aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22551 | -0.22 | 126.11 | C5H6O2N2 | COc1cc[nH]c(=O)n1 |
|
AD22552 | 0.3 | 356.38 | C18H20O4N4 | C#CCNC(=O)COc1ccc(CCCON=c2cc[nH]c(=O)[nH]2)cc1 |
|
AD22553 | 3.52 | 462.5 | C24H30O9 | COc1cc(C2OCC3C(c4cc(OC)c(OC)c(OC)c4O)OCC23)cc(OC)c1OC |
|
AD22554 | 4.93 | 544.73 | C32H48O7 | CC(=O)OC1CC(C)(C(=O)O)CC2C3=CC(=O)C4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC12C |
|
AD22555 | 3.92 | 235.29 | C16H13ON | Cc1cc(-c2cccc3cnccc23)ccc1O |
|
AD22556 | 4.98 | 304.84 | C18H17OClS | CCOc1ccc(Cc2ccc3c(c2Cl)SCC3)cc1 |
|
AD22557 | 1.27 | 248.21 | C7H5N5F3S | Nc1ncnc2c1C(SCC(F)(F)F)=N[N]2 |
|
AD22558 | 2.92 | 324.31 | C13H9N5F3S | Nc1ncnc2c1C(SCc1ccc(C(F)(F)F)cc1)=N[N]2 |
|
AD22559 | 1.86 | 222.66 | C10H9N5Cl | Clc1nc2c(c(NCC3CC3)n1)N=C[N]2 |
|
AD22560 | 2.58 | 827.08 | C40H74O10N8 | CC(C)CCCCCCCCCCCCC(=O)OC(C(C)C)C(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C1CCNC(=N)N1)C(=O)NCCCNC(CO)C(=O)O |