aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01331 | 1.82 | 446.42 | C23H18O6N4 | O=C1c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C(=O)N1NC(CO)CO |
|
AD01332 | 3.21 | 172.27 | C10H20O2 | CCCCCCCCCC(=O)O |
|
AD01333 | 0.27 | 1493.86 | C69H96O17N12S4 | NC(=O)C(CO)NC(=O)C(CCCCNC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(CCCCNC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS)NC(=O)C(Cc1ccc(O)cc1)NC(=O)CCS |
|
AD01334 | -5.62 | 435.48 | C17H33O8N5 | CNC1C(O)OC2CC(N)C(OC3C(N)CC(NC(=O)CN)C(O)C3O)OC2C1O |
|
AD01335 | 1.79 | 199.64 | C10H10O2NCl | CC(=O)Nc1cc(CO)ccc1Cl |
|
AD01336 | 0.19 | 302.71 | C14H15O6Cl | OC1OC2COC(c3ccc(Cl)cc3)OC2C(O)C1O |
|
AD01337 | 2.3 | 106.17 | C8H10 | Cc1ccc(C)cc1 |
|
AD01338 | 0.91 | 380.71 | C15H12O4N5PCl | O=P([O-])([O-])OCC(Cc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD01339 | -1.54 | 110.0 | CH3O4P | COP(=O)([O-])[O-] |
|
AD01340 | -1.25 | 112.09 | C3H4ON4 | Nc1nc[nH]c(=O)n1 |