| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AC2WTF5FMY |
| EPA CompTox | DTXSID00229476 |
Structure
| InChI Key | IYJMQRLCWBFHJL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H22N2O2 |
| Molecular Weight | 238.17 |
| AlogP | 3.17 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 58.86 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 78980-33-3 |
| NORMAN SUSDAT | |
| FDA SRS | AC2WTF5FMY |
| PubChem | 12863492 |
| ChemSpider | 11253616.0 |
CONTENTS
