aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08471 | 1.13 | 218.2 | C8H7O4FS | COC(=O)c1ccc(S(=O)(=O)F)cc1 |
|
AD08472 | 0.37 | 95.1 | C5H5ON | O=c1cccc[nH]1 |
|
AD08473 | 0.89 | 156.17 | C9H6N3 | C#CC1=C[N]c2nccc(N)c21 |
|
AD08474 | 2.37 | 257.05 | C8H6N2I | Cc1ccnc2c1C(I)=C[N]2 |
|
AD08475 | 3.35 | 171.33 | C11H25N | CCCCCCCCCCNC |
|
AD08476 | 2.3 | 403.42 | C21H19O3N6 | COC(=O)COc1cc(CNC2=Nc3c(N)ncnc3[N]2)ccc1-c1ccccc1 |
|
AD08477 | 2.42 | 518.65 | C23H34O9S2 | C=C1CC23CCC4C(C)(C(=O)OCCC(S(=O)(=O)[O-])S(=O)(=O)[O-])CCCC4(C)C2CCC1(O)C3 |
|
AD08478 | 3.5 | 442.3 | C19H18O2N6Br | O=C(OCc1ccccc1Br)N1C2CCC1C(Nc1ncnc3c1N=C[N]3)C2 |
|
AD08479 | 0.07 | 132.16 | C6H12O3 | CC1CCC(O)OC1O |
|
AD08480 | 4.36 | 738.92 | C41H58O10N2 | COC(=O)NC1C(C)OC(OC2CC=C(C)C3C=CC4C(O)C(C)CC(C)C4C3(C)C(=O)C3=C(O)C4(CC(C=O)=CC(O)C4C=C2C)OC3)CC1(C)N |