0 B10R1.3 C#CC1=CC=C(C=O)C=C1 P36909 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.3 C#CC1=CC=C(CN)C=C1 O28144 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.3 C#CC1=CC=C(CO)C=C1 O28046 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.3 C#CC1=CC=C(NC)C=C1 M22819 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.3 C#CC1=CC=C(OC)N=C1 C-3464 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.3 C#CC1=CN=C(NC)C=C1 M23226 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.3 C#CC1=NC=C(OC)N=C1 O29922 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.3 CCC1=CC=C(CO)C=C1 Q68223 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.3 CCC1=NC=C(C=O)C=C1 Q60469 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.3 CNC1=CC=C(CO)C=C1 P40364 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.3 CNC1=NC=C(C=O)C=C1 Q55452 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.3 COC1=CC=C(C#N)C=N1 P40898 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.3 COC1=CC=C(CBr)C=C1 Q67503 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.3 COC1=CC=C(CBr)C=N1 N25219 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.3 COC1=CC=C(CN)N=C1 Q52335 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.3 COC1=CC=C(NN)C=C1 P43291 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.3 COC1=CN=C(C#N)C=C1 G-6236 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.3 COC1=CN=C(C#N)N=C1 I-9488 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.3 COC1=CN=C(C=O)C=C1 N24757 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.3 COC1=CN=C(C=O)C=N1 O29829 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.3 COC1=CN=C(C=O)N=C1 I-9829 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.3 COC1=CN=C(CCl)C=C1 L13052 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.3 COC1=CN=C(CCl)N=C1 L22074 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.3 COC1=CN=C(CN)N=C1 P46510 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.3 COC1=CN=C(CN)N=C1 Q52333 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.3 COC1=CN=C(CO)C=C1 I-9706 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.3 COC1=CN=C(OC)C=C1 Q67646 [0,0,0,0,0,0|1,0,0]=1 27 B10R1.3 COC1=NC=C(C#N)C=N1 Q53605 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.3 COC1=NC=C(C=O)C=N1 Q67228 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.3 COC1=NC=C(CCl)C=N1 Q55466 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.3 COC1=NC=C(CN)C=C1 C-3721 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.3 COC1=NC=C(CN)C=C1 G-6806 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.3 COC1=NC=C(CN)C=N1 Q55480 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.3 COC1=NC=C(CO)C=C1 C-3532 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.3 COC1=NC=C(CO)C=N1 L14377 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.3 COC1=NN=C(OC)C=C1 Q67359 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.3 CSC1=CC=C(NN)C=C1 O30693 [0,0,0,0,0,0|2,1,0]=3 37 B10R1.3 CSC1=NC=C(C=O)C=C1 N24581 [0,0,0,0,0,0|3,1,0]=4 38 B10R1.3 CSC1=NC=C(CO)C=C1 N25545 [0,0,0,0,0,0|3,1,0]=4 39 B10R1.3 N#CC1=CC=C(CN)C=C1 P42878 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.3 N#CC1=CC=C(CO)C=C1 P35569 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.3 NCC1=CC=C(CBr)C=C1 P38676 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.3 NCC1=CC=C(CO)C=C1 P38312 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.3 O=CC1=CC=C(CCl)C=C1 P45270 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.3 O=CC1=CC=C(CO)C=C1 P37667 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.3 OCC1=CC=C(CBr)C=C1 O28910 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.3 OCC1=CC=C(CCl)C=C1 P40748 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.1 C#CC1=CC=C(Br)C=C1 P36174 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.1 C#CC1=CC=C(Cl)C=C1 C-3288 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.1 C#CC1=CC=C(I)C=C1 P36173 [1,0,0,0,0,0|2,0,1]=4 50 B9R1.1 C#CC1=CC=C(O)C=N1 O29432 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.1 C#CC1=NC=C(C)C=C1 O30107 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.1 C=CC1=CN=C(C)C=C1 L13585 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.1 CC1=CC=C(CN)C=N1 C-3518 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 CC1=CC=C(CO)C=N1 H-8186 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 CC1=CN=C(C=O)C=C1 Q67276 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 CC1=CN=C(CO)C=C1 N24952 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 CC1=NC=C(C=O)C=C1 C-2363 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 CCC1=CC=C(Br)N=C1 Q57112 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 CCC1=CC=C(Cl)N=C1 Q57111 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 CCC1=CC=C(N)C=N1 A-656 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 CCC1=NC=C(Br)C=C1 G-6695 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.1 CNC1=CC=C(Br)N=C1 Q65482 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 CNC1=CC=C(F)C=N1 Q58345 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.1 CNC1=CC=C(N)N=C1 Q58290 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CNC1=CC=C(N)N=C1 Q58291 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [1,0,0,0,0,0|1,0,0]=2 69 B9R1.1 CNC1=NC=C(Br)C=C1 P35851 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.1 COC1=CN=C(Br)C=C1 Q67224 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.1 COC1=CN=C(Br)C=N1 O34252 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.1 COC1=CN=C(Br)N=C1 G-6823 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.1 COC1=CN=C(Cl)C=C1 Q67222 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.1 COC1=CN=C(Cl)N=C1 I-9250 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.1 COC1=CN=C(F)C=C1 N24701 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.1 COC1=CN=C(I)N=C1 Q53690 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 COC1=CN=C(N)C=C1 G-7588 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.1 COC1=CN=C(N)C=N1 O31841 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 COC1=CN=C(N)N=C1 G-5676 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 COC1=NC=C(C)C=C1 Q67071 [1,0,0,0,0,0|1,0,0]=2 81 B9R1.1 COC1=NC=C(F)C=C1 P37735 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.1 COC1=NC=C(I)C=C1 Q67264 [1,0,0,0,0,0|2,0,0]=3 83 B9R1.1 COC1=NC=C(N)C=N1 O31128 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.1 COC1=NC=C(O)C=C1 Q67584 [1,0,0,0,0,0|1,0,0]=2 85 B9R1.1 COC1=NN=C(N)C=C1 P36408 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 CSC1=CN=C(Br)C=C1 N24931 [1,0,0,0,0,0|2,1,0]=4 87 B9R1.1 CSC1=CN=C(F)C=C1 N26916 [1,0,0,0,0,0|2,1,0]=4 88 B9R1.1 CSC1=NC=C(Br)C=C1 Q66696 [1,0,0,0,0,0|2,1,0]=4 89 B9R1.1 CSC1=NC=C(C)C=C1 N24295 [1,0,0,0,0,0|1,1,0]=3 90 B9R1.1 CSC1=NC=C(Cl)C=C1 N24817 [1,0,0,0,0,0|2,1,0]=4 91 B9R1.1 N#CC1=CC=C(S)C=C1 O30392 [1,0,0,0,0,0|2,1,0]=4 92 B9R1.1 N#CC1=NC=C(O)C=C1 G-6237 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 NCC1=CC=C(O)C=N1 O29328 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 NCC1=CC=C(O)C=N1 O31467 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 NNC1=CC=C(Br)C=C1 P38159 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.1 NNC1=CC=C(F)C=C1 P38478 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.1 O=CC1=CC=C(O)C=N1 P44434 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [1,0,0,0,0,0|2,1,0]=4 100 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 O27944 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.3 CC(N)C1=CC=C(C#N)C=C1 P35710 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.3 CC(N)C1=CC=C(CO)C=C1 P38103 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 P37663 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.3 CN(C)C1=CC=C(CN)C=C1 P40156 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O28119 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.3 CNC1=CC=C(N(C)C)C=C1 