Base information
| Cat. No. | |
| CAS No. | 75985-31-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H13N3O |
| Molecular Weight | 203.24 |
| Exact Mass | 203.106 |
| XLogP3 | 1.04428 |
| Mr | 59.528 |
| PSA | 48.92 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1nc(C)ccc1CN1CC1C#N |
