Molecule Details
| Molecular Properties | |
| SMILES: | O=C(CCl)N1CCC1 |
| MW: | 133.03 |
| Fraction sp3: | 0.8 |
| HBA: | 1 |
| HBD: | 0 |
| Rotatable Bonds: | 1 |
| TPSA: | 20.31 |
| cLogP: | 0.46 |
| Covalent Warhead: | ✔️ |
| Covalent Fragment: | ✔️ |
| Source | |
| Enamine BB: | EN300-11195 |
| Enamine SCR: | Z57039583 |
| Mcule: | MCULE-1485330958 |
| MolPort: | MolPort-002-022-776 |
LON-WEI-8f408cad-3
MAK-UNK-4b073b5c-16
0.783
SAD-SAT-d8079f6f-5
0.720
SAD-SAT-d8079f6f-3
0.720
SAD-SAT-d8079f6f-6
0.692
SAD-SAT-1b030f84-9
0.652
AAR-POS-0daf6b7e-21
0.517
MAK-UNK-704ed37c-10
0.515
MAK-UNK-95198336-4
0.500
MAK-UNK-95198336-7
0.500
MAK-UNK-f983951f-21
0.500
MAK-UNK-704ed37c-11
0.500
SAD-SAT-bc31ec01-2
0.500
MAK-UNK-95198336-6
0.500
MAK-UNK-704ed37c-13
0.486
SAD-SAT-edc8a235-3
0.486
SAD-SAT-d8079f6f-4
0.484
MAK-UNK-750cfbcc-3
0.459
MAR-TRE-6a44bbf2-79
0.459
MAK-UNK-987948f6-5
0.455
MAK-UNK-6ca90168-16
0.455
MAK-UNK-704ed37c-12
0.441
MAK-UNK-750cfbcc-1
0.441
MAK-UNK-6c8f5f75-1
0.441
MAK-UNK-6ca90168-18
0.441
MAK-UNK-6ca90168-17
0.441
MAK-UNK-4b073b5c-17
0.438
SAD-SAT-6b5a89f0-2
0.438
MAK-UNK-750cfbcc-5
0.436
VIR-GIT-7b3d3065-2
0.436
AAR-POS-0daf6b7e-9
0.436
MAK-UNK-95198336-11
0.433
VIK-SYN-9a3d118a-1
0.432
MAK-UNK-987948f6-4
0.429
SAD-SAT-5b1897b2-9
0.429
SAD-SAT-1b030f84-8
0.429
MAK-UNK-95198336-5
0.429
SAD-SAT-65574d3f-7
0.417
TOB-UNK-c2aba166-1
0.417
SAD-SAT-65574d3f-6
0.410
VIK-SYN-bf9c9ac8-1
0.405
YOI-UNK-15f562e8-4
0.405
VIK-SYN-bf9c9ac8-2
0.405
SAD-SAT-65574d3f-5
0.405
MAK-UNK-6c8f5f75-2
0.400
WAR-XCH-b0339bbe-18
0.395
MAK-UNK-750cfbcc-2
0.395
MAK-UNK-4b073b5c-19
0.394
MAK-UNK-52a1ef4b-1
0.385
MAK-UNK-95198336-9
0.382
DRR-IMP-11d47bff-1
0.381
BEN-DND-76ad4ac9-8
0.375
SAD-SAT-edc8a235-10
0.371
JOH-UNI-27ac80fd-4
0.370
MAR-TRE-6a44bbf2-66
0.370
MAK-UNK-750cfbcc-4
0.370
SAD-SAT-edc8a235-7
0.368
MAK-UNK-704ed37c-14
0.368
MAK-UNK-704ed37c-16
0.368
MAK-UNK-7c9d1431-21
0.367
MAK-UNK-95198336-8
0.367
MAK-UNK-7c9d1431-24
0.357
MAK-UNK-987948f6-2
0.357
VIK-SYN-9a3d118a-4
0.357
VIK-SYN-bf9c9ac8-7
0.357
MAR-TRE-6a44bbf2-87
0.357
DRR-IMP-38dce17f-3
0.357
SAD-SAT-6b5a89f0-9
0.357
KAT-UNK-c8a6cb16-1
0.356
MAK-UNK-704ed37c-2
0.356
MAK-UNK-4b073b5c-15
0.353
MAK-UNK-704ed37c-17
0.350
VIR-GIT-7b3d3065-3
0.349
AAR-POS-0daf6b7e-19
0.349
MAT-POS-162a9720-4
0.349
MAR-TRE-6a44bbf2-56
0.349
SAD-SAT-5b1897b2-6
0.349
MAK-UNK-7c9d1431-29
0.349
DRR-IMP-db50bf6e-3
0.349
SAD-SAT-1b030f84-4
0.348
AAR-POS-d2a4d1df-41
0.346
TAT-ENA-80bfd3e5-20
0.346
BEN-DND-03406596-8
0.346
MAK-UNK-f983951f-27
0.342
MAK-UNK-6ca90168-20
0.341
MAK-UNK-52a1ef4b-2
0.341
MAK-UNK-704ed37c-1
0.341
SWA-SYN-d2e6fa14-5
0.341
SAD-SAT-3a925b8b-4
0.341
SAD-SAT-3a925b8b-5
0.341
DRR-IMP-38dce17f-6
0.341
PAU-UNI-8cdd41c7-1
0.341
SIM-SYN-f15aaa3a-1
0.341
AAR-POS-d2a4d1df-29
0.341
AHN-SAT-de2502ba-8
0.341
MAR-TRE-6a44bbf2-61
0.341
MAK-UNK-52a1ef4b-3
0.341
DRR-IMP-db50bf6e-1
0.341
SWA-SYN-6423ea73-5
0.341
AAR-POS-d2a4d1df-25
0.341
BEN-DND-03406596-5
0.340