Compound Detail
CHEMBL1202956
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Basic Information
| ChEMBL ID | CHEMBL1202956 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | NHQLZEHQEDUFEL-UHFFFAOYSA-N |
| Parent Compound | CHEMBL105242 |
| Active Moiety | CHEMBL105242 |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
358.5
MW (Da)
2.00
ALogP
5
HBA
1
HBD
53.0
PSA (Ų)
0.82
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 5.08
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 5.08 | 5.08 | 8280.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | Ki | = | 8280.0 | nM | 5.08 | Displacement of [3H]QNB from rat ileum Muscarinic acetylcholine receptor | 2296026 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 2296026 | 10.1021/jm00163a050 | Muscarinic acetylcholine receptor | 1 |
| 2296026 | 10.1021/jm00163a050 | Cavia porcellus | 1 |
Data from ChEMBL 36 via Core Engine