Base information
| Cat. No. | |
| CAS No. | 85648-09-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C26H30ClN3O4S |
| Molecular Weight | 516.052 |
| Exact Mass | 515.165 |
| XLogP3 | 5.5873 |
| Mr | 141.456 |
| PSA | 116.87 |
| Sequence | - |
| Atom number | 65 |
| Bond number | 67 |
| Ring number | 4 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | COc1cc(CCNC[C@@H](COc2ccc(cc2)c2[nH]cc(n2)c2cccs2)O)ccc1OC.Cl |
