aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21741 | 0.95 | 202.25 | C9H18O3N2 | CCCCNC(=O)CCCNC(=O)O |
|
AD21742 | 2.14 | 294.35 | C15H22O4N2 | COc1ccc(CNC(=O)CCCCCNC(=O)O)cc1 |
|
AD21743 | 5.63 | 320.52 | C19H36N4 | CCCCCCCCCCCCCCNc1cc(NC)ncn1 |
|
AD21744 | 1.93 | 358.39 | C20H22O6 | COc1cc2c(c3occc13)CC(O)C1C23CCC(O)C1(C)C(=O)OC3 |
|
AD21745 | 2.9 | 418.53 | C24H34O6 | CC1CCCC=CC2OC(CC(O)CC=CC=CC(O)CC=CC=CC(=O)O1)C2O |
|
AD21746 | 1.4 | 224.25 | C12H10N5 | Cc1ccnc(C2=C[N]c3ncnc(N)c32)c1 |
|
AD21747 | 1.45 | 291.34 | C16H15N6 | CN(C#Cc1nc(N)c2c(n1)[N]C=N2)CCc1ccccc1 |
|
AD21748 | 1.72 | 290.93 | C6H3N4Br2 | Nc1ncnc2c1C(Br)=C(Br)[N]2 |
|
AD21749 | -4.74 | 875.06 | C37H66O12N10S | COCCNC(=O)CCC(NC(=O)C(NC(=O)C1CCCN1C(=O)C(NC(=O)C(NC(=O)C(N)CS)C(C)C)C(C)O)C(C)C)C(=O)NC(C(=O)NC(C)C(N)=O)C(C)O |
|
AD21750 | 2.93 | 698.66 | C27H44O13N2P2S | COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)C1(CCCCCCOc2ccccc2)CO1 |