aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35791 | 3.28 | 233.24 | C13H12O2NF | COc1ccc(F)c(Nc2ccc(O)cc2)c1 |
|
AD35792 | 2.59 | 257.25 | C13H10ON4F | COc1ccc(Nc2ncnc3c2C=C[N]3)c(F)c1 |
|
AD35793 | 1.47 | 228.24 | C10H10N7 | Cc1n[nH]c(C)c1Nc1ncnc2c1N=C[N]2 |
|
AD35794 | 2.49 | 259.68 | C12H8N6Cl | Cc1ccc(Nc2nc(Cl)nc3c2N=C[N]3)cn1 |
|
AD35795 | 3.25 | 220.27 | C11H9N2FS | Fc1cncc(Nc2ccc(S)cc2)c1 |
|
AD35796 | 2.44 | 242.24 | C12H9N5F | Cc1ccc(Nc2ncnc3c2C(F)=C[N]3)cn1 |
|
AD35797 | 2.5 | 257.3 | C11H9N6S | Cc1ccc(Nc2[nH]c(=S)nc3c2N=C[N]3)cn1 |
|
AD35798 | 2.95 | 262.29 | C11H9N5FS | Cc1cc(Nc2nc(F)nc3c2N=C[N]3)c(C)s1 |
|
AD35799 | 2.32 | 249.26 | C13H9N6 | C1=Cc2c(ncnc2Nc2ccnc3[nH]ccc23)[N]1 |
|
AD35800 | 2.81 | 244.3 | C11H10N5S | Cc1cc(Nc2ncnc3c2N=C[N]3)c(C)s1 |