aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06531 | 0.96 | 315.35 | C11H11O5N2S2 | COn1cc(CC(S)=NOS(=O)(=O)[O-])c2ccccc21 |
|
AD06532 | 3.59 | 748.79 | C41H40O10N4 | COC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD06533 | 1.15 | 133.15 | C7H7N3 | Nc1nccc2[nH]ccc12 |
|
AD06534 | 5.43 | 206.37 | C15H26 | CC=C(C)CCC=C(C)CCC=C(C)C |
|
AD06535 | 3.81 | 311.37 | C20H15N4 | C1=C(c2ccccc2)c2c(ncnc2N2CCc3ccccc32)[N]1 |
|
AD06536 | 3.57 | 301.33 | C17H13N6 | c1ccc(NC2=Nc3c(ncnc3Nc3ccccc3)[N]2)cc1 |
|
AD06537 | 2.89 | 336.12 | C11H7N5I | IC1=Nc2c(ncnc2Nc2ccccc2)[N]1 |
|
AD06538 | 2.6 | 237.24 | C13H9ON4 | O=C(Nc1cccc2ccccc12)C1=C[N]N=N1 |
|
AD06539 | 2.19 | 212.21 | C12H8O2N2 | Oc1cccc2nc3c(O)cccc3nc12 |
|
AD06540 | 6.01 | 439.59 | C27H31N6 | C1=Nc2c(nc(NCCC3CCCCC3)nc2NCC(c2ccccc2)c2ccccc2)[N]1 |