| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2VJ58GF47Z |
| EPA CompTox | DTXSID3072795 |
Structure
| InChI Key | NWSZEYNCLKNLMJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H16O2S |
| Molecular Weight | 176.09 |
| AlogP | 2.43 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 74758-91-1 |
| NORMAN SUSDAT | |
| FDA SRS | 2VJ58GF47Z |
| PubChem | 173312 |
CONTENTS
