| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1989) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | 33XCH0HOCD |
| Parent Compound: | PROPAFENONE |
| InChI Key | XWIHRGFIPXWGEF-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H28ClNO3 |
| Molecular Weight | 377.91 |
| AlogP | 3.24 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 58.56 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 25.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| ANTAGONIST | Beta-1 adrenergic receptor antagonist | DailyMed |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 105 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Heart Failure | 3 | D006333 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEBI | 8466 |
| ChEMBL | CHEMBL1201063 |
| FDA SRS | 33XCH0HOCD |
| Guide to Pharmacology | 2561 |
| KEGG | C07381 |
| PubChem | 36708 |
| SureChEMBL | SCHEMBL41412 |
| ZINC | ZINC01530760 |