aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44151 | 1.75 | 402.4 | C21H22O8 | COC(=O)CC1C(C(=O)OC)=COC(O)C1=CCOC(=O)C=Cc1ccccc1 |
|
AD44152 | 2.06 | 388.42 | C21H24O7 | COC(=O)C1=CC(O)CC2C3(C)CC(c4ccoc4)OC(=O)C3=CC(O)C12C |
|
AD44153 | -0.12 | 145.18 | C5H7O2NS | O=C1OCN2CSCC12 |
|
AD44154 | 2.03 | 424.77 | C19H12O3N4F3Cl | Nc1nc(-n2cc(C=O)c(=O)c3cc(F)c(N4CC(O)C4)c(Cl)c32)c(F)cc1F |
|
AD44155 | 1.21 | 444.5 | C23H24O2N8 | [NH3+]CCNC(=O)Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1 |
|
AD44156 | -0.64 | 272.02 | C2H11O9P3 | COP(=O)(O)O[PH](O)(O)CP(=O)(O)O |
|
AD44157 | 1.9 | 388.46 | C21H28O5N2 | CC(NC(CCc1ccccc1)C(=O)O)C(=O)N1C(C(=O)O)CC2CCCC21 |
|
AD44158 | 2.09 | 396.44 | C22H24O5N2 | O=C(O)CN1C(=O)C(NC(CCc2ccccc2)C(=O)O)CCc2ccccc21 |
|
AD44159 | 2.11 | 470.52 | C25H30O7N2 | COc1cc2c(cc1OC)CN(C(=O)C(C)NC(CCc1ccccc1)C(=O)O)C(C(=O)O)C2 |
|
AD44160 | 2.29 | 402.49 | C22H30O5N2 | CC(NC(CCc1ccccc1)C(=O)O)C(=O)N1C(C(=O)O)CC2CCCCC21 |