| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | E51A927SNR |
Structure
| InChI Key | ROINDGIBYTXRFE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C13H10N4 |
| Molecular Weight | 222.09 |
| AlogP | 2.01 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 51.56 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 55242-77-8 |
| NORMAN SUSDAT | |
| FDA SRS | E51A927SNR |
CONTENTS
