aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08411 | 1.75 | 254.27 | C13H12ON5 | Oc1ccc(CCNc2ncnc3c2N=C[N]3)cc1 |
|
AD08412 | 1.11 | 282.32 | C12H14O4N2S | COS(=O)(=O)NC(=O)CCc1c[nH]c2ccccc12 |
|
AD08413 | 1.33 | 245.28 | C14H15O3N | O=CNCC(O)COc1cccc2ccccc12 |
|
AD08414 | 3.87 | 508.49 | C28H20O6N4 | O=C1c2c(c3c4ccc(O)cc4n(O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NCc1ccc(CO)cc1 |
|
AD08415 | -3.82 | 798.0 | C35H67O8N13 | CCC(C)C(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)CNCCN(C)CCC(N)C(=O)O)C(=O)NC(C)C(N)=O |
|
AD08416 | 5.79 | 320.41 | C22H21OF | CCOc1ccc(Cc2cccc(-c3ccc(F)cc3)c2C)cc1 |
|
AD08417 | 3.7 | 260.72 | C16H13O2Cl | Clc1ccccc1Cc1ccc2c(c1)OCCO2 |
|
AD08418 | 4.73 | 256.78 | C18H17Cl | Cc1ccc(Cc2ccc3c(c2Cl)CCC3)cc1 |
|
AD08419 | 4.65 | 302.8 | C19H19O2Cl | CCOc1ccc(Cc2ccc3c(c2Cl)CC(C)O3)cc1 |
|
AD08420 | 5.63 | 284.79 | C19H17OCl | CCCc1ccc(Cc2ccc3occc3c2Cl)cc1 |