| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E01R4M1063 |
| EPA CompTox | DTXSID6045400 |
Structure
| InChI Key | PQFRTXSWDXZRRS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H8N4O4 |
| Molecular Weight | 200.05 |
| AlogP | 0.34 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 114.27 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7681-76-7 |
| NORMAN SUSDAT | |
| FDA SRS | E01R4M1063 |
| PubChem | 5094 |
| ChemSpider | 4915.0 |
CONTENTS
