Compound Detail
CHEMBL409280
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Basic Information
| ChEMBL ID | CHEMBL409280 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | FKUNFLFZVYVRKQ-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
241.3
MW (Da)
1.02
ALogP
6
HBA
0
HBD
47.5
PSA (Ų)
0.79
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 6.81
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL276 | IC50 | 6.81 | 6.755 | 155.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | IC50 | = | 155.0 | nM | 6.81 | Binding affinity for muscarinic acetylcholine receptor M1 using [3H]pirenzepine ... | 9464368 |
| Muscarinic acetylcholine receptor M1 | IC50 | = | 201.0 | nM | 6.7 | Binding affinity for muscarinic acetylcholine receptor M1 using [3H]oxotremorine... | 9464368 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9464368 | 10.1021/jm970125n | Muscarinic acetylcholine receptor M1 | 4 |
| 9464368 | 10.1021/jm970125n | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine