| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | W0F51T4V09 |
| EPA CompTox | DTXSID70176463 |
Structure
| InChI Key | QNLREUZIHJHXRK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H14O2S1 |
| Molecular Weight | 162.07 |
| AlogP | 1.69 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 22014-48-8 |
| NORMAN SUSDAT | |
| FDA SRS | W0F51T4V09 |
| PubChem | 5463935 |
| ChemSpider | 4576449.0 |
CONTENTS
