Base information
| Cat. No. | |
| CAS No. | 100890-94-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12N6O |
| Molecular Weight | 256.263 |
| Exact Mass | 256.107 |
| XLogP3 | 1.4947 |
| Mr | 72.7065 |
| PSA | 115.61 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Nc1[nH]c(=O)c2c(n1)n(Cc1ccccc1)c(n2)N |
