aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18841 | 2.25 | 260.28 | C15H10N5 | Nc1ncnc2c1C(c1nccc3ccccc13)=C[N]2 |
|
AD18842 | 2.25 | 260.28 | C15H10N5 | Nc1ncnc2c1C(c1cc3ccccc3cn1)=C[N]2 |
|
AD18843 | 3.33 | 738.37 | C38H60O8N5Cl | COC1(C)CC(C)C(O)C(C)CN(C)C(Cn2cc(-c3ccc(Cl)cc3)nn2)COC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |
|
AD18844 | 2.84 | 246.31 | C14H18O2N2 | COc1ccccc1Cc1c(O)n[nH]c1C(C)C |
|
AD18845 | 2.48 | 388.42 | C21H24O7 | COc1cc(CC2C(=O)OCC2C(O)c2ccc(OC)c(OC)c2)ccc1O |
|
AD18846 | 2.51 | 340.36 | C17H18O3N5 | COc1cc2c(c(OC)c1OC)C(Nc1ncnc3c1N=C[N]3)CC2 |
|
AD18847 | 3.38 | 355.43 | C21H19N6 | C1=Nc2c(ncnc2N2CCN(c3ccc(-c4ccccc4)cc3)CC2)[N]1 |
|
AD18848 | 0.84 | 188.27 | C10H20O3 | CC(=CCO)C(O)CCC(C)(C)O |
|
AD18849 | 3.85 | 347.4 | C20H19O2N4 | CN(C)c1ccc(C=CC(=O)c2ccc(OCC3=C[N]N=N3)cc2)cc1 |
|
AD18850 | 3.82 | 424.43 | C22H22O6N3 | COc1cc(C=CC(=O)c2cc(OC)c(OC)c(OC)c2)ccc1OCC1=C[N]N=N1 |