| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | D0NR12WK9J |
| EPA CompTox | DTXSID7046257 |
Structure
| InChI Key | QFVAWNPSRQWSDU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H18N2S2 |
| Molecular Weight | 314.09 |
| AlogP | 3.94 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 6.48 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 350-12-9 |
| NORMAN SUSDAT | |
| FDA SRS | D0NR12WK9J |
| PubChem | 67686 |
| ChemSpider | 61005.0 |
CONTENTS
