Compound Detail
CHEMBL568007
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Basic Information
| ChEMBL ID | CHEMBL568007 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XBXLBWDKYSNLTB-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
473.8
MW (Da)
7.81
ALogP
4
HBA
0
HBD
35.6
PSA (Ų)
0.30
QED
1
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 7.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Cannabinoid receptor 1 CHEMBL3571 | Ki | 7.42 | 7.42 | 38.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Cannabinoid receptor 1 | Ki | = | 38.0 | nM | 7.42 | Displacement of [3H]SR141716A from rat brain CB1 receptor | 19683918 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19683918 | 10.1016/j.bmcl.2009.07.130 | Cannabinoid receptor 1 | 2 |
| 19683918 | 10.1016/j.bmcl.2009.07.130 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine