Base information
| Cat. No. | |
| CAS No. | 1671-87-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8N6 |
| Molecular Weight | 236.232 |
| Exact Mass | 236.081 |
| XLogP3 | 1.3906 |
| Mr | 64.084 |
| PSA | 77.34 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 28 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | c1ccc(nc1)c1nnc(nn1)c1ccccn1 |
