aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20861 | 2.5 | 335.36 | C19H17O3N3 | Cc1ccc2c(c1)C(=C1Nc3ccccc3C1=NOCCO)C(=O)N2 |
|
AD20862 | 3.59 | 307.8 | C16H14O2NClS | O=C(O)C(c1ccccc1Cl)N1CCc2sccc2C1 |
|
AD20863 | 6.49 | 571.84 | C35H57O5N | CC1(C)CCC2(C(=O)NCCCCC(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |
|
AD20864 | 1.27 | 131.18 | C6H13O2N | CCCCCOC(N)=O |
|
AD20865 | 0.96 | 179.17 | C9H9O3N | O=CC(Cc1ccc(O)cc1)=NO |
|
AD20866 | -2.8 | 245.26 | C4H9O6N2S2 | COC(=O)C(CS(N)(=O)=O)N[S](=O)=O |
|
AD20867 | -0.9 | 178.13 | C6H4O2N5 | Nc1ncnc2c1C(C(=O)O)=N[N]2 |
|
AD20868 | 4.33 | 1328.05 | C65H52O21N8Cl2 | NC1C(=O)NC2Cc3ccc(c(Cl)c3)Oc3cc4cc(c3O)Oc3ccc(cc3Cl)C(O)C3NC(=O)C(NC(=O)C4NC(=O)C(NC2=O)c2cc(O)cc(c2)Oc2cc1ccc2O)c1ccc(O)c(c1)-c1c(O)cc(O)cc1C(C(=O)NC(CCC(=O)O)C(=O)O)NC3=O |
|
AD20869 | 1.65 | 374.39 | C20H22O7 | CC12CCC3(O)C(=O)OC(c4ccoc4)CC3(C)C1C1C=CC2(O)C(=O)O1 |
|
AD20870 | 3.34 | 276.75 | C14H15N5Cl | Clc1nc2c(c(NCCC3=CCCCC3)n1)N=C[N]2 |