Base information
| Cat. No. | |
| CAS No. | 75438-57-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12ClN5O |
| Molecular Weight | 241.677 |
| Exact Mass | 241.073 |
| XLogP3 | 0.6555 |
| Mr | 69.0334 |
| PSA | 71.43 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1nc(C)nc(c1NC1=NCCN1)Cl |
