| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 279H5WFH84 |
| EPA CompTox | DTXSID6059362 |
Structure
| InChI Key | RPHKINMPYFJSCF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H9N3 |
| Molecular Weight | 123.08 |
| AlogP | 0.43 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 78.06 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 108-72-5 |
| NORMAN SUSDAT | |
| FDA SRS | 279H5WFH84 |
| PubChem | 66952 |
| ChemSpider | 60311.0 |
CONTENTS
