Compound Detail
CHEMBL3414845
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Basic Information
| ChEMBL ID | CHEMBL3414845 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | WWFWXCONORSQAA-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
1
Publications
0
Known Names
Molecular Properties
329.5
MW (Da)
4.33
ALogP
3
HBA
1
HBD
41.0
PSA (Ų)
0.73
QED
0
Ro5 Violations
8
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 6.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 CHEMBL216 | EC50 | 6.27 | 6.27 | 537.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| T1/2 | 0.1483 | hr | Homo sapiens |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Muscarinic acetylcholine receptor M1 | EC50 | = | 537.03 | nM | 6.27 | Partial agonist activity at human muscarinic M1 acetylcholine receptor expressed... | 25478907 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 25478907 | 10.1021/jm500860w | Muscarinic acetylcholine receptor M1 | 8 |
Data from ChEMBL 36 via Core Engine