aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43301 | 2.7 | 327.16 | C11H13O2N5Br | CC(C)(C)COC(=O)Nc1ncnc2c1N=C(Br)[N]2 |
|
AD43302 | 2.77 | 325.39 | C14H12O3NFS2 | CS(=O)(=O)c1cc(C(=O)Nc2ccc(S)cc2)ccc1F |
|
AD43303 | 2.94 | 321.42 | C15H15O3NS2 | Cc1c(C(=O)Nc2ccc(S)cc2)cccc1S(C)(=O)=O |
|
AD43304 | 2.72 | 312.19 | C11H10ON3SBr | Cn1nc(C(=O)Nc2ccc(S)cc2)cc1Br |
|
AD43305 | 3.2 | 332.4 | C17H17O2N2FS | O=C(Nc1ccc(S)cc1)c1ccc(N2CCOCC2)cc1F |
|
AD43306 | 2.66 | 318.7 | C14H9O3N5Cl | COc1ccc(OC(=O)Nc2nc(Cl)nc3c2N=C[N]3)cc1 |
|
AD43307 | 2.73 | 363.15 | C13H9O3N5Br | COc1ccc(OC(=O)Nc2ncnc3c2N=C(Br)[N]3)cc1 |
|
AD43308 | 2.9 | 351.12 | C12H6O2N5FBr | O=C(Nc1nc(F)nc2c1N=C[N]2)Oc1ccc(Br)cc1 |
|
AD43309 | 3.38 | 322.39 | C18H14O2N2S | O=C(Nc1ccc(S)cc1)c1ccc(=O)n(-c2ccccc2)c1 |
|
AD43310 | 2.76 | 333.12 | C12H7O2N5Br | O=C(Nc1ncnc2c1N=C[N]2)Oc1ccc(Br)cc1 |