| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | EOK1SAC304 |
| EPA CompTox | DTXSID8060082 |
Structure
| InChI Key | YRHRIQCWCFGUEQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H8O1S1 |
| Molecular Weight | 212.03 |
| AlogP | 3.41 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 492-22-8 |
| NORMAN SUSDAT | |
| FDA SRS | EOK1SAC304 |
| PubChem | 10295 |
| ChemSpider | 9873.0 |
CONTENTS
