Base information
| Cat. No. | |
| CAS No. | 101688-01-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H6N4 |
| Molecular Weight | 182.181 |
| Exact Mass | 182.059 |
| XLogP3 | 1.41028 |
| Mr | 49.978 |
| PSA | 62.46 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cnc(nc1)c1cccnc1 |
