aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17641 | 2.85 | 233.25 | C14H9N4 | C1=Cc2c(ncnc2-c2cc3ccccc3[nH]2)[N]1 |
|
AD17642 | -0.63 | 344.27 | C14H14O6N2F2 | NC(=O)COC1OC(C(=O)Nc2ccc(F)cc2F)=CC(O)C1O |
|
AD17643 | 2.93 | 195.22 | C13H9ON | N#Cc1ccccc1-c1ccc(O)cc1 |
|
AD17644 | 5.37 | 530.75 | C32H50O6 | CC(=O)OC1C2OC3(C(C)(C)O)CCC(C)(O3)C2C2(C)CCC34CC35CCC(O)C(C)(C)C5CCC4C12C |
|
AD17645 | 2.92 | 402.4 | C21H22O8 | COc1c(O)cc(C2OCC3C(c4ccc5c(c4)OCO5)OCC23)c(O)c1OC |
|
AD17646 | 2.28 | 124.21 | C7H8S | Cc1ccc(S)cc1 |
|
AD17647 | 0.92 | 550.72 | C27H42O6N4S | CNC(=O)CSCCNC(=O)CCNC(=O)C(O)C(C)(C)CN(CCCc1ccccc1)C(=O)CC(C)=O |
|
AD17648 | 1.55 | 254.37 | C15H26O3 | CC(C)(O)C1CCC2(C)C3CC(O)C2(C)C(O)C13 |
|
AD17649 | -0.21 | 181.21 | C5H11O4NS | CCCC(=O)NS(=O)(=O)OC |
|
AD17650 | 2.55 | 266.39 | C12H14ON2S2 | Cn1c(S)nc2sc3c(c2c1=O)CCCCC3 |