aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03831 | 1.53 | 214.25 | C11H12N5 | CCCCC#CC1=Nc2c(N)ncnc2[N]1 |
|
AD03832 | 0.3 | 168.57 | C6H3N5Cl | Nc1nc(Cl)nc2c1C=N[N]2 |
|
AD03833 | 2.9 | 584.71 | C29H48O10N2 | CCOC(=O)NN(CCC1CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C1O)C(=O)OCC |
|
AD03834 | -0.35 | 156.19 | C5H6ON3S | CSC1=C(C(N)=O)N=C[N]1 |
|
AD03835 | -1.32 | 574.7 | C24H42O8N6S | CC(=O)NC(C=NNC(=O)CCCCCNC(=O)CCCCC1SCC2NC(=O)NC21)C(O)OC(CO)CO |
|
AD03836 | 2.43 | 554.73 | C29H50O8N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)N=C2OC1(C)C=C2C |
|
AD03837 | 3.36 | 184.24 | C13H12O | COc1ccc(-c2ccccc2)cc1 |
|
AD03838 | 3.37 | 403.37 | C8H2N2ClI2 | ClC1=Nc2cc(I)c(I)cc2[N]1 |
|
AD03839 | -0.65 | 352.42 | C15H20O4N4S | CC(=O)NC(CSCc1c(C)c(=O)n2c(=O)c(C)c(C)n12)C(N)=O |
|
AD03840 | 1.78 | 499.57 | C25H33O6N5 | CC1C(N)CC(NC(=O)C(CCN)OC(=O)Nc2ccccc2)C(O)C1OC(=O)Nc1ccccc1 |