Compound Detail
CHEMBL471247
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 | CHEMBL471247 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XJSXZFXFKVCTQS-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
266.3
MW (Da)
3.39
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 1 CHEMBL3571 | Ki | 4.72 | 4.72 | 19100.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 1 | Ki | = | 19100.0 | nM | 4.72 | Displacement of [3H]CP-55940 from cannabinoid CB1 receptor in rat brain cortical... | 19278853 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23679955 | 10.1021/jm4005175 | G-protein coupled receptor 55 | 3 |
| 19278853 | 10.1016/j.bmc.2009.02.027 | Cannabinoid receptor 2 | 2 |
| 19278853 | 10.1016/j.bmc.2009.02.027 | Cannabinoid receptor 1 | 1 |
Data from ChEMBL 36 via Core Engine