aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37421 | 1.64 | 245.24 | C12H11O3N3 | COC(=O)c1ccc(Oc2ncc(N)cn2)cc1 |
|
AD37422 | 0.24 | 286.31 | C14H16O2N5 | NC(=O)C1=C(Nc2ccc(N3CCOCC3)cc2)[N]C=N1 |
|
AD37423 | 1.55 | 286.06 | C7H5N5I | C=CNc1nc(I)nc2c1N=C[N]2 |
|
AD37424 | 2.16 | 246.24 | C13H11O2N2F | Nc1cnc(F)cc1C(=O)OCc1ccccc1 |
|
AD37425 | 0.96 | 287.3 | C14H15O3N4 | CC(C)OC(=O)c1cccc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD37426 | 2.24 | 247.32 | C13H13O2NS | Nc1ccccc1CS(=O)(=O)c1ccccc1 |
|
AD37427 | 1.94 | 255.11 | C10H11ON2Br | CC(=O)N1CCc2cc(Br)cc(N)c21 |
|
AD37428 | 0.51 | 269.24 | C13H9O3N4 | NC(=O)C1=C(Nc2ccc3occc(=O)c3c2)[N]C=N1 |
|
AD37429 | 1.83 | 260.09 | C9H10O3NBr | COC(=O)c1cc(N)c(OC)c(Br)c1 |
|
AD37430 | 2.11 | 242.05 | C8H5N3FBr | Nc1ncc2cc(F)cc(Br)c2n1 |