aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32201 | 1.3 | 198.02 | C6H4N3Br | N#Cc1cnc(N)c(Br)c1 |
|
AD32202 | 0.73 | 218.24 | C10H12ON5 | C=CC(C)(O)CNc1ncnc2c1N=C[N]2 |
|
AD32203 | 0.34 | 200.19 | C7H5O2N2FS | N#Cc1ccc(F)c(S(N)(=O)=O)c1 |
|
AD32204 | 1.98 | 187.16 | C9H4N4F | N#Cc1cc(F)cc(C2=C[N]N=N2)c1 |
|
AD32205 | 1.49 | 202.19 | C10H7N4F | Cn1cc(-c2cc(F)cc(C#N)c2)nn1 |
|
AD32206 | 0.62 | 193.25 | C10H15ON3 | C#CCCCCc1cn(CCO)nn1 |
|
AD32207 | 0.51 | 194.24 | C9H14ON4 | N#CCCCCc1cn(CCO)nn1 |
|
AD32208 | 0.48 | 200.24 | C9H16O3N2 | CC(C)(C)OC(=O)N1CC(N)CC1=O |
|
AD32209 | 0.19 | 191.3 | C12H19N2 | NC1CC[NH+](Cc2ccccc2)CC1 |
|
AD32210 | -0.85 | 207.3 | C12H19ON2 | C#CCCC[NH+]1CC2(CCN(C=O)C2)C1 |