aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40061 | 2.3 | 265.7 | C13H12O2N3Cl | COc1ccc(COc2nc(Cl)ncc2N)cc1 |
|
AD40062 | 2.34 | 263.32 | C13H13O3NS | Cc1ccc(S(=O)(=O)Oc2ccccc2N)cc1 |
|
AD40063 | 2.16 | 287.34 | C14H13O2N3S | Cc1cc2c(N)ccnc2n1S(=O)(=O)c1ccccc1 |
|
AD40064 | 1.86 | 273.32 | C13H11O2N3S | Nc1cnc2c(ccn2S(=O)(=O)c2ccccc2)c1 |
|
AD40065 | 1.91 | 298.33 | C15H16O2N5 | COc1ccccc1OCCN(C)c1ncnc2c1N=C[N]2 |
|
AD40066 | 2.38 | 277.35 | C14H15O3NS | O=S(=O)(CCc1ccccc1)Nc1ccc(O)cc1 |
|
AD40067 | 0.38 | 289.35 | C12H19O5NS | COc1ccc(OCCCS(=O)(=O)NCCO)cc1 |
|
AD40068 | 2.12 | 312.4 | C11H14O2N5S2 | O=S(=O)(Nc1[nH]c(=S)nc2c1N=C[N]2)C1CCCCC1 |
|
AD40069 | 1.73 | 298.37 | C10H12O2N5S2 | O=S(=O)(Nc1[nH]c(=S)nc2c1N=C[N]2)C1CCCC1 |
|
AD40070 | 1.9 | 273.38 | C11H15O3NS2 | O=S(=O)(Nc1ccc(S)cc1)C1CCOCC1 |