Base information
| Cat. No. | |
| CAS No. | 140924-50-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H54N6O4 |
| Molecular Weight | 778.98 |
| Exact Mass | 778.421 |
| XLogP3 | 9.1002 |
| Mr | 236.774 |
| PSA | 94.96 |
| Sequence | - |
| Atom number | 112 |
| Bond number | 121 |
| Ring number | 10 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CC[C@@H]1CN2CC[C@@H]1C[C@@H]2[C@@H](c1ccnc2c1cc(OC)cc2)Oc1nnc(c2c1cccc2)O[C@H](c1ccnc2c1cc(OC)cc2)[C@H]1C[C@@H]2CCN1C[C@@H]2CC |
