aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40941 | 2.35 | 329.18 | C11H9O3N2SBr | O=S(=O)(Nc1ccc(O)cc1)c1cncc(Br)c1 |
|
AD40942 | 1.99 | 337.35 | C15H15O6NS | COC(=O)c1ccc(OC)c(S(=O)(=O)Nc2ccc(O)cc2)c1 |
|
AD40943 | 1.4 | 331.18 | C9H9O2N5SBr | O=S(=O)(Nc1ncnc2c1N=C(Br)[N]2)C1CCC1 |
|
AD40944 | 2.46 | 290.56 | C10H6O3NCl3S | O=S(=O)(Nc1ccc(O)cc1)C(Cl)(Cl)Cl |
|
AD40945 | 2.37 | 328.44 | C17H20ON4S | CN1CCN(c2cncc(C(=O)Nc3ccc(S)cc3)c2)CC1 |
|
AD40946 | 0.92 | 342.24 | C14H20O2N3Br | CN1CCN(c2cc(Br)ccc2C(=O)NCCO)CC1 |
|
AD40947 | 2.25 | 313.38 | C18H20ON3F | NC(=O)c1cc(F)ccc1N1CCN(Cc2ccccc2)CC1 |
|
AD40948 | 2.14 | 301.33 | C14H11O3N3S | O=S(=O)(Nc1ccc(O)cc1)c1cccc2nccnc12 |
|
AD40949 | 2.18 | 296.37 | C12H12O3N2S2 | COc1ccc(S(=O)(=O)Nc2ccc(S)cc2)cn1 |
|
AD40950 | 1.67 | 296.37 | C17H20ON4 | CN1CCN(c2ncccc2C(N)=O)C(c2ccccc2)C1 |