SMILES for Sphingosine kinase 1

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)NC(N)=N |r,wU:14.14,wD:17.21,(-4.59,2.59,;-5.92,1.82,;-7.26,2.59,;-8.59,1.82,;-8.59,.28,;-7.26,-.49,;-5.92,.28,;-4.59,-.49,;-3.26,.28,;-2.49,-1.05,;-.95,-1.05,;-.18,.28,;-.95,1.62,;-2.49,1.62,;1.36,.28,;2.13,1.62,;3.67,1.62,;4.44,.28,;3.67,-1.05,;2.13,-1.05,;5.98,.28,;7.26,-1.05,;7.26,-2.59,;8.59,-.28,)|

BDBM174071

CCCCCCCCc1ccc(CNC(=O)C2(CC2)NC(N)=N)cc1

BDBM174072

CCCCCCCCCCCCc1ccc(NC(=O)C2(CC2)NC(N)=N)cc1

BDBM174073

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(I)cc1 |r|

BDBM174074

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(cc1)C#CC1CCCC1 |r|

BDBM174075

CCCCCCCCc1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174076

CCCCCCCCCCCCc1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174079

CCCCCCCCCCCCCCCCc1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174080

CCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)NC(N)=N

BDBM174082

CCCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)NC(N)=N

BDBM174083

CCCCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)NC(N)=N

BDBM174084

CCCCCCCCc1ccc(cc1)-c1noc(CN(C)C(N)=N)n1

BDBM174085

CCCCCCCCc1ccc(cc1)-c1noc(CNC(N)=N)n1

BDBM174088

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@H](C)NC(N)=N |r|

BDBM174090

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H](NC(N)=N)C(C)C |r|

BDBM50443388

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM50139650

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@H]1CCCN1C(N)=N |r|

BDBM174094

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1C[C@@H](O)CN1C(N)=N |r|

BDBM174096

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1[C@@H](O)CCN1C(N)=N |r|

BDBM174097

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@H]1C[C@H](O)CN1C(N)=N |r|

BDBM174098

CCCCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174105

CCCCCCCCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174106

CCCCCCCCc1cccc(c1)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM174107

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN(C1)C(N)=N |r|

BDBM174108

NC(=N)N1CC[C@H]1C1CCC(C1)c1ccc(cc1)-c1ccccc1 |r|

BDBM174109

CCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN1C(N)=N |r|

BDBM174110

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN1C(N)=N |r|

BDBM174113

CCCCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN1C(N)=N |r|

BDBM174114

CCCCCCCCc1ccc(cc1)-c1noc(CC)n1

BDBM174115

CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN1C(=N)NO |r|

BDBM174117

CCCCCCCCc1ccc(cc1)-c1noc(n1)C1CN(C1)C(N)=N

BDBM174118

CCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1CN(C1)C(N)=N

BDBM174119

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(CS(=O)(=O)c2ccccc2)cc1 |r|

BDBM174120

CCCCCCCCc1ccc(cc1)-c1nc(no1)[C@@H]1CCCN1C(N)=N |r|

BDBM174121

CCCCCCCCc1cccc(c1)-c1noc(C[C@@H]2CCCN2C(N)=N)n1 |r|

BDBM174122

CCCCCCCc1cccc(c1)-c1noc(C[C@@H]2CCCN2C(N)=N)n1 |r|

BDBM174123

CCCCCCCCCCCCc1noc(C[C@@H]2CCCN2C(N)=N)n1 |r|

BDBM174124

NC(=N)N1CCC[C@H]1Cc1nc(no1)-c1ccc(CS(=O)(=O)c2ccccc2)cc1 |r|

BDBM174126

CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCCC1C(N)=N

BDBM241904

CCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241905

CCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241906

CCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241907

CCCCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241908

CCCCCCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241909

CCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241910

CCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241911

CCCCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241912

CCCCCCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(\N)=N\O

BDBM241913

CCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

BDBM241914

CCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

BDBM241915

CCCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

BDBM241916

CCCCCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

BDBM241917

CCCCCCCCCCCCCCCCc1ccc(NC(=O)C2(CC2)C(\N)=N\O)cc1

BDBM241918

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCc2ccccc2)cc1

BDBM241919

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCCc2ccccc2)cc1

BDBM241920

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCc2ccccc2)cc1

BDBM241921

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCOCC2CCCCC2)cc1

BDBM241922

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC2CCCCC2)cc1

BDBM241923

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCCOCC2CCCCC2)cc1

BDBM241924

N\C(=N/O)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCCC1

BDBM241925

N\C(=N/O)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCC1

BDBM241926

N\C(=N/O)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCC2)cc1

BDBM241927

N\C(=N/O)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1

BDBM241928

N\C(=N/O)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:32:23:30:26.27.28,THB:31:23:26:30.29.28,31:29:26:23.32.24,22:23:30:26.27.28,32:27:30:23.31.24|

BDBM241929

CCCCCCCCCCCCCCNC(=O)C1(CC1)C(\N)=N\O

BDBM241930

CCCCCCCCCCCCCCCCNC(=O)C1(CC1)C(\N)=N\O

BDBM241931

CCCCCCCCCCCCCCCCCCNC(=O)C1(CC1)C(\N)=N\O

BDBM241932

CCCCCCCCCCCCCCCC(=O)NC1(CC1)C(\N)=N\O

BDBM241933

CCCCCCCC\C=C/CCCCCCCC(=O)NC1(CC1)C(\N)=N\O

BDBM241934

CCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O |r|

BDBM241935

CCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O |r|

BDBM241936

CCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O |r|

BDBM241937

CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1\C(N)=N\O |r|

BDBM241938

CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@@H]1\C(N)=N\O |r|

BDBM241939

N\C(=N/O)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1 |r|

BDBM50239117

Fc1cc(F)cc(c1)N1CCC[C@@H]1c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1 |r|

BDBM50251380

CCCCCCCCCCCCCC[C@@H]1OC[C@@H](NC(C)=N)[C@@H]1O |r|

BDBM50251381

CCCCCCCCCCCCCC[C@@H]1OC[C@@H](NC(C)=O)[C@@H]1O |r|

BDBM50312869

Oc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2)cc1

BDBM50600

CC(=O)N(C1CCCCC1)C1=C(Cl)C(=O)c2ccccc2C1=O |c:11|

BDBM50393642

Clc1ccc(cc1)C12CC3CC(CC(C3)(C1)C(=O)NCc1ccncc1)C2 |TLB:14:9:26:15.13.12,14:13:8.9.10:26,THB:16:13:8:10.11.26,16:13:8.9.10:26,12:13:8:10.11.26,12:11:8:15.14.13|

