Base information
| Cat. No. | |
| CAS No. | 120241-79-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N4 |
| Molecular Weight | 146.149 |
| Exact Mass | 146.059 |
| XLogP3 | 0.8667 |
| Mr | 39.6137 |
| PSA | 54.46 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | c1ccc(cn1)c1cnn[nH]1 |
