| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1963) |
| Entry Type: | Small molecule |
| Molecule Category: | Salt |
| UNII: | Y9DL7QPE6B |
| Parent Compound: | PSEUDOEPHEDRINE |
| InChI Key | CAVQBDOACNULDN-NRCOEFLKSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C20H32N2O6S |
| Molecular Weight | 428.55 |
| AlogP | 1.33 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 32.26 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 12.0 |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Rhinitis, Allergic, Seasonal | 4 | D006255 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL3989855 |
| EPA CompTox | DTXSID20889379 |
| FDA SRS | Y9DL7QPE6B |
| PubChem | 9802673 |
| SureChEMBL | SCHEMBL41308 |