| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID1071953 |
| InChI Key | PUQQCLQURHMROM-ZHACJKMWSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C19H13F19N1O7P1S1 |
| Molecular Weight | 790.98 |
| AlogP | 7.12 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 113.37 |
| Heavy Atoms | 48.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 69013-34-9 |
| NORMAN SUSDAT | |
| PubChem | 3034923 |
| ChemSpider | 2299288.0 |