aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10091 | 3.91 | 363.5 | C21H33O4N | CC12CCC(O)CC1CCC1C2CCC2(C)C(C=C[N+](=O)[O-])CCC12O |
|
AD10092 | 3.75 | 158.24 | C12H14 | CC=Cc1cccc(C=CC)c1 |
|
AD10093 | 1.55 | 248.22 | C11H9O2N4F | O=C(Nc1ccc(F)cc1)Nc1cc[nH]c(=O)n1 |
|
AD10094 | 0.1 | 308.32 | C12H12O4N4S | C=NNS(=O)(=O)c1ccc(C=C2NC(=O)N(C)C2=O)cc1 |
|
AD10095 | 1.08 | 127.17 | C5H5ONS | Oc1cccnc1S |
|
AD10096 | 1.79 | 470.3 | C21H10O13 | O=C(O)c1cc(O)c(O)c(O)c1-c1c(O)c(O)c2oc(=O)c3cc(O)c(O)c4oc(=O)c1c2c43 |
|
AD10097 | 2.07 | 305.33 | C15H13N8 | CCNc1nc(-n2cc(-c3ccccn3)cn2)nc2c1N=C[N]2 |
|
AD10098 | 2.72 | 288.26 | C15H12O6 | OC1=C(O)C(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 |
|
AD10099 | -0.3 | 188.23 | C8H16O3N2 | CCCCC(N)C(=O)NCC(=O)O |
|
AD10100 | 0.56 | 376.36 | C19H20O8 | COc1cc(C=CC(=O)OCC23OC2C(O)C2C=COC(O)C23)ccc1O |