aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03971 | 1.08 | 273.33 | C16H19O3N | Oc1ccc2c3c1OC1C(O)CCC4C(C2)NCCC341 |
|
AD03972 | -1.05 | 197.2 | C5H5ON6S | Nc1nc2c(c([S+](N)[O-])n1)N=C[N]2 |
|
AD03973 | 3.41 | 508.74 | C30H52O6 | CC(=CC(O)C(O)C(C)(C)O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C |
|
AD03974 | 1.93 | 234.28 | C11H10O2N2S | C=CCN1C(=O)C(=Cc2ccco2)N=C1S |
|
AD03975 | 1.29 | 325.36 | C15H17ON8 | CNC(=O)c1cnn(-c2nc3c(c(NC4CCCC4)n2)N=C[N]3)c1 |
|
AD03976 | -0.63 | 126.11 | C5H6O2N2 | Cc1cc(=O)[nH]c(=O)[nH]1 |
|
AD03977 | 2.66 | 251.72 | C13H14ON3Cl | Cc1cc(OCc2cn(C)nn2)cc(C)c1Cl |
|
AD03978 | -1.22 | 352.34 | C16H20O7N2 | COc1ccccc1CNC(=O)C1=CC(O)C(O)C(OCC(N)=O)O1 |
|
AD03979 | 1.45 | 270.27 | C13H12O2N5 | Oc1ccc(CCNc2ncnc3c2N=C[N]3)cc1O |
|
AD03980 | 4.42 | 286.79 | C16H11N2ClS | N#Cc1c(-c2ccc(Cl)cc2)c2c([nH]c1=S)CCC2 |