aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05731 | 3.15 | 335.3 | C16H18O5NP | COP(=O)(NCC(=O)OCc1ccccc1)Oc1ccccc1 |
|
AD05732 | 0.22 | 150.18 | C8H10ON2 | NNC(=O)Cc1ccccc1 |
|
AD05733 | 0.0 | 187.19 | C8H7N6 | CN1NC(=N)C2=C[N]c3ncnc1c32 |
|
AD05734 | 4.83 | 390.47 | C25H20N5 | C1=Nc2c(ncnc2NCC(c2ccccc2)(c2ccccc2)c2ccccc2)[N]1 |
|
AD05735 | 3.37 | 351.43 | C19H23ON6 | C1=Nc2c(nc(NCCOCc3ccccc3)nc2NC2CCCC2)[N]1 |
|
AD05736 | 2.61 | 380.17 | C13H11ON5I | COc1nc2c(c(NCc3cccc(I)c3)n1)N=C[N]2 |
|
AD05737 | 1.47 | 1149.46 | C58H104O20N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC4(C)O)C3O)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD05738 | 1.76 | 226.66 | C11H11O2N2Cl | C=NNC(=O)COc1ccc(Cl)cc1C |
|
AD05739 | -0.2 | 434.47 | C14H14O3N10S2 | NS(=O)(=O)c1nnc(N(Cc2cn(O)nn2)Cc2cn(-c3ccccc3)nn2)s1 |
|
AD05740 | 1.66 | 1177.47 | C59H104O21N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C(=O)CN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC4(C)OC)C3O)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |