Compound Detail
CHEMBL160541
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Basic Information
| ChEMBL ID | CHEMBL160541 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WIEJREPGMVWDKC-QECFJDBTSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
314.8
MW (Da)
3.35
ALogP
3
HBA
0
HBD
24.8
PSA (Ų)
0.49
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 7.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor CHEMBL1907609 | IC50 | 7.57 | 6.965 | 27.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor | IC50 | = | 27.12 | nM | 7.57 | Binding affinity against muscarinic receptor using radioligand [3H]cis-methyldio... | - |
| Muscarinic acetylcholine receptor | IC50 | = | 439.0 | nM | 6.36 | Binding affinity against muscarinic receptor using radioligand [3H]quinuclidinyl... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| - | 10.1016/0960-894X(95)00087-A | Muscarinic acetylcholine receptor | 3 |
Data from ChEMBL 36 via Core Engine