| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A498ZC6Z4F |
| EPA CompTox | DTXSID10207846 |
| InChI Key | NSDDRJXKROCWRZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H9N1S1 |
| Molecular Weight | 115.05 |
| AlogP | 1.75 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 12.36 |
| Heavy Atoms | 7.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 591-82-2 |
| NORMAN SUSDAT | |
| FDA SRS | A498ZC6Z4F |
| PubChem | 68960 |
| ChemSpider | 62183.0 |