| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5L7HJ9NHY8 |
| EPA CompTox | DTXSID40210904 |
Structure
| InChI Key | YKAWOJYVXDCFDP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H6N2O1 |
| Molecular Weight | 98.05 |
| AlogP | 0.83 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 67.87 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 61892-68-0 |
| NORMAN SUSDAT | |
| FDA SRS | 5L7HJ9NHY8 |
| PubChem | 3017295 |
| ChemSpider | 2285061.0 |
CONTENTS
