Compound Detail
CHEMBL477642
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL477642 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OTEXJGPPDFKPIG-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
474.8
MW (Da)
5.50
ALogP
5
HBA
1
HBD
74.0
PSA (Ų)
0.54
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.62
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 1 CHEMBL218 | Ki | 7.62 | 7.62 | 24.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 1 | Ki | = | 24.0 | nM | 7.62 | Displacement of [3H]CP-55940 form human recombinant CB1 receptor expressed in HE... | 18511157 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18511157 | 10.1016/j.ejmech.2008.03.040 | No relevant target | 1 |
| 18511157 | 10.1016/j.ejmech.2008.03.040 | Cannabinoid receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine