Molecule Details

CNCC1=CC(C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

Molecular Properties
SMILES:
CNCC1=CC(C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1
MW: 589.133
Fraction sp3: 0.41
HBA: 6
HBD: 1
Rotatable Bonds: 9
TPSA: 99.68
cLogP: 3.3005
Covalent Warhead: ✔️
Covalent Fragment:
CCNc1ccc(C#N)cn1

AAR-POS-d2a4d1df-5

View

CNCC1=CC(N(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

MAK-UNK-8fdbca50-19
0.650

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=CC(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)c2cccnc2)c1

MAK-UNK-8fdbca50-5
0.531

View
CNC(c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-3
0.508

View
CC(CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N(C)C(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-1
0.508

View
CC(Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-2
0.504

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=CN(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)c2cccnc2)c1

MAK-UNK-8fdbca50-20
0.485

View
CNC(c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N(C(=O)C1CCN(C(=O)CCl)CC1)C(C)C

MAK-UNK-8fdbca50-18
0.473

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cncc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)c2)c1

MAK-UNK-8fdbca50-7
0.463

View
CNCc1cc(-c2cc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)ccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-14
0.463

View
CC(C)N(C(=O)C1CCN(C(=O)CCl)CC1)C(C)Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-17
0.462

View
CC(C)N(CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-16
0.459

View
CNCc1cc(-c2ccc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)cc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-13
0.456

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cnccc2C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)c1

MAK-UNK-8fdbca50-6
0.453

View
CC(C)N(C)/C(=C/NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-39
0.452

View
CN(C(=O)C1CCN(C(=O)CCl)CC1)C(C)(C)NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-41
0.452

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCNCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)CC1

MAK-UNK-8fdbca50-32
0.452

View
CNCc1cc(-c2cccc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)c2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-12
0.449

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)c2)c1

MAK-UNK-8fdbca50-9
0.448

View
CNCc1cc(-c2ccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)cc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-28
0.448

View
CNCc1cc(-c2cc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)ccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-30
0.444

View
CNCc1cc(-c2ccccc2CC(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-11
0.442

View
CNCc1cc(-c2c(F)cccc2C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-15
0.439

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2ccc(C(C)N(C)C(=O)C3CCN(C(=O)CCl)CC3)nc2)c1

MAK-UNK-8fdbca50-8
0.438

View
CNCc1cc(-c2cccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)c2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-27
0.437

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)c1

MAK-UNK-8fdbca50-10
0.435

View
CC(C)N(C)C(=O)C1CCN(/C(=C\NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)CCl)CC1

MAK-UNK-8fdbca50-34
0.432

View
CC(C)C(C)(NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)C1CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-40
0.430

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cncc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)c2)c1

MAK-UNK-8fdbca50-22
0.430

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cnccc2N(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)c1

MAK-UNK-8fdbca50-21
0.423

View
CC(C)N(C)C(=O)C1CCN(C(=O)C(Cl)NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)CC1

MAK-UNK-8fdbca50-33
0.420

View
CNCC1=CC(CNc2ccc(C#N)cn2)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

MAK-UNK-148caf23-13
0.419

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-37
0.418

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2ccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)nc2)c1

MAK-UNK-8fdbca50-23
0.415

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)c2)c1

MAK-UNK-8fdbca50-24
0.414

View
CNCc1cc(-c2c(F)cccc2N(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-31
0.410

View
CNCc1cc(-c2ccccc2CN(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-8fdbca50-26
0.410

View
CNCC1=CC(OC(=O)c2ccc(S(N)(=O)=O)cc2)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

MAK-UNK-de9577cf-14
0.405

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2N(C(=O)C2CCN(C(=O)CCl)CC2)C(C)C)c1

MAK-UNK-8fdbca50-25
0.403

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCl)C(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)C1

MAK-UNK-8fdbca50-36
0.399

View
CC(C)N(C)C(=O)C1(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)CCN(C(=O)CCl)CC1

MAK-UNK-8fdbca50-38
0.393

View
CC(C)N(C)C(=O)C1CCC(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)(C(=O)CCl)CC1

