aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05191 | 3.0 | 330.19 | C15H12ON3Br | CNn1c(-c2ccccc2)nc2ccc(Br)cc2c1=O |
|
AD05192 | 4.83 | 496.64 | C30H40O6 | CC(=O)OC(C)C1CCC2(O)C3CC=C4CC(O)CCC4(C)C3CC(OC(=O)c3ccccc3)C12C |
|
AD05193 | 0.87 | 115.18 | C6H13ON | CCCCN(C)C=O |
|
AD05194 | 3.71 | 467.44 | C25H17O5N5 | O=C1c2c(c3c4ccc(O)cc4n(O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NCc1ccc[nH]1 |
|
AD05195 | 2.73 | 336.12 | C11H7N5I | Ic1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD05196 | 3.9 | 351.34 | C17H22O5NP | CCCOC(=O)C(C)NP(=O)(OC)Oc1cccc2ccccc12 |
|
AD05197 | 4.75 | 616.75 | C37H44O8 | CC(OC(=O)C=Cc1ccccc1)C1(O)CCC2(O)C3(O)CC=C4CC(O)CCC4(C)C3CC(OC(=O)c3ccccc3)C12C |
|
AD05198 | 3.96 | 388.45 | C22H22O2N5 | COc1cc(OC)cc(C(CNc2ncnc3c2N=C[N]3)c2ccccc2C)c1 |
|
AD05199 | -0.28 | 164.15 | C6H6ON5 | CNc1nc2c(c(=O)[nH]1)N=C[N]2 |
|
AD05200 | 1.61 | 572.7 | C32H44O9 | CC(O)C1(O)CCC2(O)C3(O)CC(O)C4(O)CC(O)CCC4(C)C3CC(OC(=O)C=CC=Cc3ccccc3)C12C |