aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14831 | 1.28 | 360.38 | C14H14O3N7S | CN(C)S(=O)(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD14832 | 0.04 | 170.22 | C6H8ON3S | CCSC1=C(C(N)=O)N=C[N]1 |
|
AD14833 | 2.65 | 270.7 | C14H9N5Cl | ClC1=Nc2c(ncnc2N2CCc3ccccc32)[N]1 |
|
AD14834 | 0.74 | 414.59 | C21H42O4N4 | CCC(C)C(C(O)CC(=O)NC)N(C)C(=O)C(NC(=O)C(NC)C(C)C)C(C)C |
|
AD14835 | 3.27 | 549.62 | C34H31O6N | COc1cc(C#Cc2ccc(C#Cc3cc(OC)c(C#CCO)cc3OC)c(N(C)C)c2)c(OC)cc1C#CCO |
|
AD14836 | 3.35 | 308.33 | C19H16O4 | O=C(C=Cc1ccc(O)cc1)CC(=O)C=Cc1ccc(O)cc1 |
|
AD14837 | 2.05 | 308.37 | C17H18ON5 | CCCNC(=O)CNc1ncnc2c1C(c1ccccc1)=C[N]2 |
|
AD14838 | 2.76 | 303.14 | C12H9N5Br | Brc1ccc(CNc2ncnc3c2N=C[N]3)cc1 |
|
AD14839 | -3.09 | 334.42 | C14H30O5N4 | CNC(C)C1(O)CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1 |
|
AD14840 | 6.95 | 546.7 | C34H42O6 | CC1(C(=O)O)CCCC2(C)c3cc(O)c(-c4cc5c(cc4O)C4(C)CCCC(C)(C(=O)O)C4CC5)cc3CCC12 |