| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | OM90ZUW7M1 |
| EPA CompTox | DTXSID5023669 |
Structure
| InChI Key | PHWBOXQYWZNQIN-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H14Cl1N1S1 |
| Molecular Weight | 263.05 |
| AlogP | 3.96 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 3.24 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 55142-85-3 |
| NORMAN SUSDAT | |
| FDA SRS | OM90ZUW7M1 |
| PubChem | 5472 |
| ChemSpider | 5273.0 |
CONTENTS
