aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22831 | 3.25 | 291.35 | C19H17O2N | CC(=O)C=C1C(=O)N(CCc2ccccc2)c2ccccc21 |
|
AD22832 | 1.89 | 267.29 | C15H13O2N3 | O=c1[nH]ccc(=NOCc2ccc3ccccc3c2)[nH]1 |
|
AD22833 | 1.07 | 179.22 | C10H13O2N | CNC(=O)CCc1ccc(O)cc1 |
|
AD22834 | 3.65 | 281.36 | C17H19ON3 | CCCCCc1ccc(-c2cc3c[nH]c(=O)nc3[nH]2)cc1 |
|
AD22835 | 2.2 | 260.35 | C12H14N5S | Nc1ncnc2c1C(SCC1=CCCCC1)=N[N]2 |
|
AD22836 | 1.32 | 390.39 | C20H22O8 | CC1(CC(=O)c2ccoc2)C(C(=O)O)CCC23COC(=O)C2(O)CC=CC13O |
|
AD22837 | 1.57 | 132.16 | C6H12O3 | COC(=O)OC(C)(C)C |
|
AD22838 | 0.64 | 293.28 | C13H15O5N3 | O=C(O)c1cc(OCCCn2cc(CO)nn2)ccc1O |
|
AD22839 | 3.96 | 288.77 | C18H17O2Cl | Clc1ccccc1Cc1ccc(OCC2COC2)cc1 |
|
AD22840 | 4.95 | 312.82 | C18H13N2ClS | Clc1ccccc1Cc1nnc(C=Cc2ccccc2)s1 |