0 B12R2.252 O=C(O)C1=CC2=C(SC=C2)S1 MC442193 [0,0,0,0,0,0|1,0,0]=1 1 B12R2.252 O=C(O)C1=CC2=CSC=C2S1 MC442194 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.400 O=C(O)C1=CC2=C(C=C(Cl)S2)N1 CS14567 [0,1,0,0,0,0|2,0,0]=3 3 B13R2.400 O=C(O)C1=CN2N=C(Br)SC2=N1 MC113254 [0,1,0,0,0,0|2,0,1]=4 4 B13R2.531 COC(=O)C1=CC2=C(C=CS2)S1 MC10780 [0,1,0,0,0,0|2,0,0]=3 5 B13R2.2334 CC1=C(C(=O)O)SC2=NC=CN21 MC113253 [0,1,0,0,0,0|3,0,0]=4 6 B13R2.2334 O=C(O)C1=C(Cl)C2=C(C=CO2)S1 MC110621 [0,1,0,0,0,0|2,1,0]=4 7 B13R2.3678 O=C(O)C1=CC2=C(N1)C(Br)=CS2 CS22142 [0,1,0,0,0,0|2,0,0]=3 8 B11R1.35 NC(CC1=CC=CS1)C(=O)O CS20416 [0,0,1,0,0,0|2,0,1]=4 9 B11R1.35 NC(Cc1cccs1)C(=O)O MC438193 [0,0,1,0,0,0|2,0,1]=4 10 B11R1.35 NC(Cc1cccs1)C(=O)O MC438194 [0,0,1,0,0,0|2,0,1]=4 11 B13R2.430 CC(=O)C1=CC2=C(C=C1)N=CS2 MC427236 [0,0,0,0,0,1|3,0,0]=4 12 B13R2.430 CC(=O)C1=CC2=C(C=C1)SC=N2 CS16602 [0,0,0,0,0,1|3,0,0]=4 13 B13R2.430 CC(=O)C1=CC=C2C=CNC2=C1 CS16097 [0,0,0,0,0,1|3,0,0]=4 14 B13R2.430 CC(=O)C1=CC=C2NC=CC2=C1 CS19941 [0,0,0,0,0,1|3,0,0]=4 15 B13R2.430 NC(=O)C1=CC2=C(C=C1)SC=N2 CS16894 [0,0,0,0,0,1|3,0,0]=4 16 B13R2.430 NC(=O)C1=CC=C2NC=CC2=C1 MC107061 [0,0,0,0,0,1|3,0,0]=4 17 B13R2.430 O=C(Cl)C1=CC=C2C=CNC2=C1 MC106292 [0,0,0,0,0,1|3,0,0]=4 18 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 MC31130 [0,0,0,0,0,1|2,0,0]=3 19 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=N2 CS13765 [0,0,0,0,0,1|3,0,0]=4 20 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 CS21477 [0,0,0,0,0,1|1,1,0]=3 21 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 MC441149 [0,0,0,0,0,1|1,0,0]=2 22 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=N2 CS10225 [0,0,0,0,0,1|2,0,0]=3 23 B13R2.430 O=C(O)C1=CC2=C(C=CN2)C=N1 CS15936 [0,0,0,0,0,1|2,0,0]=3 24 B13R2.430 O=C(O)C1=CC2=C(C=CO2)C=C1 MC441167 [0,0,0,0,0,1|1,1,0]=3 25 B13R2.430 O=C(O)C1=CC2=C(C=CS2)C=C1 MC441150 [0,0,0,0,0,1|1,0,0]=2 26 B13R2.430 O=C(O)C1=CC2=C(C=N1)N=CS2 MC106341 [0,0,0,0,0,1|2,0,0]=3 27 B13R2.430 O=C(O)C1=CC2=C(C=NN2)C=N1 MC105480 [0,0,0,0,0,1|3,0,0]=4 28 B13R2.430 O=C(O)C1=CC2=CC=NN2C=C1 MC101990 [0,0,0,0,0,1|3,0,0]=4 29 B13R2.430 O=C(O)C1=CC2=NC=CN2C=C1 MC443245 [0,0,0,0,0,1|3,0,0]=4 30 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 CS22275 [0,0,0,0,0,1|2,0,0]=3 31 B13R2.430 O=C(O)C1=CC=C2C=CNC2=N1 MC444446 [0,0,0,0,0,1|1,0,1]=3 32 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 MC444507 [0,0,0,0,0,1|3,0,0]=4 33 B13R2.430 O=C(O)C1=CC=C2NC=CC2=C1 CS22274 [0,0,0,0,0,1|2,0,0]=3 34 B13R2.430 O=C(O)C1=CC=C2NN=CC2=C1 CS13050 [0,0,0,0,0,1|3,0,0]=4 35 B13R2.430 O=C(O)C1=CN=C2C=NNC2=C1 MC105459 [0,0,0,0,0,1|3,0,0]=4 36 B13R2.430 O=C(O)C1=CN=C2NC=CC2=C1 CS18462 [0,0,0,0,0,1|1,0,1]=3 37 B13R2.430 O=C(O)C1=CN=C2NC=NC2=C1 CS14581 [0,0,0,0,0,1|2,0,1]=4 38 B13R2.430 O=C(O)C1=CN=C2NN=CC2=C1 MC444143 [0,0,0,0,0,1|2,0,1]=4 39 B13R2.430 O=C(O)C1=NC2=C(C=CN2)C=N1 MC444460 [0,0,0,0,0,1|1,0,1]=3 40 B13R2.430 O=C(O)C1=NC=C2NC=CC2=C1 CS16880 [0,0,0,0,0,1|1,0,1]=3 41 B13R2.430 O=C(O)C1=NC=C2NN=CC2=C1 MC115742 [0,0,0,0,0,1|2,0,1]=4 42 B13R2.430 O=C(O)C1=NC=C2OC=CC2=C1 CS14661 [0,0,0,0,0,1|0,1,1]=3 43 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)SC=C2 MC105722 [0,0,0,0,0,1|2,0,1]=4 44 B13R2.430 OB(O)C1=CC2=C(C=C1)SC=C2 MC442941 [0,0,0,0,0,1|2,0,1]=4 45 B13R2.430 OB(O)C1=CC2=C(C=CS2)C=C1 MC442942 [0,0,0,0,0,1|2,0,1]=4 46 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)S1 CS11315 [0,0,0,0,0,1|3,0,0]=4 47 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 CS21212 [0,0,0,0,0,1|2,0,0]=3 48 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 MC33362 [0,0,0,0,0,1|3,0,0]=4 49 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)N1 CS16659 [0,0,0,0,0,1|3,0,0]=4 50 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 CS21478 [0,0,0,0,0,1|2,0,0]=3 51 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 CS21476 [0,0,0,0,0,1|2,0,0]=3 52 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 CS14473 [0,0,0,0,0,1|1,0,0]=2 53 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)S1 MC441179 [0,0,0,0,0,1|2,0,0]=3 54 B13R2.435 O=C(O)C1=CC2=C(C=NC=N2)N1 MC105516 [0,0,0,0,0,1|2,0,0]=3 55 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 CS22268 [0,0,0,0,0,1|1,0,0]=2 56 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 MC444444 [0,0,0,0,0,1|1,0,0]=2 57 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 MC441174 [0,0,0,0,0,1|2,0,0]=3 58 B13R2.435 O=C(O)C1=CC2=CC=NC=C2N1 CS18576 [0,0,0,0,0,1|1,0,0]=2 59 B13R2.435 O=C(O)C1=CC2=CC=NC=C2O1 MC115550 [0,0,0,0,0,1|2,0,0]=3 60 B13R2.435 O=C(O)C1=CC2=CC=NC=C2S1 MC441326 [0,0,0,0,0,1|2,0,0]=3 61 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 CS15306 [0,0,0,0,0,1|1,0,0]=2 62 B13R2.435 O=C(O)C1=CC2=NC=CC=C2S1 MC441901 [0,0,0,0,0,1|2,0,0]=3 63 B13R2.435 O=C(O)C1=CC2=NC=CN=C2S1 MC441335 [0,0,0,0,0,1|2,0,0]=3 64 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 CS18408 [0,0,0,0,0,1|2,0,1]=4 65 B13R2.435 O=C(O)C1=CN2C=CC=NC2=N1 MC443785 [0,0,0,0,0,1|2,0,1]=4 66 B13R2.435 O=C(O)C1=CN2C=CN=CC2=N1 MC100039 [0,0,0,0,0,1|2,0,1]=4 67 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 CS18211 [0,0,0,0,0,1|2,0,0]=3 68 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)O1 MC442734 [0,0,0,0,0,1|2,0,1]=4 69 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 CS10508 [0,0,0,0,0,1|2,0,1]=4 70 B13R2.435 O=C(O)C1=NN2C=CC=NC2=C1 CS18273 [0,0,0,0,0,1|2,0,1]=4 71 B13R2.435 O=C(O)C1=NN2N=CC=CC2=C1 MC104992 [0,0,0,0,0,1|2,0,1]=4 72 B13R2.435 O=C(O)C1CC2=CC=CC=C2N1 CS11042 [0,0,0,0,0,1|1,0,2]=4 73 B13R2.435 O=C(O)C1CC2=CC=CC=C2N1 MC20135 [0,0,0,0,0,1|1,0,2]=4 74 B10R1.66 O=C(O)\C=C\C1=CC=CO1 MC41690 [1,0,1,0,0,0|1,1,0]=4 75 B10R1.66 O=C(O)\C=C\C1=COC=C1 MC425866 [1,0,1,0,0,0|0,1,0]=3 76 B10R1.31 O=CC1=CC=C(C(=O)O)S1 MC41685 [1,0,1,0,0,0|2,0,0]=4 77 B10R1.31 O=Cc1ccc(C(=O)O)o1 CS18919 [1,0,1,0,0,0|2,0,0]=4 78 B14R2.601 CC1=NC2=C(C=CC(C(=O)O)=C2)S1 CS13702 [0,1,0,0,0,1|2,0,0]=4 79 B14R2.601 NC1=NC2=C(C=C(C(=O)O)C=C2)S1 CS21299 [0,1,0,0,0,1|2,0,0]=4 80 B14R2.601 O=C(O)C1=CC2=C(C=C1)N=C(Br)S2 CS21381 [0,1,0,0,0,1|2,0,0]=4 81 B14R2.601 O=C(O)C1=CC2=C(C=C1)N=C(Cl)S2 CS21422 [0,1,0,0,0,1|2,0,0]=4 82 B14R2.601 O=C(O)C1=CC2=C(C=C1)N=C(O)S2 MC10125 [0,1,0,0,0,1|2,0,0]=4 83 B14R2.624 O=C(O)C1=C(Br)C=C2C=CNC2=N1 MC104997 [0,1,0,0,0,1|1,0,1]=4 84 B14R2.624 O=C(O)C1=C(Cl)C=C2NC=CC2=C1 CS15801 [0,1,0,0,0,1|2,0,0]=4 85 B14R2.966 COC(=O)C1=CC2=C(C=CN2)C=N1 MC115743 [0,1,0,0,0,1|2,0,0]=4 86 B14R2.966 COC(=O)C1=CC2=C(C=CO2)C=C1 CS16726 [0,1,0,0,0,1|1,1,0]=4 87 B14R2.966 COC(=O)C1=CC=C2C=CNC2=C1 CS13334 [0,1,0,0,0,1|2,0,0]=4 88 B14R2.966 COC(=O)C1=CC=C2NC=CC2=C1 CS11358 [0,1,0,0,0,1|2,0,0]=4 89 B14R2.966 COC(=O)C1=CN=C2NC=CC2=C1 CS17035 [0,1,0,0,0,1|1,0,1]=4 90 B14R2.966 COC(=O)C1=NC2=C(C=CN2)C=N1 MC102048 [0,1,0,0,0,1|1,0,1]=4 91 B14R2.966 COC(=O)C1=NC=C2NC=CC2=C1 CS11589 [0,1,0,0,0,1|1,0,1]=4 92 B14R2.966 O=C(CBr)C1=CC2=C(C=C1)SC=C2 MC430353 [0,1,0,0,0,1|2,0,0]=4 93 B14R2.5719 CC1=CNC2=CC(C(=O)O)=CC=C12 MC113394 [0,1,0,0,0,1|2,0,0]=4 94 B14R2.5719 CC1=CNC2=NC(C(=O)O)=CC=C12 MC104443 [0,1,0,0,0,1|1,0,1]=4 95 B14R2.5719 CN1C=CC2=CC(C(=O)O)=CN=C21 MC444123 [0,1,0,0,0,1|1,0,1]=4 96 B14R2.5998 CN1C2=C(C=CN2)C=NC1C(=O)O MC103976 [0,1,0,0,0,1|1,0,1]=4 97 B14R2.5998 O=C(O)C1=CC=C2C=CNC2=C1Cl MC102538 [0,1,0,0,0,1|2,0,0]=4 98 B14R2.5998 O=C(O)C1=CC=C2C=CNC2=C1F MC105970 [0,1,0,0,0,1|2,0,0]=4 99 B14R2.5998 O=C(O)C1=CN=C2NC=CC2=C1Cl CS13129 [0,1,0,0,0,1|1,0,1]=4 100 B14R2.5998 