Compound Detail
CHEMBL275416
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Basic Information
| ChEMBL ID | CHEMBL275416 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LLYOYAXAZDHDBE-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
506.8
MW (Da)
5.28
ALogP
6
HBA
1
HBD
72.3
PSA (Ų)
0.51
QED
2
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 6.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 1 CHEMBL218 | Ki | 6.57 | 6.57 | 270.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 1 | Ki | = | 270.0 | nM | 6.57 | Evaluated for binding affinity towards human Cannabinoid receptor 1 | 14980654 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 14980654 | 10.1016/j.bmcl.2003.12.068 | Cannabinoid receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine