Molecular Properties | |
SMILES: | O=C(NC1CCCC(C2CCCCC2)C1)C1CCN(C(=O)CCl)CC1 |
MW: | 368.22 |
Fraction sp3: | 0.9 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 49.41 |
cLogP: | 3.72 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
AAR-POS-0daf6b7e-6
MAK-UNK-750cfbcc-2
0.435
MAK-UNK-69bf97dd-10
0.420
LON-WEI-120e5cf5-20
0.397
LON-WEI-120e5cf5-15
0.384
MAR-TRE-6a44bbf2-86
0.384
MAK-UNK-69bf97dd-2
0.380
LON-WEI-120e5cf5-13
0.380
MAK-UNK-c97f7c8f-1
0.377
MAK-UNK-750cfbcc-5
0.373
AAR-POS-0daf6b7e-9
0.373
VIR-GIT-7b3d3065-2
0.373
MAK-UNK-a7992eb3-9
0.372
LON-WEI-120e5cf5-11
0.372
MAK-UNK-750cfbcc-1
0.371
MAR-TRE-6a44bbf2-15
0.368
AAR-POS-0daf6b7e-6
0.368
LON-WEI-120e5cf5-10
0.368
MAK-UNK-c97f7c8f-2
0.367
LON-WEI-120e5cf5-3
0.367
MAK-UNK-750cfbcc-3
0.364
MAR-TRE-6a44bbf2-79
0.364
MAK-UNK-69bf97dd-9
0.360
LON-WEI-120e5cf5-16
0.359
LON-WEI-120e5cf5-21
0.358
LON-WEI-120e5cf5-19
0.358
MAK-UNK-69bf97dd-8
0.356
LON-WEI-120e5cf5-17
0.354
MAK-UNK-3d7e3904-2
0.354
LON-WEI-120e5cf5-1
0.354
AAR-POS-f650c5f2-4
0.354
AAR-POS-5507155c-2
0.354
MAK-UNK-704ed37c-3
0.352
MAK-UNK-69bf97dd-7
0.348
SAD-SAT-29425be4-20
0.345
MAK-UNK-a7992eb3-7
0.345
LON-WEI-120e5cf5-6
0.344
DRR-IMP-11d47bff-1
0.343
SAD-SAT-29425be4-14
0.341
SAD-SAT-29425be4-28
0.341
MAK-UNK-69bf97dd-1
0.341
BEN-DND-76ad4ac9-4
0.338
MAK-UNK-3d7e3904-3
0.337
LON-WEI-120e5cf5-7
0.337
MAK-UNK-a7992eb3-8
0.333
LON-WEI-120e5cf5-2
0.333
LON-WEI-120e5cf5-14
0.333
SAD-SAT-9a6c5cf3-9
0.333
MAK-UNK-704ed37c-5
0.333
SAD-SAT-29425be4-29
0.330
LON-WEI-120e5cf5-4
0.329
SAD-SAT-29425be4-15
0.329
MAK-UNK-704ed37c-2
0.329
LON-WEI-120e5cf5-9
0.326
SAD-SAT-29425be4-6
0.326
SAD-SAT-29425be4-13
0.326
SAD-SAT-29425be4-19
0.326
LON-WEI-120e5cf5-12
0.326
AAR-POS-0daf6b7e-19
0.324
VIR-GIT-7b3d3065-3
0.324
SAD-SAT-d8079f6f-4
0.323
MAK-UNK-69bf97dd-5
0.323
LON-WEI-120e5cf5-18
0.322
SAD-SAT-29425be4-3
0.322
SAD-SAT-9a6c5cf3-5
0.322
MAK-UNK-704ed37c-9
0.320
MAK-UNK-750cfbcc-4
0.320
MAR-TRE-6a44bbf2-66
0.320
MAK-UNK-704ed37c-1
0.319
SAD-SAT-29425be4-23
0.318
SAD-SAT-d8079f6f-3
0.317
SAD-SAT-d8079f6f-5
0.317
AAR-POS-0daf6b7e-5
0.316
MAK-UNK-704ed37c-4
0.315
YOI-UNK-15f562e8-1
0.312
MAK-UNK-69bf97dd-3
0.312
MAK-UNK-69bf97dd-4
0.312
SAD-SAT-d8079f6f-6
0.311
SAD-SAT-29425be4-12
0.311
MAK-UNK-704ed37c-7
0.311
YOI-UNK-15f562e8-5
0.311
MED-COV-4280ac29-17
0.309
WAR-XCH-b0339bbe-18
0.309
MAK-UNK-69bf97dd-6
0.309
MAK-UNK-6c8f5f75-1
0.308
LON-WEI-120e5cf5-5
0.308
GIA-UNK-a79af1bc-1
0.308
ASH-SAT-43770c7d-7
0.307
MAK-UNK-704ed37c-6
0.307
WAR-XCH-b0339bbe-7
0.306
MAK-UNK-4b073b5c-16
0.305
MAK-UNK-704ed37c-8
0.303
SAD-SAT-29425be4-4
0.302
SAD-SAT-29425be4-9
0.301
WAR-XCH-79d12f6e-4
0.300
YOI-UNK-12211982-1
0.299
YOI-UNK-a533afbc-1
0.299
SAD-SAT-f2e2579e-5
0.299
YOI-UNK-15f562e8-2
0.299
SAD-SAT-9a6c5cf3-6
0.298
SAD-SAT-f2e2579e-9
0.298