| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60151047 |
| InChI Key | AIHIHVZYAAMDPM-MRVPVSSYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N1O6S1 |
| Molecular Weight | 259.02 |
| AlogP | 0.7 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 99.04 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 115314-17-5 |
| NORMAN SUSDAT | |
| PubChem | 146513 |
| ChemSpider | 129210.0 |