Base information
| Cat. No. | |
| CAS No. | 12772-37-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C107H140Cl2N26O32 |
| Molecular Weight | 2373.32 |
| Exact Mass | 2370.95 |
| XLogP3 | 5.5994 |
| Mr | 667.093 |
| PSA | 922.77 |
| Sequence | - |
| Atom number | 307 |
| Bond number | 314 |
| Ring number | 8 |
| Rotor number | 84 |
| Residues number | 0 |
| Canonical smiles | NCCCCN1C(=O)NC(C(O)C)C(=O)NC(C(=O)NC(C(=O)NC(C(O)C)C(=O)NC(CCCNC(=O)N)C(=O)NC(CC2CNC(=N2)N)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(=O)NC(C(=O)NC(C(=O)NC(C(=O)OC(C(C(=O)NC(C1=O)c1ccc(cc1)O)NC(=O)C(NC(=O)/C=C/C=C/CCCCC(CC)C)CC(=O)O)C)c1ccc(cc1)O)C)CC1CNC(=N1)N)c1cc(Cl)c(c(c1)Cl)O)CO)c1ccc(cc1)O)c1ccc(cc1)O)c1ccc(cc1)O.O |
