aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16321 | 0.96 | 102.13 | C5H10O2 | CCOC(=O)CC |
|
AD16322 | 3.35 | 296.32 | C18H16O4 | C=CC(=O)c1ccc(O)c(-c2cc(C(O)C=C)ccc2O)c1 |
|
AD16323 | 3.62 | 311.33 | C14H12N3F3S | NCc1ccc(Cn2c(C(F)(F)F)nc3ccccc32)s1 |
|
AD16324 | -0.57 | 287.36 | C13H25O4N3 | CC(=O)NC(CCC(N)=O)C(=O)NCCCCCCO |
|
AD16325 | 2.64 | 409.17 | C13H10O2N6I | COc1ccc(NC(=O)Nc2nc(I)nc3c2N=C[N]3)cc1 |
|
AD16326 | 5.06 | 279.47 | C17H33N3 | CCCCCCCCCCCCCCc1cn(C)nn1 |
|
AD16327 | 2.51 | 361.42 | C18H25O4N4 | CC1CCC2C(C)C(=O)N(CC3=C[N]N=N3)C3OC4(C)CCC1C23OO4 |
|
AD16328 | 5.77 | 326.27 | C16H9NCl2S2 | Clc1ccc(-c2cnc(Cc3ccccc3Cl)s2)s1 |
|
AD16329 | 4.04 | 905.19 | C47H80O11N6 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CCCCCCCCC(=O)NO)nn4)cc3)C2O)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O |
|
AD16330 | 2.46 | 299.33 | C14H11O2N4S | COC(=O)c1ccc(CSc2ncnc3c2N=C[N]3)cc1 |