SMILES for 3-oxo-5-alpha-steroid 4-dehydrogenase 2

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)C1[C@H]2C[C@@H]3C[C@@H](C[C@H]1C3)C2 |wU:19.23,27.31,1.0,14.16,wD:25.35,29.32,23.27,t:7,THB:28:27:24:22.29.30,26:27:22:25.24.30,26:25:22:27.28.31,(3.55,-4.37,;3.55,-5.91,;2.22,-5.13,;.87,-5.89,;.85,-7.43,;2.18,-8.22,;2.18,-9.75,;.85,-10.51,;-.48,-9.74,;-1.81,-10.51,;-3.13,-9.74,;-4.47,-10.51,;-3.13,-8.2,;-1.81,-7.43,;-.48,-8.2,;-.48,-6.66,;3.52,-7.47,;4.98,-7.96,;5.91,-6.73,;5.02,-5.47,;5.51,-4,;4.49,-2.85,;7.03,-3.69,;7.68,-2.32,;9.26,-2.41,;10.44,-3.52,;10.04,-2.15,;8.55,-2.06,;7.98,-3.37,;8.24,-4.78,;9.78,-4.88,;7.35,-.8,)|

BDBM50043612

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C |t:15|

BDBM50039268

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1 |t:7|

BDBM50057477

CC(C)Cc1ccc(cc1)C(Nc1cccc(c1)C(=O)c1cn(CCCC(O)=O)c2ccccc12)c1ccc(CC(C)C)cc1

BDBM50069236

OC(=O)CCCOc1ccccc1-c1cc2cc(ccc2o1)C(=O)NC(c1ccccc1)c1ccccc1

BDBM50069237

OC(=O)CCCOc1ccccc1-c1cc2ccc(cc2o1)C(=O)NC(c1ccccc1)c1ccccc1

BDBM50069235

OC(=O)CCCOc1ccccc1-c1cc2ccc(cc2o1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1

BDBM50069239

COc1ccc(cc1)C(NC(=O)c1ccc2cc(oc2c1)-c1ccccc1OCCCC(O)=O)c1ccc(OC)cc1

BDBM50070044

CN1[C@@H]2CCc3cc(\C=C\c4ccc5ccccc5n4)ccc3[C@@]2(C)CCC1=O

BDBM50070045

CN1[C@@H]2CCc3cc(CC(=O)Nc4ccccc4)ccc3[C@@]2(C)CCC1=O

BDBM50070046

CN1[C@@H]2CCc3cc(\C=C\c4cnc5ccccc5c4)ccc3[C@@]2(C)CCC1=O

BDBM50070047

CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)-c1ccco1

BDBM50070049

CN1[C@@H]2CCc3cc(\C=C/c4ccccc4)ccc3[C@@]2(C)CCC1=O

BDBM50070053

CN1[C@@H]2CCc3cc(CC(O)=O)ccc3[C@@]2(C)CCC1=O

BDBM50070051

CN1[C@@H]2CCc3cc(\C=C\c4ccccc4)ccc3[C@@]2(C)CCC1=O

BDBM50070048

CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)-c1cccs1

BDBM50070054

CN1[C@@H]2CCc3cc(ccc3[C@@]2(C)CCC1=O)C#Cc1ccccc1

BDBM50070055

CN1[C@@H]2CCc3cc(\C=C\c4cncc5ccccc45)ccc3[C@@]2(C)CCC1=O

BDBM50070052

CN1[C@@H]2CCc3cc(CC(N)=O)ccc3[C@@]2(C)CCC1=O

BDBM50070056

CN1[C@@H]2CCc3cc(CC(=O)NC(C)(C)C)ccc3[C@@]2(C)CCC1=O

BDBM50070050

CCN(CC)C(=O)Cc1ccc2c(CC[C@H]3N(C)C(=O)CC[C@]23C)c1

BDBM50078267

OC(=O)c1ccc(cc1)-c1ccc2n(Cc3ccccc3)ccc2c1

BDBM50032771

CC(C)CCCC(C)C1CCC2C3[C@@H](C)CC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50032762

