aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16641 | 3.74 | 288.29 | C17H10O2N3 | O=c1cc(-c2ccccc2)c2ccc(C3=C[N]N=N3)cc2o1 |
|
AD16642 | 2.78 | 386.44 | C21H20ON7 | COc1ccc(-c2ccc(N3CCN(c4ncnc5c4N=C[N]5)CC3)cc2)cn1 |
|
AD16643 | -0.95 | 228.21 | C6H6O3N5S | CS(=O)(=O)C1=Nc2c(O)nc(N)nc2[N]1 |
|
AD16644 | 5.15 | 693.92 | C41H59O8N | COC(=O)C(Cc1ccccc1)NC(=O)C12CCC(C)(C(=O)OC)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(CO)C4CCC3(C)C1(C)CC2 |
|
AD16645 | 3.35 | 575.79 | C33H53O7N | COC(=O)C1(C)CCC2(C(=O)NCCO)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD16646 | 5.04 | 277.82 | C16H16NClS | Clc1ccccc1Cc1ncc(C2CCCC2)s1 |
|
AD16647 | 8.87 | 577.94 | C36H67O4N | CCCCCCCCCCCCCCC=CC(O)C(=O)NC(CO)C(O)C=CCCC=C(C)CCCCCCCC |
|
AD16648 | 1.3 | 342.34 | C15H16O3N7 | CCOC(=O)c1cnn(-c2nc3c(c(NC4CCCO4)n2)N=C[N]3)c1 |
|
AD16649 | 3.95 | 368.43 | C25H20O3 | O=C1c2cc3ccccc3cc2C2C1CC(O)C21C(=O)CCc2ccccc21 |
|
AD16650 | 2.59 | 514.39 | C19H29O2N7I | O=C(CI)NCCCCCC(=O)NCCCCCCNc1ncnc2c1N=C[N]2 |