aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34931 | -0.46 | 234.21 | C11H10O4N2 | O=C1Nc2c(C(=O)NCCO)cccc2C1=O |
|
AD34932 | -0.93 | 241.27 | C9H11O3N3S | O=C(NCCO)c1cnc2n(c1=O)CCS2 |
|
AD34933 | -2.45 | 238.21 | C8H10O3N6 | Cn1nnc2c(C(=O)NCCO)ncn2c1=O |
|
AD34934 | -0.07 | 234.25 | C12H14O3N2 | CN1C(=O)Cc2ccc(C(=O)NCCO)cc21 |
|
AD34935 | 1.44 | 213.65 | C8H4ON3ClS | NC(=O)c1cc2c(Cl)ncnc2s1 |
|
AD34936 | 0.1 | 240.65 | C10H9O2N4Cl | O=C(NCCO)c1cnc2ccc(Cl)nn12 |
|
AD34937 | -0.35 | 233.23 | C11H11O3N3 | O=C(NCCO)c1ccc2c(=O)[nH]cnc2c1 |
|
AD34938 | -0.35 | 233.23 | C11H11O3N3 | O=C(NCCO)c1cc2cccnc2[nH]c1=O |
|
AD34939 | -0.01 | 234.25 | C12H14O3N2 | CN1Cc2cccc(C(=O)NCCO)c2C1=O |
|
AD34940 | -0.15 | 241.32 | C10H15O2N3S | CN1CCc2nc(C(=O)NCCO)sc2C1 |