CN1C2CCc3cc(Cl)ccc3[C@H]2CCC1=O

BDBM50091706

OC(=O)c1ccc-2c(CCc3cc(\C=C\c4ccccc4)ccc-23)c1

BDBM50091707

CN1CC(CCC1=O)c1ccc(\C=C\c2ccccc2)cc1

BDBM50091710

CN1CC(CCC1=O)c1ccc(cc1)\N=N\c1ccccc1

BDBM50094189

CC12CCC3C(CC=C4CC(=O)CCC34C)C1CCC2CC1CN1 |t:7|

BDBM50149331

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccccc1 |c:1|

BDBM50157221

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccccc1F |c:1|

BDBM50149330

COC(=O)c1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:21|

BDBM50157225

CCN(CC)C(=O)c1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:24|

BDBM50149343

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)OCc1ccccc1 |c:1|

BDBM50157218

CCCNC(=O)c1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:23|

BDBM50149342

CCOC(=O)c1ccc2N3CCC(=O)C(C)=C3CCc2c1 |c:15|

BDBM50157229

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccc(cc1)C(F)(F)F |c:1|

BDBM50157222

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccc(cc1)C(N)=O |c:1|

BDBM50157231

CCOc1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:20|

BDBM50157233

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccccc1C(F)(F)F |c:1|

BDBM50157232

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccc(N)cc1 |c:1|

BDBM50157220

CC(=O)Nc1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:21|

BDBM50157223

COc1ccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)cc1 |c:19|

BDBM50157219

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1cccc(F)c1 |c:1|

BDBM50149346

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccc(C)cc1 |c:1|

BDBM50157226

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1ccc(F)cc1 |c:1|

BDBM50149323

COC(=O)c1cccc(OC(=O)c2ccc3N4CCC(=O)C(C)=C4CCc3c2)c1 |c:22|

BDBM50157230

CC1=C2CCc3cc(ccc3N2CCC1=O)C(=O)Oc1cccc(c1)C(F)(F)F |c:1|

BDBM50149345

COC(=O)c1ccc2N3CCC(=O)C(C)=C3CCc2c1 |c:14|

BDBM50180893

Cc1cc(CC(O)=O)ccc1C(=O)c1ccc(Oc2ccccc2)cc1

BDBM50180894

OC(=O)c1ccc(cc1)C(=O)c1ccc(Oc2ccccc2)cc1

BDBM50180895

OC(=O)Cc1ccc(cc1)C(=O)c1ccc(Oc2ccccc2)cc1

BDBM50180896

OC(=O)c1ccc(cc1)C(=O)c1ccc(OCc2cc(ccc2C(F)(F)F)C(F)(F)F)cc1

BDBM50180899

OC(=O)Cc1ccc(cc1)C(=O)c1ccc(Oc2ccc(Br)cc2)cc1

BDBM50180900

OC(=O)CCc1ccc(cc1)C(=O)c1ccc(Oc2ccccc2)cc1

BDBM50180898

OC(=O)Cc1ccc(C(=O)c2ccc(Oc3ccccc3)cc2)c(F)c1

BDBM50180897

OC(=O)c1ccc(cc1)C(=O)c1ccc(OC(c2ccccc2)c2ccccc2)cc1

BDBM50180901

OC(=O)c1ccc(cc1)C(=O)c1ccc(OCc2ccccc2)cc1

BDBM50180902

OC(=O)c1ccc(cc1)C(=O)c1cccc(OCc2ccccc2)c1

BDBM50180903

OC(=O)\C=C\c1ccc(cc1)C(=O)c1ccc(Oc2ccccc2)cc1

BDBM50102599

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CC1 |r,t:5,19|

BDBM50102601

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCC1 |r,t:5,19|

BDBM50102602

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCCC1 |r,t:5,19|

BDBM50102603

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCCCC1 |r,t:5,19|

BDBM50102605

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCCCCC1 |r,t:5,19|

BDBM50102606

[H][C@@]12CC(C=O)=C(Cl)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(C)=O |r,t:5,19|

BDBM50135093

[H][C@@]12CC=C(C(=O)Cn3cncn3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(C)=O |r,t:3,25|

BDBM50141068

[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C=C(CC[C@]12C)c1nnn[nH]1 |r,c:19,t:17|

BDBM50141090

[H][C@@]12CCC(C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C=C(CC[C@]12C)c1nnn[nH]1 |r,c:21,t:19|

BDBM50141091

[H][C@@]12CC=C3C=C(CC[C@]3(C)[C@@]1([H])CC[C@]1(C)NC(=O)CC[C@@]21[H])c1nnn[nH]1 |r,c:5,t:3|

BDBM50141092

[H][C@@]12CC=C3C=C(CC[C@]3(C)[C@@]1([H])CC[C@]1(C)N(C)C(=O)CC[C@@]21[H])c1nnn[nH]1 |r,c:5,t:3|

BDBM50141093

[H][C@@]12CC=C3C=C(CC[C@]3(C)[C@@]1([H])CC[C@]1(C)N(CC=C)C(=O)CC[C@@]21[H])c1nnn[nH]1 |r,c:5,t:3|

BDBM50284137

CN1C(=O)CCC2C3CC[C@H]4CC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50284138

CC(C)N(C(C)C)C(=O)[C@@H]1CC2CCC3C(CC[C@@]4(C)C3CCC(=O)N4C)[C@@]2(C)C1

BDBM50284139

CN1C(=O)CCC2C3CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C

BDBM50284140

CC(C)N(C(C)C)C(=O)[C@@H]1C[C@@H]2CCC3C(CC[C@@]4(C)C3CCC(=O)N4C)[C@@]2(C)C1

BDBM50284141

CN1C(=O)CCC2C3CCC4[C@@H](O)CC[C@]4(C)C3CC[C@]12C

BDBM50213061

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r|

BDBM50284142

CN1C(=O)CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@]12C |t:9|

BDBM50334789

C[C@]12CC[C@H]3[C@@H](CC=C4C=C(CC[C@]34C)C(O)=O)[C@@H]1CCC(=O)N2 |r,c:9,t:7|

BDBM50334790

C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CCC(=O)N2 |r|

BDBM50334791

C[C@]12CC[C@H]3[C@@H](CCc4cc(OS(O)(=O)=O)ccc34)[C@@H]1CCC(=O)N2 |r|

BDBM50344122

CC(C)(C)N(C(=O)C1CSCN1C(=O)C1CCC(=O)N1)C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4NC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:35|

BDBM50234463

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCCCC1 |r,t:3,25|

BDBM50234464

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCCC1 |r,t:3,25|

BDBM50234466

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CCC1 |r,t:3,25|

BDBM50234467

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(C)=O |r,t:3,25|

BDBM50234468

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |r,t:3,25|

BDBM50234469

[H][C@@]12CC=C(C(=O)Cn3ccnc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CC1 |r,t:3,25|

BDBM50072189

CC(C)(C)NC(=O)[C@@H]1CCC2C3CCC4=CC(=O)CCN4C3=CC[C@]12C |c:23,t:14|

BDBM50057499

CN1C2CCc3cc(Cl)ccc3[C@@]2(C)CCC1=O

BDBM50072190

CC1C(=O)CC[C@@]2(C)C1=NCc1cc(Cl)ccc21 |t:9|

BDBM50057501

C[C@]12CCC(=CC1=CCc1cc(Cl)ccc21)C(O)=O |c:4,7|

BDBM50101144

CCc1cc(OCC(=O)N(C(C)C)C(C)C)ccc1-c1ccc(cc1)C(O)=O

BDBM50101143

CC(C)N(C(C)C)C(=O)COc1c(F)cc(cc1[N+]([O-])=O)-c1ccc(cc1)C(O)=O

BDBM50101145

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4NC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50101146

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1ccc(cc1C(F)(F)F)C(O)=O

BDBM50101147

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1c(Cl)cc(cc1Cl)C(O)=O

BDBM50101148

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1c(F)cc(cc1F)C(O)=O

BDBM50101149

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1ccc(cc1)C(O)=O

BDBM50101150

CC(C)N(C(C)C)C(=O)COc1cc(Cl)c(c(Cl)c1)-c1ccc(cc1)C(O)=O

BDBM50101151

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1c(C)cc(cc1C)C(O)=O

BDBM50101153

CCc1cc(ccc1OCC(=O)N(C(C)C)C(C)C)-c1ccc(cc1)C(O)=O

BDBM50366682

CC(C)N(C(C)C)C(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(ccc4[C@H]3CC[C@]12C)C(O)=O

BDBM50101154

OC(=O)c1ccc(cc1)-c1cc(F)c(OCC(=O)NC(c2ccccc2)(c2ccccc2)c2ccccc2)c(c1)[N+]([O-])=O

BDBM50101155

CC(C)N(C(C)C)C(=O)COc1c(cc(cc1C(C)C)-c1ccc(cc1)C(O)=O)C(C)C

BDBM50101156

CC(C)N(C(C)C)C(=O)COc1ccc(cc1)-c1ccc(cc1Cl)C(O)=O

BDBM50031890

[H][C@@]12CC[C@H](C(=O)NC(C)(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C=C(CC[C@]12C)C(O)=O |r,c:25,t:23|

BDBM50039262

CCN(CC)C(=O)[C@H]1CCC2C3CN(Cc4ccccc4)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:22|

BDBM50039270

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4CC(=O)C(C)C[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039271

CCN(CC)C(=O)[C@H]1CCC2C3CN(C)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:15|

BDBM50039274

CCN(CC)C(=O)[C@H]1CCC2C3CN(C#N)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:16|

BDBM50039275

CC(C)(C)N(O)C(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C |t:14|

BDBM50039278

CN1CC2C3CC[C@H](C(=O)NC45CC6CC(CC(C6)C4)C5)[C@@]3(C)CCC2[C@@]2(C)C=CC(=O)C=C12 |c:33,t:37,TLB:18:17:20:13.12.14,18:13:20:17.19.16,THB:16:15:12:17.19.18,16:17:12:15.20.14|

BDBM50039279

CCCN1CC2C3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12 |t:30|

BDBM50039283

CC(C)(C)NC(=O)[C@H]1CCC2C3CN=C4CC(=O)C=C[C@]4(C)C3CC[C@]12C |c:18,t:13|

BDBM50039290

CCCCCCN1CC2C3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12 |t:33|

BDBM50039288

CN1CC2C3CC[C@H](C(=O)NC(c4ccccc4)c4ccccc4)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12 |t:39|

BDBM50039289

CN1CC2C3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C(C)=C12 |t:29|

BDBM50039292

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(I)C(=O)CC[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039256

CN1CC2C3CC[C@H](C(=O)NC45CC6CC(CC(C6)C4)C5)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C(Br)=C12 |t:38,TLB:14:15:19:13.12.18,18:17:20:13.12.14,18:13:20:17.19.16,THB:14:13:19:15.20.16|

BDBM50039267

CCN(CC)C(=O)[C@H]1CCC2C3CCN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C |t:14|

BDBM50039304

CC1C(=O)CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@H]4C(=O)NC(C)(C)C)C3CN=C12 |t:28|

BDBM50039264

CCN(CC)C(=O)[C@H]1CCC2C3CN(CC)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:16|

BDBM50039258

CCN(CC)C(=O)[C@H]1CCC2C3CN(C)C4=CC(=O)C=C[C@]4(C)C3CC[C@]12C |c:19,t:15|

BDBM50039296

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)N1CCCCC1 |t:7|

BDBM50039265

CCC1C(=O)CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@H]4C(=O)N(CC)CC)C3CN=C12 |t:29|

BDBM50039305

CCCN1CC2C3CC[C@H](C(=O)NC(c4ccccc4)c4ccccc4)[C@@]3(C)CCC2[C@@]2(C)C=CC(=O)C=C12 |c:37,t:41|

BDBM50039300

CCCCN1CC2C3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12 |t:31|

BDBM50039318

CCCC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C |t:11|

BDBM50039319

CCN(CC)C(=O)[C@H]1CCC2C3CN(C)C4=C(C)C(=O)CC[C@]4(C)C3CC[C@]12C |c:15|

BDBM50039291

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(Cl)C(=O)CC[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039282

CC(C)c1cc(C(C)C)c(C(=O)[C@H]2CCC3C4CN=C5CC(=O)CC[C@]5(C)C4CC[C@]23C)c(c1)C(C)C |t:18|

BDBM50039315

CC(C)CC(=O)[C@H]1CCC2C3CN(C)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:14|

BDBM50039320

CCN(CC)C(=O)[C@H]1CCC2C3CCC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50039263

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4CC(=O)C5CC5[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039281

CCN(CC)C(=O)[C@H]1CCC2C3CN(CC(O)=O)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:18|

BDBM50039312

CN1CC2C3CC[C@H](C(=O)NC45CC6CC(CC(C6)C4)C5)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C(C)=C12 |t:38,TLB:18:13:20:17.19.16,18:17:20:13.12.14,THB:16:15:12:17.19.18,16:17:12:15.20.14|

BDBM50039297

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(C)C(=O)C=C[C@]4(C)C3CC[C@]12C |c:19,t:13|

BDBM50039309

CN1CC2C3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CCC2[C@@]2(C)C=CC(=O)C=C12 |c:24,t:28|

BDBM50039273

CC(C)CC(=O)[C@H]1CCC2C3CN=C4C(Br)C(=O)CC[C@]4(C)C3CC[C@]12C |t:12|

BDBM50039322

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4CC(=O)C=C[C@]4(C)C3CC[C@]12C |c:18,t:13|

BDBM50039323

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(C)C(=O)CC[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039269

CC(C)(C)NC(=O)[C@H]1CCC2C3CN=C4CC(=O)C5CC5[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039310

CCN(CC)C(=O)[C@H]1CCC2C3CN(C(C)C)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:17|

BDBM50039306

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(Br)C(=O)CC[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039272

CCN(CC)C(=O)[C@H]1CCC2C3CN(C(C)=O)C4=CC(=O)CC[C@]4(C)C3CC[C@]12C |t:17|

BDBM50039301

CCN(CC)C(=O)[C@H]1CCC2C3CN=C4C(CN(C)C)C(=O)CC[C@]4(C)C3CC[C@]12C |t:13|

BDBM50039261

CN1CC2C3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12 |t:28|

BDBM50039307

CCN(CC)C(=O)[C@H]1CCC2C3CN(C)C4=CC(=O)C5CC5[C@]4(C)C3CC[C@]12C |t:15|

BDBM50037911

CC(C)CCCC(C)C1CCC2C3[C@@H](C)CC4N(C)C(=O)C=C[C@]4(C)C3CC[C@]12C |c:21|

BDBM50037912

CC(C)CCCC(C)C1CCC2C3CCC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50037917

CC[C@H]1C=C2N(C)C(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C |t:3|

BDBM50037916

CC(C)CCCC(C)C1CCC2C3[C@@H](C)C=C4NC(=O)CC[C@]4(C)C3CC[C@]12C |t:15|

BDBM50037918

CC[C@H]1C=C2NC(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C |t:3|

BDBM50037922

CCN1C2C[C@H](C)C3C4CCC(C(C)CCCC(C)C)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50037924

CCC[C@H]1C=C2NC(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C |t:4|

BDBM50037915

CC[C@H]1CC2N(C)C(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C

BDBM50037920

CC(C)CCCC(C)C1CCC2C3[C@@H](C)CC4NC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50037921

CCC[C@H]1CC2N(C)C(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C

BDBM50037925

CC(C)CCCC(C)C1CCC2C3[C@@H](C)CC4NC(=O)C=C[C@]4(C)C3CC[C@]12C |c:20|

BDBM50037923

CC(C)CCCC(C)C1CCC2C3CCC4NC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50037919

CC(C)CCCC(C)C1CCC2C3C(CC[C@]12C)[C@@]1(C)CCC(=O)NC1=C[C@@H]3c1ccccc1 |c:28|

BDBM50037930

CC(C)CCCC(C)C1CCC2C3[C@@H](C)CC4N(CC=C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50037933

CC(C)CCCC(C)C1CCC2C3[C@@H](C)C=C4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C |t:15|

BDBM50368906

CC(C)CCCC(C)[C@H]1CCC2C3[C@@H](C)CC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50037913

CC[C@H]1CC2NC(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C

BDBM50037926

CC(C)CCCC(C)C1CCC2C3[C@H](C=C4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccccc1 |t:14|

BDBM50037927

CCC[C@H]1C=C2N(C)C(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C |t:4|

BDBM50037929

CCC[C@H]1CC2NC(=O)CC[C@]2(C)C2CC[C@]3(C)C(CCC3C12)C(C)CCCC(C)C

BDBM50037928

CC(C)CCCC(C)C1CCC2C3[C@H](CC4NC(=O)CC[C@]4(C)C3CC[C@]12C)c1ccccc1

BDBM50037931

CC(C)CCCC(C)C1CCC2C3[C@H](CC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccccc1

BDBM50031877

CC(C)(C)c1ccc(cc1NC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C)C(F)(F)F |t:20|

BDBM50031876

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)NC1(CCCC1)c1ccc(Cl)cc1 |c:12|

BDBM50031891

CC(C)(C)c1ccccc1NC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C |t:20|

BDBM50031883

CC1C(=O)CC[C@]2(C)C3CC[C@@]4(C)C(CC[C@@H]4C(=O)Nc4c(cccc4C(F)(F)F)C(F)(F)F)C3CN=C12 |t:39|

BDBM50031874

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)Nc1c(Cl)cccc1C(F)(F)F |c:12|

BDBM50031900

CC(C)(C)c1ccc(cc1)-c1ccc(cc1NC(=O)[C@H]1CCC2C3CN=C4CC(=O)CC[C@]4(C)C3CC[C@]12C)C(F)(F)F |t:27|

BDBM50031892

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)Nc1ccccc1 |t:7|

BDBM50031896

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F |t:7|

BDBM50031901

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |t:7|

BDBM50031895

C[C@]12CCC3C(CN=C4CC(=O)CC[C@]34C)C1CC[C@@H]2C(=O)NC1(CCCC1)c1ccc(Cl)cc1 |t:7|

BDBM50032763

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1cccc(Br)c1 |c:12|

BDBM50032774

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1cccc(F)c1 |c:12|

BDBM50032775

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)N1CCCCc2ccccc12 |c:12|

BDBM50032760

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc(cc1)C(=O)c1ccccc1 |c:12|

BDBM50032769

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)N(c1ccccc1)c1ccccc1 |c:12|

BDBM50032782

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1cccc(c1)C(F)(F)F |c:12|

BDBM50032761

CCN(C(=O)C1CCC2C3CCC4NC(=O)C=C[C@]4(C)C3CC[C@]12C)c1ccccc1 |c:16|

BDBM50032758

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc(cc1)C(F)(F)F |c:12|

BDBM50032785

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1cccc2ccccc12 |c:12|

BDBM50032786

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc2ccccc2c1 |c:12|

BDBM50032789

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1cccc(Cl)c1 |c:12|

BDBM50032778

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccccc1 |c:12|

BDBM50032787

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc(Cl)cc1 |c:12|

BDBM50032795

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)n1ccc2ccccc12 |c:12|

BDBM50032798

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)N1CCCc2ccccc12 |c:12|

BDBM50032783

Cc1cccc(NC(=O)C2CCC3C4CCC5NC(=O)C=C[C@]5(C)C4CC[C@]23C)c1 |c:20|

BDBM50032781

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc(F)cc1 |c:12|

BDBM50032773

Cc1ccc(NC(=O)C2CCC3C4CCC5NC(=O)C=C[C@]5(C)C4CC[C@]23C)cc1 |c:19|

BDBM50032779

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CCC2C(=O)Nc1ccc(cc1)-c1ccccc1 |c:12|

BDBM50032764

CN(C(=O)C1CCC2C3CCC4NC(=O)C=C[C@]4(C)C3CC[C@]12C)c1ccccc1 |c:15|

BDBM50034130

CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)CC

BDBM50034132

CCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034137

CCCCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034138

CN1[C@@H]2CCC3C4CC[C@H](N(C=O)C5CCCCC5)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50034141

CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)c1ccccc1

BDBM50034142

CN1[C@@H]2CCC3C4CC[C@H](N(CCC(C)(C)C)C=O)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50034146

CCCCCCCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034147

CCN(CC)C(=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034136

CN(C=O)[C@H]1CCC2C3CC[C@H]4NC(=O)C=C[C@]4(C)C3CC[C@]12C |c:15|

BDBM50034148

CC(C)C(=O)N([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccc(cc1)[N+]([O-])=O

BDBM50034150

COc1ccc(cc1)N([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)C(C)C

BDBM50034145

CN1[C@@H]2CCC3C4CC[C@H](N(C=O)C5CC5)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50034133

CCCCCCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034153

CC(C)N(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034143

CCCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034158

CN(C=O)[C@H]1CCC2C3CC=C4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C |t:10|

BDBM50034151

CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)CCCC

BDBM50034159

CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)CCC

BDBM50034149

CC(C)C(=O)N([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O

BDBM50034155

CCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(C)=O

BDBM50034134

CC(C)CCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034162

CC(C)C(=O)N([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccccc1

BDBM50034140

CN1[C@@H]2CCC3C4CC[C@H](N(Cc5ccccc5)C=O)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50034161

COc1ccc(cc1)N([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)c1ccccc1

BDBM50034135

CCCCCN([C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)C(=O)CCCCBr

BDBM50034163

CN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034154

CCCCCCN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034156

CN(C=O)[C@H]1CCC2C3CC[C@H]4NC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034131

CN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)C=C[C@]4(C)C3CC[C@]12C |c:16|

