| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 48XI86F84W |
| EPA CompTox | DTXSID4042250 |
Structure
| InChI Key | JAYZFNIOOYPIAH-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17O4P1S2 |
| Molecular Weight | 260.03 |
| AlogP | 2.28 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 52.6 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2674-91-1 |
| NORMAN SUSDAT | |
| FDA SRS | 48XI86F84W |
| ChemSpider | 82644.0 |
CONTENTS
