aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08851 | 2.43 | 171.58 | C8H6O2NCl | O=C(O)Nc1ccccc1Cl |
|
AD08852 | 3.39 | 342.39 | C20H22O5 | COc1cc2ccc1Oc1cc(ccc1O)CC(O)C(=O)CCCC2 |
|
AD08853 | -0.46 | 170.14 | C7H7O2N2F | NC(=O)Cc1cc[nH]c(=O)c1F |
|
AD08854 | -0.37 | 173.12 | C7H5O2NF2 | C#CC1(O)C=CNC(=O)C1(F)F |
|
AD08855 | 3.76 | 359.41 | C20H19ON6 | C1=Nc2c(nc(NCCOCc3ccccc3)nc2Nc2ccccc2)[N]1 |
|
AD08856 | 5.18 | 488.71 | C30H48O5 | CC1(C)CCC2(C(=O)O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD08857 | 2.09 | 518.65 | C29H42O8 | C=C1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CCC4(C)C3C2COC(C)=O)C(O)C1O |
|
AD08858 | 2.33 | 354.31 | C19H14O7 | CC(=O)Oc1cc(C)cc2c1C(=O)c1c(OC(C)=O)cc(O)cc1C2=O |
|
AD08859 | 5.27 | 332.43 | C20H16ON2S | COc1ccc(-c2cc(-c3ccc(C)cc3)[nH]c(=S)c2C#N)cc1 |
|
AD08860 | 2.03 | 210.23 | C11H14O4 | CCC(C)C(=O)c1c(O)cc(O)cc1O |