aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16701 | 3.34 | 556.47 | C22H35O2N7I | CN(CCCCCCN(C)c1ncnc2c1N=C[N]2)C(=O)CCCCCCNC(=O)CI |
|
AD16702 | -1.97 | 153.12 | C5H5O2N4 | NC(=O)C1=C(NC=O)[N]C=N1 |
|
AD16703 | 2.33 | 231.19 | C11H5N4F2 | Fc1ccc(-c2ncnc3c2N=C[N]3)c(F)c1 |
|
AD16704 | 0.1 | 165.13 | C6H5O2N4 | COc1nc(O)c2c(n1)[N]C=N2 |
|
AD16705 | 5.21 | 1422.0 | C72H89O19N10Cl | CCCCCCCCCCNCc1c(O)cc2c(c1O)-c1cc(ccc1O)C1NC(=O)C3NC(=O)C(CC(N)=O)NC(=O)C(NC(=O)C(CC(C)C)NC)C(O)c4ccc(c(Cl)c4)Oc4cc3cc(c4O)Oc3cccc(c3)C(OC3CC(C)(N)C(O)C(C)O3)C(NC1=O)C(=O)NC2C(=O)O |
|
AD16706 | -0.51 | 284.26 | C13H16O7 | COC(=O)C1=COC(O)C2C(COC(C)=O)=CC(O)C12 |
|
AD16707 | 2.1 | 194.23 | C11H14O3 | COc1ccc(CCCC(=O)O)cc1 |
|
AD16708 | 6.79 | 460.74 | C30H52O3 | CC(C)CCCC(C)(O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C |
|
AD16709 | -0.57 | 146.16 | C6H11ON2F | CNC(=O)C1CC(F)CN1 |
|
AD16710 | 2.3 | 646.91 | C34H66O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCCC(C)C)C(C)C(O)C1(C)O |