Base information
| Cat. No. | |
| CAS No. | 80576-77-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H23N7O5 |
| Molecular Weight | 453.451 |
| Exact Mass | 453.176 |
| XLogP3 | 2.5315 |
| Mr | 118.772 |
| PSA | 207.3 |
| Sequence | - |
| Atom number | 56 |
| Bond number | 58 |
| Ring number | 3 |
| Rotor number | 10 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)C(Cc1cnc2c(n1)c(N)nc(n2)N)C |
