aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16621 | 0.52 | 268.26 | C13H16O6 | COC(=O)C1=COC(O)C2C(COC(C)=O)=CCC12 |
|
AD16622 | 6.72 | 691.91 | C41H57O8N | COC1CC(O)C=CC=CC=CC(C)C(C(C)C(O)CC(C)O)OC(=O)C=CC=CC=CC(C)=CC(C)C(O)C=CC=Cc2coc(n2)C1C |
|
AD16623 | 0.46 | 98.15 | C5H10N2 | CN(C)CCC#N |
|
AD16624 | 3.33 | 314.77 | C18H15O2N2Cl | CN1C(=O)CN(c2ccc(Cc3ccccc3Cl)cc2)C1=O |
|
AD16625 | -1.42 | 126.1 | C3H4ON5 | NC(=O)C1=C(N)[N]N=N1 |
|
AD16626 | 0.5 | 271.22 | C11H7O3N6 | O=c1c2c(nnn1Cc1ccccc1[N+](=O)[O-])[N]C=N2 |
|
AD16627 | 5.98 | 470.69 | C30H46O4 | C=C1C(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C12 |
|
AD16628 | 0.03 | 297.43 | C13H23ON5S | CSCCC(N)C(=O)NCc1cc2n(n1)CCN(C)C2 |
|
AD16629 | 2.84 | 460.61 | C27H40O6 | CC1C2C(CC3C4CC=C5CC(O)CCC5(C)C4CC(=O)C32C)OC12OCC(CO)CC2O |
|
AD16630 | 2.16 | 240.26 | C14H12O2N2 | O=C(NN=Cc1ccccc1)c1ccc(O)cc1 |