aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23031 | 3.75 | 311.16 | C17H12O3Cl2 | O=C(Oc1ccc(CCO)cc1)c1c(Cl)cccc1Cl |
|
AD23032 | -0.3 | 91.09 | C3H6ONF | O=CNCCF |
|
AD23033 | 1.36 | 219.22 | C11H10ON3F | Nc1nc(CO)cc(-c2ccc(F)cc2)n1 |
|
AD23034 | 2.04 | 688.81 | C33H40O5N10S | Cc1ccc(C(=O)Nc2nc(-c3cccc(NC(=O)CCC(=O)NC(Cc4cn(C)nn4)C(=O)NC(CCCCN)C(N)=O)c3)cs2)cc1 |
|
AD23035 | 3.71 | 249.4 | C16H27ON | CNCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 |
|
AD23036 | 3.14 | 284.73 | C15H11N5Cl | Clc1nc2c(c(NC3CCc4ccccc43)n1)N=C[N]2 |
|
AD23037 | 0.05 | 201.17 | C8H5ON6 | Nc1ncnc2c1C(c1ncco1)=N[N]2 |
|
AD23038 | 1.23 | 228.21 | C11H7N5F | Nc1ncnc2c1C(c1ccc(F)cn1)=C[N]2 |
|
AD23039 | 3.66 | 289.72 | C15H11N4FCl | CC(Nc1nc(Cl)nc2c1C=C[N]2)c1ccccc1F |
|
AD23040 | 2.32 | 288.3 | C16H16O5 | COc1ccc2c(c1)OCC(c1ccc(O)cc1O)C2O |