aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21931 | -0.29 | 253.26 | C11H15O4N3 | Cc1nc(O)nc(O)c1C=CC(=O)NCC(C)O |
|
AD21932 | 4.07 | 1185.25 | C61H68O17N8 | CCCCCCC=Cc1cc2ccc1Oc1cc3cc(c1O)Oc1ccc(cc1)C(O)C(NC(=O)C(CC(C)C)NC)C(=O)NC(CC(N)=O)C(=O)NC3C(=O)NC1C(=O)NC(C(=O)NC(C(=O)O)c3cc(O)cc(O)c3-c3cc1ccc3O)C2O |
|
AD21933 | 1.2 | 295.36 | C11H21O6NS | COS(=O)(=O)NC(=O)CCCCCCCCC(=O)O |
|
AD21934 | 3.39 | 250.33 | C11H14ON4S | [N-]=[N+]=NCCCCC(=O)Nc1ccc(S)cc1 |
|
AD21935 | 2.99 | 486.4 | C23H29O4N5Cl2 | CCc1c(Cl)c(OCCCn2cc(CCN3CCC(N)CC3)nn2)c(Cl)c(O)c1C(=O)O |
|
AD21936 | 6.36 | 360.63 | C20H42O2NS | CCCCCCCCCCN(CCCCCCCCCC)[S](=O)=O |
|
AD21937 | 3.88 | 282.34 | C18H18O3 | COc1ccc(C=CC(C)=O)cc1OCc1ccccc1 |
|
AD21938 | 0.03 | 166.19 | C5H4N5S | NSc1ncnc2c1C=N[N]2 |
|
AD21939 | 7.02 | 516.76 | C32H52O5 | CC(=O)OC1CC2(C)C3=C(CCC2C(C)(C)C1O)C1(C)CCC(C)(C(C)C(C)C)C(C(=O)O)C1(C)CC3 |
|
AD21940 | 6.56 | 486.69 | C30H46O5 | C=C(C)C1CCC2(C(=O)O)CCC3(C)C(CCC4C5(C)C(CC(=O)O)OC(C)(C)C5CCC43C)C12 |