| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID10233529 |
Structure
| InChI Key | UEANEAODIZOETQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H10N2O3 |
| Molecular Weight | 182.07 |
| AlogP | 0.31 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 98.57 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 84540-48-7 |
| NORMAN SUSDAT | |
| PubChem | 3019946 |
| ChemSpider | 2286977.0 |
CONTENTS
