aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22001 | 2.75 | 256.3 | C16H16O3 | Cc1ccc(C(=O)Oc2ccc(CCO)cc2)cc1 |
|
AD22002 | 2.75 | 256.3 | C16H16O3 | Cc1cccc(C(=O)Oc2ccc(CCO)cc2)c1 |
|
AD22003 | 3.99 | 366.37 | C21H18O6 | COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)COC3 |
|
AD22004 | 1.49 | 254.26 | C12H15O3N2F | O=C(O)NCCCC(=O)NCc1ccc(F)cc1 |
|
AD22005 | 5.25 | 416.65 | C27H44O3 | CC(C)C(O)CCC(C)C1CC(O)C2C3=CCC4CC(O)CCC4(C)C3=CCC12C |
|
AD22006 | -0.39 | 811.03 | C39H70O10N8 | CC(NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)C(C)O)C(C)C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(C)C)C(C)C(=O)O)C(C)C)C(C)C)C(C)C |
|
AD22007 | 3.07 | 200.24 | C13H12O2 | COc1cccc(-c2ccccc2O)c1 |
|
AD22008 | 5.24 | 486.69 | C30H46O5 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CC(O)C4C5(C)CCC(O)C(C)(C=O)C5CCC43C)C12 |
|
AD22009 | 1.13 | 430.56 | C16H26O4N6S2 | CCCSC(CCO)=NS(=O)(=O)CCCCCn1cnc2c(=O)[nH]c(N)nc21 |
|
AD22010 | 2.91 | 456.59 | C25H36O4N4 | CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NC(C)(C)C(=O)N2CCOCC2)cc1 |