SMILES for DNA gyrase subunit A

179 SMILES Strings for DNA gyrase subunit A

Compound Name

SMILES String

BDBM50211477

Brc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM24778

CC1=CC(=O)c2ccccc2C1=O |t:1|

BDBM50478003

CC1CN(CC(C)O1)c1c(F)c([N+]([O-])=O)c2c3c1OCC(C)n3cc(C(O)=O)c2=O

BDBM50478006

CC1CN(CC(C)O1)c1c(F)cc2c3c1OCC(C)n3cc(C(O)=O)c2=O

BDBM50478005

CC1COc2c(N3CCC4(CC3)OCCO4)c(F)cc3c2n1cc(C(O)=O)c3=O

BDBM50045004

CC1COc2c(N3CCN(C)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O

BDBM50478010

CC1COc2c(N3CCN(CC3)C(=O)c3ccco3)c(F)cc3c2n1cc(C(O)=O)c3=O

BDBM50478009

CC1COc2c(N3CCN(CC3)C(c3ccccc3)c3ccc(Cl)cc3)c(F)c([N+]([O-])=O)c3c2n1cc(C(O)=O)c3=O

BDBM50478007

CC1COc2c(N3CCSCC3)c(F)c([N+]([O-])=O)c3c2n1cc(C(O)=O)c3=O

BDBM50478004

CC1COc2c(N3CCSCC3)c(F)cc3c2n1cc(C(O)=O)c3=O

BDBM50478008

CC1COc2c(N3CCc4ccccc4C3C(=O)NC(C)(C)C)c(F)c([N+]([O-])=O)c3c2n1cc(C(O)=O)c3=O

BDBM50521800

CCNC(=O)Nc1cc(N2CCC(N)C2)c(cn1)C(=O)Nc1cccnc1

BDBM50521805

CCNC(=O)Nc1cc(N2CCCC2)c(cn1)C(=O)Nc1cccnc1

BDBM50521804

CCNC(=O)Nc1cc(Nc2ccc(OC)cc2)c(cn1)C(=O)Nc1cccnc1

BDBM50521807

CCNC(=O)Nc1cc(Nc2ccccc2O)c(cn1)C(=O)Nc1cccnc1

BDBM50521806

CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cc(Br)cn1

BDBM50521799

CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cccn1

BDBM50521802

CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1ccnn1

BDBM50521803

CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1cncn1

BDBM50521801

CCNC(=O)Nc1cc(c(cn1)C(=O)Nc1cccnc1)-n1nccn1

BDBM50457571

CCNCc1cc2cc-3c(CCCc4c(O)c(C(O)=O)c(=O)[nH]c-34)cc2n1C

BDBM139418

CCOC[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM50408207

CCSc1[nH]c2ccc(cc2c(=O)c1C(C)=O)C(F)(F)F

BDBM50483021

CC[C@@H]1CCN(C1)c1c(F)cc2c(c1C)n(C1CC1)c(=O)n(N)c2=O |r|

BDBM50483020

CC[C@@H]1CCN(C1)c1c(F)cc2c(c1OC)n(C1CC1)c(=O)n(N)c2=O |r|

BDBM50483022

CC[C@@H]1CCN(C1)c1c(F)cc2c(c1OC)n(cc(C(O)=O)c2=O)C1CC1 |r|

BDBM50483023

CC[C@@H]1CCN(C1)c1c(F)cn2c(c1OC)c(C1CC1)c(=O)n(N)c2=O |r|

BDBM139385

CC[C@@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139378

CC[C@@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139384

CC[C@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139377

CC[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM21691

CCn1cc(C(O)=O)c(=O)c2ccc(C)nc12

BDBM50518937

CN(C)c1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50518929

CN(CCCN1CCN(CC1)c1nccc2ccccc12)c1cc(=O)oc2ccccc12

BDBM50131445

COC(=O)c1cn2[C@@H](C)COc3c(N4CCN(C)CC4)c(F)cc(c23)c1=O

BDBM139419

COCCOC[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139391

COC[C@@H]1CN(C(=O)O1)c1noc2c(Cl)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139405

COC[C@@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139406

COC[C@@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@H](C)[C@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139389

COC[C@@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139441

COC[C@@H]1[C@@H](C)OC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139392

COC[C@H]1CN(C(=O)O1)c1noc2c(Cl)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139388

COC[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139451

COC[C@H]1[C@@H](C)OC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)C4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139413

CON=C[C@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r,w:2.1|

BDBM139412

CON=C[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r,w:2.1|

BDBM139425

CO[C@@H](C)[C@@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM50330317

CO[C@@H]1[C@@H](OC(=O)c2ccc(C)[nH]2)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2Cl)OC1(C)C |r,wU:3.3,13.14,wD:2.1,15.16,(-8.34,-2.73,;-8.34,-1.19,;-7.01,-.42,;-7.01,1.12,;-8.34,1.89,;-9.68,1.12,;-9.68,-.42,;-11.01,1.89,;-11.17,3.42,;-12.68,3.74,;-13.45,2.4,;-14.98,2.24,;-12.42,1.26,;-5.68,1.89,;-5.68,3.43,;-4.34,1.12,;-3.01,1.89,;-1.67,1.12,;-1.67,-.42,;-.34,-1.19,;.99,-.42,;2.33,-1.19,;2.33,-2.73,;3.66,-.42,;4.99,-1.19,;6.33,-.42,;6.33,1.12,;7.66,-1.19,;7.66,-2.73,;8.99,-3.5,;10.33,-2.73,;11.66,-3.5,;10.33,-1.19,;11.66,-.42,;13,-1.19,;14.33,-.42,;15.66,-1.19,;14.33,1.12,;8.99,-.42,;3.66,1.12,;4.99,1.89,;2.33,1.89,;.99,1.12,;-.34,1.89,;-.34,3.43,;-4.34,-.42,;-5.68,-1.19,;-6.67,-2.37,;-4.69,-2.37,)|

BDBM50178917

CO\N=C1/CN(CC1CN)c1nc2n(cc(C(O)=O)c(=O)c2cc1F)C1CC1

BDBM50131428

COc1c(N2CC3CCCNC3C2)c(F)cc2C(=O)C(CN(C3CC3)c12)C(O)=O

BDBM50117914

COc1c(N2CCNC(C)C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1

BDBM50330327

COc1c(N2CC[C@H](C2)C(C)(C)N)c(F)cc2c1n(C1CC1)c1s[nH]c(=O)c1c2=O |r|

BDBM50366824

COc1c(N2C[C@@H]3CCCN[C@@H]3C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1 |r|

BDBM50476065

COc1c(c(F)cc2c1n(C1CC1)c1s[nH]c(=O)c1c2=O)-c1cc(C)nc(C)c1

BDBM50476068

COc1c(c(F)cc2c1n(C1CC1)c1s[nH]c(=O)c1c2=O)-c1ccnc(C)c1

BDBM50481218

COc1c(ccc2c1n(cc(C(O)=O)c2=O)[C@@H]1C[C@@H]1F)N1CC[C@H](C1)C1(N)CC1 |r|

BDBM50518943

COc1cc2ccccc2c(n1)N1CCN(CCCNc2cc(=O)oc3ccccc23)CC1

BDBM50518948

COc1ccc2cc(F)nc(N3CCN(CC(O)CNc4cc(=O)oc5ccc(F)cc45)CC3)c2c1

BDBM50518918

COc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50211475

COc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM50393503

COc1ccc2ncc(F)c([C@@H](O)CC[C@@H]3CCN(CCSc4cccs4)C[C@@H]3C(O)=O)c2c1 |r|

BDBM50254142

COc1ccc2nccc([C@@H](O)CC[C@@H]3CCN(C[C@@H]3C(O)=O)C3CC(C3)c3ccccc3)c2c1 |r,wU:10.10,14.13,19.20,(27.36,-12.97,;28.69,-12.2,;30.02,-12.97,;30.02,-14.51,;31.36,-15.28,;32.69,-14.5,;34.03,-15.27,;35.36,-14.5,;35.35,-12.95,;34.01,-12.19,;34.01,-10.65,;32.67,-9.88,;35.34,-9.87,;36.67,-10.63,;38,-9.86,;39.34,-10.63,;40.66,-9.86,;40.66,-8.32,;39.33,-7.55,;37.99,-8.32,;36.65,-7.56,;35.32,-8.34,;36.64,-6.02,;42,-7.54,;43.48,-7.92,;43.88,-6.42,;42.41,-6.04,;45.2,-5.64,;46.54,-6.4,;47.87,-5.63,;47.86,-4.08,;46.51,-3.32,;45.19,-4.11,;32.69,-12.96,;31.35,-12.2,)|

