| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | F4K83TT7JQ |
| EPA CompTox | DTXSID70202433 |
| InChI Key | HEXQKPDCBSWTHM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6N2 |
| Molecular Weight | 118.05 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 2.0 |
| Polar Surface Area | 47.58 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 54095-53-3 |
| NORMAN SUSDAT | |
| FDA SRS | F4K83TT7JQ |
| PubChem | 104691 |
| ChemSpider | 94513.0 |