aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35951 | 3.12 | 232.31 | C12H12ON2S | COc1ccncc1Nc1ccc(S)cc1 |
|
AD35952 | 0.82 | 227.21 | C10H7ON6 | O=c1ccc(Nc2ncnc3c2N=C[N]3)c[nH]1 |
|
AD35953 | 2.54 | 216.24 | C12H12O2N2 | COc1ccncc1Nc1ccc(O)cc1 |
|
AD35954 | 3.32 | 220.3 | C11H12ON2S | Cc1noc(C)c1Nc1ccc(S)cc1 |
|
AD35955 | 2.55 | 250.28 | C14H12N5 | C(=CNc1ncnc2c1N=C[N]2)Cc1ccccc1 |
|
AD35956 | 2.92 | 262.66 | C12H6N5FCl | Fc1nc2c(c(Nc3cccc(Cl)c3)n1)N=C[N]2 |
|
AD35957 | 1.81 | 267.29 | C14H13ON5 | O=c1[nH]c2ncnc(NC=CCc3ccccc3)c2[nH]1 |
|
AD35958 | 2.04 | 261.67 | C12H8ON5Cl | O=c1[nH]c2ncnc(Nc3cccc(Cl)c3)c2[nH]1 |
|
AD35959 | 2.57 | 263.28 | C15H11ON4 | O=C1CCc2cc(Nc3ncnc4c3C=C[N]4)ccc21 |
|
AD35960 | 2.26 | 264.27 | C14H10ON5 | O=C1CCc2cc(Nc3ncnc4c3N=C[N]4)ccc21 |