aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33671 | -1.03 | 244.3 | C12H16N6 | C[NH+]1CC2CN(c3ncnc4c3N=C[N]4)CC2C1 |
|
AD33672 | -0.31 | 237.24 | C10H16ON2F3 | O=CN1CC2(C1)C[NH+](CCCC(F)(F)F)C2 |
|
AD33673 | 0.28 | 232.3 | C11H22O4N | CCOC(=O)CCC([NH3+])CCC(=O)OCC |
|
AD33674 | -0.5 | 246.32 | C12H18N6 | CN(c1ncnc2c1N=C[N]2)C1CCC[NH+](C)C1 |
|
AD33675 | -0.01 | 237.35 | C12H17ON2S | O=CN1CC2CC(C1)[NH+](Cc1cccs1)C2 |
|
AD33676 | -0.01 | 237.35 | C12H17ON2S | O=CN1CC2CC[NH+](Cc3cccs3)C2C1 |
|
AD33677 | 0.14 | 237.35 | C12H17ON2S | O=CN1CCC2C1CC[NH+]2Cc1cccs1 |
|
AD33678 | 0.14 | 237.35 | C12H17ON2S | O=CN1CC2CCC(C1)[NH+]2Cc1cccs1 |
|
AD33679 | -0.09 | 237.35 | C12H17ON2S | Cc1ccc(C[NH+]2CC3(CN(C=O)C3)C2)s1 |
|
AD33680 | 0.0 | 237.35 | C12H17ON2S | O=CN1CCC2(C1)C[NH+](Cc1ccsc1)C2 |