Base information
| Cat. No. | |
| CAS No. | 110782-31-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H54N7O8P |
| Molecular Weight | 887.958 |
| Exact Mass | 887.377 |
| XLogP3 | 8.75108 |
| Mr | 243.165 |
| PSA | 177.93 |
| Sequence | - |
| Atom number | 118 |
| Bond number | 124 |
| Ring number | 7 |
| Rotor number | 21 |
| Residues number | 0 |
| Canonical smiles | N#CCCOP(N(C(C)C)C(C)C)O[C@@H]1[C@@H](COC(c2ccc(cc2)OC)(c2ccc(cc2)OC)c2ccccc2)O[C@H]([C@@H]1OC)n1cnc2c1ncnc2NC(=O)c1ccccc1 |
