| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 07H7L3RT69 |
| EPA CompTox | DTXSID5052468 |
| InChI Key | MKQSWTQPLLCSOB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H7Cl1F3N1O2S1 |
| Molecular Weight | 320.98 |
| AlogP | 4.17 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 39.19 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 72850-64-7 |
| NORMAN SUSDAT | |
| FDA SRS | 07H7L3RT69 |
| PubChem | 91715 |
| ChemSpider | 82815.0 |