aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15421 | 0.07 | 370.41 | C20H22O5N2 | O=C(NC1CC(NC(=O)c2ccccc2)C(O)C(O)C1O)c1ccccc1 |
|
AD15422 | 9.34 | 535.9 | C34H65O3N | CCCCCCCCCC=CCCC=CC(O)C(CO)NC(=O)CCCCCCCCCCCCCCC |
|
AD15423 | 1.32 | 362.38 | C19H22O7 | COc1ccc(C(=O)OCC23C(OC)OC4(C)CC(=O)C2CC43O)cc1 |
|
AD15424 | 4.21 | 618.72 | C32H46O10N2 | CCC1OC(=O)C(C)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=NOC(=O)NCCc2ccccc2)C(C)C2OC(=O)OC12C |
|
AD15425 | 1.13 | 275.7 | C13H10ON5Cl | Nc1nc2c(c(=O)[nH]1)[N+](Cc1cccc(Cl)c1)=C[N]2 |
|
AD15426 | 3.84 | 246.74 | C15H15N2Cl | CC(C)c1ccc(Cc2ccccc2Cl)nn1 |
|
AD15427 | 2.39 | 208.24 | C10H8O3S | COC(=O)c1cc2ccc(O)cc2s1 |
|
AD15428 | 3.33 | 275.74 | C13H8N4ClS | Clc1cccc(SCc2ncnc3c2N=C[N]3)c1 |
|
AD15429 | 1.18 | 214.35 | C12H26ON2 | CN1CCN(CCCCCCCO)CC1 |
|
AD15430 | 8.52 | 852.04 | C44H65O10N7 | CN1CCN([N+]([O-])=NOc2cc(NCCC(=O)OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)CCC45C)C3(C)C)c([N+](=O)[O-])cc2[N+](=O)[O-])CC1 |