Compound Detail
CHEMBL141452
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Basic Information
| ChEMBL ID | CHEMBL141452 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RYMPNGRNVBLMDN-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
504.7
MW (Da)
4.63
ALogP
10
HBA
0
HBD
76.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
13
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 9.72
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | Ki | 9.72 | 9.72 | 0.2 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 0.19 | nM | 9.72 | Binding affinity towards M1 muscarinic receptor expressed in A9 L cells by displ... | 11741475 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11741475 | 10.1021/jm0102405 | Muscarinic acetylcholine receptor M1 | 2 |
| 11741475 | 10.1021/jm0102405 | Muscarinic acetylcholine receptor M4 | 1 |
| 11741475 | 10.1021/jm0102405 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine