| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80209392 |
Structure
| InChI Key | ASYBZHICIMVQII-UHNVWZDZSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H14N2O3 |
| Molecular Weight | 162.1 |
| AlogP | -1.5 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 109.57 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 60594-62-9 |
| NORMAN SUSDAT | |
| PubChem | 108976 |
| ChemSpider | 98000.0 |
CONTENTS
