SMILES for Mitogen-activated protein kinase kinase kinase 13

CCO[C@H]1CC[C@@H](CC1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r,wU:6.9,wD:3.2,(-10.69,-2.07,;-9.17,-2.3,;-8.2,-1.11,;-6.67,-1.29,;-6.07,-2.71,;-4.54,-2.9,;-3.62,-1.67,;-4.21,-.26,;-5.74,-.07,;-2.08,-1.82,;-1.19,-.57,;-1.83,.83,;.34,-.72,;1.37,.44,;2.78,-.18,;2.63,-1.71,;1.13,-2.04,;4.11,.59,;4.11,2.13,;5.44,2.9,;6.78,2.13,;8.24,2.61,;9.15,1.36,;10.69,1.36,;8.24,.12,;6.78,.59,;5.44,-.18,)|

BDBM637265

CCN1CCCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637266

CN1CCCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637267

COc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637269

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCOC1

BDBM637270

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOCC1

BDBM637272

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCCC1

BDBM637273

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCOCC1

BDBM637275

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCC1

BDBM637276

CCOc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637277

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC(F)(F)F)c1

BDBM637278

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(Cl)c1

BDBM637279

Cc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637280

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC(F)F)c1

BDBM637281

CC(C)Oc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637282

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1CCCOC1

BDBM637283

C[C@H]1CCC[C@@H](C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637286

CN1C2CCC1CC(C2)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |TLB:0:1:3.4:6.8.7|

