| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | C24QL9BQ36 |
| EPA CompTox | DTXSID60196771 |
Structure
| InChI Key | JSJWCHRYRHKBBW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8N2O3 |
| Molecular Weight | 132.05 |
| AlogP | -0.46 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 93.41 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 462-88-4 |
| NORMAN SUSDAT | |
| FDA SRS | C24QL9BQ36 |
| PubChem | 111 |
| ChemSpider | 109.0 |
CONTENTS
