aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00771 | 2.21 | 289.72 | C15H12O2N3Cl | COc1ccn2c(=O)n(Cc3ccccc3Cl)nc2c1 |
|
AD00772 | 5.63 | 344.5 | C22H32O3 | CC(=CCc1cc(O)c(C)cc1O)CCC=C(C)CC(=O)CC(C)C |
|
AD00773 | 2.87 | 863.11 | C44H74O11N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3cccc(-c4cn(CCCCCC(=O)NO)nn4)c3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD00774 | 1.51 | 589.77 | C30H55O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD00775 | 0.9 | 289.34 | C14H19O2N5 | CN(C)Cc1ccc(-c2cn(CCC(=O)NO)nn2)cc1 |
|
AD00776 | 1.22 | 182.17 | C9H10O4 | COc1cc(C=O)cc(OC)c1O |
|
AD00777 | 1.5 | 162.13 | C7H4O2N3 | O=[N+]([O-])c1cccc2c1N=C[N]2 |
|
AD00778 | 2.52 | 304.34 | C17H20O5 | COc1ccc(OCC(O)COc2ccc(OC)cc2)cc1 |
|
AD00779 | 2.45 | 295.96 | C8H8O2Br2 | OCCc1cc(Br)c(O)c(Br)c1 |
|
AD00780 | 6.39 | 422.46 | C27H19O2N2F | Oc1ccc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c(-c2ccc(F)cc2)n1 |