aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35711 | 2.64 | 251.27 | C14H11ON4 | CC(=O)c1cccc(Nc2ncnc3c2C=C[N]3)c1 |
|
AD35712 | 2.83 | 256.26 | C13H11N5F | CCc1ccc(Nc2nc(F)nc3c2N=C[N]3)cc1 |
|
AD35713 | 2.89 | 256.26 | C13H11N5F | Cc1cccc(C)c1Nc1nc(F)nc2c1N=C[N]2 |
|
AD35714 | 1.73 | 253.27 | C13H11ON5 | O=c1[nH]c2ncnc(NC=Cc3ccccc3)c2[nH]1 |
|
AD35715 | 2.89 | 256.26 | C13H11N5F | Cc1cc(C)cc(Nc2nc(F)nc3c2N=C[N]3)c1 |
|
AD35716 | 3.34 | 227.26 | C14H13O2N | CC(=O)c1ccc(Nc2ccc(O)cc2)cc1 |
|
AD35717 | 1.48 | 251.27 | C13H11N6 | N=c1nc2c(c(N)n1C=Cc1ccccc1)N=C[N]2 |
|
AD35718 | 2.33 | 252.26 | C13H10ON5 | CC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD35719 | 3.28 | 233.24 | C13H12O2NF | COc1ccc(Nc2ccc(O)cc2)cc1F |
|
AD35720 | 2.4 | 266.28 | C14H12ON5 | CC(=O)Nc1cccc(Nc2ncnc3c2C=C[N]3)c1 |