aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43551 | 0.76 | 144.24 | C6H12N2S | NC(=S)NC1CCCC1 |
|
AD43552 | 1.78 | 309.35 | C16H17ON6 | Cc1ccccc1C(C)(C)C(=O)n1c(N)c2c(nc1=N)[N]C=N2 |
|
AD43553 | 2.94 | 324.55 | C11H5N6ClBr | Clc1nc2c(c(Nc3cnccc3Br)n1)N=C[N]2 |
|
AD43554 | 2.61 | 366.14 | C12H9ON5I | COc1cccc(Nc2ncnc3c2C(I)=C[N]3)n1 |
|
AD43555 | 2.71 | 318.33 | C15H17O2N5F | CC(C)(C)OC(=O)N1CCC(=Nc2ncnc3c2C(F)=C[N]3)C1 |
|
AD43556 | 2.5 | 283.34 | C13H11N6S | Cc1cccc(NC(=S)Nc2ncnc3c2N=C[N]3)c1 |
|
AD43557 | 1.77 | 314.43 | C16H30O4N2 | CC(C(=O)NCCO)C1CCN(C(=O)OC(C)(C)C)C(C)C1 |
|
AD43558 | 2.47 | 311.37 | C16H13O2N3S | Cn1c(=O)c(C(=O)Nc2ccc(S)cc2)nc2ccccc21 |
|
AD43559 | 2.26 | 312.38 | C14H14N7S | CN(C)c1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD43560 | 2.4 | 330.37 | C14H13N7FS | CN(C)c1ccc(NC(=S)Nc2nc(F)nc3c2N=C[N]3)cc1 |