Compound Detail
CHEMBL608698
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Basic Information
| ChEMBL ID | CHEMBL608698 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YULLQQIZDNODNZ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
347.4
MW (Da)
3.56
ALogP
5
HBA
0
HBD
47.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 2 meas. best 6.2
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | EC50 | 6.2 | 6.2 | 631.0 | 1 |
| Cannabinoid receptor 1 CHEMBL218 | EC50 | 5.4 | 5.4 | 3981.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | EC50 | = | 630.96 | nM | 6.2 | Agonist activity at human CB2 receptor | 20005703 |
| Cannabinoid receptor 1 | EC50 | = | 3981.07 | nM | 5.4 | Agonist activity at human CB1 receptor | 20005703 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20005703 | 10.1016/j.bmcl.2009.11.117 | Cannabinoid receptor 2 | 2 |
| 20005703 | 10.1016/j.bmcl.2009.11.117 | Cannabinoid receptor 1 | 2 |
Data from ChEMBL 36 via Core Engine