Compound Detail
CHEMBL1822940
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 | CHEMBL1822940 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PEAAKWGEQGHNHJ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
398.4
MW (Da)
3.44
ALogP
4
HBA
2
HBD
80.4
PSA (Ų)
0.61
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 10.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | Ki | 10.68 | 10.68 | 0.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 0.021 | nM | 10.68 | Binding affinity to CB2 receptor | 21872477 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21872477 | 10.1016/j.bmc.2011.07.062 | Cannabinoid receptor 1 | 1 |
| 21872477 | 10.1016/j.bmc.2011.07.062 | Cannabinoid receptor 2 | 1 |
| 21872477 | 10.1016/j.bmc.2011.07.062 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine