aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37801 | 2.14 | 241.7 | C11H8O2NClS | NS(=O)(=O)c1cccc2c(Cl)cccc12 |
|
AD37802 | 0.38 | 268.29 | C13H17O3N2F | O=C(NCCO)c1ccc(N2CCOCC2)cc1F |
|
AD37803 | 0.08 | 275.24 | C12H11O4N4 | COc1ccc(OC(=O)NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD37804 | 0.7 | 276.27 | C14H13O3N2F | O=C(NCCO)c1cccn(-c2ccc(F)cc2)c1=O |
|
AD37805 | 0.56 | 258.28 | C14H14O3N2 | O=C(NCCO)c1ccc(=O)n(-c2ccccc2)c1 |
|
AD37806 | 0.79 | 263.27 | C13H14O2N3F | O=C(NCCO)c1cn(Cc2ccccc2F)cn1 |
|
AD37807 | 2.27 | 247.32 | C12H13ON3S | Cc1c(C(=O)Nc2ccc(S)cc2)ncn1C |
|
AD37808 | 2.27 | 247.32 | C12H13ON3S | Cc1cn(C)nc1C(=O)Nc1ccc(S)cc1 |
|
AD37809 | 0.89 | 273.35 | C12H19O4NS | COc1cc(C)c(S(=O)(=O)NCCO)c(C)c1C |
|
AD37810 | 1.58 | 242.23 | C13H10O3N2 | NC(=O)c1ccc(-c2ccc3c(c2)OCO3)cn1 |