| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 784Q9O56S9 |
| EPA CompTox | DTXSID0021836 |
Structure
| InChI Key | FYFDQJRXFWGIBS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H4N2O4 |
| Molecular Weight | 168.02 |
| AlogP | 1.5 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 86.28 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 100-25-4 |
| NORMAN SUSDAT | |
| FDA SRS | 784Q9O56S9 |
| PubChem | 7492 |
| ChemSpider | 7211.0 |
CONTENTS
