| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00167945 |
Structure
| InChI Key | SVLVXRRQKCWWRO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5F1N2O6 |
| Molecular Weight | 208.01 |
| AlogP | -0.11 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 112.58 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16544-21-1 |
| NORMAN SUSDAT | |
| PubChem | 85486 |
| ChemSpider | 77096.0 |
CONTENTS
