Compound Detail
CHEMBL132331
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Basic Information
| ChEMBL ID | CHEMBL132331 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YWJMWMMNEQFTQG-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
205.3
MW (Da)
1.20
ALogP
4
HBA
0
HBD
38.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL276 | IC50 | 6.08 | 6.075 | 840.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | IC50 | = | 840.0 | nM | 6.08 | In vitro binding affinity against rat hippocampus M1 receptor using [3H]pirenzep... | 1433209 |
| Muscarinic acetylcholine receptor M1 | IC50 | = | 850.0 | nM | 6.07 | In vitro binding affinity against rat hippocampus M1 receptor using [3H]oxotremo... | 1433209 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 1433209 | 10.1021/jm00100a005 | Muscarinic acetylcholine receptor M1 | 2 |
| 1433209 | 10.1021/jm00100a005 | Oryctolagus cuniculus | 1 |
Data from ChEMBL 36 via Core Engine