| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID6072471 |
Structure
| InChI Key | STJUHIUVWHDFMZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H16N2O2 |
| Molecular Weight | 196.12 |
| AlogP | 1.35 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 47.72 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 72066-78-5 |
| NORMAN SUSDAT | |
| PubChem | 174887 |
| ChemSpider | 152506.0 |
CONTENTS