BDBM637287

COc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1OC

BDBM637288

COc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1

BDBM637289

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OCC(F)(F)F)c1

BDBM637290

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OC2CC2)c1

BDBM637291

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccnc1

BDBM637292

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(OCCN2CCOCC2)c1

BDBM637294

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCC1COCCO1

BDBM637296

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCc1ccccc1

BDBM637297

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)c(F)c1

BDBM637298

COc1cccc(CN(C)C(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637299

CN1CCO[C@H](CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)C1 |r|

BDBM637300

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCCc1ccccc1

BDBM637301

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(F)c1

BDBM637304

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1Cl

BDBM637305

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1C(F)(F)F

BDBM637306

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1c(F)cccc1F

BDBM637307

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cc(F)cc(F)c1

BDBM637308

Cc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1C

BDBM637309

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1Cl

BDBM637310

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(Cl)cc1

BDBM637311

CCOc1ccccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637312

Cc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637313

COc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637315

CN1CCCCC1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637316

COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)ccc1F

BDBM637317

COc1cccc(c1)C(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637318

Cc1cccc(C)c1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637319

COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)ccn1

BDBM637320

COc1cncc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637321

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(c1)C#N

BDBM637323

COc1cc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc(OC)c1

BDBM637324

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ncco1

BDBM637325

Cc1csc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1

BDBM637326

Cn1ccnc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637327

Cn1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1

BDBM637328

Cc1cn(C)nc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637330

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1nc(cs1)C(F)(F)F

BDBM637331

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1nc2ccccc2o1

BDBM637332

COc1ccc2oc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc2c1

BDBM637334

CC(C)c1csc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1

BDBM637335

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cnc(Cl)s1

BDBM637336

Cn1cnc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637339

COc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)n1

BDBM637340

Cn1nccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637341

COc1ccnc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637342

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cn2ccccc2n1

BDBM637345

COc1ccc2n(C)c(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc2c1

BDBM637346

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cnc2ccccn12

BDBM637348

COc1cccc(c1)[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637349

COc1cccc(c1)[C@@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637350

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cccc(Cl)c1 |r|

BDBM637352

C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cccc(Cl)c1 |r|

BDBM637353

COc1ccc2OC(C)(C)CC(NC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)c2c1

BDBM637354

COc1cccc(c1)C(C)(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637355

CCNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637356

COCCCNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637357

COC1CCC(C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637358

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccsc1

BDBM637359

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccs1

BDBM637360

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccco1

BDBM637361

Cn1cccc1CNC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637362

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccoc1

BDBM637363

CCc1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637364

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(OCCN2CCCCC2)cc1

BDBM637365

COC(=O)c1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637366

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(OCCN2CCOCC2)cc1

BDBM637367

COc1cccc(CCNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637368

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCCc1c(F)cccc1Cl

BDBM637369

CN(CCc1ccccc1)C(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637370

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1cccc(c1)C(O)=O

BDBM637371

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1OC(F)(F)F

BDBM637372

CCN1CCC[C@H](C1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637373

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1OC(F)F

BDBM637374

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)Nc1ccccc1CO

BDBM637375

COc1cccc(c1)C(CCO)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637376

COc1cccc(c1)C1(CC1)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637377

COCCOc1cccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c1

BDBM637378

CC(C)c1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637379

CC(O)c1ccccc1NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637380

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc2OCOc2c1

BDBM637381

COc1cccc(CNC(=O)c2cc(cs2)-c2cn3nc(N)nc3cc2F)c1

BDBM637382

Nc1nc2cc(F)c(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1

BDBM637383

C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637384

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CC1)c1ccc(F)cc1

BDBM637385

Nc1nc2cc(F)c(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637386

CC(C)C(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1

BDBM637387

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637388

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1

BDBM637389

Cc1cccc2oc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)nc12

BDBM637390

Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1ccc(F)cc1

BDBM637391

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1COc2ccc(F)cc12

BDBM637392

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCc2ccccc12

BDBM637393

CC(C)(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1

BDBM637394

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CCC1)c1ccc(F)cc1

BDBM637395

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(CCCC1)c1ccc(F)cc1

BDBM637396

COc1cccc(CNC(=O)c2cc(c(C)s2)-c2ccc3nc(N)nn3c2)c1

BDBM637397

Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NC1CCCCC1

BDBM637398

Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1nc2ccccc2o1

BDBM637399

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1(COC1)c1ccc(F)cc1

BDBM637400

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOc2ccc(F)cc12

BDBM637401

CC1(C)CC(NC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)c2ccccc2O1

BDBM637402

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCOc2ccccc12

BDBM637403

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1CCCc2cc(F)ccc12

BDBM637404

CC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637405

Cc1sc(cc1-c1ccc2nc(N)nn2c1)C(=O)NCc1ccccc1

BDBM637406

CCC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|

BDBM637407

COC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|

BDBM637408

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|

BDBM637409

CC[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|

BDBM637410

C[C@@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1 |r|

BDBM637411

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)N[C@H](c1ccccc1)C(F)(F)F |r|

BDBM637412

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(C1CC1)c1ccccc1

BDBM637413

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCCC2=O)cc1

BDBM637414

CCN(CC)Cc1ccc(CNC(=O)c2cc(cs2)-c2ccc3nc(N)nn3c2)cc1

BDBM637415

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cnn(C)c1

BDBM637416

CCn1ccc(n1)C(C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1

BDBM637417

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2CCCCc2s1

BDBM637418

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1cn[nH]c1

BDBM637419

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc(C)c(C)s1

BDBM637420

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2ccccc2n1C

BDBM637421

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(c1ccc(F)cc1)C(F)(F)F

BDBM637422

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC(CO)c1ccc(F)cc1

BDBM637423

CCC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1

BDBM637424

COC[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637425

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NC1COC1

BDBM637426

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)N[C@@H](CCO)c1ccc(F)cc1 |r|

BDBM637427

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCOCC2)cc1

BDBM637428

CN1CCN(Cc2ccc(CNC(=O)c3cc(cs3)-c3ccc4nc(N)nn4c3)cc2)CC1

BDBM637429

Nc1nc2ccc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(CN2CCCC2)cc1

BDBM637430

C[C@@H](CO)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637433

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(cc1)C(C)(C)C

BDBM637434

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(C)cc1 |r|

BDBM637435

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nccn1C

BDBM637436

C[C@H](NC(=O)c1scc(c1C)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637437

