| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID0062761 |
Structure
| InChI Key | POTQBGGWSWSMCX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H20N2O2 |
| Molecular Weight | 176.15 |
| AlogP | -0.28 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 70.5 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2997-01-5 |
| NORMAN SUSDAT | |
| PubChem | 76342 |
| ChemSpider | 15017163.0 |
CONTENTS
