aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01621 | 9.9 | 502.89 | C33H58OS | CC(C)CCCC(C)C1CCC2C3CC=C4CC(OCCCCCCS)CCC4(C)C3CCC12C |
|
AD01622 | 3.71 | 395.42 | C21H24O3NF3 | CC1OC(O)CC(C)(NCc2ccc(-c3ccc(C(F)(F)F)cc3)cc2)C1O |
|
AD01623 | 1.98 | 424.53 | C23H36O7 | CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD01624 | 2.84 | 788.97 | C39H66O10N4F2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(F)c(F)c2)C(C)C(O)C1(C)O |
|
AD01625 | 2.34 | 787.07 | C39H70O10N4S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)NCCc2cccs2)C(C)C(O)C1(C)O |
|
AD01626 | 2.71 | 546.7 | C28H50O10 | CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(O1)OC(C)C(O)C3O)C2O |
|
AD01627 | 1.32 | 246.23 | C11H13ON2F3 | CNC(=O)C(N)Cc1ccc(C(F)(F)F)cc1 |
|
AD01628 | -0.45 | 149.14 | C5H5N6 | Nc1nc(N)c2c(n1)[N]C=N2 |
|
AD01629 | -0.96 | 136.11 | C6H4O2N2 | C#Cc1c[nH]c(=O)[nH]c1=O |
|
AD01630 | 3.04 | 174.24 | C9H18O3 | CCCCCCCCOC(=O)O |