aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18641 | 0.34 | 204.24 | C8H6N5S | C#CCSC1=N[N]c2ncnc(N)c21 |
|
AD18642 | 2.21 | 270.34 | C13H12N5S | Cc1ccc(CSC2=N[N]c3ncnc(N)c32)cc1 |
|
AD18643 | 2.07 | 256.31 | C12H10N5S | Cc1ccccc1SC1=N[N]c2ncnc(N)c21 |
|
AD18644 | 0.47 | 590.76 | C29H54O10N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)O |
|
AD18645 | 2.39 | 576.6 | C31H32O9N2 | COC(=O)C(Cc1cn(C)c2ccccc12)NC(=O)C(OC)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O |
|
AD18646 | 1.07 | 282.29 | C14H18O6 | C=CCOC(=O)CC1C(C(=O)OC)=COC(O)C1=CC |
|
AD18647 | 2.56 | 395.8 | C19H18O7NCl | O=C(O)CCOCCOc1cc2c(=O)c(C(=O)O)cn(C3CC3)c2cc1Cl |
|
AD18648 | 4.17 | 258.75 | C17H15OCl | Cc1ccc(Cc2ccc3c(c2Cl)CCO3)cc1 |
|
AD18649 | 0.66 | 177.25 | C5H7O2NS2 | CNS(=O)(=O)c1ccsc1 |
|
AD18650 | -0.81 | 192.16 | C7H6O2N5 | COC(=O)C1=N[N]c2ncnc(N)c21 |