aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14181 | -1.02 | 181.14 | C5H5O2N6 | Nc1nc(O)c2c(n1)[N]C(NO)=N2 |
|
AD14182 | 0.67 | 138.17 | C8H10O2 | OCc1cccc(CO)c1 |
|
AD14183 | 1.49 | 288.33 | C14H18O2N5 | COC(=O)C1CCC(Cc2nc(N)c3c(n2)[N]C=N3)CC1 |
|
AD14184 | 7.82 | 280.54 | C20H40 | CCCCCCCCCC=CCCCCCCCCC |
|
AD14185 | 1.51 | 202.22 | C8H4N5S | C1=Nc2c(ncnc2-c2nccs2)[N]1 |
|
AD14186 | 7.47 | 541.81 | C31H59O6N | CCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCC)CC(=O)NC(CO)C(=O)O |
|
AD14187 | 7.35 | 470.69 | C30H46O4 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C(C)(CCC(=O)O)C(C(=C)C)CCC43C)C12 |
|
AD14188 | 5.77 | 484.68 | C30H44O5 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CC4OC(=O)CC(O)C5(C)C(C(=C)C)CCC3(C)C45)C12 |
|
AD14189 | 6.05 | 472.71 | C30H48O4 | CC(C)=CC1CC(O)(C2CCC3(C)C2CCC2C4(C)CCC(O)C(C)(C)C4CCC23C)C(=O)O1 |
|
AD14190 | -1.97 | 2209.79 | C108H130O29N21Cl | CC(C)CC1NC(=O)CNC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)C)NC(=O)C(CCCN)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CNC(=O)C(CC(N)=O)NC(=O)c2ccccc2)C(C(N)=O)OC(=O)C(c2ccc(O)c(Cl)c2)NC(=O)C(C)NC1=O |