| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0068159 |
| InChI Key | KKDLWQFJOGDMBI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9N1O1S2 |
| Molecular Weight | 175.01 |
| AlogP | 1.26 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 39123-31-4 |
| NORMAN SUSDAT | |
| PubChem | 170162 |
| ChemSpider | 148786.0 |