Molecular Properties | |
SMILES: | CC(C)N(C)C(=O)N1CCN(C(=O)CCl)CC1 |
MW: | 261.753 |
Fraction sp3: | 0.82 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 43.86 |
cLogP: | 0.8296 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
YOI-UNK-15f562e8-4
1.000
SAD-SAT-1b030f84-9
0.576
AAR-POS-0daf6b7e-21
0.526
VIR-GIT-7b3d3065-3
0.500
AAR-POS-0daf6b7e-19
0.500
VIK-SYN-9a3d118a-1
0.489
MAK-UNK-987948f6-5
0.476
MAK-UNK-704ed37c-11
0.475
MAK-UNK-704ed37c-12
0.465
MAK-UNK-987948f6-4
0.455
SAD-SAT-1b030f84-8
0.455
MAK-UNK-6ca90168-16
0.442
VIK-SYN-bf9c9ac8-2
0.435
MAK-UNK-6ca90168-18
0.432
MAK-UNK-6ca90168-17
0.432
SAD-SAT-5b1897b2-9
0.422
MAK-UNK-704ed37c-10
0.422
SAD-SAT-89668ff1-8
0.418
DRR-IMP-11d47bff-1
0.412
MAK-UNK-4b073b5c-16
0.410
MAK-UNK-95198336-3
0.405
MAK-UNK-704ed37c-13
0.404
WAR-XCH-b0339bbe-18
0.396
SAD-SAT-d8079f6f-4
0.395
SAD-SAT-d8079f6f-5
0.390
SAD-SAT-d8079f6f-3
0.390
MAK-UNK-6ca90168-10
0.389
MAK-UNK-52a1ef4b-1
0.388
TOB-UNK-c2aba166-1
0.383
MAK-UNK-e4a48a85-14
0.382
SAD-SAT-d8079f6f-6
0.381
SWA-SYN-6423ea73-5
0.377
SWA-SYN-d2e6fa14-5
0.377
MAK-UNK-52a1ef4b-3
0.377
AHN-SAT-de2502ba-8
0.377
AAR-POS-d2a4d1df-25
0.377
NIM-UNI-310206f0-6
0.375
MAK-UNK-f983951f-21
0.372
SAD-SAT-bc31ec01-2
0.372
SAD-SAT-3a925b8b-1
0.370
MAK-UNK-3f402c2b-28
0.368
MAK-UNK-987948f6-2
0.365
AAR-POS-0daf6b7e-18
0.364
MAK-UNK-d4768348-7
0.362
MAR-TRE-6a44bbf2-56
0.358
SAD-SAT-5b1897b2-6
0.358
DRR-IMP-db50bf6e-3
0.358
SAD-SAT-1b030f84-4
0.357
ASH-SAT-43770c7d-10
0.357
VIK-SYN-9a3d118a-2
0.356
VIK-SYN-bf9c9ac8-6
0.356
MAR-TRE-6a44bbf2-77
0.356
MAK-UNK-7c9d1431-17
0.356
SIM-SYN-f15aaa3a-1
0.352
SAD-SAT-3a925b8b-4
0.352
SAD-SAT-3a925b8b-5
0.352
AAR-POS-d2a4d1df-29
0.352
DRR-IMP-db50bf6e-1
0.352
MAR-TRE-6a44bbf2-61
0.352
MAK-UNK-6ca90168-20
0.352
MAK-UNK-52a1ef4b-2
0.352
HYO-UNK-49a60884-1
0.351
AAR-POS-d2a4d1df-22
0.351
AAR-POS-d2a4d1df-27
0.351
AAR-POS-d2a4d1df-35
0.351
MED-COV-4280ac29-15
0.351
MAR-LAB-efb042c5-5
0.351
MAR-TRE-6a44bbf2-68
0.351
SAD-SAT-3a925b8b-9
0.351
MAR-TRE-6a44bbf2-52
0.351
JOH-UNI-0e1753c1-3
0.351
LON-WEI-8f408cad-3
0.351
ABB-MCD-f8003a30-1
0.350
MAK-UNK-af83ef51-2
0.350
MAR-TRE-6a44bbf2-32
0.350
NIM-UNI-310206f0-25
0.348
SAD-SAT-65574d3f-5
0.347
JOH-UNI-27ac80fd-25
0.345
AAR-POS-0daf6b7e-16
0.345
SAD-SAT-1b030f84-5
0.345
MAK-UNK-7c9d1431-13
0.345
MAK-UNK-6ca90168-4
0.345
AAR-POS-d2a4d1df-24
0.345
MAK-UNK-7c9d1431-12
0.345
MAR-TRE-6a44bbf2-78
0.345
MAR-TRE-6a44bbf2-41
0.344
JOK-SYG-18591e8f-1
0.344
PEI-IMP-ca0b2813-3
0.344
MAK-UNK-6ca90168-7
0.344
MAK-UNK-750cfbcc-1
0.340
MAK-UNK-6c8f5f75-1
0.340
MAK-UNK-750cfbcc-2
0.340
MAR-TRE-6a44bbf2-87
0.340
MAK-UNK-7c9d1431-24
0.340
VIK-SYN-9a3d118a-4
0.340
VIK-SYN-bf9c9ac8-7
0.340
DRR-IMP-38dce17f-3
0.340
AHN-SAT-de2502ba-7
0.339
MAR-TRE-6a44bbf2-21
0.339
SAD-SAT-65574d3f-9
0.339