aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43681 | 2.2 | 315.4 | C16H23ON6 | CC1CCC(C(C)C)C(C(=O)n2c(N)c3c(nc2=N)[N]C=N3)C1 |
|
AD43682 | 1.57 | 329.37 | C14H13O2N6S | O=S(=O)(NC1CC1)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD43683 | 1.88 | 328.38 | C15H14O2N5S | O=S(=O)(NC1CC1)c1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD43684 | 2.81 | 328.44 | C18H20O2N2S | O=C(Nc1ccc(S)cc1)C1COCCN1Cc1ccccc1 |
|
AD43685 | 1.9 | 342.23 | C15H20O3NBr | O=C(NCCO)C1(Cc2cccc(Br)c2)CCOCC1 |
|
AD43686 | 1.77 | 314.43 | C16H30O4N2 | CC(C)C1(C(=O)NCCO)CCN(C(=O)OC(C)(C)C)CC1 |
|
AD43687 | 1.86 | 317.31 | C15H18O3NF3 | O=C(NCCO)C1(c2ccccc2C(F)(F)F)CCOCC1 |
|
AD43688 | 1.8 | 344.2 | C14H18O4NBr | CC(C)C(=O)OC(C(=O)NCCO)c1ccc(Br)cc1 |
|
AD43689 | 2.06 | 307.37 | C15H17O4NS | Cc1ccccc1Oc1cccc(S(=O)(=O)NCCO)c1 |
|
AD43690 | 2.3 | 352.12 | C11H7ON5I | Oc1cncc(Nc2ncnc3c2C(I)=C[N]3)c1 |