| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U52GH47YQX |
| EPA CompTox | DTXSID40194977 |
Structure
| InChI Key | BPYHGTCRXDWOIQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5N3O2 |
| Molecular Weight | 139.04 |
| AlogP | 0.57 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 82.05 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4214-75-9 |
| NORMAN SUSDAT | |
| FDA SRS | U52GH47YQX |
| PubChem | 77887 |
| ChemSpider | 61295.0 |
CONTENTS
