Base information
| Cat. No. | |
| CAS No. | 4404-43-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H44N12O10S2 |
| Molecular Weight | 916.982 |
| Exact Mass | 916.274 |
| XLogP3 | 5.7304 |
| Mr | 238.764 |
| PSA | 338.36 |
| Sequence | - |
| Atom number | 108 |
| Bond number | 113 |
| Ring number | 6 |
| Rotor number | 22 |
| Residues number | 0 |
| Canonical smiles | OCCN(c1nc(Nc2ccc(c(c2)S(=O)(=O)O)C=Cc2ccc(cc2S(=O)(=O)O)Nc2nc(Nc3ccccc3)nc(n2)N(CCO)CCO)nc(n1)Nc1ccccc1)CCO |
