Compound Detail
CHEMBL1243043
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Basic Information
| ChEMBL ID | CHEMBL1243043 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CCRMFAIAQJFSMP-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
423.5
MW (Da)
3.32
ALogP
3
HBA
1
HBD
52.6
PSA (Ų)
0.74
QED
0
Ro5 Violations
7
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 7.31
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | EC50 | 7.31 | 7.31 | 49.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | EC50 | = | 49.0 | nM | 7.31 | Agonist activity at human muscarinic M1 receptor expressed in CHO-K1 cells asses... | 20684563 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20684563 | 10.1021/jm100697g | Muscarinic acetylcholine receptor M1 | 2 |
Data from ChEMBL 36 via Core Engine