aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD19601 | 4.04 | 338.44 | C16H12N5S2 | Nc1nc2c(c(=S)[nH]1)N=C(SCc1cccc3ccccc13)[N]2 |
|
AD19602 | -0.01 | 210.21 | C8H6O3N2S | N#Cc1ccccc1S(=O)(=O)NC=O |
|
AD19603 | 7.87 | 624.99 | C37H72O5N2 | CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCCCCNC(=O)C1CCCCC1 |
|
AD19604 | 3.39 | 440.87 | C22H19O4N5Cl | CCOC(=O)C1=C(C)Oc2nc(C)n(CC3=C[N]N=N3)c(=O)c2C1c1ccc(Cl)cc1 |
|
AD19605 | 5.38 | 486.69 | C30H46O5 | CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CC(O)C43C)C2C1 |
|
AD19606 | 4.81 | 344.41 | C23H20O3 | OC(COc1cccc2ccccc12)COc1cccc2ccccc12 |
|
AD19607 | 2.1 | 380.4 | C21H20O5N2 | C=CC1C(O)OC=C2C(=O)N3C(C(=O)O)Cc4c([nH]c5ccccc45)C3CC21 |
|
AD19608 | 4.22 | 310.35 | C19H18O4 | CCc1ccc(O)c(C(=O)CCc2ccc3occc3c2)c1O |
|
AD19609 | -0.28 | 202.25 | C10H18O4 | CC1C(O)OCC2C1CC(O)C2(C)O |
|
AD19610 | 0.46 | 128.24 | C8H18N | C[NH+](C)C1CCCCC1 |