Compound Detail
CHEMBL553322
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Basic Information
| ChEMBL ID | CHEMBL553322 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QOUPYPDQPYZVJW-UHFFFAOYSA-N |
| Parent Compound | CHEMBL1194804 |
| Active Moiety | CHEMBL1194804 |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
171.2
MW (Da)
0.23
ALogP
3
HBA
1
HBD
32.7
PSA (Ų)
0.57
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 5.07
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 5.07 | 5.07 | 8540.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 8540.0 | nM | 5.07 | Binding affinity against muscarinic acetylcholine receptor from rat brain crude ... | 7739014 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7739014 | 10.1021/jm00009a016 | Muscarinic acetylcholine receptor | 2 |
| 7739014 | 10.1021/jm00009a016 | Rattus norvegicus | 1 |
| 7739014 | 10.1021/jm00009a016 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine