aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43171 | 2.53 | 327.41 | C17H17O2N3S | CN1C(=O)CC(C(=O)Nc2ccc(S)cc2)C1c1cccnc1 |
|
AD43172 | 1.33 | 335.14 | C11H14O3NI | COc1cc(C)c(I)cc1C(=O)NCCO |
|
AD43173 | 1.78 | 308.38 | C16H24O4N2 | CN(Cc1ccc(C(=O)NCCO)cc1)C(=O)OC(C)(C)C |
|
AD43174 | 2.99 | 306.82 | C16H15ON2ClS | NC(=O)C(c1ccccc1Cl)N1CCc2sccc2C1 |
|
AD43175 | 2.9 | 324.55 | C11H5N6ClBr | Clc1cnccc1Nc1ncnc2c1N=C(Br)[N]2 |
|
AD43176 | 2.09 | 366.14 | C12H9ON5I | OCc1ccc(Nc2ncnc3c2C(I)=C[N]3)cn1 |
|
AD43177 | 1.17 | 314.18 | C12H16O2N3Br | O=C(NCCO)c1cnc(N2CCCC2)c(Br)c1 |
|
AD43178 | 1.61 | 307.34 | C16H15ON6 | N=c1nc2c(c(N)n1C(=O)Cc1ccc(C3CC3)cc1)N=C[N]2 |
|
AD43179 | 1.86 | 309.35 | C16H17ON6 | CC(C)(CC(=O)n1c(N)c2c(nc1=N)[N]C=N2)c1ccccc1 |
|
AD43180 | 1.71 | 311.37 | C16H19ON6 | N=c1nc2c(c(N)n1C(=O)C13CC4CC(CC(C4)C1)C3)N=C[N]2 |