aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02701 | -0.15 | 387.19 | C14H15O6N2Br | NC(=O)COC1OC(C(=O)Nc2ccc(Br)cc2)=CC(O)C1O |
|
AD02702 | 5.42 | 234.43 | C17H30 | CC1(C)CCCC2(C)C1CCC1(C)CCCC12 |
|
AD02703 | 0.94 | 285.31 | C14H15O2N5 | COc1ccc(CNc2nc3c(c(=O)[nH]2)[N+](C)=C[N]3)cc1 |
|
AD02704 | -1.51 | 148.16 | C6H12O4 | OCC1OCCC(O)C1O |
|
AD02705 | 1.48 | 258.29 | C10H8N7S | Nc1nc(NN=Cc2ccsc2)nc2c1N=C[N]2 |
|
AD02706 | 3.31 | 246.34 | C11H8N3S2 | c1ccc(CSC2=Nc3cnsc3[N]2)cc1 |
|
AD02707 | 3.61 | 296.41 | C20H24O2 | C#CC1(O)CCC2C3CCc4cc(O)ccc4C3CCC21C |
|
AD02708 | -0.23 | 96.11 | CH4O3S | COS(=O)O |
|
AD02709 | 1.97 | 279.39 | C12H19N6S | NCCCCCCCSc1nc(N)c2c(n1)[N]C=N2 |
|
AD02710 | 1.41 | 205.32 | C9H19O2NS | CCCCOC(=O)C(N)CCSC |