aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38761 | 0.62 | 293.33 | C11H13O2N6S | CCOC(=O)C(C)NC(=S)Nc1ncnc2c1N=C[N]2 |
|
AD38762 | 0.37 | 297.3 | C10H10O2N6FS | COC(=O)CCNC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD38763 | 0.89 | 313.75 | C11H10O2N6ClS | COC(=O)CCNC(=S)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD38764 | -0.09 | 294.37 | C11H22O5N2S | CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NCCO)C1 |
|
AD38765 | 1.31 | 264.31 | C12H12O3N2S | NS(=O)(=O)c1ncccc1OCc1ccccc1 |
|
AD38766 | 0.14 | 303.34 | C12H17O6NS | CCOc1ccc(C(=O)OC)cc1S(=O)(=O)NCCO |
|
AD38767 | 1.09 | 273.31 | C11H15O5NS | COC(=O)CCCS(=O)(=O)Nc1ccc(O)cc1 |
|
AD38768 | 0.93 | 304.33 | C14H18O3N5 | COC(=O)CCN(CC1CCCO1)c1ncnc2c1N=C[N]2 |
|
AD38769 | 0.46 | 303.35 | C14H19O2N6 | CCOC(=O)CN1CCCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD38770 | 0.68 | 303.35 | C14H19O2N6 | COC(=O)CN1CCCC(CNc2ncnc3c2N=C[N]3)C1 |