Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(c2c(F)cc(Nc3ncccn3)cc2F)CC1 |
MW: | 367.1 |
Fraction sp3: | 0.31 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 61.36 |
cLogP: | 2.39 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
N,N-Dialkyl aniline derivatives (2)
MED-COV-4280ac29-15
NIM-UNI-310206f0-8
0.535
NIM-UNI-310206f0-1
0.521
NIM-UNI-310206f0-6
0.515
NIM-UNI-310206f0-12
0.506
NIM-UNI-310206f0-23
0.506
NIM-UNI-310206f0-10
0.506
NIM-UNI-310206f0-20
0.500
NIM-UNI-310206f0-22
0.500
NIM-UNI-310206f0-32
0.494
NIM-UNI-310206f0-13
0.494
NIM-UNI-310206f0-18
0.488
NIM-UNI-310206f0-3
0.486
NIM-UNI-310206f0-24
0.482
NIM-UNI-310206f0-43
0.477
NIM-UNI-310206f0-11
0.476
VIK-SYN-9a3d118a-4
0.469
MAR-TRE-6a44bbf2-87
0.469
VIK-SYN-bf9c9ac8-7
0.469
NIM-UNI-310206f0-4
0.467
NIM-UNI-310206f0-7
0.466
NIM-UNI-310206f0-14
0.465
NIM-UNI-310206f0-28
0.461
NIM-UNI-310206f0-15
0.460
NIM-UNI-310206f0-9
0.456
NIM-UNI-310206f0-16
0.456
NIM-UNI-310206f0-41
0.455
NIM-UNI-310206f0-2
0.449
NIM-UNI-310206f0-21
0.447
NIM-UNI-310206f0-17
0.446
NIM-UNI-310206f0-19
0.440
NIM-UNI-310206f0-42
0.438
NIM-UNI-310206f0-36
0.429
NIM-UNI-310206f0-46
0.427
NIM-UNI-310206f0-29
0.425
NIM-UNI-310206f0-27
0.418
NIM-UNI-310206f0-44
0.416
NIM-UNI-310206f0-26
0.415
NIM-UNI-310206f0-25
0.415
NIM-UNI-310206f0-63
0.414
NIM-UNI-310206f0-49
0.408
SAD-SAT-5b1897b2-3
0.400
NIM-UNI-310206f0-37
0.400
NIM-UNI-310206f0-38
0.389
SAD-SAT-5b1897b2-10
0.386
NIM-UNI-310206f0-50
0.385
NIM-UNI-310206f0-51
0.385
SAD-SAT-5b1897b2-1
0.380
NIM-UNI-310206f0-40
0.379
NIM-UNI-310206f0-45
0.378
NIM-UNI-310206f0-48
0.378
NIM-UNI-310206f0-34
0.376
NIM-UNI-310206f0-54
0.375
DRR-IMP-38dce17f-5
0.375
NIM-UNI-310206f0-35
0.374
DRR-IMP-38dce17f-4
0.370
SAD-SAT-5b1897b2-8
0.365
NIM-UNI-310206f0-39
0.364
NIM-UNI-310206f0-65
0.358
NIM-UNI-310206f0-57
0.357
MAT-POS-162a9720-4
0.357
NIM-UNI-310206f0-62
0.355
NIM-UNI-310206f0-47
0.354
NIM-UNI-310206f0-56
0.352
AHN-SAT-de2502ba-15
0.351
NIM-UNI-310206f0-55
0.350
NIM-UNI-310206f0-61
0.349
MAK-UNK-849bee6c-1
0.347
SAD-SAT-581007d4-1
0.347
SWA-SYN-6423ea73-6
0.346
SWA-SYN-d2e6fa14-6
0.346
NIM-UNI-310206f0-60
0.343
NIM-UNI-310206f0-53
0.343
SAD-SAT-65574d3f-9
0.342
DRR-IMP-38dce17f-2
0.342
MAR-TRE-6a44bbf2-3
0.341
NIM-UNI-310206f0-31
0.340
SAD-SAT-5b1897b2-4
0.338
NIM-UNI-310206f0-59
0.336
MAT-POS-162a9720-2
0.333
NIM-UNI-310206f0-64
0.333
NIL-NON-a189c016-1
0.333
NIM-UNI-310206f0-33
0.333
DRR-IMP-38dce17f-6
0.333
PAU-UNI-8cdd41c7-1
0.333
NIM-UNI-310206f0-30
0.330
NIM-UNI-310206f0-66
0.330
NIM-UNI-310206f0-58
0.330
MAR-TRE-6a44bbf2-41
0.329
AHN-SAT-de2502ba-3
0.329
MAR-TRE-6a44bbf2-47
0.329
NIM-UNI-310206f0-52
0.327
DAR-DIA-fb20be43-1
0.326
STE-KUL-2e0d2e88-3
0.325
SAD-SAT-5b1897b2-5
0.325
DRR-IMP-38dce17f-1
0.324
DRR-IMP-38dce17f-3
0.324
MAK-UNK-7c9d1431-24
0.324
MAK-UNK-849bee6c-26
0.324
NIR-THE-b7e8e081-2
0.321
BEN-DND-6de5dfa0-16
0.321