)c(Cl)c2)c1

BDBM50316313

COc1cccc(C[n+]2cn([C@@H]3O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]3O)c3nc(N)[nH]c(=O)c23)c1 |r|

BDBM451147

COc1cccc(C[n+]2cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c3nc(N)nc([O-])c23)c1 |r|

BDBM167340

COc1cccc(Cl)c1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1 |(-1.77,-9.77,;-1.77,-8.13,;-3.19,-7.31,;-4.52,-8.08,;-5.86,-7.31,;-5.86,-5.77,;-4.52,-5,;-4.52,-3.35,;-3.19,-5.77,;-1.86,-5,;-.52,-5.77,;.81,-5,;.81,-3.46,;-.52,-2.69,;-1.86,-3.46,;-2.81,-2.3,;-2.03,-.97,;-4.35,-2.3,;2.14,-2.69,;3.61,-3.16,;4.51,-1.92,;3.61,-.67,;2.14,-1.15,;6.05,-1.92,;6.82,-3.25,;8.36,-3.25,;9.13,-1.92,;10.67,-1.92,;8.36,-.58,;9.19,.84,;6.82,-.58,)|

BDBM167341

COc1cccc(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167282

COc1cccc(c1)-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM167335

COc1cccc(n1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167342

COc1ccccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167281

COc1ccccc1-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM167333

COc1ncc(cn1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167336

COc1ncccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167284

CS(=O)(=O)c1ccc(cc1)-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM50294222

C[n+]1cn(C2OC(COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)C(O)C2O)c2nc(N)[n-]c(=O)c12

BDBM50294223

C[n+]1cn(C2OC(COP([S-])(=O)OP([O-])(=O)OP([O-])([O-])=O)C(O)C2O)c2nc(N)[n-]c(=O)c12

BDBM50370484

C[n+]1cn(C2O[C@H](CO)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50370488

C[n+]1cn(C2O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50370490

C[n+]1cn(C2O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50110845

C[n+]1cn([C@@H]2O[C@H](COP(O)(=O)OP([O-])(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50543773

C[n+]1cn([C@@H]2O[C@H](COP(O)(S)=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50316304

C[n+]1cn([C@@H]2O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50543775

C[n+]1cn([C@@H]2O[C@H](COP(S)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50365101

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)NP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50365099

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)NP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50316302

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50316303

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50365102

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP([O-])(=O)NP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50365100

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])(=O)NP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50294220

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50365103

C[n+]1cn([C@@H]2O[C@H](COP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50294221

C[n+]1cn([C@@H]2O[C@H](CO[P@@]([S-])(=O)OP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3cnc4c3nc(N)[nH]c4=O)[C@@H](O)[C@H]2O)c2nc(N)[n-]c(=O)c12 |r|

BDBM50452630

C[n+]1cn([C@@H]2O[C@H](Cn3cc(nn3)P(O)([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM50410170

C[n+]1cn([C@H]2C[C@@H](O)[C@@H](COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)O2)c2nc([NH-])[nH]c(=O)c12

BDBM50263263

Cc1cc(Nc2cc(N)ncn2)c(=O)n2c1C(=O)NC21CCCCC1

BDBM167355

Cc1cc(ccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1)C#N

BDBM167329

Cc1cc(ccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1)C(O)=O

BDBM167260

Cc1cc(ccc1Cl)-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM167291

Cc1ccc(-c2csc(n2)-c2ccc(c(c2)C(O)=O)-c2ccccc2[N+]([O-])=O)c(C)c1

BDBM167370

Cc1ccc(C=O)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167392

Cc1ccc(Cl)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167388

Cc1ccc(Cl)c(c1F)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1 |(-5.19,-9.44,;-5.19,-7.9,;-6.53,-7.13,;-6.53,-5.59,;-5.19,-4.82,;-5.19,-3.28,;-3.86,-5.59,;-3.86,-7.13,;-2.52,-7.9,;-2.52,-4.82,;-1.19,-5.59,;.14,-4.82,;.14,-3.28,;-1.19,-2.51,;-2.53,-3.28,;-3.25,-2.19,;-2.49,-.85,;-4.79,-2.19,;1.48,-2.51,;2.94,-2.98,;3.85,-1.74,;2.94,-.49,;1.48,-.97,;5.39,-1.74,;6.16,-3.07,;7.7,-3.07,;8.47,-1.74,;10.01,-1.74,;7.7,-.4,;8.47,.93,;6.16,-.4,)|

