aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37401 | 2.04 | 240.26 | C14H12O2N2 | CCN1C(=O)c2cccc3c(N)ccc(c23)C1=O |
|
AD37402 | 2.13 | 244.09 | C9H10O2NBr | COC(=O)c1cc(N)c(C)c(Br)c1 |
|
AD37403 | 1.09 | 288.31 | C12H10O2N5S | NS(=O)(=O)c1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD37404 | 1.49 | 273.3 | C11H9ON6S | Cn1cc(Nc2[nH]c(=S)nc3c2N=C[N]3)ccc1=O |
|
AD37405 | 1.09 | 288.31 | C12H10O2N5S | NS(=O)(=O)c1cccc(Nc2ncnc3c2C=C[N]3)c1 |
|
AD37406 | 1.77 | 281.3 | C14H13ON6 | CC(=O)NCc1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD37407 | 1.48 | 275.68 | C12H8ON6Cl | Cn1cc(Nc2nc(Cl)nc3c2N=C[N]3)ccc1=O |
|
AD37408 | 1.77 | 281.3 | C14H13ON6 | CC(=O)NCc1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37409 | 0.49 | 286.31 | C14H16O2N5 | CCN(C)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD37410 | 0.58 | 267.27 | C13H11ON6 | NC(=O)C1=C(Nc2cccc(-n3cccn3)c2)[N]C=N1 |