aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30461 | -0.4 | 241.26 | C7H9O2N6S | CN(C)S(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD30462 | 0.75 | 207.2 | C7H7O2NF2S | NS(=O)(=O)Cc1ccc(F)c(F)c1 |
|
AD30463 | 0.54 | 240.27 | C8H10O2N5S | CC(C)S(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD30464 | 0.37 | 229.22 | C7H6O2N4FS | CS(=O)(=O)Nc1ncnc2c1C(F)=C[N]2 |
|
AD30465 | 0.15 | 226.24 | C7H8O2N5S | CCS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD30466 | 0.01 | 194.16 | C5H4O2N2F2S | NS(=O)(=O)c1ncc(F)cc1F |
|
AD30467 | 0.75 | 211.16 | C6H4O2NF3S | NS(=O)(=O)c1cc(F)cc(F)c1F |
|
AD30468 | -1.03 | 202.23 | C9H16O4N | COC(=O)C1CC([NH3+])CC1C(=O)OC |
|
AD30469 | -0.41 | 192.29 | C11H18N3 | NC1CC[NH+](Cc2ccncc2)CC1 |
|
AD30470 | -0.7 | 212.27 | C10H18O2N3 | CC1C[NH+](CCc2nnco2)CC(C)O1 |