Compound Detail
CHEMBL2387532
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 | CHEMBL2387532 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CMVXSXQKCIEASR-UHFFFAOYSA-N |
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
415.3
MW (Da)
5.89
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.36
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.24
IC50 1 meas. best 5.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | Ki | 6.24 | 6.24 | 578.0 | 1 |
| G-protein coupled receptor 55 CHEMBL1075322 | IC50 | 5.42 | 5.42 | 3760.0 | 1 |
| Cannabinoid receptor 1 CHEMBL218 | Ki | 4.99 | 4.99 | 10200.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 578.0 | nM | 6.24 | Displacement of [3H]-CP55,940 from human CB2 receptor transfected in CHOK1 cells | 23679955 |
| G-protein coupled receptor 55 | IC50 | = | 3760.0 | nM | 5.42 | Antagonist activity at human GPR55 transfected in CHO cells assessed as inhibiti... | 23679955 |
| Cannabinoid receptor 1 | Ki | = | 10200.0 | nM | 4.99 | Displacement of [3H]-CP55,940 from human CB1 receptor transfected in CHOK1 cells | 23679955 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 23679955 | 10.1021/jm4005175 | Cannabinoid receptor 2 | 2 |
| 23679955 | 10.1021/jm4005175 | Cannabinoid receptor 1 | 2 |
| 23679955 | 10.1021/jm4005175 | G-protein coupled receptor 55 | 2 |
| 23679955 | 10.1021/jm4005175 | N-arachidonyl glycine receptor | 2 |
Data from ChEMBL 36 via Core Engine