aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19721 | 3.28 | 308.17 | C15H11N5Cl2 | Cn1cnc2c(NCc3cccc(Cl)c3)nc(Cl)nc21 |
|
AD19722 | 2.81 | 260.34 | C15H20O2N2 | Cc1c(Cc2ccc(OC(C)C)cc2)c(O)nn1C |
|
AD19723 | -3.33 | 363.24 | C11H16O9NF3 | O=C(NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO)C(F)(F)F |
|
AD19724 | 1.11 | 133.19 | C9H11N | NC1Cc2ccccc2C1 |
|
AD19725 | 2.5 | 402.46 | C17H20O3N7S | CCCCCNS(=O)(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD19726 | 1.64 | 614.78 | C31H54O10N2 | CCN=C1OC2C(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC3(C)O)OC(C)CC2N1C |
|
AD19727 | 4.72 | 326.78 | C20H15O3Cl | O=C(CCc1ccc2ccccc2c1)c1c(O)cc(Cl)cc1O |
|
AD19728 | -0.4 | 279.26 | C11H13O4N5 | C=CCn1c(=O)[nH]c2nc(NC(=O)COC)nc(O)c21 |
|
AD19729 | -0.19 | 104.1 | C4H8O3 | COCC(=O)OC |
|
AD19730 | 4.78 | 428.61 | C27H40O4 | CC(C(=O)CCC(C)CO)=C1C(=O)CC2C3CC=C4CC(O)CCC4(C)C3CCC12C |