Base information
| Cat. No. | |
| CAS No. | 106241-72-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H13N5O2 |
| Molecular Weight | 223.232 |
| Exact Mass | 223.107 |
| XLogP3 | 0.8602 |
| Mr | 58.4478 |
| PSA | 117.01 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 29 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | Nc1nc(CCOC(=O)C(=C)C)nc(n1)N |
