aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41121 | 1.99 | 216.24 | C12H12O2N2 | CCOC(=O)c1cc(N)nc2ccccc12 |
|
AD41122 | 2.29 | 235.67 | C12H10ON3Cl | Nc1cncc(OCc2cccc(Cl)c2)n1 |
|
AD41123 | 2.52 | 214.05 | C10H5N3Cl2 | Nc1c(Cl)ccc2c(Cl)ncnc12 |
|
AD41124 | 2.5 | 221.65 | C11H8ON3Cl | Nc1cnc(Cl)nc1Oc1ccccc1 |
|
AD41125 | 2.27 | 228.68 | C11H13O2N2Cl | CC(C)(C)OC(=O)c1cnc(N)c(Cl)c1 |
|
AD41126 | 2.46 | 224.66 | C8H7N2F2ClS | CSc1ccc(C(N)(F)F)nc1Cl |
|
AD41127 | 2.34 | 228.28 | C11H8N4S | Nc1nc(-c2ccncc2)nc2sccc12 |
|
AD41128 | 1.8 | 227.69 | C11H14ON3Cl | CCN(CC)C(=O)c1cc(N)nc(Cl)c1 |
|
AD41129 | 2.52 | 223.64 | C11H7N3FCl | Nc1cc(Cl)nc(-c2ccc(F)cc2)n1 |
|
AD41130 | 2.16 | 227.48 | C9H5ON2Cl3 | NC(Cl)(Cl)Oc1ccc(Cl)nc1 |