Compound Detail
CHEMBL354476
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Basic Information
| ChEMBL ID | CHEMBL354476 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZLXNNXGRPXLRSC-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
381.3
MW (Da)
4.18
ALogP
4
HBA
1
HBD
50.2
PSA (Ų)
0.86
QED
0
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.74
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 1 CHEMBL3571 | Ki | 6.74 | 6.74 | 183.0 | 1 |
| Cannabinoid receptor 2 CHEMBL5373 | Ki | 6.13 | 6.13 | 744.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 1 | Ki | = | 183.0 | nM | 6.74 | Binding affinity against Cannabinoid receptor 1 in rat forebrain | 10052983 |
| Cannabinoid receptor 2 | Ki | = | 744.0 | nM | 6.13 | Binding affinity against Cannabinoid receptor 2 in mouse spleen | 10052983 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10052983 | 10.1021/jm980363y | Cannabinoid receptor 1 | 1 |
| 10052983 | 10.1021/jm980363y | Cannabinoid receptor 2 | 1 |
| 10052983 | 10.1021/jm980363y | Cannabinoid receptor | 1 |
Data from ChEMBL 36 via Core Engine