| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | LW65NJ3YWV |
| EPA CompTox | DTXSID5020310 |
Structure
| InChI Key | RZXLPPRPEOUENN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H8Cl2O3S1 |
| Molecular Weight | 301.96 |
| AlogP | 3.76 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 80-33-1 |
| NORMAN SUSDAT | |
| FDA SRS | LW65NJ3YWV |
| PubChem | 6635 |
| ChemSpider | 6383.0 |
CONTENTS
