aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20421 | 2.13 | 177.23 | C8H7N3S | S=c1[nH]nc(-c2ccccc2)[nH]1 |
|
AD20422 | -0.94 | 485.51 | C21H27O5N9 | CCC(=O)Nc1cc(C(=O)NCc2cn(CCO)nn2)cc(C(=O)NCc2cn(CCO)nn2)c1 |
|
AD20423 | 3.16 | 370.52 | C18H30O4N2S | CNS(=O)(=O)NC(=O)CCCCCCCCCCOc1ccccc1 |
|
AD20424 | 2.54 | 179.65 | C11H10NCl | Clc1cccc(C2C=CCN2)c1 |
|
AD20425 | 6.03 | 351.58 | C21H41ON3 | CCCCCCCCCCCCCCCCCCn1cc(CO)nn1 |
|
AD20426 | 6.69 | 365.61 | C22H43ON3 | CCCCCCCCCCCCCCCCCCn1cc(COC)nn1 |
|
AD20427 | 2.38 | 231.32 | C12H13N3S | CNc1nc(C2NCc3ccccc32)cs1 |
|
AD20428 | 0.95 | 314.33 | C15H22O7 | COc1cc(OC2CC(O)CC(CO)O2)cc(OC)c1OC |
|
AD20429 | 1.33 | 173.22 | C10H11N3 | NCc1ccc(-n2ccnc2)cc1 |
|
AD20430 | 1.28 | 631.8 | C32H57O11N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OCC2CO2)CC(C)C(=O)C(C)C(O)C1(C)O |