Base information
| Cat. No. | |
| CAS No. | 204845-95-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C33H33N5O3 |
| Molecular Weight | 547.647 |
| Exact Mass | 547.258 |
| XLogP3 | 6.4881 |
| Mr | 158.98 |
| PSA | 97.31 |
| Sequence | - |
| Atom number | 74 |
| Bond number | 79 |
| Ring number | 6 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | Nc1nc(OCc2ccccc2)c2c(n1)n(cn2)[C@H]1C[C@@H]([C@H](C1=C)COCc1ccccc1)OCc1ccccc1 |
