| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TYK6V68AZZ |
| EPA CompTox | DTXSID40201458 |
Structure
| InChI Key | ARRJJHJQSNPJFV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H14O1S1 |
| Molecular Weight | 134.08 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5331-37-3 |
| NORMAN SUSDAT | |
| FDA SRS | TYK6V68AZZ |
| PubChem | 79241 |
| ChemSpider | 71566.0 |
CONTENTS
