aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07611 | 2.9 | 324.38 | C19H20O3N2 | CCCCC1(O)C(=O)N(c2ccccc2)N(c2ccccc2)C1=O |
|
AD07612 | -6.61 | 970.87 | C34H60O17N12P2 | NCCN(CCN)CCNC(=O)Cc1cn(C2CC(O)C(COP(=O)(O)OC3CC(n4cc(CC(=O)NCCN(CCN)CCN)c(=O)[nH]c4=O)OC3COP(=O)(O)O)O2)c(=O)[nH]c1=O |
|
AD07613 | 2.33 | 268.4 | C15H28O2N2 | CCCCC1CCC(N(CC(=O)NC)C(C)=O)CC1 |
|
AD07614 | -3.77 | 279.26 | C11H19O8 | O=C([O-])COC1C(O)C(CO)CC(OCCO)C1O |
|
AD07615 | -1.63 | 288.3 | C12H20O6N2 | CCCCNC(=O)C1=CC(O)C(O)C(OCC(N)=O)O1 |
|
AD07616 | 1.57 | 177.97 | C4H3I | C=CC#CI |
|
AD07617 | 1.71 | 206.2 | C11H10O4 | CC(=O)Oc1ccc(C=CC(=O)O)cc1 |
|
AD07618 | 1.8 | 220.22 | C12H12O4 | COC(=O)C=Cc1ccc(OC(C)=O)cc1 |
|
AD07619 | 3.12 | 253.34 | C17H19ON | COc1ccc(CC2NCCc3ccccc32)cc1 |
|
AD07620 | 0.01 | 286.76 | C14H19O3N2Cl | NC1CC(N)C(OCc2ccc(Cl)cc2)C(O)C1O |