BDBM50251395

CCCCCCCCc1ccccc1CC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM50251400

CCCCCCCc1cccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)c1 |r|

BDBM50251432

CCCCCCCCc1cccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)c1 |r|

BDBM50251402

CCCCCCc1ccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)cc1 |r|

BDBM50251403

CCCCCCCCc1ccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)cc1 |r|

BDBM50251408

CCCCCCCCCCCCc1ccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)cc1 |r|

BDBM50251409

CCCCCCCCCCCCCCc1ccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)cc1 |r|

BDBM50251433

N[C@@H]1CO[C@@H](CCCCCCCCCCCOCC2CCCCC2)[C@H]1O |r|

BDBM50251419

N[C@@H]1CO[C@@H](CCCCCCCCCOCC2CCCCC2)[C@H]1O |r|

BDBM50251423

N[C@@H]1CO[C@@H](CCCCCCCCOCC2CCCCC2)[C@H]1O |r|

BDBM50251434

CC(C)COCCCCCCCCCCC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM50251426

CCCCCCCCCOCCCC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM50041978

Cc1cc(cc(c1)OCc2ccc(cc2)CN3CCC[C@@H]3CO)CS(=O)(=O)c4ccccc4

BDBM50175277

CCCCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50017016

CCCCOc1ccc(CC\C=C2/SC(=O)N(CCN)C2=O)cc1

BDBM50393641

CCCCCCCCc1ccc(CC[C@@](N)(CO)COC)cc1 |r|

BDBM50251394

CCCCCCCCCCCCCC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM50251401

CCCCCCCCCc1cccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)c1 |r|

BDBM50251435

CCCCCCCCCCc1ccc(CC[C@@H]2OC[C@@H](N)[C@@H]2O)cc1 |r|

BDBM50251418

N[C@@H]1CO[C@@H](CCCCCCCCCCOCC2CCCCC2)[C@H]1O |r|

BDBM50251424

CCCCCCCOCCCCCC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM50251430

CCCCCCCCCCCCCC[C@@H]1OC[C@@H](NC(N)=N)[C@@H]1O |r|

BDBM50251431

CCCCCCCCCCCCCC[C@@H]1OC[C@@H](N)[C@@H]1OC |r|

BDBM50240721

CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)N(C)C |r|

BDBM50266425

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3ccc(cc3)C(F)(F)F)cc2)CCCN1C(N)=N

BDBM50266426

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3cccc(c3)C(F)(F)F)cc2)CCCN1C(N)=N

BDBM50266427

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3ccc(F)c(c3)C(F)(F)F)cc2)CCCN1C(N)=N

BDBM50266428

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3cc(F)cc(c3)C(F)(F)F)cc2)CCCN1C(N)=N

BDBM50266429

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3ccc(cc3)-c3ccccc3)cc2)CCCN1C(N)=N

BDBM50266437

[H][C@@]1(CCCN1C(N)=N)c1nc(no1)-c1ccc(OCCCCCCCC)c(c1)C(F)(F)F |r|

BDBM50266438

[H][C@]1(CCCN1C(N)=N)c1nc(no1)-c1ccc2cc(CCCCCCCC)ccc2c1 |r|

BDBM50266446

[H][C@@]1([C@@H](O)CCN1C(N)=N)c1nc(no1)-c1ccc2cc(OCCCCC)ccc2c1 |r|

BDBM50266447

CC(=O)N(C1CCCCC1)C1C(Cl)C(=O)c2ccccc2C1=O

BDBM50266436

[H][C@@]1(Cc2nc(no2)-c2ccc(Nc3nc(cs3)-c3ccc(OC(F)(F)F)cc3)cc2)CCCN1C(N)=N

BDBM50277230

CCCCOC(=O)Nc1cccc(c1)C(O)CN1CCN(CC1)c1ccncc1

BDBM50443387

CCCCCCCCc1ccc(CCN2CCC(O)CC2)cc1

BDBM50443389

CCCCCc1ccc(\C=C\[C@H](O)[C@@H](CO)NC)cc1 |r|

BDBM50277231

CCCCOC(=O)Nc1ccc(cc1)C(O)CN1CCN(CC1)c1ccncc1

BDBM50277232

CC1Cc2c(N\N=C\c3ccc(Cl)cc3)ncnc2N(C)c2ccccc12

BDBM50462709

O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1

BDBM50463484

CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1

BDBM50463483

O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12

BDBM50463479

CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1

BDBM50496603

CCCCCCCCCCCCCCOC[C@@H](O)[C@H](C)N(C)C |r|

BDBM50496602

CCCCCCCCCCCCCCC[C@@H](O)[C@H](CO)NC(=S)Nc1cccc(c1)C(F)(F)F |r|

BDBM50496601

CCCCCCCCCCCCCCC[C@@H](O)[C@H](C)N |r|

BDBM50514473

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(c1)C(F)(F)F

BDBM50514475

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(c1)C1CC1

BDBM50514476

CCc1cc(ccc1OCc1ccc(cc1)C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50514474

CCCc1cc(ccc1OCc1ccc(cc1)C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50514477

CC(C)c1cc(ccc1OCc1ccc(cc1)C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50514478

CC(C)(C)c1cc(ccc1OCc1ccc(cc1)C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50514480

CCCCCCCCOc1ccc(cc1C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50514479

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)c(CC=C)c1

BDBM50139649

Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1\C=N\c1ccccc1NS(=O)(=O)c1ccc(C)cc1

BDBM50523493

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccc(Cl)cc3)c2)cc1 |r|

BDBM50523496

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OS(=O)(=O)c3ccccc3)c2)cc1 |r|

