aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22431 | 4.3 | 428.22 | C17H19O5NPBr | COP(=O)(NC(C)C(=O)OCc1ccccc1)Oc1ccc(Br)cc1 |
|
AD22432 | 5.62 | 341.86 | C20H16ONClS | C=CCOc1ccc(Cc2ncc(-c3ccccc3)s2)c(Cl)c1 |
|
AD22433 | 10.71 | 510.89 | C33H66O3 | CCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(=O)OC |
|
AD22434 | 4.75 | 574.62 | C27H20O6N5S2 | COc1cccc2cc(CSC3=Nc4c(nc(N)nc4SCc4cc5cccc(OC)c5oc4=O)[N]3)c(=O)oc12 |
|
AD22435 | 8.62 | 382.67 | C25H50O2 | CCCCCCCCCCCC(CCCCCCCCCCC)C(=O)OC |
|
AD22436 | 5.54 | 428.66 | C28H44O3 | CC(CO)CCC1(O)CC2CC3C4CCC5=CC(=O)CCC5(C)C4CCC3(C)C2C1C |
|
AD22437 | 1.4 | 240.25 | C12H10ON5 | COc1ccc(C2=Nc3c(N)ncnc3[N]2)cc1 |
|
AD22438 | 4.08 | 214.35 | C13H26O2 | CCCCCCCCCCC(=O)OCC |
|
AD22439 | 2.51 | 395.14 | C12H8O2N6I | O=[N+]([O-])c1nc2c(c(NCc3cccc(I)c3)n1)N=C[N]2 |
|
AD22440 | -0.5 | 174.18 | C5H6O3N2S | CSc1cn(O)c(=O)[nH]c1=O |