aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23131 | 4.41 | 318.8 | C19H19O3Cl | CCOc1ccc(Cc2ccc3c(c2Cl)OCC3OC)cc1 |
|
AD23132 | 8.25 | 654.94 | C41H58O3N4 | CC(=O)c1ccccc1-n1cc(CNC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C2(C)CC3)nn1 |
|
AD23133 | 1.14 | 167.17 | C7H9O2N3 | CNNc1ccc([N+](=O)[O-])cc1 |
|
AD23134 | 0.93 | 235.23 | C12H7N6 | N#Cc1ccc(C2=N[N]c3ncnc(N)c32)cc1 |
|
AD23135 | 2.37 | 279.11 | C13H6N5Cl2 | Nc1ncnc2c1C(c1ccc(Cl)c(Cl)c1)=N[N]2 |
|
AD23136 | -1.35 | 362.15 | C11H10O9NP2 | COP(=O)([O-])OC(CN1C(=O)c2ccccc2C1=O)P(=O)([O-])[O-] |
|
AD23137 | 4.42 | 255.75 | C17H14NCl | Cn1ccc2cc(Cc3ccccc3Cl)ccc21 |
|
AD23138 | 1.65 | 246.47 | C7H3N4ClBr | Nc1nc(Cl)c2c(n1)[N]C=C2Br |
|
AD23139 | -0.61 | 178.17 | C7H8ON5 | CC(O)C1=N[N]c2ncnc(N)c21 |
|
AD23140 | 5.78 | 1356.63 | C69H61O16N10Cl3 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NN=Cc4ccc(-c5ccc(Cl)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |