| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID30880599 |
| InChI Key | WUGSPVXFVQZHFC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C28H28F17N3O8S1 |
| Molecular Weight | 889.13 |
| AlogP | 8.25 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 18.0 |
| Polar Surface Area | 147.32 |
| Heavy Atoms | 57.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 68298-72-6 |
| NORMAN SUSDAT | |
| PubChem | 3017840 |
| ChemSpider | 2285491.0 |