aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20921 | 0.95 | 186.2 | C9H8N5 | Cn1ccc2c1-c1c(N)ncnc1[N]2 |
|
AD20922 | 1.95 | 270.34 | C13H12N5S | Nc1ncnc2c1C(SCCc1ccccc1)=N[N]2 |
|
AD20923 | 3.1 | 264.38 | C12H18N5S | CCCCNc1nc(SCCC)nc2c1N=C[N]2 |
|
AD20924 | 4.02 | 306.39 | C18H20N5 | Cc1cc(C)cc(-c2nc3c(c(NC4CCCC4)n2)N=C[N]3)c1 |
|
AD20925 | 4.07 | 299.46 | C13H21ON3S2 | C=CCCCCCCCCC(=O)Nc1nnc(S)s1 |
|
AD20926 | 4.18 | 510.5 | C30H22O8 | Cc1cc(O)c2c(c1)C(O)c1ccc(C3c4cccc(O)c4C(=O)c4c(O)cc(C)c(O)c43)c(O)c1C2=O |
|
AD20927 | 4.94 | 244.4 | C16H20S | Cc1ccsc1Cc1ccc(C(C)(C)C)cc1 |
|
AD20928 | 4.44 | 492.74 | C30H52O5 | CC(C)(O)C=CCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC12C |
|
AD20929 | 3.46 | 312.3 | C16H13O2N4F | Cc1cc2c(F)c(Oc3ncnn4cc(O)c(C)c34)ccc2[nH]1 |
|
AD20930 | 3.16 | 440.53 | C22H24O4N4S | Nc1nc(CC(=O)Nc2ccc(CCN(CC(O)c3ccccc3)C(=O)O)cc2)cs1 |