| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8AUU7WNS4S |
| EPA CompTox | DTXSID10163216 |
| InChI Key | NIPXPORFFVCBNP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H6O4S2 |
| Molecular Weight | 253.97 |
| AlogP | 2.74 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 16.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 14596-82-8 |
| NORMAN SUSDAT | |
| FDA SRS | 8AUU7WNS4S |
| PubChem | 84548 |
| ChemSpider | 76271.0 |