| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | I3AKK727FU |
| EPA CompTox | DTXSID60203414 |
| InChI Key | OGUWOLDNYOTRBO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N1S1 |
| Molecular Weight | 139.05 |
| AlogP | 1.39 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 12.03 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 54903-50-3 |
| NORMAN SUSDAT | |
| FDA SRS | I3AKK727FU |
| PubChem | 3085076 |
| ChemSpider | 2037271.0 |