BDBM139415

CSC[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM50408213

CSc1[nH]c2c(Cl)cc(cc2c(=O)c1C(C)=O)C(F)(F)F

BDBM50408212

CSc1[nH]c2c(Cl)cc(cc2c(=O)c1C(C)=O)[N+]([O-])=O

BDBM50408211

CSc1[nH]c2c(F)ccc(c2c(=O)c1C(C)=O)C(F)(F)F

BDBM50408209

CSc1[nH]c2c(ccc(c2c(=O)c1C(C)=O)C(F)(F)F)C(F)(F)F

BDBM50408210

CSc1[nH]c2cc(c(cc2c(=O)c1C(C)=O)C#N)C(F)(F)F

BDBM139439

C[C@@H](O)[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM93041

C[C@@H]1CC(=O)c2c(O)cccc2[C@@H]1O

BDBM139393

C[C@@H]1CN(C(=O)O1)c1noc2c(Cl)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139375

C[C@@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139450

C[C@@H]1CN2C([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](OC2=O)C#N)C(=O)NC(=O)NC1=O |r|

BDBM139447

C[C@@H]1CN2C([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)c2ncccn2)C(=O)NC(=O)NC1=O |r|

BDBM139427

C[C@@H]1CN2C([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2ncccn2)C(=O)NC(=O)NC1=O |r|

BDBM139402

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(Cl)c23)N2C[C@@H](CF)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139404

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(Cl)c23)N2[C@@H](CCCF)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139403

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(Cl)c23)N2[C@@H](CCCO)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139383

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2CC(C)(C)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139372

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2CCOC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139390

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](CF)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139397

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](CO)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139410

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](OC2=O)C=NO)C(=O)NC(=O)NC1=O |r,w:27.32|

BDBM139444

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@@H](OC2=O)c2ccccn2)C(=O)NC(=O)NC1=O |r|

BDBM139408

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@H](CF)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139414

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@H](CN=[N+]=[N-])OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139407

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@H](CO)OC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139438

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@H](OC2=O)C#N)C(=O)NC(=O)NC1=O |r|

BDBM139422

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2C[C@H](OC2=O)c2ccccn2)C(=O)NC(=O)NC1=O |r|

BDBM139434

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CC#N)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139396

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CC=C)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139400

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CCCF)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139399

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CCCO)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139401

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CCO)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139386

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CF)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139417

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CN=[N+]=[N-])COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139398

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)C2CCOCC2)C(=O)NC(=O)NC1=O |r|

BDBM139379

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)c2ccccc2)C(=O)NC(=O)NC1=O |r|

BDBM139445

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)c2ccccn2)C(=O)NC(=O)NC1=O |r|

BDBM139446

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)c2ccncc2)C(=O)NC(=O)NC1=O |r|

BDBM139432

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](COC2=O)c2ncnn2C)C(=O)NC(=O)NC1=O |r|

BDBM139416

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](CS(C)(=O)=O)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139382

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@@H](Cc3ccccc3)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139387

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](CF)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139443

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](CN=[N+]=[N-])COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139428

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C#C)C(=O)NC(=O)NC1=O |r|

BDBM139411

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C#N)C(=O)NC(=O)NC1=O |r|

BDBM139420

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C(F)F)C(=O)NC(=O)NC1=O |r|

BDBM139421

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C2CC2)C(=O)NC(=O)NC1=O |r|

BDBM139442

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C2CCOCC2)C(=O)NC(=O)NC1=O |r|

BDBM139409

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C=C)C(=O)NC(=O)NC1=O |r|

BDBM139437

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)C=NO)C(=O)NC(=O)NC1=O |r,w:27.32|

BDBM139435

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)[C@@H](O)CO)C(=O)NC(=O)NC1=O |r|

BDBM139436

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)[C@H](O)CO)C(=O)NC(=O)NC1=O |r|

BDBM139380

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2ccccc2)C(=O)NC(=O)NC1=O |r|

BDBM139423

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2ccccn2)C(=O)NC(=O)NC1=O |r|

BDBM139424

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2ccncc2)C(=O)NC(=O)NC1=O |r|

BDBM139426

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2cnccn2)C(=O)NC(=O)NC1=O |r|

BDBM139431

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](COC2=O)c2ncnn2C)C(=O)NC(=O)NC1=O |r|

BDBM139381

C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)N2[C@H](Cc3ccccc3)COC2=O)C(=O)NC(=O)NC1=O |r|

BDBM139373

C[C@@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139395

C[C@@H]1OC(=O)N([C@@H]1C)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139433

C[C@H](O)[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139374

C[C@H]1CN(C(=O)O1)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139429

C[C@H]1COC(=O)N1c1noc2c(Cl)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139376

C[C@H]1COC(=O)N1c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM50366826

C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c2n1cc(C(O)=O)c3=O |r|

BDBM50481219

C[C@H]1NCc2cc(ccc12)-c1ccc2c(c1OC(F)F)n(cc(C(O)=O)c2=O)C1CC1

BDBM139394

C[C@H]1OC(=O)N([C@H]1C)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM139440

C[C@H]1OC(=O)N([C@H]1CF)c1noc2c(F)c3N4C[C@@H](C)O[C@@H](C)[C@@H]4C4(Cc3cc12)C(=O)NC(=O)NC4=O |r|

BDBM50518917

Cc1c(NCCCN2CCN(CC2)c2nccc3ccc(F)cc23)c2ccccc2oc1=O

BDBM93039

Cc1cc(O)c2C(=O)C(=CC(=O)c2c1)c1c(C)cc(O)c2C(=O)C=CC(=O)c12 |c:8,25|

BDBM93038

Cc1cc(O)c2C(=O)C=C(C(=O)c2c1)c1c(C)cc2C(=O)C=CC(=O)c2c1O |c:8,23|

BDBM50107009

Cc1cc(O)c2C(=O)C=CC(=O)c2c1 |c:8|

BDBM93040

Cc1cc(O)c2C(=O)C=CC(=O)c2c1-c1c(C)cc2C(=O)C=CC(=O)c2c1O |c:8,23,(4.47,.97,;5.81,1.74,;5.81,3.28,;7.14,4.05,;7.14,5.59,;8.47,3.28,;9.85,4.1,;9.83,5.64,;11.25,3.31,;11.25,1.71,;9.85,.92,;9.85,-.58,;8.47,1.74,;7.14,.97,;7.14,-.57,;8.47,-1.34,;9.81,-2.11,;8.47,-2.88,;7.14,-3.65,;7.16,-5.25,;8.51,-6.01,;5.78,-6.07,;4.39,-5.26,;4.4,-3.66,;3.08,-2.88,;5.81,-2.88,;5.81,-1.34,;4.47,-.57,)|

BDBM50518934

Cc1cc2ccccc2c(n1)N1CCN(CCCNc2cc(=O)oc3ccccc23)CC1

BDBM50211506

Cc1cc2nc(cc(-c3ccccc3)c2cc1C)-c1cccc(Oc2ccccc2)c1

BDBM50518947

Cc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50518920

Cc1cccc2oc(=O)cc(NCCCN3CCN(CC3)c3nccc4ccc(F)cc34)c12

BDBM50518936

Clc1cc2ccccc2c(n1)N1CCN(CCCNc2cc(=O)oc3ccccc23)CC1

BDBM50518951

Clc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50211474

Clc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM50518923

Clc1ccc2oc(=O)cc(NC3CCN(CCCc4ccccc4)CC3)c2c1

BDBM50518933

Clc1ccc2oc(=O)cc(NCCCN3CCN(CC3)c3nccc4ccccc34)c2c1

BDBM50518944

Fc1cc2ccccc2c(n1)N1CCN(CCCNc2cc(=O)oc3ccccc23)CC1

BDBM50518928

Fc1ccc2ccnc(N3CCN(CCC(=O)Nc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50518931

