| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | H1JNO61WBQ |
| EPA CompTox | DTXSID40194795 |
| InChI Key | VCGGTZJUUXVOOJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H13N1S1 |
| Molecular Weight | 155.08 |
| AlogP | 2.71 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 41981-72-0 |
| NORMAN SUSDAT | |
| FDA SRS | H1JNO61WBQ |
| PubChem | 521080 |
| ChemSpider | 454518.0 |