Compound Detail
CHEMBL140576
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Basic Information
| ChEMBL ID | CHEMBL140576 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PYIXVGYEKZNJFJ-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
343.4
MW (Da)
2.51
ALogP
4
HBA
1
HBD
49.8
PSA (Ų)
0.82
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 8.07 | 8.07 | 8.4 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | Ki | = | 8.43 | nM | 8.07 | In vitro for binding affinity for muscarinic acetylcholine receptors in homogeni... | 11087580 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 11087580 | 10.1021/jm000305o | Muscarinic acetylcholine receptor | 1 |
| 11087580 | 10.1021/jm000305o | No relevant target | 1 |
Data from ChEMBL 36 via Core Engine