Base information
| Cat. No. | |
| CAS No. | 63013-46-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C20H17N5O8 |
| Molecular Weight | 455.378 |
| Exact Mass | 455.108 |
| XLogP3 | 4.0481 |
| Mr | 116.136 |
| PSA | 185.09 |
| Sequence | - |
| Atom number | 50 |
| Bond number | 52 |
| Ring number | 3 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | O=C(N[C@H](C(=O)O)Cc1ncn(c1)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])OCc1ccccc1 |