O=C(O)C1=CN=C2NC=CC2=C1F MC431605 [0,1,0,0,0,1|1,0,1]=4 101 B14R2.8824 O=C(O)C1=CC(O)=C2C=CNC2=C1 MC113364 [0,1,0,0,0,1|2,0,0]=4 102 B14R2.24358 CC1=CNC2=NC=C(C(=O)O)C=C12 MC104439 [0,1,0,0,0,1|1,0,1]=4 103 B14R2.24358 CN1C=CC2=C1N=C(C(=O)O)N=C2 MC104465 [0,1,0,0,0,1|1,0,1]=4 104 B14R2.24358 CN1C=CC2=CC=C(C(=O)O)C=C21 CS20750 [0,1,0,0,0,1|2,0,0]=4 105 B14R2.24358 O=C(O)C1=CC=C2NC=C(Br)C2=C1 MC425471 [0,1,0,0,0,1|2,0,0]=4 106 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 MC41799 [0,1,0,0,0,1|2,0,0]=4 107 B14R2.450 CN1C(C(=O)O)=CC2=CC=CC=C21 CS11350 [0,1,0,0,0,1|1,0,0]=3 108 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 MC433155 [0,1,0,0,0,1|2,0,0]=4 109 B14R2.972 COC(=O)C1=CC2=C(C=CC=C2)S1 MC429622 [0,1,0,0,0,1|2,0,0]=4 110 B14R2.972 COC(=O)C1=CC2=C(N=CN=C2)N1 MC104527 [0,1,0,0,0,1|1,0,0]=3 111 B14R2.972 COC(=O)C1=CC2=CC=CC=C2N1 CS11361 [0,1,0,0,0,1|1,0,0]=3 112 B14R2.972 COC(=O)C1=CC2=CC=CN=C2N1 CS13203 [0,1,0,0,0,1|1,0,0]=3 113 B14R2.972 COC(=O)C1=CC2=NC=CN=C2S1 CS18450 [0,1,0,0,0,1|2,0,0]=4 114 B14R2.972 COC(=O)C1=NC2=C(C=CC=C2)N1 MC107164 [0,1,0,0,0,1|2,0,0]=4 115 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)O2 MC441314 [0,1,0,0,0,1|2,0,0]=4 116 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)S2 MC41800 [0,1,0,0,0,1|2,0,0]=4 117 B14R2.4529 CC1=CC2=C(C=C1)OC(C(=O)O)=C2 MC441312 [0,1,0,0,0,1|2,0,0]=4 118 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=C1 CS10730 [0,1,0,0,0,1|1,0,0]=3 119 B14R2.4529 CC1=CC=C2C=C(C(=O)O)NC2=N1 MC104472 [0,1,0,0,0,1|1,0,0]=3 120 B14R2.4529 CC1=CC=C2C=C(C(=O)O)SC2=N1 MC441321 [0,1,0,0,0,1|2,0,0]=4 121 B14R2.4529 CC1=CC=C2NC(C(=O)O)=CC2=C1 CS10456 [0,1,0,0,0,1|1,0,0]=3 122 B14R2.4529 CC1=CC=C2NC(C(N)=O)=CC2=C1 MC107564 [0,1,0,0,0,1|2,0,0]=4 123 B14R2.4529 NC1=CN=C2NC(C(=O)O)=CC2=C1 MC104471 [0,1,0,0,0,1|1,0,0]=3 124 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)O1 MC114702 [0,1,0,0,0,1|2,0,0]=4 125 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)S1 MC441038 [0,1,0,0,0,1|2,0,0]=4 126 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)O1 MC441313 [0,1,0,0,0,1|2,0,0]=4 127 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)S1 MC443455 [0,1,0,0,0,1|2,0,0]=4 128 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)N=C2)N1 CS12323 [0,1,0,0,0,1|1,0,0]=3 129 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)O1 MC114912 [0,1,0,0,0,1|2,0,0]=4 130 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 MC441164 [0,1,0,0,0,1|2,0,0]=4 