P37575 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 P50006 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.3 COC1=CC=C(C(N)=S)C=N1 O31104 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.3 COC1=CN=C(B(O)O)C=C1 Q52650 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.3 COC1=CN=C(C(=O)O)C=C1 Q68348 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.3 COC1=CN=C([C@@H](C)N)C=C1 Q62470 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 A-701 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.83 C=CCC1=CN=C(OC)C=C1 N26473 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.83 CCC1=CC=C(CCN)C=C1 P36862 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.83 CCC1=CC=C(CNC)C=C1 P37356 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.83 CCCC1=CN=C(OC)C=C1 N26472 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.83 CCNC1=CC=C(CC)C=C1 P37885 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.83 CCNC1=CC=C(OC)C=C1 P42858 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.83 CCOC1=CC=C(CBr)C=C1 P39282 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.83 CCOC1=CN=C(C=O)C=C1 Q60410 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.83 CCOC1=CN=C(CBr)C=C1 Q62401 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.83 CCOC1=CN=C(CCl)C=C1 Q62400 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.83 CCOC1=NC=C(C=O)C=C1 Q67337 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.83 CNCC1=CC=C(C#N)C=C1 P38675 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.83 CNCC1=CC=C(CN)C=C1 P38885 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.83 CNCC1=CN=C(OC)C=C1 L19846 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.83 COC1=CC=C(CCBr)C=C1 P41235 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.83 COC1=CC=C(CNN)C=C1 C-3256 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.83 COCC1=CC=C(C=O)C=C1 N25868 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.83 COCC1=CC=C(CO)C=C1 M23214 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.279 C#CC1=CC=C(OC)C(F)=C1 M22820 [0,1,0,0,0,0|1,0,1]=3 138 B11R1.279 CCC1=CC=C(OC)C=C1N O30194 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.279 COC1=C(Br)N=C(C=O)C=C1 O34034 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.279 COC1=C(Cl)C=C(CO)C=N1 Q67576 [0,1,0,0,0,0|3,0,0]=4 141 B11R1.279 COC1=CC(C)=C(C#N)C=N1 Q53580 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.279 COC1=CC(C)=C(CO)C=N1 N26452 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.279 COC1=CC=C(C#N)C(C)=N1 O30268 [0,1,0,0,0,0|3,0,0]=4 144 B11R1.279 COC1=CC=C(C#N)C=C1N O31758 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.279 COC1=CC=C(C=O)C(C)=C1 Q67923 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.279 COC1=CC=C(C=O)C(C)=N1 N25093 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.279 COC1=CC=C(C=O)C(Cl)=N1 N26232 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.279 COC1=CC=C(C=O)C(N)=C1 O32243 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.279 COC1=CC=C(C=O)N=C1C N27704 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.279 COC1=CC=C(CBr)C=C1Br N25169 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.279 COC1=CC=C(CO)C(Br)=C1 N24390 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.279 COC1=CC=C(CO)C(C)=C1 N24982 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.279 COC1=CC=C(CO)C(C)=N1 Q67841 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.279 COC1=CC=C(CO)C(Cl)=C1 N25365 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 N26191 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.279 COC1=CC=C(CO)C(F)=C1 P38219 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.279 COC1=CC=C(CO)C(O)=C1 N24302 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.279 COC1=CC=C(CO)C=C1Br Q67814 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.279 COC1=CC=C(CO)C=C1C Q67936 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.279 COC1=CC=C(CO)C=C1Cl Q67888 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.279 COC1=CC=C(CO)C=C1F Q65952 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.279 COC1=CC=C(OC)C(O)=C1 N24557 [0,1,0,0,0,0|0,0,0]=1 163 B11R1.279 COC1=CN=C(C=O)C(C)=C1 Q60407 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.279 COC1=CN=C(C=O)C=C1Cl O29323 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.279 COC1=CN=C(CCl)C=C1Cl O32182 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.279 COC1=CN=C(CO)C=C1O O31707 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.279 COC1=CN=C(OC)C(C)=C1 N26962 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.279 COC1=CN=C(OC)C(Cl)=C1 N27771 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.279 COC1=NC=C(C#N)C(I)=C1 O33647 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.279 COC1=NC=C(C=O)C(C)=C1 Q66658 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.279 COC1=NC=C(C=O)C=C1Br Q67210 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.279 COC1=NC=C(C=O)C=C1C N25919 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.279 COC1=NC=C(C=O)C=C1Cl Q66656 [0,1,0,0,0,0|3,0,0]=4 174 B11R1.279 COC1=NC=C(CO)C=C1Br N25984 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.279 COC1=NC=C(CO)C=C1C N26256 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.279 COC1=NN=C(OC)C(I)=C1 N25073 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.279 CSC1=C(Cl)C=C(C=O)C=C1 N27211 [0,1,0,0,0,0|2,1,0]=4 178 B11R1.279 CSC1=C(F)C=C(C=O)C=C1 N25178 [0,1,0,0,0,0|2,1,0]=4 179 B11R1.279 CSC1=C(F)C=C(CO)C=C1 N25670 [0,1,0,0,0,0|2,1,0]=4 180 B11R1.279 CSC1=CC=C(C=O)C(C)=C1 S70485 [0,1,0,0,0,0|2,1,0]=4 181 B11R1.279 CSC1=CC=C(C=O)C(F)=C1 N25674 [0,1,0,0,0,0|2,1,0]=4 182 B8R1.2 COC1=CN=CN=C1 M15459 [2,0,0,0,0,0|2,0,0]=4 183 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.3 CC1=CC=C(F)C=N1 P38896 [2,0,0,0,0,0|2,0,0]=4 185 B8R1.3 CC1=CN=C(I)C=C1 O29967 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.3 CC1=NC=C(O)C=N1 O33295 [2,0,0,0,0,0|2,0,0]=4 187 B8R1.3 CC1=NN=C(O)C=C1 C-2282 [2,0,0,0,0,0|2,0,0]=4 188 B8R1.3 NC1=CC=C(O)C=N1 E-3088 [2,0,0,0,0,0|2,0,0]=4 189 B8R1.3 OC1=CC=C(Br)N=C1 C-3384 [2,0,0,0,0,0|2,0,0]=4 190 B8R1.3 OC1=CN=C(Cl)C=C1 G-5339 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.1 BrC1=CC=C(CCI)C=C1 P35777 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.1 BrCCC1=CC=C(Br)C=C1 P40516 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.1 C=COC1=CC=C(Br)C=C1 N25160 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.1 CC1=CC=C(CCN)N=C1 Q58444 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.1 CCNC1=CC=C(Br)C=C1 P36614 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.1 CCNC1=CC=C(Cl)C=C1 P41554 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.1 CCNC1=CC=C(F)C=C1 O32514 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.1 CCNC1=CC=C(N)C=C1 P37237 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.1 CCOC1=CC=C(F)C=C1 M23303 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.1 CCOC1=NC=C(Cl)C=C1 N25842 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.1 CCOC1=NC=C(F)C=C1 N24463 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.1 CNCC1=CC=C(Cl)C=C1 P42874 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.1 CNCC1=CC=C(N)C=C1 P38425 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.1 CNCC1=CC=C(O)C=C1 P36065 [1,1,0,0,0,0|1,0,0]=3 205 B10R1.1 COCC1=CC=C(Br)C=C1 Q67196 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.1 COCC1=CN=C(Br)C=C1 N25975 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.1 COCC1=NC=C(Br)C=C1 N27297 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.1 COCC1=NC=C(O)C=N1 Q65340 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.1 FC1=CC=C(CCBr)C=C1 I-9285 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.1 NCCC1=CC=C(I)C=C1 P36354 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.1 NOCC1=CC=C(Cl)C=C1 O31868 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.1 NOCC1=CC=C(F)C=C1 10767 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [1,1,0,0,0,0|1,0,0]=3 221 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.25 C#CC1=CC=C(C)C=C1C P40859 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.25 CC1=CC(O)=CC=C1C=O Q68156 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.25 CC1=CC(O)=CC=C1CO Q68377 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.25 CC1=CC=C(C#N)C(Cl)=C1 Q68084 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.25 CC1=CC=C(C=O)C(F)=C1 Q67651 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.25 CC1=CC=C(CO)C(Br)=C1 N24923 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.25 CC1=CC=C(CO)C(C)=C1 P40779 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.25 CC1=CC=C(CO)C(Cl)=C1 N25728 [1,1,0,0,0,0|2,0,0]=4 230 B10R1.25 CC1=CC=C(CO)C(F)=C1 Q67939 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.25 CC1=CC=C(CO)C(O)=C1 N25355 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.25 CC1=CC=C(NO)C(Cl)=C1 O29263 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.25 CCC1=CC=C(Cl)C=C1N O29377 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.25 CNC1=CC=C(C)C=C1F P37822 [1,1,0,0,0,0|1,0,0]=3 235 B10R1.25 COC1=C(Br)N=C(F)C=C1 N26207 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.25 COC1=C(Br)N=C(N)C=C1 O30533 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.25 COC1=C(C)C=C(Br)C=N1 10642 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.25 COC1=C(C)C=C(O)C=C1 N25234 [1,1,0,0,0,0|0,0,0]=2 239 B10R1.25 COC1=C(Cl)C=C(I)C=C1 N24180 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.25 COC1=C(Cl)N=C(N)C=C1 G-6967 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.25 COC1=CC=C(Br)C=C1F I-9161 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.25 COC1=CC=C(Br)C=C1N Q67396 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.25 COC1=CC=C(Br)N=C1C N24916 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.25 COC1=CC=C(Br)N=C1F N26001 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.25 COC1=CC=C(Br)N=C1N Q65385 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.25 COC1=CC=C(C)C=C1F Q67608 [1,1,0,0,0,0|0,0,0]=2 247 B10R1.25 COC1=CC=C(C)N=C1Br Q67211 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.25 COC1=CC=C(C)N=C1F N26378 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.25 COC1=CC=C(Cl)N=C1Cl N25563 [1,1,0,0,0,0|2,0,0]=4 250 B10R1.25 COC1=CC=C(F)N=C1C N26375 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.25 COC1=CC=C(I)C=C1Br Q68173 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.25 COC1=CC=C(I)N=C1Br Q67215 [1,1,0,0,0,0|2,0,0]=4 253 B10R1.25 COC1=CC=C(O)C=C1Br Q66991 [1,1,0,0,0,0|0,0,0]=2 254 B10R1.25 COC1=CC=C(O)C=C1Cl Q67654 [1,1,0,0,0,0|0,0,0]=2 255 B10R1.25 COC1=CC=C(O)C=C1F Q67009 [1,1,0,0,0,0|0,0,0]=2 256 B10R1.25 COC1=CN=C(Br)C=C1N Q65374 [1,1,0,0,0,0|2,0,0]=4 257 B10R1.25 COC1=CN=C(Cl)C=C1C Q67505 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.25 COC1=CN=C(Cl)C=C1N Q69333 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.25 COC1=CN=C(F)C=C1Br N25531 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.25 COC1=CN=C(F)C=C1C N24782 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.25 COC1=CN=C(F)C=C1I N25508 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.25 COC1=CN=C(N)C=C1Br P48328 [1,1,0,0,0,0|2,0,0]=4 263 B10R1.25 COC1=CN=C(N)C=C1C L20666 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.25 COC1=CN=C(N)C=C1Cl G-6858 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.25 COC1=NC=C(Br)C=C1Cl Q67094 [1,1,0,0,0,0|2,0,0]=4 266 B10R1.25 COC1=NC=C(Br)C=C1I Q67165 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.25 COC1=NC=C(Br)C=C1N C-3689 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.25 COC1=NC=C(Br)C=C1N N26780 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.25 COC1=NC=C(Br)C=C1O G-6879 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.25 COC1=NC=C(C)C=C1Br N25597 [1,1,0,0,0,0|1,0,0]=3 271 