Compound Detail
CHEMBL569760
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 | CHEMBL569760 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BEZNQWHLSZMASN-UHFFFAOYSA-M |
| Parent Compound | CHEMBL1197392 |
| Active Moiety | CHEMBL1197392 |
5
Targets
5
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names
Molecular Properties
354.5
MW (Da)
5.01
ALogP
2
HBA
1
HBD
33.4
PSA (Ų)
0.78
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 5 meas. best 8.68
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | Ki | 8.68 | 8.68 | 2.1 | 1 |
| Muscarinic acetylcholine receptor M3 CHEMBL245 | Ki | 8.14 | 8.14 | 7.2 | 1 |
| Muscarinic acetylcholine receptor M2 CHEMBL211 | Ki | 7.99 | 7.99 | 10.2 | 1 |
| Muscarinic acetylcholine receptor M5 CHEMBL2035 | Ki | 7.94 | 7.94 | 11.5 | 1 |
| Muscarinic acetylcholine receptor M4 CHEMBL1821 | Ki | 7.81 | 7.81 | 15.5 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | Ki | = | 2.089 | nM | 8.68 | Displacement of [3H]NMS from human cloned muscarinic M1 receptor expressed in CH... | 19928767 |
| Muscarinic acetylcholine receptor M3 | Ki | = | 7.244 | nM | 8.14 | Displacement of [3H]NMS from human cloned muscarinic M3 receptor expressed in CH... | 19928767 |
| Muscarinic acetylcholine receptor M2 | Ki | = | 10.23 | nM | 7.99 | Displacement of [3H]NMS from human cloned muscarinic M2 receptor expressed in CH... | 19928767 |
| Muscarinic acetylcholine receptor M5 | Ki | = | 11.48 | nM | 7.94 | Displacement of [3H]NMS from human cloned muscarinic M5 receptor expressed in CH... | 19928767 |
| Muscarinic acetylcholine receptor M4 | Ki | = | 15.49 | nM | 7.81 | Displacement of [3H]NMS from human cloned muscarinic M4 receptor expressed in CH... | 19928767 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19928767 | 10.1021/jm901048j | Muscarinic acetylcholine receptor M3 | 2 |
| 19928767 | 10.1021/jm901048j | Muscarinic acetylcholine receptor M1 | 1 |
| 19928767 | 10.1021/jm901048j | Muscarinic acetylcholine receptor M2 | 1 |
| 19928767 | 10.1021/jm901048j | Muscarinic acetylcholine receptor M4 | 1 |
| 19928767 | 10.1021/jm901048j | Muscarinic acetylcholine receptor M5 | 1 |
| 19928767 | 10.1021/jm901048j | Unchecked | 1 |
| 19928767 | 10.1021/jm901048j | Muscarinic receptor 2 | 1 |
| 19928767 | 10.1021/jm901048j | Muscarinic receptor 4 | 1 |
Data from ChEMBL 36 via Core Engine