Cc1c(csc1C(=O)NCc1ccc(F)cc1)-c1ccc2nc(N)nn2c1

BDBM637438

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(cc1)C(F)(F)F |r|

BDBM637439

COc1ccc(cc1)[C@H](C)NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1 |r|

BDBM637440

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(Cl)cc1 |r|

BDBM637441

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OC(F)(F)F)cc1 |r|

BDBM637442

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OCC(F)F)cc1

BDBM637443

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1nc2ccccc2o1 |r|

BDBM637444

C[C@H](NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccccc1F |r|

BDBM637445

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1F

BDBM637446

CC(NC(=O)c1cc(cs1)-c1ccc2nc(N)nn2c1)c1ccc(OC(F)(F)F)cc1

BDBM637447

C[C@H](NC(=O)c1cc(c(F)s1)-c1ccc2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637448

Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637449

COc1cccc(CNC(=O)c2cc(cs2)-c2ccn3nc(N)nc3c2)c1

BDBM637450

Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCc1ccccc1

BDBM637451

Nc1nc2cc(ccn2n1)-c1csc(c1)C(=O)NCC1CCCCC1

BDBM637452

CCOc1cccc(CNC(=O)c2cc(cs2)-c2ccn3nc(N)nc3c2)c1

BDBM637453

Cc1cccc(C)c1NC(=O)c1cc(cs1)-c1ccn2nc(N)nc2c1

BDBM637454

C[C@H](NC(=O)c1cc(cs1)-c1ccn2nc(N)nc2c1)c1ccc(F)cc1 |r|

BDBM637455

Nc1nc2cc(cc(C(O)=O)n2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637456

Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637457

COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C)c3nc(N)nn3c2)c1

BDBM637458

Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccccc1

BDBM637459

Cc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NC1CCCCC1

BDBM637460

Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1)C(F)(F)F

BDBM637461

C[C@H](NC(=O)c1cc(cs1)-c1cc(c2nc(N)nn2c1)C(F)(F)F)c1ccccc1 |r|

BDBM637462

C[C@H](NC(=O)c1cc(cs1)-c1cc(c2nc(N)nn2c1)C(F)(F)F)c1ccc(F)cc1 |r|

BDBM637463

Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NCc1ccccc1)C(F)(F)F

BDBM637464

Nc1nc2c(cc(cn2n1)-c1csc(c1)C(=O)NC1CCCCC1)C(F)(F)F

BDBM637465

COc1cccc(CNC(=O)c2cc(cs2)-c2cc(c3nc(N)nn3c2)C(F)(F)F)c1

BDBM637466

COc1cccc(CNC(=O)c2cc(cs2)-c2cc(F)c3nc(N)nn3c2)c1

BDBM637467

Nc1nc2c(F)cc(cn2n1)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637468

C[C@H](NC(=O)c1cc(cs1)-c1cc(F)c2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637469

CC(C)NS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637470

CCNS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637471

CNS(=O)(=O)c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637472

COCc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637473

COCc1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637474

CC(C)NC(=O)c1cc(cn2ncnc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637475

COc1cccc(CNC(=O)c2cc(cs2)-c2cc(C(=O)NC(C)C)c3ncnn3c2)c1

BDBM637476

CC(C)NC(=O)c1cc(cn2ncnc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637477

CC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637478

CC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637479

CCc1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637480

CCc1nnc(o1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637481

CCc1nnc(o1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637482

CCc1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637483

CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](CC)c1ccc(F)cc1 |r|

BDBM637484

CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)N[C@@H](C)c1ccc(F)cc1 |r|

BDBM637485

CCC(C)c1nnc(s1)-c1cc(cn2nc(N)nc12)-c1csc(c1)C(=O)NCc1ccc(F)cc1

BDBM637486

CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2nnc(s2)[C@@H](C)CO)c2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM637487

CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2cnn(CC(F)(F)F)c2)n2nc(N)nc2c1)c1ccc(F)cc1 |r|