BDBM167387

Cc1ccc(F)c(c1Cl)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1 |(-7.86,-5.59,;-6.53,-6.36,;-6.53,-7.9,;-5.19,-8.67,;-3.86,-7.9,;-2.52,-8.67,;-3.86,-6.36,;-5.19,-5.59,;-5.19,-4.05,;-2.52,-5.59,;-1.19,-6.36,;.14,-5.59,;.14,-4.05,;-1.19,-3.28,;-2.53,-4.05,;-3.25,-2.96,;-2.49,-1.62,;-4.79,-2.96,;1.48,-3.28,;2.94,-3.75,;3.85,-2.51,;2.94,-1.26,;1.48,-1.74,;5.39,-2.51,;6.16,-3.84,;7.7,-3.84,;8.47,-2.51,;10.01,-2.51,;7.7,-1.17,;8.47,.16,;6.16,-1.17,)|

BDBM50370485

Cc1ccc(SNc2nc3n(cnc3c(=O)[nH]2)C2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r|

BDBM167391

Cc1ccc(c(Cl)c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167292

Cc1ccc(cc1)-c1csc(n1)-c1ccc(c(c1)C(O)=O)-c1ccccc1[N+]([O-])=O

BDBM167321

Cc1cccc(CNC(=O)c2ccc(cc2)-c2ccc(cc2C(O)=O)-c2nc(cs2)-c2ccc(Cl)c(Cl)c2)c1

BDBM50316318

Cc1cccc(C[n+]2cn([C@@H]3O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]3O)c3nc(N)[nH]c(=O)c23)c1 |r|

BDBM451155

Cc1ccccc1-c1ccc(C[n+]2cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c3nc(N)nc([O-])c23)cc1 |r|

BDBM60446

Cc1ccccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50316320

Cc1ccccc1C[n+]1cn([C@@H]2O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)[nH]c(=O)c12 |r|

BDBM60441

Cc1cnccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167390

Cc1cscc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM60440

Cc1ncccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50597687

Clc1ccc2N(CCc2c1)c1ncnc2sc(nc12)C(=O)NCC1CCNCC1

BDBM50597673

Cn1ccc2ncnc(Nc3ccc(F)cc3OC(CF)CF)c12

BDBM50597675

Cn1ccc2ncnc(Nc3ccc(F)cc3OC3CCCC3)c12

BDBM50597674

Cn1ccc2ncnc(Nc3ccc(F)cc3O[C@@H]3CCCOC3)c12 |r|

BDBM167301

Cn1nccc1CNC(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50597678

Fc1ccc2N(CCc2c1)c1ncnc2cc[nH]c12

BDBM50597684

Fc1ccc2N(CCc2c1)c1ncnc2sc(nc12)C(=O)NCC1CCNCC1

BDBM50543776

N.C[n+]1cn([C@@H]2O[C@H](COP(O)(=O)NCCc3c[nH]c4ccccc34)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50543777

N.C[n+]1cn([C@@H]2O[C@H](COP(S)(=O)NCCc3c[nH]c4ccccc34)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50543778

N.N.C[n+]1cn([C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)NCCc3c[nH]c4ccccc34)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50543779

N.N.C[n+]1cn([C@@H]2O[C@H](COP(S)(=O)OP(O)(=O)NCCc3c[nH]c4ccccc34)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50543780

N.Nc1nc([O-])c2[n+](Cc3ccccc3)cn([C@@H]3O[C@H](COP(O)(=O)NCCc4c[nH]c5ccccc45)[C@@H](O)[C@H]3O)c2n1 |r|

