| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GOU22OT3BX |
| EPA CompTox | DTXSID0068230 |
Structure
| InChI Key | TVSXDZNUTPLDKY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4N2O1 |
| Molecular Weight | 144.03 |
| AlogP | 1.53 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 53.22 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 40465-45-0 |
| NORMAN SUSDAT | |
| FDA SRS | GOU22OT3BX |
| PubChem | 170380 |
| ChemSpider | 3214.0 |
CONTENTS
