Base information
| Cat. No. | |
| CAS No. | 20245-85-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7N5 |
| Molecular Weight | 161.164 |
| Exact Mass | 161.07 |
| XLogP3 | 1.0902 |
| Mr | 46.1144 |
| PSA | 69.62 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | C=Cn1cnc2c1ncnc2N |
