aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35231 | 0.81 | 214.23 | C11H10ON4 | N#Cc1ccccc1-c1cn(CCO)nn1 |
|
AD35232 | 0.92 | 213.24 | C12H11ON3 | C#Cc1cccc(-c2cn(CCO)nn2)c1 |
|
AD35233 | 1.0 | 231.29 | C11H21O4N | CCOC(=O)CCC(N)CCC(=O)OCC |
|
AD35234 | 1.6 | 219.69 | C9H10O2NClS | Cc1cc(S(N)(=O)=O)c(C)cc1Cl |
|
AD35235 | 1.64 | 226.08 | C8H5O2NCl2S | NS(=O)(=O)c1cccc(Cl)c1Cl |
|
AD35236 | 1.64 | 226.08 | C8H5O2NCl2S | NS(=O)(=O)c1ccc(Cl)cc1Cl |
|
AD35237 | 0.86 | 216.65 | C8H5O2N2ClS | N#Cc1ccc(S(N)(=O)=O)c(Cl)c1 |
|
AD35238 | -0.03 | 244.25 | C9H9O3N2FS | N#Cc1cc(S(=O)(=O)NCCO)ccc1F |
|
AD35239 | 1.32 | 213.26 | C9H11O3NS | C=CCS(=O)(=O)Nc1ccc(O)cc1 |
|
AD35240 | -0.03 | 240.28 | C10H12O3N2S | N#Cc1ccc(CS(=O)(=O)NCCO)cc1 |