| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MBZ62VSZ9Z |
| EPA CompTox | DTXSID2062329 |
Structure
| InChI Key | AOCDQWRMYHJTMY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H4N4O2 |
| Molecular Weight | 164.03 |
| AlogP | 0.87 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 84.71 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2338-12-7 |
| NORMAN SUSDAT | |
| FDA SRS | MBZ62VSZ9Z |
| PubChem | 61301 |
| ChemSpider | 55240.0 |
CONTENTS
