Molecular Properties | |
SMILES: | CN(CC1CCN(c2ccc(S(N)(=O)=O)cc2)CC1)c1ccc(F)cc1 |
MW: | 377.485 |
Fraction sp3: | 0.37 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 66.64 |
cLogP: | 2.8259 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
WAR-XCH-b6889685-4
0.774
WAR-XCH-b6889685-57
0.641
WAR-XCH-b6889685-6
0.638
WAR-XCH-b6889685-7
0.629
WAR-XCH-b72a1bbc-48
0.603
WAR-XCH-b72a1bbc-49
0.594
WAR-XCH-b6889685-1
0.592
WAR-XCH-b6889685-2
0.577
WAR-XCH-b6889685-3
0.577
WAR-XCH-b72a1bbc-14
0.525
WAR-XCH-b72a1bbc-44
0.521
WAR-XCH-b6889685-20
0.515
WAR-XCH-b72a1bbc-23
0.508
WAR-XCH-b6889685-54
0.492
WAR-XCH-b6889685-56
0.486
WAR-XCH-b72a1bbc-39
0.485
WAR-XCH-b6889685-48
0.480
WAR-XCH-b6889685-26
0.479
WAR-XCH-b72a1bbc-20
0.478
WAR-XCH-b6889685-53
0.477
WAR-XCH-b72a1bbc-19
0.471
WAR-XCH-b72a1bbc-21
0.458
WAR-XCH-b6889685-55
0.457
WAR-XCH-b6889685-18
0.455
WAR-XCH-b72a1bbc-9
0.453
WAR-XCH-b72a1bbc-47
0.449
WAR-XCH-b6889685-62
0.446
WAR-XCH-b6889685-8
0.444
WAR-XCH-b6889685-15
0.440
WAR-XCH-b6889685-58
0.434
WAR-XCH-b72a1bbc-43
0.434
WAR-XCH-b6889685-59
0.432
WAR-XCH-b72a1bbc-33
0.427
WAR-XCH-b6889685-21
0.423
WAR-XCH-b6889685-23
0.420
WAR-XCH-b72a1bbc-26
0.419
WAR-XCH-b6889685-10
0.418
WAR-XCH-b72a1bbc-36
0.416
WAR-XCH-b72a1bbc-37
0.416
WAR-XCH-b6889685-19
0.416
WAR-XCH-b6889685-13
0.415
WAR-XCH-b6889685-11
0.415
WAR-XCH-b6889685-12
0.415
WAR-XCH-b6889685-16
0.412
WAR-XCH-b72a1bbc-42
0.410
WAR-XCH-b6889685-22
0.410
WAR-XCH-b72a1bbc-45
0.407
WAR-XCH-b72a1bbc-40
0.405
WAR-XCH-b72a1bbc-5
0.403
WAR-XCH-b72a1bbc-16
0.403
WAR-XCH-b6889685-64
0.403
WAR-XCH-b72a1bbc-38
0.402
WAR-XCH-b6889685-14
0.402
WAR-XCH-b72a1bbc-41
0.400
WAR-XCH-b72a1bbc-11
0.400
WAR-XCH-b72a1bbc-34
0.400
WAR-XCH-b72a1bbc-24
0.395
WAR-XCH-b72a1bbc-30
0.395
WAR-XCH-b6889685-9
0.395
WAR-XCH-b6889685-17
0.395
WAR-XCH-b72a1bbc-17
0.395
WAR-XCH-b72a1bbc-10
0.394
WAR-XCH-b72a1bbc-29
0.391
WAR-XCH-b72a1bbc-46
0.390
WAR-XCH-b6889685-30
0.390
WAR-XCH-b6889685-43
0.390
WAR-XCH-b72a1bbc-7
0.389
WAR-XCH-b72a1bbc-15
0.389
WAR-XCH-b72a1bbc-28
0.388
WAR-XCH-b6889685-63
0.388
WAR-XCH-b72a1bbc-35
0.386
WAR-XCH-b72a1bbc-12
0.384
WAR-XCH-b72a1bbc-6
0.384
WAR-XCH-b6889685-24
0.384
WAR-XCH-b6889685-25
0.382
WAR-XCH-b72a1bbc-32
0.379
WAR-XCH-b72a1bbc-18
0.378
WAR-XCH-b72a1bbc-22
0.378
WAR-XCH-b72a1bbc-25
0.378
WAR-XCH-b72a1bbc-31
0.375
WAR-XCH-b72a1bbc-1
0.375
WAR-XCH-b6889685-44
0.375
WAR-XCH-b6889685-47
0.375
WAR-XCH-b6889685-29
0.373
WAR-XCH-b6889685-32
0.372
WAR-XCH-b6889685-49
0.369
WAR-XCH-b6889685-37
0.368
WAR-XCH-b6889685-61
0.365
WAR-XCH-b6889685-46
0.362
WAR-XCH-b6889685-45
0.362
WAR-XCH-b72a1bbc-27
0.362
WAR-XCH-b6889685-28
0.361
WAR-XCH-b6889685-33
0.359
WAR-XCH-b6889685-31
0.359
WAR-XCH-b6889685-27
0.358
WAR-XCH-b72a1bbc-8
0.354
WAR-XCH-b6889685-60
0.341
WAR-XCH-b6889685-38
0.330
WAR-XCH-b72a1bbc-13
0.330
WAR-XCH-b6889685-39
0.329