BDBM50523494

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccccc3)c2)cc1 |r|

BDBM50523497

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3cccc(F)c3)c2)cc1 |r|

BDBM50523498

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccc(F)cc3)c2)cc1 |r|

BDBM50523499

COc1ccc(COc2cccc(OCc3ccc(CN4CCC[C@@H]4CO)cc3)c2)cc1 |r|

BDBM50523500

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccc(cc3)C#N)c2)cc1 |r|

BDBM50523501

OC[C@H]1CCCN1Cc1ccc(COc2cccc(SCc3ccccc3)c2)cc1 |r|

BDBM50523502

OC[C@H]1CCCN1Cc1ccc(COc2cccc(SCc3ccc(Cl)cc3)c2)cc1 |r|

BDBM50523503

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3cccc(Cl)c3)c2)cc1 |r|

BDBM50523505

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccccc3F)c2)cc1 |r|

BDBM50523506

OC[C@H]1CCCN1Cc1ccc(COc2cccc(CCc3ccccc3)c2)cc1 |r|

BDBM50523504

OC[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccccc3Cl)c2)cc1 |r|

BDBM50523495

OC[C@H]1CCCN1Cc1ccc(COc2cccc(SCc3ccc(F)cc3)c2)cc1 |r|

BDBM50237420

OC[C@H]1CCCN1Cc1ccc(COc2cccc(CS(=O)(=O)c3ccccc3)c2)cc1 |r|

BDBM50536410

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(NC(=O)CN2CCOCC2)c1

BDBM50536679

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|

BDBM50536675

FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1

BDBM50536678

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F

BDBM50536681

Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|

BDBM50537742

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

BDBM50331855

COc1ccc(cc1)-c1cc([nH]n1)C(=O)NN=C(C)c1ccc(OC)c(OC)c1 |w:16.17|

BDBM50546440

COc1ccc(Nc2nc(N)c(s2)C(=O)c2ccc(OC)c(OC)c2)cc1

BDBM50552497

CCCCCCCCCCCCc1ccc(CN2CCC[C@@H]2CO)cc1

BDBM50552498

CCCCCCCCCCCc1ccc(CN2CCC[C@@H]2CO)cc1

BDBM50552499

CCCCCCCCCCc1ccc(CN2CCC[C@@H]2CO)cc1

BDBM50552500

OC[C@H]1CCCN1Cc1ccc(Oc2ccc(cc2)-c2cccc(c2)C(F)(F)F)cc1

BDBM50552501

CCCCCCCCOc1ccc(COc2ccc(cc2C(F)(F)F)-c2noc(n2)[C@@H]2CCCN2C(N)=N)cc1

BDBM50077147

CCCCCCCCc1ccc(cc1)-c1noc(C[C@@H]2CCCN2C(N)=N)n1

BDBM50556206

Cc1ccc(cc1)S(=O)(=O)Nc1cccc(\C=N\c2ccccc2NS(=O)(=O)c2ccc(C)cc2)c1

BDBM50559347

CCCCCCCCCCCCCC[C@H]1NC[C@H](N)[C@@H]1O

BDBM50559348

CCCCCCCCCCCCCC[C@H]1NC[C@H](N)[C@@H]1O |r|

BDBM50562757

CCCCOc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50562758

CCCCCCCCCCn1cc(-c2noc(n2)[C@@H]2CCCN2C(N)=N)c2ccccc12

BDBM50562759

CCCCCCCCCCCCn1cc(-c2noc(n2)[C@@H]2CCCN2C(N)=N)c2ccccc12

BDBM50562760

CCCCCCCCCn1ccc2cc(ccc12)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50562761

CCCCCCCCCCn1ccc2cc(ccc12)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50177006

NC(=N)N1CCC[C@H]1c1nc(no1)-c1ccc2cc(OCc3ccc(cc3)C(F)(F)F)ccc2c1

BDBM50567202

COc1ccc(\C=N\NC(=O)c2cc([nH]n2)-c2ccc3ccccc3c2)cc1OC

BDBM50567203

O=C(N\N=C\c1ccc2OCCOc2c1)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567204

COc1ccc(\C=N\NC(=O)c2cc([nH]n2)-c2ccc3ccccc3c2)cc1

BDBM50567205

COc1ccccc1\C=N\NC(=O)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567206

COc1cccc(\C=N\NC(=O)c2cc([nH]n2)-c2ccc3ccccc3c2)c1

BDBM50567207

COc1ccc2ccccc2c1\C=N\NC(=O)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567208

Oc1ccc(\C=N\NC(=O)c2cc(n[nH]2)-c2ccc3ccccc3c2)cc1

BDBM50567209

Oc1cccc(\C=N\NC(=O)c2cc(n[nH]2)-c2ccc3ccccc3c2)c1

BDBM50567210

Oc1ccccc1\C=N\NC(=O)c1cc(n[nH]1)-c1ccc2ccccc2c1

BDBM50567211

O=C(N\N=C\C1CCCCC1)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567212

O=C(N\N=C\c1cccc2ccccc12)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567213

O=C(N\N=C\c1ccccc1)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567214

O=C(N\N=C\c1cccnc1)c1cc([nH]n1)-c1ccc2ccccc2c1

BDBM50567215

Clc1ccc(\C=N\NC(=O)c2cc([nH]n2)-c2ccc3ccccc3c2)cc1

BDBM50567216

[O-][N+](=O)c1cccc(\C=N\NC(=O)c2cc([nH]n2)-c2ccc3ccccc3c2)c1

BDBM50331854

Oc1ccc2ccccc2c1C=NNC(=O)c1cc(n[nH]1)-c1ccc2ccccc2c1 |w:12.14|

BDBM50605390

CN(CCO)Cc1ccc(COc2cc(C)cc(CS(=O)(=O)c3ccccc3)c2)cc1

BDBM50605389

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CCCCC3CO)cc2)c1

BDBM50605388

Cc1cc(CS(=O)(=O)c2ccc(F)cc2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605387

Cc1cc(CS(=O)(=O)c2ccc(Cl)cc2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605386

Cc1cc(CS(=O)(=O)c2ccc(Br)cc2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605385

Cc1ccc(cc1)S(=O)(=O)Cc1cc(C)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605383

Cc1cc(CS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605381

Cc1cc(CS(=O)(=O)C2CC2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50605382

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCCCCCCCN2CCC[C@@H]2CO)c1 |r|

BDBM50605380

OC[C@H]1CCCN1Cc1ccc(COc2cc(CS(=O)(=O)c3ccccc3)cc(c2)C(F)(F)F)cc1 |r|

BDBM50605384

Cc1cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)cc(CS(=O)(=O)c2ccccc2)c1Br |r|

BDBM50323217

C[C@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(cc1)-c1noc(CCC2CCCC2)n1 |r|

BDBM50438132

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50605391

CCCCCCCCc1ccc(cc1)-c1noc(C[C@@H]2CCCN2C(N)=N)n1 |r|

BDBM50407504

Cl.CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(N)=N

BDBM50407505

CCCCCCCCCCCCC\C=C\[C@H](O)[C@@H](CO)N(C)C |r|

BDBM50009730

CCCCCCCCCCCCC\C=C\C(O)C(N)CO

BDBM50407506

CCCCCCCCOc1ccc(cc1C(F)(F)F)-c1noc(n1)[C@@H]1CCCN1C(N)=N |r|

BDBM50407507

CCCCCCCCOc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1[C@@H](O)CCN1C(N)=N |r|

BDBM50407508

COc1ccc2[nH]c(=O)c(\C=C\C(=O)c3ccc(Nc4nccc(n4)-c4ccc5ccccc5c4)cc3)cc2c1

BDBM50407509

Brc1cc2CC3CC(CCc4ccccc4)N(O3)c2c2ccccc12

BDBM50407510

CCCCCCCCCCCCCC[C@@H]1OC[C@H](N)[C@@H]1O |r|

BDBM50407511

CCCCCCCCCCCCCC[C@H]1OC[C@H](N)[C@@H]1O |r|

BDBM50407512

N[C@H]1CN[C@H](CCCCCCCCCCCOC2CCOCC2)[C@H]1O |r|

BDBM50407513

CCCOCCCCCCCCCC[C@@H]1OC[C@@H](N)[C@@H]1O |r|

BDBM7460

c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O

BDBM4078

c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O

BDBM50628294

OCCNC(=O)c1ccc(COc2cccc(OCc3ccccc3)c2)cc1

BDBM50628295

NC(=O)[C@@H]1CCCN1C(=O)c1ccc(COc2cccc(OCc3ccccc3)c2)cc1 |r|

BDBM50628296

NC(=O)CNCc1ccc(COc2cccc(OCc3ccccc3)c2)cc1

BDBM50628297

NC(=O)[C@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccccc3)c2)cc1 |r|

BDBM50628298

OC[C@H]1CCCN1C(=O)c1ccc(OCc2noc(n2)-c2ccc(Cl)cc2)cc1 |r|

BDBM50628299

NCCNC(=O)c1ccc(OCc2noc(n2)-c2ccc(Cl)cc2)cc1

BDBM50628300

OC[C@@H]1CCCN1C(=O)c1ccc(OCc2noc(n2)-c2ccc(Cl)cc2)cc1 |r|

BDBM50628301

NC(=O)[C@H]1CCCN1C(=O)c1ccc(OCc2noc(n2)-c2ccc(cc2)C(F)(F)F)cc1 |r|

BDBM50628302

OC[C@H]1CCCN1C(=O)c1ccc(OCc2noc(n2)-c2ccc(cc2)C(F)(F)F)cc1 |r|

BDBM50628303

OC[C@@H]1CCCN1Cc1ccc(COc2cccc(OCc3ccccc3)c2)cc1 |r|

BDBM174948

Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F

BDBM50268986

CCCCCCCCCCCCCC#CC(=O)[C@@H]1COC(C)(C)N1C(=O)OC(C)(C)C |r|

BDBM50269039

CCCCCCCCCCCCCCCC(=O)C(C=O)=NC(=O)OC(C)(C)C |w:20.20|

BDBM50293706

N[C@@H](CO)[C@H](O)\C=C\CCCCCCc1ccc(I)cc1 |r|

BDBM50293707

N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCc1ccc(I)cc1 |r|

BDBM50293708

N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCc1ccc(I)cc1 |r|

BDBM50293709

N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCCc1ccc(I)cc1 |r|

BDBM50293710

N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCCCc1ccc(I)cc1 |r|

BDBM50293711

N[C@@H](CO)[C@H](O)\C=C\CCCCCCCCCCCCCc1ccc(I)cc1 |r|

BDBM50299310

CCCCCCCCc1ccc(NC(=O)[C@H](N)CO)cc1 |r|

BDBM50299311

CCCCCCCCc1ccc(NC(=O)[C@@H](N)CO)cc1 |r|

BDBM50299312

CCCCCCCCc1ccc(NC(=O)C(C)(N)CO)cc1

BDBM50299313

CCCCCCCCc1ccc(NC(=O)[C@@H](N)COC)cc1 |r|

BDBM50299314

CCCCCCCCc1ccc(NC(=O)C(N)C(C)(C)O)cc1

BDBM50299315

CCCCCCCCc1ccc(NC(=O)[C@H](CO)NC)cc1 |r|

BDBM50172238

CCCCCCCCc1ccc(NC(=O)[C@@H](N)[C@@H](C)O)cc1

BDBM50299316

CCCCCCCCc1ccc(NC(=O)[C@H](N)[C@H](C)O)cc1 |r|

BDBM50299317

CCCCCCCCc1ccc(NC(=O)[C@H](N)[C@@H](C)O)cc1 |r|

BDBM50299318

CCCCCCCCc1ccc(NC(=O)[C@@H](N)[C@H](C)O)cc1 |r|

BDBM50299319

CCCCCCCCc1ccc(NC(=O)[C@@H](N)[C@@H](O)CC)cc1 |r|

BDBM50299320

CCCCCCCCc1ccc(CNC(=O)C(N)CO)cc1

BDBM50299321

CCCCCCCCc1ccc(NC[C@@H](N)CO)cc1 |r|

BDBM50299322

CCCCCCCCc1ccc(NC(=O)[C@H](N)CCO)cc1 |r|

BDBM50299323

CCCCCCCCc1ccc(NC(=O)[C@@H](N)CCO)cc1 |r|

BDBM50299324

CCCCCCCCc1ccc(NC(=O)C(N)CCCO)cc1

BDBM50299325

CCCCCCCCc1ccc(NC(=O)[C@@H](N)CCCCO)cc1 |r|

BDBM50299326

CCCCCCCCc1ccc(CNC(=O)C(N)CCO)cc1

BDBM50299327

CCCCCCCCc1ccc(NCC(N)CCO)cc1

BDBM50299328

CCCCCCCCc1ccc(NC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50299329

CCCCCCCCc1ccc(NC(=O)[C@H]2NCC[C@H]2O)cc1 |r|

BDBM50299330

CCCCCCCCc1ccc(NC(=O)[C@H]2NC[C@@H](O)[C@@H]2O)cc1 |r|

BDBM50299331

CCCCCCCCc1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50299332

CCCCCCCCc1ccc(CCNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50299333

CCCCCCCCc1ccc(NC[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323215

CC[C@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(cc1)-c1noc(CCC2CCCCC2)n1 |r|

BDBM50323216

C[C@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(cc1)-c1noc(CCC2CCCCC2)n1 |r|

BDBM50323218

CCCCCCCc1nc(no1)-c1ccc(cc1)[C@@H](NC(=O)[C@H]1NCC[C@@H]1O)C(C)C |r|

BDBM50323219

CCCCCCCc1nc(no1)-c1ccc(cc1)[C@H](CC)NC(=O)[C@H]1NCC[C@@H]1O |r|

BDBM50323220

CCCCCCCc1nc(no1)-c1ccc(cc1)[C@H](C)NC(=O)[C@H]1NCC[C@@H]1O |r|

BDBM50323221

CCCCCCCc1nc(no1)-c1ccc(cc1)[C@@H](C)NC(=O)[C@H]1NCC[C@@H]1O |r|

BDBM50323222

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(CCc2ccccc2)n1 |r|

BDBM50323223

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(CCC2CCCCC2)n1 |r|

BDBM50323224

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(CCC2CC2)n1 |r|

BDBM50323225

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(CCC2CCCC2)n1 |r|

BDBM50323226

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(n1)C1CCCCCC1 |r|

BDBM50323227

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(n1)C1CCCC1 |r|

BDBM50323228

CC1(CCCCC1)c1nc(no1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323229

O[C@H]1CCN[C@@H]1C(=O)NCc1ccc(cc1)-c1noc(n1)C1CCCCC1 |r|

BDBM50323230

CCCCCc1nc(no1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323231

CCCCCCc1nc(no1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323232

CCCCCCCc1cc(n[nH]1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323233

CCCCCCCc1cnc(s1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323234

CCCCCCCc1noc(n1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323235

CCCCCCCc1cn(nn1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323236

CCCCCCCc1nnc(o1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323237

CCCCCCCc1nc(nn1C)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323238

CCCCCCCCc1nc(no1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323239

CCCCCCCCc1nc(no1)-c1ccc(NC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323240

CCCCCCCc1nc(no1)-c1ccc(CNC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323241

CCCCCCCc1nc(no1)-c1ccc(NC(=O)[C@H]2NCC[C@@H]2O)cc1 |r|

BDBM50323242

CC[C@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(cc1)-c1noc(CCC2CCCC2)n1 |r|

BDBM50343811

CCCCCCCCCCCCCCNC(=O)C1(CC1)C(N)=N

BDBM50343812

CCCCCCCCCCCCCCCCNC(=O)C1(CC1)C(N)=N

BDBM50343813

CCCCCCCCCCCCCCCCCCNC(=O)C1(CC1)C(N)=N

BDBM50343814

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCc2ccccc2)cc1

BDBM50343815

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCCc2ccccc2)cc1

BDBM50343816

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCc2ccccc2)cc1

BDBM50343817

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCOCC2CCCCC2)cc1

BDBM50343818

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC2CCCCC2)cc1

BDBM50343819

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCCOCC2CCCCC2)cc1

BDBM50343820

NC(=N)C1(CC1)C(=O)Nc1ccc(CCCCCCCOCC23CC4CC(CC(C4)C2)C3)cc1 |TLB:21:22:25:29.28.27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22|

BDBM50343821

NC(=N)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCCC1

BDBM50343822

NC(=N)C1(CC1)C(=O)NCCCCCCCCCCOCC1CCCC1

BDBM50343823

NC(=N)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1

BDBM50343824

NC(=N)C1(CC1)NC(=O)c1ccc(CCCCCCCOCC2CCCC2)cc1

BDBM50343825

CCCCOCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(N)=N

BDBM50343826

CCCCCCCCCCCOc1ccc(cc1)C(=O)NC1(CC1)C(N)=N

BDBM50343827

NC(=N)C1(CC1)NC(=O)CCCCCCCCCCOCC1CCCCC1

BDBM50343828

CCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CCC1)C(N)=N

BDBM50343829

CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@H]1C(N)=N |r|

BDBM50343830

CCCCCCCCCCCCc1ccc(cc1)C(=O)N1CCC[C@@H]1C(N)=N |r|

BDBM50343831

NC(=N)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCOCC2CCCCC2)cc1 |r|

BDBM50343832

NC(=N)[C@@H]1CCCN1C(=O)c1ccc(CCCCCCCCCC2CCCCC2)cc1 |r|

BDBM50343833

NC(=N)[C@@H]1CCCN1C(=O)CCCCCCCCCCOCC1CCCCC1 |r|

BDBM50343834

NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(c[nH]1)-c1cccc(CCC2CCCCC2)c1 |r|

BDBM50343835

NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(co1)-c1cccc(CCC2CCCCC2)c1 |r|

BDBM50343836

NC(=N)[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1nc(cs1)-c1cccc(CCC2CCCCC2)c1 |r|

BDBM50359972

CCCCCCCCc1ccc(cc1)[C@@H]1CC[C@@H](CC1)NC |r,wU:17.21,14.14,(10.36,-24.91,;9.02,-25.67,;7.68,-24.91,;6.35,-25.67,;5.02,-24.91,;3.68,-25.67,;2.35,-24.91,;1.01,-25.67,;-.32,-24.91,;-.32,-23.37,;-1.65,-22.59,;-2.98,-23.37,;-2.98,-24.91,;-1.65,-25.67,;-4.32,-22.59,;-4.32,-21.05,;-5.65,-20.29,;-6.99,-21.05,;-6.99,-22.59,;-5.65,-23.37,;-8.32,-20.29,;-9.65,-21.05,)|

BDBM50359973

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)NCCO |r,wU:14.14,wD:17.21,(12.8,-36.55,;14.13,-37.32,;14.13,-38.86,;15.47,-39.63,;15.47,-41.17,;16.79,-41.94,;16.79,-43.48,;18.13,-44.25,;19.47,-43.48,;20.8,-44.25,;22.13,-43.48,;22.13,-41.94,;20.8,-41.17,;19.47,-41.94,;23.47,-41.17,;23.47,-39.63,;24.8,-38.86,;26.13,-39.63,;26.13,-41.17,;24.8,-41.94,;27.47,-38.86,;28.81,-39.63,;30.13,-38.86,;31.47,-39.63,)|

BDBM50359974

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@H](N)CC1 |r,wU:14.14,wD:17.18,(33.29,-3.69,;31.96,-4.46,;30.63,-3.69,;29.3,-4.46,;27.96,-3.69,;26.64,-4.46,;25.3,-3.69,;23.97,-4.46,;22.63,-3.69,;22.63,-2.16,;21.31,-1.39,;19.97,-2.16,;19.97,-3.69,;21.31,-4.46,;18.65,-1.39,;17.31,-2.16,;15.98,-1.39,;15.98,.15,;14.64,.92,;17.31,.92,;18.65,.15,)|

BDBM50359975

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)N(C)C |r,wU:14.14,wD:17.21,(16.15,-9.43,;17.48,-10.2,;17.48,-11.74,;18.82,-12.51,;18.82,-14.05,;20.15,-14.82,;20.15,-16.36,;21.49,-17.13,;22.81,-16.36,;24.15,-17.13,;25.49,-16.36,;25.49,-14.82,;24.15,-14.05,;22.81,-14.82,;26.82,-14.05,;26.82,-12.51,;28.15,-11.74,;29.49,-12.51,;29.49,-14.05,;28.15,-14.82,;30.82,-11.74,;30.82,-10.2,;32.15,-12.51,)|

BDBM50359976

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)C |r,wU:14.14,wD:17.21,(-6.9,-36.2,;-5.57,-36.97,;-5.57,-38.51,;-4.24,-39.28,;-4.24,-40.82,;-2.91,-41.59,;-2.91,-43.13,;-1.57,-43.89,;-.24,-43.13,;1.09,-43.89,;2.43,-43.13,;2.43,-41.59,;1.09,-40.82,;-.24,-41.59,;3.75,-40.82,;3.75,-39.28,;5.09,-38.51,;6.42,-39.28,;6.42,-40.82,;5.09,-41.59,;7.75,-38.51,;9.08,-39.28,;7.75,-36.97,;9.07,-37.73,)|

BDBM50359977

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:14.14,wD:17.21,(13.28,-44.88,;11.94,-45.65,;10.61,-44.88,;9.28,-45.65,;7.95,-44.88,;6.62,-45.65,;5.29,-44.88,;3.95,-45.65,;2.62,-44.88,;2.62,-43.35,;1.29,-42.58,;-.04,-43.35,;-.04,-44.88,;1.29,-45.65,;-1.37,-42.58,;-2.7,-43.35,;-4.04,-42.58,;-4.04,-41.04,;-2.7,-40.27,;-1.37,-41.04,;-5.37,-40.27,;-5.37,-38.73,;-6.7,-41.04,;-6.71,-39.49,;-6.71,-37.96,;-8.04,-37.19,)|

BDBM50359978

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)C(C)C |r,wU:14.14,wD:17.21,(9.12,.65,;7.79,-.12,;6.45,.65,;5.12,-.12,;3.79,.65,;2.46,-.12,;1.12,.65,;-.21,-.12,;-1.55,.65,;-1.55,2.19,;-2.88,2.95,;-4.21,2.19,;-4.21,.65,;-2.88,-.12,;-5.55,2.95,;-6.88,2.19,;-8.21,2.95,;-8.21,4.49,;-6.88,5.27,;-5.55,4.49,;-9.55,5.27,;-9.55,6.81,;-10.88,4.49,;-10.89,6.04,;-10.89,7.58,;-12.23,5.27,)|

BDBM50359979

CCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCO |r,wU:14.14,wD:17.21,(14.2,-24.16,;12.87,-24.93,;11.53,-24.16,;10.2,-24.93,;8.87,-24.16,;7.53,-24.93,;6.19,-24.16,;4.86,-24.93,;3.53,-24.16,;3.53,-22.62,;2.2,-21.85,;.86,-22.62,;.86,-24.16,;2.2,-24.93,;-.47,-21.85,;-1.81,-22.62,;-3.14,-21.85,;-3.14,-20.31,;-1.81,-19.54,;-.47,-20.31,;-4.47,-19.54,;-4.47,-18,;-5.81,-20.31,;-5.82,-18.76,;-5.82,-17.22,;-7.15,-16.45,)|

