aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12831 | 3.67 | 518.35 | C27H21O7NCl2 | CC(=O)NC1CC(=O)OCC(O)c2ccc3c(c2Cl)C2=CC=CC2(O)C3Oc2c(O)cc1cc2Cl |
|
AD12832 | 1.61 | 266.29 | C13H12N7 | Nc1nc(NN=CCc2ccccc2)nc2c1N=C[N]2 |
|
AD12833 | 0.16 | 350.32 | C17H18O8 | COc1ccc(C(=O)OC2C3C=COC(O)C3C3(CO)OC23)cc1O |
|
AD12834 | 1.51 | 232.75 | C12H21ON2Cl | CCC1CCC(C(=O)NCC(C)Cl)NC1 |
|
AD12835 | 2.78 | 285.34 | C17H19O3N | CNC(=O)c1cc(C(C)(C)c2ccc(O)cc2)ccc1O |
|
AD12836 | 0.64 | 180.22 | C6H6N5S | Cn1c(N)nc2c(c1=S)N=C[N]2 |
|
AD12837 | 2.44 | 86.18 | C6H14 | CCCC(C)C |
|
AD12838 | 3.5 | 354.4 | C20H16N7 | Nc1nc(NN=CC=C(c2ccccc2)c2ccccc2)nc2c1N=C[N]2 |
|
AD12839 | 2.82 | 259.29 | C12H8N4FS | Fc1cccc(SCc2ncnc3c2N=C[N]3)c1 |
|
AD12840 | 2.53 | 518.69 | C30H46O7 | CC(=CC1CC(C)(O)C2C(CC3(C)C4C(O)C=C5C(CC(O)C(O)C5(C)C)C4(C)C(=O)CC23C)O1)CO |