| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 63RUQ95KWE |
| EPA CompTox | DTXSID70202615 |
Structure
| InChI Key | KKACJTWOOFIGAD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8N2O2 |
| Molecular Weight | 116.06 |
| AlogP | 0.85 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 76.67 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5426-52-8 |
| NORMAN SUSDAT | |
| FDA SRS | 63RUQ95KWE |
| PubChem | 79474 |
| ChemSpider | 71787.0 |
CONTENTS