BDBM50034157

CN1[C@@H]2CCC3C4CC[C@H](N(C(=O)c5ccccc5)c5ccccc5)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50034139

CC(C)CN(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034144

CCC(CC)N(C=O)[C@H]1CCC2C3CC[C@H]4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034508

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4C(=O)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034509

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4=C(Br)C(=O)CC[C@]4(C)C3CC[C@]12C |c:14|

BDBM50034507

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4C(=S)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50034511

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4=C(Cl)C(=O)CC[C@]4(C)C3CC[C@]12C |c:14|

BDBM50057482

CC(C)Cc1ccc(cc1)[C@H](C)Oc1ccc(C(=O)Nc2ccccc2OCCCC(O)=O)c(C)c1C

BDBM50055150

CC\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1

BDBM50032297

C\C(=C/C(=O)Nc1ccccc1OCCCC(O)=O)c1ccc2n(ccc2c1)C(c1ccc(F)cc1)c1ccc(F)cc1

BDBM50055148

CCCC(CCC)n1ccc2cc(ccc12)C(\CC)=C\C(=O)Nc1ccccc1OCCCC(O)=O

BDBM50057447

CC(C)Cc1ccc(cc1)[C@H](C)Oc1ccc(cc1)C(=O)c1cn(CCCC(O)=O)c2ccccc12

BDBM50057452

CN1C2CCC3C4CC[C@H](C(=O)N(C(=O)NC(C)(C)C)C(C)(C)C)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50057454

CCN1C2C[C@H](C)C3C4CC[C@H](C(C)CCCC(C)C)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50057457

CN1C2CCC3C4CC[C@H](C(=O)N(C5CCCCC5)C(=O)NC5CCCCC5)[C@@]4(C)CCC3[C@@]2(C)CCC1=O

BDBM50057458

CC(C)CCCC(C)[C@H]1CCC2C3CCC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50057459

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4=C(C#N)C(=O)CC[C@]4(C)C3CC[C@]12C |c:14|

BDBM50057460

CC(C)Cc1ccc(cc1)[C@@H](C)Oc1ccc(cc1)C(=O)c1cn(CCCC(O)=O)c2ccccc12

BDBM50057467

Cc1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(O)=O

BDBM50057473

CC(C)Cc1ccc(cc1)[C@]1(C)Oc2ccc(cc2O1)C(=O)c1cn(CCCC(O)=O)c2ccccc12

BDBM50057470

Cc1c(C(=O)c2ccc3OC(Oc3c2)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c2ccccc2n1CCCC(O)=O

BDBM50369339

CC(C)NC(=O)N(C(C)C)C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C

BDBM50057485

CC(C)NC(=O)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4NC(=O)CC[C@]4(C)C3CC[C@]12C

BDBM50057487

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F |c:12|

BDBM50057451

CC(C)CCCC(C)[C@H]1CCC2C3[C@H](CC4N(C)C(=O)CC[C@]4(C)C3CC[C@]12C)c1ccccc1

BDBM50057498

OC(=O)c1cc2cc(OCc3ccccc3)ccc2[nH]1

BDBM50057495

CC(C)NC(=O)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4NC(=O)C=C[C@]4(C)C3CC[C@]12C |c:23|

BDBM50057475

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)Nc1cccc2ccccc12 |c:12|

BDBM50057492

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)n1ccc2ccccc12 |c:12|

BDBM50057490

C[C@]12CCC3C(CCC4NC(=O)C=C[C@]34C)C1CC[C@@H]2C(=O)N(c1ccccc1)c1ccccc1 |c:12|

BDBM50057479

OC(=O)c1ccc-2c(CCc3cc(Br)ccc-23)c1

BDBM50057476

CN(C(=O)[C@H]1CCC2C3CCC4NC(=O)C=C[C@]4(C)C3CC[C@]12C)c1ccccc1 |c:15|

BDBM50057508

CC(C)NC(=O)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4N(C)C(=O)C=C[C@]4(C)C3CC[C@]12C |c:24|

BDBM50057483

CCCc1ccc(OC(C)c2ccc(cc2)C(=O)c2cn(CCCC(O)=O)c3ccccc23)cc1

BDBM50093590

CC12CCC3C(CCC4=CC(=O)CCC34C)C1CCC2CCN=O |t:8|

BDBM50093594

CC(N=O)[C@H]1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C |t:11|

BDBM50093598

CC(CC1CCC2C3CC(=O)C4=CC(=O)CCC4(C)C3CCC12C)N=O |t:11|

BDBM50093600

CC(N=O)C1=CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C |t:4,11|

BDBM50093592

CC(CC1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C)N=O |t:10|

BDBM50093595

CC(N=O)[C@H]1CCC2C3CC(=O)C4=CC(=O)CCC4(C)C3CCC12C |t:12|

BDBM50116416

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)C23[#6]-[#6]-4-[#6]-[#6](-[#6]-[#6](-[#6]-4)-[#6]2)-[#6]3)c(F)c1 |TLB:23:18:25:24.22.21,23:22:25:17.18.19,THB:21:20:17:24.22.23,21:22:17:25.20.19|

BDBM50116419

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)c(F)c1

BDBM50116421

[#6]-[#8]-c1cc(ccc1\[#6]=[#6]-1\[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6](=O)-[#6](-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](-[#8])=O

BDBM50116423

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-c2ccccc2)-c2ccccc2)cc1

BDBM50116424

[#8]-[#6](=O)-[#6]-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)c(F)c1

BDBM50116426

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)C23[#6]-[#6]-4-[#6]-[#6](-[#6]-[#6](-[#6]-4)-[#6]2)-[#6]3)cc1 |TLB:19:20:24:17.18.23,23:22:25:17.18.19,23:18:25:24.22.21,THB:19:18:24:25.20.21|

BDBM50116429

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)cc1

BDBM50116428

[#6]-[#8]-c1cc(ccc1\[#6]=[#6]-1\[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6](=O)-[#6](-c1ccccc1)-c1ccccc1)-[#6](-[#8])=O

BDBM50116430

[#6]-[#8]-c1cc(ccc1\[#6]=[#6]-1/[#6]-[#6]-[#7](-[#6]-[#6]-1)-[#6](=O)C12[#6]-[#6]-3-[#6]-[#6](-[#6]-[#6](-[#6]-3)-[#6]1)-[#6]2)-[#6](-[#8])=O |TLB:24:19:26:25.23.22,24:23:26:18.19.20,THB:22:21:18:25.23.24,22:23:18:26.21.20|

