| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QYQ23V3KJK |
| EPA CompTox | DTXSID40186211 |
Structure
| InChI Key | MSYHGYDAVLDKCE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H3F7N2O1 |
| Molecular Weight | 264.01 |
| AlogP | 2.36 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 34.89 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 32477-35-3 |
| NORMAN SUSDAT | |
| FDA SRS | QYQ23V3KJK |
| PubChem | 94431 |
| ChemSpider | 85218.0 |
CONTENTS
