aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18281 | 3.81 | 394.41 | C21H20O5N3 | COc1ccc(C(=O)C=Cc2ccc(OCC3=C[N]N=N3)c(OC)c2)cc1OC |
|
AD18282 | 4.56 | 413.25 | C19H15O3N3Br | COc1cc(C=CC(=O)c2ccc(Br)cc2)ccc1OCC1=C[N]N=N1 |
|
AD18283 | 3.7 | 349.33 | C18H13O4N4 | O=C(C=Cc1cccc([N+](=O)[O-])c1)c1ccc(OCC2=C[N]N=N2)cc1 |
|
AD18284 | 2.66 | 342.15 | C15H8O2N3Br | O=C1Nc2ccccc2C1=C1C(=O)Nc2ncc(Br)cc21 |
|
AD18285 | 2.43 | 360.78 | C17H9O4N2ClS | O=C1Nc2ccccc2C1=C1C(=O)Nc2ccc(S(=O)(=O)Cl)cc21 |
|
AD18286 | 4.04 | 405.39 | C20H24O6NP | COc1ccc(OP(=O)(OC)N2CCCC2C(=O)OCc2ccccc2)cc1 |
|
AD18287 | 1.59 | 151.19 | C7H5ONS | O=c1[nH]ccc2sccc12 |
|
AD18288 | 5.53 | 794.98 | C44H62O11N2 | COC(=O)NC1C(C)OC(OC2CC=C(C)C3C=CC4C(O)C(C)CC(C)C4C3(C)C(=O)C3=C(O)C4(CC(C)C(COC(C)=O)=CC4C=C2C)OC3=O)CC1(C)N |
|
AD18289 | 4.47 | 266.37 | C16H14N2S | CSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1 |
|
AD18290 | 5.28 | 480.98 | C23H15O2N5ClS2 | Nc1nc2c(c(SCc3cc4cc(Cl)ccc4oc3=O)n1)N=C(SCc1ccccc1)[N]2 |