aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17231 | 3.95 | 546.75 | C32H50O7 | CC(=O)OC(CC(C)C1C(=O)C(O)C2(C)C3=CCC4C(C)(C)C(O)CCC45CC35CCC12C)C(O)C(C)(C)O |
|
AD17232 | 4.77 | 1281.09 | C65H55O17N9Cl2 | 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)NC1CCNCC1)NC3=O |
|
AD17233 | 5.13 | 287.82 | C17H14NClS | CSc1ccc(Cc2c[nH]c3cccc(Cl)c23)cc1 |
|
AD17234 | 2.86 | 269.35 | C14H13N4S | C1=Nc2c(CCSCc3ccccc3)ncnc2[N]1 |
|
AD17235 | 2.49 | 343.38 | C19H21O5N | COc1cc(C=CC(=O)NCCc2ccc(O)c(OC)c2)ccc1O |
|
AD17236 | 7.42 | 552.67 | C35H36O6 | O=C(O)Cc1cccc(-c2cc(CCCCCCCc3ccc(O)c(-c4cccc(CC(=O)O)c4)c3)ccc2O)c1 |
|
AD17237 | -0.31 | 162.14 | C6H10O5 | CC(O)(CC(=O)O)CC(=O)O |
|
AD17238 | 1.98 | 330.38 | C19H22O5 | COC1CC2(C)CC(=O)C3CC2(O)C13COC(=O)c1ccccc1 |
|
AD17239 | 1.58 | 329.35 | C18H19O5N | C=CC1C(O)OC=C2C(=O)N3CCc4cc(O)c(O)cc4C3CC21 |
|
AD17240 | 8.67 | 717.2 | C37H30O2N7F3ClS | Nc1sc(-c2ccc(C(=O)NCCCCCCNc3nc(Cl)nc4c3N=C[N]4)cc2)c(-c2cccc(C(F)(F)F)c2)c1C(=O)c1ccccc1 |