| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | V3XW7B25ZF |
| EPA CompTox | DTXSID8065957 |
Structure
| InChI Key | UAUSQEVPWPGBHG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H8N2O1 |
| Molecular Weight | 100.06 |
| AlogP | 0.38 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 70.1 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 75202-19-6 |
| NORMAN SUSDAT | |
| FDA SRS | V3XW7B25ZF |
| PubChem | 85916 |
| ChemSpider | 76681.0 |
CONTENTS
