aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16771 | 3.71 | 160.33 | C9H20S | CCCCCC(CC)SC |
|
AD16772 | -2.43 | 280.27 | C11H20O8 | O=C(O)COC1C(O)C(CO)CC(OCCO)C1O |
|
AD16773 | 3.0 | 268.31 | C17H16O3 | COc1cc2c(cc1O)-c1ccccc1CC=C2CO |
|
AD16774 | 1.75 | 404.5 | C23H32O6 | CC12C(O)CC3C(CCC4CC(O)CCC43C=O)C1(O)CCC2C1=CC(=O)OC1 |
|
AD16775 | 0.08 | 214.0 | C5H2ON4Br | O=c1[nH]cnc2c1C(Br)=N[N]2 |
|
AD16776 | -1.1 | 164.15 | C6H6ON5 | CNC1=N[N]c2nc[nH]c(=O)c21 |
|
AD16777 | 3.83 | 264.78 | C14H13N2ClS | CCSc1cnc(Cc2ccccc2Cl)nc1 |
|
AD16778 | 2.44 | 212.32 | C10H16ON2S | CCCCCCSc1cc[nH]c(=O)n1 |
|
AD16779 | 2.24 | 330.34 | C20H14O3N2 | O=C1Nc2ccccc2C1=C1C(=O)Nc2ccc(C#CCCO)cc21 |
|
AD16780 | 3.26 | 273.32 | C13H11O2N3S | CCOc1ccc(-c2noc(-c3cscn3)n2)cc1 |