| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20207135 |
| InChI Key | PDFGVCYGRLLUDE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17N1O5S1 |
| Molecular Weight | 227.08 |
| AlogP | -1.45 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 98.07 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 58431-91-7 |
| NORMAN SUSDAT | |
| PubChem | 94043 |
| ChemSpider | 5009.0 |