| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID2071734 |
Structure
| InChI Key | BEIDPQDXXXUJEZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H18N4 |
| Molecular Weight | 158.15 |
| AlogP | -1.6 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 53.32 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 68758-73-6 |
| NORMAN SUSDAT | |
| PubChem | 111567 |
| ChemSpider | 100093.0 |
CONTENTS
