Compound Detail
CHEMBL596289
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Basic Information
| ChEMBL ID | CHEMBL596289 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | LUHNHJZWUYWOMX-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
432.8
MW (Da)
5.03
ALogP
4
HBA
0
HBD
59.5
PSA (Ų)
0.43
QED
1
Ro5 Violations
4
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 5.32
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M5 CHEMBL2035 | EC50 | 5.32 | 5.32 | 4800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M5 | EC50 | = | 4800.0 | nM | 5.32 | Agonist activity at human muscarinic M5 expressed in CHO cells assessed as stimu... | 20004578 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20004578 | 10.1016/j.bmcl.2009.11.089 | Muscarinic acetylcholine receptor M5 | 2 |
| 20004578 | 10.1016/j.bmcl.2009.11.089 | Muscarinic acetylcholine receptor M1 | 1 |
| 20004578 | 10.1016/j.bmcl.2009.11.089 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine