| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | YT67D88ODY |
| EPA CompTox | DTXSID7049211 |
| InChI Key | WDZGGAFMGIOIQS-DHZHZOJOSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H11N1O3 |
| Molecular Weight | 253.07 |
| AlogP | 3.49 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 60.21 |
| Heavy Atoms | 19.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1222-98-6 |
| NORMAN SUSDAT | |
| FDA SRS | YT67D88ODY |
| PubChem | 5377323 |
| ChemSpider | 13987.0 |