aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15201 | 3.15 | 394.34 | C21H14O8 | O=c1oc2cc(O)c3c(c2c2c(O)c(O)c(O)cc12)OC(c1ccc(O)cc1)C3 |
|
AD15202 | 2.99 | 364.49 | C19H32O3N4 | CCCCCCCCCC(=O)NC(C(=O)Nc1cc[nH]c(=O)n1)C(C)C |
|
AD15203 | 2.49 | 177.03 | C9H6OCl2 | OCc1ccc(Cl)c(Cl)c1 |
|
AD15204 | 0.38 | 164.25 | C6H14O2NS | NCCCCCC[S](=O)=O |
|
AD15205 | -1.84 | 1340.44 | C60H93O25N9 | Cc1cc(COC(=O)NC2(C)CC(O)OC(C)C2O)cc(C)c1OC(=O)NCCOCCOCCNC(=O)CNC(=O)CC(NC(=O)COCCO)C(=O)NCC(=O)NCCOCCOCCNC(=O)Oc1c(C)cc(COC(=O)NC2(C)CC(O)OC(C)C2O)cc1C |
|
AD15206 | -2.53 | 1598.03 | C50H64O32N19P5 | Cc1cn(C2CC(O)C(COP(=O)(O)OC3CC(n4cnc5c(=O)[nH]c(N)nc54)OC3COP(=O)(O)OC3CC(n4cnc5c(N)ncnc54)OC3COP(=O)(O)OC3CC(n4cnc5c(=O)[nH]c(N)nc54)OC3COP(=O)(O)OC3CC(n4cc(C)c(=O)[nH]c4=O)OC3COP(=O)(O)O)O2)c(=O)[nH]c1=O |
|
AD15207 | 0.84 | 152.15 | C8H8O3 | O=CCc1ccc(O)c(O)c1 |
|
AD15208 | 3.16 | 197.24 | C13H11ON | ON=Cc1ccc(-c2ccccc2)cc1 |
|
AD15209 | 3.07 | 227.26 | C14H13O2N | ON=Cc1ccc(OCc2ccccc2)cc1 |
|
AD15210 | 2.45 | 296.37 | C18H20O2N2 | CN1CCN(C(=O)c2cccc(-c3ccc(O)cc3)c2)CC1 |