Compound Detail
CHEMBL266712
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Basic Information
| ChEMBL ID | CHEMBL266712 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ZAIKPEWFCSQNQB-UHFFFAOYSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names
Molecular Properties
368.5
MW (Da)
5.91
ALogP
4
HBA
1
HBD
59.7
PSA (Ų)
0.32
QED
1
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 3 meas. best 8.17
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 2 CHEMBL253 | Ki | 8.17 | 8.17 | 6.7 | 1 |
| Cannabinoid receptor 2 CHEMBL5373 | Ki | 8.17 | 8.17 | 6.7 | 1 |
| Cannabinoid receptor 1 CHEMBL3571 | Ki | 6.44 | 6.44 | 360.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 2 | Ki | = | 6.7 | nM | 8.17 | Displacement of [3H]CP-55940 from CB2 receptor in mouse spleen membranes | 18038967 |
| Cannabinoid receptor 2 | Ki | = | 6.7 | nM | 8.17 | Binding affinity to CB2 (unknown origin) | 27494166 |
| Cannabinoid receptor 1 | Ki | = | 360.0 | nM | 6.44 | Displacement of [3H]CP-55940 from CB1 receptor in rat brain synaptosomes | 18038967 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18038967 | 10.1021/jm070441u | Cannabinoid receptor 2 | 3 |
| 18038967 | 10.1021/jm070441u | Cannabinoid receptor 1 | 1 |
| 18038967 | 10.1021/jm070441u | Unchecked | 1 |
| 18038967 | 10.1021/jm070441u | Rattus norvegicus | 1 |
| 27494166 | 10.1016/j.ejmech.2016.07.057 | Cannabinoid receptor 2 | 1 |
Data from ChEMBL 36 via Core Engine