aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17541 | 1.1 | 245.29 | C12H15ON5 | Cn1cnc2c(NC3CC4CCC3O4)ncnc21 |
|
AD17542 | 4.73 | 434.66 | C27H46O4 | CC(C)CCC(=O)C(C)C1(O)C(O)CC2C3CCC4CC(O)CCC4(C)C3CCC21C |
|
AD17543 | 1.97 | 559.74 | C28H47O9S | CC(C)C(C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(O)C(O)C3C(OS(=O)(=O)[O-])CC12O)CO |
|
AD17544 | 2.53 | 223.34 | C11H17N3S | c1sc(NC2CCC2)nc1C1CCCN1 |
|
AD17545 | 1.85 | 219.26 | C8H11N3F2S | CNc1nc(C2CC(F)(F)CN2)cs1 |
|
AD17546 | 2.14 | 209.32 | C10H15N3S | c1sc(NC2CC2)nc1C1CCCN1 |
|
AD17547 | 1.21 | 116.16 | C6H12O2 | CCC(C)C(=O)OC |
|
AD17548 | 1.2 | 268.3 | C13H14N7 | Nc1ccc(CCNc2nc(N)nc3c2N=C[N]3)cc1 |
|
AD17549 | 3.04 | 416.47 | C21H21O4N2FS | CN(C1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(F)cc1 |
|
AD17550 | 3.22 | 321.45 | C13H17N6S2 | N#CSCCCCCCCSc1nc(N)c2c(n1)[N]C=N2 |