Compound Detail
CHEMBL597644
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Basic Information
| ChEMBL ID | CHEMBL597644 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | VGGIXTMKNTVMSP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
322.2
MW (Da)
2.87
ALogP
4
HBA
0
HBD
32.5
PSA (Ų)
0.81
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.67
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 CHEMBL4980 | Ki | 8.67 | 8.67 | 2.1 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Neuronal acetylcholine receptor subunit alpha-7 | Ki | = | 2.15 | nM | 8.67 | Displacement of [125I]BTX from rat alpha7 nicotinic acetylcholine receptor expre... | 20043678 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20043678 | 10.1021/jm9015075 | Neuronal acetylcholine receptor subunit alpha-7 | 2 |
| 20043678 | 10.1021/jm9015075 | 5-hydroxytryptamine receptor 3A | 1 |
Data from ChEMBL 36 via Core Engine