Molecular Properties | |
SMILES: | CC(C)S(=O)(=O)N(CC1CC1)c1cc(F)c(N2CCN(C(=O)CCl)CC2)c(F)c1 |
MW: | 449.14 |
Fraction sp3: | 0.63 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 7 |
TPSA: | 60.93 |
cLogP: | 2.81 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
N,N-Dialkyl aniline derivatives (2)
Hetero_hetero
MED-COV-4280ac29-15
NIM-UNI-310206f0-26
0.714
NIM-UNI-310206f0-45
0.684
NIM-UNI-310206f0-29
0.662
NIM-UNI-310206f0-34
0.630
NIM-UNI-310206f0-27
0.602
NIM-UNI-310206f0-6
0.600
NIM-UNI-310206f0-13
0.582
NIM-UNI-310206f0-37
0.577
NIM-UNI-310206f0-36
0.550
NIM-UNI-310206f0-48
0.542
NIM-UNI-310206f0-63
0.530
NIM-UNI-310206f0-44
0.529
NIM-UNI-310206f0-51
0.529
NIM-UNI-310206f0-38
0.518
NIM-UNI-310206f0-55
0.511
NIM-UNI-310206f0-8
0.507
NIM-UNI-310206f0-46
0.506
NIM-UNI-310206f0-23
0.500
NIM-UNI-310206f0-40
0.500
NIM-UNI-310206f0-42
0.500
NIM-UNI-310206f0-54
0.495
NIM-UNI-310206f0-35
0.489
NIM-UNI-310206f0-9
0.487
NIM-UNI-310206f0-12
0.482
NIM-UNI-310206f0-7
0.480
NIM-UNI-310206f0-14
0.477
NIM-UNI-310206f0-20
0.459
NIM-UNI-310206f0-1
0.455
NIM-UNI-310206f0-11
0.455
NIM-UNI-310206f0-32
0.453
NIM-UNI-310206f0-18
0.449
NIM-UNI-310206f0-31
0.449
NIM-UNI-310206f0-4
0.443
NIM-UNI-310206f0-57
0.442
NIM-UNI-310206f0-3
0.442
NIM-UNI-310206f0-28
0.441
NIM-UNI-310206f0-19
0.436
NIM-UNI-310206f0-2
0.427
NIM-UNI-310206f0-15
0.424
NIM-UNI-310206f0-43
0.424
NIM-UNI-310206f0-47
0.423
NIM-UNI-310206f0-41
0.419
NIM-UNI-310206f0-5
0.415
NIM-UNI-310206f0-24
0.413
NIM-UNI-310206f0-22
0.413
NIM-UNI-310206f0-58
0.408
NIM-UNI-310206f0-16
0.406
NIM-UNI-310206f0-60
0.396
NIM-UNI-310206f0-62
0.393
NIM-UNI-310206f0-56
0.390
NIM-UNI-310206f0-39
0.390
NIM-UNI-310206f0-52
0.389
NIM-UNI-310206f0-10
0.387
NIM-UNI-310206f0-21
0.386
NIM-UNI-310206f0-33
0.385
NIM-UNI-310206f0-17
0.384
NIM-UNI-310206f0-61
0.374
NIM-UNI-310206f0-64
0.370
NIM-UNI-310206f0-65
0.370
NIM-UNI-310206f0-53
0.368
NIM-UNI-310206f0-49
0.365
SAD-SAT-5b1897b2-10
0.365
NIM-UNI-310206f0-59
0.360
SAD-SAT-5b1897b2-5
0.358
NIM-UNI-310206f0-50
0.358
MAT-POS-162a9720-4
0.356
NIM-UNI-310206f0-66
0.355
NIM-UNI-310206f0-30
0.354
VIK-SYN-bf9c9ac8-1
0.348
YOI-UNK-15f562e8-4
0.348
JIA-UNI-93b03cae-1
0.346
MAR-TRE-6a44bbf2-41
0.346
VIK-SYN-bf9c9ac8-7
0.342
VIK-SYN-9a3d118a-4
0.342
MAR-TRE-6a44bbf2-87
0.342
SAD-SAT-65574d3f-9
0.342
DRR-IMP-38dce17f-2
0.342
SAD-SAT-5b1897b2-4
0.338
NIL-NON-a189c016-1
0.333
MAR-TRE-6a44bbf2-32
0.333
ABB-MCD-f8003a30-1
0.333
MAK-UNK-7c9d1431-10
0.333
MAT-POS-162a9720-2
0.333
SAD-SAT-581007d4-1
0.329
AAR-POS-d2a4d1df-24
0.329
KAI-MCD-cb49037b-1
0.325
AAR-POS-0daf6b7e-18
0.325
SAD-SAT-581007d4-4
0.321
VIK-SYN-9a3d118a-2
0.321
VIK-SYN-bf9c9ac8-6
0.321
DRR-IMP-38dce17f-7
0.321
MAK-UNK-6ca90168-14
0.321
MAK-UNK-7c9d1431-29
0.320
DRR-IMP-11d47bff-1
0.320
AHN-SAT-de2502ba-15
0.317
DRR-IMP-38dce17f-4
0.316
HYO-UNK-49a60884-1
0.316
AAR-POS-d2a4d1df-35
0.316
JOH-UNI-0e1753c1-3
0.316
MED-COV-4280ac29-15
0.316