BDBM50116422

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6]-[#6](-c2ccccc2)-c2ccccc2)cc1

BDBM50116431

[#8]-[#6](=O)-[#6]-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)cc1

BDBM50116417

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#7](-c2ccccc2)-c2ccccc2)cc1

BDBM50116432

[#8]-[#6](=O)-c1ccc(\[#6]=[#6]-2\[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#6](-c2ccccc2)-c2ccccc2)c(F)c1

BDBM50116433

OC(=O)c1ccc(OC2CCN(CC2)C(=O)C23CC4CC(CC(C4)C2)C3)cc1 |TLB:19:20:24:17.18.23,THB:21:22:17:25.20.19,21:20:17:24.22.23,19:18:24:25.20.21|

BDBM50128544

C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34C)C1CC=C2n1cnc2ccccc12 |c:21,t:8|

BDBM50269785

[H][C@@]12CC[C@H](C(=O)Nc3ccccc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)CC[C@]12C |r|

BDBM50057448

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:17,t:15|

BDBM50057489

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(CC[C@]4(C)C3CC[C@]12C)[N+]([O-])=O |c:17,t:15|

BDBM50391268

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(CC[C@]4(C)C3CC[C@]12C)[N+]([O-])=O |c:17|

BDBM50391269

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:17|

BDBM50396328

C[C@]12CC[C@H]3[C@@H](CC=C4C=C(CC[C@H]34)C(O)=O)[C@@H]1CCC2=O |r,c:9,t:7|

BDBM50396329

CCOC(=O)CCN1C(=O)CC[C@H]2[C@@H]3CC=C4C=C(CC[C@]4(C)[C@H]3CC[C@]12C)C(O)=O |r,c:17,t:15|

BDBM50396330

C[C@]12CC[C@H]3[C@@H](CC=C4C=C(CC[C@]34C)C(O)=O)[C@@H]1CCC(=O)N2CC=C |r,c:9,t:7|

BDBM50396331

CCN1C(=O)CC[C@H]2[C@@H]3CC=C4C=C(CC[C@]4(C)[C@H]3CC[C@]12C)C(O)=O |r,c:12,t:10|

BDBM50396332

CN1C(=O)CC[C@H]2[C@@H]3CC=C4C=C(CC[C@]4(C)[C@H]3CC[C@]12C)C(O)=O |r,c:11,t:9|

BDBM50044881

CN1C(=O)CCC2=C1CCc1cc(Cl)ccc21 |c:6|

BDBM50403326

COc1cccc2c1CC=C1C=C(CCC21C)C(O)=O |c:12,t:10|

BDBM50403325

CC12CCC(=CC1=CCc1cc(Cl)ccc21)P(O)O |c:4,7|

BDBM50403323

COc1cccc2c1CC=C1C=C(CCC21C)P(O)O |c:12,t:10|

BDBM50403324

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(CC[C@]4(C)C3CC[C@]12C)P(O)O |c:17,t:15|

BDBM50403327

COc1ccc2c(CC=C3C=C(CCC23C)C(O)=O)c1 |c:10,t:8|

BDBM50403607

OC(=O)c1ccc-2c(CCc3ccccc-23)c1

BDBM50403605

OC(=O)c1ccc-2c(Cc3ccccc-23)c1

BDBM50403611

OC(=O)c1ccc-2c(CCc3cc(Cl)ccc-23)c1

BDBM50403610

CC(C)(C)NC(=O)[C@H]1CCC2C3CCC4C=C(CC[C@]4(C)C3CC[C@]12C)P(=O)=O |c:15|

BDBM50403608

C[C@]12CCC(CC1=CCc1cc(Cl)ccc21)P(=O)=O |c:7|

BDBM50403606

CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(ccc4[C@H]3CC[C@]12C)C(O)=O

BDBM50403612

COc1cccc2c1CC[C@H]1[C-]([N+]#N)C(=O)CC[C@]21C

BDBM50406344

CC(C)N(C(C)C)C(=O)[C@H]1CC[C@H]2[C@@H]3CCc4cc(C(O)=O)c(cc4[C@H]3CC[C@]12C)C(O)=O

BDBM50406345

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=C[C@H](CC[C@]4(C)C3CC[C@]12C)C(O)=O |t:16|

BDBM50406346

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC(C)=C4C=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:18,t:16|

BDBM50406347

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=C[C@](O)(CC[C@]4(C)C3CC[C@]12C)C(O)=O |t:16|

BDBM50406348

[H][C@@]12CC[C@H](C(=O)N(C(C)C)C(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])CC(CC[C@]12C)C(O)=O

BDBM50406349

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=C[C@@H](CC[C@]4(C)C3CC[C@]12C)C(O)=O |t:16|

BDBM50406350

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=C[C@@](O)(CC[C@]4(C)C3CC[C@]12C)C(O)=O |t:16|

BDBM50406351

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(C=C[C@]4(C)C3CC[C@]12C)C(O)=O |c:17,19,t:15|

BDBM50406352

CC(CO)[C@@H]1CCC2C3CCC4C=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:12|

BDBM50406353

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=CC(=CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:18,t:16|

BDBM50406355

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CCC4=C(CCC(=C4)C(O)=O)C3CC[C@]12C |c:20,t:16|

BDBM50057469

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C(C)=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:18,t:15|

BDBM50406356

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(CC[C@]4(C)C3C=C[C@]12C)C(O)=O |c:17,26,t:15|

BDBM50406357

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC(F)=C4C=C(CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:18,t:16|

BDBM50406358

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC=C4C=C(CC[C@@H]4C3CC[C@]12C)C(O)=O |c:17,t:15|

BDBM50406359

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4C=C(C=C[C@]4(C)C3CC[C@]12C)C(O)=O |c:17,19|

BDBM50406361

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3CC[C@H]4CC(=CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:18|

