aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32211 | 0.85 | 189.24 | C10H13N4 | C[N+](C)=CNc1ccc(N)cc1C#N |
|
AD32212 | -0.3 | 209.31 | C12H21ON2 | C=CCCCC[NH+]1CC2(CN(C=O)C2)C1 |
|
AD32213 | -0.3 | 209.31 | C12H21ON2 | C=CCCC[NH+]1CC2(CCN(C=O)C2)C1 |
|
AD32214 | -0.33 | 128.06 | C2H9O4P | CO[PH](O)(O)OC |
|
AD32215 | 0.8 | 240.25 | C12H10ON5 | O=c1[nH]cnc2c1N=C(NCc1ccccc1)[N]2 |
|
AD32216 | 2.37 | 204.22 | C12H12O3 | CCc1cc(=O)oc2cc(C)cc(O)c12 |
|
AD32217 | 2.44 | 194.23 | C11H14O3 | CC=Cc1cc(OC)c(O)c(OC)c1 |
|
AD32218 | 1.25 | 228.26 | C12H12ON4 | O=C1C=CC2NN=NC2N1Cc1ccccc1 |
|
AD32219 | 1.58 | 234.19 | C6H3N5F3S | Nc1nc(SC(F)(F)F)nc2c1N=C[N]2 |
|
AD32220 | 1.33 | 229.24 | C12H11O2N3 | Cc1ccc(C(=O)Nc2cc[nH]c(=O)n2)cc1 |