| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9069134 |
| InChI Key | SEQWUAQJBYUKJI-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C20H23N7O2 |
| Molecular Weight | 393.19 |
| AlogP | 3.09 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 9.0 |
| Polar Surface Area | 130.94 |
| Heavy Atoms | 29.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 56842-61-6 |
| NORMAN SUSDAT | |
| PubChem | 92545 |
| ChemSpider | 83551.0 |