| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 46561PKP9T |
| EPA CompTox | DTXSID60177045 |
Structure
| InChI Key | VHBFEIBMZHEWSX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7N1S1 |
| Molecular Weight | 101.03 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.36 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2253-73-8 |
| NORMAN SUSDAT | |
| FDA SRS | 46561PKP9T |
| PubChem | 75263 |
| ChemSpider | 67806.0 |
CONTENTS
