aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42851 | 1.94 | 339.12 | C10H8N6I | Cn1cc(Nc2ncnc3c2C(I)=C[N]3)cn1 |
|
AD42852 | 1.99 | 337.36 | C18H17O3N4 | COc1cc(NC2=C(C(N)=O)N=C[N]2)ccc1OCc1ccccc1 |
|
AD42853 | 3.33 | 290.36 | C16H22O3N2 | CC(C)(C)OC(=O)N1CC=C(Nc2ccc(O)cc2)CC1 |
|
AD42854 | 2.99 | 347.42 | C15H19O2N6S | CC(C)(C)OC(=O)N1CC=C(Nc2[nH]c(=S)nc3c2N=C[N]3)CC1 |
|
AD42855 | 2.89 | 302.34 | C18H14ON4 | NC(=O)c1ccnn1-c1ccc2ccc(-c3ccccc3)cn12 |
|
AD42856 | 1.69 | 356.41 | C18H22O3N5 | CC(C)(C)OC(=O)N1CCc2cc(NC3=C(C(N)=O)N=C[N]3)ccc2C1 |
|
AD42857 | 3.39 | 295.34 | C17H17O2N3 | COc1ccc(Cn2cc(Nc3ccc(O)cc3)cn2)cc1 |
|
AD42858 | 2.85 | 314.38 | C18H22O3N2 | Oc1ccc(Nc2ccc(OCCN3CCOCC3)cc2)cc1 |
|
AD42859 | 2.49 | 315.36 | C15H19O2N6 | CC(C)(C)OC(=O)N1CCC(=Nc2ncnc3c2N=C[N]3)CC1 |
|
AD42860 | 2.23 | 339.12 | C10H8N6I | Cc1n[nH]cc1Nc1ncnc2c1C(I)=C[N]2 |