aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15401 | -1.79 | 178.13 | C6H4O2N5 | NC(=O)C1=N[N]c2nc[nH]c(=O)c21 |
|
AD15402 | 2.42 | 278.22 | C12H7N5F3 | Fc1ccc(F)c(CNc2ncnc3c2N=C[N]3)c1F |
|
AD15403 | 3.48 | 292.49 | C14H32O2N2S | CCCCCCCCCCCCCCNS(N)(=O)=O |
|
AD15404 | 2.84 | 324.33 | C19H16O5 | CC(=O)C1Cc2c(c(O)cc3c(=O)c4ccccc4oc23)C(O)C1 |
|
AD15405 | 3.56 | 564.74 | C30H44O8S | CCC1OC(=O)CC(O)C(C)C(O)C(CCS(=O)(=O)c2ccc(C)cc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD15406 | 6.04 | 518.78 | C32H54O5 | CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2C(O)CC2C(C(C)=CCCC(C)(C)O)CCC23C)C1(C)C |
|
AD15407 | 4.58 | 360.47 | C20H18N5S | CC(Cc1ccccc1)Nc1nc(Sc2ccccc2)nc2c1N=C[N]2 |
|
AD15408 | 0.06 | 271.06 | C4H7O7N3P2 | COP(=O)([O-])OP(=O)(O)OCC1=C[N]N=N1 |
|
AD15409 | -0.08 | 102.13 | C5H10O2 | CC(=CCO)CO |
|
AD15410 | 0.9 | 179.22 | C10H13O2N | CNC(Cc1ccccc1)C(=O)O |