BDBM50393643

CCCCCCCCCCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:22.22,wD:25.29,(13.61,-48.19,;14.36,-46.84,;15.9,-46.82,;16.65,-45.48,;18.19,-45.46,;18.94,-44.12,;20.48,-44.1,;21.24,-42.75,;22.78,-42.73,;23.53,-41.39,;25.07,-41.37,;25.82,-40.03,;27.36,-40.01,;28.11,-38.66,;29.65,-38.64,;30.41,-37.3,;31.95,-37.28,;32.7,-35.93,;34.24,-35.91,;35.03,-37.23,;34.28,-38.58,;32.74,-38.6,;36.57,-37.2,;37.31,-35.85,;38.85,-35.83,;39.64,-37.16,;38.89,-38.5,;37.36,-38.52,;41.18,-37.13,;42.51,-36.35,;40.78,-35.64,;41.97,-38.46,;43.51,-38.44,;44.3,-39.76,)|

BDBM50393644

CCCCCCCCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:20.20,wD:23.27,(-17.8,-51.88,;-17.06,-50.54,;-15.52,-50.52,;-14.76,-49.17,;-13.22,-49.15,;-12.47,-47.81,;-10.92,-47.79,;-10.17,-46.45,;-8.63,-46.43,;-7.88,-45.08,;-6.34,-45.06,;-5.59,-43.72,;-4.05,-43.7,;-3.29,-42.36,;-1.75,-42.34,;-1,-40.99,;.54,-40.97,;1.33,-42.28,;.58,-43.64,;-.97,-43.66,;2.87,-42.26,;3.61,-40.91,;5.15,-40.89,;5.94,-42.21,;5.19,-43.56,;3.66,-43.58,;7.48,-42.19,;8.81,-41.41,;7.08,-40.69,;8.27,-43.51,;9.81,-43.49,;10.6,-44.82,)|

BDBM50393645

CCCCCCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:18.18,wD:21.25,(15.17,-38.8,;15.92,-37.46,;17.46,-37.44,;18.21,-36.1,;19.75,-36.08,;20.5,-34.73,;22.04,-34.71,;22.8,-33.37,;24.34,-33.35,;25.09,-32.01,;26.63,-31.99,;27.38,-30.64,;28.92,-30.62,;29.68,-29.28,;31.21,-29.25,;32.01,-30.57,;31.25,-31.93,;29.71,-31.95,;33.54,-30.54,;34.28,-29.19,;35.83,-29.17,;36.62,-30.5,;35.87,-31.84,;34.33,-31.86,;38.16,-30.48,;39.49,-29.7,;37.75,-28.98,;38.95,-31.8,;40.49,-31.78,;41.28,-33.1,)|

BDBM50393646

CCCCCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:17.17,wD:20.24,(-15.05,-41.94,;-13.51,-41.92,;-12.76,-40.58,;-11.22,-40.56,;-10.46,-39.22,;-8.92,-39.2,;-8.17,-37.85,;-6.63,-37.83,;-5.87,-36.49,;-4.33,-36.47,;-3.58,-35.13,;-2.04,-35.11,;-1.29,-33.76,;.25,-33.74,;1.04,-35.06,;.29,-36.41,;-1.25,-36.43,;2.58,-35.03,;3.32,-33.68,;4.86,-33.66,;5.66,-34.98,;4.9,-36.33,;3.37,-36.35,;7.2,-34.96,;8.52,-34.18,;6.79,-33.47,;7.98,-36.28,;9.52,-36.26,;10.31,-37.59,)|

BDBM50393647

CCCCCCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:16.16,wD:19.23,(15.59,-31.26,;16.34,-29.91,;17.88,-29.89,;18.64,-28.55,;20.18,-28.53,;20.93,-27.19,;22.47,-27.17,;23.22,-25.82,;24.76,-25.8,;25.51,-24.46,;27.05,-24.44,;27.81,-23.09,;29.35,-23.07,;30.14,-24.39,;29.39,-25.74,;27.84,-25.76,;31.67,-24.36,;32.42,-23.01,;33.96,-22.99,;34.75,-24.31,;34,-25.66,;32.47,-25.68,;36.29,-24.29,;37.62,-23.51,;35.89,-22.8,;37.08,-25.62,;38.62,-25.6,;39.41,-26.92,)|

BDBM50393648

CCCCCCc1ccc(cc1)[C@H]1CC[C@@H](CC1)[N+](C)(C)CCC |r,wU:12.12,wD:15.19,(17.92,-22.42,;18.67,-21.07,;20.21,-21.05,;20.97,-19.71,;22.51,-19.69,;23.26,-18.35,;24.8,-18.33,;25.55,-16.98,;27.09,-16.96,;27.88,-18.27,;27.13,-19.63,;25.59,-19.65,;29.42,-18.24,;30.16,-16.9,;31.71,-16.88,;32.5,-18.2,;31.74,-19.55,;30.21,-19.57,;34.04,-18.18,;35.37,-17.4,;33.63,-16.68,;34.82,-19.5,;36.36,-19.48,;37.15,-20.81,)|

BDBM50426176

CC(=CC(=O)CCC(=O)N1CCN(CC1)Cc2cc3c(s2)c(nc(n3)c4cccc5c4cn[nH]5)N6CCOCC6)C

BDBM50004888

CCCCCCCCc1ccc(CC[C@@](N)(CO)\C=C\P(O)(O)=O)cc1 |r|

BDBM50433311

CCCCCCCCc1ccc(CC[C@@](CO)(\C=C\P(O)(O)=O)N=[N+]=[N-])cc1 |r|

BDBM50433312

CCCCCCCCc1ccc(CC[C@@](CF)(\C=C\P(O)(O)=O)N=[N+]=[N-])cc1 |r|

BDBM50438113

CCCCCCCCCCCCc1ccc(cc1)C(=O)NC1(CC1)C(N)=N

BDBM50438114

CCCCc1ccc(\C=C\[C@H](O)[C@@H](CO)NC)cc1 |r|

BDBM50438119

OC[C@H]1C[C@@H](O)CCN1CCCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50438120

COC[C@H]1CCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438123

COc1ccccc1-c1csc(Nc2ccc(CCN3CCCC[C@@H]3CO)cc2)n1 |r|

BDBM50438124

OC1CCCN(CCc2ccc(Nc3nc(cs3)-c3ccc4ccccc4c3)cc2)C1

BDBM50438125

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2)cc1 |r|

BDBM50438126

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)C23CC4CC(CC(C4)C2)C3)cc1 |r,TLB:24:25:23.22.28:29,THB:24:23:25.30.26:29,26:25:22:28.27.29,26:27:24.25.30:22|

