aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06491 | 4.16 | 338.79 | C20H15O2N2Cl | Clc1ccccc1Cc1ccc(-c2ccc3c(c2)OCCO3)nn1 |
|
AD06492 | -1.95 | 374.37 | C8H10O4N10S2 | NS(=O)(=O)c1nnc(N(Cc2cn(O)nn2)Cc2cn(O)nn2)s1 |
|
AD06493 | 2.35 | 261.31 | C12H11O2N3S | CC(=O)Nc1ccc(NC(=O)c2cscn2)cc1 |
|
AD06494 | -3.91 | 880.84 | C30H36O19N6S3 | O=C(COCCOCC(=O)Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c12)NCCNC(=O)C1CC(O)C(O)C(NC(=O)c2cc(=O)[nH]c(=O)[nH]2)C1 |
|
AD06495 | 0.18 | 216.22 | C10H10ON5 | Cc1ccc(NC2=N[N]C(C(N)=O)=N2)cc1 |
|
AD06496 | 0.87 | 231.24 | C11H11O2N4 | COC(=O)C1=NC(Nc2ccc(C)cc2)=N[N]1 |
|
AD06497 | -0.27 | 273.24 | C10H9O2N8 | CCOC(=O)c1cn(-c2nc(N)c3c(n2)[N]C=N3)nn1 |
|
AD06498 | 0.43 | 163.18 | C7H9N5 | CCn1cnc2c(N)ncnc21 |
|
AD06499 | 0.24 | 163.24 | C6H13O2NS | COC(=O)C(N)CCSC |
|
AD06500 | 6.08 | 317.82 | C22H16NCl | Clc1cccc2[nH]cc(Cc3ccc(-c4ccccc4)cc3)c12 |