aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43511 | 2.9 | 326.36 | C17H17ON5F | CC(C)Cc1ccc(CC(=O)Nc2nc(F)nc3c2N=C[N]3)cc1 |
|
AD43512 | 1.94 | 323.38 | C17H19ON6 | CC(C)Cc1ccc(CC(=O)n2c(N)c3c(nc2=N)[N]C=N3)cc1 |
|
AD43513 | 2.03 | 325.37 | C17H19O2N5 | CC(C)Cc1ccc(CC(=O)Nc2ncnc3[nH]c(=O)[nH]c23)cc1 |
|
AD43514 | 3.22 | 296.3 | C13H10O2N2F2S | O=C(Nc1ccc(S)cc1)c1ccc(OC(F)F)cn1 |
|
AD43515 | 2.5 | 283.34 | C13H11N6S | Cc1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD43516 | 1.04 | 232.24 | C11H11N5F | FCC1C2CN(c3ncnc4c3N=C[N]4)CC12 |
|
AD43517 | 2.84 | 336.41 | C16H20O4N2S | CC(C)(C)OC(=O)N1C(=O)CCC1C(=O)Nc1ccc(S)cc1 |
|
AD43518 | 2.26 | 331.76 | C16H14O2N5Cl | O=C(CCCc1ccc(Cl)cc1)Nc1ncnc2[nH]c(=O)[nH]c12 |
|
AD43519 | 2.17 | 329.77 | C16H14ON6Cl | N=c1nc2c(c(N)n1C(=O)CCCc1ccc(Cl)cc1)N=C[N]2 |
|
AD43520 | 2.4 | 343.35 | C19H13O2N5 | O=C(Nc1ncnc2[nH]c(=O)[nH]c12)C1c2ccccc2-c2ccccc21 |