aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08091 | 2.23 | 270.34 | C13H12N5S | CNC1=Nc2c(ncnc2SCc2ccccc2)[N]1 |
|
AD08092 | 0.53 | 193.2 | C10H11O3N | OCC1COC(c2ccccc2O)=N1 |
|
AD08093 | -1.18 | 366.37 | C17H22O7N2 | COc1cccc(CCNC(=O)C2=CC(O)C(O)C(OCC(N)=O)O2)c1 |
|
AD08094 | 3.37 | 298.29 | C17H14O5 | O=C(CCc1ccc2occc2c1)c1c(O)cc(O)cc1O |
|
AD08095 | 5.92 | 475.48 | C27H26O5NP | COP(=O)(NC(Cc1ccccc1)C(=O)OCc1ccccc1)Oc1cccc2ccccc12 |
|
AD08096 | 1.66 | 257.3 | C11H9N6S | Nc1nc2c(c(SCc3cccnc3)n1)N=C[N]2 |
|
AD08097 | 0.98 | 86.16 | C4H6S | C#CCSC |
|
AD08098 | 1.64 | 299.32 | C13H9O2N5S | N#CC1=C(N)NC(S)=C(C#N)C1c1ccc([N+](=O)[O-])cc1 |
|
AD08099 | 0.13 | 162.18 | C7H8N5 | CN(C)c1ncnc2c1C=N[N]2 |
|
AD08100 | 0.65 | 222.25 | C9H8O2N3S | O=[S](=O)Cc1cn(-c2ccccc2)nn1 |