B10R1.25 COC1=NC=C(Cl)C=C1I N26342 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.25 COC1=NC=C(I)C=C1C N25697 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.25 COC1=NC=C(O)C=C1C N25032 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.25 COC1=NC=C(O)C=C1Cl N25353 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 N26937 [1,1,0,0,0,0|1,1,0]=4 276 B10R1.25 CSC1=C(Cl)C=C(O)C=C1 N27242 [1,1,0,0,0,0|0,1,0]=3 277 B10R1.25 CSC1=CC=C(Br)C=C1C Q68080 [1,1,0,0,0,0|1,1,0]=4 278 B10R1.25 CSC1=CC=C(Br)C=C1F Q67467 [1,1,0,0,0,0|1,1,0]=4 279 B10R1.25 CSC1=CC=C(C)C=C1Br Q67598 [1,1,0,0,0,0|0,1,0]=3 280 B10R1.25 CSC1=CC=C(Cl)C=C1Br N24474 [1,1,0,0,0,0|1,1,0]=4 281 B10R1.25 CSC1=CC=C(F)C=C1Br Q67404 [1,1,0,0,0,0|1,1,0]=4 282 B10R1.25 CSC1=CC=C(F)C=C1C N24243 [1,1,0,0,0,0|1,1,0]=4 283 B10R1.25 CSC1=CC=C(F)C=C1F Q67753 [1,1,0,0,0,0|1,1,0]=4 284 B10R1.25 CSC1=CC=C(F)C=C1O N25555 [1,1,0,0,0,0|1,1,0]=4 285 B10R1.25 CSC1=CC=C(N)C=C1F O29735 [1,1,0,0,0,0|1,1,0]=4 286 B10R1.25 CSC1=NC=C(C)C=C1Br N25458 [1,1,0,0,0,0|1,1,0]=4 287 B10R1.25 CSC1=NC=C(O)C=C1C N27254 [1,1,0,0,0,0|1,1,0]=4 288 B10R1.25 O=CC1=CC=C(O)C=C1Cl P37350 [1,1,0,0,0,0|2,0,0]=4 289 B10R1.25 OCC1=CC=C(O)C=C1F O30496 [1,1,0,0,0,0|2,0,0]=4 290 B10R1.176 CC1=C(O)C=C(C=O)C=C1 N25292 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.176 CC1=CC(C=O)=CC=C1O Q68150 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.176 CC1=CC=C(C#N)C=C1Cl P39756 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.176 CC1=CC=C(C=O)C=C1Br Q67254 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.176 CC1=CC=C(C=O)C=C1Cl Q67635 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.176 CC1=CC=C(CO)C=C1Br Q67930 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.176 CCC1=CC=C(F)C(Br)=C1 N24841 [1,1,0,0,0,0|2,0,0]=4 297 B10R1.176 CCC1=CC=C(N)C(F)=C1 O34054 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.176 COC1=CC(=O)N(C)C=C1 O31429 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.176 COC1=CC(Cl)=C(N)C=N1 P43475 [1,1,0,0,0,0|2,0,0]=4 300 B10R1.176 COC1=CC=C(Br)C(Br)=N1 O32648 [1,1,0,0,0,0|2,0,0]=4 301 B10R1.176 COC1=CC=C(Br)C(Cl)=N1 Q68267 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.176 COC1=CC=C(Br)C(I)=C1 Q68050 [1,1,0,0,0,0|1,0,0]=3 303 B10R1.176 COC1=CC=C(Br)C(N)=N1 M15811 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.176 COC1=CC=C(Br)C(O)=C1 Q66993 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.176 COC1=CC=C(C)C(Br)=C1 N24125 [1,1,0,0,0,0|0,0,0]=2 306 B10R1.176 COC1=CC=C(C)C(Cl)=N1 O32368 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.176 COC1=CC=C(C)C(F)=C1 Q67079 [1,1,0,0,0,0|0,0,0]=2 308 B10R1.176 COC1=CC=C(C)C(O)=C1 Q67987 [1,1,0,0,0,0|0,0,0]=2 309 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 Q57228 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.176 COC1=CC=C(Cl)C(N)=N1 Q53164 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.176 COC1=CC=C(F)C(I)=C1 N24584 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.176 COC1=CC=C(F)C(O)=C1 Q67529 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.176 COC1=CC=C(I)C(Br)=C1 Q67866 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.176 COC1=CC=C(N)C(C)=N1 P37660 [1,1,0,0,0,0|2,0,0]=4 315 B10R1.176 COC1=CC=C(N)C(C)=N1 P38847 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.176 COC1=CC=C(N)C(I)=C1 Q52916 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.176 COC1=CC=C(N)C(O)=C1 M15200 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.176 COC1=CC=C(N)C(O)=C1 M15201 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.176 COC1=CC=C(O)C(C)=C1 Q67705 [1,1,0,0,0,0|0,0,0]=2 320 B10R1.176 COC1=CN=C(Br)C(C)=C1 N25865 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.176 COC1=CN=C(Br)C(F)=C1 O29400 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.176 COC1=CN=C(C)C(Br)=C1 I-9994 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.176 COC1=CN=C(Cl)C(C)=C1 N25631 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.176 