| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | SXR7D2V9JP |
| EPA CompTox | DTXSID70179575 |
| InChI Key | OKOZRTTWERNRQS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H13N1S1 |
| Molecular Weight | 251.08 |
| AlogP | 4.79 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 24864-19-5 |
| NORMAN SUSDAT | |
| FDA SRS | SXR7D2V9JP |
| PubChem | 90635 |
| ChemSpider | 81644.0 |