aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01631 | 1.58 | 331.35 | C17H18O3N3F | O=C(O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O |
|
AD01632 | 4.96 | 295.84 | C16H18ONClS | CCCCCOc1cnc(Cc2ccccc2Cl)s1 |
|
AD01633 | 4.65 | 275.76 | C15H10ONClS | Clc1ccccc1Cc1ncc(-c2ccoc2)s1 |
|
AD01634 | -0.8 | 130.08 | C4H3O2N2F | O=c1[nH]cc(F)c(=O)[nH]1 |
|
AD01635 | -0.3 | 158.13 | C6H7O2N2F | CCn1cc(F)c(=O)[nH]c1=O |
|
AD01636 | 3.69 | 342.3 | C18H12O3N2F2 | O=C(NN=Cc1ccc(-c2ccc(F)cc2F)o1)c1ccccc1O |
|
AD01637 | 2.76 | 168.24 | C10H16O2 | CC(C)=CCCC(C)=CC(=O)O |
|
AD01638 | -2.76 | 343.34 | C14H21O7N3 | NC(=O)COC1OC(C(=O)NC2CCCCNC2=O)=CC(O)C1O |
|
AD01639 | 2.45 | 456.53 | C23H36O9 | CCC1OC(=O)C(C)C(=O)C(C)C(O)C(C)(OC)CC(C)C(=O)C(C)C2OC(=O)OC12C |
|
AD01640 | 0.77 | 246.3 | C12H22O5 | CC1OC(OC2CCC(O)OC2C)CCC1O |