Compound Detail
CHEMBL2022937
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Basic Information
| ChEMBL ID | CHEMBL2022937 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNVXTPUNOIQFKN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
397.4
MW (Da)
3.93
ALogP
6
HBA
3
HBD
92.1
PSA (Ų)
0.47
QED
0
Ro5 Violations
9
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.3
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL2492 | EC50 | 5.3 | 5.3 | 5011.9 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | EC50 | = | 5011.87 | nM | 5.3 | Agonist activity at human alpha7 nAChR expressed in GH4C1 cells by FLIPR assay | 22503248 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 22503248 | 10.1016/j.bmcl.2012.03.040 | Neuronal acetylcholine receptor subunit alpha-7 | 1 |
Data from ChEMBL 36 via Core Engine