aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33741 | 0.49 | 136.15 | C7H8ON2 | Cc1ccc(C(N)=O)cn1 |
|
AD33742 | 0.49 | 136.15 | C7H8ON2 | Cc1cccc(C(N)=O)n1 |
|
AD33743 | 0.49 | 136.15 | C7H8ON2 | Cc1cncc(C(N)=O)c1 |
|
AD33744 | 0.49 | 136.15 | C7H8ON2 | Cc1ccc(C(N)=O)nc1 |
|
AD33745 | -0.73 | 265.27 | C10H9O3N4S | NC(=O)C1=C(NS(=O)(=O)c2ccccc2)[N]C=N1 |
|
AD33746 | 0.41 | 246.66 | C7H5O2N5ClS | CS(=O)(=O)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD33747 | 0.8 | 260.69 | C8H7O2N5ClS | CCS(=O)(=O)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD33748 | 0.93 | 254.3 | C9H12O2N5S | CCCCS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD33749 | -0.99 | 245.28 | C8H13O3N4S | CCCCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |
|
AD33750 | 0.67 | 231.32 | C10H17O3NS | CC1(C)C2CCC1(CS(N)(=O)=O)C(=O)C2 |