Compound Detail
CHEMBL343242
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Basic Information
| ChEMBL ID | CHEMBL343242 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BPKMMXKNCOJMOQ-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
209.3
MW (Da)
1.66
ALogP
3
HBA
1
HBD
23.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.04
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | Ki | 5.04 | 5.04 | 9200.0 | 1 |
| Muscarinic acetylcholine receptor M3 CHEMBL5498 | Ki | 4.43 | 4.43 | 37000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 9200.0 | nM | 5.04 | Binding affinity for muscarinic acetylcholine receptor M1 by measuring displacem... | 7853341 |
| Muscarinic acetylcholine receptor M3 | Ki | = | 37000.0 | nM | 4.43 | Binding affinity for muscarinic acetylcholine receptor M3 by measuring displacem... | 7853341 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7853341 | 10.1021/jm00003a011 | Muscarinic acetylcholine receptor | 2 |
| 7853341 | 10.1021/jm00003a011 | Muscarinic acetylcholine receptor M1 | 1 |
| 7853341 | 10.1021/jm00003a011 | Muscarinic acetylcholine receptor M2 | 1 |
| 7853341 | 10.1021/jm00003a011 | Muscarinic acetylcholine receptor M3 | 1 |
Data from ChEMBL 36 via Core Engine