Base information
| Cat. No. | |
| CAS No. | 89322-66-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C5H6IN3O |
| Molecular Weight | 251.025 |
| Exact Mass | 250.956 |
| XLogP3 | 1.2532 |
| Mr | 45.6454 |
| PSA | 61.03 |
| Sequence | - |
| Atom number | 16 |
| Bond number | 16 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1nc(N)ncc1I |