BDBM637488

CC[C@H](NC(=O)c1cc(cs1)-c1cc(-c2cnn(CC(F)(F)F)c2)c2nc(N)nn2c1)c1ccc(F)cc1 |r|

BDBM716242

Cc1cnc(Nc2cc(C3CCN(C4CCCC4)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM50059190

c1cnc(cc1C#N)Nc2cc(cc(n2)N3CCC(C3)(F)F)C4CCN(CC4)C5COC5

BDBM716244

Cc1cnc(Nc2cc(C3CCN(CC4CC4)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716251

Cc1cnc(Nc2cc(C3CCN(C4CCC4)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716252

N#Cc1ccnc(Nc2cc(C3CCN(C(C)=O)CC3)cc(N3CCC(F)(F)C3)n2)c1

BDBM716253

Cc1cnc(Nc2cc(C3CCN(C)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716254

Cc1cnc(Nc2cc(C3CCN(C(C)C)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716255

CC(=O)N1CCC(c2cc(Nc3ccccn3)nc(N3CCC(F)(F)C3)c2)CC1

BDBM716256

CC(=O)N1CCC(c2cc(Nc3cn(C)cn3)nc([NH+]3CCC(F)(F)C3)c2)CC1

BDBM716257

CC(=O)N1CCC(c2cc(Nc3ncn(C)c3C#N)nc(N3CCC(F)(F)C3)c2)CC1

BDBM716258

CC(=O)N4CCC(c3cc(Nc1cn(C)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716259

CC(=O)N4CCC(c3cc(Nc1ccn(C)n1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716260

CC(=O)N1CCC(c2cc(Nc3cc4[nH]ccc4cn3)nc(N3CCC(F)(F)C3)c2)CC1

BDBM716261

CC(=O)N5CCC(c4cc(Nc2cnc1ccccc1n2)nc(N3CCC(F)(F)C3)c4)CC5

BDBM716262

CC(=O)N4CCC(c3cc(Nc1cnccn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716263

CC(=O)N1CCC(c2cc(Nc3ccncn3)nc(N3CCC(F)(F)C3)c2)CC1

BDBM716264

CC(=O)N1CCC(c2cc(Nc3ncccn3)nc(N3CCC(F)(F)C3)c2)CC1

BDBM716265

CC(=O)N4CCC(c3cc(Nc1nccnc1C)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716266

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716267

CC(=O)N4CCC(c3cc(Nc1cncc(C)n1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716268

CC(=O)N4CCC(c3cc(Nc1cnc(N)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716269

CC(=O)N4CCC(c3cc(Nc1cncc(N)n1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716270

CC(=O)N4CCC(c3cc(Nc1cnc(C(F)(F)F)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716271

CC(=O)N5CCC(c4cc(Nc2cnc(C1CC1)cn2)nc(N3CCC(F)(F)C3)c4)CC5

BDBM716272

CCc4cnc(Nc3cc(C1CCN(C(C)=O)CC1)cc(N2CCC(F)(F)C2)n3)cn4

BDBM716273

CC(=O)N4CCC(c3cc(Nc1cnc(C#N)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716274

COc4cnc(Nc3cc(C1CCN(C(C)=O)CC1)cc(N2CCC(F)(F)C2)n3)cn4

BDBM716275

CC(=O)N4CCC(c3cc(Nc1cnc(C(N)=O)cn1)nc(N2CCC(F)(F)C2)c3)CC4

BDBM716276

Cc1cnc(Nc2cc(C3CCN(C4COC4)CC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716277

CC(=O)N4CC(c3cc(Nc1cnc(C)cn1)nc(N2CCC(F)(F)C2)c3)C4

BDBM716278

Cc1cnc(Nc2cc(C3CN(C(C)C)C3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716279

Cc1cnc(Nc2cc(C3CN(CC4CC4)C3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716280

Cc1cnc(Nc2cc(C3CN(C4CCC4)C3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716281

Cc1cnc(Nc2cc(C3CN(C4CCCC4)C3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716282

Cc1cc(Nc2cnc(C)cn2)nc(N2CCC(F)(F)C2)c1

BDBM716283

Cc3cnc(Nc2cc(C(F)(F)F)cc(N1CCC(F)(F)C1)n2)cn3

BDBM716284

Cc1cnc(Nc2cc(CN3CCOCC3)cc(N3CCC(F)(F)C3)n2)cn1

BDBM716285

CC(=O)N3CCC(c2cc(NCCCCO)nc(Nc1cnc(C)cn1)c2)CC3

BDBM716286

CC(=O)N4CCC(c3cc(NCC1CC1)nc(Nc2cnc(C)cn2)c3)CC4

BDBM716287

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N(C)CC2CC2)c3)CC4

BDBM716288

CCN(CC)c3cc(C1CCN(C(C)=O)CC1)cc(Nc2cnc(C)cn2)n3

BDBM716289

CC(=O)N3CCC(c2cc(Nc1cnc(C)cn1)nc(N(CCO)CCO)c2)CC3

BDBM716290

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCC2)c3)CC4

BDBM716291

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CC(F)(F)C2)c3)CC4

BDBM716292

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCOCC2)c3)CC4

BDBM716293

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCC(F)(F)CC2)c3)CC4

BDBM716294

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(NN2CCCC2)c3)CC4

BDBM716295

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCCC(C(N)=O)C2)c3)CC4

BDBM716296

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CCC(O)C2)c3)CC4

BDBM716297

CC(=O)N4CCC(c3cc(Nc1cnc(C)cn1)nc(N2CC[C@H](N(C)C)C2)c3)CC4

BDBM716298

CC(=O)N3CCC(c2cc(N)nc(Nc1cnc(C)cn1)c2)CC3

BDBM716299

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CC2C3)c4)CC5

BDBM716300

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N2CC3C(C2)C3(C)C)c4)CC5

BDBM716301

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N2CC3C(C2)C3(F)F)c4)CC5

BDBM716302

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CCC2(CC2)C3)c4)CC5

BDBM716303

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2(CCC2)C3)c4)CC5

BDBM716304

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2(CCCC2)C3)c4)CC5

BDBM716305

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CC(C2)C3)c4)CC5

BDBM716306

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N2CC3CC(C2)C3O)c4)CC5

BDBM716307

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CCC(C2)C3)c4)CC5

BDBM716308

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CCC2C3)c4)CC5

BDBM716309

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N2CCC3(CC2)CC3)c4)CC5

BDBM716310

CC(=O)N5CCC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CN(C(C)=O)CC2C3)c4)CC5

BDBM716311

Cc1cnc(Nc2cc(C3CCN(CC4CC4)CC3)cc(N3CC4C(C3)C4(C)C)n2)cn1

BDBM716312

CC(=O)N6CCC(c5cc(Nc2cnc(C1CC1)cn2)nc(N3CC4C(C3)C4(C)C)c5)CC6

BDBM716313

c1nc(C2CC2)cnc1Nc1cc(C2CCN(CC3CC3)CC2)cc(N2CC3CC3C2)n1

BDBM716314

CC(=O)N6CCC(c5cc(Nc2cnc(C1CC1)cn2)nc(N4CC3CC3C4)c5)CC6

BDBM716315

CC(=O)N6CC(c5cc(Nc2cnc(C1CC1)cn2)nc(N4CC3CC3C4)c5)C6

BDBM716316

c1nc(C2CC2)cnc1Nc1cc(C2CN(CC3CC3)C2)cc(N2CC3CC3C2)n1

BDBM716317

Cc1cnc(Nc2cc(C3CCN(CC4CC4)CC3)cc(N3CC4CC(C4)C3)n2)cn1

BDBM716318

Cc1cnc(Nc2cc(C3CCN(CC4CC4)CC3)cc(N3CCC4(CC4)C3)n2)cn1

BDBM716319

Cc1cnc(Nc2cc(C3CCN(CC4CC4)CC3)cc(N3CC4CCC4C3)n2)cn1

BDBM716320

Cc1cnc(Nc2cc(C3CN(CC4CC4)C3)cc(N3CC4CCC4C3)n2)cn1

BDBM716321

CC(=O)N5CC(c4cc(Nc1cnc(C)cn1)nc(N3CC2CCC2C3)c4)C5

BDBM716322

c1nc(C2CC2)cnc1Nc1cc(C2CCN(CC3CC3)CC2)cc(N2CC3CCC3C2)n1

BDBM716323

CC(=O)N6CCC(c5cc(Nc2cnc(C1CC1)cn2)nc(N4CC3CCC3C4)c5)CC6

BDBM716324

CC(=O)N6CC(c5cc(Nc2cnc(C1CC1)cn2)nc(N4CC3CCC3C4)c5)C6

BDBM716325

c1nc(C2CC2)cnc1Nc1cc(C2CN(CC3CC3)C2)cc(N2CC3CCC3C2)n1

BDBM50271207

[H][C@@]12CN(C[C@]1([H])[C@H]2c1cc(nn1C(C)C)-c1cnc(N)c(OC(F)(F)F)c1)C1COC1 |r|

BDBM50271212

[H][C@@]12CN(C[C@]1([H])[C@H]2c1cc(nn1CC1CC1)-c1cnc(N)c(c1)C(F)(F)F)C1COC1 |r|

BDBM324284

Cn1cc(Nc2nccc(n2)-c2ccc3[C@@H](CCN(Cc3c2)C2COC2)NC(=O)c2cn(nn2)C(C)(C)C)cn1 |r|

BDBM289504

CC(C)C(O)c1nc(cn1C12CC(C1)(C2)N1CCOCC1)-c1cnc(N)c(c1)C(F)(F)F

BDBM50609697

Nc1ncc(cc1OC(F)F)-c1cc(nc(n1)N1CCC(F)(F)C1)N1C[C@@H]2C[C@H]1CO2

BDBM50609698

[H][C@]12CN(c3cc(nc(n3)N3CC4CC3C4)-c3cnc(N)cn3)[C@]([H])(CO1)C2 |r,wU:23.27,1.0,(-4.72,-1.9,;-5.22,-3.47,;-3.88,-2.7,;-2.55,-3.47,;-1.22,-2.7,;-1.22,-1.16,;.11,-.38,;1.45,-1.15,;1.45,-2.69,;.11,-3.46,;2.78,-3.46,;4.19,-2.83,;5.22,-3.98,;4.45,-5.31,;2.94,-4.99,;3.71,-3.66,;.11,1.16,;-1.22,1.92,;-1.22,3.47,;.11,4.24,;.11,5.78,;1.44,3.47,;1.44,1.93,;-2.55,-5.01,;-1.01,-4.89,;-3.88,-5.78,;-5.22,-5.01,;-4.13,-4.56,)|

BDBM50609699

[H][C@]12CN(c3cc(nc(n3)N3CC4CC3C4)-c3cnc(N)c(n3)C(F)(F)F)[C@]([H])(CO1)C2 |r,wU:1.0,27.31,(-4.72,-1.9,;-5.22,-3.47,;-3.88,-2.7,;-2.55,-3.47,;-1.22,-2.7,;-1.22,-1.16,;.11,-.38,;1.45,-1.15,;1.45,-2.69,;.11,-3.46,;2.78,-3.46,;4.19,-2.83,;5.22,-3.98,;3.71,-3.66,;2.94,-4.99,;4.45,-5.31,;.11,1.16,;-1.22,1.92,;-1.22,3.47,;.11,4.24,;.11,5.78,;1.44,3.47,;1.44,1.93,;2.77,4.24,;4.11,3.47,;2,5.57,;3.54,5.57,;-2.55,-5.01,;-1.01,-4.89,;-3.88,-5.78,;-5.22,-5.01,;-4.13,-4.55,)|

