aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD11441 | 4.43 | 315.83 | C17H14N3ClS | Cn1c(SCc2ccccc2)nnc1-c1ccc(Cl)cc1 |
|
AD11442 | 2.95 | 347.4 | C19H19ON6 | OCCCNc1nc2c(c(NCc3cccc4ccccc34)n1)N=C[N]2 |
|
AD11443 | 3.36 | 329.39 | C19H17N6 | Nc1nc(NC(Cc2ccccc2)c2ccccc2)nc2c1N=C[N]2 |
|
AD11444 | 3.6 | 691.9 | C38H61O10N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OCC=Cc2ccccc2)CC(C)C(=O)C(C)C(O)C1(C)O |
|
AD11445 | 1.07 | 155.12 | C5H8ONF3 | CCC(=O)NCC(F)(F)F |
|
AD11446 | 2.75 | 285.34 | C17H19O3N | COc1ccccc1-c1cc(O)ccc1CCNC(C)=O |
|
AD11447 | 4.05 | 1216.31 | C63H73O18N7 | CC(=O)OC1C(=O)C2(C)C(OC(=O)CCCc3cn(CCO)nn3)CC3OCC3(OC(C)=O)C2C(OC(=O)c2ccccc2)C2(O)CC(OC(=O)C(OC(=O)CCCc3cn(CCO)nn3)C(NC(=O)c3ccccc3)c3ccccc3)C(C)=C1C2(C)C |
|
AD11448 | 1.26 | 330.34 | C17H18O5N2 | NC(Cc1ccc(Oc2ccc(O)cc2)cc1)C(=O)NCC(=O)O |
|
AD11449 | 4.98 | 306.81 | C19H20OFCl | CCc1ccc(Cc2ccc(COCCF)cc2Cl)cc1 |
|
AD11450 | -1.75 | 504.53 | C21H30O6N9 | CC(NC(=O)CO)C(=O)NC(CCC(=O)NCCCCCC(=O)Nc1ncnc2c1N=C[N]2)C(N)=O |