| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | OOB953S9X2 |
| EPA CompTox | DTXSID9066091 |
Structure
| InChI Key | FFNKBQRKZRMYCL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H4N4 |
| Molecular Weight | 108.04 |
| AlogP | -0.31 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 79.22 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16617-46-2 |
| NORMAN SUSDAT | |
| FDA SRS | OOB953S9X2 |
| PubChem | 85515 |
| ChemSpider | 77125.0 |
CONTENTS
