aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37131 | 2.71 | 292.3 | C11H10O3N5S | OS(O)(O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37132 | 1.96 | 263.29 | C14H17O4N | COC(=O)C1CCCN1C(=O)OCc1ccccc1 |
|
AD37133 | 0.69 | 269.29 | C13H13ON6 | Cc1ccc(CNC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc1 |
|
AD37134 | 2.11 | 265.31 | C14H19O4N | COC(=O)C(NC(=O)OCc1ccccc1)C(C)C |
|
AD37135 | 1.66 | 290.3 | C12H9ON5FS | Nc1nc2c(c(=O)[nH]1)N=C(SCc1ccc(F)cc1)[N]2 |
|
AD37136 | 0.13 | 87.12 | C4H9ON | CC(C)C(N)=O |
|
AD37137 | -0.59 | 132.19 | C4H8ON2S | CC(=O)NCC(N)=S |
|
AD37138 | 1.56 | 286.34 | C13H12ON5S | Nc1nc2c(c(=O)[nH]1)N=C(SCCc1ccccc1)[N]2 |
|
AD37139 | 1.52 | 270.27 | C13H12O2N5 | CCOc1ccc(NC2=Nc3c(nc[nH]c3=O)[N]2)cc1 |
|
AD37140 | 0.72 | 186.23 | C8H10O3S | Cc1ccc(S(=O)(=O)CO)cc1 |