| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MBM1C4K26S |
| EPA CompTox | DTXSID2057609 |
Structure
| InChI Key | MRWQRJMESRRJJB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H20N4O2 |
| Molecular Weight | 264.16 |
| AlogP | 1.01 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 61.82 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1028-33-7 |
| NORMAN SUSDAT | |
| FDA SRS | MBM1C4K26S |
| PubChem | 70569 |
| ChemSpider | 63738.0 |
CONTENTS
