| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 5PUL8BW840 |
| EPA CompTox | DTXSID0065694 |
Structure
| InChI Key | WSYOWIMKNNMEMZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5N3O2 |
| Molecular Weight | 127.04 |
| AlogP | 0.63 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 71.82 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 14003-66-8 |
| NORMAN SUSDAT | |
| FDA SRS | 5PUL8BW840 |
| PubChem | 26385 |
| ChemSpider | 24581.0 |
CONTENTS
