aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19641 | 2.27 | 228.21 | C11H7N5F | Fc1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD19642 | 3.55 | 336.42 | C19H22ON5 | Cc1cccc(C)c1COC1CCCC1Nc1ncnc2c1N=C[N]2 |
|
AD19643 | 2.65 | 212.2 | C13H8O3 | O=c1oc2cc(O)ccc2c2ccccc12 |
|
AD19644 | 0.51 | 142.11 | C6H6O4 | Oc1cc(O)c(O)c(O)c1 |
|
AD19645 | -4.9 | 325.27 | C11H19O10N | O=C(CO)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO |
|
AD19646 | 1.61 | 221.24 | C11H12ON3F | COCc1cn(Cc2ccc(F)cc2)nn1 |
|
AD19647 | 0.96 | 207.21 | C10H10ON3F | OCc1cn(Cc2ccc(F)cc2)nn1 |
|
AD19648 | 1.61 | 178.19 | C10H10O3 | COc1ccc(C=CC=O)cc1O |
|
AD19649 | 1.81 | 486.34 | C17H25O2N7I | O=C(CI)NCCCCCC(=O)NCCCCNc1ncnc2c1N=C[N]2 |
|
AD19650 | 0.71 | 184.15 | C8H8O5 | CC(=O)c1c(O)cc(O)c(O)c1O |