Molecular Properties | |
SMILES: | CC(C)N(C(=O)C1CCN(C(=O)CCl)CC1)C(C)Cc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1 |
MW: | 589.133 |
Fraction sp3: | 0.41 |
HBA: | 6 |
HBD: | 0 |
Rotatable Bonds: | 9 |
TPSA: | 92.58 |
cLogP: | 4.5716 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-2
0.769
MAK-UNK-8fdbca50-1
0.690
MAK-UNK-8fdbca50-16
0.687
MAK-UNK-8fdbca50-18
0.681
MAK-UNK-8fdbca50-41
0.664
MAK-UNK-8fdbca50-39
0.664
MAK-UNK-8fdbca50-40
0.652
MAK-UNK-8fdbca50-32
0.622
MAK-UNK-8fdbca50-3
0.622
MAK-UNK-8fdbca50-34
0.607
MAK-UNK-8fdbca50-5
0.593
MAK-UNK-8fdbca50-28
0.592
MAK-UNK-8fdbca50-37
0.589
MAK-UNK-8fdbca50-38
0.587
MAK-UNK-8fdbca50-22
0.583
MAK-UNK-8fdbca50-33
0.582
MAK-UNK-8fdbca50-30
0.575
MAK-UNK-8fdbca50-20
0.569
MAK-UNK-8fdbca50-11
0.568
MAK-UNK-8fdbca50-23
0.567
MAK-UNK-8fdbca50-27
0.566
MAK-UNK-8fdbca50-36
0.563
MAK-UNK-8fdbca50-13
0.560
MAK-UNK-8fdbca50-14
0.556
MAK-UNK-8fdbca50-26
0.556
MAK-UNK-8fdbca50-12
0.551
MAK-UNK-8fdbca50-24
0.542
MAK-UNK-8fdbca50-8
0.540
MAK-UNK-8fdbca50-35
0.540
MAK-UNK-8fdbca50-31
0.532
MAK-UNK-8fdbca50-7
0.531
MAK-UNK-8fdbca50-9
0.528
MAK-UNK-8fdbca50-21
0.524
MAK-UNK-de9577cf-11
0.517
MAK-UNK-8fdbca50-6
0.508
MAK-UNK-8fdbca50-15
0.504
MAK-UNK-8fdbca50-25
0.500
MAK-UNK-8fdbca50-19
0.496
MAK-UNK-8fdbca50-10
0.489
MAK-UNK-702fb7d3-11
0.485
MAK-UNK-702fb7d3-12
0.485
MAK-UNK-702fb7d3-6
0.485
MAK-UNK-9a6be56d-8
0.484
MAK-UNK-702fb7d3-5
0.484
MAK-UNK-702fb7d3-8
0.481
MAK-UNK-702fb7d3-9
0.481
MAK-UNK-148caf23-9
0.480
MAK-UNK-702fb7d3-14
0.478
MAK-UNK-702fb7d3-19
0.477
MAK-UNK-de9577cf-2
0.475
MAK-UNK-702fb7d3-13
0.474
MAK-UNK-702fb7d3-7
0.474
MAK-UNK-702fb7d3-10
0.467
MAK-UNK-702fb7d3-17
0.466
MAK-UNK-8fdbca50-4
0.462
MAK-UNK-9a6be56d-29
0.458
MAK-UNK-148caf23-4
0.452
MAK-UNK-702fb7d3-4
0.452
MAK-UNK-de9577cf-1
0.452
MAK-UNK-702fb7d3-3
0.449
MAK-UNK-702fb7d3-18
0.449
MAK-UNK-148caf23-5
0.444
MAK-UNK-9a6be56d-26
0.444
MAK-UNK-148caf23-6
0.441
MAK-UNK-702fb7d3-1
0.438
MAK-UNK-702fb7d3-2
0.438
MAK-UNK-de9577cf-10
0.437
MAK-UNK-9a6be56d-31
0.436
MAK-UNK-148caf23-2
0.434
MAK-UNK-148caf23-7
0.434
MAK-UNK-148caf23-3
0.430
MAK-UNK-9a6be56d-27
0.429
MAK-UNK-148caf23-1
0.426
MAK-UNK-9a6be56d-3
0.424
MAK-UNK-de9577cf-3
0.423
MAK-UNK-9a6be56d-28
0.422
MAK-UNK-148caf23-8
0.419
MAK-UNK-9a6be56d-32
0.418
MAK-UNK-9a6be56d-30
0.415
MAK-UNK-702fb7d3-21
0.413
MAK-UNK-9a6be56d-25
0.410
MAK-UNK-9a6be56d-1
0.407
MAK-UNK-de9577cf-12
0.395
MAK-UNK-702fb7d3-20
0.393
PEI-IMP-ca0b2813-1
0.379
MAK-UNK-9a6be56d-4
0.378
SAD-SAT-29425be4-27
0.376
ANT-OPE-a517596a-1
0.366
MAK-UNK-148caf23-10
0.366
MAK-UNK-de9577cf-7
0.361
MAK-UNK-9a6be56d-9
0.360
MAK-UNK-de9577cf-4
0.359
MAK-UNK-de9577cf-22
0.356
MAK-UNK-9a6be56d-14
0.355
MAK-UNK-de9577cf-15
0.348
MAK-UNK-de9577cf-17
0.348
MAK-UNK-9a6be56d-5
0.348
MAK-UNK-9a6be56d-22
0.348
YOI-UNK-12211982-6
0.345
YOI-UNK-a533afbc-6
0.345