aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16741 | 2.11 | 185.61 | C9H8O2NCl | O=C(O)NCc1cccc(Cl)c1 |
|
AD16742 | 0.57 | 228.2 | C10H10O2N2F2 | NC(=O)CCNC(=O)c1ccc(F)c(F)c1 |
|
AD16743 | 4.25 | 234.34 | C18H18 | c1ccc(C2CC2)c(Cc2ccc3c(c2)CC3)c1 |
|
AD16744 | 3.47 | 776.03 | C41H69O9N5 | CCCc1ccc(-n2cc(COCC3CN(C)CC(C)C(O)C(C)CC(C)(OC)C(OC4OC(C)CC(N(C)C)C4O)C(C)C(O)C(C)C(=O)O3)nn2)cc1 |
|
AD16745 | 2.07 | 704.91 | C36H60O8N6 | COC1(C)CC(C)C(O)C(C)CN(C)C(Cn2cc(-c3ccccn3)nn2)COC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |
|
AD16746 | 0.17 | 370.49 | C20H34O6 | CC1(O)CC23CC(O)C4(O)C(CC(O)C4(C)C)C(C)(O)C2CCC1C3O |
|
AD16747 | 2.56 | 457.45 | C24H19O5N5 | CN(C)CC(=O)NN1C(=O)c2c(c3c4cccc(O)c4[nH]c3c3[nH]c4c(O)cccc4c23)C1=O |
|
AD16748 | 2.46 | 498.48 | C25H20O5N7 | O=C(Cc1ccc(Nc2ncnc3c2N=C[N]3)cc1)Nc1ccc(CC(=O)ON2C(=O)CCC2=O)cc1 |
|
AD16749 | 3.33 | 289.33 | C16H19O4N | CCCCCC(=O)Nc1cc2ccc(O)c(C)c2oc1=O |
|
AD16750 | 1.84 | 278.29 | C15H12ON5 | CNc1nc(C#Cc2ccc(OC)cc2)nc2c1N=C[N]2 |