| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 90NZ6P9NG2 |
| EPA CompTox | DTXSID4064131 |
Structure
| InChI Key | TWIIRMSFZNYMQE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H6N2O2 |
| Molecular Weight | 138.04 |
| AlogP | 0.26 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 52.08 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 6164-79-0 |
| NORMAN SUSDAT | |
| FDA SRS | 90NZ6P9NG2 |
| PubChem | 72662 |
| ChemSpider | 65523.0 |
CONTENTS
