Base information
| Cat. No. | |
| CAS No. | 1010386-62-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C34H42N3O7S2+ |
| Molecular Weight | 668.843 |
| Exact Mass | 668.246 |
| XLogP3 | 7.7001 |
| Mr | 188.626 |
| PSA | 160.85 |
| Sequence | - |
| Atom number | 88 |
| Bond number | 91 |
| Ring number | 4 |
| Rotor number | 13 |
| Residues number | 0 |
| Canonical smiles | C#CCNC(=O)CCCCCN1c2ccc(cc2C(/C/1=C\C=C\C1=[N+](CC)c2c(C1(C)C)cc(cc2)S(=O)(=O)O)(C)C)S(=O)(=O)O |