aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07831 | 4.01 | 308.31 | C14H9N3F3S | FC(F)(F)c1cccc(CSc2ncnc3c2C=C[N]3)c1 |
|
AD07832 | 4.15 | 338.36 | C20H18O5 | COc1ccc(-c2cc(O)c(-c3ccc(OC)cc3)c(O)c2O)cc1 |
|
AD07833 | 3.13 | 259.4 | C10H17ON3S2 | CCCCCCCC(=O)Nc1nnc(S)s1 |
|
AD07834 | 8.36 | 453.76 | C24H43ON3S2 | CCCCCCCCC=CCCCCCCCCCCCC(=O)Nc1nnc(S)s1 |
|
AD07835 | 2.06 | 155.63 | C9H10NCl | CNCc1ccc(Cl)cc1 |
|
AD07836 | 5.21 | 366.81 | C20H14N5FCl | Cc1cc(C)cc(-c2nc3c(c(Nc4ccc(Cl)cc4F)n2)N=C[N]3)c1 |
|
AD07837 | 1.66 | 1177.47 | C59H104O21N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(=O)N(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC4(C)OC)C3O)C2O)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD07838 | 4.93 | 474.68 | C29H46O5 | CC1(C)CCC2(C(=O)O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(O)C5CCC43C)C2C1 |
|
AD07839 | -0.79 | 102.14 | C4H10ON2 | NCCCC(N)=O |
|
AD07840 | -0.01 | 220.21 | C9H10O2N5 | CCNC(=O)CC1=Nc2c(O)ncnc2[N]1 |