Base information
| Cat. No. | |
| CAS No. | 1001659-25-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8N4O |
| Molecular Weight | 188.186 |
| Exact Mass | 188.07 |
| XLogP3 | 1.0665 |
| Mr | 49.4539 |
| PSA | 73.8 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | NC(=O)c1ccnc(c1)n1cncc1 |
