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DRD3_chembl19_set.smi
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DRD3_chembl19_set.smi
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C[NH2+][C@H]([C@H](c1ccccc1)OC)C(=O)c2ccc(cc2)Br C04772790
CC[NH+](CC)C[C@@H](Cn1c2ccc(cc2c3c1CCCC3)C)O C00384443
Cc1ccsc1C[NH+](Cc2cccc3c2cccn3)C[C@@H](C)O C12185383
C[C@H](c1ccc(c(c1)F)F)[NH+](C)CCC(=O)Nc2ccccc2 C23668582
c1c(cc(c(c1C[NH2+]C2CC2)OC[C@@H]3CCCCO3)Cl)Cl C36230869
CCC[NH2+]Cc1c(nn(c1C)Cc2ccc(cc2Cl)Cl)C C36868634
CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc2c(cccc2Cl)Cl C37156413
c1cc[nH+]c(c1)CCN[C@@H](c2ccco2)c3ccc(s3)Cl C37201254
CC[C@@H](C)[NH2+][C@H](c1ccc(c(c1)Br)F)C(=O)OC C38066890
CCCn1cc[nH+]c1[C@H](c2cc(ccc2Br)F)NCC C41113773
C[C@H](c1cccc[nH+]1)N(C(C)C)C(=S)Nc2ccccc2Cl C00262022
c1cc(oc1)[C@H](c2ccc(s2)Cl)NCCc3cc[nH+]cc3 C48262091
CC(C)[NH2+]Cc1cccc(c1OCc2cscn2)Br C48795557
CC[C@@H](C)N(C)c1c(cc(cn1)Br)C[NH2+]C(C)(C)C C51438723
CC(C)(C)[NH2+]Cc1cc(cnc1N(C)CC(F)(F)F)Br C51447917
Cc1ccsc1C[NH+](C)[C@H](c2ccccc2)C(=O)NC(C)C C51735092
CC(C)NC(=O)[C@@H](c1ccccc1)[NH+](C)Cc2ccc(c(c2)F)F C52518477
Cc1csc(n1)[C@@H](c2cc(cc(c2)Cl)Cl)[NH2+]CCOC C53288541
Cc1csc(n1)[C@H](c2ccc(cc2Cl)Cl)[NH2+]CCOC C53288767
Cc1c(sc(n1)[C@H](c2cccc(c2Cl)Cl)[NH2+]CCOC)C C53291067
CC[NH2+]Cc1c(nc(s1)N(C)Cc2ccc(cc2)Br)C C55002431
C[C@H](c1ccc(s1)Cl)NC[C@@H](C(C)C)N2CC[NH+](CC2)C C40770242
c1cc(c[nH+]c1)CN(C2CCCC2)C(=S)NC3CCCCC3 C06615367
C[NH2+][C@H](c1ccc(cc1)CCOC)c2ccc(o2)Br C35467418
CC(C)Oc1ccc(cn1)C[NH2+]Cc2ccc(c(c2)Br)F C61046826
CCCn1cc[nH+]c1CNc2ccc(cc2C(F)(F)F)Cl C61877305
CCCn1cc[nH+]c1CNc2c(cccc2Cl)C(F)(F)F C61877534
c1ccc(cc1)CNC(=O)[C@H](Cc2cc[nH+]cc2)c3ccccc3 C62072534
C[C@H](c1ccccc1)NC(=O)[C@H](Cc2cc[nH+]cc2)c3ccccc3 C62074310
CC(C)[C@H](CC(=O)NCc1ccc[nH+]c1)c2ccc3c(c2)CCC3 C62080661
Cc1ncc(s1)COc2c(cc(cc2Cl)Cl)C[NH2+]C(C)C C62336706
C[C@@H](c1ccc(cc1Cl)Cl)[NH2+]Cc2nccn2CC(F)(F)F C57879346
CCCn1c(ccn1)[C@@H](Cc2cccc(c2)Br)[NH2+]C C69471213
Cc1ccsc1C[NH+](C)CC(=O)Nc2cccc(c2)SC C16346750
CCC(CC)C(=O)N1CCC(CC1)[NH2+]Cc2ccc(cc2F)F C69756392
CCCc1c(sc(n1)N2CCSC[C@@H]2C)C[NH2+]C(C)(C)C C70222264
C[NH2+]C[C@@H](c1ccccc1Br)O[C@H]2CCC[C@@H](C2)OC C70328271
Cc1c(scn1)C[NH2+]Cc2cc(ccc2OC(F)F)Cl C71212812
C[NH+](CCNCc1ccc(o1)I)C2CCCC2 C71376950
Cc1ccc(c(c1)C)[C@H](CN(C)[C@@H](c2ccccc2)c3cccc[nH+]3)O C72629460
C[C@H](CNC(=O)[C@](C)(c1ccccc1)[NH+](C)C)c2cccs2 C73855167
Cc1ccc(s1)C[C@H](C)NC(=O)[C@](C)(c2ccccc2)[NH+](C)C C73857002
CCS[C@@H]1CC[C@H](C1)[NH+](C)CC(=O)Nc2cccc(c2C)C C76071629
Cc1cccc(c1NC(=O)C[NH+](C)[C@H]2CCC[C@@H]2SC)C(C)C C76147120
Cn1c2ccccc2nc1CCC[NH2+]Cc3ccc(cc3F)F C76901153
Cn1c2ccccc2[nH+]c1CCNCc3ccccc3C(F)(F)F C76896311
CCN1CCN(CC1)[C@H](C)C[NH2+]Cc2cc(cc(c2)Cl)Cl C77328315
CCn1c2cccc(c2[nH+]c1CSC[C@H](c3ccccc3)O)F C77566527
CC[NH2+][C@H](C)c1ccc(cc1Cl)N(C)Cc2csc(n2)C C78907193
C[C@@H](C(OC)OC)[NH2+]C1CC(C1)c2cccc(c2)Br C79585029
Cc1cc(c(c(c1)C)S(=O)(=O)NCCSC(C)(C)C)C C02842299
COc1ccc(cc1)SCC(=O)Nc2ccc(cc2)SC C08049287
CC(C)NC(=O)Cc1csc(n1)SCc2ccccc2F C08939199
C=CCn1c(cnc1SCc2ccc(c(c2)Cl)Cl)CO C09650161
CC(C)(CNc1c(cc(cn1)C(F)(F)F)Cl)SCC#N C20385517
Cc1ccccc1[C@@H](CC(=O)NCc2ccccc2)n3cccc3 C20998797
CCCCN(C)[C@H](C)C(=O)Nc1ccc(c(c1)C)Br C25510078
CCN1CC[NH+](CC1)C[C@H](CO[C@@H]2C[C@@H](CC(C2)(C)C)C)[S-] C22863959
C[C@@H](c1ccc(c(c1)Cl)Cl)NS(=O)(=O)CCCCl C36881543
CC[C@@H](c1cccs1)Nc2ccccc2S(=O)(=O)C(F)F C37086418
CCCN[C@@H](Cc1ccc(cc1)Br)c2cnccn2 C37536080
C[C@H](c1ccc(s1)Br)N[C@@H](C(C)C)C(=O)OC C38002282
C[C@@H](CNC(=O)CBr)Oc1ccc(cc1)C(C)(C)C C41688649
CCCn1cc(cn1)[C@H](Cc2cccc(c2)Br)NC C43470035
c1cc(oc1)[C@@H](c2ccc(s2)Cl)NCCc3ccncc3 C48262090
Cc1ccc(o1)[C@H](C)NC(=O)CSCc2ccc(s2)Cl C48462275
CCc1ccc(s1)S(=O)(=O)N[C@@H](CC)c2cccs2 C48673933
C[C@@H](c1ccc(cc1)Br)NC(=O)CN(C)CC(C)C C49442506
CCNCc1cc(c(nc1)N(C)Cc2ccc(s2)Cl)Cl C51481936
CC[C@@H](C(=O)OCC)[C@](C)(c1ccc(cc1)Br)O C52250515
CCCNC[C@@H](c1ccccc1)n2c(c(c(n2)C)Br)C C52573754
Cc1csc(n1)[C@@H](c2cc(cc(c2)Cl)Cl)NCCOC C53288541
CCCN([C@@H](C)c1ccccc1Br)C(=O)[C@@H](C)NC C54075229
Cc1cccc(c1)NC(=S)N(Cc2ccccn2)C3CCCC3 C06898304
CCNCc1c(nc(s1)N(C)[C@H](C)c2ccc(cc2)Cl)C C62028135
Cc1ccc(cc1)Cc2c(nc(s2)CNC(=O)CC(C)C)C C62610130
C[C@H]([C@H](c1ccccc1S(=O)(=O)NC2CC2)C(C)C)Cl C63041030
c1cc(c(c(c1)F)CNCc2ccc(nc2)OC3CCCC3)F C69711746
CCCNCc1c(nc(s1)N2C[C@@H](S[C@H](C2)C)C)C3CC3 C70387046
CCCc1c(sc(n1)N2C[C@H](S[C@H](C2)C)C)CNC3CC3 C70387056
CCc1c(sc(n1)N2C[C@@H](S[C@H](C2)C)C)CNCC(C)C C70387115
C[C@H](C(C)C)NC(=O)CN(C)Cc1cc(cc(c1)Cl)Cl C71953588
C[C@H](C(=O)Nc1ccc(cc1)SC(F)F)OC2CCCC2 C72640929
Cc1cc(c(cc1C)CNCCS(=O)(=O)c2ccccc2F)C C73006682
C[C@@H](Cc1ccccc1F)NC(=O)[C@](C)(c2ccccc2)N(C)C C73032232
CC[C@@H](C1CCOCC1)NC(=O)[C@@H](C)Sc2ccc(cc2)C C74410136
CC[C@@H](C1CCOCC1)NC(=O)CSc2ccc(c(c2)F)F C74410274
Cc1c(sc(n1)CNC(=O)C[C@@H](c2ccccc2)C(C)C)C C75334530
Cc1cccc(c1)CNc2cccc(c2)CN(C)C(=O)C(F)(F)F C75678914
c1ccc(c(c1)CNCCc2cn3ccccc3n2)C(F)(F)F C75759830
C[C@@H](CSC)NC(=O)N(C)Cc1ccccc1C(F)(F)F C77799228
C[C@H](c1cccs1)SCC(=O)Nc2ccc(cc2)C(=O)C C77961782
C[C@H](c1ccccc1)NC(=O)CSc2ccc(c(c2)F)C(=O)C C78023787
C[C@@H](Cc1ccc(cc1)C(F)(F)F)C(=O)N[C@@H](C)[C@@H]2CCCO2 C78061660
CCc1ccc(cc1)[C@H](C)CC(=O)N[C@@H](C)c2nc(cs2)C C78108705
CCc1nc(cs1)[C@@H](C)NC(=O)[C@H](C)Cc2ccccc2F C78120110
Cc1c(c2ccccc2[nH]1)CC(=O)N(CC=C)Cc3ccccc3 C24501079
CCc1ccc(cc1)NC(=O)C[S@@](=O)[C@@H](C)c2cccc(c2)C C78749724
CCN(c1cccc2c1cccc2)C(=O)CS[C@@H](C)[C@H](C)O C79054737
CCN[C@@](CSc1ccc(cn1)Br)(C#N)C2CC2 C79446694
Cc1ccc2c([nH+]1)cc(o2)C(=O)N(Cc3ccccc3)Cc4ccccc4 C08798453
c1cc(ccc1n2cc[nH+]c2SCC(=O)N3CCCCCC3)Br C10884744
Cc1c(nc(o1)c2ccccc2F)C[NH+](C)Cc3cccc4c3ccnc4 C12024799
c1ccc2c(c1)CC[C@H](C2)[NH+]3CCC(CC3)n4c5c(cccn5)nc4C6CCC6 C11913436
Cc1c(c(c(c(c1C)C)S(=O)(=O)N2CCC[C@@H]2c3cc[nH+]cc3)C)C C12563039
Cc1c(nc(o1)c2cccc(c2F)F)C[NH+](C)C[C@@H]3Cc4ccccc4O3 C12756473
C[C@H](C(=O)N1CCc2c1cccc2)Sc3[nH+]cc(n3C)c4ccccc4 C05175102
CC(=O)N1Cc2ccccc2OC3(C1)CCC(CC3)[NH+](C)C[C@@H]4CCC=CC4 C19019845
Cc1cc(cc(n1)[C@H]2CCC[NH+]2Cc3ccnn3C)Cc4cccc(c4)F C19691992
CC1CCN(CC1)c2[nH+]cc3c(n2)CCN(C3)Cc4cc(cc(c4)F)F C21039600
c1cc2c(cc1S(=O)(=O)N3CCC(CC3)c4cc[nH+]cc4)CCCC2 C21114775
Cc1ccc(c(c1)CN(c2ccccc2)C3=[NH+][C@@H]4CS(=O)(=O)C[C@@H]4S3)C C21167330
Cc1ccc2[nH+]c(cn2c1)CN3CCC[C@@H](C3)c4nc5ccccc5s4 C24001810
c1ccc2c(c1)c(nc([nH+]2)c3ccsc3)N4CCC[C@@H]4c5cccnc5 C24534468
C[NH+](C)CCN(c1nc2ccccc2s1)C(=O)c3ccc(c(c3)F)F C36640640
CCOC(=O)C1=C([C@H](S[C@H]1/N=C/[C@@H]2C(=c3ccccc3=[NH+]2)Cl)C)C C38889883
Cc1c(cccc1C(F)(F)F)C2=NN=C3[C@H]2C[NH+](CC3)C4CCOCC4 C39543006
c1ccc(cc1)C(=O)N2C[NH+](Cc3c2sc4c3CCCC4)C[C@@H]5CCCO5 C39853671
CC[C@@H](C)Cn1c2ccccc2[nH+]c1[C@H]3CC(=O)N(C3)c4ccc(cc4)F C40256288
CN(C)c1ccc(c[nH+]1)C(=O)Oc2ccc(cc2)I C48675111
Cc1ccc2[nH+]c(cc(=O)n2c1)CN(C)Cc3ccc(s3)Br C52710194
c1ccc(cc1)c2[nH+]c3c(c(n2)N4CCN(CC4)[C@H]5CCSC5)CCC3 C55575805
Cc1ccc2cccc(c2[nH+]1)OS(=O)(=O)c3ccc(s3)Br C25653585
Cc1c(ccc2c1O/C(=C\c3cc[nH+]cc3)/C2=O)OCc4ccc(cc4)F C41435522
CN1CCN(CC1)[C@H]2N=C(CS2)C3=c4ccccc4=[NH+][C@@H]3c5ccccc5 C39758601
c1ccc(c(c1)c2ccc(o2)[C@H]3[C@@H](O3)C(=O)C4=c5ccccc5=[NH+]C4)Cl C39946098
c1ccc2=[NH+][C@@H]3[C@H](N(CCC3=c2c1)C(=O)CC4=CCCCC4)c5ccccn5 C64131495
COc1cccc(c1)[C@@H]2[C@@H]3C(=c4ccccc4=[NH+]3)CCN2Cc5nccs5 C64640402
COc1cc(ccc1F)[C@@H]2[C@H]3C(=c4ccccc4=[NH+]3)CCN2Cc5nccs5 C64651124
Cc1cc(c(cc1C)c2c([nH+]cn2CCn3ccnc3)c4ccccc4)C C65385606
Cc1c[nH+]c(c(c1OC)C)CN(C)C(=O)c2ccc-3c(c2)Cc4c3cccc4 C58958174
CC(C)Cc1nc(on1)C[NH+]2CCc3c(ccs3)[C@H]2c4cccs4 C22532848
Cc1c(c(ccc1[C@@H]2[C@@H](N=C3N2CCS3)c4ccccn4)[NH+]5CCCC5)C C68561756
