aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39771 | 1.31 | 308.29 | C13H15O3N5F | COC(=O)C(NC(=O)Nc1ncnc2c1C(F)=C[N]2)C(C)C |
|
AD39772 | 1.61 | 313.39 | C16H21ON6 | O=C1CCCCN1CC1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39773 | 1.87 | 294.34 | C16H16ON5 | OC1(c2ccccc2)CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39774 | 1.55 | 295.32 | C13H17N6F2 | CN(CC(F)F)C1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39775 | 0.96 | 289.13 | C10H13O3N2Br | CCOc1ncc(Br)cc1C(=O)NCCO |
|
AD39776 | 0.4 | 293.73 | C11H12O5NClS | COC(=O)c1ccc(Cl)cc1S(=O)(=O)NCCO |
|
AD39777 | 2.08 | 274.35 | C13H14ON4S | CN(C)c1cncc(C(=O)Nc2ccc(S)cc2)n1 |
|
AD39778 | 1.41 | 304.33 | C14H18O3N5 | COC(=O)C(CC(C)C)NC(=O)Nc1ncnc2c1C=C[N]2 |
|
AD39779 | 1.1 | 305.32 | C13H17O3N6 | COC(=O)C(CC(C)C)NC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD39780 | 0.23 | 300.34 | C15H18O2N5 | NC(=O)C1=C(Nc2ccccc2CN2CCOCC2)[N]C=N1 |