131 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)S1 MC41760 [0,1,0,0,0,1|2,0,0]=4 132 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)O1 MC441171 [0,1,0,0,0,1|2,0,0]=4 133 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)S1 MC441141 [0,1,0,0,0,1|2,0,0]=4 134 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)O1 MC441172 [0,1,0,0,0,1|2,0,0]=4 135 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)S1 MC41787 [0,1,0,0,0,1|2,0,0]=4 136 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2N1 MC444391 [0,1,0,0,0,1|1,0,0]=3 137 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CN=C2S1 MC441323 [0,1,0,0,0,1|2,0,0]=4 138 B14R2.4529 O=C(O)C1=CC2=CC(Br)=NC=C2N1 CS15209 [0,1,0,0,0,1|1,0,0]=3 139 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2N1 CS22050 [0,1,0,0,0,1|1,0,0]=3 140 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 MC20054 [0,1,0,0,0,1|1,0,0]=3 141 B14R2.4529 O=C(O)C1=CC2=CC(F)=CN=C2N1 MC103942 [0,1,0,0,0,1|1,0,0]=3 142 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2N1 CS22090 [0,1,0,0,0,1|1,0,0]=3 143 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)N=C2N1 MC444420 [0,1,0,0,0,1|1,0,0]=3 144 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2N1 MC20052 [0,1,0,0,0,1|1,0,0]=3 145 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)N=C2N1 MC121106 [0,1,0,0,0,1|1,0,0]=3 146 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 MC20055 [0,1,0,0,0,1|1,0,0]=3 147 B14R2.4529 O=C(O)C1=CC2=NC(Br)=CC=C2N1 MC104549 [0,1,0,0,0,1|1,0,0]=3 148 B14R2.4529 O=C(O)C1=CC2=NC=C(Br)C=C2N1 MC102085 [0,1,0,0,0,1|1,0,0]=3 149 B14R2.4529 O=C(O)C1=CC2=NC=C(Cl)C=C2N1 MC102042 [0,1,0,0,0,1|1,0,0]=3 150 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 MC41759 [0,1,0,0,0,1|2,0,0]=4 151 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)S2 MC441057 [0,1,0,0,0,1|2,0,0]=4 152 B14R2.7969 CC1=CC=CC2=C1N=C(C(=O)O)N2 CS12511 [0,1,0,0,0,1|2,0,0]=4 153 B14R2.7969 CC1=CC=CC2=C1OC(C(=O)O)=C2 MC441311 [0,1,0,0,0,1|2,0,0]=4 154 B14R2.7969 CC1=CC=CC2=C1SC(C(=O)O)=C2 MC441142 [0,1,0,0,0,1|2,0,0]=4 155 B14R2.7969 NC1=CC=CC2=C1OC(C(=O)O)=C2 MC431602 [0,1,0,0,0,1|2,0,0]=4 156 B14R2.7969 O=C(O)C1=CC2=C(Br)C=NC=C2S1 MC441176 [0,1,0,0,0,1|2,0,0]=4 157 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)O1 MC441316 [0,1,0,0,0,1|2,0,0]=4 158 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)S1 MC441143 [0,1,0,0,0,1|2,0,0]=4 159 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)O1 MC441315 [0,1,0,0,0,1|2,0,0]=4 160 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Cl)S1 MC41767 [0,1,0,0,0,1|2,0,0]=4 161 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2F)O1 MC441317 [0,1,0,0,0,1|2,0,0]=4 162 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2F)S1 MC441145 [0,1,0,0,0,1|2,0,0]=4 163 B14R2.7969 O=C(O)C1=CC2=C(C=CN=C2Br)N1 MC105989 [0,1,0,0,0,1|1,0,0]=3 164 B14R2.7969 O=C(O)C1=CC2=C(C=CN=C2Cl)S1 MC441333 [0,1,0,0,0,1|2,0,0]=4 165 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CN=C2N1 MC444341 [0,1,0,0,0,1|1,0,0]=3 166 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=NC=C2S1 MC441177 [0,1,0,0,0,1|2,0,0]=4 167 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 CS14286 [0,1,0,0,0,1|1,0,0]=3 168 B14R2.7969 O=C(O)C1=CC2=C(N=CN=C2Cl)N1 CS12322 [0,1,0,0,0,1|1,0,0]=3 169 B14R2.7969 O=C(O)C1=CC2=C(N=CN=C2Cl)S1 MC441337 [0,1,0,0,0,1|2,0,0]=4 170 B14R2.7969 O=C(O)C1=CC2=C(N=NC=C2O)N1 MC116436 [0,1,0,0,0,1|1,0,0]=3 171 B14R2.7969 O=C(O)C1=CC2=C(O1)C(Br)=CC=C2 MC441300 [0,1,0,0,0,1|2,0,0]=4 172 B14R2.7969 O=C(O)C1=CC2=C(O1)C(F)=CC=C2 MC441298 [0,1,0,0,0,1|2,0,0]=4 173 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Br)=CC=C2 CS16632 [0,1,0,0,0,1|2,0,0]=4 174 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=CC=C2 CS10798 [0,1,0,0,0,1|2,0,0]=4 175 B14R2.7969 O=C(O)C1=CC2=C(S1)C(F)=CC=C2 MC441144 [0,1,0,0,0,1|2,0,0]=4 176 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 MC30342 [0,1,0,0,0,1|1,0,0]=3 177 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 CS12600 [0,1,0,0,0,1|1,0,0]=3 178 B14R2.7969 O=C(O)C1=CC2=CC=CC(O)=C2N1 MC106623 [0,1,0,0,0,1|1,0,0]=3 179 B14R2.7969 O=C(O)C1=CC2=CC=NC(Cl)=C2S1 MC441328 [0,1,0,0,0,1|2,0,0]=4 180 B14R2.839 CCOC(=O)C1=CC2=C(C=CS2)N1 CS14488 [0,2,0,0,0,0|2,0,0]=4 181 B12R2.1362 O=C(O)C1=CN=C2SC=CN12 CS12639 [0,0,1,1,0,0|1,0,0]=3 182 B10R1.23 NC(C(=O)O)C1=CC=CS1 MC103430 [0,0,1,0,1,0|1,0,1]=4 183 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O MC445160 [0,0,1,0,0,1|2,0,0]=4 184 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 CS10967 [0,0,1,0,0,1|2,0,0]=4 185 B12R1.226 O=C(O)\C=C\C1=CC(Br)=CC=C1 CS21499 [0,0,1,0,0,1|2,0,0]=4 186 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 CS21503 [0,0,1,0,0,1|2,0,0]=4 187 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 MC40208 [0,0,1,0,0,1|2,0,0]=4 188 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 CS10976 [0,0,1,0,0,1|2,0,0]=4 189 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 