| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QM4AR6M6T8 |
| EPA CompTox | DTXSID6049432 |
Structure
| InChI Key | XSCHRSMBECNVNS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H6N2 |
| Molecular Weight | 130.05 |
| AlogP | 1.63 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 91-19-0 |
| NORMAN SUSDAT | |
| FDA SRS | QM4AR6M6T8 |
| PubChem | 7045 |
| ChemSpider | 21106470.0 |
CONTENTS
