| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7RL75UH45F |
| EPA CompTox | DTXSID8067810 |
Structure
| InChI Key | BYWDOHJOAPKMOF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H17N3 |
| Molecular Weight | 131.14 |
| AlogP | -0.9 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 41.29 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 34066-96-1 |
| NORMAN SUSDAT | |
| FDA SRS | 7RL75UH45F |
| PubChem | 118594 |
| ChemSpider | 82718.0 |
CONTENTS
