| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | RE400VN2B4 |
| EPA CompTox | DTXSID10213725 |
| InChI Key | BWAPJIHJXDYDPW-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H12N2 |
| Molecular Weight | 136.1 |
| AlogP | 1.47 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 52.04 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6393-01-7 |
| NORMAN SUSDAT | |
| FDA SRS | RE400VN2B4 |
| PubChem | 160824 |
| ChemSpider | 141303.0 |