| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID40457130 |
| InChI Key | QGVHMBIQPGFCFW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H8F17N1O2 |
| Molecular Weight | 557.03 |
| AlogP | 5.7 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 10.0 |
| Polar Surface Area | 37.38 |
| Heavy Atoms | 35.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 852527-40-3 |
| NORMAN SUSDAT | |
| PubChem | 11157197 |
| ChemSpider | 9332305.0 |