| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R9AW3LRY8R |
| EPA CompTox | DTXSID90196663 |
Structure
| InChI Key | IIVUJUOJERNGQX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H4N2O2 |
| Molecular Weight | 124.03 |
| AlogP | 0.17 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 63.08 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4595-61-3 |
| NORMAN SUSDAT | |
| FDA SRS | R9AW3LRY8R |
| PubChem | 78346 |
| ChemSpider | 70716.0 |
CONTENTS
