aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17741 | 2.8 | 246.31 | C14H18O2N2 | CCCOc1ccc(Cc2c(O)n[nH]c2C)cc1 |
|
AD17742 | 1.87 | 317.31 | C12H9O3N6S | Nc1nc2c(c(SCc3cc([N+](=O)[O-])ccc3O)n1)N=C[N]2 |
|
AD17743 | 4.18 | 453.37 | C24H26O4N2Cl2 | O=C(COC(=O)CCCc1ccc(N(CCCl)CCCl)cc1)Nc1ccc(O)cc1 |
|
AD17744 | 3.14 | 632.66 | C26H35O7N6F3S | O=C(CCCCC1SCC2NC(=O)NC21)NCCOCCOCCOc1cc(C2(C(F)(F)F)N=N2)ccc1CON=CO |
|
AD17745 | 1.53 | 277.32 | C15H19O4N | CC(=Cc1ccc(O)c(O)c1)C(=O)NC1CCCC1O |
|
AD17746 | 4.75 | 692.76 | C35H47O3N7Cl2S | NCCCN(CCCN)C(=O)NCCCCOc1cc(Cl)c(CN2CSCC2C(=O)N2CCN(C3CC3)c3ccccc32)cc1Cl |
|
AD17747 | 2.65 | 160.21 | C8H16O3 | CCCCCCCOC(=O)O |
|
AD17748 | 2.58 | 270.24 | C15H10O5 | O=c1cc(-c2ccccc2)oc2c(O)c(O)cc(O)c12 |
|
AD17749 | 5.74 | 590.8 | C34H54O8 | CCCCCCCC(=O)OCC1CC(O)C2CC(C)C(CC=CC=CC(C)CC3CC(O)CC(CC=CC(=O)O1)O3)O2 |
|
AD17750 | 4.3 | 324.37 | C20H14N5 | C1=Nc2c(ncnc2NCc2c3ccccc3cc3ccccc23)[N]1 |