aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33481 | 2.89 | 241.25 | C13H10N4F | Cc1cc(Nc2ncnc3c2C=C[N]3)ccc1F |
|
AD33482 | 2.89 | 241.25 | C13H10N4F | Cc1ccc(Nc2ncnc3c2C=C[N]3)c(F)c1 |
|
AD33483 | 2.84 | 235.27 | C14H11N4 | CC(=Nc1ncnc2c1C=C[N]2)c1ccccc1 |
|
AD33484 | 3.0 | 237.29 | C14H13N4 | CCc1cccc(Nc2ncnc3c2C=C[N]3)c1 |
|
AD33485 | 2.52 | 216.27 | C11H14N5 | CC(C)(C)CC=Nc1ncnc2c1N=C[N]2 |
|
AD33486 | 3.95 | 207.34 | C12H17NS | CC(C)(C)C=CNc1ccc(S)cc1 |
|
AD33487 | 3.03 | 231.25 | C12H12N4F | FC1=C[N]c2ncnc(N=C3CCCCC3)c21 |
|
AD33488 | 2.81 | 229.29 | C11H9N4S | Cc1cscc1Nc1ncnc2c1C=C[N]2 |
|
AD33489 | 3.05 | 241.25 | C13H10N4F | Cc1ccccc1Nc1ncnc2c1C(F)=C[N]2 |
|
AD33490 | 3.78 | 207.32 | C10H9NS2 | Sc1ccc(Nc2ccsc2)cc1 |