aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16961 | 1.81 | 214.06 | C8H8ONBr | CNC(=O)c1cccc(Br)c1 |
|
AD16962 | 3.32 | 203.19 | C8H4NF3S | FC(F)(F)c1ccc2scnc2c1 |
|
AD16963 | 2.2 | 274.69 | C13H9ON5Cl | Nc1nc2c(c(OCc3ccc(Cl)cc3)n1)N=C[N]2 |
|
AD16964 | 4.22 | 829.09 | C45H72O10N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccccc2-c2ccccc2)C(C)C(O)C1(C)O |
|
AD16965 | 2.45 | 813.07 | C40H68O11N4S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)Nc2ccc3c(c2)OCO3)C(C)C(O)C1(C)O |
|
AD16966 | 2.57 | 512.62 | C27H32ON10 | CN1CCN(c2ccc3nc(-c4ccc(OCCn5cc(CCc6cn(C)nn6)nn5)cc4)[nH]c3c2)CC1 |
|
AD16967 | 6.79 | 483.6 | C31H27N6 | C1=Nc2c(nc(NCCC(c3ccccc3)c3ccccc3)nc2NCc2cccc3ccccc23)[N]1 |
|
AD16968 | 2.31 | 257.32 | C13H17N6 | C1=Nc2c(nc(NC3CC3)nc2NC2CCCC2)[N]1 |
|
AD16969 | 2.31 | 257.32 | C13H17N6 | C1=Nc2c(nc(NC3CCCC3)nc2NC2CC2)[N]1 |
|
AD16970 | 0.43 | 842.09 | C40H75O10N9 | CC(C)C(NC(=O)NC(C(=O)NC(C(=O)NCCCN(CCCCCCCCCCCCN1CCOCC1)C(CO)C(=O)O)C(O)C(C)C)C1CCN=C(N)N1)C(=O)O |