aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08761 | 6.61 | 280.5 | C19H36O | CCCCCCCCC=CCCCCCCCC(C)=O |
|
AD08762 | 3.01 | 311.73 | C16H10ON5Cl | Cc1nc2cccnc2n2c(-c3cc(O)ccc3Cl)nnc12 |
|
AD08763 | 3.21 | 329.39 | C19H17N6 | Nc1nc2c(c(NCC(c3ccccc3)c3ccccc3)n1)N=C[N]2 |
|
AD08764 | 5.78 | 422.54 | C25H20N5S | C1=Nc2c(nc(Sc3ccccc3)nc2NCC(c2ccccc2)c2ccccc2)[N]1 |
|
AD08765 | 1.94 | 297.11 | C11H9O3N2Br | CC(=NN)c1c(O)c2cc(Br)ccc2oc1=O |
|
AD08766 | -4.4 | 1015.15 | C40H58O10N18S2 | Cc1c(N)nc(C(CC(N)=O)NCC(N)C(N)=O)nc1C(=O)NC(C(=O)NC(C)C(O)C(C)C(=O)NC(C(=O)NCCc1nc(-c2nc(C(=O)NCCC(=N)N)cs2)cs1)C(C)O)C(O)c1c[nH]cn1 |
|
AD08767 | 2.15 | 173.01 | C6H5OBr | Oc1ccc(Br)cc1 |
|
AD08768 | 9.46 | 798.89 | C51H42O9 | O=C(O)Cc1cccc(-c2cc(Cc3cc(Cc4ccc(O)c(-c5cccc(CC(=O)O)c5)c4)cc(Cc4ccc(O)c(-c5cccc(CC(=O)O)c5)c4)c3)ccc2O)c1 |
|
AD08769 | 2.11 | 557.73 | C29H51O9N | CCC1OC(=O)C(C)C(O)CC(OC2OC(C)CC(N(C)CC)C2O)C2(C)CC(C)=C(O2)C(C)C(O)C1(C)O |
|
AD08770 | 3.54 | 434.26 | C17H17ON5I | Ic1cccc(COC2CCCC2Nc2ncnc3c2N=C[N]3)c1 |