Base information
| Cat. No. | |
| CAS No. | 21708-87-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H27N7O5 |
| Molecular Weight | 457.483 |
| Exact Mass | 457.207 |
| XLogP3 | -0.0055 |
| Mr | 117.955 |
| PSA | 171.88 |
| Sequence | - |
| Atom number | 60 |
| Bond number | 63 |
| Ring number | 4 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | OC[C@H]1O[C@H]([C@@H]([C@@H]1NC(=O)C(Cc1ccc(cc1)O)N)O)n1cnc2c1ncnc2N(C)C |
