| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BIQ5M88OLZ |
| EPA CompTox | DTXSID10201480 |
Structure
| InChI Key | YXHIINNJOGKPLF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H10O1S1 |
| Molecular Weight | 154.05 |
| AlogP | 2.73 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5333-83-5 |
| NORMAN SUSDAT | |
| FDA SRS | BIQ5M88OLZ |
| PubChem | 79248 |
| ChemSpider | 71573.0 |
CONTENTS
