| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID2067953 |
| InChI Key | GQYDZBRCPSLDOG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H17N1O1S1 |
| Molecular Weight | 331.1 |
| AlogP | 5.5 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 24.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 35976-48-8 |
| NORMAN SUSDAT | |
| PubChem | 118902 |
| ChemSpider | 106247.0 |