| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60437818 |
Structure
| InChI Key | KDBUTNSQYYLYOY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H10N4O1 |
| Molecular Weight | 142.09 |
| AlogP | -0.96 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 90.09 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 155601-17-5 |
| NORMAN SUSDAT | |
| PubChem | 10290847 |
| ChemSpider | 8466316.0 |
CONTENTS
