aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36221 | 1.4 | 236.22 | C11H6N7 | N#Cc1ccc(Nc2ncnc3c2N=C[N]3)cn1 |
|
AD36222 | 2.34 | 264.27 | C14H10ON5 | N#CCOc1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD36223 | 2.25 | 252.23 | C13H7N5F | C#Cc1ccc(Nc2nc(F)nc3c2N=C[N]3)cc1 |
|
AD36224 | 2.22 | 253.08 | C8H7N5Br | CC(C)=Nc1ncnc2c1N=C(Br)[N]2 |
|
AD36225 | 3.15 | 228.23 | C13H9ON2F | N#Cc1cc(F)cc(Nc2ccc(O)cc2)c1 |
|
AD36226 | 2.45 | 252.23 | C13H7N5F | N#Cc1cc(F)cc(Nc2ncnc3c2C=C[N]3)c1 |
|
AD36227 | 2.77 | 266.31 | C13H8N5S | C#Cc1cccc(Nc2[nH]c(=S)nc3c2N=C[N]3)c1 |
|
AD36228 | 2.72 | 251.24 | C14H8N4F | C#Cc1cccc(Nc2ncnc3c2C(F)=C[N]3)c1 |
|
AD36229 | 2.25 | 252.23 | C13H7N5F | C#Cc1cccc(Nc2nc(F)nc3c2N=C[N]3)c1 |
|
AD36230 | 3.1 | 231.32 | C12H13N3S | C=CCn1cc(Nc2ccc(S)cc2)cn1 |