aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39761 | 1.96 | 269.02 | C7H4ON2F3Br | NC(=O)c1cc(C(F)(F)F)ncc1Br |
|
AD39762 | 1.93 | 264.31 | C12H12O3N2S | CS(=O)(=O)c1ccc(Nc2ccc(O)cc2)cn1 |
|
AD39763 | 0.4 | 306.35 | C14H20O3N5 | CC(C)(C)OC(=O)N1CCC=C(NC2=C(C(N)=O)N=C[N]2)C1 |
|
AD39764 | 1.75 | 270.53 | C7H5O2NClSBr | NS(=O)(=O)c1cc(Br)ccc1Cl |
|
AD39765 | 1.6 | 284.38 | C13H20O3N2S | CCCN(CCC)S(=O)(=O)c1ccc(C(N)=O)cc1 |
|
AD39766 | 2.08 | 274.35 | C13H14ON4S | CN(C)c1ncc(C(=O)Nc2ccc(S)cc2)cn1 |
|
AD39767 | 1.61 | 313.39 | C16H21ON6 | O=C(CC1CCN(c2ncnc3c2N=C[N]3)CC1)N1CCCC1 |
|
AD39768 | 1.94 | 305.36 | C12H9O2N4S2 | CS(=O)(=O)c1ccc(Sc2ncnc3c2N=C[N]3)cc1 |
|
AD39769 | 1.1 | 305.32 | C13H17O3N6 | CCC(C)C(NC(=O)Nc1ncnc2c1N=C[N]2)C(=O)OC |
|
AD39770 | 1.41 | 304.33 | C14H18O3N5 | CCC(C)C(NC(=O)Nc1ncnc2c1C=C[N]2)C(=O)OC |