aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39141 | 2.29 | 199.26 | C12H13N3 | CCc1ccc(-c2ccc(N)nn2)cc1 |
|
AD39142 | 0.16 | 270.29 | C9H12O3N5S | CCOCCS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD39143 | 2.07 | 270.34 | C10H10O3N2S2 | Cc1oncc1S(=O)(=O)Nc1ccc(S)cc1 |
|
AD39144 | 0.31 | 279.7 | C10H10O5NClS | O=C(O)c1ccc(Cl)c(S(=O)(=O)NCCO)c1 |
|
AD39145 | 1.85 | 198.22 | C12H10ON2 | NC(=O)c1cccnc1-c1ccccc1 |
|
AD39146 | 2.23 | 272.38 | C9H8O2N2S3 | O=S(=O)(Nc1ccc(S)cc1)c1nccs1 |
|
AD39147 | 1.85 | 198.22 | C12H10ON2 | NC(=O)c1ccccc1-c1cccnc1 |
|
AD39148 | 0.31 | 279.7 | C10H10O5NClS | O=C(O)c1cc(S(=O)(=O)NCCO)ccc1Cl |
|
AD39149 | -0.31 | 284.28 | C9H10O4N5S | COC(=O)CCS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD39150 | 1.95 | 206.27 | C10H10ON2S | Cc1cc(C(N)=O)c(-n2cccc2)s1 |