| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID80396837 |
| InChI Key | CEUFGDDOMXCXFW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H6N2 |
| Molecular Weight | 142.05 |
| AlogP | 2.04 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 39.58 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 16136-52-0 |
| NORMAN SUSDAT | |
| PubChem | 3817602 |
| ChemSpider | 507117.0 |