Compound Detail
CHEMBL190961
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Basic Information
| ChEMBL ID | CHEMBL190961 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | OALSRRFAECYMBO-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
256.3
MW (Da)
2.94
ALogP
2
HBA
1
HBD
46.5
PSA (Ų)
0.86
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Gamma-hydroxybutyrate receptor CHEMBL3558 | IC50 | 5.08 | 5.08 | 8300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Gamma-hydroxybutyrate receptor | IC50 | = | 8300.0 | nM | 5.08 | Displacement of [3H]NCS-382 (16 nM) from GHB receptor of rat cerebrocortical mem... | 15927467 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15927467 | 10.1016/j.bmcl.2005.05.011 | Gamma-hydroxybutyrate receptor | 1 |
| 15927467 | 10.1016/j.bmcl.2005.05.011 | GABA-A receptor; anion channel | 1 |
| 15927467 | 10.1016/j.bmcl.2005.05.011 | GABA B receptor | 1 |
Data from ChEMBL 36 via Core Engine