BDBM60451

NC(=O)c1ccc(Cl)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167331

NC(=O)c1ccccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167328

NC(=O)c1ncccc1-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167403

NC(O)c1ccc(Cl)c(c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50044268

Nc1ccc(C\C(=N\Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)C(O)=O)cc1[N+]([O-])=O

BDBM451145

Nc1nc([O-])c2[n+](Cc3cc4ccccc4s3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451158

Nc1nc([O-])c2[n+](Cc3ccc(c(Cl)c3)-c3ccccc3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451144

Nc1nc([O-])c2[n+](Cc3ccc(cc3)-c3ccccc3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451160

Nc1nc([O-])c2[n+](Cc3ccc(cc3)-c3ccccc3F)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451159

Nc1nc([O-])c2[n+](Cc3ccc(cc3)-c3cccs3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451157

Nc1nc([O-])c2[n+](Cc3ccc(cc3F)-c3ccccc3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451148

Nc1nc([O-])c2[n+](Cc3cccc(OC(F)(F)F)c3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451154

Nc1nc([O-])c2[n+](Cc3cccc(OCc4ccccc4)c3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451150

Nc1nc([O-])c2[n+](Cc3cccc(Oc4ccccc4)c3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM451152

Nc1nc([O-])c2[n+](Cc3cccc(c3)C(=O)Oc3c(Cl)cccc3Cl)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM50543774

Nc1nc([O-])c2[n+](Cc3ccccc3)cn([C@@H]3O[C@H](COP(O)(S)=O)[C@@H](O)[C@H]3O)c2n1 |r|

BDBM451149

Nc1nc([O-])c2[n+](Cc3ccccc3CS(=O)(=O)c3ccccc3)cn([C@H]3O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]3O)c2n1 |r|

BDBM50386773

Nc1nc2c(cn(CCOc3ccc(Br)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |r|

BDBM50386772

Nc1nc2c(cn(CCOc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |r|

BDBM50386770

Nc1nc2n(c[n+](CC(=O)Nc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50370492

Nc1nc2n(c[n+](CC=C)c2c(=O)[nH]1)C1O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386764

Nc1nc2n(c[n+](CCCc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386762

Nc1nc2n(c[n+](CCOc3ccc(Br)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386769

Nc1nc2n(c[n+](CCOc3ccc(Cl)c(F)c3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386766

Nc1nc2n(c[n+](CCOc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386767

Nc1nc2n(c[n+](CCOc3ccc(F)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386768

Nc1nc2n(c[n+](CCOc3ccc(cc3)C#N)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386761

Nc1nc2n(c[n+](CCOc3ccc(cc3)C(F)(F)F)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386765

Nc1nc2n(c[n+](CCOc3ccccc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386763

Nc1nc2n(c[n+](CCc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316319

Nc1nc2n(c[n+](Cc3cc(Cl)ccc3Cl)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316310

Nc1nc2n(c[n+](Cc3cc(F)ccc3Cl)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50386771

Nc1nc2n(c[n+](Cc3cc4cc(Cl)ccc4o3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316307

Nc1nc2n(c[n+](Cc3ccc(Cl)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316315

Nc1nc2n(c[n+](Cc3ccc(F)cc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316312

Nc1nc2n(c[n+](Cc3ccc(cc3)C(O)=O)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316316

Nc1nc2n(c[n+](Cc3ccc4ccccc4c3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316308

Nc1nc2n(c[n+](Cc3cccc(Cl)c3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316306

Nc1nc2n(c[n+](Cc3cccc(F)c3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316314

Nc1nc2n(c[n+](Cc3cccc(c3)C(F)(F)F)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316317

Nc1nc2n(c[n+](Cc3cccc(c3)[N+]([O-])=O)c2c(=O)[nH]1)[C@@H]1O[C@H](CO[P+](O)([O-])[O-])[C@@H](O)[C@H]1O |r|

BDBM50370481

Nc1nc2n(c[n+](Cc3ccccc3)c2c(=O)[nH]1)C1O[C@H](COP([O-])([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50370487

Nc1nc2n(c[n+](Cc3ccccc3)c2c(=O)[nH]1)C1O[C@H](COP([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50249977

Nc1nc2n(c[n+](Cc3ccccc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |r|

BDBM50316305

Nc1nc2n(c[n+](Cc3ccccc3)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316309

Nc1nc2n(c[n+](Cc3ccccc3Cl)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50316311

Nc1nc2n(c[n+](Cc3ccccc3F)c2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50370491

Nc1nc2n(cnc2c(=O)[nH]1)C1O[C@H](COP([O-])=O)[C@@H](O)[C@H]1O |r|

BDBM50165116

Nc1nc2n(cnc2c(=O)[nH]1)[C@H]1C[C@@H](O)[C@@H](COP([O-])(=O)OP([O-])(=O)OP([O-])([O-])=O)O1

BDBM50130693

Nc1ncnc2[nH]nc(Nc3ccc(F)cc3)c12

BDBM297345

O=C(Nc1cc(Nc2ccc3C(=O)NCc3c2)ncn1)C1CC1

BDBM50570883

OC(=O)C(Cc1ccccc1[N+]([O-])=O)=NNc1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50018919

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50044269

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc(cs1)-c1ccc(O)cc1

BDBM50570882

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc(cs1)-c1ccc(cc1)-c1ccccc1

BDBM50018922

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CCc3c(Cl)c(Cl)ccc-23)s1

BDBM50018927

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CCc3cc(Cl)c(Cl)cc-23)s1

BDBM50018907

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(COc3c(Cl)c(Cl)ccc-23)s1

BDBM50018913

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(COc3cc(Cl)c(Cl)cc-23)s1

BDBM50018935

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CS(=O)(=O)c3c(Cl)c(Cl)ccc-23)s1

BDBM50018925

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CS(=O)(=O)c3cc(Cl)c(Cl)cc-23)s1

BDBM50018906

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CSc3c(Cl)c(Cl)ccc-23)s1

BDBM50018902

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(CSc3cc(Cl)c(Cl)cc-23)s1

BDBM50018921

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(C[S+]([O-])c3c(Cl)c(Cl)ccc-23)s1

BDBM50018917

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N/Nc1nc-2c(C[S+]([O-])c3cc(Cl)c(Cl)cc-23)s1

BDBM50018918

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CCc3c(Cl)c(Cl)ccc-23)s1

BDBM50018910

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CCc3cc(Cl)c(Cl)cc-23)s1

BDBM50018911

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(COc3c(Cl)c(Cl)ccc-23)s1

BDBM50018909

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(COc3cc(Cl)c(Cl)cc-23)s1

BDBM50018936

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CS(=O)(=O)c3c(Cl)c(Cl)ccc-23)s1

BDBM50018924

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CS(=O)(=O)c3cc(Cl)c(Cl)cc-23)s1

BDBM50018916

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CSc3c(Cl)c(Cl)ccc-23)s1

BDBM50018908

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(CSc3cc(Cl)c(Cl)cc-23)s1

BDBM50018937

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(C[S+]([O-])c3c(Cl)c(Cl)ccc-23)s1

BDBM50018920

OC(=O)C(\Cc1ccccc1[N+]([O-])=O)=N\Nc1nc-2c(C[S+]([O-])c3cc(Cl)c(Cl)cc-23)s1

BDBM167384

OC(=O)c1cc(ccc1-c1c(F)cccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1 |(-2.49,-1.62,;-3.25,-2.96,;-4.79,-2.96,;-2.53,-4.05,;-1.19,-3.28,;.14,-4.05,;.14,-5.59,;-1.19,-6.36,;-2.52,-5.59,;-3.86,-6.36,;-3.86,-7.9,;-2.52,-8.67,;-5.19,-8.67,;-6.53,-7.9,;-6.53,-6.36,;-5.19,-5.59,;-5.19,-4.05,;1.48,-3.28,;2.94,-3.75,;3.85,-2.51,;2.94,-1.26,;1.48,-1.74,;5.39,-2.51,;6.16,-3.84,;7.7,-3.84,;8.47,-2.51,;10.01,-2.51,;7.7,-1.17,;8.47,.16,;6.16,-1.17,)|

