aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01551 | -0.15 | 130.19 | C6H14ON2 | CC(C)CC(N)C(N)=O |
|
AD01552 | 0.15 | 414.37 | C21H18O9 | COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(=O)CO)CC3O |
|
AD01553 | 1.03 | 406.39 | C20H22O9 | COc1cc(C=CC(=O)OC2CC(C)(O)C3C(O)OC=C(C(=O)O)C23)ccc1O |
|
AD01554 | 1.97 | 244.21 | C11H7ON5F | Oc1ccc(Nc2ncnc3c2N=C[N]3)cc1F |
|
AD01555 | 2.49 | 260.32 | C13H12O2N2S | CC(=O)C1=C(C)NC(S)=C(C#N)C1c1ccco1 |
|
AD01556 | 3.92 | 246.69 | C15H11O2Cl | CC(=O)c1ccc(-c2ccc(O)c(Cl)c2)cc1 |
|
AD01557 | 1.55 | 167.23 | C8H9ONS | O=C(CS)Nc1ccccc1 |
|
AD01558 | 1.02 | 434.47 | C21H27O5N4F | CN(CCNc1cc2c(cc1F)c(=O)c(C(=O)NCCO)cn2C1CC1)CCC(=O)O |
|
AD01559 | 0.22 | 260.23 | C8H8O6N2S | COS(=O)(=O)NC(=O)c1ccccc1[N+](=O)[O-] |
|
AD01560 | -0.52 | 392.55 | C20H36O2N6 | CN(C)CCC(N)C(=O)NCc1ccc(CNC(=O)C(N)CCN(C)C)cc1 |