BDBM50438128

OC1CCN(CCc2ccc(Nc3nc(cs3)-c3ccc4ccccc4c3)cc2)CC1

BDBM50438118

OCC1CCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1

BDBM50438137

CC(C)(C)c1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50438141

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc(cc2)C#N)cc1 |r|

BDBM50438139

OCCC1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1

BDBM50438145

OCC1CS(=O)(=O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1

BDBM50438138

OCC1COCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1

BDBM50438147

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(F)cc2)cc1 |r|

BDBM50438136

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2cccc(F)c2)cc1 |r|

BDBM50438146

Cc1ccccc1-c1csc(Nc2ccc(CCN3CCCC[C@@H]3CO)cc2)n1 |r|

BDBM50438144

OC[C@@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438131

CN1CCN(CCc2ccc(Nc3nc(cs3)-c3ccc4ccccc4c3)cc2)C(CO)C1

BDBM50438117

OC[C@@H]1CCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438140

OCC1CCCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1

BDBM50438149

COc1cccc(c1)-c1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50438134

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)C2CCCC2)cc1 |r|

BDBM50438116

OC[C@H]1CCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438121

OC[C@@H]1C[C@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438156

OC[C@H]1C[C@H](O)CN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50438157

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2cc(ccc2F)C(F)(F)F)cc1 |r|

BDBM50438135

CCCCc1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50438142

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2Cl)cc1 |r|

BDBM50438150

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2)cc1 |r|

BDBM50438158

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)C2CCCCC2)cc1 |r|

BDBM50438151

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2cccc(Cl)c2)cc1 |r|

BDBM50438161

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2cccc(c2F)C(F)(F)F)cc1 |r|

BDBM50438148

C[C@]1(O)CCN(CCc2ccc(Nc3nc(cs3)-c3ccc4ccccc4c3)cc2)[C@@H](CO)C1 |r|

BDBM50438130

OC[C@H]1C[C@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438129

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2C(F)(F)F)cc1 |r|

BDBM50438127

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2Cl)cc1 |r|

BDBM50438115

OCC1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1

BDBM50438165

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2)cc1 |r|

BDBM50438162

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2F)cc1 |r|

BDBM50438166

OC[C@H]1C[C@@H](O)CN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50438167

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(cc2F)C(F)(F)F)cc1 |r|

BDBM50438163

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2cccc(c2)C(F)(F)F)cc1 |r|

BDBM50438122

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2F)cc1 |r|

BDBM50438154

Cc1cccc(c1)-c1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50438152

COc1ccc(cc1)-c1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50438143

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc(cc2)C(F)(F)F)cc1 |r|

BDBM50438155

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccccc2Cl)cc1 |r|

BDBM50438159

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2)cc1 |r|

BDBM50438133

OC[C@H]1CCCCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438169

OC[C@H]1C[C@H](O)CN1CCCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50438160

OC[C@H]1C[C@@H](O)CN1CCCc1ccc(Nc2nc(cs2)-c2ccc(Cl)c(Cl)c2)cc1 |r|

BDBM50438164

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2cccc(Cl)c2)cc1 |r|

BDBM50438153

OC[C@H]1C[C@@H](O)CCN1CCc1ccc(Nc2nc(cs2)-c2ccc3ccccc3c2)cc1 |r|

BDBM50438168

Cc1ccc(cc1)-c1csc(Nc2ccc(CCN3CC[C@H](O)C[C@@H]3CO)cc2)n1 |r|

BDBM50443383

CCCCCCCCCCCCc1ccc(CCN2CCC[C@@H]2CO)cc1 |r|

BDBM50443384

CCCCCCCCc1ccc(CCN2CCC[C@@H]2CO)cc1 |r|

BDBM50443385

CCCCCCCCCCCCCCC[C@H](O)[C@@H](N)CO

BDBM50443386

CCCCCCCCc1ccc(CCN2CCC(N)CC2)cc1

BDBM50017015

CCCCCCCCCCCCC/C=C/[C@H](O)[C@@H](CO)NC(=N)N

BDBM50017017

Oc1ccc(CCNC(=O)C23CC4CC(C2)CC(C4)(C3)c2ccc(Cl)cc2)cc1O |TLB:18:17:11.12.13:15,THB:18:12:15:19.17.16,16:17:11:13.14.15,16:14:11:19.18.17,20:17:11:13.14.15,20:17:11.12.13:15|

BDBM50017018

Cc1cc(C[S+]([O-])(=O)c2ccccc2)cc(OCc2ccc(CN3CCC[C@H]3CO)cc2)c1

BDBM50023443

Cc1csc(Nc2nc(cs2)-c2nccs2)n1

BDBM50077142

C[C@@H](NC(=O)[C@H]1NCC[C@@H]1O)c1ccc(cc1)-c1noc(CCC2CCCC2)n1 |r|

BDBM50077143

Cl.CCCCCCCCc1ccc(cc1)-c1noc(n1)[C@@H]1CCN1C(N)=N |r|

BDBM50077144

Cl.[H][C@]1([C@@H](O)CCN1C(N)=N)c1nc(no1)-c1ccc(CCCCCCCC)cc1 |r|

BDBM50077145

Cl.[H][C@]1(C[C@@H](O)CN1C(N)=N)c1nc(no1)-c1ccc(CCCCCCCC)cc1 |r|

BDBM50077146

Cl.CCCCCCCCc1ccc(cc1)-c1nc(no1)[C@@H]1CCCN1C(N)=N |r|

BDBM50139648

OC[C@H]1C[C@H](O)CN1CCCc1ccc(Nc2nc(cs2)-c2cccc(c2)C(F)(F)F)cc1 |r|

BDBM50139651

Clc1ccc(cc1)-c1nnc(NCc2ccncc2)o1

BDBM50139652

Oc1ccc(Nc2nnc(o2)-c2ccc(I)cc2)cc1

BDBM50175275

CCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175276

CCCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175278

CCCCCCCCCCCCCc1ccc(cc1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175279

CCCCCCCCCCCCc1cccc(c1)C(=O)NC1(CC1)C(N)=N

BDBM50175280

CCCCCCCCCCc1cccc(c1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175281

CCCCCCCCCCCc1cccc(c1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175282

CCCCCCCCCCCCc1cccc(c1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175283

CCCCCCCCCCCCCc1cccc(c1)-c1noc(n1)C1(CC1)C(N)=N

BDBM50175284

CCCCCCCCCCCCc1ccc(cc1)-c1nc(no1)C1(CC1)C(N)=N

BDBM50175285

CCCCCCCCCCCCc1cccc(c1)-c1nc(no1)C1(CC1)C(N)=N

BDBM50175286

CCCCCCCCCCCCc1ccc(cc1)-c1nnc(o1)C1(CC1)C(N)=N

BDBM50175287

CCCCCCCCCCCCc1cccc(c1)-c1nnc(o1)C1(CC1)C(N)=N

BDBM50177004

CCCCCOc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50177005

CCCCCCOc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1CCCN1C(N)=N

BDBM50177007

CCCCCOc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1[C@@H](O)CCN1C(N)=N

BDBM50177008

CC(C)COc1ccc2cc(ccc2c1)-c1noc(n1)[C@@H]1[C@@H](O)CCN1C(N)=N

BDBM50178352

Oc1ccc(CNC(=O)C23CC4CC(C2)CC(C4)(C3)c2ccc(Cl)cc2)cc1O |TLB:10:9:17.11.12:15,12:13:18:17.11.10,THB:10:11:15:18.9.14|

BDBM50178353

COc1cccc(COc2ccc(\C=N\NC(=O)c3cccc(O)c3)cc2)c1

BDBM50178354

COc1cccc(COc2ccc(\C=N\NC(=O)c3ccc(O)cc3)cc2)c1

BDBM50178355

Oc1cc(O)cc(c1)C(=O)N\N=C\c1cccc(OCc2ccccc2C(F)(F)F)c1

BDBM50178356

Oc1ccc(cc1O)C(=O)N\N=C\c1cccc(OCc2ccccc2C(F)(F)F)c1

BDBM50178357

Oc1cccc(c1)C(=O)N\N=C\c1cccc(OCc2ccccc2C(F)(F)F)c1

BDBM50178358

Oc1ccc(cc1)C(=O)N\N=C\c1cccc(OCc2ccccc2C(F)(F)F)c1

BDBM50178359

Oc1cc(O)cc(c1)C(=O)N\N=C\c1ccc(OCc2ccccc2C(F)(F)F)cc1

BDBM50178360

Oc1ccc(cc1O)C(=O)N\N=C\c1ccc(OCc2ccccc2C(F)(F)F)cc1

BDBM50178361

Oc1cccc(c1)C(=O)N\N=C\c1ccc(OCc2ccccc2C(F)(F)F)cc1

BDBM50178362

Oc1ccc(cc1)C(=O)N\N=C\c1ccc(OCc2ccccc2C(F)(F)F)cc1

BDBM50178613

COc1cccc(COc2ccc(\C=N\NC(=O)c3ccc(O)c(O)c3)cc2)c1

BDBM50178610

COc1cccc(COc2ccc(\C=N\NC(=O)c3cc(O)cc(O)c3)cc2)c1

BDBM50178609

COc1cccc(COc2cccc(\C=N\NC(=O)c3ccc(O)cc3)c2)c1

BDBM50178548

COc1cccc(COc2cccc(\C=N\NC(=O)c3cccc(O)c3)c2)c1

BDBM50178533

COc1cccc(COc2cccc(\C=N\NC(=O)c3ccc(O)c(O)c3)c2)c1

BDBM50178505

COc1cccc(COc2cccc(\C=N\NC(=O)c3cc(O)cc(O)c3)c2)c1

BDBM50178504

O=C(N\N=C\c1cccc(OCc2ccccc2)c1)c1ccc2[nH]cnc2c1

BDBM50178503

COc1ccc(COc2ccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1

BDBM50178502

COc1cccc(COc2ccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)cc2)c1

BDBM50178501

COc1ccccc1COc1ccc(\C=N\NC(=O)c2cc(O)c(O)c(O)c2)cc1

BDBM50178500

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccc3ccccc3c2)cc1

BDBM50178499

CC(C)(C)c1ccc(COc2ccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1

BDBM50178498

Cc1ccc(COc2ccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)cc2)cc1

BDBM50178497

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccc(cc2)C#N)cc1

BDBM50178447

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2cccc(c2)C#N)cc1

BDBM50178446

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccccc2C#N)cc1

BDBM50178445

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1

BDBM50178444

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2cccc(c2)C(F)(F)F)cc1

BDBM50178443

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccccc2C(F)(F)F)cc1

BDBM50178442

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1ccc(OCc2ccccc2)cc1

BDBM50178441

COc1ccc(COc2cccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)c2)cc1

BDBM50178440

COc1cccc(COc2cccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)c2)c1

BDBM50178439

COc1ccccc1COc1cccc(\C=N\NC(=O)c2cc(O)c(O)c(O)c2)c1

BDBM50178438

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2cccc3ccccc23)c1

BDBM50178437

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccc(cc2)C#N)c1

BDBM50178436

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2cccc(c2)C#N)c1

BDBM50178435

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccccc2C#N)c1

BDBM50178434

CC(C)(C)c1ccc(COc2cccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)c2)cc1

BDBM50178433

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccc(Cl)cc2)c1

BDBM50178413

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2cccc(Cl)c2)c1

BDBM50178412

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccccc2Cl)c1

BDBM50178411

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccc(F)cc2)c1

BDBM50178410

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2cccc(F)c2)c1

BDBM50178409

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccccc2F)c1

BDBM50178408

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccc(cc2)C(F)(F)F)c1

BDBM50178407

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2cccc(c2)C(F)(F)F)c1

BDBM50178406

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccccc2C(F)(F)F)c1

BDBM50178405

Cc1ccc(COc2cccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)c2)cc1

BDBM50178365

Cc1cccc(COc2cccc(\C=N\NC(=O)c3cc(O)c(O)c(O)c3)c2)c1

BDBM50178364

Cc1ccccc1COc1cccc(\C=N\NC(=O)c2cc(O)c(O)c(O)c2)c1

BDBM50178363

Oc1cc(cc(O)c1O)C(=O)N\N=C\c1cccc(OCc2ccccc2)c1

BDBM50208911

CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|

BDBM50237413

Cc1nc2ccc(cc2n1C[C@H]1CCCO1)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237414

Cc1nc2ccc(cc2n1C[C@H]1CCCO1)-c1ccc(CN2CCC[C@H]2CO)cc1 |r|

BDBM50237415

Cc1nc2ccc(cc2n1C[C@@H]1CCCO1)-c1ccc(CN2CCC[C@H]2CO)cc1 |r|

BDBM50237416

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CCC[C@H]3CO)cc2)c1

BDBM50237417

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CC[C@H](O)C3)cc2)c1 |r|

BDBM50237418

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3C[C@@H](O)[C@H](O)C3)cc2)c1 |r|

BDBM50237419

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CNCCO)cc2)c1

BDBM50237421

OC[C@H]1CCCN1Cc1ccc(COc2cccc(CS(=O)(=O)C3CC3)c2)cc1 |r|

BDBM50237422

CC(C)c1cccc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50237423

Cc1nc(no1)-c1cccc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50237424

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc3[nH]c(N)nc3c2)c1

BDBM50237425

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc3[nH]cnc3c2)c1

BDBM50237426

Cc1nc2ccc(cc2n1CCC1CCC1)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237427

Cc1nc2ccc(cc2n1CC1CCCC1)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237428

Cc1nc2ccc(cc2n1Cc1ccccc1)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237429

CC(C)Cn1c(C)nc2ccc(cc12)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237430

Cc1nc2ccc(cc2n1C[C@H]1CCCO1)-c1ccc(CN2CCCC2)cc1 |r|

BDBM50237431

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3C[C@H](O)[C@H](O)C3)cc2)c1 |r|

BDBM50237432

CS(=O)(=O)Cc1cccc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1 |r|

BDBM50237433

OC[C@H]1CCCN1Cc1ccc(COc2cccc(NC(=O)c3ccccc3)c2)cc1 |r|

BDBM50237434

Cc1nc2ccc(cc2n1C[C@@H]1CCCO1)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237436

CC(C)CCn1c(C)nc2ccc(cc12)-c1ccc(CN2CCC[C@@H]2CO)cc1 |r|

BDBM50237437

Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CC[C@@H](O)C3)cc2)c1 |r|

BDBM50237435

OC[C@H]1CCCN1Cc1ccc(COc2cccc(c2)C2CCCCC2)cc1 |r|