Base information
| Cat. No. | |
| CAS No. | 222631-44-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H16ClN5O3 |
| Molecular Weight | 301.729 |
| Exact Mass | 301.094 |
| XLogP3 | -0.0209 |
| Mr | 77.5402 |
| PSA | 140.31 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 37 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1N[C@H]([C@@H]([C@@H]1O)O)c1c[nH]c2c1ncnc2N.Cl |
