| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9070907 |
Structure
| InChI Key | WGMLAJNLNAEBAH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H29N3 |
| Molecular Weight | 215.24 |
| AlogP | 1.31 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 27.3 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 67952-95-8 |
| NORMAN SUSDAT | |
| PubChem | 106227 |
| ChemSpider | 95675.0 |
CONTENTS