COC1=CN=C(F)C(C)=C1 N25926 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.176 COC1=CN=C(F)C(I)=C1 N25099 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.176 COC1=CN=C(F)C(O)=C1 N27785 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.176 COC1=CN=C(N)C(Br)=C1 Q53409 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.176 COC1=NC(C)=C(F)C=C1 P38455 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.176 COC1=NC(C)=C(O)C=N1 Q62960 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.176 COC1=NC=C(Br)C(C)=C1 Q66996 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.176 COC1=NC=C(Br)C(F)=C1 P49377 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.176 COC1=NC=C(Br)C(N)=C1 G-5633 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.176 COC1=NC=C(C)C(Br)=C1 Q62263 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.176 COC1=NC=C(Cl)C(C)=C1 N24194 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.176 COC1=NC=C(Cl)C(I)=C1 O29143 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.176 COC1=NC=C(Cl)C(O)=C1 N26019 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.176 COC1=NC=C(F)C(N)=C1 Q52643 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.176 COC1=NC=C(F)C(O)=C1 O31520 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.176 COC1=NC=C(I)C(C)=C1 Q67976 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.176 COC1=NC=C(N)C(I)=C1 Q62441 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.176 COC1=NC=C(N)C(O)=C1 O29805 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.176 COC1=NC=C(O)C(C)=C1 N25924 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.176 CSC1=CC(F)=C(F)C=C1 N24442 [1,1,0,0,0,0|1,1,0]=4 344 B10R1.176 CSC1=CC(O)=C(C)C=C1 N26961 [1,1,0,0,0,0|0,1,0]=3 345 B10R1.176 CSC1=CC(O)=C(F)C=C1 N27741 [1,1,0,0,0,0|1,1,0]=4 346 B10R1.176 CSC1=CC=C(Br)C(C)=C1 N24368 [1,1,0,0,0,0|1,1,0]=4 347 B10R1.176 CSC1=CC=C(Br)C(F)=C1 N24385 [1,1,0,0,0,0|1,1,0]=4 348 B10R1.176 CSC1=CC=C(O)C(C)=C1 N24608 [1,1,0,0,0,0|0,1,0]=3 349 B10R1.176 N#CC1=CC=C(O)C(I)=C1 O31643 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.176 N#CC1=CC=C(O)C(N)=C1 O30796 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.176 OCC1=CC=C(O)C(Br)=C1 Q68849 [1,1,0,0,0,0|2,0,0]=4 352 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 P35874 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.5 CCC(O)C1=CC=C(OC)C=C1 P37583 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 Q68222 [0,2,0,0,0,0|1,0,0]=3 355 B12R1.5 COC(=O)C1=CC=C(OC)C=N1 Q56358 [0,2,0,0,0,0|1,0,0]=3 356 B12R1.5 COC(=O)C1=CN=C(OC)N=C1 Q67509 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.5 COC(=O)C1=CN=C(SC)C=C1 O29122 [0,2,0,0,0,0|1,1,0]=4 358 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 P48338 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 P40807 [0,2,0,0,0,0|1,0,1]=4 360 B12R1.5 COC1=CC=C(C(N)CO)C=C1 P41432 [0,2,0,0,0,0|1,0,0]=3 361 B12R1.5 COC1=CC=C(C(O)CN)C=C1 P37470 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 P43091 [0,2,0,0,0,0|1,0,0]=3 363 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 P40188 [0,2,0,0,0,0|1,0,0]=3 364 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 P42415 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.6 COC1=CC=C([B-](F)(F)F)C=C1 Q66553 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.48 CNC1=CC=C(C(C)=O)C=C1N O31571 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.48 COC1=C(Br)C=C(B(O)O)C=C1 N26872 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 N26398 [0,2,0,0,0,0|2,0,0]=4 369 B12R1.48 COC1=CC=C(C(C)=O)C=C1C Q67903 [0,2,0,0,0,0|1,0,0]=3 370 B12R1.48 COC1=CC=C(C(C)C)C=C1Br Q67537 [0,2,0,0,0,0|1,0,0]=3 371 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 P42866 [0,2,0,0,0,0|1,0,0]=3 372 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 M23131 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 P35884 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 P36718 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.256 