| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60179968 |
Structure
| InChI Key | DGQXIDAJSBKRMJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C15H13N1O1S1 |
| Molecular Weight | 255.07 |
| AlogP | 4.12 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 25324-52-1 |
| NORMAN SUSDAT | |
| PubChem | 91401 |
| ChemSpider | 82533.0 |
CONTENTS
