| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | A39HVU28BD |
| EPA CompTox | DTXSID5042118 |
| InChI Key | PUTUPQVEMBRCAG-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H14N1O4P1S2 |
| Molecular Weight | 271.01 |
| AlogP | 1.53 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 55.84 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 29173-31-7 |
| NORMAN SUSDAT | |
| FDA SRS | A39HVU28BD |
| ChemSpider | 31737.0 |