| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6SMO0I83KL |
| EPA CompTox | DTXSID6069165 |
| InChI Key | FOBITDGBIATDTQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H13N1S1 |
| Molecular Weight | 155.08 |
| AlogP | 2.79 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 57246-60-3 |
| NORMAN SUSDAT | |
| FDA SRS | 6SMO0I83KL |
| PubChem | 93596 |
| ChemSpider | 84490.0 |