| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0B4PCW98KD |
| EPA CompTox | DTXSID0059667 |
Structure
| InChI Key | QNDGQRJVVZJMJO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C16H32N2O1 |
| Molecular Weight | 268.25 |
| AlogP | 3.61 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 12.0 |
| Polar Surface Area | 35.83 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 136-99-2 |
| NORMAN SUSDAT | |
| FDA SRS | 0B4PCW98KD |
| PubChem | 8709 |
| ChemSpider | 8385.0 |
CONTENTS
