aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22941 | 3.25 | 534.6 | C29H28O2N9 | O=C(NCCNC(=O)c1nc2c(c(NCC(c3ccccc3)c3ccccc3)n1)N=C[N]2)NCc1ccccn1 |
|
AD22942 | -0.78 | 269.31 | C11H19O3N5 | COC(=O)C(CCCCN)NC(=O)c1cn(C)nn1 |
|
AD22943 | 4.44 | 320.79 | C19H18O2FCl | FC1(CCOc2ccc(Cc3ccccc3Cl)cc2)COC1 |
|
AD22944 | -1.37 | 277.29 | C5H7O3N7S2 | NS(=O)(=O)c1nnc(NCc2cn(O)nn2)s1 |
|
AD22945 | 4.36 | 512.6 | C29H36O8 | CC1CC23OC(=O)C(=C2O)OC(=O)C2(C)C(C=CC4C(O)CCCC42)CCCCC=CC3C=C1C(=O)O |
|
AD22946 | 2.36 | 200.62 | C10H9O3Cl | COc1ccc(Cl)c(C)c1C(=O)O |
|
AD22947 | 0.77 | 158.24 | C8H18ON2 | NCCCCCCCC(N)=O |
|
AD22948 | 6.89 | 284.53 | C19H40O | CCCCCCCCCCCCCCCCCCOC |
|
AD22949 | 4.34 | 877.56 | C46H73O9N6Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCCc2cn(CCc3c[nH]c4ccc(Cl)cc34)nn2)C(C)C(O)C1(C)O |
|
AD22950 | 3.06 | 336.47 | C20H32O4 | CC1(C(=O)O)CCCC2(C)C1CC(O)C13CC(CO)C(CCC21)C3 |