| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TTR9Y6YSS8 |
| EPA CompTox | DTXSID80197109 |
Structure
| InChI Key | MPAIWVOBMLSHQA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H4N2O2 |
| Molecular Weight | 160.03 |
| AlogP | 0.84 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 88.04 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4733-50-0 |
| NORMAN SUSDAT | |
| FDA SRS | TTR9Y6YSS8 |
| PubChem | 78467 |
| ChemSpider | 70832.0 |
CONTENTS
