| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PB8V69Y76T |
| EPA CompTox | DTXSID0061240 |
| InChI Key | YBAZINRZQSAIAY-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H6N2 |
| Molecular Weight | 118.05 |
| AlogP | 1.14 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 49.81 |
| Heavy Atoms | 9.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 873-74-5 |
| NORMAN SUSDAT | |
| FDA SRS | PB8V69Y76T |
| PubChem | 13396 |
| ChemSpider | 12822.0 |