0 B18R2.9259 Cc1cc(CNc2ccc(F)cc2)ccc1F Amb17408175 [0,0,0,0,0,0|4,0,0]=4 1 B18R2.9259 Cc1ccc(CNc2ccc(F)cc2)cc1C Amb9629158 [0,0,0,0,0,0|4,0,0]=4 2 B18R2.9259 Cc1ccc(SCC2=CC(=O)C(O)=CO2)cc1 Amb21176408 [0,0,0,0,0,0|1,0,0]=1 3 B18R2.9259 Nc1ccc(SCc2ccc(Cl)c(Cl)c2)cc1 Amb6384525 [0,0,0,0,0,0|4,0,0]=4 4 B18R2.9259 O=C1C=C(CSc2ccc(Cl)cc2)OC=C1O Amb21176402 [0,0,0,0,0,0|0,1,0]=1 5 B18R2.9259 O=C1C=C(CSc2ccc(F)cc2)OC=C1O Amb21176422 [0,0,0,0,0,0|0,0,0]=0 6 B17R2.193 O=C1C=C(CSc2ncccn2)OC=C1O Amb18384442 [1,0,0,0,0,0|2,0,0]=3 7 B17R2.193 Oc1ccc(CSc2ccncc2)cc1O Amb32416603 [1,0,0,0,0,0|2,0,1]=4 8 B17R2.207 Cc1ccc(CNc2ccc(F)cc2)cc1 Amb3699183 [1,0,0,0,0,0|3,0,0]=4 9 B17R2.207 Cc1ccc(CSc2ccc(N)cc2)cc1 Amb8930371 [1,0,0,0,0,0|3,0,0]=4 10 B17R2.207 Cc1ccc(NCc2ccc(O)cc2)cc1 Amb3547087 [1,0,0,0,0,0|3,0,0]=4 11 B17R2.207 Fc1ccc(CCc2ccc(F)cc2)cc1 Amb2759832 [1,0,0,0,0,0|3,0,0]=4 12 B17R2.207 Fc1ccc(NCc2ccc(Cl)cc2)cc1 Amb4313433 [1,0,0,0,0,0|3,0,0]=4 13 B17R2.207 Nc1ccc(CCc2ccc(O)cc2)cc1 Amb6298293 [1,0,0,0,0,0|3,0,0]=4 14 B17R2.207 Nc1ccc(CSc2ccc(Br)cc2)cc1 Amb8996693 [1,0,0,0,0,0|2,1,0]=4 15 B17R2.207 Nc1ccc(CSc2ccc(Cl)cc2)cc1 Amb2414967 [1,0,0,0,0,0|2,1,0]=4 16 B17R2.207 Nc1ccc(CSc2ccc(F)cc2)cc1 Amb2414977 [1,0,0,0,0,0|2,0,0]=3 17 B17R2.207 Nc1ccc(SCc2ccc(Cl)cc2)cc1 Amb8930431 [1,0,0,0,0,0|3,0,0]=4 18 B17R2.207 Nc1ccc(SCc2ccc(F)cc2)cc1 Amb2719883 [1,0,0,0,0,0|3,0,0]=4 19 B17R2.207 Oc1ccc(C#Cc2ccc(F)cc2)cc1 Amb10839829 [1,0,0,0,0,0|2,0,1]=4 20 B17R2.207 Oc1ccc(CCc2ccc(Cl)cc2)cc1 Amb2413167 [1,0,0,0,0,0|2,1,0]=4 21 B17R2.207 Oc1ccc(CCc2ccc(O)cc2)cc1 Amb2445097 [1,0,0,0,0,0|3,0,0]=4 22 B17R2.207 Oc1ccc(CNc2ccc(Br)cc2)cc1 Amb4032194 [1,0,0,0,0,0|2,1,0]=4 23 B17R2.207 Oc1ccc(CNc2ccc(Cl)cc2)cc1 Amb4020906 [1,0,0,0,0,0|2,1,0]=4 24 B17R2.207 Oc1ccc(CNc2ccc(F)cc2)cc1 Amb4018606 [1,0,0,0,0,0|2,0,0]=3 25 B17R2.207 Oc1ccc(CNc2ccc(O)cc2)cc1 Amb6867964 [1,0,0,0,0,0|3,0,0]=4 26 B17R2.207 Oc1ccc(SSc2ccc(O)cc2)cc1 Amb583424 [1,0,0,0,0,0|3,0,0]=4 27 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb2704333 [1,0,0,0,0,0|2,0,1]=4 28 B17R2.207 Oc1ccc(\C=N\c2ccc(F)cc2)cc1 Amb33715879 [1,0,0,0,0,0|2,0,1]=4 29 B17R2.215 Cc1cccc(CNc2ccc(F)cc2)c1 Amb4313254 [1,0,0,0,0,0|3,0,0]=4 30 B17R2.215 Cc1cccc(CSc2ccc(N)cc2)c1 Amb8930369 [1,0,0,0,0,0|3,0,0]=4 31 B17R2.215 Fc1ccc(NCc2cccc(Cl)c2)cc1 Amb4303626 [1,0,0,0,0,0|3,0,0]=4 32 B17R2.215 Fc1ccc(NCc2cccc(F)c2)cc1 Amb6696703 [1,0,0,0,0,0|3,0,0]=4 33 B17R2.215 Nc1ccc(SCc2cccc(Cl)c2)cc1 Amb8930389 [1,0,0,0,0,0|3,0,0]=4 34 B17R2.215 Nc1ccc(SCc2cccc(F)c2)cc1 Amb8930281 [1,0,0,0,0,0|3,0,0]=4 35 B17R2.215 Nc1cccc(COc2ccc(F)cc2)c1 Amb6243286 [1,0,0,0,0,0|2,1,0]=4 36 B17R2.215 Oc1cccc(CNc2ccc(F)cc2)c1 Amb6696810 [1,0,0,0,0,0|2,0,1]=4 37 B19R2.2679 COC1=CNC(CSc2ccc(F)cc2)=CC1=O Amb18384440 [0,1,0,0,0,0|1,0,0]=2 38 B19R2.2679 COC1=COC(CSc2ccc(C)cc2)=CC1=O Amb28487748 [0,1,0,0,0,0|1,0,0]=2 39 B19R2.2679 COC1=COC(CSc2ccc(Cl)cc2)=CC1=O Amb22471188 [0,1,0,0,0,0|0,1,0]=2 40 B19R2.2679 COC1=COC(CSc2ccc(F)cc2)=CC1=O Amb28487922 [0,1,0,0,0,0|0,0,0]=1 41 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1C Amb9629166 [0,1,0,0,0,0|3,0,0]=4 42 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1Cl Amb1882528 [0,1,0,0,0,0|3,0,0]=4 43 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1F Amb8841402 [0,1,0,0,0,0|3,0,0]=4 44 B19R2.2679 COc1ccc(CNc2ccc(F)cc2)cc1O Amb6696710 [0,1,0,0,0,0|2,0,1]=4 45 B19R2.2847 COc1cc(CNc2ccc(F)cc2)ccc1O Amb6696693 [0,1,0,0,0,0|2,0,1]=4 46 B19R2.2847 O=Cc1cc(\N=N\c2ccc(F)cc2)ccc1O Amb20411372 [0,1,0,0,0,0|3,0,0]=4 47 B19R2.149413 CC1=CN=C(SCC2=CC(=O)C(O)=CO2)NC1=O Amb28482808 [0,1,0,0,0,0|3,0,0]=4 48 B17R2.472 Cc1cc(Cc2ccc(F)cc2)ccc1N Amb17140927 [0,0,0,0,1,0|3,0,0]=4 49 B17R2.472 Cc1cc(Cc2ccc(O)cc2)ccc1O Amb17595818 [0,0,0,0,1,0|3,0,0]=4 50 B17R2.472 Cc1ccc(Cc2ccc(F)cc2)cc1N Amb17140924 [0,0,0,0,1,0|3,0,0]=4 51 B17R2.472 Nc1cc(Cc2ccc(F)cc2)ccc1Cl Amb17158075 [0,0,0,0,1,0|3,0,0]=4 52 B16R2.132 Brc1ccc(CSc2ccccc2)cc1 Amb22482416 [2,0,0,0,0,0|2,0,0]=4 53 B16R2.132 Brc1ccc(CSc2ccccc2)nc1 Amb27475623 [2,0,0,0,0,0|2,0,0]=4 54 B16R2.132 Brc1ccc(SCc2ccccc2)cc1 Amb4012831 [2,0,0,0,0,0|1,1,0]=4 55 B16R2.132 Clc1ccc(CSc2ccccc2)cc1 Amb2610191 [2,0,0,0,0,0|2,0,0]=4 56 B16R2.132 Fc1ccc(NCc2ccccc2)cc1 Amb3726374 [2,0,0,0,0,0|2,0,0]=4 57 B16R2.132 Fc1ccc(NCc2ccccn2)cc1 Amb6696824 [2,0,0,0,0,0|2,0,0]=4 58 B16R2.132 Fc1ccc(OCc2ccccc2)cc1 Amb2684652 [2,0,0,0,0,0|1,1,0]=4 59 B16R2.132 Nc1ccc(CSc2ccccc2)cc1 Amb2608452 [2,0,0,0,0,0|2,0,0]=4 60 B16R2.132 Nc1ccc(SCc2ccccc2)cc1 Amb6675929 [2,0,0,0,0,0|2,0,0]=4 61 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb10609692 [2,0,0,0,0,0|2,0,0]=4 62 B16R2.132 Oc1ccc(CNc2ccccc2)cc1 Amb3544585 [2,0,0,0,0,0|2,0,0]=4 63 B16R2.132 Oc1ccc(SCc2ccccc2)cc1 Amb30594452 [2,0,0,0,0,0|2,0,0]=4 64 B16R2.252 Brc1cccc(CSc2ccccc2)c1 Amb5221073 [2,0,0,0,0,0|2,0,0]=4 65 B18R2.65908 Cc1ccnc(SCC2=CC(=O)C(O)=CO2)n1 Amb24120589 [1,1,0,0,0,0|2,0,0]=4 66 B18R2.9252 Oc1ccc(CNc2ccc(F)cc2F)cc1 Amb6698216 [1,1,0,0,0,0|2,0,0]=4 67 B18R2.2571 COc1ccc(Cc2ccc(F)cc2)cc1N Amb17142724 [0,1,0,0,1,0|2,0,0]=4 68 B18R3.6310 O=C1C=C2CNc3ccccc3N2C=C1O Amb20413981 [1,0,0,1,0,0|2,0,0]=4 69 B16R2.124 Cc1cc(Cc2ccccc2)ccc1O Amb24065834 [1,0,0,0,1,0|2,0,0]=4 70 B16R2.124 Nc1cc(Cc2ccccc2)ccc1O Amb33552377 [1,0,0,0,1,0|2,0,0]=4 71 B16R2.124 Oc1ccc(Cc2ccccc2)cc1Cl Amb24065833 [1,0,0,0,1,0|2,0,0]=4 72 B16R2.124 Oc1ccc(Cc2ccccc2)cc1O Amb24060583 [1,0,0,0,1,0|1,0,1]=4 73 B16R2.33 Fc1ccc(Cc2ccc(F)cc2)cc1 Amb2684762 [1,0,0,0,1,0|2,0,0]=4 74 B16R2.33 Fc1ccc(Sc2ccc(Br)cn2)cc1 Amb27590664 [1,0,0,0,1,0|2,0,0]=4 75 B16R2.33 Nc1ccc(Cc2ccc(F)cc2)cc1 Amb17101867 [1,0,0,0,1,0|2,0,0]=4 76 B16R2.33 Nc1ccc(Sc2ccc(F)cc2)cc1 Amb17342011 [1,0,0,0,1,0|2,0,0]=4 77 B16R2.33 Oc1ccc(Cc2ccc(O)cc2)cc1 Amb2710982 [1,0,0,0,1,0|2,0,0]=4 78 B16R2.33 Oc1ccc(Oc2ccc(F)cc2)cc1 Amb7094538 [1,0,0,0,1,0|1,1,0]=4 79 B16R2.33 Oc1ccc(Oc2ccc(F)cc2)nc1 Amb31307891 [1,0,0,0,1,0|1,1,0]=4 80 B16R2.33 Oc1ccc(Sc2ccc(O)cc2)cc1 Amb1016532 [1,0,0,0,1,0|2,0,0]=4 81 B16R2.137 Cc1ccc(CNc2ccc(F)cc2)o1 Amb6696721 [1,0,0,0,1,0|2,0,0]=4 82 B16R2.137 Clc1ccc(SCc2ccc(Br)o2)cc1 Amb27843177 [1,0,0,0,1,0|1,1,0]=4 83 B16R2.137 Fc1ccc(SCc2ccc(Br)o2)cc1 Amb27198849 [1,0,0,0,1,0|1,0,0]=3 84 B16R2.137 Nc1ccc(SCc2ccc(Cl)o2)cc1 Amb32788910 [1,0,0,0,1,0|2,0,0]=4 85 B16R2.131 Nc1cccc(Cc2ccc(F)cc2)c1 Amb17139840 [1,0,0,0,1,0|2,0,0]=4 86 B16R2.1067 Cc1ccoc1CSc2ccc(N)cc2 Amb32987730 [1,0,0,0,1,0|2,0,0]=4 87 B16R2.2864 Cc1cc(-c2ccc(F)cc2)ccc1O Amb21856716 [0,0,0,0,2,0|2,0,0]=4 88 B16R2.2864 Oc1ccc(-c2ccc(F)cc2)cc1Cl Amb17137469 [0,0,0,0,2,0|2,0,0]=4 89 B16R2.2864 Oc1ccc(-c2ccc(F)cc2)cc1F Amb32666593 [0,0,0,0,2,0|2,0,0]=4 90 B18R2.274 Nc1ccc(CSCc2ccc(F)cc2)cc1 Amb17497823 [1,0,0,0,0,1|2,0,0]=4 91 B18R2.274 Oc1ccc(CNCc2ccc(F)cc2)cc1 Amb6697071 [1,0,0,0,0,1|2,0,0]=4