| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID70206431 |
| InChI Key | SCSLYXQZQWKMEW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C11H15N1O6S1 |
| Molecular Weight | 289.06 |
| AlogP | 0.4 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 90.93 |
| Heavy Atoms | 19.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 57734-48-2 |
| NORMAN SUSDAT | |
| PubChem | 93784 |
| ChemSpider | 84650.0 |