aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18721 | 3.15 | 340.8 | C18H21O5Cl | CCOC(=O)C(C(=O)OCC)C(CC(C)=O)c1ccc(Cl)cc1 |
|
AD18722 | 4.32 | 354.4 | C21H22O5 | COc1cc(O)c(CC=C(C)C)c2c1C(=O)CC(c1ccc(O)cc1)O2 |
|
AD18723 | 3.76 | 378.8 | C20H13O2N5Cl | N#CC1=C(N)Oc2cc(OCC3=C[N]N=N3)ccc2C1c1ccccc1Cl |
|
AD18724 | 0.65 | 254.3 | C8H6O2N4S2 | O=c1nc(SSc2cc[nH]c(=O)n2)cc[nH]1 |
|
AD18725 | 0.99 | 245.0 | C5H2N4I | Ic1ncnc2c1N=C[N]2 |
|
AD18726 | 4.47 | 386.44 | C22H26O6 | COc1c(C)cc(C)c(C)c1C(=O)Oc1c(C)c(C)c(C(=O)O)c(OC)c1C |
|
AD18727 | 4.94 | 517.22 | C17H6ON7F6Cl2S | N#Cc1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(NCC2=C[N]N=N2)c1[S+]([O-])C(F)(F)F |
|
AD18728 | 3.41 | 318.46 | C20H30O3 | C=CC1(C)CCC2=C(C1)C(=O)CC1C2(C)CCC(O)C1(C)CO |
|
AD18729 | 2.69 | 332.31 | C17H16O7 | COc1cc(O)c2c(=O)c3c(OC)c(OC)cc(OC)c3oc2c1 |
|
AD18730 | 3.51 | 363.27 | C16H9ON5F4 | Cc1nc2ccc(C(F)(F)F)nc2n2c(-c3cc(O)ccc3F)nnc12 |