MAK-UNK-8fdbca50-35
0.387

View
CNCC1=CC(N2CCCc3ccc(S(N)(=O)=O)cc32)(S(=O)(=O)c2cccnc2)C(c2ccccc2F)=C1

MAK-UNK-9a6be56d-11
0.379

View
CCc1ccc(CN(Cc2cccnc2)C(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-27
0.344

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1

AAR-POS-0daf6b7e-19
0.343

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1

VIR-GIT-7b3d3065-3
0.343

View
O=C(Nc1cccnc1)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-11
0.339

View
O=C(CCl)N1Cc2ccccc2C(c2cccc(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)c2)C1

MAK-UNK-702fb7d3-13
0.331

View
CN(C(=O)C1CCN(C(=O)CCl)CC1)c1ccccc1

LON-WEI-120e5cf5-5
0.330

View
O=C(CCl)N1Cc2ccccc2C(c2ccccc2NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)C1

MAK-UNK-702fb7d3-12
0.329

View
O=C(CCl)N1Cc2ccccc2C(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)(c2ccccc2)C1

MAK-UNK-702fb7d3-6
0.327

View
O=C(CCl)N1CCN(c2c(F)cc(N(CC3CC3)S(=O)(=O)c3cccnc3)cc2F)CC1

NIM-UNI-310206f0-27
0.326

View
CC(=O)N(C[C@@H]1CN(C(=O)CCl)CC[C@@H]1C(=O)N(C)C(C)C)c1cccnc1

THO-SYG-f9b2970d-8
0.320

View
CC(C)N(C)C(=O)[C@H]1CCN(C(=O)CCl)C[C@@H]1CC(=O)Nc1cccnc1

THO-SYG-f9b2970d-6
0.320

View
O=C(CCl)N1Cc2cccc(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)c2C(c2ccccc2)C1

MAK-UNK-702fb7d3-11
0.320

View
O=C(CCl)N1Cc2c(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)cccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-8
0.318

View
O=C(CCl)N1Cc2cc(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)ccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-9
0.316

View
O=C(CCl)N1Cc2ccccc2C(c2ccc(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)cc2)C1

MAK-UNK-702fb7d3-14
0.314

View
CC(C)N(C)C(=O)[C@H]1CCN(C(=O)CCl)[C@H](CC(=O)Nc2cccnc2)C1

THO-SYG-f9b2970d-5
0.313

View
O=C(CCl)N1CC(c2ccccc2)c2ccccc2C1NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-702fb7d3-5
0.313

View
O=C(CCl)N1Cc2ccc(NCc3cc(-c4ccccc4F)n(S(=O)(=O)c4cccnc4)c3)cc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-10
0.308

View
CC(=O)N(C[C@H]1C[C@@H](C(=O)N(C)C(C)C)CCN1C(=O)CCl)c1cccnc1

THO-SYG-f9b2970d-7
0.308

View
O=C(CCl)N1CCN(c2c(F)cc(N(c3ncccn3)S(=O)(=O)c3cccnc3)cc2F)CC1

NIM-UNI-310206f0-28
0.303

View
CCN(C(=O)C1CCN(C(=O)CCl)CC1)C(CF)c1ccccc1

YOI-UNK-12211982-6
0.303

View
CCN(C(=O)C1CCN(C(=O)CCl)CC1)C(CF)c1ccccc1

YOI-UNK-a533afbc-6
0.303

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1OC(=O)c1ccc(S(N)(=O)=O)cc1

MAK-UNK-de9577cf-15
0.302

View
CNCc1cc(-c2ccccc2F)c(S(=O)(=O)c2cccnc2)[nH]1

MAK-UNK-0955449e-29
0.301

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1CNc1ccc(C#N)cn1

MAK-UNK-148caf23-12
0.296

View
CNCc1cc(S(=O)(=O)c2cccnc2)c(-c2ccccc2F)n1-c1c(O)cc(C(=O)O)c(O)c1I

MAK-UNK-0955449e-31
0.296

View
CNC(=C(CCl)N1Cc2ccccc2C(c2ccccc2)C1)c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-702fb7d3-21
0.294

View
CN(CC(=O)N1Cc2ccccc2C(c2ccccc2)C1)Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-702fb7d3-17
0.294

View
O=C(CCl)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccccc3F)CC2)CC1

SAD-SAT-9a6c5cf3-10
0.293

View
CNCc1cc(-c2ccccc2F)n(C(C(=O)NC)c2cccnc2)c1

MAK-UNK-0955449e-3
0.292

View
O=C(CCl)N1Cc2ccccc2C(c2ccccc2)C1NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-702fb7d3-7
0.292

View
O=C(CCl)C1(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)Cc2ccccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-4
0.292

View
COC(=O)c1ccc(S(=O)(=O)N(C)Cc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)cc1

MAK-UNK-de9577cf-2
0.292

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=CCNc2ccc(C#N)cn2)c2cccnc2)c1

MAK-UNK-148caf23-14
0.292

View
CC(C)N(Cc1ccc(-c2ccccc2)s1)C(=O)C1CCN(C(=O)CCl)CC1

SAD-SAT-29425be4-16
0.291

View
O=C(CCNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N1Cc2ccccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-1
0.290

View
CNCc1cc(-c2ccccc2F)n(C(CCNC(=O)OC)c2cccnc2)c1

MAK-UNK-0955449e-4
0.290

View
CNCc1cc(S(=O)(=O)c2cccnc2)c(-c2ccccc2F)n1-c1cc[nH]n1

MAK-UNK-0955449e-30
0.289

View
COC(=O)C(C)(C)N(Cc1cccc(OC)c1OC)C(=O)C1CCN(C(=O)CCl)CC1

SAD-SAT-29425be4-22
0.287

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=NS(=O)(=O)c2ccc3c(c2)N(C)CCC3)c2cccnc2)c1

MAK-UNK-9a6be56d-5
0.287

View
Cc1cccnc1NC(=O)C1CCN(C(=O)CCl)CC1

LON-WEI-120e5cf5-21
0.286

View
C[N+](Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)=C(CCl)N1Cc2ccccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-19
0.286

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=CN2CCCc3ccc(S(N)(=O)=O)cc32)c2cccnc2)c1

MAK-UNK-9a6be56d-14
0.285

View
CNCc1cn(S(=O)(=O)c2cccnc2)c(-c2ccccc2F)c1CNc1ccc(C#N)cn1

MAK-UNK-148caf23-11
0.284

View
O=C(CCl)N1CCN(S(=O)(=O)c2cccc(F)c2)C(CNCN(C(=O)Nc2cccnc2)c2ccccc2)C1

MAC-MCD-76766525-1
0.283

View
CNCc1cc(-c2ccccc2F)n(S(=O)(=COC(=O)c2ccc(S(N)(=O)=O)cc2)c2cccnc2)c1

MAK-UNK-de9577cf-22
0.283

View
O=S(=O)(c1cccnc1)n1cc(CN/C=C(\CCl)N2Cc3ccccc3C(c3ccccc3)C2)cc1-c1ccccc1F

MAK-UNK-702fb7d3-3
0.282

View
O=C(C(Cl)NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)N1Cc2ccccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-2
0.282

View
C[N+](Cl)(Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)N1Cc2ccccc2C(c2ccccc2)C1

MAK-UNK-702fb7d3-18
0.282

View
CC(Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)OC(=O)c1ccc(S(N)(=O)=O)cc1

MAK-UNK-de9577cf-11
0.282

View
O=C(c1cccc(F)c1)C1CCN(C(=O)CCl)CC1

BEN-DND-76ad4ac9-4
0.281

View
CNN(c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)S(=O)(=O)c1ccc(C(=O)OC)cc1

MAK-UNK-de9577cf-3
0.281

View
CNCc1cn(S(=O)(=O)c2cccnc2)c(-c2ccccc2F)c1OC(=O)c1ccc(S(N)(=O)=O)cc1

MAK-UNK-de9577cf-13
0.280

View
CC(NCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)Nc1ccc(C#N)cn1

MAK-UNK-148caf23-7
0.279

View
C[C@@H](C(=O)Nc1cnccc1C#N)C1CCN(C(=O)CCl)CC1

SAD-SAT-89668ff1-3
0.278

View
CNC(Cl)(C(=O)N1Cc2ccccc2C(c2ccccc2)C1)c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1

MAK-UNK-702fb7d3-20
0.277

View
CC(C)(C)c1ccc(S(=O)(=O)CCNC(=O)C2CCN(C(=O)CCl)CC2)cc1

SAD-SAT-29425be4-6
0.276

View
CN1CCC(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)c2ccc(S(N)(=O)=O)cc21

MAK-UNK-9a6be56d-29
0.276

View
CC(C)N(C)C(=O)C1CCN(C(=O)CNS(=O)(=O)c2cccnc2)CC1

0.471

View
CC(c1ccccc1F)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.465

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCNS(=O)(=O)c2cccnc2)CC1

0.460

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN(C2CC2)S(=O)(=O)c2cccnc2)CC1

0.460

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN(C)S(=O)(=O)c2cccnc2)CC1

0.459

View
CC(c1ccccc1F)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.442

View
CNC(=O)[C@H](C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.440

View
CC(N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)C1(C)CC1

0.435

View
CC(CS(C)(=O)=O)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.435

View
CC(CS(C)(=O)=O)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.430

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCc2ncc(-c3ccccc3F)o2)CC1

0.429

View
CNC(=O)[C@H](C)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.429

View
CC(C)N(C)C(=O)C1CCN(C(=O)COC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)CC1

0.429

View
CC(c1ccc(F)c(F)c1)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.427

View
CC(C)N(C)C(=O)C1CCN(C(=O)COC(=O)CCNS(=O)(=O)c2cccnc2)CC1

0.426

View
CC(c1cc(F)ccc1F)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.422

View
CC(C)N(C)C(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2cccnc2)CC1

0.422

View
CC(C)N(C)C(=O)C1CCN(C(=O)Cc2cccnc2)CC1

0.422

View
CC(N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1)C1(S(C)(=O)=O)CC1

0.420

View
CC(C)N(C)C(=O)C1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)CC1

0.419

View
CC(c1ccccc1Cl)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.416

View
CC(NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1cccnc1

0.414

View
CC(C)N(C)C(=O)C1CCN(C(=O)C(=O)NCCNS(=O)(=O)c2cccnc2)CC1

0.413

View
CC(N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1)C1(C)CC1

0.412

View
CC(C)N(Cc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.411

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCCNC(=O)c2cccnc2)CC1

0.411

View
CN(CCc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.411

View
CC(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.410

View
Cc1ccccc1C(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.409

View
CCS(=O)(=O)CC(C)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.409

View
C[C@H](NC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1F

0.409

View
CN(Cc1c(F)cccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.409

View
CN(CC(=O)N1CCC(C(=O)NC2CC2)CC1)S(=O)(=O)c1cccnc1

0.409

View
CC(CS(C)=O)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.409

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN2CCN(c3cccnc3)CC2)CC1

0.409

View
CN(C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)C(CN)C1CC1

0.409

View
CCC(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.407

View
CC(C)N(C)C(=O)C1CCN(C(=O)CS(=O)(=O)Cc2c(F)cccc2F)CC1

0.407

View
CC(C)N(C)C(=O)C1CCN(C(=O)CSc2nnc(-c3ccccc3F)o2)CC1

0.407

View
CN(CC(=O)N1CCC(Oc2ncccc2F)CC1)S(=O)(=O)c1cccnc1

0.407

View
CC(C)N(C)C(=O)C1CCN(C(=O)COCC(=O)NCc2cccnc2)CC1

0.407

View
CCN(C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1F

0.404

View
CN(CC(=O)N1CCC(c2ccccc2F)CC1)S(=O)(=O)c1cccnc1

0.404

View
CN(CC(=O)N1CCC(c2c(F)cccc2F)C1)S(=O)(=O)c1cccnc1

0.404

View
CC(c1ccc(F)cc1)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CC(c1ccc(F)c(F)c1)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.404

View
CCS(=O)(=O)CC(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CCOC(=O)[C@H](C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CCOC(=O)C(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CON(C)C(=O)C1CCN(C(=O)CNS(=O)(=O)c2cccnc2)CC1

