aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03191 | 3.29 | 402.41 | C22H18O4N4 | COc1ccc2cc3[n+](cc2c1OCC1=C[N]N=N1)CCc1cc2c(cc1-3)OCO2 |
|
AD03192 | 3.71 | 474.56 | C27H30O4N4 | Cc1cc2nc3c(=O)n(COC(=O)C(C)c4ccc(CC(C)C)cc4)c(=O)nc-3n(C)c2cc1C |
|
AD03193 | -1.02 | 405.41 | C19H23O7N3 | O=c1ccn(C2OC(C(O)CNCC3COc4ccccc4O3)CC2O)c(=O)[nH]1 |
|
AD03194 | 0.37 | 162.1 | C5H4O2N2F2 | O=c1nc(OC(F)F)cc[nH]1 |
|
AD03195 | 1.21 | 134.2 | C5H10O2S | CCC(SC)C(=O)O |
|
AD03196 | 1.51 | 220.18 | C11H8O5 | Cc1c(O)ccc2c(C(=O)O)cc(=O)oc12 |
|
AD03197 | 2.99 | 202.25 | C13H14O2 | COCc1ccc2cc(OC)ccc2c1 |
|
AD03198 | -0.48 | 150.15 | C5H6N6 | Nc1nc(N)c2[nH]ncc2n1 |
|
AD03199 | 3.32 | 324.33 | C19H16O5 | CC(=O)CC(c1ccc(O)cc1)c1c(O)c2ccccc2oc1=O |
|
AD03200 | -0.31 | 177.15 | C6H5ON6 | N=C(NO)c1ncnc2c1N=C[N]2 |