BDBM167397

OC(=O)c1cc(ccc1-c1cc(Cl)cc(Cl)c1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167359

OC(=O)c1cc(ccc1-c1cc(Cl)ccc1C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167396

OC(=O)c1cc(ccc1-c1cc(Cl)ccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167265

OC(=O)c1cc(ccc1-c1cc(Cl)ccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167381

OC(=O)c1cc(ccc1-c1cc(F)cc(F)c1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167378

OC(=O)c1cc(ccc1-c1cc(F)ccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167379

OC(=O)c1cc(ccc1-c1cc(F)ccc1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167345

OC(=O)c1cc(ccc1-c1cc(O)ccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167338

OC(=O)c1cc(ccc1-c1cc(OC(F)(F)F)ccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167376

OC(=O)c1cc(ccc1-c1cc(ccc1Cl)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167255

OC(=O)c1cc(ccc1-c1cc(ccc1[N+]([O-])=O)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167362

OC(=O)c1cc(ccc1-c1ccc(C#N)c(Cl)c1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167363

OC(=O)c1cc(ccc1-c1ccc(Cl)c(c1)C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167395

OC(=O)c1cc(ccc1-c1ccc(Cl)cc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167398

OC(=O)c1cc(ccc1-c1ccc(Cl)cc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167383

OC(=O)c1cc(ccc1-c1ccc(Cl)cc1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167377

OC(=O)c1cc(ccc1-c1ccc(F)cc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167372

OC(=O)c1cc(ccc1-c1ccc(F)cc1C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167382

OC(=O)c1cc(ccc1-c1ccc(F)cc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167380

OC(=O)c1cc(ccc1-c1ccc(F)cc1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167350

OC(=O)c1cc(ccc1-c1ccc(F)cn1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167356

OC(=O)c1cc(ccc1-c1ccc(cc1)C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167308

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)N1CCCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167307

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)N1CCOCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167313

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NC1CCOC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167314

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NC1CCOCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167312

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCC1CCCO1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167311

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCC1CCOCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167309

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCCCN1CCOCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167310

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCCN1CCOCC1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167318

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCCc1ccccc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167317

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCCc1cccnc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167323

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1ccc(F)cc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167324

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1cccc(F)c1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167322

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1cccc(c1)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167327

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1ccccc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167325

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1ccccc1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167319

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1cccnc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167326

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1cccs1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167320

OC(=O)c1cc(ccc1-c1ccc(cc1)C(=O)NCc1ccncc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167296

OC(=O)c1cc(ccc1-c1ccc(cc1)[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167373

OC(=O)c1cc(ccc1-c1ccc(cc1C(F)(F)F)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167375

OC(=O)c1cc(ccc1-c1ccc(cc1Cl)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167400

OC(=O)c1cc(ccc1-c1cccc(Cl)c1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167386

OC(=O)c1cc(ccc1-c1cccc(F)c1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167357

OC(=O)c1cc(ccc1-c1cccc(c1)C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167297

OC(=O)c1cc(ccc1-c1cccc(c1)[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167374

OC(=O)c1cc(ccc1-c1cccc(c1Cl)C(F)(F)F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167354

OC(=O)c1cc(ccc1-c1cccc(n1)C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM60447

OC(=O)c1cc(ccc1-c1ccccc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM60449

OC(=O)c1cc(ccc1-c1ccccc1C#N)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167371

OC(=O)c1cc(ccc1-c1ccccc1C=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167401

OC(=O)c1cc(ccc1-c1ccccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167385

OC(=O)c1cc(ccc1-c1ccccc1F)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167271

