aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10161 | 3.5 | 336.52 | C21H36O3 | CC(O)C1CCC2(O)C3CCC4CC(O)CCC4(C)C3CCC12C |
|
AD10162 | 0.63 | 166.23 | C8H14N4 | Cn1cc(C2CCCCN2)nn1 |
|
AD10163 | -1.03 | 157.09 | C4H3O4N3 | O=c1[nH]cc([N+](=O)[O-])c(=O)[nH]1 |
|
AD10164 | -0.92 | 102.14 | C4H10ON2 | CNC(=O)C(C)N |
|
AD10165 | 11.28 | 660.98 | C43H64O5 | CCCCCCCCCC=CC=CC=CC=CC=CC(=O)OCC(CO)OC(=O)C=CC=CC=CC=CC=CCCCCCCCCC |
|
AD10166 | 1.78 | 247.25 | C12H13O3N3 | CN(N=O)C(Cc1c[nH]c2ccccc12)C(=O)O |
|
AD10167 | 1.57 | 172.22 | C9H16O3 | CC(O)CCCCC=CC(=O)O |
|
AD10168 | -0.55 | 463.44 | C21H25O9N3 | COC(C(=NNC(N)=O)C(O)C(C)O)C1Cc2cc3cc(O)cc(O)c3c(O)c2C(=O)C1O |
|
AD10169 | 4.03 | 452.51 | C25H28O6N2 | COC(=O)CCCCNC(=O)Cc1onc(-c2ccc(OC)cc2)c1-c1ccc(OC)cc1 |
|
AD10170 | -0.89 | 103.12 | C4H9O2N | CNC(=O)CCO |