| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E5QLP6U63S |
| EPA CompTox | DTXSID70205242 |
| InChI Key | CEFLNPUKMSWYFB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H21N1O3 |
| Molecular Weight | 251.15 |
| AlogP | 1.74 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 49.77 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 56681-55-1 |
| NORMAN SUSDAT | |
| FDA SRS | E5QLP6U63S |
| PubChem | 151353 |
| ChemSpider | 133390.0 |