aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD07291 | 2.51 | 287.43 | C14H25O3NS | CCCCCCCC(=O)NC1CC(CSC)OC1=O |
|
AD07292 | 1.04 | 198.23 | C11H10N4 | C[n+]1cnc2c(c1N)-c1ccccc1[N]2 |
|
AD07293 | 2.45 | 512.51 | C27H28O10 | CC(=O)OC1CC(O)(C(=O)OCc2ccccc2O)CC(OC(C)=O)C1OC(=O)C=Cc1ccccc1 |
|
AD07294 | 2.29 | 302.29 | C12H8O3N5S | O=[N+]([O-])c1cccc(CSc2nc(O)c3c(n2)[N]C=N3)c1 |
|
AD07295 | 3.14 | 363.37 | C20H17O4N3 | Cc1c(O)ccc2c(OCCn3cnc(-c4cccnc4)c3)cc(=O)oc12 |
|
AD07296 | 4.09 | 333.17 | C18H10O2N2Cl2 | O=C(Nc1ccc(Cl)cc1)c1c[nH]c2ccc(Cl)cc2c1=O |
|
AD07297 | -0.98 | 524.59 | C23H32O3N12 | Cn1cc(-c2cc(C(=O)NCCCC(=O)NC(CCCNC(=N)N)C(N)=O)cc(-c3cn(C)nn3)c2)nn1 |
|
AD07298 | 3.03 | 308.42 | C18H28O4 | CCC1=C(C)C(=O)C(O)C2C1(C)CCC(OC(C)=O)C2(C)C |
|
AD07299 | 0.48 | 121.14 | C6H7N3 | CN(C)C=C(C#N)C#N |
|
AD07300 | 4.46 | 728.97 | C41H64O9N2 | COC1(C)CC(C)C(O)C(C)CN(C)CC(COc2ccc(-c3ccccc3)cc2)OC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1O |