aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14041 | 2.11 | 388.42 | C21H24O7 | COc1cc(CC2(O)C(=O)OCC2Cc2ccc(OC)c(OC)c2)ccc1O |
|
AD14042 | 4.72 | 318.37 | C21H18O3 | COC(=O)c1ccc(-c2ccc(OCc3ccccc3)cc2)cc1 |
|
AD14043 | 1.27 | 604.83 | C31H60O9N2 | CCNC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD14044 | 0.26 | 232.27 | C11H14ON5 | C1=Nc2c(CCN3CCOCC3)ncnc2[N]1 |
|
AD14045 | 0.61 | 144.56 | C6H5ON2Cl | Nc1cc[nH]c(=O)c1Cl |
|
AD14046 | 12.57 | 1189.3 | C66H54O3N21 | O=C(CCCn1cc(-c2ccc(C3=C[N]N=N3)cc2)nn1)Nc1cccc(-c2cc(-c3cccc(NC(=O)CCCn4cc(-c5ccc(C6=C[N]N=N6)cc5)nn4)c3)cc(-c3cccc(NC(=O)CCCn4cc(-c5ccc(C6=C[N]N=N6)cc5)nn4)c3)c2)c1 |
|
AD14047 | 3.06 | 370.44 | C16H12O2N5S2 | CSC1=Nc2c(nc(N)nc2SCc2cc3ccccc3oc2=O)[N]1 |
|
AD14048 | 3.82 | 449.34 | C16H11O2N5S2Br | CSC1=Nc2c(nc(N)nc2SCc2cc3cc(Br)ccc3oc2=O)[N]1 |
|
AD14049 | -9.52 | 891.78 | C33H53O25N3 | CC(=O)NC1C(O)CC(OC(CO)C(O)C2OC(OC(CO)C(O)C3OC(O)(C(=O)O)CC(O)C3NC(C)=O)(C(=O)O)CC(O)C2NC(C)=O)(C(=O)O)OC1C(O)C(O)CO |
|
AD14050 | 1.26 | 218.73 | C11H19ON2Cl | CC(Cl)CNC(=O)C1CCCC(C)N1 |