aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21881 | 1.78 | 206.24 | C12H14O3 | CC(=CCOC(=O)c1ccccc1)CO |
|
AD21882 | -0.05 | 452.19 | C9H19O11N4P3 | COP(=O)(O)OP(=O)(O)OP(=O)(O)OCCc1cn(CCNC(C)=O)nn1 |
|
AD21883 | 1.59 | 203.25 | C11H13ON3 | CCC(=O)NCc1nc2ccccc2[nH]1 |
|
AD21884 | 2.89 | 277.33 | C17H15ON3 | Nc1nc(CO)cc(-c2cccc(-c3ccccc3)c2)n1 |
|
AD21885 | -3.35 | 1427.59 | C68H90O15N20 | CC(C)CC(NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1cnc[nH]1)NC(=O)C(CCC(N)=O)NC(=O)CCC(N)=O)C(=O)NC(CCCNC(=N)N)C(=O)N1CCCC1C(=O)NCC(N)=O |
|
AD21886 | 1.69 | 135.17 | C8H9ON | ON=CCc1ccccc1 |
|
AD21887 | 4.8 | 587.74 | C31H47O7N4 | COC1=CCC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC2CC(OCC3=C[N]N=N3)OC12 |
|
AD21888 | 3.36 | 280.35 | C16H12ON2S | O=C1C(=Cc2ccccc2)N=C(S)N1c1ccccc1 |
|
AD21889 | 2.96 | 299.31 | C14H22O4NP | COP(=O)(Cc1ccccc1)NC(C)C(=O)OC(C)C |
|
AD21890 | -2.77 | 582.58 | C24H30O6N12 | O=C(NCc1cn(CCO)nn1)c1cc(C(=O)NCc2cn(CCO)nn2)cc(C(=O)NCc2cn(CCO)nn2)c1 |