| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9B8VDQ6JKZ |
| EPA CompTox | DTXSID90162207 |
| InChI Key | QYESFCLSVSNRTN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N1O6S1 |
| Molecular Weight | 259.02 |
| AlogP | 1.78 |
| Hydrogen Bond Acceptor | 7.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 95.74 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 14289-24-8 |
| NORMAN SUSDAT | |
| FDA SRS | 9B8VDQ6JKZ |
| PubChem | 84327 |
| ChemSpider | 76070.0 |