| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | KL52CY83PM |
| EPA CompTox | DTXSID00174871 |
| InChI Key | IZWMZVDEYOKQCG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C18H23N1O4 |
| Molecular Weight | 317.16 |
| AlogP | 3.01 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 48.95 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 20781-23-1 |
| NORMAN SUSDAT | |
| FDA SRS | KL52CY83PM |
| PubChem | 88696 |
| ChemSpider | 80032.0 |