| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID90275624 |
| InChI Key | FBAMWRYINJFGPJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H8Cl1F2N1O3 |
| Molecular Weight | 335.02 |
| AlogP | 3.62 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 59.3 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 98105-79-4 |
| NORMAN SUSDAT | |
| PubChem | 57338 |
| ChemSpider | 51692.0 |