aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13551 | 2.85 | 348.48 | C21H32O4 | CC12OC3C4C5(C)CCC(O)CC5CCC4(O1)C1CCC2C1(C)C3O |
|
AD13552 | 2.49 | 298.29 | C17H14O5 | COc1cc(C)cc2c1C(=O)c1c(OC)cc(O)cc1C2=O |
|
AD13553 | 1.62 | 362.43 | C19H26O5N2 | CN(C)n1cc(C(=O)O)c(=O)c2cc(CCCCOCCCO)ccc21 |
|
AD13554 | -0.33 | 191.17 | C7H7ON6 | COC(=N)C1=C[N]c2nnnc(N)c21 |
|
AD13555 | 2.83 | 372.21 | C15H12ON6Br | Nc1nc(OCCc2c[nH]c3ccc(Br)cc23)nc2c1N=C[N]2 |
|
AD13556 | 2.72 | 327.76 | C16H12ON6Cl | Nc1nc(OCCc2c[nH]c3ccc(Cl)cc23)nc2c1N=C[N]2 |
|
AD13557 | 5.98 | 461.88 | C24H25O5NPCl | COP(=O)(NC(C(=O)OCc1cccc(Cl)c1)C(C)C)Oc1cccc2ccccc12 |
|
AD13558 | 1.03 | 652.69 | C32H44O14 | CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCC1C(C)C(OC(=O)CC2C(C(=O)OC)=COC(O)C2=CC)CC1C(CO)CO |
|
AD13559 | 0.24 | 128.16 | C4H4ON2S | NC(=O)c1cncs1 |
|
AD13560 | 2.39 | 314.34 | C18H18O5 | O=C(O)C1=COC(O)C2C3CC(CC12)C(c1ccccc1)=CO3 |