aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38741 | 0.89 | 313.75 | C11H10O2N6ClS | CCOC(=O)CNC(=S)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD38742 | 0.79 | 278.05 | C7H7O2N2I | COc1ccc(C(N)=O)nc1I |
|
AD38743 | 0.37 | 297.3 | C10H10O2N6FS | CCOC(=O)CNC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD38744 | -0.03 | 286.31 | C11H14O5N2S | COC(=O)c1cc(C(N)=O)cc(N(C)S(C)(=O)=O)c1 |
|
AD38745 | 0.11 | 281.13 | C7H9O3N2SBr | O=S(=O)(NCCO)c1cccc(Br)n1 |
|
AD38746 | 0.11 | 281.13 | C7H9O3N2SBr | O=S(=O)(NCCO)c1ccc(Br)cn1 |
|
AD38747 | 1.11 | 266.12 | C7H8O3NSBr | COc1cc(Br)ccc1S(N)(=O)=O |
|
AD38748 | 1.48 | 287.34 | C12H17O5NS | COC(=O)CCCCS(=O)(=O)Nc1ccc(O)cc1 |
|
AD38749 | 0.5 | 299.72 | C10H8O2N6ClS | COC(=O)CNC(=S)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD38750 | 0.14 | 285.32 | C12H15O5NS | COC(=O)C=Cc1cccc(S(=O)(=O)NCCO)c1 |