aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11211 | 2.3 | 690.92 | C38H62O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCC#Cc2ccccc2)C(C)C(O)C1(C)O |
|
AD11212 | 2.37 | 282.33 | C15H16ON5 | Nc1nc(OCCCCc2ccccc2)nc2c1N=C[N]2 |
|
AD11213 | 1.79 | 335.35 | C16H15ON8 | N=C(N)Nc1nc(OCCc2c[nH]c3ccccc23)nc2c1N=C[N]2 |
|
AD11214 | -0.37 | 140.14 | C6H8O2N2 | CCc1c[nH]c(=O)[nH]c1=O |
|
AD11215 | 3.57 | 298.33 | C18H12N5 | C1=Nc2c(ncnc2NC2c3ccccc3-c3ccccc32)[N]1 |
|
AD11216 | 1.83 | 248.06 | C8H9OI | OCCc1ccc(I)cc1 |
|
AD11217 | -1.44 | 167.12 | C7H5O4N | O=C([O-])c1c[nH+]cc(C(=O)O)c1 |
|
AD11218 | 2.49 | 190.27 | C10H10N2S | N#Cc1cc2c([nH]c1=S)CCCC2 |
|
AD11219 | 3.3 | 293.14 | C14H8N5Cl2 | Clc1cccc(Cl)c1CNc1ncnc2c1N=C[N]2 |
|
AD11220 | 1.92 | 390.39 | C20H22O8 | COc1cc(C=CC(=O)OC2CC3C(C(=O)O)=COC(O)C3C2C)ccc1O |