BDBM50057468

CC(C)N(C(C)C)C(=O)[C@H]1CCC2C3C=CC4=CC(=CC[C@]4(C)C3CC[C@]12C)C(O)=O |c:14,18,t:16|

BDBM50406362

C[C@]12CCC3C(CC=C4C=C(CC[C@]34C)C(O)=O)C1CC[C@@H]2C#N |c:9,t:7|

BDBM50407302

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc2OCOc2c1

BDBM50407303

OC(=O)c1ccc(cc1)C(=O)c1ccc(Cc2ccc(cc2)C(F)(F)F)cc1

BDBM50407304

Cc1ccc(Cc2ccc(cc2)C(=O)c2ccc(cc2)C(O)=O)cc1

BDBM50407306

CC(C)(C)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(O)=O

BDBM50407307

OC(=O)c1ccc(cc1)C(=O)c1ccc(Oc2ccc(cc2)[N+]([O-])=O)cc1

BDBM50407308

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(F)(F)F

BDBM50407309

Cn1c(cc2cc(OCc3ccccc3)ccc12)C(O)=O

BDBM50407310

COc1cc2cc([nH]c2cc1OCc1ccccc1)C(O)=O

BDBM50407311

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)C1CCCCC1

BDBM50407312

OC(c1ccc(Oc2ccccc2)cc1)c1ccc(cc1)C(O)=O

BDBM50407313

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(Cl)c(Cl)c1

BDBM50407314

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)-c1ccc(Cl)cc1Cl

BDBM50407305

COc1cc2cc(C(O)=O)n(C)c2cc1OCc1ccccc1

BDBM50407315

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccccc1

BDBM50407316

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(O)cc1

BDBM50407317

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1cccc(c1)C(F)(F)F

BDBM50407318

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(O)=O

BDBM50407319

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(cc1)[N+]([O-])=O

BDBM50407320

OC(=O)c1ccc(Cc2ccc(Oc3ccccc3)cc2)cc1

BDBM50004955

c1ccc2c(c1)cc([nH]2)C(=O)O

BDBM50407321

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)Cc1ccccc1

BDBM50009101

OC(=O)c1cc2c(OCc3ccccc3)cccc2[nH]1

BDBM50407322

OC(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)Cc1ccccc1

BDBM50407323

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(Cl)cc1Cl

BDBM50407324

OC(=O)c1ccc(cc1)C(=O)c1ccc(cc1)C(=O)c1ccc(Cl)cc1

BDBM50409033

C[C@]12CC[C@H]3[C@@H](CCC4=C[C@@H](O)CC[C@]34C)C1CCC2=CCN=O |w:20.24,t:8|

BDBM50409040

C[C@]12CC[C@H]3[C@@H](CC=C4CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2[C@H]1CN1 |r,t:7|

BDBM50409041

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC[C@@H]2[C@H]1CN1 |r,t:7|

BDBM50340473

CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CN=C4CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:18,t:13|

BDBM50488060

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C |r,t:15|

BDBM50488061

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C#N)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:16|

BDBM50488062

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc1ccccc1 |r,t:8|

BDBM50488063

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 |r,t:8|

BDBM50488064

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC12CC3CC(CC(C3)C1)C2 |r,t:8,TLB:26:27:24.25.30:31,THB:26:25:31:32.27.28,28:27:24:30.29.31,28:29:24:32.26.27|

BDBM50488065

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC4C5CC6CC(C5)CC4C6)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C(C)=C12 |r,wU:25.28,4.4,21.25,7.7,26.31,wD:3.2,t:38,TLB:10:11:17:13.14.15,20:19:17:13.14.15,THB:10:11:13.20.14:18.16.17,20:14:11.19.18:17,15:14:11:18.16.17,15:16:11:13.20.14,(23.05,-27.5,;23.05,-25.96,;24.38,-25.2,;24.38,-23.66,;25.72,-22.91,;27.18,-23.4,;28.11,-22.16,;27.21,-20.89,;27.7,-19.43,;26.68,-18.28,;29.21,-19.13,;29.7,-17.67,;31.3,-16.98,;32.33,-17.95,;33.75,-18.19,;34.37,-16.79,;33.31,-15.71,;31.89,-15.61,;31.87,-16.42,;31.24,-17.88,;32.31,-18.96,;25.73,-21.36,;25.72,-19.82,;24.4,-20.58,;23.05,-21.34,;23.05,-22.88,;21.72,-23.66,;21.71,-22.12,;20.39,-22.88,;19.06,-23.66,;19.06,-25.2,;17.73,-25.97,;20.39,-25.96,;20.39,-27.5,;21.72,-25.2,)|

BDBM50488066

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)C=CC(=O)C=C12 |r,c:24,t:28|

BDBM50488067

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(CC)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:16|

BDBM50488068

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)N(Cc1ccccc1)Cc1ccccc1 |r,t:8|

BDBM50488069

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=C(I)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,c:14|

BDBM50340475

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:15|

BDBM50488070

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)N1CCOCC1 |r,t:8|

BDBM50488071

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C)C4=C(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,c:15|

BDBM50488072

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=C(C)C(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:14,19|

BDBM50340474

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN=C4C(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|

BDBM50488073

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=C(Cl)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,c:14|

BDBM50340477

CCCCCCN1C[C@H]2[C@@H]3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:33|

BDBM50340479

CCCCN1C[C@H]2[C@@H]3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:31|

BDBM50488074

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C(C)C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:17|

BDBM50488075

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488076

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r,t:8|

BDBM50488077

CC(C)(C)c1ccc(cc1)-c1ccc(cc1NC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(F)(F)F |r,t:28|

BDBM50488078

CC(C)CC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|

BDBM50488079

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)N1CCSCC1 |r,t:8|

BDBM50488080

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NN(c1ccccc1)c1ccccc1 |r,t:8|

BDBM50488081

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC(C1CCCCC1)C1CCCCC1 |r,t:8|

BDBM50488082

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r,t:8|

BDBM50488083

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NCc1ccccc1 |r,t:8|

BDBM50488084

CC(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|

BDBM50488085

CON(C)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|

BDBM50488086

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)OC1C2CC3CC(C2)CC1C3 |r,wU:4.3,16.19,1.0,19.23,14.16,wD:5.5,t:8,TLB:32:31:29:25.26.27,22:23:29:25.26.27,THB:32:26:23.31.30:29,27:26:23:30.28.29,27:28:23:25.32.26,22:23:25.32.26:30.28.29,(20.54,-3.16,;20.55,-4.7,;19.22,-3.92,;17.87,-4.68,;17.87,-6.22,;19.2,-7.01,;19.2,-8.54,;17.87,-9.3,;16.54,-8.54,;15.21,-9.3,;13.88,-8.54,;12.55,-9.31,;13.88,-7,;15.21,-6.22,;16.54,-7,;16.53,-5.46,;20.54,-6.25,;22,-6.74,;22.93,-5.5,;22.03,-4.23,;22.52,-2.77,;21.5,-1.62,;24.03,-2.47,;24.5,-1,;26.25,-1.06,;26.76,-2.38,;27.94,-3.2,;29.1,-2.2,;28.61,-.77,;27.36,-.08,;27,-.81,;25.81,-1.86,;26.31,-3.28,)|

