| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | CT7C6AR5DD |
| EPA CompTox | DTXSID6068272 |
| InChI Key | KZFUMWVJJNDGAU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C21H21N3O2 |
| Molecular Weight | 347.16 |
| AlogP | 4.19 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 51.27 |
| Heavy Atoms | 26.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 41044-12-6 |
| NORMAN SUSDAT | |
| FDA SRS | CT7C6AR5DD |
| PubChem | 100335 |
| ChemSpider | 90669.0 |