| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4U6DG183QZ |
| EPA CompTox | DTXSID10166242 |
Structure
| InChI Key | PATFUZGQWONVOC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H11N1S1 |
| Molecular Weight | 141.06 |
| AlogP | 2.27 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 15729-76-7 |
| NORMAN SUSDAT | |
| FDA SRS | 4U6DG183QZ |
| PubChem | 85073 |
| ChemSpider | 76737.0 |
CONTENTS
