Compound Detail
CHEMBL420268
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Basic Information
| ChEMBL ID | CHEMBL420268 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | XINSCWBHVQVKQT-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
234.3
MW (Da)
0.62
ALogP
3
HBA
0
HBD
40.6
PSA (Ų)
0.52
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Kd 2 meas. best 6.82
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL2094109 | Kd | 6.82 | 6.82 | 150.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | Kd | = | 150.0 | nM | 6.82 | Determination of dissociation constant from antimuscarinic activity on isolated ... | 1732545 |
| Muscarinic acetylcholine receptor | Kd | = | 150.0 | nM | 6.82 | Equilibrium dissociation constant muscarinic receptor complex, measured in guine... | 3346873 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1732545 | 10.1021/jm00080a013 | Muscarinic acetylcholine receptor | 1 |
| 1732545 | 10.1021/jm00080a013 | Mus musculus | 1 |
| 3346873 | 10.1021/jm00398a015 | Muscarinic acetylcholine receptor | 1 |
| 3346873 | 10.1021/jm00398a015 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine