aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37381 | 1.47 | 257.36 | C11H19O2N3S | CC(C)N(C(C)C)S(=O)(=O)c1ccc(N)nc1 |
|
AD37382 | 1.57 | 271.33 | C12H11N6S | CSc1ccc(-n2c(N)c3c(nc2=N)[N]C=N3)cc1 |
|
AD37383 | 1.92 | 268.26 | C13H10O2N5 | COC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD37384 | 1.77 | 267.32 | C14H15N6 | Cc1cc(C)c(-n2c(N)c3c(nc2=N)[N]C=N3)c(C)c1 |
|
AD37385 | 1.44 | 249.31 | C13H19O2N3 | CCOC(=O)C1CCN(c2cncc(N)c2)CC1 |
|
AD37386 | 1.49 | 267.27 | C13H11ON6 | CNC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD37387 | 1.23 | 253.25 | C12H9ON6 | NC(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37388 | 1.88 | 287.69 | C13H8ON6Cl | NC(=O)c1ccccc1Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD37389 | 1.81 | 273.71 | C13H10N6Cl | Cc1ccc(-n2c(N)c3c(nc2=N)[N]C=N3)c(Cl)c1 |
|
AD37390 | 1.83 | 281.3 | C14H13ON6 | CN(C)C(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |