| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 90LN6Y7I7H |
| EPA CompTox | DTXSID6024337 |
Structure
| InChI Key | QHTQREMOGMZHJV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H16Cl1N1O1S1 |
| Molecular Weight | 257.06 |
| AlogP | 4.04 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 20.31 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 28249-77-6 |
| NORMAN SUSDAT | |
| FDA SRS | 90LN6Y7I7H |
| PubChem | 34192 |
| ChemSpider | 31512.0 |
CONTENTS