0.404

View
CC(C(=O)NC(C)(C)C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CNC(=O)C(C)CN(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CN(Cc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.404

View
CC(NCC(=O)N1CCC(C(=O)N(C)C(C)C)CC1)c1ncccc1F

0.404

View
CC(C)N(C)C(=O)C1CCN(C(=O)Cn2cc(-c3ccccc3F)nn2)CC1

0.404

View
CN(C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)c1ccccc1F

0.402

View
CC(N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)C(F)(F)F

0.402

View
CNC(=O)C1CCN(C(=O)CN(C)S(=O)(=O)c2cccnc2)CC1

0.402

View
C[C@H](CO)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.402

View
CC(CO)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.402

View
CC(C)N(C)C(=O)C1CCN(C(=O)CCCc2cccnc2)CC1

0.402

View
CC(C)N(C)C(=O)C1CCN(C(=O)CS(=O)(=O)Cc2ccccc2F)CC1

0.402

View
CC(c1cccnc1)N(C)CC(=O)N1CCC(C(=O)N(C)C(C)C)CC1

0.402

View
CC(CN)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.402

View
CN(Cc1c(F)cccc1Cl)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.402

View
CC(c1cccnc1)N(C)C(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1

0.400

View
CC(c1cccnc1)N(C)C(=O)C1CCN(C(=O)COc2ccccc2)CC1

0.400

View
CN(CC(=O)N1CCC(c2ccccc2F)C1)S(=O)(=O)c1cccnc1

0.400

View
CC(C)N(Cc1ccccc1F)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.400

View
CC(C)C(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.400

View
CCC(C)N(CCc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN(Cc2cccnc2)c2ccccc2)CC1

0.400

View
O=C(CN(C1CC1)S(=O)(=O)c1cccnc1)N1CCN(c2ccccc2F)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)CNc2ccccc2F)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)COc2ccc(-c3cccnc3)cc2)CC1

0.400

View
CC(c1cc(F)ccc1F)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.400

View
CCN(Cc1c(F)cccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.400

View
CCN(C)C(=O)C(C)NC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)CS(=O)(=O)Cc2c(F)cccc2Cl)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN2CC(C)(C)C2c2cccnc2)CC1

0.400

View
CC(C)S(=O)(=O)N(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1

0.400

View
CC(C)S(=O)(=O)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.400

View
CC(C)N(C)C(=O)C1CCN(C(=O)COC(=O)CCc2ncc(-c3ccccc3F)o2)CC1

0.398

View
CC(C)CN(Cc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.398

View
Cc1c(NCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cnn1-c1ccccc1F

0.398

View
CN(CC(=O)N1CCC(C(=O)NCc2ccc(F)cc2)CC1)S(=O)(=O)c1cccnc1

0.398

View
CCCC(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.398

View
CC(c1cccnc1)N(C)C(=O)C1CCN(c2ccccc2F)C1

0.398

View
CC(C)C(c1ccccc1)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.398

View
CSCC(C)N(C)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.398

View
CN(CC(=O)N1CCN(c2ccccc2F)CC1)S(=O)(=O)c1cccnc1

0.398

View
CC(C)N(C)C(=O)C1CCN(C(=O)COCc2cccnc2)CC1

0.398

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN(c2ccccc2F)S(C)(=O)=O)CC1

0.398

View
CC(C)N(C)C(=O)C1CCN(C(=O)CN(c2ccccc2F)S(=O)(=O)C(C)C)CC1

0.398

View
CN(CC(=O)N1CCC(C(=O)c2ccccc2)CC1)S(=O)(=O)c1cccnc1

0.398

View
CC(C)N(C)C(=O)C1CCN(C(=O)CNS(=O)(=O)c2ccccc2F)CC1

0.398

View
CC(C)N(C)C(=O)C1CCN(C(=O)CSc2nnc(-c3ccccc3F)[nH]2)CC1

0.396

View
CC(c1cccnc1)N(C)C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1

0.396

View
CCCCN(C)C(=O)C1CCN(C(=O)CNS(=O)(=O)c2cccnc2)CC1

0.396

View
CCN(Cc1ccccc1F)C(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1

0.396

View


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