aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39201 | 1.9 | 314.76 | C10H5O2N5ClS2 | O=S(=O)(Nc1nc(Cl)nc2c1N=C[N]2)c1cccs1 |
|
AD39202 | 0.42 | 315.33 | C14H11O3N4S | NC(=O)C1=C(NS(=O)(=O)c2ccc3ccccc3c2)[N]C=N1 |
|
AD39203 | 1.84 | 308.73 | C12H7O2N5ClS | O=S(=O)(Nc1nc(Cl)nc2c1N=C[N]2)c1ccccc1 |
|
AD39204 | 0.19 | 307.36 | C13H15O3N4S | Cc1cc(C)c(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)c(C)c1 |
|
AD39205 | 1.84 | 308.73 | C12H7O2N5ClS | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1ccc(Cl)cc1 |
|
AD39206 | -0.08 | 299.72 | C11H8O3N4ClS | NC(=O)C1=C(NS(=O)(=O)c2ccc(Cl)cc2)[N]C=N1 |
|
AD39207 | 1.51 | 303.32 | C13H11O3N4S | COc1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1 |
|
AD39208 | 1.8 | 300.32 | C13H10O2N5S | O=S(=O)(C=Cc1ccccc1)Nc1ncnc2c1N=C[N]2 |
|
AD39209 | 2.28 | 271.29 | C8H8O2NF3S2 | O=S(=O)(CC(F)(F)F)Nc1ccc(S)cc1 |
|
AD39210 | 1.8 | 302.34 | C13H12O2N5S | Cc1ccc(C)c(S(=O)(=O)Nc2ncnc3c2N=C[N]3)c1 |