| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 130UFS7AE0 |
| EPA CompTox | DTXSID50200412 |
Structure
| InChI Key | PETSAYFQSGAEQY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8N2O2 |
| Molecular Weight | 164.06 |
| AlogP | 0.27 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 55.02 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 524-40-3 |
| NORMAN SUSDAT | |
| FDA SRS | 130UFS7AE0 |
| PubChem | 10666 |
| ChemSpider | 10216.0 |
CONTENTS
