Base information
| Cat. No. | |
| CAS No. | 58111-94-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C21H23N5O6 |
| Molecular Weight | 441.437 |
| Exact Mass | 441.165 |
| XLogP3 | 3.8598 |
| Mr | 116.892 |
| PSA | 169.36 |
| Sequence | - |
| Atom number | 55 |
| Bond number | 57 |
| Ring number | 3 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@H](C(=O)O)CCCNC(=N)N[N+](=O)[O-])OCC1c2ccccc2-c2c1cccc2 |