BDBM50609700

[H][C@]12CN(c3cc(nc(n3)N3CC4CC3C4)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CO1)C2 |r,wU:1.0,27.31,(-4.83,-1.9,;-5.33,-3.46,;-4,-2.69,;-2.66,-3.46,;-1.33,-2.69,;-1.33,-1.16,;0,-.38,;1.33,-1.15,;1.33,-2.69,;0,-3.46,;2.67,-3.46,;4.07,-2.83,;5.11,-3.98,;3.6,-3.66,;2.83,-4.99,;4.34,-5.31,;0,1.16,;-1.33,1.92,;-1.33,3.47,;-0,4.23,;-0,5.78,;1.33,3.47,;2.66,4.24,;4,3.47,;5.33,4.24,;4,1.93,;1.33,1.93,;-2.66,-5,;-1.12,-4.89,;-4,-5.78,;-5.33,-5,;-4.24,-4.55,)|

BDBM50609701

[H][C@]12CN(c3cc(cc(n3)C3CC3)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CO1)C2 |r|

BDBM50609702

[H][C@]12CN(c3cc(cc(c3)-c3cnc(N)c(OC(F)F)n3)C3CC3)[C@]([H])(CO1)C2 |r|

BDBM50609703

[H][C@]12CN(c3cc(cc(n3)-c3cnc(N)c(OC(F)F)n3)C3CC3)[C@]([H])(CO1)C2 |r|

BDBM50609704

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)C3CC3)[C@]([H])(CO1)C2 |r|

BDBM50609705

[H][C@]12CN(c3cc(cc(n3)N3CCC(F)(F)C3)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CO1)C2 |r|

BDBM50609706

[H][C@]12CN(c3cc(nc(n3)N3CCC(F)(F)C3)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CO1)C2 |r|

BDBM50609707

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CCC(F)(F)C3)[C@]([H])(CO1)C2 |r|

BDBM50609708

[H][C@]12CN(c3cc(cc(n3)N3CC4CC3C4)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CN1C(=O)OC)C2 |r,wU:1.0,27.31,(-3.99,-.9,;-4,-2.31,;-2.66,-1.54,;-1.33,-2.31,;.01,-1.54,;-0,-0,;1.34,.77,;2.67,0,;2.67,-1.53,;1.33,-2.3,;4,-2.3,;5.41,-1.68,;6.44,-2.82,;5.67,-4.15,;4.16,-3.83,;5.01,-2.63,;1.34,2.31,;-0,3.07,;-0,4.62,;1.33,5.39,;1.33,6.93,;2.66,4.62,;4,5.39,;5.33,4.62,;6.66,5.39,;5.33,3.08,;2.66,3.08,;-1.33,-3.85,;.36,-3.86,;-2.66,-4.62,;-4,-3.85,;-5.33,-4.62,;-6.66,-3.85,;-5.33,-6.16,;-6.66,-6.93,;-2.91,-3.4,)|

BDBM50609709

[H][C@@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CCC(F)(F)C3)[C@@]([H])(CO1)C2 |r|

BDBM50609710

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CC4CC3C4)[C@]([H])(CO1)C2 |r,wU:1.0,27.31,(-5.32,-2.06,;-5.33,-3.47,;-4,-2.69,;-2.66,-3.47,;-1.33,-2.69,;0,-3.46,;1.33,-2.69,;1.34,-1.15,;0,-.38,;-1.34,-1.16,;0,1.16,;-1.33,1.92,;-1.33,3.47,;-0,4.24,;-0,5.78,;1.33,3.47,;2.66,4.24,;4,3.47,;5.33,4.24,;4,1.93,;1.33,1.93,;2.67,-3.46,;4.07,-2.83,;5.11,-3.98,;4.34,-5.31,;2.83,-4.99,;3.59,-3.87,;-2.66,-5.01,;-.97,-5.01,;-4,-5.78,;-5.33,-5.01,;-4.24,-4.55,)|

BDBM50609711

[H][C@]12CN(c3nc(SC)cc(n3)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CO1)C2 |r|

BDBM50609712

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)[C@@H]3CCCO3)[C@]([H])(CO1)C2 |r|

