Compound,SMILES,"[35S]GTPgS binding, Emax of A3 agonist Cl-IB-MECA (100 nM)"
5,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCC5)N4)C=CC=C3,113±4
6,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCC5)N4)C=CC=C3,110±4
7,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCC5)N4)C=CC=C3,154±9
8,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCC5)N4)C=CC=C3,120±4
12a,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@H]5C[C@H]6C[C@@H]5CC6)N4)C=CC=C3,103±4
12b,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5(C[C@H]6C7)C[C@@H](C6)C[C@@H]7C5)N4)C=CC=C3,148±10
13,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(CCC)N4)C=CC=C3,128±11
14,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C(CCC)CCC)N4)C=CC=C3,171±9
15,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C(CCC(F)(F)F)CCC(F)(F)F)N4)C=CC=C3,118±7
16,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCC(C(F)(F)F)CC5)N4)C=CC=C3,120±4
17,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CC5)N4)C=CC=C3,118±8
18,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCC=CCC5)N4)C=CC=C3,147±7
19,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCCC5)N4)C=CC=C3,107±3
20,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCCCC5)N4)C=CC=C3,143±6
21,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCCCCC5)N4)C=CC=C3,109±6
22,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCCCCCC5)N4)C=CC=C3,118±4
23,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5CCCCCCCCCCC5)N4)C=CC=C3,99±3
24,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C(C5(C6)CC6C5)N4)C=CC=C3,141±9
25,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@]5(C6)CC[C@@H]6CC5)N4)C=CC=C3,120±6
26,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@@]5(C6)CCC[C@H]6CCC5)N4)C=CC=C3,147±9
27,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@@]5([H])C[C@H]6CCC[C@H](C6)C5)N4)C=CC=C3,141±9
28,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@@]5([H])CC[C@H]6[C@H](C6)CC5)N4)C=CC=C3,143±14
29,[H]C1(C2=NC(C(NC3=CC=C(Cl)C(Cl)=C3)=N4)=C(N2)C5=C4C=CC=C5)CC6C=CC1CC6,129±9
30,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@]5([H])CC[C@H]6[C@H](O6)CC5)N4)C=CC=C3,131±11
31,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@@]5([H])CC[C@H](O6)[C@H]6CC5)N4)C=CC=C3,119±5
32,ClC(C(Cl)=C1)=CC=C1NC2=NC3=C(C4=C2N=C(C5CCCC(CC5)=O)N4)C=CC=C3,108±9
33,ClC(C(Cl)=C1)=CC=C1NC2=NC3=C(C4=C2N=C([C@]5([H])CCC[C@H](O)CC5)N4)C=CC=C3,156±8
34,ClC(C=C1)=C(Cl)C=C1NC2=NC3=C(C4=C2N=C([C@@]5([H])CCC[C@H](O)CC5)N4)C=CC=C3,160±13
35,IC(C=C1)=CC=C1NC2=NC3=C(C4=C2N=C(C5CCCCC5)N4)C=CC=C3,136±8
36,BrC(C=C1)=CC=C1NC2=NC3=C(C4=C2N=C(C5CCCCC5)N4)C=CC=C3,162±16
37,O=C(OC)/C=C/C(C=C1)=CC=C1NC2=NC3=C(C4=C2N=C(C5CCCCC5)N4)C=CC=C3,133±6
38,ClC(S1)=CC=C1C#CC(C=C2)=CC=C2NC3=NC4=C(C5=C3N=C(C6CCCCC6)N5)C=CC=C4,131±8
39,IC(C=C1)=CC=C1NC2=NC3=C(C4=C2N=C(C(CCC)CCC)N4)C=CC=C3,158±8
48,CCCC(CCC)C1=NC(C(NC2=CC=C([Si](C)(C)C)C=C2)=N3)=C(N1)C4=C3C=CC=C4,-
49,CCCC(CCC)C1=NC(C(NC2=CC=C([Si](CCCC)(CCCC)CCCC)C=C2)=N3)=C(N1)C4=C3C=CC=C4,-
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