aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17811 | 4.54 | 340.42 | C21H24O4 | C=C(C#Cc1cc(O)ccc1O)CCC=C(C)CCC=C(C)C(=O)O |
|
AD17812 | -0.74 | 518.56 | C26H34O9N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNCCc2ccc(-c3ccccc3)cc2)O1 |
|
AD17813 | -1.43 | 534.52 | C25H30O11N2 | COC1(C(=O)O)CC(O)C(NC(=O)CO)C(C(O)C(O)CNC(=O)c2ccc(-c3ccc(O)cc3)cc2)O1 |
|
AD17814 | 1.83 | 228.32 | C10H16O2N2S | CSCCCNC(=O)NCc1ccco1 |
|
AD17815 | 4.17 | 756.75 | C40H34O9N7 | O=C(NCCOCCOCCNC(=O)c1ccc2c(c1)C1(OC2=O)c2ccc(O)cc2Oc2cc(O)ccc21)c1ccc(CNc2ncnc3c2N=C[N]3)cc1 |
|
AD17816 | 1.75 | 335.25 | C15H14O6NP | CNC(=O)OC(c1cccc(Oc2ccccc2)c1)P(=O)([O-])[O-] |
|
AD17817 | 5.38 | 307.1 | C15H7OF3Cl2 | Oc1ccc(-c2ccc(Cl)c(C(F)(F)F)c2)cc1Cl |
|
AD17818 | 3.47 | 807.75 | C37H60O16Cl2 | CCc1c(Cl)c(OCCOCCOCCOCCOCCOCCOC)c(Cl)c(OCCOCCOCCOCCOCCOCCOC)c1C(=O)O |
|
AD17819 | 1.09 | 154.19 | C6H6ON2S | C=NNC(=O)c1ccsc1 |
|
AD17820 | 3.09 | 276.72 | C16H13O3Cl | O=C(Oc1ccc(CCO)cc1)c1cccc(Cl)c1 |