aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33121 | 1.74 | 191.23 | C11H13O2N | C=CCCOc1ccc(C(N)=O)cc1 |
|
AD33122 | 0.95 | 221.21 | C10H10ON4F | C=CC(O)CNc1ncnc2c1C(F)=C[N]2 |
|
AD33123 | 1.0 | 238.66 | C10H9ON5Cl | C=CC(O)CNc1nc(Cl)nc2c1N=C[N]2 |
|
AD33124 | 0.59 | 204.23 | C11H12O2N2 | Cc1cc(C#N)cc(C(=O)NCCO)c1 |
|
AD33125 | 1.51 | 197.62 | C9H8ON3Cl | COc1nc(N)c(C#N)c(C)c1Cl |
|
AD33126 | 1.74 | 204.62 | C10H5N4Cl | N#Cc1cnc2nc(Cl)ccc2c1N |
|
AD33127 | 2.35 | 200.16 | C9H7N2F3 | N#CCc1ccc(C(F)(F)F)cc1N |
|
AD33128 | 0.84 | 221.28 | C10H11ON3S | N#Cc1ccccc1NC(=S)NCCO |
|
AD33129 | 1.94 | 191.25 | C10H9ONS | CC#CC(=O)Nc1ccc(S)cc1 |
|
AD33130 | 2.07 | 206.27 | C10H10ON2S | CC(C#N)C(=O)Nc1ccc(S)cc1 |