MC40216 [0,0,1,0,0,1|2,0,0]=4 190 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 CS10964 [1,0,0,0,0,1|2,0,0]=4 191 B12R2.32 O=CC1=CC2=CC=CC=C2N1 CS18099 [1,0,0,0,0,1|1,0,0]=3 192 B12R2.32 O=CC1=CC2=CC=NC=C2N1 MC116282 [1,0,0,0,0,1|1,0,0]=3 193 B12R2.32 O=CC1=CC2=CC=NC=C2S1 MC441877 [1,0,0,0,0,1|2,0,0]=4 194 B12R2.32 O=CC1=CC2=NC=CC=C2O1 MC103691 [1,0,0,0,0,1|2,0,0]=4 195 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 MC33243 [1,0,0,0,0,1|2,0,0]=4 196 B12R2.32 OCC1=CC2=CC=CC=C2N1 CS20715 [1,0,0,0,0,1|1,0,1]=4 197 B12R2.44 O=CC1=CC2=C(C=C1)N=CS2 MC427239 [1,0,0,0,0,1|2,0,0]=4 198 B12R2.44 O=CC1=CC2=C(C=C1)OC=C2 CS21474 [1,0,0,0,0,1|1,1,0]=4 199 B12R2.44 O=CC1=CC2=C(C=C1)SC=N2 MC115936 [1,0,0,0,0,1|2,0,0]=4 200 B12R2.44 O=CC1=CC2=C(C=C1)SN=C2 MC105912 [1,0,0,0,0,1|2,0,0]=4 201 B12R2.44 O=CC1=CC2=C(C=CO2)C=C1 MC441152 [1,0,0,0,0,1|1,1,0]=4 202 B12R2.44 O=CC1=CC2=C(C=CS2)C=C1 MC441269 [1,0,0,0,0,1|1,0,0]=3 203 B12R2.44 O=CC1=CC=C2C=CNC2=C1 CS21527 [1,0,0,0,0,1|2,0,0]=4 204 B12R2.44 O=CC1=CC=C2C=CNC2=N1 MC115920 [1,0,0,0,0,1|1,0,1]=4 205 B12R2.44 O=CC1=CC=C2NC=CC2=C1 CS21526 [1,0,0,0,0,1|2,0,0]=4 206 B12R2.44 O=CC1=NC=C2OC=CC2=C1 CS14660 [1,0,0,0,0,1|0,1,1]=4 207 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=C1 CS16292 [0,0,0,0,0,2|2,0,0]=4 208 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 CS11274 [0,0,0,0,0,2|1,0,1]=4 209 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 CS11279 [0,0,0,0,0,2|1,0,1]=4 210 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 CS10060 [0,0,0,0,0,2|1,0,1]=4 211 B14R2.781 O=C(O)C1=CC=C2C=NC=CC2=C1 CS10714 [0,0,0,0,0,2|2,0,0]=4 212 B14R2.781 O=C(O)C1=CC=C2C=NC=NC2=C1 MC102441 [0,0,0,0,0,2|2,0,0]=4 213 B14R2.781 O=C(O)C1=CC=C2N=CC=NC2=C1 CS11933 [0,0,0,0,0,2|2,0,0]=4 214 B14R2.781 O=C(O)C1=CC=C2N=CN=CC2=C1 MC425062 [0,0,0,0,0,2|2,0,0]=4 215 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 CS11276 [0,0,0,0,0,2|1,0,1]=4 216 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 CS21462 [0,0,0,0,0,2|1,0,1]=4 217 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 CS21460 [0,0,0,0,0,2|1,0,1]=4 218 B14R2.781 O=C(O)C1=NC2=CN=CC=C2C=C1 MC442821 [0,0,0,0,0,2|1,0,1]=4 219 B14R2.1008 CC(=O)OC1=CC2=C(C=C1)SC=C2 MC111399 [0,0,0,0,0,2|2,0,0]=4 220 B14R2.1008 O=C(O)CC1=CC=C2C=CNC2=C1 CS15626 [0,0,0,0,0,2|2,0,0]=4 221 B14R2.768 O=C(O)CC1=CC2=C(C=CC=C2)O1 CS21317 [0,0,0,0,0,2|2,0,0]=4 222 B14R2.768 O=C(O)CC1=CC2=CC=CC=C2N1 MC10334 [0,0,0,0,0,2|1,0,0]=3