| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4M216HR018 |
| EPA CompTox | DTXSID00953789 |
Structure
| InChI Key | XPQULTFBJPGINB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9NS |
| Molecular Weight | 127.05 |
| AlogP | 2.01 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 12.89 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 31883-01-9 |
| NORMAN SUSDAT | |
| FDA SRS | 4M216HR018 |
| PubChem | 40380 |
CONTENTS
