| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80584838 |
| InChI Key | ONXVYKQEANDRAX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C29H19F17O1 |
| Molecular Weight | 706.12 |
| AlogP | 9.91 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 20.23 |
| Heavy Atoms | 47.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 649561-66-0 |
| NORMAN SUSDAT | |
| PubChem | 16218249 |
| ChemSpider | 17345685.0 |