aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36561 | 0.72 | 247.25 | C12H13O3N3 | COC(=O)c1ccc(-c2cn(CCO)nn2)cc1 |
|
AD36562 | 0.63 | 247.25 | C12H13O3N3 | O=C(OCc1ccccc1)c1cn(CCO)nn1 |
|
AD36563 | 0.49 | 269.3 | C12H19O4N3 | CCOC(=O)C(CCc1cn(C)nn1)C(=O)OCC |
|
AD36564 | 0.63 | 247.25 | C12H13O3N3 | O=C(OCc1cn(CCO)nn1)c1ccccc1 |
|
AD36565 | 0.89 | 255.32 | C12H21O3N3 | CC(C)(C)OC(=O)C(C)(C)c1cn(CCO)nn1 |
|
AD36566 | 0.9 | 246.31 | C13H18ON4 | CN(Cc1ccccc1)Cc1cn(CCO)nn1 |
|
AD36567 | -0.03 | 261.3 | C10H15O5NS | COc1ccc(OC)c(S(=O)(=O)NCCO)c1 |
|
AD36568 | -0.03 | 261.3 | C10H15O5NS | COc1ccc(S(=O)(=O)NCCO)cc1OC |
|
AD36569 | -0.03 | 261.3 | C10H15O5NS | COc1ccc(S(=O)(=O)NCCO)c(OC)c1 |
|
AD36570 | -0.19 | 265.31 | C8H11O5NS2 | COC(=O)c1sccc1S(=O)(=O)NCCO |