aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39751 | 0.99 | 313.26 | C12H12ON6F3 | CN(c1ncnc2c1N=C[N]2)C1CCN(CC(F)(F)F)C1=O |
|
AD39752 | 1.16 | 281.3 | C14H13ON6 | Cc1cccc(C)c1C(=O)n1c(N)c2c(nc1=N)[N]C=N2 |
|
AD39753 | 1.75 | 270.53 | C7H5O2NClSBr | NS(=O)(=O)c1ccc(Br)c(Cl)c1 |
|
AD39754 | 1.49 | 260.26 | C9H6ON7S | O=C(Nc1nccs1)Nc1ncnc2c1N=C[N]2 |
|
AD39755 | -0.23 | 188.17 | C8H6ON5 | O=C1CN(c2ncnc3c2N=C[N]3)C1 |
|
AD39756 | -0.43 | 190.19 | C8H8ON5 | OC1CN(c2ncnc3c2N=C[N]3)C1 |
|
AD39757 | 1.12 | 283.27 | C10H12O3NF3S | O=S(=O)(Cc1ccccc1C(F)(F)F)NCCO |
|
AD39758 | 1.93 | 264.31 | C12H12O3N2S | CS(=O)(=O)c1cncc(Nc2ccc(O)cc2)c1 |
|
AD39759 | 2.36 | 285.35 | C16H19O2N3 | Oc1ccc(Nc2ccc(CN3CCOCC3)nc2)cc1 |
|
AD39760 | 2.02 | 275.05 | C5H2ON2F3SBr | NC(=O)c1sc(Br)nc1C(F)(F)F |