| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 46E636572H |
| EPA CompTox | DTXSID6044852 |
| InChI Key | OGNCVVRIKNGJHQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C13H14N2 |
| Molecular Weight | 198.12 |
| AlogP | 2.65 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 25.78 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 17252-51-6 |
| NORMAN SUSDAT | |
| FDA SRS | 46E636572H |
| PubChem | 87019 |
| ChemSpider | 77230.0 |