| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | XWW7MD9ZRU |
| EPA CompTox | DTXSID40185961 |
Structure
| InChI Key | HYSDHMFCQHHFGV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H6N4O2 |
| Molecular Weight | 166.05 |
| AlogP | 0.51 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 84.75 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 32183-13-4 |
| NORMAN SUSDAT | |
| FDA SRS | XWW7MD9ZRU |
| PubChem | 96507 |
| ChemSpider | 87124.0 |
CONTENTS
