Compound Detail
CHEMBL5208202
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Basic Information
| ChEMBL ID | CHEMBL5208202 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BOMVPNICAUUHMI-ZAGWXBKKSA-M |
| Parent Compound | CHEMBL5222856 |
| Active Moiety | CHEMBL5222856 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
418.6
MW (Da)
7.35
ALogP
1
HBA
0
HBD
9.2
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 4.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL2492 | Ki | 4.3 | 4.3 | 50000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | Ki | = | 50000.0 | nM | 4.3 | Displacement of [125I]alpha-bungarotoxin from human alpha7 nAChR expressed in SH... | 35834819 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35834819 | 10.1021/acs.jmedchem.2c00746 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
Data from ChEMBL 36 via Core Engine