Cc1cc(c(cc1C)/C=C/C(=O)N2CCC[C@@H](C2)C[NH+]3CCOCC3)C C69710820
Cc1ccc(cc1)S(=O)(=O)C[C@H]2CSc3n2c4cc(c(cc4[nH+]3)C)C C19829147
Cc1ccc(c(c1Cl)Cl)c2[nH+]ccn2C[C@@H]3CC(=O)N(C3)C4CC4 C71721279
Cc1ccccc1c2cccc(c2)c3[nH+]ccn3C[C@H]4CCS(=O)(=O)C4 C71776417
C[C@@H](c1cc[nH+]cc1)N(C)C(=O)c2csc(n2)c3ccc(cc3)Cl C47278323
CC(=O)c1ccc(s1)C(=O)N2C[C@@H]([C@@H]3[C@H]2C4CC[NH+]3CC4)c5ccccc5 C72134632
Cc1cc(cc(n1)[C@@H]2CCC[NH+]2Cc3ccnn3C)Cc4ccc(cc4)F C72372458
C[C@@H]1CCCC[NH+]1C[C@@H]2CCCN(C2)C(=O)/C=C/c3cccc4c3nccc4 C72808253
Cc1c2ccccc2sc1C(=O)N(Cc3ccc[nH+]c3)Cc4ccco4 C73784232
C[NH+](Cc1nnc(o1)c2ccccc2Br)CC3CCCCC3 C44715052
c1ccc(c(c1)c2nnc(o2)C[NH+]3CCC[C@@H]3c4ccccc4Cl)F C75642777
C[C@@H]1[C@@H]([NH+](CCS1)Cc2nnc(o2)c3cccc(c3)F)c4ccccc4 C75749123
Cc1ccc(cc1)[C@@H]2CN(C[C@H]2[NH+](C)C)C(=O)c3c(cc(s3)C)OC C77439480
Cc1ccc(cc1)c2nc(=S)n(c(=S)n2C)/C(=[NH+]/C)/c3ccc(cc3)C C13685801
Cc1c2ccccc2[nH+]c(c1CC(=O)N(Cc3ccc(cc3)C#N)C(C)C)C C78281066
c1nc(c2c3c(sc2n1)CCCC3)N4CC[C@@H](C4)C[NH+]5CCCCC5 C78424883
c1cc2c(cc1Br)[C@H](CCO2)OC(=O)/C=C/c3cc[nH+]cc3 C79167812
CCCOCCOC(=O)C1[C@@H](C2=C(CC(CC2=O)(C)C)N=C1C)c3cc[nH+]cc3 C04684556
C/C(=[NH+]\CCc1cccs1)/C2C(=NN(C2=O)c3ccccc3)CC(=O)OC C04736922
CCOc1cccc2c1nc(s2)N(CCC[NH+](C)C)C(=O)c3ccc(cc3)C#N C05122391
CCOC(=O)COc1c(c(c2c(n1)-c3ccccc3CC2)c4cc[nH+]cc4)C#N C08382977
CCOC(=O)CN(c1ccc(cc1)C)C(=O)CSc2c(c(cc([nH+]2)C)C)C#N C08653865
Cc1cc(c(n1c2cc(on2)C)C)C(=O)CSc3[nH+]c(c(n3C4CCCC4)C)C C07140244
CCCc1c[nH+]c2c(c1OCCC)c(=O)n(c(=O)n2C)Cc3ccccc3C C09649700
C[NH+](C)CCN(c1nc2c(ccc(c2s1)OC)OC)C(=O)Cc3cccs3 C10061724
C[NH+](CCOc1ccc(cc1)OC)Cc2nnc(o2)c3cc4c(s3)CCCC4 C12799729
c1cc(c2c(c1)sc(n2)N(CCCn3cc[nH+]c3)C(=O)c4ccc(cc4)C#N)F C07424489
COc1cccc(c1)C(=O)N(Cc2ccc[nH+]c2)c3nc4c(cccc4s3)OC C05142115
CN(Cc1cc[nH+]c2c1cccc2)C(=O)c3cc(on3)COc4ccc(cc4F)F C12319974
CCn1ccc(n1)C(=O)N(CCC[NH+](C)C)c2nc3c(s2)cccc3Cl C13702269
CCn1c(cc(n1)C(=O)N(CCC[NH+](C)C)c2nc3c(cccc3s2)F)C C13703033
CCn1c(c[nH+]c1SCc2nnnn2c3ccccc3)c4ccc(cc4)C C26676122
C[C@H]1CCc2c(sc3c2c(=O)n(c(n3)C[NH+](C)C)[C@@H](C)C(=O)OC(C)C)C1 C36069289
Cc1ccc2c(c1)sc(n2)N(CCC[NH+](C)C)C(=O)c3ccnn3C(C)C C38506865
CC(C)n1c(ccn1)C(=O)N(CC[NH+](C)C)c2nc3c(cc(cc3s2)F)F C38506901
CC[NH+](CC)CCN(c1nc2c(cccc2s1)C)C(=O)c3c(cnn3C)C C38507170
Cc1cc(nn1C(C)C)C(=O)N(CC[NH+](C)C)c2nc3ccc(cc3s2)F C38508908
C[NH+](C)CCCN(c1nc2c(cccc2s1)F)C(=O)c3ccc4c(c3)nccn4 C36645303
CCOc1ccc2c(c1)sc(n2)N(CCCn3cc[nH+]c3)C(=O)C4CCCC4 C38847852
CC(C)C(=O)N(C[C@H]1C=c2cc(ccc2=[NH+]C1=O)OC)c3ccc(cc3)OC C38959761
CCCCN(C[C@@H]1C=c2cc(ccc2=[NH+]C1=O)OC)S(=O)(=O)c3ccccc3 C38994786
CC(C)CN(C[C@H]1C=c2ccccc2=[NH+]C1=O)S(=O)(=O)c3ccc(cc3)OC C39012551
C[C@H](c1nnc(n1c2ccc(cc2)Cl)SCC(=O)OC(C)C)[NH+](C)C C36855704
CCCC[NH+](Cn1c(=S)n2c3ccccc3c(=O)n(c2n1)C)[C@H](C)CC C54472096
CC[NH+](Cc1ccccc1Cl)Cn2c(=O)c3c(cn2)cn(n3)c4ccccc4 C57086531
Cn1c(=O)c2ccccc2n3c1nnc3C[NH+](CC=C)Cc4ccc(s4)Cl C58013815
Cc1c(c(no1)c2ccccc2)c3nnc(o3)C[NH+](C)[C@@H](C)c4ccc(cc4)F C16431413
C[C@@H]1C[C@H](CN(C1)c2nnc(n2Cc3ccco3)SCCc4cc[nH+]cc4)C C58635280
CCOC(=O)c1ccc(cc1)/[NH+]=C/c2cc(c(o2)N3CCOCC3)Br C59678993
c1ccc2c(c1)c(=O)n(cn2)c3ccc(cc3)C(=O)OCCCc4ccc[nH+]c4 C60749159
Cc1c(ccc2c1O/C(=C\c3cc[nH+]cc3)/C2=O)OCC(=O)c4ccc(cc4)OC C41437588
C[C@@H](C(=O)N(c1nccs1)C2CCCCC2)OC(=O)C3=c4ccccc4=[NH+]C3 C38690230
CC(C)CC1=C[C@H](N=N1)CN2CCC[C@@H](C2)[NH+]3CCc4cc(c(cc4C3)OC)OC C39387798
c1ccc(cc1)[C@H](C(=O)C2=c3ccccc3=[NH+]C2)OC(=O)c4cn5ccccc5n4 C39756455
CC[NH+](CC)[C@@H](Cn1cnc(c1c2cnn(c2C)C)c3ccccc3)c4ccco4 C65429227
CC[NH+](Cc1ccc(o1)S(=O)(=O)N(C)C)[C@H](C)c2cc3ccccc3o2 C66434433
C[C@@H](Cc1nnc(o1)SCc2cc(=O)n3ccsc3[nH+]2)c4ccccc4 C28867665
Cc1ccc(s1)C[NH+](Cc2ccco2)Cc3nnc(o3)c4ccc(cc4)OC C69174356
Cc1cc(cc(c1)n2cc[nH+]c2SCC(=O)N3CCC(CC3)C(=O)OC)C C07056342
CC(C)OC(=O)Cc1nc(cs1)C[NH+]2[C@@H]3CCCC[C@@H]3C[C@@H]2C(=O)OC C69923641
Cc1c(nc(o1)c2cccc(c2)Oc3ccccc3)C[NH+](C)Cc4ccncn4 C71681351
Cn1cc[nH+]c1COc2ccc(cc2)C(=O)/C=C/c3cc4cccc(c4o3)OC C71937461
CCc1nc(on1)[C@@H](C)Sc2[nH+]cc(n2C[C@@H]3CCCO3)c4ccccc4 C72000790
Cc1c(nc(o1)c2ccccc2)CC(=O)OCc3[nH+]ccn3Cc4ccccc4 C72015808
C[C@H]1CCCN(C1)c2ncc(cn2)c3cncn3Cc4ccccc4C[NH+](C)C C72391890
CC[NH+](CC)C[C@@H]1CCN(C1)c2c3c(c(sc3ncn2)C(=O)OCC)C C78559764
CCc1cc(=O)n2c([nH+]1)sc(n2)N(Cc3cccc(c3)C)Cc4ccco4 C79076434
CCOc1ccc(cc1)[C@@H]2C(=C(N=C3N2C(=O)[C@H](S3)C)C)C(=O)OCC C02487346
Cc1csc2n1c(=O)cc(n2)CSc3nnc(n3CC=C)c4ccccc4 C04563109
COc1cc(ccc1OCC=C)/C=N/n2cnc3c(c2=O)c4c(s3)CCCC4 C02123583
CCOC(=O)[C@@H]1[C@@H](C2=C(C[C@H]([C@@H](C2=O)C(=O)OC)C)N=C1C)c3ccccc3 C04719611
CCOC(=O)[C@@H]1[C@@H](C2=C(C[C@H]([C@H](C2=O)C(=O)OC)C)N=C1C)c3ccccc3F C04719644
Cc1c(c(on1)C)CSc2nc3c(c(cs3)c4ccco4)c(=O)n2CC=C C01099192
Cc1ccc(cc1)Cn2c(c(c(n2)C)C(=O)OCC(=O)N3CCCC[C@@H]3C)Cl C04779103
CCOC(=O)c1c(c2cc(ccc2o1)Br)CSc3nncn3C C03396549
CN(C1=NS(=O)(=O)c2c1cccc2)/N=C/c3ccc(cc3)OCc4ccccc4 C01099754
Cc1cc(c(n1c2cc(cc(c2)Cl)Cl)C)C(=O)COC(=O)c3cnccn3 C06486539
CCn1c(nnc1SCC(=O)c2ccc(cc2Cl)Cl)c3cnccn3 C03295785
CCCOc1ccc(cc1)[C@@H]2C(=C(N=C3N2C(=O)[C@@H](S3)C)C)C(=O)OC C06593419
Cc1c(c(on1)C)COC(=O)/C=C/c2c(nn(c2Cl)c3ccc(cc3)F)C C07061154
CCCCc1nc2c(c(n1)S[C@@H](C)c3ccccc3)c(=O)n(c(=O)n2C)C C07392243
CCCCc1nc2c(c(n1)SCc3ccccc3Cl)c(=O)n(c(=O)n2C)C C07392304
CCN(CC)S(=O)(=O)c1ccc(cc1)C2=N/C(=C\c3cccc(c3)C)/C(=O)O2 C08180104
CC(C)[C@@H](C(=O)OCc1cccc2c1nccc2)N3C(=O)c4ccccc4C3=O C10539680
C[C@@H](c1ccon1)N(C)C(=O)c2ccc3c(c2)nc(o3)CCc4ccccc4 C12203741
C[C@H]1C=C2C([C@H](C(C(=N2)C)C(=O)OC(C)C)c3cccs3)C(=O)[C@H]1C(=O)OC C12319909
CCN(CC)S(=O)(=O)c1cccc(c1)C2=N/C(=C\c3ccc(cc3)F)/C(=O)O2 C12734670
CCn1ccc(n1)C(=O)/N=c\2/n(c3c(cc(cc3s2)F)F)CCOCC C13702821
CC(C)c1cc(c2cnn(c2n1)C(C)C)C(=O)N(C)Cc3ccc(cc3)N(C)C C23744823
Cc1cccc(c1C)n2c(nnn2)S[C@H](C)C(=O)N(C)Cc3ccccc3 C24270534
CC(=O)N(c1ccccc1F)c2nc(cs2)COC(=O)C3(CCCC3)C#N C24841460
CCN(CC)S(=O)(=O)c1cccc(c1)C2=N/C(=C\c3c(ccs3)C)/C(=O)O2 C24929116
C=CCn1c(nnc1SCc2cc(=O)n3ccsc3n2)c4ccccc4 C03543120
C[C@H]1CCc2c(sc3c2c(=O)n(c(n3)CN(C)C)[C@@H](C)C(=O)OC(C)C)C1 C36069289
CN(C)c1ccc(cc1[N+](=O)[O-])C(=O)N(C)C(c2ccccc2)c3ccccc3 C36751388
CCCn1c(nnc1S[C@@H](C)C(=O)N2C[C@H](C[C@@H](C2)C)C)c3ccncc3 C36832744
Cc1nc(on1)[C@@H](C)Sc2nnc(n2c3ccccc3)Cc4cccs4 C36694716
Cc1cc(n2c(n1)nc(n2)SCc3nnc(s3)SCc4ccccc4)C C00680271
Cc1ccc(o1)CN(C)C(=O)c2cc(on2)COc3ccc(cc3Cl)F C12200159
CCOc1ccc2c(c1)sc(n2)N(Cc3ccncc3)C(=O)c4ccco4 C38827860
C[C@H]1C(=C(N=N1)C)CCN(C)c2nc(cnn2)c3ccc(cc3)C(F)(F)F C39420752
C[C@@H](CN1C[C@@H](CC1=O)c2nc(on2)c3cccc(c3)N(C)C)c4ccccc4 C44429656
CCN(C[C@@H](C)C#N)C(=O)Cn1cnc2c(c1=O)c(c(s2)c3ccccc3)C C53576371
Cc1cccc(c1n2c(nnn2)SCC(=O)N(C)[C@@H](C)c3ccccc3)C C11619059
Cc1ccc(cc1)COC(=O)Cc2c(nc3nc(nn3c2C)C(F)(F)F)C C11598176
CCOc1nnc(s1)CSc2nnc3n2cc(cc3Cl)C(F)(F)F C59933636
Cc1ccc(o1)/C=C/C(=O)N(Cc2nnc(o2)c3ccccc3Cl)C(C)C C16011191
Cc1cc(cc2c1C(=O)/C(=C/c3ccc(cc3)N(C)C)/O2)O[C@H](C)C(=O)OC C41499511
Cc1c(sc2c1c(ncn2)S[C@@H](C)C(=O)C3=NC(=C([C@H]3C)C(=O)OC)C)C C63726395
CN(CCc1nc(on1)c2ccccc2)S(=O)(=O)c3ccccc3Cl C64841247
c1cc(sc1)Cc2nnc(o2)SCc3nc(on3)c4ccc(cc4)F C66261619
CC(C)N(C)S(=O)(=O)c1ccc(c(c1)C(=O)Oc2ccc(cc2)C#N)Cl C66324659
CC[C@H](C)[C@H](C)N(C1CC1)C(=O)c2c(n(nn2)c3cccc4c3nccc4)C C67170366
C[C@H](c1nnc(o1)c2cccs2)Sc3nnc(o3)Cc4ccccc4F C67955438
CN(C)S(=O)(=O)c1cccc(c1)CSc2nnc(o2)c3ccccc3 C06907057
Cc1cc(c(c2c1C(=O)N([C@@H]2C#N)Cc3ccc(cc3)C(=O)OC)C(C)C)OC C71682207
Cc1c2c(nc(n1)[C@@H]3CCCN3C(=O)CCOC)N(CCC2)CC4CCCCC4 C72373748
CCCOC(=O)C1=C(N=C2C[C@H](CC(=O)C2[C@H]1c3cccnc3)c4ccccc4)C C04044075
CC1=C([C@@H](N2C(=O)CCSC2=N1)c3ccc(cc3)Br)C(=O)OCC=C C02484759
C[C@@H]1C(=O)N2[C@@H](C(=C(N=C2S1)C)C(=O)OCC(C)C)c3ccc(cc3)SC C02463338
C[C@H]1CCc2c(sc3c2c(=O)n(c(n3)SCC(=O)N4CCCCC4)CC=C)C1 C00724012
CCOC(=O)c1ccc(cc1)n2c3c(cc(cn3)C(F)(F)F)nc2C(F)(F)F C01503372
Cc1cc2c(cc1C)oc3c(c2=O)[C@H](N(C3=O)CCOC)c4ccc(cc4)SC C02703652
CC[C@H](C)N1C(=O)/C(=C\c2cn(c3c2cccc3)Cc4ccccc4C#N)/SC1=O C04648586
CCCn1c(=O)c2c3c(sc2nc1SCC(=O)N4C[C@H](C[C@@H](C4)C)C)CCC3 C05212581
Cc1c(sc2c1c(=O)n(c(n2)SCC(=O)N3[C@H](CCC[C@@H]3C)C)CC=C)C C03319275
CCN(c1ccccc1)C(=O)Cn2cnc3c(c2=O)c(cs3)c4ccc(cc4)F C05556825
CN([C@@H]1CCS(=O)(=O)C1)C(=O)COc2ccc(cc2)C34CC5CC(C3)CC(C5)C4 C06788285
Cc1c(c(n(n1)c2ccccc2)Cl)C(=O)N(C)Cc3ccc(cc3)OC(F)F C06869888
Cc1cc(c(n1C)C)C(=O)CSc2nc3cc(ccc3c(=O)n2CC=C)Cl C06903106
CC1=C([C@H]([C@H]2C(=N1)C[C@@H](CC2=O)c3ccccc3)c4cccnc4)C(=O)OC(C)C C00848053
Cc1ccc(c(c1)C)N2C(=O)/C(=C/c3cc(c(c(c3)OC)OC)OC)/SC2=S C01216086
CCOC(=O)[C@@H]1CCCN(C1)C2=NC(=O)/C(=C/c3ccc(cc3)Br)/S2 C09188894
CS(=O)(=O)c1ccc(cc1)C(=O)N(Cc2ccccc2)c3nc4ccccc4s3 C09524306
Cc1cc(cc(c1)n2c(=O)c3c(nc2SCCC4OCCO4)C[C@H](S3)C)C C09648025
C[C@@H]1Cc2c(c(=O)n(c(n2)SCC(=O)N(C)c3ccccc3)c4ccccc4)S1 C10617087
c1ccc(cc1)[C@H]2CSc3ccccc3N2C(=O)CSc4nncn4C5CC5 C10649286
Cc1c(c(n(n1)c2ccccc2)C)CCC(=O)N3CCC[C@H]3c4nc5ccccc5s4 C12678225
c1cc(cc(c1)Br)/C=C/C(=O)c2ccc(cc2)S(=O)(=O)N3CCOCC3 C12818100
Cn1cncc1S(=O)(=O)/C(=C/c2ccccc2Sc3ccc(cc3)Cl)/C#N C01037618
Cc1ccc(cc1)CN(C)C(=O)Cn2c(nc3c(c2=O)cc(s3)c4ccccc4)C C13016584
CCn1cnnc1SCC(=O)c2cc(n(c2C)c3cc(cc(c3)Cl)Cl)C C07371860
CN1c2ccc(cc2CC1=O)C(=O)CSc3nc4c(n3c5ccccc5)CCCC4 C07099680
Cc1cc(cc(c1CSc2nnc(o2)C[C@H]3CCS(=O)(=O)C3)C)C(C)(C)C C21625272
c1ccc(c(c1)OCC(=O)N(C[C@H]2CCCO2)c3nc4c(cccc4s3)F)F C22889015
C[C@@H](c1ccccc1)N(C)C(=O)Cn2cnc3c(c2=O)c(cs3)c4ccc(cc4)F C22984334
C[C@H](c1nnc(n1c2ccc(cc2)F)S[C@H]3CCCCC3=O)N4CCCCC4 C23483006
CC(C)c1ccccc1N\2[C@H]3CS(=O)(=O)C[C@H]3S/C2=N\C(=O)CCC4CCCC4 C32507949
Cc1c(cnn1c2ccc(cc2)Br)C(=O)N(C)[C@@H](C)c3ccc(cc3)OC C32752820
C[N+](C)(CCN1C(=O)[C@H]2[C@H](C=C[C@H]([C@@H]2C1=O)c3ccccc3)c4ccccc4)[CH-]C#N C15276684
Cc1c(cco1)c2nn(c(=S)n2c3ccccc3)CN4CCC[C@@H](C4)C(F)(F)F C36705990
C[C@@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@@]4([C@@H]3CC[C@@H]4OC(=O)CCN5CCOCC5)C C33928787
c1cc2cccnc2c(c1)OCc3nnc(o3)SCc4c(cccc4Cl)F C01223324
Cc1ccccc1[C@H]2C=NN=C2C3CCN(CC3)C(=O)CSc4nc(cs4)C C39445195
CCN(Cc1cccc(c1)F)C(=O)c2cc(nc3c2cnn3Cc4cccs4)C C39555071
c1ccc(cc1)c2nc(cs2)CC(=O)N([C@@H]3CCS(=O)(=O)C3)C4CCCCC4 C32925895
c1cc(ccc1c2nc(no2)[C@H]3CC(=O)N(C3)c4ccc(cc4)C(F)(F)F)C(F)(F)F C44423278
C[C@@H]1C[C@@H]1c2ccc(o2)CN(Cc3ccco3)C(=O)c4ccc(o4)Br C47132469
c1cc(c(cc1Cl)Cl)c2csc(n2)N(C[C@@H]3CCCO3)C(=O)[C@@H]4CCCO4 C57337004
COc1cc(ccc1OC(F)F)/C=C\2/C(=O)OC(=N2)c3cccc(c3)Br C28454274
CCN(CC)C(=O)CSc1nc2ccsc2c(=O)n1c3ccc(c(c3)C)F C57428606
CCC(CC)C(=O)/N=C/1\N([C@@H]2CS(=O)(=O)C[C@@H]2S1)c3ccccc3C(C)C C32507985
c1ccc(cc1)CS[C@H]2CC(=O)N(C2=O)c3ccc(cc3)c4nc5ccccc5o4 C00689537
Cc1c(n2ccc(cc2n1)Cl)C(=O)N(CCc3ccccn3)Cc4ccccc4 C71468717
CC[C@@H]1c2ccsc2CCN1C(=O)Cc3ccc(s3)S(=O)(=O)N4CCCC4 C71807034
c1ccc2c(c1)c(=O)n(cn2)CC(=O)N(Cc3cccs3)c4ccc(cc4F)F C55751672
Cc1c2cc(ccc2oc1C(=O)N(Cc3cccnc3)C[C@H]4CCCO4)Br C71981705
c1ccnc(c1)CSc2c(c(cc([nH+]2)c3ccc4c(c3)OCCO4)C(F)(F)F)C#N C00971480
CC1=NC2=C([C@@H](C1C(=O)OCCc3ccccc3)c4ccc[nH+]c4)C(=O)CC(C2)(C)C C01196688
CC(=O)c1ccc(cc1)C(=O)N(CC[NH+](C)C)c2nc3c(cc(cc3s2)F)F C05121741
CC1=C([C@@H]([C@H]2C(=N1)CC(CC2=O)(C)C)c3cccc[nH+]3)C(=O)OCCc4ccccc4 C00801131
CCOc1cccc2c1nc(s2)N(Cc3ccc[nH+]c3)C(=O)Cc4cccs4 C10060738
c1cc[nH+]c(c1)CSc2nc3c(c(=O)n2c4ccc(cc4)OC(F)(F)F)SCC3 C10457548
CC(C)c1ccc(cc1)N2[C@H]3CS(=O)(=O)C[C@H]3[NH+](CC2=O)CCc4ccccc4F C12000579
Cc1cnc(nc1[C@H]2CCCN(C2)C(=O)Cc3ccsc3)SCc4ccc[nH+]c4 C12149093
C[C@@H](c1nccs1)[NH+](C)Cc2cn(nc2c3ccc(cc3)Oc4ccccc4)C C12584000
CC[C@H]1CCCCN1C(=O)Cn2c3cnccc3[nH+]c2SCc4cccc(c4)F C06752224
CSc1cccc(c1)C(=O)N(CCCn2cc[nH+]c2)c3nc4ccc(cc4s3)F C10581719
Cc1cc(ccc1OC)CC(=O)N(Cc2ccc[nH+]c2)c3nc4ccccc4s3 C12663292
C[NH+](CC12CC3CC(C1)CC(C3)C2)[C@H]4CCc5c(c(nn5CC=C)C(=O)N(C)C)C4 C14740683
C=CCN1CCN(C[C@@H](C1=O)Cc2cccc(c2)c3cc[nH+]cc3)C(=O)Cc4ccccc4 C19015527
C=CCN1CCN(C[C@@H](C1=O)Cc2ccccc2c3cc[nH+]cc3)C(=O)C4CCCC4 C19015649
CC(C)(C)CC(=O)N1CCN(C(=O)[C@@H](C1)Cc2cccc(c2)c3cc[nH+]cc3)CC=C C19082663
CC(C)CC(=O)N1CCN(C(=O)[C@@H](C1)Cc2ccccc2c3ccc[nH+]c3)CC=C C19446459
C/C(=C\c1ccccc1)/C[NH+](C)Cc2ccc(cc2)[C@H]3CN(C[C@@H]3C(=O)N(C)C)C(=O)C C19699187
Cc1cc(cc([nH+]1)C2CCN(CC2)C(=O)[C@@H](C)N3CCCC3=O)Cc4ccc(cc4)Cl C19691597
C[NH+]1CCC[C@@H](C1)CN(C)Cc2cn(nc2c3ccc(cc3)OC)c4ccccc4F C14954868
Cn1c(nnc1SCc2ccccc2)[C@H]3CCCN(C3)Cc4ccc5c(c4)ccc[nH+]5 C20256315
C[NH+](Cc1cccc(c1)F)CC(=O)N(Cc2cccs2)c3ccc4c(c3)OCCO4 C24071729
Cc1ccccc1n2c(nn(c2=S)C[NH+](C)[C@@H]3CCc4c3cccc4)c5ccncc5 C25452858
CN(c1ccc(cc1)F)C(=O)CSc2[nH+]c3ccccc3n2Cc4ccncc4 C33050525
CCn1cc[nH+]c1CN(C)Cc2cn(nc2c3ccc(cc3)F)c4ccc(cc4)C C11663136
CCOc1ccc2c(c1)sc(n2)N(CC[NH+](C)C)C(=O)c3ccc(cc3F)F C36641370
Cc1c(ccc2c1nc(s2)N(CC[NH+](C)C)C(=O)c3c(nc(s3)C)C)Cl C36643031
Cc1ccc(c2c1nc(s2)N(CCC[NH+](C)C)C(=O)c3c(nc(s3)C)C)C C36645381
Cc1cccc2c1nc(s2)N(CCCn3cc[nH+]c3)C(=O)c4ccc(c(c4)F)F C38847661
Cc1c(scn1)C(=O)N(C[C@H]2CCCO2)CC3CC[NH+](CC3)C4Cc5ccccc5C4 C39455219
CCN(C[C@@H]1C=NN=C1c2cccc(c2)F)CC3CCN(CC3)C4CC[NH+](CC4)C C39485624
CC[C@@H]1Cc2c(nc(n(c2=O)CC=C)SCC(=O)C3=c4ccccc4=[NH+]C3)S1 C39745932
c1ccc2c(c1)cccc2OCCn3c4ccccc4[nH+]c3[C@@H]5CC(=O)N(C5)C6CC6 C40182932
c1ccc(cc1)c2cc(c3ccccc3n2)C(=O)N(Cc4ccc[nH+]c4)Cc5ccco5 C58604329
Cc1cc(cc(c1OCC(F)(F)F)C)C[NH+](C)Cc2cc(=O)n3ccccc3n2 C54396004
COc1cc(ccc1SC)C(=O)/C=C/c2cn(nc2c3cc[nH+]cc3)c4ccccc4 C60245366
C[C@@H]1C[C@@H](CN(C1)C(=O)Cc2csc(n2)c3ccc(cc3)CN4CC[NH+](CC4)C)C C62042715
Cc1ccc2=[NH+]C(=O)C3=C[C@H](SC3=c2c1)C(=O)N(CCC(C)C)Cc4ccco4 C63494538
CC(C)n1cc(cn1)[C@H]2[C@H]3C(=c4ccccc4=[NH+]3)CCN2Cc5ccc(cc5F)OC C64053748
COC(=O)CCCC(=O)N1CCC2=c3ccccc3=[NH+][C@H]2[C@H]1c4c(cccc4Cl)F C64061621
CCc1ccc(cc1)[C@@H]2[C@@H]3C(=c4ccccc4=[NH+]3)CCN2C(=O)CN5CCN(CC5)CC C64066839
CCc1ccc(cc1)[C@H]2[C@H]3C(=c4ccccc4=[NH+]3)CCN2C(=O)CN5CCN(CC5)CC C64066843
CCOc1ccc(cc1)C[NH+](C)Cn2c(=S)n(c(n2)c3ccccc3Cl)C C16350131
C[NH+](Cc1ccc(s1)Br)Cn2c(=S)oc(n2)Cc3ccc(cc3)OC C18898663
Cc1csc2n1c(=O)cc([nH+]2)COC(=O)[C@H]3C[C@@H]3c4ccccc4C(F)(F)F C70038525
Cc1c(n2ccc(cc2n1)Cl)C(=O)N(CCc3cccc[nH+]3)Cc4ccccc4 C71468717
C[NH+](CCN(C)C(=O)c1cc(nc2c1cccc2)c3ccncc3)C4CCCCC4 C71941830
c1cc([nH+]c(c1)C2CCN(CC2)C(=O)c3cnccn3)Cc4ccc(cc4)C(F)(F)F C72349228
Cc1cc(cc([nH+]1)[C@H]2CCCN2Cc3cnc(nc3)N(C)C)Cc4ccc(cc4)F C72372455
CCn1c(c(cn1)CN2CCC[C@@H]2c3cc(cc([nH+]3)C)Cc4cccc(c4)OC)C C72372456
CCCOc1c(cc(cc1Br)C[NH2+]CC=C)OCC C20932420
CCC[C@H](c1ccccc1)C(=O)NC[C@H](c2ccccc2)[NH+](C)C C33028943
CC[C@H](c1ccc(cc1)Br)[NH2+][C@@H](CC(C)C)C(=O)OC C36980223
CCCC[C@@H](CC)CN[C@@H](c1cccs1)c2[nH+]ccn2C C37219414
CCCCCC[C@H](C)N[C@@H](c1cccs1)c2[nH+]ccn2C C37318052
CC[C@@H](C)[C@H](C(=O)OC)[NH2+]C(c1cccs1)c2cccs2 C37313208
C[C@H](CCCC(C)C)N[C@H](c1cccs1)c2[nH+]ccn2C C37231692
CC[NH+](CC)[C@H](C)CNC(=O)C[C@@H](c1ccc(cc1)C)C2CC2 C40652799
CC[NH2+][C@](CSc1cccs1)(c2ccccc2)C(=O)OC C45553213
CC[NH+](CC)C[C@H](C)N[C@@H](C)c1c(nc(s1)C(C)(C)C)C C45693318
CC(C)OCCO[C@@H](C[NH2+]C(C)(C)C)c1cccc(c1)Cl C50495215
CC[C@@H](C)C[C@@](CC)(c1nc(cs1)C(C)C)[NH2+]CCOC C53289789
CC[C@@H](C)[NH+](CCNc1ccc(cc1)Br)CCOC C53440434
C[C@H]1CCC[C@@H](C1)SCCC[C@@](C)(C(=O)OC)[NH2+]C(C)C C54695785
CCOC(=O)[C@@](C)(CCS[C@@H]1CCC[C@@H](C1)C)[NH2+]C2CC2 C54695919
CCCc1c(sc(n1)N(CCC)CC(F)(F)F)C[NH2+]CC C54998575
CCCc1c(sc(n1)N(C)[C@@H](C)C(C)(C)C)C[NH2+]C2CC2 C54998609
COCC[NH+](C/C=C/c1ccccc1)Cc2ccc(c(c2)Cl)O C55090844
CC(C)[C@H](CN(C)C)[NH2+]Cc1cc(ccc1OC(F)F)Cl C49198173
CCc1ccc(cc1)CN(Cc2ccc[nH+]c2)C(=S)NCC(C)C C59034694
CCC(CC)[C@@H](CNCc1cnc(s1)C(C)(C)C)[NH+](C)C C59180955
CCCN(CCC)[C@H](CN1CC[NH2+]CC1)c2ccc(c(c2)C)C C62268986
CCN(CCOC)c1cc(ccc1C[NH2+]C(C)(C)C)Br C62737241
CC[C@H](c1ccc(cc1)OC[C@@H]2CCCO2)[NH2+]CC3CCCCC3 C66180931
CC(C)(C)[C@H](c1cccs1)[NH2+]CCCCCn2cccn2 C68458522
CC[NH2+][C@](C)(C[C@H](C)SCc1ccccc1)C(=O)OCC C68632728
CCOC(=O)[C@@](C)(C[C@H](C)SC1CCCCC1)[NH2+]C2CC2 C68639087
CCOC(=O)[C@](C)(C[C@@H](C)SCc1ccccc1C)[NH2+]C C68641306
CC[NH2+][C@@](C)(C[C@@H](C)Sc1ccc(cc1)Cl)C(=O)OC C68631091
Cc1ccc(cc1)S[C@@H](C)C[C@@](C)(C(=O)OC)[NH2+]C2CC2 C68632978
CCOC(=O)[C@@](C)(C[C@H](C)Sc1ccccc1Cl)[NH2+]C C68634662
Cc1cccc(c1)S[C@H](C)C[C@](C)(C(=O)OC)[NH2+]C2CC2 C68639494
CC[NH2+][C@@](C)(C[C@H](C)SCc1ccccc1C)C(=O)OC C68641288
CC[NH2+][C@@](C)(C[C@H](C)SCc1cccc(c1)C)C(=O)OC C68641425
CCC[C@@H]1CN([C@@](C[NH2+]1)(C)CC)CCCOCC(F)(F)F C68701967
c1ccc(c(c1)c2ccc(s2)C[NH2+]CCOC[C@H]3CCOC3)F C68992517
CCOC(=O)[C@@](CSC1CCCCC1)(C2CC2)[NH2+]C3CC3 C69188505
c1cc(oc1)COCCC[NH2+][C@H]2CCCC[C@@H]2C(F)(F)F C69389232
CCCN[C@@H](Cc1cccc(c1)Cl)c2[nH+]ccn2CCC C69497435
CCOc1ccc2c(c1)[nH]c([nH+]2)SCCCCCBr C70492126
CCC[NH2+][C@H](CCCC=C)c1cc(c(c(c1)Cl)OC)OC C71276768
CC[NH+](CC)CC(=O)Nc1cccc(c1C)CSC(C)C C75112277
c1ccc(cc1)COc2ccc(cc2)NCCCc3ccc[nH+]c3 C76276877
CC(C)C[NH2+]CCCc1cc(c(c(c1OC)Cl)OC)Cl C76351377
CC[NH+](CC)CCCN1CC[C@H](C1)CNc2cc(ccc2C)C C76463398
Cn1cccc1C[NH2+][C@@H](COCc2ccccc2)c3ccccc3 C77454104
CCC[NH2+][C@H](C)c1ccc(cc1Cl)N(CCOC)C2CC2 C78905809
CCC[NH2+][C@@H](C)c1ccc(cc1Cl)N(CC)C[C@@H](C)C#N C78906086
CC[C@@H](C)N(CCOC)c1ccc(c(c1)Cl)[C@@H](C)[NH2+]CC C78906534
CCc1ccc(cc1)C(C)(C)CNC(=O)CCCC[NH+](C)C C79646189
c1ccc(cc1)C(=O)Oc2ccc[nH+]c2I C01384949
Cc1cc(c(c([nH+]1)SCC(=O)c2ccccc2)C#N)C(F)(F)F C00049759
CCCCN(C1=C[C@@H]2CC[C@H](C1)[NH+]2C)C(=O)c3cc(cc(c3)C)C C05298050
CC(C)(C)c1cc(cc([o+]1)C(C)(C)C)/C=C/c2ccc(c(c2)OC)O C01795644
c1ccc2cc(ccc2c1)c3csc(n3)/C(=C/c4cc[nH+]cc4)/C#N C06045895
c1cc(ccc1n2cc[nH+]c2S[C@H]3CCCCCC3=O)Cl C26042534
C[NH+](Cc1cn2ccccc2c1C#N)[C@@H]3CCCc4c3cccc4 C32888248
C[C@H](c1cccnc1)n2c3ccc(cc3[nH+]c2[C@@H](C)Cl)Cl C36911723
C[C@H](c1ccncc1)n2c3c(cccc3Cl)[nH+]c2[C@H](C)Cl C36911785
C[C@H](c1nc2c(n1CC(C)(C)C[NH+](C)C)cccc2F)Cl C37421618
CC[NH+](CC)CCN1CCn2c3ccc(cc3c4c2[C@H]1CCC4)C C20608603
Cc1ccsc1C[NH+](C)C[C@H]2C=NN=C2c3ccc(cc3F)F C39356804
CCn1c2ccc(cc2[nH+]c1COc3ccccc3)C(F)(F)F C40417125
C[C@H](c1[nH+]c2cccc(c2n1CC[C@H]3CCCO3)Cl)Cl C44510543
C[NH+]1CCC[C@@H](C1)Cn2c(nc3c2c(ccc3)Cl)CCCl C44538446
C[C@@H]1C[NH+]([C@@H](CO1)C)Cc2csc(n2)c3ccccc3Cl C45838917
CC[NH+](Cc1ccccc1C)Cc2cc(cc3c2OCOC3)F C48059237
C[C@H](c1nc2cc(ccc2n1[C@@H](C[NH+](C)C)C(C)C)F)Cl C49223110
c1ccc(c(c1)c2nc(cs2)C[NH+]3CCCC[C@@H]3C=O)Cl C54238186
Cc1csc2n1c(=O)cc([nH+]2)CS[C@@H](C)c3cccc(c3)F C56221207
Cc1cc(ccc1OCc2cn3ccccc3[nH+]2)Br C57523371
CN(Cc1cccc[nH+]1)C(=O)/C=C/c2ccc(s2)c3ccccc3 C58356474
Cc1c(c(n(n1)C)Cl)C[NH+](C)[C@H](C)c2cccc(c2)Cl C61858350
CC[C@@H]1CCCCN1C(=O)[C@@H](Cc2ccc[nH+]c2)c3ccccc3 C62104932
Cc1cccc(n1)CN2CCC3=c4ccccc4=[NH+][C@@H]3[C@@H]2C(C)(C)C C64622281
C[NH+](C)Cc1nc2ccccc2n1Cc3ccc(cc3)Br C71502721
Cc1cc(ccc1F)C2C[C@H]3CC[C@@H](C2)[NH+]3Cc4coc(n4)C C72156640
c1cc(c[nH+]c1)C2CN(C2)Cc3ccc(o3)c4ccc(cc4)Cl C72168173
c1ccc(c(c1)c2c(nccn2)[C@@H]3CCC[NH+](C3)C4CCCC4)F C72358320
Cc1cnc(o1)C[NH+]2CCCC[C@@H]2c3ccc(cc3)C(F)(F)F C72600102
Cc1c(n(c([nH+]1)S[C@@H](C)c2ccc(cc2)F)C[C@H]3CCCO3)C C72615181
C[NH+]1C[C@H]2CN(C[C@@H]2[C@@H]1c3ccccc3)Cc4nc5ccccc5s4 C72715906
Cc1cccn2c1[nH+]c(cc2=O)CSCc3ccc(cc3)F C72775976
CC[C@H]1C[NH+](CCS1)Cc2cc(=O)oc3c2ccc(c3C)C C72861252
C[C@H]1C[C@@H](CN1C(=O)C2(Cc3ccccc3C2)[NH+](C)C)c4ccccc4 C73729657
CC(C)c1ccc2c(c1)C[NH+](C[C@H]2C(=O)N(C)c3ccccc3)C C74482466
C[C@@H]1C[C@H]2CCCC[C@@H]2[NH+]1CCn3cc(cn3)Br C75837974
C[C@H]1C[C@H]2CCCC[C@@H]2[NH+]1CCn3cc(cn3)Br C75837975
Cc1ccc(cc1)[C@@H]2CCC[C@@H]2N(C)Cc3[nH+]ccn3C(F)F C75886312
Cc1cccc(c1C)[C@@H]2CCCC[NH+]2Cc3nccn3C(F)F C75999527
CC[C@@H]1[C@@H](CCN1Cc2[nH+]ccn2C(F)F)c3ccc(cc3)C C76109056
c1cc(oc1)c2nc(cs2)C[NH+]3CCSC[C@@H]3c4cccs4 C76179344
C[C@@H]1C[C@H](C[NH+]1Cc2cn3ccsc3n2)c4ccc(cc4)F C76811451
C[NH+](C)CCN(C1CCCCC1)C(=O)c2ccc(s2)Cl C77542784
CN1/C(=[NH+]/Cc2ccccc2)/SCC(=N1)c3ccc(c(c3)F)F C13133596
C[C@H](Cc1nc2ccccc2s1)N3CC[NH+](CC3)C4CCCC4 C78686143
Cc1cc(c2ccccc2[nH+]1)CS(=O)(=O)[C@H](C)c3cccs3 C78808164
C[NH+](Cc1ccc(c(c1)F)F)Cc2ncc(o2)c3ccc(cc3)F C78887261
Cc1ccc(c(c1)F)C(=O)O[C@@H](c2ccccc2)c3cc[nH+]cc3 C79149495
Cc1c(n(c([nH+]1)S[C@@H](C)c2cccc(c2)F)C[C@H]3CCCO3)C C79388447
CC(C)[NH+](CC[C@]1(CCOC(C1)(C)C)Cc2ccccc2)Cc3ccccc3 C04023264
COc1ccc(cc1)Sc2cc3ccccc3[nH+]c2c4ccc(cc4)Cl C04051406
c1ccc(cc1)c2cc(c(c([nH+]2)Oc3ccc(cc3)Cl)C#N)C(F)(F)F C01389556
CC(C)(C)c1cc(cc([o+]1)C(C)(C)C)c2cc(c([nH]2)c3ccccc3)c4ccccc4 C03107380
c1cc(ccc1c2cc(c(c([nH+]2)Oc3ccc(cc3F)F)C#N)C(F)(F)F)Cl C01389591
c1ccc2c(c1)cccc2CSc3c(c(c4c([nH+]3)CCCC4)C(F)(F)F)C#N C08993418
Cc1cc(c(c([nH+]1)SCc2csc(n2)c3ccccc3)C#N)C(F)(F)F C10399157
Cc1ccccc1CSc2[nH+]c3ccncc3n2Cc4c(cc(cc4C)C)C C06752333
Cc1cccc(c1)CSc2nc3cc[nH+]cc3n2Cc4cc(ccc4C)C C04913613
Cc1ccc(c(c1)CSc2nc3cc[nH+]cc3n2Cc4cccc(c4)Cl)C C04914452
c1ccc(c(c1)CSc2nc3cc[nH+]cc3n2Cc4c(cccc4Cl)F)F C04914635
Cc1ccc(cc1C)N(C)C(=O)CSc2c3cc(ccc3[nH+]c4c2CCCC4)Cl C04923875
Cc1ccc(cc1)Sc2c(c(cc([nH+]2)c3ccc(cc3)Cl)C(F)(F)F)C#N C04052738
Cc1ccc(cc1)S(=O)(=O)c2c(cc([nH+]c2Sc3ccc(cc3)Cl)C)C C04054056
CCCCSc1c2c(c3c4c(c([nH+]c3s2)CC(C)C)CCCC4)ncn1 C13284488
c1cc(cc(c1)F)CSc2nc3ccc[nH+]c3n2Cc4c(cccc4Cl)F C15679839
c1ccc(cc1)/[NH+]=c\2/n(c(cs2)c3ccc(cc3)Br)Cc4ccco4 C02303814
c1cc(ccc1CS[C@@H](Cn2cc[nH+]c2)c3ccc(cc3Cl)Cl)Cl C03873371
c1ccc(c(c1)/C=[NH+]/[C@H](c2ccccc2Cl)/N=C/c3ccccc3Cl)Cl C17820285
C[NH+](C)C1[C@@H]2CC3C[C@H]1CC(C2)(C3)OC(=O)C(c4ccccc4)c5ccccc5 C19798461
Cc1ccc(c(c1)[C@@H]2[NH+]=C(C(=N2)c3cccc(c3)C(F)(F)F)c4ccccc4)C C39358484
CC[C@@H](c1[nH+]c2ccccc2n1CC(=C)Br)Oc3cccc(c3)C C39900136
CC[C@H](c1[nH+]c2ccccc2n1Cc3ccccc3Cl)Oc4cccc(c4)C C39906845
CC[C@@H](c1[nH+]c2ccccc2n1Cc3ccccc3Cl)Oc4ccccc4 C39907006
CC[C@H](c1[nH+]c2ccccc2n1C[C@H]3CC3(Cl)Cl)Oc4ccccc4 C39907099
CN(C)c1ccc(cc1)c2[nH+]c3ccccc3n2Cc4c(cccc4Cl)Cl C39908531
C[C@H](c1ccccc1)n2c3ccccc3[nH+]c2C(c4ccccc4)c5ccccc5 C40210407
c1ccc(c(c1)Cc2[nH+]c3ccccc3n2Cc4ccc(cc4)Br)Cl C40225679
C=CCc1ccccc1OCCn2c3ccccc3[nH+]c2Cc4ccc(cc4)Cl C40225963
c1ccc2c(c1)[nH+]c(n2Cc3ccc(cc3)Br)COc4ccccc4Cl C40232878
CC(C)c1ccc(cc1)OCc2[nH+]c3ccccc3n2CC(=C)Br C40235583
C[C@@H](c1ccccc1)n2c3ccccc3[nH+]c2[C@H](C)Oc4ccc(cc4)Cl C40236532
Cc1cccc(c1)c2[nH+]c3ccccc3n2CCOc4ccccc4C(C)C C40239624
c1ccc(cc1)[C@@H](c2[nH+]c3ccccc3n2Cc4ccco4)Sc5ccccc5 C40390290
CC(C)Cn1c2cc(ccc2[nH+]c1COc3ccc(cc3Cl)Cl)Cl C40417707
CCc1ccc(cc1)/C=C\2/C(=O)/C(=C/c3ccc(cc3)CC)/C[NH+](C2)C(C)C C20115385
CCSc1[nH+]cc(n1c2ccc(cc2)C)c3ccc(cc3)Br C44085556
c1cc(ccc1c2c[nH+]c(n2c3ccc(cc3)F)SC4CCCC4)Br C44087169
CCSc1[nH+]cc(n1c2cccc(c2)Cl)c3ccc(cc3)Br C44087419
Cc1ccc(cc1)c2c[nH+]c(n2c3ccc(cc3)OC(F)(F)F)SC(C)C C44087984
Cc1ccccc1/[NH+]=C(/c2ccccc2)\N(Cc3ccccc3)c4ccccc4 C05589902
CC[C@H](C)c1ccc(cc1)/[NH+]=C/c2cc(c(o2)I)Br C59104094
c1cc(ccc1Sc2c(cc(o2)/C=[NH+]/C3CCCCC3)Br)Cl C59248763
CC[C@@H](C)c1ccc(cc1)/[NH+]=C/c2cc(c(o2)N3CCCC3)Br C59248263
CC[C@H](C)c1ccc(cc1)/[NH+]=C/c2cc(c(o2)N3CCCC3)Br C59248266
COc1cccc(c1)/[NH+]=C/c2cc(c(o2)Sc3ccc(cc3)Cl)Br C59303055
CC(C)[C@@H]1[C@H]2C(=c3ccccc3=[NH+]2)CCN1C(=O)C(c4ccccc4)c5ccccc5 C64032426
CCc1ccc(cc1)c2c(sc3c2c(nc(n3)SCCC[NH+](C)C)Cl)C C71579805
c1ccc(cc1)/C=[NH+]\c2ccc(cc2)Oc3ccc(cc3)/N=C\c4ccccc4 C03130025
CC1CCC(CC1)CCn2c3ccc(cc3[nH+]c2CCl)Br C78806667
Cc1ccc(cc1)C(=O)/C=C/Sc2c(c(nc(c2Cl)Cl)Cl)Cl C02556113
Cc1ccc(cc1)c2cc(nn2c3nc(cs3)c4ccc(cc4)F)C(F)(F)F C03765702
CCN(c1cccc2c1cccc2)C(=O)CSc3ccc(cc3)Br C03263406
CCC(=O)N(c1cccc(c1)Br)c2nc(c(s2)C)c3ccccc3 C00643407
Cc1ccccc1CSc2nc3ccsc3c(=O)n2c4ccc(cc4)Cl C02908790
Cc1ccc(cc1)n2c(=O)c3c(c(sc3nc2SCc4ccccc4)C)C C04680247
c1ccc(cc1)C(=NCCN=C(c2ccccc2)c3ccccc3)c4ccccc4 C01601669
c1ccc(c(c1)/C=C/C=N/c2ccc3c(c2)nc(o3)c4ccc(cc4)F)Cl C01885623
c1ccc(cc1)C(=O)/C(=C/c2cccc(c2)Br)/c3nc4ccccc4o3 C04818965
Cc1cccc(c1)n2c(=O)c3c4c(sc3nc2SCC=C)CSC(C4)(C)C C02357886
C[C@@H]1CC[C@@H]([C@@H](C1)OC(=O)CSc2ccc(cc2)Br)C(C)C C04997547
c1cc(ccc1Sc2ccc(nn2)[C@H](C#N)c3ccc(cc3Cl)Cl)Cl C03117029
Cc1ccsc1/C=C(\C#N)/c2ccc(s2)C(=O)c3ccc(cc3)Cl C03048826
Cc1ccccc1Cn2c3ccccc3nc2[C@H](C)c4ccc(cc4)CC(C)C C02713400
Cc1ccccc1Cn2cnc3c(c2=O)c(cs3)c4ccc(cc4)C(C)C C02614649
CCOc1ccc(cc1)/N=c\2/n(c(cs2)c3ccc(s3)Br)C C05673377
Cc1ccc(c(c1)/C=C/2\C(=O)c3ccccc3S2)OC(=O)c4ccccc4F C01835930
c1ccc(cc1)c2c(oc(n2)SCc3ccccc3Cl)c4ccccc4 C06618447
Cc1ccc(c(c1)CSc2nc3c(c(=O)n2c4cc(cc(c4)C)C)SCC3)C C07446848
CC(C)CSc1c2c3c(sc2nc(n1)CSc4ccc(cc4)Cl)CCC3 C08150634
c1cc(ccc1C(=O)/C=C/Sc2nc3cc(ccc3s2)Cl)Br C02556212
C=CCSc1c2c(c3c4c(c(nc3s2)c5ccccc5)CCCC4)ncn1 C08656160
Cc1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=C2C#N)SCc4ccccc4Cl)CCCC3=O C09334876
Cc1ccc(cc1)[C@H]2[C@@H](C(=NC3=CCCC(=O)[C@H]23)SCc4ccccc4Cl)C#N C09334876
Cc1cc(c2c(c1)n(/c(=N\C(=O)Cc3ccc(s3)Cl)/s2)CC=C)C C10061152
Cc1cccc(c1)c2c3c(c(c(n2)SCc4cccc(c4)F)C#N)CCCC3 C04052156
CSC(=Nc1ccc(cc1)/C=C/c2ccc(cc2)N=C(SC)SC)SC C13409716
CC(C)(C)c1ccc(cc1)C(=O)Oc2ccc(cc2)I C03012219
Cc1ccc(cc1)N2[C@H](S/C(=C\c3ccc(cc3)N(C)C)/C2=O)c4ccccc4 C32594775
CC(=O)O[C@@H]1CC[C@]2([C@@H]3CC[C@@]4([C@@H]([C@@H]3CC=C2C1)CC=C4C(=O)c5ccccc5)C)C C34387241
CC(C)c1ccc(cc1)SCC(=O)c2cc(sc2Br)Br C35230825
c1cc(c(c(c1)F)F)COc2c(cc(cc2Cl)Cl)CBr C36888922
C[C@@H]1C[C@@H](CC(C1)(C)C)OCC(=O)c2cc(sc2Br)Br C37348586
c1cc(cc(c1)OC(F)F)C(=O)c2cc(sc2Br)Br C37379731
CCc1nnc(c2n1c3cc(sc3c2)C)SCc4ccc(cc4Cl)F C06893936
Cc1ccc(c(c1)C)c2cc3c(nccn3n2)SCc4cc(ccc4C)C C38651976
c1ccc(cc1)S[C@H]([C@H]2CC3c4ccccc4C2c5c3cccc5)C6C(=O)CCCC6=O C38656565
CSc1cccc(c1)C(=O)/N=c\2/n(c3c(ccc(c3s2)Cl)Cl)CC=C C36685742
CCSc1ccc(cc1)CC(=O)/N=c/2\n(c3c(s2)ccc(c3Cl)Cl)C C39735918
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@@H]2CC(=O)[C@@H]4[C@@]3(CCC(=O)C4)C)C C03844266
C[C@H](CCC(=O)OC)[C@H]1CC[C@H]2[C@@]1(C=C[C@@H]3[C@@H]2CC[C@@H]4[C@@]3(CCC=C4)C)C C39944698
CC[C@H](C)n1c2ccccc2nc1[C@@H](c3ccccc3)Sc4ccccc4 C40390052
C=CCSc1ncc(n1c2cccc(c2)C(F)(F)F)c3ccc(c(c3)Cl)Cl C44087842
C[C@H]1CN(C[C@H](C1)C)P(=O)(/C=C(\Cl)/c2ccccc2)/C=C(\Cl)/c3ccccc3 C03179120
Cc1csc(n1)N(c2ccccc2)C(=O)/C=C/c3ccc(s3)Br C14586677
Cc1c(ccc2c1O/C(=C\c3ccc(cc3)Cl)/C2=O)OCc4ccccc4F C41435214
c1ccc(c(c1)[C@@H](c2cc(c(cc2F)Br)F)Br)OC(F)F C70474301
Cc1c(c2c(s1)ncn(c2=O)Cc3ccc(cc3)C(C)C)c4ccc(cc4)Cl C71433763
C#CCOC(=O)c1ccc2c(c1)sc(n2)c3ccccc3Br C73635102
C#CCOC(=O)c1ccc2c(c1)sc(n2)c3ccc(cc3)Br C73635124
COC(=O)CSc1c(c(cc([nH+]1)c2ccc(cc2)Br)c3cccs3)C#N C00754735
C[C@]12CCC(=O)C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OC(=O)CC[NH+]5CCCCC5)C C04082329
CC(C)(C)c1ccc(cc1)C(=O)N(CCC[NH+](C)C)c2nc3ccc(cc3s2)F C04359611
C[NH+](C)CCN(c1nc2ccc(cc2s1)F)C(=O)/C=C/c3ccccc3Cl C05115253
CC[NH+](CC)CCN(c1nc2c(cc(cc2s1)F)F)C(=O)c3cccc(c3)F C05122206
Cc1ccc(c2c1nc(s2)N(CC[NH+](C)C)C(=O)CSc3ccc(cc3)F)C C05239669
C[NH+](C)CCCN(c1nc2c(s1)cccc2Cl)C(=O)c3ccc(cc3)SC C05242654
C[NH+](C)CCN(c1nc2c(cc(cc2s1)F)F)C(=O)c3ccc(cc3)SC C05242672
CC(C)OP(=O)([C@@H](c1ccc(cc1)Br)[NH+]2CCCCC2)OC(C)C C06563997
c1ccc(cc1)[C@H](CC(=O)OC2c3ccccc3-c4c2cccc4)[NH+]5CCCCC5 C06582082
C[NH+](C)CCN(c1nc2c(s1)cccc2SC)C(=O)/C=C/c3cccs3 C07599587
C[NH+](C)CCN(c1nc2ccc(cc2s1)SC)C(=O)/C=C/c3cccs3 C07599640
Cc1cc(c(c([nH+]1)SCC(=O)c2ccc(cc2)Br)C#N)C(F)(F)F C00704883
CC(=O)C1=CC[C@H]2[C@@]1(CC[C@H]3[C@@H]2CC[C@@H]4[C@@]3(CC[C@@H](C4)OC(=O)CC[NH+]5CCCC5)C)C C04029578
CC(C)OC(=O)CSc1c(c(cc([nH+]1)c2cccs2)c3ccc(cc3)F)C#N C01825324
Cc1ccc(cc1)c2c[nH+]c(n2C)SCC(=O)N(C)Cc3ccc(s3)Cl C08724631
c1ccc2c(c1)nc(s2)N(Cc3cccc[nH+]3)C(=O)CSc4ccc(cc4)Cl C09293971
Cc1cc2c(cc1C)sc(n2)N(Cc3ccc[nH+]c3)C(=O)c4cccc(c4)C(F)(F)F C09323403
CC(C)(C)c1ccc(cc1)C(=O)N(Cc2ccc[nH+]c2)c3nc4ccc(cc4s3)F C09241732
CC(C)(C)c1ccc(cc1)C(=O)N(Cc2ccc[nH+]c2)c3nc4c(cccc4s3)F C09242169
c1ccc(cc1)c2cn3c(c([nH+]c3n2Cc4ccccn4)c5ccccc5)c6ccccc6 C09428666
C[C@@H](c1nc2ccccc2s1)[NH+](C)Cc3csc(n3)COc4ccc(cc4)F C09481622
Cc1ccc(c(c1)C)CC(=O)N(CCC[NH+](C)C)c2nc3c(ccc(c3s2)C)C C09504403
Cc1cc2c(cc1C)sc(n2)N(Cc3cccc[nH+]3)C(=O)Cc4ccc(cc4)SC C09565428
Cc1ccc(c2c1nc(s2)N(Cc3cccc[nH+]3)C(=O)c4cccc(c4)SC(C)C)C C09566277
CC(C)Sc1ccc(cc1)C(=O)N(Cc2cccc[nH+]2)c3nc4c(s3)cccc4Cl C09566372
Cc1ccc(cc1)SCC(=O)N(Cc2ccc[nH+]c2)c3nc4c(cc(cc4s3)F)F C09545687
CSc1ccc(cc1)CC(=O)N(Cc2ccc[nH+]c2)c3nc4c(cccc4s3)F C10020360
Cc1cc(cc2c1nc(s2)N(Cc3cccc[nH+]3)C(=O)/C=C/c4cccs4)Cl C10020789
CCc1ccc2c(c1)sc(n2)N(Cc3ccc[nH+]c3)C(=O)c4ccc(cc4C)C C07454319
CC[C@@H]1CCCCN1C(=O)CSc2[nH+]cc(n2CC(C)C)c3ccc(cc3)Cl C01340135
CCc1ccc(cc1)N(Cc2ccccc2Cl)C3=[NH+][C@@H]4CS(=O)(=O)C[C@H]4S3 C20867432
Cc1cc(c2c(c1)nc(s2)N(CC[NH+](C)C)C(=O)C34CC5CC(C3)CC(C5)C4)C C36640609
Cc1cccc(c1)CC(=O)N(CC[NH+](C)C)c2nc3ccc(cc3s2)Br C36641913
Cc1cccc(c1)CC(=O)N(Cc2cccc[nH+]2)c3nc4c(cc(cc4s3)C)C C36691190
CCc1ccc(cc1)N(Cc2ccc(cc2)F)C[C@H]3C=c4ccc(cc4=[NH+]C3=O)OC C38825835
Cc1ccc(cc1)c2c[nH+]c(n2c3ccc(cc3)Cl)SCC(=O)N4CCCC4 C44087564
Cc1ccc(c2c1[nH+]c(s2)OC3CCN(CC3)C(=O)Cc4ccc(cc4)C(C)C)C C49442781
Cc1ccc(s1)CN(CCc2ccccc2)Cc3cc(=O)n4ccccc4[nH+]3 C58068369
CSCc1[nH+]c2ccccc2n1CC(=O)N(Cc3ccccc3)c4ccccc4 C58340819
C[NH+](Cc1ccc(c(c1)Cl)Cl)Cc2nnc(o2)c3ccc(cc3)Br C15449605
Cc1cc(c(cc1C)S(=O)(=O)N(CCc2ccccc2)Cc3cccc[nH+]3)C C61974365
CSc1ccc(cc1)[C@H]2[C@@H]3C(=c4ccccc4=[NH+]3)CCN2CCCn5cccn5 C64166794
c1ccc(cc1)CN(Cc2ccccc2)Cc3cc(=O)n4cc(ccc4[nH+]3)Cl C64590898
c1ccc2=[NH+]CC(=c2c1)CCCC(=O)N3CCC[C@@H]3c4nc5ccccc5s4 C64701952
C[C@@H](C[NH+](C)Cc1csc(n1)N(c2ccc(cc2)F)C(=O)C)c3ccccc3 C66853282
c1ccc(cc1)[C@H]2CC(=NN2c3ccc(cc3)/C=N/c4cccc[nH+]4)c5ccccc5 C06996093
c1ccc2c(c1)ccnc2C(=O)N(Cc3ccc(c(c3)Cl)Cl)Cc4cccc[nH+]4 C72081658
Cc1cc(cc([nH+]1)[C@@H]2CCN(C2)C(=O)CCc3nc4ccccc4s3)Cc5ccccc5 C72374785
Cc1cccc(c1)CN(Cc2cccc[nH+]2)S(=O)(=O)c3c(cccc3Cl)Cl C79309175
CC(C)(C)C[NH+](C)CC12CC3CC(C1)CC(C3)C2 C05043985
CCCSc1[nH+]c2ccccc2n1CC(=C)C C34783839
CCCSc1[nH+]c2ccccc2n1CC(C)C C34783960
CCC[C@H]1CC[C@@H]([C@@H](C1)[NH+](C)C2CCCCC2)C#N C35250477
CCC[C@@H]1CC[C@@H]([C@@H](C1)[NH+](CC)C2CCCC2)C#N C35766051
CC[C@H]1CC[C@H]([C@@H](C1)[NH+](CC)C2CCCC2)C#N C35766063
CCC(CC)[NH+](C)[C@@H]1C[C@@H](CC[C@@H]1C#N)C(C)(C)CC C36789071
CCC[C@@H](C)n1c2ccc(cc2[nH+]c1CCl)C C36891292
CCCCn1c2ccc(cc2[nH+]c1CCCl)C C36909382
CCCCn1c2ccc(cc2[nH+]c1[C@@H](C)Cl)C C36909380
CCC(C)(C)[C@H]1CC[C@H]([C@@H](C1)[NH+](CC)CC)C#N C37145652
CCC(C)(C)[C@H]1CC[C@H]([C@@H](C1)[NH+](C)C(C)C)C#N C37146168
CCC[C@@H]1CC[C@H]([C@@H](C1)[NH+](CC)[C@@H](C)CC)C#N C37147244
CC[C@H](C)C[NH+](C)[C@@H]1C[C@@H](CC[C@@H]1C#N)C(C)(C)C C37173111
CCCn1c2ccc(cc2[nH+]c1c3ccc(cc3)CCl)F C37439943
CC(C)(C)c1ccc(cc1)[C@H](C2CCCC2)[NH+]=C=O C41328425
C[C@H]1CC[C@H]([C@@H](C1)[NH+](CC(C)C)CC(C)C)C#N C42034054
CC[NH+](Cc1ccc(cc1)Br)CC(C)C C42270304
CCCCC[NH+]([C@@H]1C[C@@H](CC[C@@H]1C#N)C)C(C)C C42556935
CC[C@@H]1CC[C@@H]([C@@H](C1)[NH+](C)[C@@H](C)CC(C)C)C#N C42582584
CC[C@H]1CC[C@@H]([C@@H](C1)[NH+](CC(C)C)C(C)C)C#N C42582817
CC(C)C[NH+](CC(=O)c1ccc(s1)Cl)C(C)C C42587896
Cc1ccccc1C[NH+](C)Cc2c(ccs2)Br C43501886
Cc1ccc(cc1)C[NH+](C)Cc2ccc(s2)Br C48583536
C[C@@H](c1[nH+]c2cc(ccc2n1CCc3ccsc3)F)Cl C49185598
Cc1ccc2c(c1)[nH+]c(n2C(C3CC3)C4CC4)[C@H](C)Cl C49236598
CC1CCC(CC1)[NH+](C)CCCCCCCl C51019407
C[C@H]1CCCC[C@H]1[NH+](C)CCCCCCCl C51019473
CC(C)(C[NH+](C1CCCCC1)C2CCCCC2)C=O C51175677
C[C@H]1CCC[C@@H](C1)[NH+](C)CC2(CCCCC2)C=O C51178155
Cc1cccc(c1)CCn2c3cccc(c3[nH+]c2CCl)F C51670746
CCC[C@@H]1CCC(=O)[C@H](C1)C[NH+](C)[C@@H](C)C(C)C C53927172
C[NH+](C[C@@H]1CCCCCC1=O)CC2CCCCC2 C53930835
CC(C)[C@@H]1CCC(=O)[C@H](C1)C[NH+](C)C2CCCC2 C54558971
CC[C@@H](C)[C@H](C)n1c2ccccc2[nH+]c1CCl C49094718
C[C@@H](Cc1ccsc1)n2c3ccccc3[nH+]c2CCCl C44386632
CCn1c2ccccc2[nH+]c1SCc3cccc(c3)C C59048845
Cc1cc(cc(c1[C@H](C[NH+]2[C@H](CCC[C@@H]2C)C)Cl)C)OC C62348203
CC[C@@H](/C=[NH+]/C(C)(C)C)[C@@H]1[C@@H]2CC[C@@H](C2)C1(C)C C68591582
CCC(CC)[NH+](CCc1ccsc1)CCCl C69767268
CC[C@H](c1nc(cs1)CCl)[NH+]2CCCCC[C@@H]2C C70411079
C1CC[C@H]([C@@H](CC1)[NH+](CC2CC2)CC3CC3)C#N C70505292
CCCC[NH+](CCCl)Cc1ccc(s1)Cl C71057778
Cc1[nH+]c2cc(ccc2n1C)C[C@@H](CC(C)C)Br C71424199
CCc1ccc2c(c1)[nH+]c(n2CC(=C)C)[C@H](C)Br C71667529
Cc1cc([nH+]cc1SC(C)(C)C)N(C)c2ccccc2 C72223355
Cc1c(n(c([nH+]1)SCCC(F)(F)F)C2CCCC2)C C72969980
CCCCn1c2ccc(cc2[nH+]c1CCS)C(C)C C74297399
CC(C)c1ccc2c(c1)[nH+]c(n2CC(=C)C)CCl C74297313
CCc1ccc2cc([nH+]c(c2c1)CC(C)C)C=O C77258733
Cc1ccc(cc1)Sc2c(c(cc[nH+]2)c3ccc(cc3)F)C#N C01403525
c1ccc(cc1)c2cc([nH+]c3c2cccc3)c4ccccc4 C02187289
CCCSc1c(c(cc([nH+]1)c2ccc(cc2)C)C(F)(F)F)C#N C03637014
CCc1ccc(cc1)c2cc(c3ccccc3[nH+]2)N(CC)CC C04542554
Cc1c2ccccc2[nH+]c-3c1[C@H](Oc4c3cccc4)c5ccccc5 C12970467
Cc1ccccc1/[NH+]=C/c2c3ccccc3cc4c2cccc4 C02171043
C[C@@H](Cn1c2ccccc2[nH+]c1[C@@H](C)c3ccccc3)c4ccccc4 C26533490
C[C@@H](c1c([nH+]c2n1cccc2)c3ccc(cc3)C(C)(C)C)Cl C31915045
Cc1cccn2c1[nH+]c(c2[C@H](C)Cl)c3ccc4ccccc4c3 C31915521
Cc1ccc(cc1)/C=[NH+]/[C@@H](c2ccc(cc2)C)/N=C/c3ccc(cc3)C C32601905
CCSc1[nH+]c2ccccc2n1Cc3cc(ccc3C)C C34784196
Cc1ccc2c(c1)[nH+]c(n2c3ccccc3C(C)C)CCl C36898283
C[C@@H](c1ccccc1)n2c3c(cccc3Cl)[nH+]c2[C@@H](C)Cl C36909672
C[C@H](c1[nH+]c2cc(ccc2n1c3ccc(c(c3)Cl)Cl)F)Cl C36910509
CCc1cccc(c1)n2c3ccc(cc3[nH+]c2[C@@H](C)Cl)F C36910941
Cc1ccc2c(c1)[nH+]c(n2c3ccccc3Br)CCCl C36911099
Cc1ccc2c(c1)[nH+]c(n2c3cc(cc(c3)Cl)Cl)[C@@H](C)Cl C36911280
C[C@H]1CCC[C@@H](C1)n2c3c(cccc3Cl)[nH+]c2[C@@H](C)Cl C36911593
C[C@@H]1CCC[C@H]([C@@H]1C)n2c3cccc(c3[nH+]c2[C@@H](C)Cl)F C37421877
CCCCCC#CCN1CC[NH+](CC1)C23CC4CC(C2)CC(C4)C3 C19626765
C[C@@H](CC(C)C)n1c2ccc(cc2[nH+]c1CCCl)Br C36911661
c1cc(ccc1c2ccc3c([nH+]2)CCCC3)Br C33858403
CC(C)Cn1c2ccccc2[nH+]c1C(c3ccccc3)c4ccccc4 C40210395
Cc1ccccc1c2[nH+]c3ccccc3n2[C@@H](C)c4ccccc4 C40239454
CC[C@@H](C)n1c2ccccc2[nH+]c1[C@H](CC)c3ccccc3 C40390047
CC[C@H](C)c1[nH+]c2cc(ccc2n1CC(C)C)C(F)(F)F C40417601
CC(C)N(CC(F)(F)F)c1cc(c2ccccc2[nH+]1)CCl C42779485
Cc1ccc(cc1)c2c[nH+]c(n2c3ccc(cc3)C)SCC(C)C C44085500
CC[C@H](c1cccs1)n2c3cccc(c3[nH+]c2[C@@H](C)Cl)F C49531776
CC[C@@H](c1cccs1)n2c3cccc(c3[nH+]c2CCCl)F C49531779
CCOc1ccc(cc1)/[NH+]=C/c2ccc(cc2)C(C)(C)C C58883384
CC#CCSc1[nH+]c2ccccc2n1C3CCCCC3 C06511030
CC[C@H](C)c1ccc(cc1)/[NH+]=C/c2cccn2c3ccccc3 C59250242
c1ccc2c(c1)cccc2/C=[NH+]/c3cccc4c3cccc4 C59513990
c1ccc2cc(ccc2c1)/[NH+]=C/c3cccc4c3cccc4 C03152201
c1cc(ccc1Cc2cn3cc(ccc3[nH+]2)Br)Cl C62434239
CC[C@@H]1CCC[C@@H](C1)n2c3ccc(cc3[nH+]c2[C@@H](C)Cl)C C68595666
CC[C@@H]1CCC[C@H](C1)n2c3cccc(c3[nH+]c2[C@@H](C)Cl)F C68595689
C[C@H](CCC(C)C)n1c2ccc(cc2[nH+]c1[C@@H](C)Cl)F C69235274
C[C@@H](CCC(C)C)n1c2ccc(cc2[nH+]c1[C@@H](C)Cl)F C69235275
C[C@H](CCC(C)C)n1c2c(ccc(c2F)F)[nH+]c1[C@H](C)Cl C69235296
C[C@H]1CC[C@@H]([C@@H](C1)Br)C(C)(C)c2cccc3c2cc[nH+]c3 C69412236
C[C@H]1CC[C@H]([C@@H](C1)Br)C(C)(C)c2cccc3c2cc[nH+]c3 C69412244
c1cc(sc1Cn2c([nH+]c3c2c(c(cc3)F)F)CCCl)Cl C71320495
Cc1cccn2c1[nH+]c(c2)c3ccc(cc3)C(Cl)(Cl)Cl C71570460
CC(C)(C)c1ccc(cc1)c2cn3cc(ccc3[nH+]2)C(F)(F)F C71571256
CCc1ccc2c(c1)[nH+]c(n2CC(C)C)[C@@H](C)Br C71667526
c1ccc(cc1)c2[nH+]c3ccccc3n2c4ccc(cc4)Br C71863586
CC(C)c1[nH+]c2cc(ccc2n1c3ccccc3)C(C)(C)C C76212274
Cc1cccc2n1c(c([nH+]2)c3ccc(c(c3)Cl)Cl)[C@@H](C)Cl C31920983
CC1(CC2=NC(=C)C([C@H](C2C(=O)C1)c3cc[nH+]cc3)C(=O)OCc4ccc(cc4)OC)C C08425145
C[NH+](C)CCCN(c1nc2c(cc(cc2s1)F)F)C(=O)c3ccc(cc3)C(=O)OC C09151944
Cc1cc2c(cc1C)sc(n2)N(Cc3ccc[nH+]c3)C(=O)c4ccc(cc4)C(=O)OC C09323423
COc1cc(cc(c1)OC)C(=O)N(Cc2ccc[nH+]c2)c3nc4ccc(cc4s3)Cl C09241755
COc1ccc2c(c1)nc(s2)N(Cc3ccc[nH+]c3)C(=O)COc4ccc(cc4)Cl C09273375
Cc1cc(c2c(c1)sc(n2)N(Cc3ccc[nH+]c3)C(=O)c4cc(cc(c4)OC)OC)C C09273629
Cc1ccc(c2c1sc(n2)N(Cc3ccc[nH+]c3)C(=O)COc4ccc(cc4)Cl)OC C09274019
Cc1c(sc2c1c(nc(n2)C[NH+]3CCC(CC3)C)Sc4nnc(n4C5CC5)C(C)C)C C09516453
C[C@H](c1nnc(n1c2ccc(cc2)F)SCc3cn4ccccc4n3)[NH+]5CCCCC5 C09729743
CCc1ccc2c(c1)sc(n2)N(Cc3ccc[nH+]c3)C(=O)Cc4ccc5c(c4)OCO5 C09522370
COc1ccc(cc1)SCC(=O)N(Cc2cccc[nH+]2)c3nc4c(cccc4s3)OC C10023385
CC[NH+](CC)CCN(c1nc2cc3c(cc2s1)OCO3)C(=O)/C=C/c4cccs4 C10066865
Cc1ccc(cc1C)CC(=O)N(CC[NH+](C)C)c2nc3c(ccc(c3s2)OC)OC C10699230
Cc1cc(c2c(c1)sc(n2)N(CCCn3cc[nH+]c3)C(=O)COc4ccc(cc4)Cl)C C10583971
c1cc(ccc1/C=C/c2cc[nH+]cc2)OC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4 C11858601
Cc1c(nc(o1)c2ccc(cc2)C(F)(F)F)C[NH+](C)Cc3nc(no3)c4ccccc4 C12298156
Cc1ccccc1n2cc(c(n2)c3ccc(c(c3)F)OC)C[NH+](C)[C@@H](C)c4ccon4 C12709888
CCc1cccc2c1nc(s2)N(CCCn3cc[nH+]c3)C(=O)c4ccc(cc4)OC C07424555
CCCN(CC1CC1)C(=O)CSc2nc3ccccc3c(=O)n2c4cc(cc[nH+]4)C C05923055
COc1ccc(cc1)[C@@H]2CC3=NC(=C)C([C@H](C3C(=O)C2)c4ccc[nH+]c4)C(=O)OC5CCCC5 C00861362
Cc1cc(ccc1OC)CC(=O)N(Cc2ccc[nH+]c2)c3nc4c(cccc4s3)OC C12663295
CCn1ccc(n1)C(=O)N(CC[NH+](CC)CC)c2nc3ccc(cc3s2)Br C13702253
COc1cc(cc(c1)OC)C(=O)N(Cc2ccc[nH+]c2)c3nc4c(s3)cccc4Cl C15881800
CCCc1ncc(c(n1)[C@H]2CCCN2C(=O)COc3c(cccc3C)C)c4cc[nH+]cc4C C19525629
Cc1ccc2c(cc(=O)oc2c1)CSc3nnc(n3c4ccc(cc4)F)[C@@H](C)[NH+](C)C C23483075
Cc1cccn2c1[nH+]c(c2)CSc3nc4ccc(cc4c(=O)n3CCOC)Br C23593925
C[C@H](c1nnc(n1c2ccc(cc2)Cl)SCc3coc(n3)c4cccs4)[NH+](C)C C24876583
Cc1ccc2[nH+]c(cn2c1)COc3ccc(cc3)C(=O)N(C)[C@@H](C)c4nc5ccccc5s4 C25073232
CC[C@H](C)c1ccc(cc1)S(=O)(=O)N2CCN(CC2)Cc3cn4cccc(c4[nH+]3)C C32664784
Cc1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)N(CCCOC)[C@H](C)c4cc[nH+]cc4 C33249174
CCOC(=O)C1(CC[NH+](CC1)Cc2c(cc(cc2n3cccn3)C)C)C[C@@H]4CCCCO4 C12440888
Cn1c(nnc1S[C@H](c2ccccc2)C(=O)C3=c4ccccc4=[NH+]C3)c5ccccc5OC C38689261
C[NH+](C)CCN1[C@@H](c2c(=O)c3ccc4ccccc4c3oc2C1=O)c5ccc(cc5)OCC=C C38712826
Cc1ccc(c2c1nc(s2)N(CC[NH+](C)C)C(=O)c3ccccc3C(=O)OC)Cl C36642128
C[NH+](C)CCCN(c1nc2c(cc(cc2s1)F)F)C(=O)c3cc(on3)c4ccccc4 C36645331
Cc1ccc(c(c1)N(C[C@H]2C=c3ccccc3=[NH+]C2=O)C(=O)c4ccc(c(c4)OC)OC)C C38902897
Cc1cccc(c1)N(C[C@@H]2C=c3cc(ccc3=[NH+]C2=O)C)C(=O)c4ccc(c(c4)OC)OC C38906318
Cc1ccc2=[NH+]C(=O)[C@H](C=c2c1)CN(c3ccc(cc3)OC)C(=O)c4ccc(cc4)OC C38915191
C[C@H](c1nnc(n1c2ccc(cc2)Cl)SCC(=O)N(c3ccccc3)C(C)C)[NH+](C)C C39567385
C[C@@H](c1nnc(n1c2ccc(cc2)Cl)SCC(=O)N(c3ccccc3)C(C)C)[NH+](C)C C39567387
Cc1ccc2[nH+]c(cn2c1)CSc3nc4cc(ccc4c(=O)n3CCCOC)Cl C39575865
CCc1ccc(cc1)N2C[C@H](CC2=O)c3[nH+]c4ccccc4n3CC(=O)N(C)C5CCCCC5 C40257417
CC[NH+](CC)CCN(c1nc2c(cccc2s1)F)C(=O)c3cnc4ccccc4n3 C36642607
C[NH+](C)CCCN(c1nc2c(cccc2s1)F)C(=O)/C=C/c3ccc4c(c3)OCO4 C36644672
CCc1c(n2cccc(c2[nH+]1)OCc3ccc(cc3)C(F)(F)F)N(C)C(=O)c4ccncc4 C61926070
c1ccc(cc1)[C@H](C(=O)C2=c3ccccc3=[NH+]C2)Sc4nnnn4c5ccc(cc5)Cl C39945765
CC[C@H](C)CC1=C2C(=NC(=NC2=O)SCc3cc(=O)n4c(csc4[nH+]3)C)S[C@@H]1C C38722313
Cc1ccc(cc1)c2cc(nc[nH+]2)N3CCN(CC3)S(=O)(=O)c4ccc(cc4)CC(C)C C35483173
CCOC(=O)c1ccc(cc1)/N=C\2/c3cc(ccc3N(C2=O)C[NH+](C)C)Br C19939542
CC(C)[C@@H](CN(Cc1ccc(c(c1)Cl)Cl)c2nn3c(=O)ccnc3s2)[NH+](C)C C79109174
CC[NH+](CC)CCN1[C@H](/C(=C(/c2ccc(cc2)C)\O)/C(=O)C1=O)c3ccc(cc3)C C06160154
Cc1ccc(cc1)Cn2c(c(c(n2)C)C(=O)NC[C@@H](Cc3ccccc3)[NH+](C)C)Cl C07989526
Cc1ccc(cc1)Cn2cc[nH+]c2SCC(=O)Nc3ccc(cc3)OC(F)(F)F C08824387
Cc1ccc(cc1F)NC(=O)Cn2c3cnccc3[nH+]c2SCc4cccc(c4)F C08913059
Cc1c(c(c(c(c1C)C)S(=O)(=O)NC[C@H](c2ccc3c(c2)CCN3C)[NH+](C)C)C)C C08800519
C[C@@H](C(=O)NC1CCCCC1)Sc2[nH+]cc(n2C[C@H]3CCCO3)c4ccccc4 C11606870
C=CCC1(CCCN1C(=O)C[C@@H]2C(=O)NCC[NH+]2Cc3ccc(cc3Cl)F)CC=C C11815977
c1cc(cnc1)CN(C[C@H]2CCC[NH+](C2)C3CCCCC3)C(=O)c4cc5c([nH]4)ccs5 C12429294
Cc1ccccc1CSc2nc3cc[nH+]cc3n2CC(=O)NCCC4=CCCCC4 C06752323
c1ccc(cc1)OP(=O)(Nc2ccc(c[nH+]2)Br)Oc3ccccc3 C13283278
CSCCC[NH2+]Cc1c(nc2n1cc(cc2)Cl)C(=O)N3CCCCCCC3 C12302139
c1ccc(cc1)c2c(n(c(n2)c3ccccc3)[C@H](Cn4cc[nH+]c4)O)c5ccccc5 C15910279
Cn1cc[nH+]c1[C@H](c2ccc(cc2)Cl)NC(=O)c3ccc(cc3)OC(F)(F)F C16261788
Cn1cc[nH+]c1[C@@H](c2ccc(cc2)Cl)NC(=O)CSc3nc4ccccc4s3 C16262239
Cc1ccc(cc1)CC(=O)N2CCC[C@](C2)(Cc3ccccc3c4ccc[nH+]c4)C(=O)NC C19209414
Cc1ccc(cc1)c2ccccc2C[C@@]3(CCCN(C3)C(=O)Cc4ccc[nH+]c4)C(=O)NC C19212797
c1ccc(c(c1)Cc2cnc(s2)NC(=O)c3ccccc3Cn4cc[nH+]c4)Cl C19349679
CCCC(=O)N1CCC[C@](C1)(Cc2ccccc2c3ccc[nH+]c3)C(=O)NC(C)C C19501241
Cc1c(c(n(n1)c2ccc(cc2)F)C)C[NH2+][C@@H](C)c3nc4ccccc4n3C(C)C C19715478
Cc1nc2cc(ccc2s1)NC(=O)[C@@H]3C[C@H](C[NH+]3C(C)C)Sc4ccc(cc4)OC C19759053
CC1=C([C@@H](C2=C(N1)CC(CC2=O)(C)C)c3cc[nH+]cc3)C(=O)OCCc4ccccc4 C19775029
Cc1c(n(c(c1C#N)NC(=O)C[NH+](C)Cc2ccc(cc2F)F)Cc3ccccc3)C C22965106
Cc1c(c(n(n1)c2ccc(cc2)F)Cl)C(=O)NC[C@@H](c3ccccc3Cl)[NH+](C)C C23788857
Cc1c(n(c([nH+]1)S[C@@H](C)C(=O)Nc2ccc(c(c2)Cl)OC)C3CCCC3)C C07178850
Cn1cc[nH+]c1[C@@H](c2ccccc2)NC(=O)COc3cc(c(cc3Cl)Cl)Cl C24955513
Cc1ccc(cc1)OCC(=O)NC[C@@H](c2ccc(cc2)C(C)(C)C)[NH+]3CCOCC3 C28292057
Cn1cc[nH+]c1[C@H](c2ccccc2)NC(=O)CSc3nc4cc(ccc4s3)Cl C28942741
Cc1cc(c(c(c1C)S(=O)(=O)N[C@@H](C)[C@@H](c2ccccc2)[NH+]3CCOCC3)C)C C32738628
C[C@H](c1ccc2cc(ccc2c1)OC)C(=O)N[C@@H](c3ccc(cc3)F)c4[nH+]ccn4C C32830705
CC[NH+]1CCc2c(sc(c2C(=O)OCC)NC(=O)C34CC5CC(C3)CC(C5)C4)C1 C36628526
CC(C)(C(=O)NC[C@@H](c1ccc(cc1)N(C)C)[NH+](C)C)Oc2ccc(cc2)Cl C38635291
Cc1cc(c(cc1Cl)Cl)S(=O)(=O)NC[C@@H](c2ccc3c(c2)CCN3C)[NH+](C)C C38670101
CC(C)c1ccc(cc1)OCC(=O)NC[C@H](c2ccc3c(c2)CCCN3C)[NH+](C)C C38670208
C[C@@H](C(=O)Nc1ccccc1OC(F)F)Sc2[nH+]cc(n2C)c3ccccc3 C07179298
C[C@H](C(=O)C)n1c2ccccc2[nH+]c1CCNC(=O)Cc3ccc(cc3)c4ccccc4 C40203444
c1csc2n1c(c(n2)C(=O)N3CCCCCCC3)C[NH2+]CC[C@@H]4C[C@@H]5C[C@H]4C=C5 C43619497
C[C@@H]1CCC[C@](C1)(CNC(=O)c2cnn(c2C(F)(F)F)c3ccc(cc3)Cl)[NH+](C)C C58168414
C[C@H]1CCCC[C@@H]1NC(=O)Cc2csc(n2)c3ccc(cc3)CN4CC[NH+](CC4)C C62048179
COC(=O)[C@@H](CC1=c2ccccc2=[NH+]C1)NC(=O)C(c3ccccc3)c4ccccc4 C63162846
CC(C)[C@@H]1[C@@H]2C(=c3ccccc3=[NH+]2)CCN1C(=S)Nc4ccc(cc4)C(=O)OC C63302072
C[C@@H]1C(=c2cc(ccc2=[NH+]1)OC)CC/N=C(\C)/C3=C(C[C@@H](CC3=O)c4ccccc4)O C63514651
CCc1ccc(cc1)CNC(=O)CC2CCN(CC2)C(=O)[C@@H]3C=c4cc(ccc4=[NH+]3)Cl C64541043
Cc1ccc(cc1)c2[nH+]ccc(n2)N3CCC[C@@H](C3)C(=O)NCc4ccc(cc4)SC C64929001
Cc1cccc(c1C)OCC(=O)NCc2[nH+]c3ccccc3n2CCc4ccccc4 C71489388
Cc1c(nc([nH]1)SCc2ccc(cc2)OCc3[nH+]ccn3C)Cc4ccccc4 C71966449
CCn1c2ccccc2[nH+]c1[C@H](C)NC(=O)CCc3ccc(cc3)OC(F)(F)F C72090434
C#CCN(Cc1ccc[nH+]c1)C(=O)Nc2ccc(cc2)Cc3nc4ccccc4s3 C72270419
Cc1ccc(cc1)[C@H](C)C(=O)NCC2CCC(CC2)c3c(cncn3)c4cc[nH+]cc4 C72395436
Cc1cccc2n1cc([nH+]2)CNC(=O)[C@](C)(Cc3nc4ccccc4s3)c5ccccc5 C78772184
C[C@@H](C(=O)Nc1cccc(c1)Oc2cc[nH+]cc2)Oc3cccc(c3Cl)Cl C78991910
CC(C)c1cccc(c1NC(=O)[C@@H](C(C)C)N2C(=O)c3ccccc3C2=O)C(C)C C00946430
CC(C)Sc1nnc(n1c2ccccc2)CNC(=O)C34CC5CC(C3)CC(C5)C4 C04059401
Cn1c(=O)c2c3c(sc2nc1SCCCC(=O)NC4CCCCC4)CCCC3 C01805046
Cc1ccccc1CCN(Cc2cc3ccc(c(c3[nH]c2=O)C)C)C(=O)c4ccco4 C01359508
C[C@@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CSc4nnc(o4)C5CCCCC5 C04891660
CCc1nc2c(c3c(s2)CCCC3)c(n1)SCC(=O)Nc4ccc(cc4)OC C02339510
CCOc1ccc(cc1)NC(=O)[C@@H](C)Sc2c3c4c(sc3ncn2)CCCC4 C05236402
Cc1cccc(c1)NC(=O)CN(c2ccc(c(c2)C(F)(F)F)Cl)S(=O)(=O)C C00975971
Cc1ccc(cc1)N([C@H](C)C(=O)Nc2ccccc2c3ccccc3)S(=O)(=O)C C01062918
Cc1ccc(cc1)NC(=O)CN(c2ccc(c(c2)C(F)(F)F)Cl)S(=O)(=O)C C01219414
CCc1nnc(c2n1c3ccsc3c2)S[C@H](CC)C(=O)Nc4ccccc4F C06750377
CC[C@@H](C(=O)NCCc1cccs1)n2c(=O)c3c4ccccc4sc3c(n2)C C06799371
CN(C)c1ccc(cc1)NC(=O)CSc2c3c(csc3ncn2)c4ccccc4 C00929823
Cc1ccc(cc1F)NC(=O)CSc2nc3cc(ccc3c(=O)n2CC=C)Cl C09085400
c1ccc(cc1)c2nnc(n2c3ccccc3)SCC(=O)Nc4ccc(cc4F)F C09663830
CCc1cc2c(cc1S(=O)(=O)N(CC)Cc3ccccc3)[nH]c4c2C(=O)CCC4 C09685956
Cc1cccc(c1)n2c(nnc2S[C@@H](C)C(=O)Nc3ccc(cc3)C(F)(F)F)C C09816083
c1cc(oc1)CNC(=O)/C(=C/c2ccc(o2)c3ccc(c(c3)C(F)(F)F)Cl)/C#N C09982283
CC(C)Cn1c(=O)c2ccc(cc2nc1SCC(=O)Nc3ccc(cc3)F)Cl C09987800
C[C@H](c1ccc(cc1Cl)Cl)NC(=O)[C@H](C)Sc2nncn2c3ccccc3 C11427871
C[C@@H](C(=O)Nc1ccc(cc1)C(=O)C)OC(=O)c2c(c3ccc(cc3s2)F)Cl C11443766
C[C@@H](C(=O)Nc1ccc(cc1)Cc2nc3ccccc3s2)Sc4nccn4C C08135879
C[C@@H](C(=O)Nc1cccc(c1)C(=O)C)Sc2nc3c(n2c4ccccc4)CCCC3 C05183246
C[C@@H](C(=O)Nc1ccc(c(c1F)F)F)Sc2nc3ccccc3c(=O)n2CC=C C15231129
CC1=C([C@@H]([C@@H](C(=N1)SCC(=O)NC(C)(C)C)C#N)c2ccc(cc2)Cl)C(=O)C C04320295
Cc1ccc(cc1)N2C(=O)/C(=C/c3ccc(cc3)C(C)C)/N=C2S[C@@H](C)C(=O)NC C19297357
CC1=C([C@H](C2=C(N1)CCCC2=O)c3ccc(cc3)SC)C(=O)OC[C@@H]4CCCO4 C19830715
CC(=O)c1ccccc1NC(=O)CSc2c3c(csc3ncn2)c4ccccc4 C22086978
Cc1cc(cc(c1)OC[C@H](Cn2cnc3c(c2=O)c(cs3)c4ccccc4)O)C C24829648
Cc1ccc(cc1)c2c(sc(n2)C)CC(=O)N(C)CC(=O)Nc3cccc(c3C)C C24861993
Cn1ccnc1[C@H](c2ccccc2)NC(=O)/C=C/c3csc(n3)c4ccc(cc4)F C25159659
Cc1c(nc(o1)c2cccs2)CC(=O)Nc3ccc(cc3C(F)(F)F)N(C)C C36759505
c1ccc(cc1)c2cn3c(csc3n2)CC(=O)Nc4ccccc4OC(F)(F)F C36795543
Cc1ccc(cc1Cl)NC(=O)CSc2nc3c(ccs3)c(=O)n2CC=C C36799789
c1ccc(cc1)N([C@H](c2cccs2)C(=O)NC3CCCCC3)C(=O)c4ccccn4 C01339023
c1ccc(cc1)C2=NN=C[C@@H]2/C=N/NC(=O)[C@H]3CC3(c4ccccc4)c5ccccc5 C39699629
Cc1ccc(cc1)[C@H](CNS(=O)(=O)c2c(cc(cc2C)C)C)N3CCN(CC3)C C36699292
CC[C@@H](C(=O)Nc1c(c(c(s1)C)C)C#N)Sc2cc(ncn2)c3ccccc3 C40171548
c1cc(cc(c1)F)c2nc3n(n2)c(cs3)CCNC(=O)C4(CC4)c5cccs5 C49504964
CCCn1c(=O)c2c(ccs2)nc1SCC(=O)Nc3ccc(cc3F)Cl C57425200
CCCN\1C(=O)[C@H](S/C1=N\c2cc(ccc2C)C)CC(=O)Nc3ccccc3F C06559390
CCc1ccc(cc1)NC(=O)CSc2c3cc(nn3ccn2)c4ccc(cc4)F C57511107
Cc1c(cccc1Cl)NC(=O)[C@H](C)Sc2nc3c(ccs3)c(=O)n2CC=C C16726891
CCCCCn1c(=O)c2c3c(sc2nc1S[C@H]4CCCCNC4=O)CCC3 C10583432
COc1cccc(c1)c2c(cc3ccc(cc3n2)F)CNCc4cn5ccccc5n4 C64131585
CCc1ccc(cc1)[C@@H](C)NC(=O)COc2c3cc(ccc3ncn2)Br C68883140
CN([C@@H]1CCCc2c1cccc2)C(=O)CSc3nnc(s3)NC4CCCCC4 C32555754
CN(Cc1ccc(s1)Br)C(=O)NCCc2ccc(cc2)n3cccn3 C71823621
Cc1cc(c(cc1S(=O)(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)OC)OC C26529472
Cc1ccccc1n2cnnc2SCC(=O)N[C@@H](C)c3ccc(cc3Cl)Cl C79384426
c1cc(ccc1Sc2cc(c[nH+]c2C#N)C(F)(F)F)Cl C03047564
c1ccc(cc1)Sc2cccc([nH+]2)Sc3ccccc3 C02023561
Cc1cccc([nH+]1)C[C@H](Cc2ccccc2)c3ccccc3 C00967186
c1ccc(cc1)[C@@H]2[C@@H]3[NH+]2[C@@H](N=C3c4ccccc4)c5ccccc5 C04418997
CSSc1c(c(cc([nH+]1)c2ccccc2)c3ccccc3)C#N C05335900
C[C@H]1C[C@@H](C[NH+](C1)[C@@H](C)C(=O)c2ccc(cc2)Br)C C35021857
CC(C)(C)[C@H]1CC[C@H]([C@@H](C1)[NH+](C)C2CCCCC2)C#N C35250474
Cc1ccc2c(c1)[nH+]c(n2Cc3ccccc3Cl)[C@H](C)Cl C36909459
C[C@@H]1CCC[C@H]([C@@H]1C)n2c([nH+]c3c2c(ccc3)Cl)CCCl C36910085
CCc1ccc(cc1)n2c3ccc(cc3[nH+]c2[C@@H](C)Cl)Cl C36910742
Cc1cc(cc(c1)n2c3ccccc3[nH+]c2CCCl)C C36910985
CCC(C)(C)[C@H]1CC[C@@H]([C@@H](C1)[NH+]2CCCCCC2)C#N C37145802
c1ccc(cc1)Cc2ccccc2/[NH+]=C/c3ccccc3 C37638219
Cc1cc(c2c(cc[nH+]c2c1)/C=C/c3ccc(cc3)N(C)C)C C13221042
CC(C)(C)/[NH+]=C/c1cc(sc1S)c2ccccc2 C05685905
Cc1cc2c(cc[nH+]c2cc1C)/C=C/c3ccc(cc3)N(C)C C01559786
CCCn1c2ccccc2[nH+]c1[C@@H](CC)c3ccccc3 C40417435
CC(C)n1c2ccc(cc2[nH+]c1c3cccs3)C(F)(F)F C40417313
C[C@H](c1ccc(cc1)Br)[C@@H](C#N)[NH+]2CCCCC2 C41538670
CC[C@H](C)C[NH+](C)Cc1ccc(s1)Br C43677696
Cc1ccc2c(c1)[nH+]c(n2Cc3ccccc3C)CCCl C48265996
Cc1ccc(s1)[C@H](C)n2c3cccc(c3[nH+]c2CCCl)F C49185661
Cc1ccc2c(c1)[nH+]c(n2C(C3CC3)C4CC4)[C@@H](C)Cl C49236596
c1ccc2c(c1)[nH+]c(n2Cc3ccc(cc3F)F)CCCl C51017708
C[C@H](Cc1ccsc1)n2c3cc(ccc3[nH+]c2[C@@H](C)Cl)F C52123845
C[C@@H](c1cccs1)n2c([nH+]c3c2c(c(cc3)F)F)CCCl C53171050
CCC1CCC(CC1)[NH+]2CCN3CCC[C@@H]3[C@@H]2C4CCCCC4 C22575799
C[C@@H]1C[C@@H](C[NH+](C1)[C@@H](C)C(=O)c2ccc(s2)Cl)C C37331888
C[C@H](c1ccccc1F)[NH+](C)Cc2c(ccs2)Br C59181022
c1c[nH+]ccc1CCSC23CC4CC(C2)CC(C4)C3 C59502953
C[C@@H](c1ccsc1)n2c3cccc(c3[nH+]c2[C@H](C)Cl)F C61365397
CCCC[NH+](CC)C[C@@H](c1ccc(c(c1)F)F)Cl C62349260
C=CC[NH+](CC=C)C[C@@H](c1ccc(c(c1)Cl)Cl)Cl C62343479
C=CC[NH+](CC=C)C[C@@H](c1cccc(c1)Br)Cl C62346421
C=CC[NH+](CC=C)C[C@@H](c1ccc(c(c1)F)F)Cl C62349334
C=CC[NH+](CC=C)C[C@H](c1ccc(c(c1)F)F)Cl C62349338
CC[C@H](c1cc[nH+]c2c1cccc2)[C@H](C)Br C63044705
c1ccc2=[NH+]CC(=c2c1)SCc3ccc(c(c3)Cl)Cl C63642955
C[C@@H](c1ccc(cc1)c2cc3ccccc3nc2)[NH+](C)C C65492842
CCCC[NH+](Cc1ccc(cc1F)Br)[C@@H](C)CC C70139081
CCCC[NH+](Cc1cccc(c1)Br)[C@H](C)CC C70139088
C[C@H](c1[nH+]c2cc(ccc2n1[C@H](C)C3CCCC3)Cl)Cl C70307624
CC(C)[NH+](CCCCl)Cc1cccc(c1)Br C71057665
C[C@@H](c1[nH+]c2ccc(cc2n1Cc3ccc(s3)Cl)F)Cl C71320455
CCc1ccc2c(c1)[nH+]c(n2Cc3ccccc3F)CCl C71667503
CC[NH+](CC)CCSC[C@H]1CC[C@H]2C[C@@H]1C2(C)C C71778529
Cc1c(n(c([nH+]1)SCC#Cc2ccccc2)c3ccccc3)C C72262402
Cc1ccc2c(c1)/c(=[NH+]/CC=C)/cc(o2)c3ccccc3 C01916589
CC(C)CCn1c2ccc(cc2[nH+]c1CCl)C(C)C C74297308
CC[C@H](c1[nH+]c2cc(ccc2n1C)C(C)C)Br C74297365
C[C@@H]1CC[C@H]([C@@H](C1)OC[C@@H](C[NH+]2[C@@H](CCC[C@@H]2C)C)O)C(C)C C05043180
CC(C)c1ccc(c(c1)[C@H](c2ccccc2)[NH+]3CCOCC3)O C05384645
CC(C)[NH+](C)Cc1cc(ccc1O)c2ccnc3c2ccc(c3)Cl C12243111
Cc1ccccc1CC(=O)Nc2cccc(c2)/C=C/c3cccc[nH+]3 C06822559
c1c[nH+]ccc1CN(C2CCCC2)C(=S)NC3CCCCCCC3 C21262203
CC[C@H](c1c([nH+]c2n1c(ccc2)C)c3ccc(cc3)C(C)(C)C)O C31914317
C[C@H]([C@H]1CCC[NH+](C1)C)Nc2ccc3c(c2)sc(n3)SC C36956267
C[C@H](c1ccc(cc1)Br)[NH2+][C@@H](C)c2ccc3c(c2)OCO3 C36981992
C[C@@H](c1ccc(c(c1)OC)OC)[NH2+][C@@H](C)c2ccc(s2)Cl C36992435
CCN(CC)c1[nH+]cc(s1)CNc2ccc(c(c2)Cl)C C37188462
C[C@@H](c1ccc(c(c1Cl)Cl)Cl)Nc2ccc([nH+]c2)N(C)C C37283866
C[C@H](c1cccc[nH+]1)Nc2cc(c(c(c2)Cl)OC(F)F)Cl C37777783
C[C@H](c1ccc(cc1Cl)Cl)[NH2+]Cc2cn(nc2C(C)C)C C37201480
C[C@H](CCC(C)C)[NH2+]Cc1cc2c(cc1Br)OCO2 C35111310
Cc1ccc(cc1C)C2=NN=C[C@@H]2C[NH2+][C@H](C)c3ccc(cc3)F C39468360
CC(=O)c1ccc(cc1)Nc2cc[nH+]c3c2cc(cc3)C(F)(F)F C41054639
Cc1cc(no1)C[NH2+][C@@H](C)c2ccc(c(c2Cl)Cl)Cl C44692944
C[C@@H](c1ccccc1Br)[NH2+][C@H](c2ccccc2)C(=O)OC C47979001
CCOc1ccc(cc1F)/[NH+]=C/c2cc(ccc2O)Br C48627832
CCCC[C@@H](C)[NH2+]Cc1cc2c(c(c1)Br)OCO2 C50887277
c1cnc(cc1Oc2cc(c(cc2Cl)Cl)Cl)C[NH2+]C3CC3 C51545200
CC(C)(C)[NH2+]Cc1cc(ccn1)Oc2ccc(cc2)Br C51547143
CC[NH2+]Cc1c(cc(o1)COc2cc(ccc2Cl)Cl)C C52652853
CCC[NH2+][C@H](C)c1c(nc(s1)N(C)[C@@H]2CCC[C@@H](C2)C)C C54907277
CCCc1c(sc(n1)N2CC[C@H](C[C@@H]2C)C)C[NH2+]C(C)C C54998168
CCc1c(sc(n1)N(C)[C@H]2CCCC[C@@H]2C)C[NH2+]C(C)C C55001036
CCOc1cc(cc(c1O)CC=C)/C=[NH+]/c2ccc(c(c2)Cl)F C59303213
CC[NH2+]Cc1ccoc1COc2cc(c(cc2Cl)Cl)Cl C52649224
c1coc(c1C[NH2+]C2CC2)COc3cc(c(cc3Cl)Cl)Cl C52649226
C[C@H](c1ccc(cc1)Cl)N(C)c2ccc(c(n2)C[NH2+]C)Cl C62019188
C[C@@H](c1ccc(cc1)Cl)[NH+](C)Cc2c(ccc(n2)NC)Cl C62017286
CCc1c(sc(n1)N(C)[C@H](C)c2ccccc2Cl)C[NH2+]C C62028160
CCC[NH2+][C@H](C)c1c(nc(s1)N2CCC(CC2)(C)CC)C C62959047
CC(=C[C@H]1[C@@H](C1(C)C)C(=O)NCCC2=c3ccccc3=[NH+]C2)C C63736591
CCC(CC)C(=O)Nc1cccc(c1)[C@@H]2C=c3cc(ccc3=[NH+]2)F C63737355
CC(C)c1ccc(cc1)C2=N[NH+]=C(SC2)NCC(F)(F)F C63890736
Cc1c(oc(n1)C[NH2+][C@@H](c2ccc(cc2)C(C)(C)C)C(C)C)C C67386581
C[NH+](CCNC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F)C2CCCCC2 C68899758
CCC[NH2+][C@]1(CCO[C@H](C1)CC)c2nc(cs2)C(C)(C)C C70369137
CC[C@H]1C[C@](CCO1)(c2nc(cs2)C(C)(C)C)[NH2+]C(C)C C70369285
CC[C@@H]1CCC[C@@H](C1)Oc2ccc(c(n2)C[NH2+]C(C)C)Cl C71141608
Cc1cccnc1C[NH2+][C@H](c2ccco2)c3ccc(s3)Cl C71339838
Cc1ccc[nH+]c1CN[C@@H](c2ccco2)c3ccc(s3)Cl C71339837
CCCCCn1c2ccc(cc2nc1C3CC[NH2+]CC3)C(C)C C71667781
CC[C@](C)(c1nccs1)[NH2+]Cc2c(nc(s2)c3ccccc3)C C72683007
CC[C@@](C)(c1nccs1)[NH2+]Cc2csc(n2)c3ccccc3F C72684290
Cc1c2ccccc2nc(n1)C[NH2+][C@@H](C)c3ccc(cc3Cl)Cl C73882353
CCN(CC)c1c2ccc(cc2c(c[nH+]1)NCc3ccccc3)C C74408127
CC(C)Sc1ccc(n[nH+]1)NCc2ccc(cc2C(F)(F)F)F C78679753
C[C@H](c1ccc(c(c1)F)F)[NH2+][C@H](C)c2ccc(cc2OC)OC C78968854
CC[NH+](CC)CCSc1nc2ccccc2c(=O)n1c3ccccc3C C01301812
CC[NH+](CC)CCN(c1nc2c(cccc2s1)F)C(=O)c3ccccc3 C05122005
CCC(=O)O[C@@H](c1ccnc2c1cccc2)[C@H]3C[C@@H]4CC[NH+]3C[C@@H]4C=C C06663719
Cc1cccc(c1)C(=O)N(CC[NH+](C)C)c2nc3ccc(cc3s2)SC C07599624
CCOC(=O)c1c(c2ccccc2nc1C[NH+](C)Cc3ccccc3F)C C07910916
C[NH+](C)CCCN(c1nc2ccc(cc2s1)F)C(=O)Cc3cccs3 C10061690
C[C@H](c1ccccc1)[NH+](C)Cc2nc(no2)c3cccc(c3)C(F)(F)F C10101804
CC[NH+](Cc1c(oc(n1)c2ccc(cc2)C(F)(F)F)C)C[C@H]3CCCO3 C11775136
C[NH+](CCc1ccccc1)Cc2nc(no2)c3ccc(cc3)C(F)(F)F C12092690
Cc1c(nc(o1)c2ccc(cc2F)F)C[NH+](CC3CCC3)C[C@H]4CCCO4 C12200370
C[C@H](CCC=C(C)C)C[NH+]1CCC(CC1)CCC(=O)N2CCOCC2 C20455939
CC(C)CCCN1CC[C@@H](CCC1=O)N2CC[NH+](CC2)C3CCCCC3 C20999759
CC1=C[C@H]([C@@H](C[C@H]1CC(=O)N(C)CCc2cccc[nH+]2)C(C)C)CC#N C30882557
COC(=O)[C@H]1CCCC[NH+]1Cc2csc(n2)c3ccc(cc3)C(F)(F)F C32900939
CCCC(=O)O[C@H](c1ccnc2c1cccc2)[C@H]3C[C@@H]4CC[NH+]3C[C@@H]4C=C C33653030
CCCCN(C[C@H]1C=c2ccc(cc2=[NH+]C1=O)C)C(=O)c3ccccc3C C38906438
CCCCN(C[C@@H]1C=c2cc(ccc2=[NH+]C1=O)C)C(=O)c3ccc(cc3)C C38979056
Cc1ccc(cc1C)C2=NN=C[C@@H]2C[NH+](C)[C@@H](C)c3ccccc3OC C39538073
C=CCn1c2ccccc2[nH+]c1SCc3nccn3Cc4ccccc4 C40067275
CC(C)c1[nH+]c2ccccc2n1CC(=O)N(Cc3ccccc3)C(C)C C40231414
CC(C)n1c2ccc(cc2[nH+]c1Cc3ccc(c(c3)OC)OC)C(F)(F)F C40417302
COc1ccc(cc1)c2c[nH+]c(n2c3ccc(cc3)OC(F)F)SC C44088112
CCCn1c2cc(ccc2[nH+]c1SCc3cc(no3)C)C(F)(F)F C45660127
CC[C@@H](C)N(Cc1cccc(c1)Cl)C(=O)CCc2c([nH+]n(c2C)C)C C55060738
CCCCCN(Cc1ccc(cc1)F)Cc2cc(=O)n3ccccc3[nH+]2 C57622239
Cc1ccc(o1)c2nc(cs2)C[NH+](CCOC)[C@@H](C)c3ccccc3 C58298052
Cc1c(n2ccccc2[nH+]1)COC(=O)C(c3ccccc3)c4ccccc4 C62049784
Cc1ccc(cc1)C(C)(C)CCC(=O)N2C[C@H]([NH+]([C@H](C2)C)CCCOC)C C62314660
Cc1ccc2nc(cc(=O)n2c1)C[NH+](Cc3ccc(cc3)Cl)CC(C)C C64590872
Cc1ccc(cc1)CN(Cc2cc(=O)n3cccc(c3[nH+]2)C)CC(C)C C64590812
Cc1c(nc(o1)c2ccccc2)C[NH+](C)[C@H](c3ccccc3)c4ccccn4 C66540924
Cc1c(c(n([nH+]1)C)C)CCC(=O)OCCCc2c(cccc2Cl)F C66745591
c1ccc(cc1)[C@H](c2cc[nH+]cc2)OC(=O)COCc3ccccc3Cl C68284641
c1ccc(cc1)Cc2nc(cs2)C(=O)O[C@H](c3ccccc3)c4cc[nH+]cc4 C68724188
CCCC[NH+](CC)Cc1csc(n1)N(c2ccc(c(c2)C)C)C(=O)C C70946705
Cn1cc[nH+]c1SCCC(=O)N(C2CCCCC2)C3CCCCC3 C71258933
CCCCn1c(c([nH+]c1S[C@@H](C)C(=O)N2C[C@H](C[C@@H](C2)C)C)C)C C71834578
C[C@@H](C#N)Oc1ccc(cc1)/C=C/C(=O)c2ccc(cc2)c3cc[nH+]cc3 C72701630
C[C@H]1CCCC[NH+]1C[C@@H]2CCCN(C2)C(=O)CCc3ccc(o3)[C@@H]4C[C@@H]4C C72808536
CCCCN(CC(F)(F)F)Cn1c(=O)c2c(c(c([nH+]c2s1)C)C)C C72915443
C[C@@H](c1cccc[nH+]1)OC(=O)[C@H]2C[C@@H]2c3ccc(cc3)OC(F)(F)F C73526990
Cc1ccc(c(c1)O[C@H](C)C(=O)N2CC[C@@H](C2)C[NH+](C)CC3CC3)C(C)C C74318709
CCc1nc2c(c(cs2)c3ccc(cc3)F)c(=O)n1CC[NH+](CC)CC C75317853
CCCc1nc2c(c(cs2)c3ccccc3)c(=O)n1CC[NH+](CC)CC C75318249
CC[NH+](CC)CCn1c(=O)c2c(c(sc2nc1c3cccc(c3)C)C)C C75318529
CN(Cc1ccc(cc1)OCC=C)C(=O)CCc2cc[nH+]c3c2cccc3 C76558963
C[C@@H](CC(=O)c1ccccc1F)C(=O)O[C@@H](C)c2cc3ccccc3[nH+]c2 C76908425
CC[NH+](CCc1nc(no1)c2cccc(c2)Cl)CCC(F)(F)F C77274045
Cc1c(c(n([nH+]1)CC(C)C)C)CCC(=O)N2CCC[C@H]2C3CCCCC3 C55599877
CCc1ccc(cc1)[C@H](C)CC(=O)N(C)C2CC[NH+](CC2)C3CCOCC3 C78092782