| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NE63ZPE4R7 |
| EPA CompTox | DTXSID00195824 |
Structure
| InChI Key | UQSMMTFBNJUPGW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H11Cl1S1 |
| Molecular Weight | 186.03 |
| AlogP | 3.16 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4332-51-8 |
| NORMAN SUSDAT | |
| FDA SRS | NE63ZPE4R7 |
| PubChem | 78036 |
| ChemSpider | 70417.0 |
CONTENTS
