aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20411 | 2.9 | 344.32 | C18H16O7 | COc1cc(-c2cc(=O)c3c(O)c(OC)c(OC)cc3o2)ccc1O |
|
AD20412 | 15.21 | 1833.63 | C103H181O18N9 | CCCCCCCCC=CCCCCCCCC(=O)OC1CCC2(C)C(=CC(C(=O)CCCCCCCC=CCCCCCCCC)C3C2CCC2(C)C(C(C)CCC(=O)NCCCC(=O)NCC(=O)NC(COCCC(=O)NCCCNC(=O)CCCCO)(COCCC(=O)NCCCNC(=O)CCCCO)COCCC(=O)NCCCNC(=O)CCCCO)CCC32)C1 |
|
AD20413 | 3.48 | 410.78 | C17H18O4N5PCl | COP(=O)(OC)OCC(Cc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD20414 | -1.23 | 396.44 | C20H28O8 | CC1=CC(=O)C(O)C2(C)C1CC1OC(=O)C(O)C3C(CO)C(O)C(O)C2C13C |
|
AD20415 | 6.13 | 470.69 | C30H46O4 | CC1=C(C)C2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C(=O)O)CC1 |
|
AD20416 | 3.75 | 319.21 | C13H9N3SBr | Brc1ccccc1CSc1ncnc2c1C=C[N]2 |
|
AD20417 | 3.85 | 352.83 | C20H17ON4Cl | C=NN=c1[nH]nc(-c2ccc(Cl)cc2)cc1Cc1ccccc1OC |
|
AD20418 | 2.86 | 282.25 | C16H10O5 | O=C(O)c1ccccc1-c1oc2ccccc2c(=O)c1O |
|
AD20419 | 0.37 | 718.79 | C36H43O7N8F | NC1CC(NC(=O)CCc2cn(Cc3ccc(CN4CCN(c5cc6c(cc5F)c(=O)c(C(=O)O)cn6C5CC5)CC4)cc3)nn2)C(O)C(O)C1O |
|
AD20420 | 1.72 | 266.29 | C13H12N7 | Cc1ccc(C=NNc2nc(N)c3c(n2)[N]C=N3)cc1 |