Compound Detail
CHEMBL145976
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Basic Information
| ChEMBL ID | CHEMBL145976 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | KKVQAQZURYILKT-RMKNXTFCSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
178.2
MW (Da)
1.75
ALogP
3
HBA
1
HBD
38.1
PSA (Ų)
0.71
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 1 meas. best 5.16
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | IC50 | 5.16 | 5.16 | 6950.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | IC50 | = | 6950.0 | nM | 5.16 | In vitro displacement of [3H]oxotremorine-M from muscarinic acetylcholine recept... | 10585207 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10585207 | 10.1021/jm9910627 | Neuronal acetylcholine receptor | 1 |
| 10585207 | 10.1021/jm9910627 | Muscarinic acetylcholine receptor | 1 |
Data from ChEMBL 36 via Core Engine