aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35821 | 1.34 | 251.22 | C11H9ON4F2 | NC(=O)C1=C(Nc2cccc(C(F)F)c2)[N]C=N1 |
|
AD35822 | 2.29 | 243.22 | C12H8ON4F | Oc1ccc(F)cc1Nc1ncnc2c1C=C[N]2 |
|
AD35823 | 2.75 | 257.25 | C13H10ON4F | Cc1cc(O)ccc1Nc1ncnc2c1C(F)=C[N]2 |
|
AD35824 | 2.61 | 249.26 | C13H9N6 | C1=Nc2c(ncnc2Nc2cccc3[nH]ccc23)[N]1 |
|
AD35825 | 2.11 | 251.27 | C13H11N6 | C1=Cc2c(ncnc2Nc2cnc(C3CC3)nc2)[N]1 |
|
AD35826 | 1.58 | 257.32 | C14H17ON4 | CCc1c(C)cc(NC2=C(C(N)=O)N=C[N]2)cc1C |
|
AD35827 | 2.58 | 242.24 | C12H9N5F | Cc1c(F)cccc1Nc1ncnc2c1N=C[N]2 |
|
AD35828 | 1.34 | 251.22 | C11H9ON4F2 | NC(=O)C1=C(Nc2ccc(C(F)F)cc2)[N]C=N1 |
|
AD35829 | 2.45 | 266.28 | C14H12ON5 | C1=Nc2c(ncnc2Nc2ccc3c(c2)CCCO3)[N]1 |
|
AD35830 | 2.29 | 243.22 | C12H8ON4F | Oc1ccc(Nc2ncnc3c2C=C[N]3)cc1F |