Base information
| Cat. No. | |
| CAS No. | 42832-87-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H11N3O |
| Molecular Weight | 225.246 |
| Exact Mass | 225.09 |
| XLogP3 | 3.0081 |
| Mr | 70.8835 |
| PSA | 84.9 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 30 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc2c(c1)[nH]c1c(c2=O)ccc(c1)N |
