aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10221 | 1.8 | 287.69 | C13H8ON6Cl | O=C(NNc1ncnc2c1N=C[N]2)c1ccc(Cl)cc1 |
|
AD10222 | 2.61 | 1690.66 | C83H98O22N14Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NC(=O)C(CCCCN)NC(=O)C(Cc4ccc(O)cc4)NC(=O)C(N)CC(C)C)c4cc(O)cc(O)c4-c4cc3ccc4O)C(OC3CC(C)(N)C(O)C(C)O3)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD10223 | 3.47 | 222.37 | C15H26O | CC(C)C1CCC(C)C23CCC(C)(O)C2C13 |
|
AD10224 | 1.21 | 167.16 | C8H9O3N | COc1cccc(C=NO)c1O |
|
AD10225 | 4.46 | 522.33 | C22H17ON7I | COc1ccc(-c2cnn(-c3nc4c(c(NCc5cccc(I)c5)n3)N=C[N]4)c2)cc1 |
|
AD10226 | 4.79 | 376.44 | C24H18N5 | C1=Nc2c(ncnc2NC(c2ccccc2)(c2ccccc2)c2ccccc2)[N]1 |
|
AD10227 | 0.08 | 214.22 | C10H14O5 | CC1(O)CCC2C(C(=O)O)=COC(O)C21 |
|
AD10228 | 7.39 | 718.97 | C44H62O8 | CC=C(C)C(=O)OC1C(OC(=O)C=Cc2ccccc2)C23C(O)CC4(C)C5(C)CCC6C(C)(C)C(O)CCC6(C)C5CCC4(OC2O)C3CC1(C)C |
|
AD10229 | 4.44 | 328.41 | C20H24O4 | CCOc1ccc(CCC(=O)c2c(O)cc(C(C)C)cc2O)cc1 |
|
AD10230 | 3.16 | 419.42 | C21H19O4N6 | COc1ccc(NC(=O)COc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1OC |