| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PNG4BJG1Z6 |
| EPA CompTox | DTXSID6062129 |
| InChI Key | ICMVGKQFVMTRLB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H11N1 |
| Molecular Weight | 145.09 |
| AlogP | 2.53 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 11.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 2046-18-6 |
| NORMAN SUSDAT | |
| FDA SRS | PNG4BJG1Z6 |
| PubChem | 74897 |
| ChemSpider | 67460.0 |