Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(c2c(F)cc(N3CCOCC3)cc2F)CC1 |
MW: | 359.12 |
Fraction sp3: | 0.56 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 36.02 |
cLogP: | 1.69 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
N,N-Dialkyl aniline derivatives (2)
MED-COV-4280ac29-15
NIM-UNI-310206f0-6
0.583
NIM-UNI-310206f0-9
0.528
NIM-UNI-310206f0-2
0.521
NIM-UNI-310206f0-3
0.500
NIM-UNI-310206f0-29
0.493
NIM-UNI-310206f0-1
0.493
NIM-UNI-310206f0-8
0.486
NIM-UNI-310206f0-25
0.480
NIM-UNI-310206f0-26
0.480
NIM-UNI-310206f0-4
0.479
NIM-UNI-310206f0-5
0.466
NIM-UNI-310206f0-20
0.456
NIM-UNI-310206f0-36
0.456
MAT-POS-162a9720-4
0.452
NIM-UNI-310206f0-11
0.451
NIM-UNI-310206f0-48
0.451
NIM-UNI-310206f0-34
0.447
NIM-UNI-310206f0-12
0.443
NIM-UNI-310206f0-37
0.443
NIM-UNI-310206f0-23
0.443
NIM-UNI-310206f0-14
0.440
NIM-UNI-310206f0-44
0.440
NIM-UNI-310206f0-63
0.439
NIM-UNI-310206f0-15
0.435
NIM-UNI-310206f0-45
0.434
NIM-UNI-310206f0-13
0.432
NIM-UNI-310206f0-32
0.432
NIM-UNI-310206f0-19
0.432
NIM-UNI-310206f0-18
0.429
NIM-UNI-310206f0-51
0.424
NIM-UNI-310206f0-16
0.416
NIM-UNI-310206f0-40
0.416
NIM-UNI-310206f0-41
0.414
NIM-UNI-310206f0-42
0.414
NIM-UNI-310206f0-38
0.412
NIM-UNI-310206f0-10
0.412
NIM-UNI-310206f0-27
0.409
AAR-POS-0daf6b7e-18
0.409
NIM-UNI-310206f0-22
0.407
NIM-UNI-310206f0-24
0.407
MAT-POS-162a9720-5
0.403
NIM-UNI-310206f0-43
0.402
NIM-UNI-310206f0-46
0.402
MAK-UNK-f983951f-21
0.400
SAD-SAT-5b1897b2-10
0.394
NIM-UNI-310206f0-28
0.389
SAD-SAT-65574d3f-9
0.388
SAD-SAT-5b1897b2-4
0.382
NIM-UNI-310206f0-54
0.380
NIM-UNI-310206f0-35
0.379
NIM-UNI-310206f0-33
0.378
JOH-UNI-27ac80fd-4
0.377
NIM-UNI-310206f0-17
0.376
NIM-UNI-310206f0-57
0.376
NIL-NON-a189c016-1
0.375
MAT-POS-162a9720-2
0.375
NIM-UNI-310206f0-58
0.374
NIM-UNI-310206f0-47
0.372
NIM-UNI-310206f0-56
0.370
VIK-SYN-bf9c9ac8-7
0.369
MAR-TRE-6a44bbf2-87
0.369
VIK-SYN-9a3d118a-4
0.369
NIM-UNI-310206f0-52
0.369
NIM-UNI-310206f0-39
0.368
NIM-UNI-310206f0-55
0.368
NIM-UNI-310206f0-61
0.366
NIM-UNI-310206f0-21
0.365
NIM-UNI-310206f0-60
0.361
NIM-UNI-310206f0-31
0.357
NIM-UNI-310206f0-49
0.357
MAK-UNK-7c9d1431-10
0.356
NIM-UNI-310206f0-59
0.352
JIA-UNI-93b03cae-1
0.352
NIM-UNI-310206f0-64
0.350
NIM-UNI-310206f0-53
0.347
SAD-SAT-1b030f84-9
0.346
GIA-UNK-20b63697-2
0.346
TAM-UNI-d1c3dd9f-12
0.345
BOG-INS-bdba9cfb-1
0.337
NIM-UNI-310206f0-65
0.337
NIM-UNI-310206f0-50
0.337
MAR-TRE-6a44bbf2-41
0.333
NIM-UNI-310206f0-66
0.333
SAD-SAT-5b1897b2-8
0.333
AHN-SAT-de2502ba-3
0.333
SAD-SAT-581007d4-1
0.333
NIM-UNI-310206f0-62
0.333
STU-CHA-6cae54d3-1
0.330
SAD-SAT-5b1897b2-5
0.329
DRR-IMP-38dce17f-2
0.329
SAD-SAT-5b1897b2-1
0.329
SAD-SAT-5b1897b2-3
0.329
VIK-SYN-bf9c9ac8-6
0.324
VIK-SYN-9a3d118a-2
0.324
MAK-UNK-7c9d1431-28
0.324
MAK-UNK-7c9d1431-29
0.324
MAK-UNK-52a1ef4b-1
0.323
STU-CHA-6d5cfe2b-1
0.322
SAD-SAT-6b5a89f0-2
0.322
NIM-UNI-310206f0-30
0.321