| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YX8TAO9O90 |
| EPA CompTox | DTXSID5020156 |
| InChI Key | ABNDFSOIUFLJAH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H7N1S1 |
| Molecular Weight | 149.03 |
| AlogP | 2.4 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3012-37-1 |
| NORMAN SUSDAT | |
| FDA SRS | YX8TAO9O90 |
| PubChem | 18170 |
| ChemSpider | 17163.0 |