| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9070826 |
| InChI Key | CRGIYPZDEQHQFH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H16F15N1O4S1 |
| Molecular Weight | 603.06 |
| AlogP | 5.48 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 13.0 |
| Polar Surface Area | 63.68 |
| Heavy Atoms | 37.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67906-38-1 |
| NORMAN SUSDAT | |
| PubChem | 106084 |
| ChemSpider | 95569.0 |