| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4QGO9S8DSC |
| EPA CompTox | DTXSID0027561 |
| InChI Key | MYWWWNVEZBAKHR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H14O4S1 |
| Molecular Weight | 206.06 |
| AlogP | 0.85 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 4131-74-2 |
| NORMAN SUSDAT | |
| FDA SRS | 4QGO9S8DSC |
| PubChem | 77781 |
| ChemSpider | 70178.0 |