Compound Detail
CHEMBL1788286
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 | CHEMBL1788286 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DAIWBMZPSVQRCH-LJQANCHMSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
335.4
MW (Da)
3.56
ALogP
4
HBA
0
HBD
38.8
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 8.29
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL2672 | Ki | 8.29 | 8.29 | 5.2 | 1 |
| Muscarinic acetylcholine receptor M1 CHEMBL276 | Ki | 7.57 | 7.57 | 27.0 | 1 |
| Muscarinic acetylcholine receptor M2 CHEMBL309 | Ki | 7.13 | 6.455 | 74.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 5.16 | nM | 8.29 | Binding affinity against Muscarinic acetylcholine receptor M1 by displacement of... | 3385735 |
| Muscarinic acetylcholine receptor M1 | Ki | = | 27.0 | nM | 7.57 | Evaluated for the phosphatidyl inositol turnover at Muscarinic acetylcholine rec... | 3385735 |
| Muscarinic acetylcholine receptor M2 | Ki | = | 74.0 | nM | 7.13 | Binding affinity against Muscarinic acetylcholine receptor M2 by displacement of... | 3385735 |
| Muscarinic acetylcholine receptor M2 | Ki | = | 1660.0 | nM | 5.78 | Evaluated for the inhibition of adenylate cyclase at M2 receptor in rat heart | 3385735 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3385735 | 10.1021/jm00402a035 | Muscarinic acetylcholine receptor M1 | 3 |
| 3385735 | 10.1021/jm00402a035 | Muscarinic acetylcholine receptor M2 | 3 |
| 3385735 | 10.1021/jm00402a035 | Muscarinic acetylcholine receptors; M1 & M2 | 1 |
| 3385735 | 10.1021/jm00402a035 | Muscarinic receptor M1 and M2 | 1 |
Data from ChEMBL 36 via Core Engine