Fc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5CCNCc45)CC3)c2c1

BDBM50518930

Fc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5CCOCc45)CC3)c2c1

BDBM50518952

Fc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5CCS(=O)(=O)Cc45)CC3)c2c1

BDBM50518913

Fc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5CCSCc45)CC3)c2c1

BDBM50518938

Fc1ccc2ccnc(N3CCN(CCCNc4cc(=O)oc5ccccc45)CC3)c2c1

BDBM50211476

Fc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM50518932

Fc1ccc2oc(=O)cc(NCCCN3CCN(CC3)c3nccc4ccccc34)c2c1

BDBM50211504

N#Cc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM50518945

O=C(NCCCN1CCN(CC1)c1nccc2ccccc12)c1ccccc1

BDBM50518916

O=C1CN(CCN1CCCNc1cc(=O)oc2ccccc12)c1nccc2ccccc12

BDBM50518935

O=c1cc(NCCCN2CCN(CC2)c2nc(cc3ccccc23)C#N)c2ccccc2o1

BDBM50518910

O=c1cc(NCCCN2CCN(CC2)c2nccc3ccc(cc23)C#N)c2ccccc2o1

BDBM50518946

O=c1cc(NCCCN2CCN(CC2)c2nccc3ccccc23)c2CCCCc2o1

BDBM50518939

O=c1cc(NCCCN2CCN(CC2)c2nccc3ccccc23)c2ccccc2o1

BDBM50518914

O=c1cc(NCCCN2CCN(CC2)c2nccc3ncccc23)c2ccccc2o1

BDBM50518912

O=c1cc(NCCN2CCN(CC2)c2nccc3ccccc23)c2ccccc2o1

BDBM50518927

O=c1cc(N[C@H]2C[C@@H](C2)N2CCN(CC2)c2nccc3ccccc23)c2ccccc2o1 |r,wU:7.9,wD:5.4,(48.21,-35.72,;46.66,-35.71,;45.89,-34.36,;44.35,-34.36,;43.58,-33.02,;42.04,-33.01,;40.95,-31.91,;39.85,-33,;40.94,-34.09,;38.3,-33,;37.53,-34.33,;35.99,-34.33,;35.21,-32.99,;35.98,-31.65,;37.54,-31.65,;33.67,-32.99,;32.9,-31.65,;31.35,-31.66,;30.59,-32.99,;31.37,-34.31,;30.59,-35.64,;31.36,-36.97,;32.9,-36.97,;33.66,-35.64,;32.9,-34.33,;43.57,-35.69,;42.04,-35.68,;41.26,-37,;42.03,-38.34,;43.56,-38.35,;44.33,-37.03,;45.87,-37.04,)|

BDBM50518922

O=c1cc(N[C@H]2C[C@H](C2)N2CCN(CC2)c2nccc3ccccc23)c2ccccc2o1 |r,wU:7.9,5.4,(23.93,-35.73,;22.38,-35.72,;21.61,-34.37,;20.07,-34.37,;19.31,-33.03,;17.76,-33.02,;16.66,-34.11,;15.57,-33.01,;16.67,-31.92,;14.02,-33.01,;13.25,-34.35,;11.71,-34.34,;10.93,-33,;11.71,-31.66,;13.26,-31.66,;9.39,-33,;8.62,-31.67,;7.07,-31.67,;6.31,-33.01,;7.09,-34.32,;6.31,-35.65,;7.08,-36.98,;8.62,-36.98,;9.38,-35.66,;8.62,-34.34,;19.3,-35.7,;17.76,-35.69,;16.98,-37.02,;17.75,-38.36,;19.28,-38.36,;20.05,-37.04,;21.6,-37.05,)|

BDBM50518942

O=c1cc(OCCCN2CCN(CC2)c2nccc3ccccc23)c2ccccc2o1

BDBM21690

OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O

BDBM50518925

OC(CCN1CCN(CC1)c1nccc2ccc(F)cc12)Cc1cc(=O)oc2ccccc12

BDBM50518924

OC(CNc1cc(=O)oc2ccc(F)cc12)CN1CCN(CC1)c1nccc2ncccc12

BDBM50518915

OC(CNc1nc(=O)oc2ccc(F)cc12)CN1CCN(CC1)c1nc(F)cc2ccc(F)cc12

BDBM50518940

OC(CNc1nc(=O)oc2ccc(F)cc12)CN1CCN(CC1)c1nccc2ccc(F)cc12

BDBM50518926

O[C@@H](CNc1cc(=O)oc2ccccc12)CN1CCN(CC1)c1nccc2ccc(F)cc12 |r|

BDBM50518941

O[C@H](CNc1cc(=O)oc2ccccc12)CN1CCN(CC1)c1nccc2ccc(F)cc12 |r|

BDBM50518911

O[C@H](CNc1nc(=O)oc2ccccc12)CN1CCN(CC1)c1nccc2ccc(F)cc12 |r|

BDBM50211505

Oc1c(Cl)cc2nc(cc(-c3ccccc3)c2c1Cl)-c1cccc(Oc2ccccc2)c1

BDBM50211507

Oc1ccc2nc(cc(-c3ccccc3)c2c1)-c1cccc(Oc2ccccc2)c1

BDBM50226181

[#6]-[#8]-[#6@@H]1-[#6@@H](-[#8]-[#6](-[#7])=O)-[#6@@H](-[#8])-[#6@H](-[#8]-c2ccc3c(-[#8])c(-[#7]-[#6](=O)-c4ccc(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c4)c(=O)oc3c2-[#6])-[#8]C1([#6])[#6] |r|

BDBM50483850

[H][C@]1(CCN(C1)c1c(F)cc2c(c1OC)n(C1CC1)c1s[nH]c(=O)c1c2=O)[C@H](C)N |r|

BDBM50483849

[H][C@]1(CCN(C1)c1c(F)cc2c(c1OC)n(C1CC1)c1s[nH]c(=O)c1c2=O)[C@H](C)NC |r|

BDBM50483851

[H][C@]1(CCN(C1)c1c(F)cc2c(c1OC)n(C1CC1)c1s[nH]c(=O)c1c2=O)[C@H](C)NCCF |r|