aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02941 | -0.23 | 117.15 | C5H11O2N | CCOCCNC=O |
|
AD02942 | 1.45 | 127.17 | C5H5ONS | On1ccccc1=S |
|
AD02943 | 0.0 | 210.11 | C6H5O3N2F3 | O=c1[nH]cc(OCC(F)(F)F)c(=O)[nH]1 |
|
AD02944 | 1.79 | 330.22 | C14H20O3NBr | CC1OC(O)CC(C)(NCc2cccc(Br)c2)C1O |
|
AD02945 | 0.88 | 124.14 | C7H8O2 | OCc1ccc(O)cc1 |
|
AD02946 | 2.82 | 317.45 | C20H29O3 | C=C1CC23CCC4C(C)(C(=O)[O-])CCCC4(C)C2CCC1(O)C3 |
|
AD02947 | 1.71 | 181.26 | C9H11ONS | COC(=S)NCc1ccccc1 |
|
AD02948 | 4.19 | 371.45 | C17H19O2N6S | CCCCCNc1nc2c(c(SCc3ccc([N+](=O)[O-])cc3)n1)N=C[N]2 |
|
AD02949 | -1.14 | 239.23 | C10H13O4N3 | NC(Cc1ccc(O)cn1)C(=O)NCC(=O)O |
|
AD02950 | 2.8 | 410.55 | C23H38O6 | CCC1CC(C)C(=O)C=CC(C)=CC(CO)C(CC)OC(=O)CC(O)C(C)C1O |