aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33501 | 3.46 | 191.3 | C11H13NS | Sc1ccc(NC2=CCCC2)cc1 |
|
AD33502 | 3.06 | 237.29 | C14H13N4 | Cc1ccc(Nc2ncnc3c2C=C[N]3)c(C)c1 |
|
AD33503 | 2.89 | 241.25 | C13H10N4F | Cc1ccc(Nc2ncnc3c2C=C[N]3)cc1F |
|
AD33504 | 2.89 | 241.25 | C13H10N4F | Cc1ccc(F)c(Nc2ncnc3c2C=C[N]3)c1 |
|
AD33505 | 2.81 | 229.29 | C11H9N4S | Cc1sccc1Nc1ncnc2c1C=C[N]2 |
|
AD33506 | 2.89 | 241.25 | C13H10N4F | Cc1cc(F)cc(Nc2ncnc3c2C=C[N]3)c1 |
|
AD33507 | 3.06 | 237.29 | C14H13N4 | Cc1ccc(Nc2ncnc3c2C=C[N]3)cc1C |
|
AD33508 | 3.06 | 235.34 | C11H15N4S | CCCC(CC)Sc1ncnc2c1N=C[N]2 |
|
AD33509 | 2.89 | 241.25 | C13H10N4F | Cc1ccc(F)cc1Nc1ncnc2c1C=C[N]2 |
|
AD33510 | 1.44 | 212.36 | C13H26ON | OCC[NH2+]C1CCCC2(CCCCC2)C1 |