aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10231 | -0.64 | 253.21 | C10H11O5N3 | COc1nc2c(c(O)c(C)c(=O)n2O)c(=O)n1C |
|
AD10232 | 1.65 | 247.04 | C8H7O4Br | COC(=O)c1cc(O)c(O)c(Br)c1 |
|
AD10233 | 1.56 | 233.02 | C7H5O4Br | O=C(O)c1cc(O)c(O)c(Br)c1 |
|
AD10234 | 1.62 | 410.4 | C16H12O3N9S | O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)Nc1ncnc2c1N=C[N]2 |
|
AD10235 | 4.24 | 260.75 | C14H9N2ClS | Cc1cc(-c2ccc(Cl)cc2)c(C#N)c(=S)[nH]1 |
|
AD10236 | 4.33 | 262.52 | C13H6ONCl3 | CC(=O)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12 |
|
AD10237 | 4.73 | 346.38 | C11H3NCl3I | Clc1cc2[nH]c(Cl)c(I)c2cc1Cl |
|
AD10238 | 3.82 | 437.63 | C27H39O2N3 | Cc1ccccc1Cc1ccc(CCCC(=O)NC(C)(C)C(=O)N(C)CCN(C)C)cc1 |
|
AD10239 | 1.98 | 210.27 | C12H18O3 | COc1ccc(COCCC(C)O)cc1 |
|
AD10240 | 3.49 | 234.26 | C15H10ON2 | Oc1c2c3c(ccnc3c3ccccc13)C=CN2 |