aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16761 | -1.41 | 179.14 | C6H5O2N5 | Nc1ncnc2[nH]c(=O)[nH]c(=O)c12 |
|
AD16762 | -0.35 | 229.63 | C8H8O2N5Cl | Nc1nc(O)c2c(n1)[nH]c(=O)n2CCCl |
|
AD16763 | 0.39 | 233.24 | C8H5ON6S | Nc1ncnc2c1-c1c(O)nc(S)nc1[N]2 |
|
AD16764 | 3.68 | 208.3 | C16H16 | Cc1ccccc1Cc1ccc2c(c1)CC2 |
|
AD16765 | 3.39 | 254.33 | C17H18O2 | COc1ccc(Cc2ccc3c(c2)CC3)c(OC)c1 |
|
AD16766 | 2.77 | 403.43 | C21H25O7N | CC(C)OC(=O)c1cn(C2CC2)c2ccc(OCCOCCC(=O)O)cc2c1=O |
|
AD16767 | 1.72 | 329.31 | C17H15O6N | O=C(O)CC(NC(=O)c1cccc(-c2ccccc2O)c1)C(=O)O |
|
AD16768 | -2.15 | 184.11 | C5H4O4N4 | Cn1c(=O)[nH]c2no[n+]([O-])c2c1=O |
|
AD16769 | 0.89 | 259.39 | C13H29O2N3 | CCCCCCNCCN(C)CCC(N)C(=O)O |
|
AD16770 | 0.8 | 214.26 | C11H18O4 | C=CC(C)(O)CCC=C(CO)C(=O)OC |