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1c(F)cccc1F

BDBM167263

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cc(Cl)ccc1Cl

BDBM167273

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cc(F)cc(F)c1

BDBM167259

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F

BDBM167278

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Br)cc1

BDBM167276

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Br)s1

BDBM167266

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167264

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)cc1

BDBM167261

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(Cl)cc1Cl

BDBM167269

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(F)c(Cl)c1

BDBM167274

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(F)c(F)c1

BDBM167252

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(F)cc1

BDBM167270

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(F)cc1F

BDBM167253

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(OC(F)(F)F)cc1

BDBM167254

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(OC(F)F)cc1

BDBM167287

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(cc1)C#N

BDBM167258

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc(cc1)C(F)(F)F

BDBM167285

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccc2OCCOc2c1

BDBM167277

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccc(Br)c1

BDBM167268

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccc(Cl)c1

BDBM167275

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccc(F)c1

BDBM167286

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccc(c1)C#N

BDBM167257

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccc(c1)C(F)(F)F

BDBM167294

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccccc1

BDBM167256

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccccc1C(F)(F)F

BDBM167262

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccccc1Cl

BDBM167272

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccccc1F

BDBM167288

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccccn1

BDBM167289

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccnc1

BDBM167295

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1cccs1

BDBM167290

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccncc1

BDBM167293

OC(=O)c1cc(ccc1-c1ccccc1[N+]([O-])=O)-c1nc(cs1)-c1ccsc1

BDBM60442

OC(=O)c1cc(ccc1-c1cccnc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM60443

OC(=O)c1cc(ccc1-c1ccncc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167393

OC(=O)c1cc(ccc1-c1ccsc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167334

OC(=O)c1cc(ccc1-c1cnc(O)nc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167352

OC(=O)c1cc(ccc1-c1cncc(Cl)c1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM60439

OC(=O)c1cc(ccc1-c1cncnc1)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167394

OC(=O)c1cc(ccc1-c1sccc1Cl)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167369

OC(=O)c1ccc(c(F)c1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM167306

OC1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(cc1C(O)=O)-c1nc(cs1)-c1ccc(Cl)c(Cl)c1

BDBM50110895

[NH4+].[NH4+].[NH4+].[NH4+].C[n+]1cn([C@@H]2O[C@H](CO[P@@]([S-])(=O)OP([O-])(=O)CP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50110843

[NH4+].[NH4+].[NH4+].[NH4+].C[n+]1cn([C@@H]2O[C@H](CO[P@@]([S-])(=O)OP([O-])(=O)OP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50110896

[NH4+].[NH4+].[NH4+].[NH4+].C[n+]1cn([C@@H]2O[C@H](CO[P@]([S-])(=O)OP([O-])(=O)CP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50110844

[NH4+].[NH4+].[NH4+].[NH4+].C[n+]1cn([C@@H]2O[C@H](CO[P@]([S-])(=O)OP([O-])(=O)OP([O-])([O-])=O)[C@@H](O)[C@H]2O)c2nc(N)nc([O-])c12 |r|

BDBM50110894

[NH4+].[NH4+].[NH4+].[NH4+].[BH3-][P@@](=O)(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1c[n+](C)c2c([O-])nc(N)nc12)OP([O-])(=O)CP([O-])([O-])=O |r|

BDBM50110892

[NH4+].[NH4+].[NH4+].[NH4+].[BH3-][P@@](=O)(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1c[n+](C)c2c([O-])nc(N)nc12)OP([O-])(=O)OP([O-])([O-])=O |r|

BDBM50110893

[NH4+].[NH4+].[NH4+].[NH4+].[BH3-][P@](=O)(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1c[n+](C)c2c([O-])nc(N)nc12)OP([O-])(=O)CP([O-])([O-])=O |r|

BDBM50110891

[NH4+].[NH4+].[NH4+].[NH4+].[BH3-][P@](=O)(OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1c[n+](C)c2c([O-])nc(N)nc12)OP([O-])(=O)OP([O-])([O-])=O |r|