BDBM50488087

CC(C)c1cc(C(C)C)c(C(=O)[C@H]2CC[C@H]3[C@@H]4CNC5=CC(=O)CC[C@]5(C)[C@H]4CC[C@]23C)c(c1)C(C)C |r,t:19|

BDBM50488088

CC(C)(C)N(O)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:15|

BDBM50488089

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)N1CCCCC1 |r,t:8|

BDBM50488090

CCCN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC(c4ccccc4)c4ccccc4)[C@@]3(C)CC[C@@H]2[C@@]2(C)C=CC(=O)C=C12 |r,c:37,t:41|

BDBM50488091

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC4C5CC6CC(C5)CC4C6)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,wU:25.28,4.4,21.25,7.7,26.31,wD:3.2,t:37,TLB:10:11:17:13.14.15,20:19:17:13.14.15,THB:10:11:13.20.14:18.16.17,20:14:11.19.18:17,15:14:11:18.16.17,15:16:11:13.20.14,(5.58,-28.85,;5.58,-27.31,;6.92,-26.54,;6.91,-25.01,;8.25,-24.25,;9.72,-24.74,;10.64,-23.5,;9.74,-22.24,;10.23,-20.78,;9.21,-19.63,;11.74,-20.47,;12.23,-19.02,;13.83,-18.32,;14.86,-19.3,;16.28,-19.54,;16.9,-18.14,;15.85,-17.06,;14.42,-16.95,;14.4,-17.77,;13.77,-19.23,;14.84,-20.3,;8.26,-22.7,;8.25,-21.16,;6.93,-21.92,;5.58,-22.69,;5.58,-24.23,;4.25,-25.01,;4.24,-23.47,;2.92,-24.23,;1.59,-25.01,;1.59,-26.55,;.26,-27.32,;2.92,-27.31,;4.25,-26.55,)|

BDBM50488092

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C(C)=C12 |r,t:29|

BDBM50488093

CC1=C2NC[C@H]3[C@@H]4CC[C@H](C(=O)NC(C)(C)C)[C@@]4(C)CC[C@@H]3[C@@]2(C)CCC1=O |r,c:1|

BDBM50488094

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC(C)(C)C)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:28|

BDBM50488095

CCCC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:12|

BDBM50488096

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC(c4ccccc4)c4ccccc4)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:39|

BDBM50488097

CC(C)CC(=O)[C@H]1CC[C@H]2[C@@H]3CN(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488098

CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488099

CC(C)(C)NC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488100

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=C(Br)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,c:14|

BDBM50488101

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(Cc4ccccc4)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:22|

BDBM50340478

CCCN1C[C@H]2[C@@H]3CC[C@H](C(=O)N(CC)CC)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C=C12 |r,t:30|

BDBM50488102

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:18,t:14|

BDBM50488103

CC(C)(C)c1ccccc1NC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:21|

BDBM50488104

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)N1CCNCC1 |r,t:8|

BDBM50488105

CCN(C)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|

BDBM50488106

COC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:11|

BDBM50488107

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488108

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CN(C)C4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C |r,c:19,t:15|

BDBM50488109

CCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)C(C)(C)C[C@]4(C)[C@H]3CC[C@]12C |r,t:14|

BDBM50488110

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC(c1ccccc1)c1ccccc1 |r,t:8|

BDBM50488111

CC(C)N(C(C)C)C(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:16|

BDBM50488112

C[C@]12CC[C@H]3[C@@H](CNC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)NC(c1ccccc1)(c1ccccc1)c1ccccc1 |r,t:8|

BDBM50488113

CC(C)CC(=O)[C@H]1CC[C@H]2[C@@H]3CNC4=C(Br)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,c:13|

BDBM50488114

CN1C[C@H]2[C@@H]3CC[C@H](C(=O)NC4C5CC6CC(C5)CC4C6)[C@@]3(C)CC[C@@H]2[C@@]2(C)CCC(=O)C(Br)=C12 |r,wU:25.28,4.4,21.25,7.7,26.31,wD:3.2,t:38,TLB:10:11:17:13.14.15,20:19:17:13.14.15,THB:10:11:13.20.14:18.16.17,20:14:11.19.18:17,15:14:11:18.16.17,15:16:11:13.20.14,(13.71,-26.2,;13.71,-24.66,;15.04,-23.89,;15.04,-22.36,;16.37,-21.6,;17.84,-22.09,;18.77,-20.85,;17.87,-19.59,;18.36,-18.13,;17.34,-16.97,;19.87,-17.82,;20.35,-16.36,;21.96,-15.67,;22.99,-16.64,;24.4,-16.88,;25.02,-15.49,;23.97,-14.41,;22.55,-14.3,;22.53,-15.12,;21.9,-16.58,;22.96,-17.65,;16.39,-20.05,;16.38,-18.51,;15.06,-19.27,;13.71,-20.03,;13.71,-21.58,;12.38,-22.35,;12.37,-20.81,;11.05,-21.57,;9.72,-22.35,;9.72,-23.89,;8.39,-24.66,;11.05,-24.65,;11.05,-26.19,;12.38,-23.89,)|

BDBM50517880

[H][C@@]12CC[C@H](C(=O)NC(c3ccccc3)(C(F)(F)F)C(F)(F)F)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)C=C[C@]12C |r,c:41|

BDBM50340481

C[C@]12CC[C@H]3[C@@H](CC[C@H]4NC(=O)C=C[C@]34C)[C@@H]1CC[C@@H]2C(=O)Nc1cc(ccc1C(F)(F)F)C(F)(F)F |r,c:12|

BDBM50517901

[H][C@@]12CC[C@H](C(=O)NC(C)(c3ccccc3)C(F)(F)F)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])NC(=O)C=C[C@]12C |r,c:38|

BDBM50517908

[H][C@@]12CC[C@H](C(=O)NC(C)(C)C)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C=C(F)CC[C@]12C |r,t:23,25|

BDBM50589273

[H][C@@]12CC=C(C3=NN([C@@H](C3)c3ccc(F)cc3)C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |r,t:3,5,33|

BDBM50589274

[H][C@@]12CC=C(c3ccn(n3)-c3ccc(Cl)cc3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |r,t:3,30|

BDBM50462940

[H][C@@]12CC(C=O)=C(n3cnc4ccccc34)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@@H](O)CC[C@]12C |r,t:5,29|

BDBM50589275

[H][C@@]12CC(C=O)=C(n3cnc4ccccc34)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OC(=O)C1CC1 |r,t:5,29|