| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | O14B3U97FW |
| EPA CompTox | DTXSID40196416 |
Structure
| InChI Key | MWBWWFOAEOYUST-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H5N5 |
| Molecular Weight | 135.05 |
| AlogP | -0.28 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Polar Surface Area | 81.21 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 452-06-2 |
| NORMAN SUSDAT | |
| FDA SRS | O14B3U97FW |
| PubChem | 9955 |
| ChemSpider | 9561.0 |
CONTENTS
