aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42831 | 2.62 | 356.43 | C17H18O2N5S | O=S(=O)(c1ccc(Nc2ncnc3c2C=C[N]3)cc1)N1CCCCC1 |
|
AD42832 | 1.93 | 325.09 | C9H6N6I | IC1=C[N]c2ncnc(Nc3cn[nH]c3)c21 |
|
AD42833 | 2.74 | 354.11 | C11H6N5FI | Fc1cncc(Nc2ncnc3c2C(I)=C[N]3)c1 |
|
AD42834 | 2.44 | 351.13 | C11H8N6I | Cc1ccc(Nc2nc(I)nc3c2N=C[N]3)cn1 |
|
AD42835 | 2.13 | 330.39 | C15H16O2N5S | CC(C)NS(=O)(=O)c1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD42836 | 3.31 | 332.43 | C17H20O3N2S | O=S(=O)(c1ccc(Nc2ccc(O)cc2)cc1)N1CCCCC1 |
|
AD42837 | 3.32 | 291.37 | C15H17O3NS | CC(C)S(=O)(=O)c1ccc(Nc2ccc(O)cc2)cc1 |
|
AD42838 | 2.22 | 295.33 | C15H15ON6 | CCN(C)C(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42839 | 2.22 | 342.4 | C16H16O2N5S | O=S(=O)(c1cccc(Nc2ncnc3c2C=C[N]3)c1)N1CCCC1 |
|
AD42840 | 2.92 | 318.4 | C16H18O3N2S | O=S(=O)(c1cccc(Nc2ccc(O)cc2)c1)N1CCCC1 |