BDBM50609713

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)[C@H]3CCCO3)[C@]([H])(CO1)C2 |r|

BDBM50609714

Nc1ncc(nc1OC(F)F)-c1cc(nc(n1)N1CC2CC(C1)O2)N1CCC(F)(F)C1

BDBM50609715

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CCC(F)(F)C3)[C@]([H])(CN1C(=O)OCC)C2 |r|

BDBM50609716

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CC4CC3C4)[C@]([H])(CN1C(=O)OCC)C2 |r,wU:1.0,27.31,(-4,0,;-4,-1.54,;-2.66,-.77,;-1.33,-1.54,;.01,-.77,;1.33,-1.53,;2.67,-.76,;2.67,.77,;1.34,1.54,;-0,.77,;1.34,3.08,;-0,3.84,;-0,5.39,;1.33,6.16,;1.33,7.7,;2.66,5.39,;4,6.16,;5.33,5.39,;6.66,6.16,;5.33,3.85,;2.66,3.85,;4,-1.53,;5.41,-.91,;6.44,-2.05,;5.67,-3.38,;4.16,-3.06,;4.93,-1.73,;-1.33,-3.08,;.21,-3.08,;-2.66,-3.85,;-4,-3.08,;-5.33,-3.85,;-6.66,-3.08,;-5.33,-5.39,;-6.66,-6.16,;-6.66,-7.7,;-2.91,-2.63,)|

BDBM50609717

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)N3CCC(F)(F)C3)[C@]([H])(CN1c1ccc(C)nn1)C2 |r|

BDBM50609718

[H][C@]12CN(c3nc(SC)cc(n3)-c3cnc(N)c(OC(F)F)n3)[C@]([H])(CN1C(=O)OCC)C2 |r|

BDBM50609719

[H][C@]12CN(c3nc(cc(n3)-c3cnc(N)c(OC(F)F)n3)C3CC3)[C@]([H])(CN1C(=O)OCC)C2 |r|

BDBM50326053

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC

BDBM50308060

C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O

BDBM4814

CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C

BDBM50300690

CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1

BDBM16673

CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl

BDBM50326054

CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|

BDBM13535

COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1

BDBM50026612

CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5

BDBM2579

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC

BDBM25028

CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1

BDBM50355495

Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C

BDBM50355496

O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1

BDBM15138

Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|

BDBM60665

CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C

BDBM21

CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br

BDBM13533

Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C

BDBM27817

CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12

BDBM50128285

Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|

BDBM25013

CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|

BDBM5446

COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C

BDBM13530

CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1

BDBM50132260

Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F

BDBM21079

Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1

BDBM6568

CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl

BDBM32362

COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N

BDBM25045

Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1

BDBM60589

Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1

BDBM31095

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1

BDBM50355501

c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4

BDBM26300

CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO

BDBM36409

CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12

BDBM50242737

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|

BDBM13216

Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl

BDBM50309910

COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C

BDBM50355497

Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO

BDBM15244

c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl

BDBM5445

CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1

BDBM5931

CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3

BDBM50355500

C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|

BDBM482158

CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl

BDBM50322823

CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM24654

Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1

BDBM50306682

C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|

BDBM25617

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F

BDBM50355494

COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1

BDBM50161957

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C

BDBM25084

Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1

BDBM25628

OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O

BDBM24773

CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C

BDBM25117

CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4

BDBM31093

OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|

BDBM5655

CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|

BDBM4779

C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM25121

CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|

BDBM50355504

COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|

BDBM25118

CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O

BDBM50237710

Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F

BDBM13534

CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1

BDBM31085

CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1

BDBM25919

Cc1cnc2c(NCCN)nc3ccc(C)cc3n12

BDBM50332294

Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4

BDBM50184807

C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C

BDBM12621

COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F

BDBM26474

CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1

BDBM4851

Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1

BDBM50355499

CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|

BDBM50193995

C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|

BDBM13336

CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1

BDBM4552

CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC

BDBM17055

CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|

BDBM31088

Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12

BDBM5447

COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F

BDBM50331096

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1