| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | P0X95DWC8T |
| EPA CompTox | DTXSID6047157 |
| InChI Key | GFRRQSASJZMMJC-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H18O2S1 |
| Molecular Weight | 226.1 |
| AlogP | 3.83 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 30.21 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 61295-41-8 |
| NORMAN SUSDAT | |
| FDA SRS | P0X95DWC8T |
| ChemSpider | 39738.0 |