aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23291 | 2.42 | 250.71 | C12H13N5Cl | CN(c1nc(Cl)nc2c1N=C[N]2)C1CCCC1 |
|
AD23292 | -1.91 | 119.12 | C4H9O3N | O=CNCC(O)CO |
|
AD23293 | 0.14 | 121.09 | C4H5ONF2 | O=CNC1CC1(F)F |
|
AD23294 | 1.78 | 310.35 | C16H22O6 | COC(=O)CC(O)(CC(C)C)C(=O)OCc1ccc(O)cc1 |
|
AD23295 | 4.34 | 480.59 | C21H20O7S3 | COc1cc(C2c3cc4c(cc3C(SSS)C3COC(=O)C23)OCO4)cc(OC)c1O |
|
AD23296 | 6.52 | 563.99 | C31H24O4N3F2Cl | Cc1c(-c2ccc3c(c2)OCCO3)cccc1C(F)(F)Oc1cc(OCc2ccnc(C#N)c2)c(CN)cc1Cl |
|
AD23297 | 2.58 | 365.18 | C13H12N5I | Cn1cnc2c(NCc3cccc(I)c3)ncnc21 |
|
AD23298 | 0.95 | 249.72 | C10H12O3NClS | CN(CCO)S(=O)(=O)c1ccc(Cl)cc1 |
|
AD23299 | 0.9 | 219.25 | C8H7N6S | S=C=NCCNc1ncnc2c1N=C[N]2 |
|
AD23300 | 4.35 | 431.53 | C20H15N8S2 | S=C=Nc1ccc(NC(=S)NCc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1 |