Compound Detail
CHEMBL133680
Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL133680 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | RQAOVOFARPHOBF-UHFFFAOYSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
221.3
MW (Da)
1.19
ALogP
5
HBA
0
HBD
46.8
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 6.57
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL276 | Ki | 6.57 | 6.57 | 270.0 | 1 |
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 6.52 | 6.52 | 300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 270.0 | nM | 6.57 | In vitro binding affinity for muscarinic M1 receptor by displacing [3H]pirenzepi... | 7990109 |
| Muscarinic acetylcholine receptor | Ki | = | 300.0 | nM | 6.52 | In vitro binding affinity for muscarinic receptor by displacing [3H]oxotremorine... | 7990109 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 7990109 | 10.1021/jm00050a006 | Muscarinic acetylcholine receptor | 3 |
| 7990109 | 10.1021/jm00050a006 | Muscarinic acetylcholine receptor M1 | 1 |
Data from ChEMBL 36 via Core Engine