aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22841 | -0.31 | 137.14 | C6H7ON3 | NNC(=O)c1ccncc1 |
|
AD22842 | 3.75 | 419.5 | C21H25O6NS | O=C(CCCCCS)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O)ccc1O |
|
AD22843 | 0.93 | 216.2 | C6H4N5F2S | Nc1ncnc2c1C(SC(F)F)=N[N]2 |
|
AD22844 | 0.33 | 180.22 | C6H6N5S | CSC1=N[N]c2ncnc(N)c21 |
|
AD22845 | 2.93 | 270.38 | C17H22ON2 | CN(CCCCC(N)=O)Cc1ccc2ccccc2c1 |
|
AD22846 | 0.88 | 243.33 | C11H17O3NS | Cc1cc(C)c(S(=O)(=O)NCCO)c(C)c1 |
|
AD22847 | 0.86 | 360.36 | C19H20O7 | COc1ccc(C=CC(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1 |
|
AD22848 | 0.84 | 307.39 | C16H25O3N3 | CN(CCCCc1cccc(C(N)=O)c1)CCC(N)C(=O)O |
|
AD22849 | 3.86 | 450.44 | C25H22O8 | COc1cc(OC)c(C2=C(C)C=C(O)C3C(=O)c4c(O)cccc4C(=O)C23)c(O)c1C(C)=O |
|
AD22850 | -0.72 | 372.51 | C18H36O4N4 | CCCCC1=C(CN)OC(OC2C(N)CC(NCC)C(O)C2O)C(N)C1 |