| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Z3794V5PR2 |
| EPA CompTox | DTXSID60177368 |
| InChI Key | KXEHVMQCOHOQHB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C6H7N3O4 |
| Molecular Weight | 185.04 |
| AlogP | -0.04 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 87.26 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 22813-31-6 |
| NORMAN SUSDAT | |
| FDA SRS | Z3794V5PR2 |
| PubChem | 89851 |
| ChemSpider | 81104.0 |