aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41111 | 2.02 | 228.25 | C13H12O2N2 | Nc1ccc(C(=O)OCc2ccccc2)cn1 |
|
AD41112 | 2.27 | 222.25 | C13H10N4 | Nc1nc(-c2cccnc2)nc2ccccc12 |
|
AD41113 | 2.35 | 217.3 | C11H11N3S | Nc1cc(SCc2ccccc2)ncn1 |
|
AD41114 | 2.35 | 217.3 | C11H11N3S | Nc1nccc(SCc2ccccc2)n1 |
|
AD41115 | 2.12 | 215.26 | C12H13ON3 | CCOc1ccc(-c2ccc(N)nn2)cc1 |
|
AD41116 | 1.61 | 247.71 | C9H10O2N3ClS | CCOC(=O)c1c(N)nc(SC)nc1Cl |
|
AD41117 | 2.52 | 214.05 | C10H5N3Cl2 | Nc1nc2c(Cl)cccc2nc1Cl |
|
AD41118 | 2.46 | 224.66 | C8H7N2F2ClS | CSc1cnc(Cl)c(C(N)(F)F)c1 |
|
AD41119 | 2.23 | 218.63 | C10H9N2F2Cl | NC(F)(F)c1cc(Cl)nc2c1CCC2 |
|
AD41120 | 2.31 | 237.26 | C14H11ON3 | Nc1ccc2ccn(C(=O)c3ccccc3)c2n1 |