aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD25401 | 1.56 | 125.2 | C6H7NS | Nc1ccccc1S |
|
AD25402 | 1.02 | 138.17 | C7H10ON2 | CN(NO)c1ccccc1 |
|
AD25403 | 0.72 | 170.56 | C6H3ON4Cl | On1cnc2c(Cl)ncnc21 |
|
AD25404 | -2.33 | 106.1 | C3H8O3N | [NH3+]C(CO)C(=O)O |
|
AD25405 | 0.37 | 181.2 | C6H5ON4S | CSC1=Nc2c(nc[nH]c2=O)[N]1 |
|
AD25406 | -1.16 | 182.18 | C7H10O2N4 | CN1C(=O)C2NC=NC2N(C)C1=O |
|
AD25407 | 0.31 | 168.18 | C5H4ON4S | O=c1[nH]cnc2[nH]c(=S)[nH]c12 |
|
AD25408 | 0.56 | 194.28 | C11H18ON2 | CCC12CN3CN(CC(C)(C3)C1=O)C2 |
|
AD25409 | -0.87 | 169.18 | C7H11O2N3 | CNc1cc(=O)n(C)c(=O)n1C |
|
AD25410 | -1.94 | 169.14 | C5H7O2N5 | NC(=O)CNc1cn[nH]c(=O)n1 |