aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD13691 | 2.13 | 264.32 | C14H20O3N2 | O=C(O)NCCCCCC(=O)NCc1ccccc1 |
|
AD13692 | 2.27 | 282.31 | C14H19O3N2F | O=C(O)NCCCCCC(=O)NCc1ccc(F)cc1 |
|
AD13693 | 3.82 | 630.69 | C35H38O9N2 | COC(=O)C(Cc1cn(CC=C(C)C)c2ccccc12)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD13694 | 3.89 | 630.69 | C35H38O9N2 | COC(=O)C(Cc1c[nH]c2c(CC=C(C)C)cccc12)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD13695 | 1.82 | 446.42 | C23H18O6N4 | O=C1c2c(c3c4cc(O)ccc4[nH]c3c3[nH]c4ccc(O)cc4c23)C(=O)N1NC(CO)CO |
|
AD13696 | 0.83 | 348.35 | C18H20O7 | COc1ccc(C(=O)OCC23C4OC5(O)CC(C)(O4)C2(O)CC53)cc1 |
|
AD13697 | -0.14 | 219.23 | C9H11ON6 | CCNC(=O)CC1=Nc2c(N)ncnc2[N]1 |
|
AD13698 | 3.29 | 377.36 | C19H14O2N6F | O=C(COc1ccc(Nc2ncnc3c2N=C[N]3)cc1)Nc1ccc(F)cc1 |
|
AD13699 | -1.8 | 2214.8 | C108H133O30N20Cl | CCCC=CC=CC(=O)NC(CC(N)=O)C(=O)CC1C(=O)NC(c2ccc(O)cc2)C(=O)NC(CCCN)C(=O)NC(C(C)O)C(=O)NC(c2ccc(O)cc2)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(Cc2ccccc2)C(=O)NC(CCCN)C(=O)NC(c2ccc(O)cc2)C(=O)NC(C(C)O)C(=O)NC(c2ccc(O)cc2)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(c2ccc(O)c(Cl)c2)C(=O)OC1C(N)=O |
|
AD13700 | 0.64 | 248.27 | C11H14O2N5 | CCCCCNc1nc(=O)c2c(c(=O)[nH]1)N=C[N]2 |