| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | P8740PEW4B |
| EPA CompTox | DTXSID50168588 |
Structure
| InChI Key | BMTSZVZQNMNPCT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6N2O1 |
| Molecular Weight | 110.05 |
| AlogP | 0.37 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Polar Surface Area | 59.14 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 16867-03-1 |
| NORMAN SUSDAT | |
| FDA SRS | P8740PEW4B |
| PubChem | 28114 |
| ChemSpider | 26152.0 |
CONTENTS
