Compound Detail
CHEMBL462236
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Basic Information
| ChEMBL ID | CHEMBL462236 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XBAVWVJRTJQHFI-KNQAVFIVSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
382.9
MW (Da)
5.01
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.74
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.9
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL2492 | EC50 | 6.9 | 6.9 | 125.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 125.89 | nM | 6.9 | Agonist activity at human recombinant alpha7 nAChR expressed in rat GH3 cells by... | 19208472 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19208472 | 10.1016/j.bmcl.2009.01.073 | Neuronal acetylcholine receptor subunit alpha-7 | 2 |
| 19208472 | 10.1016/j.bmcl.2009.01.073 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine