Base information
| Cat. No. | |
| CAS No. | 116644-53-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C29H38FN3O3 |
| Molecular Weight | 495.629 |
| Exact Mass | 495.29 |
| XLogP3 | 5.2709 |
| Mr | 140.959 |
| PSA | 67.45 |
| Sequence | - |
| Atom number | 74 |
| Bond number | 77 |
| Ring number | 4 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | COCC(=O)O[C@]1(CCN(CCCc2nc3c([nH]2)cccc3)C)CCc2c([C@@H]1C(C)C)ccc(c2)F |
