| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID3069304 |
Structure
| InChI Key | RVAGIRWUMWXFKJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H10N2O1S1 |
| Molecular Weight | 206.05 |
| AlogP | 2.5 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 38.92 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 59021-05-5 |
| NORMAN SUSDAT | |
| PubChem | 100931 |
| ChemSpider | 91191.0 |
CONTENTS
