aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34741 | -0.36 | 251.29 | C12H17O3N3 | O=C(NCCO)c1ccncc1N1CCOCC1 |
|
AD34742 | -0.1 | 253.28 | C10H11O3N3S | O=S(=O)(NCCO)c1ccc2nccnc2c1 |
|
AD34743 | 0.05 | 246.27 | C12H14O2N4 | O=C(NCCO)c1nccn1Cc1ccccn1 |
|
AD34744 | -0.01 | 232.24 | C11H12O2N4 | O=C(NCCO)c1cncn1-c1ccccn1 |
|
AD34745 | 0.95 | 223.28 | C11H17O2N3 | Cc1nn(C2CCOCC2)c(C)c1C(N)=O |
|
AD34746 | 0.05 | 246.27 | C12H14O2N4 | O=C(NCCO)c1cn(Cc2ccccn2)cn1 |
|
AD34747 | 1.04 | 230.27 | C12H14ON4 | Cc1nn(Cc2cccnc2)c(C)c1C(N)=O |
|
AD34748 | -0.04 | 239.27 | C11H17O3N3 | O=C(NCCO)c1cn(C2CCOCC2)cn1 |
|
AD34749 | 1.04 | 231.25 | C12H13O2N3 | COc1cccc(Cn2ccnc2C(N)=O)c1 |
|
AD34750 | 1.04 | 230.27 | C12H14ON4 | Cc1nn(Cc2ccccn2)c(C)c1C(N)=O |