Base information
| Cat. No. | |
| CAS No. | 11096-26-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C22H22ClKN6O |
| Molecular Weight | 461.001 |
| Exact Mass | 460.118 |
| XLogP3 | 3.8959 |
| Mr | 116.078 |
| PSA | 89.61 |
| Sequence | - |
| Atom number | 53 |
| Bond number | 55 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1[n-]nnn1)CO)Cl.[K+] |
