aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00671 | 2.65 | 265.31 | C17H15O2N | O=C1NC(C=Cc2ccccc2)C1Oc1ccccc1 |
|
AD00672 | -0.94 | 257.17 | C7H10O3N6P | Nc1ncnc2c1N=C(NCCP(=O)(O)O)[N]2 |
|
AD00673 | 0.76 | 382.45 | C20H30O7 | CC1C=CC(=O)OC(C)C(CO)C2OC2C=CC(=O)C(C)(O)CC(C)C1O |
|
AD00674 | 0.59 | 140.14 | C7H8O3 | OCc1cc(O)ccc1O |
|
AD00675 | 1.84 | 159.19 | C10H9ON | Cc1cccc2c(=O)[nH]ccc12 |
|
AD00676 | 4.39 | 518.74 | C31H50O6 | CC1(C)CC(C(=O)O)C2(C)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC43C)C2C1 |
|
AD00677 | 1.67 | 163.15 | C9H6ONF | O=c1[nH]ccc2ccc(F)cc12 |
|
AD00678 | 0.8 | 178.19 | C9H10O2N2 | Cc1ccc(C(=O)NC(N)=O)cc1 |
|
AD00679 | 1.72 | 238.25 | C13H10ON4 | NC(=O)c1nnc(-c2ccc3ccccc3c2)[nH]1 |
|
AD00680 | 3.22 | 331.3 | C17H15O7 | COc1cc(-c2[o+]c3cc(O)cc(O)c3cc2O)cc(OC)c1O |