| Keyword(s): | Human Metabolites |
| Molecule Category | Salt-form |
| UNII | AF5YBU3H3K |
| EPA CompTox | DTXSID00232783 |
Structure
| InChI Key | GMWSAVIQMJXHLI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H17N3 |
| Molecular Weight | 179.12 |
| AlogP | 1.47 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 61.9 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 83898-06-0 |
| NORMAN SUSDAT | |
| FDA SRS | AF5YBU3H3K |
| PubChem | 3019442 |
CONTENTS
