Molecular Properties | |
SMILES: | CN(C)c1ccc(C(CNC(=O)C2CCN(C(=O)CCl)CC2)N(C)C)cc1 |
MW: | 394.21 |
Fraction sp3: | 0.6 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 55.89 |
cLogP: | 1.95 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
N,N-Dialkyl aniline derivatives (4)
N,N-Dialkyl aniline derivatives (5)
Long aliphatic chain
anil_di_alk_D(198)
MED-COV-4280ac29-15
SAD-SAT-29425be4-15
0.463
MAK-UNK-750cfbcc-2
0.431
SAD-SAT-29425be4-20
0.427
SAD-SAT-29425be4-14
0.425
SAD-SAT-29425be4-13
0.422
SAD-SAT-29425be4-28
0.422
SAD-SAT-29425be4-3
0.417
SAD-SAT-29425be4-6
0.405
LON-WEI-120e5cf5-10
0.403
MAK-UNK-69bf97dd-8
0.402
MAR-TRE-6a44bbf2-86
0.400
LON-WEI-120e5cf5-15
0.400
YOI-UNK-a533afbc-6
0.398
YOI-UNK-12211982-6
0.398
LON-WEI-120e5cf5-5
0.395
LON-WEI-120e5cf5-20
0.395
MAK-UNK-69bf97dd-7
0.393
MAK-UNK-c97f7c8f-1
0.392
LON-WEI-120e5cf5-21
0.390
SAD-SAT-29425be4-12
0.386
MAR-TRE-6a44bbf2-15
0.385
AAR-POS-0daf6b7e-6
0.385
LON-WEI-120e5cf5-3
0.383
MAK-UNK-c97f7c8f-2
0.383
MAK-UNK-69bf97dd-6
0.380
VIR-GIT-7b3d3065-3
0.380
AAR-POS-0daf6b7e-19
0.380
LON-WEI-120e5cf5-13
0.378
MAK-UNK-69bf97dd-9
0.375
LON-WEI-120e5cf5-16
0.375
SAD-SAT-29425be4-9
0.374
SAD-SAT-29425be4-29
0.374
LON-WEI-120e5cf5-19
0.373
LON-WEI-120e5cf5-11
0.370
MAK-UNK-69bf97dd-3
0.370
LON-WEI-120e5cf5-17
0.369
LON-WEI-120e5cf5-1
0.369
AAR-POS-f650c5f2-4
0.369
AAR-POS-5507155c-2
0.369
LON-WEI-120e5cf5-4
0.360
SAD-SAT-29425be4-4
0.358
SAD-SAT-29425be4-25
0.358
LON-WEI-120e5cf5-12
0.356
MAK-UNK-69bf97dd-1
0.355
YOI-UNK-12211982-1
0.354
YOI-UNK-a533afbc-1
0.354
MAK-UNK-3d7e3904-3
0.353
MAK-UNK-3d7e3904-2
0.353
VIK-SYN-9a3d118a-8
0.349
MAK-UNK-750cfbcc-1
0.348
SAD-SAT-29425be4-23
0.348
LON-WEI-120e5cf5-14
0.348
YOI-UNK-15f562e8-5
0.347
LON-WEI-120e5cf5-9
0.340
LON-WEI-120e5cf5-7
0.337
MAK-UNK-a7992eb3-8
0.333
SAD-SAT-29425be4-5
0.330
MAK-UNK-a7992eb3-7
0.330
MAK-UNK-3d7e3904-1
0.326
GIA-UNK-a79af1bc-1
0.325
MAK-UNK-6ca90168-11
0.325
MAK-UNK-750cfbcc-3
0.324
MAR-TRE-6a44bbf2-79
0.324
MAK-UNK-69bf97dd-2
0.323
SAD-SAT-d8079f6f-4
0.323
SAD-SAT-29425be4-30
0.323
MAK-UNK-69bf97dd-5
0.323
LON-WEI-120e5cf5-18
0.323
BEN-DND-76ad4ac9-4
0.321
SAD-SAT-29425be4-10
0.321
ASH-SAT-43770c7d-7
0.320
LON-WEI-120e5cf5-2
0.319
WAR-XCH-79d12f6e-4
0.317
MAK-UNK-a7992eb3-9
0.317
YOI-UNK-15f562e8-2
0.316
AAR-POS-0daf6b7e-9
0.315
MAK-UNK-750cfbcc-5
0.315
VIR-GIT-7b3d3065-2
0.315
YOI-UNK-12211982-2
0.314
SAD-SAT-29425be4-21
0.314
YOI-UNK-a533afbc-2
0.314
SAD-SAT-29425be4-8
0.313
YOI-UNK-15f562e8-1
0.313
MAK-UNK-69bf97dd-4
0.312
SAD-SAT-29425be4-11
0.312
MAK-UNK-704ed37c-2
0.312
MED-COV-4280ac29-4
0.311
MED-COV-4280ac29-17
0.310
SAD-SAT-29425be4-22
0.309
MAR-TRE-a3327163-19
0.308
SAD-SAT-f2e2579e-10
0.304
LON-WEI-120e5cf5-6
0.304
MAR-TRE-6a44bbf2-66
0.304
NIM-UNI-310206f0-6
0.304
MAK-UNK-750cfbcc-4
0.304
MAK-UNK-69bf97dd-10
0.303
MAK-UNK-a7992eb3-6
0.303
MAK-UNK-704ed37c-1
0.303
SAD-SAT-29425be4-16
0.302
SAD-SAT-29425be4-27
0.302