CC(O)C1=CC=C(N(C)C)C=C1 P37588 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.452 COC1=CC(O)=C(B(O)O)C=C1 N27743 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.452 COC1=CC=C(B(O)O)C(Br)=C1 N26729 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.452 COC1=CC=C(C(C)C)C(F)=C1 C-3733 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.452 COC1=CC=C(C(C)O)C(F)=C1 N25311 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.452 COC1=CC=C(C(N)=O)C(N)=C1 M23146 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 O30894 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 L19340 [0,2,0,0,0,0|1,0,1]=4 383 B12R1.4 COC1=CC=C(CC(=O)[O-])C=C1 Q66992 [0,2,0,0,0,0|1,0,1]=4 384 B12R1.4 COC1=CC=C(NC(C)C)C=C1 P40746 [0,2,0,0,0,0|1,0,0]=3 385 B12R1.4 COC1=CC=C(OC(C)=O)C=C1 Q67288 [0,2,0,0,0,0|0,0,0]=2 386 B12R1.71 C#CC1=CC=C(OCCC)C=C1 P38335 [0,2,0,0,0,0|1,0,1]=4 387 B12R1.71 C#CCOC1=CC=C(OC)C=C1 P40611 [0,2,0,0,0,0|0,0,0]=2 388 B12R1.71 C=CCOC1=CC=C(C=O)C=C1 P38204 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.71 C=CCOC1=CC=C(OC)C=C1 P41609 [0,2,0,0,0,0|0,0,0]=2 390 B12R1.71 CCC1=CC=C(CCCO)C=C1 O28817 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.71 CCC1=CC=C(OCCN)C=C1 P36697 [0,2,0,0,0,0|1,0,0]=3 392 B12R1.71 CCC1=CC=C(OCCO)C=C1 P37522 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.71 CCOCC1=CC=C(C=O)C=C1 Q68273 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.71 CCOCC1=CC=C(CO)C=C1 Q68755 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.71 CNCCC1=CC=C(OC)C=C1 P38192 [0,2,0,0,0,0|1,0,0]=3 396 B12R1.71 COC1=CC=C(C#CCBr)C=C1 L19331 [0,2,0,0,0,0|1,0,0]=3 397 B12R1.71 COC1=CC=C(C#CCO)C=C1 O27972 [0,2,0,0,0,0|1,0,0]=3 398 B12R1.71 COC1=CC=C(CCCBr)C=C1 O28114 [0,2,0,0,0,0|1,0,0]=3 399 B12R1.71 COC1=CC=C(CCCI)C=C1 O28095 [0,2,0,0,0,0|1,0,0]=3 400 B12R1.71 COC1=CC=C(CCCN)C=C1 P38522 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.71 COC1=CC=C(CCCO)C=C1 P37549 [0,2,0,0,0,0|1,0,0]=3 402 B12R1.71 COC1=CC=C(NCCN)C=C1 P39417 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.71 COC1=CC=C(OCCN)C=C1 P37768 [0,2,0,0,0,0|0,0,0]=2 404 B12R1.71 COC1=CC=C(OCCO)C=C1 P37559 [0,2,0,0,0,0|0,0,0]=2 405 B12R1.71 COCOC1=CC=C(OC)C=C1 Q68165 [0,2,0,0,0,0|0,0,0]=2 406 B12R1.71 CSC1=CC=C(OCCN)C=C1 P42324 [0,2,0,0,0,0|0,1,0]=3 407 B12R1.71 N#CC1=CC=C(OCCN)C=C1 P36696 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.71 N#CCOC1=CC=C(C=O)C=C1 P38390 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.71 O=CC1=CC=C(OCCBr)C=C1 Q69372 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.71 O=CC1=CC=C(OCCF)C=C1 Q69754 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.71 OCC1=CC=C(OCCF)C=C1 Q69755 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.114 CCOC1=C(F)C=C(C=O)C=C1 N25044 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.114 CCOC1=CC=C(C=O)C=C1Br Q66291 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.114 CCOC1=CC=C(C=O)C=C1Cl Q68068 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.114 COC1=CC=C(CC#N)C(F)=C1 P36276 [0,2,0,0,0,0|1,0,1]=4 416 B12R1.114 COC1=CC=C(CCN)C(F)=C1 P38246 [0,2,0,0,0,0|1,0,0]=3 417 B12R1.116 CCOC1=CC=C(CCN)C=C1 P36961 [0,2,0,0,0,0|1,0,0]=3 418 B12R1.116 CCOC1=CC=C(CCO)C=C1 O28110 [0,2,0,0,0,0|1,0,0]=3 419 B12R1.288 CCOC1=CC=C(C=O)C(C)=C1 N24705 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.288 CCOC1=CC=C(C=O)C(Cl)=C1 N25806 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.288 CCOC1=CC=C(CO)C(Cl)=C1 N27589 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.288 COCC1=CC=C(OC)C(Br)=C1 Q67879 [0,2,0,0,0,0|0,0,0]=2 423 B12R1.78 C#CC1=CC=C(OC)C(OC)=C1 P38107 [0,2,0,0,0,0|1,0,1]=4 424 B12R1.78 COC1=C(C=O)C=C(SC)C=C1 N26947 [0,2,0,0,0,0|0,1,0]=3 425 B12R1.78 COC1=C(CN)C=C(C=O)C=C1 L21072 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.78 COC1=CC=C(C#N)C(C#N)=C1 P51217 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.78 COC1=CC=C(SC)C(OC)=N1 N27351 [0,2,0,0,0,0|1,1,0]=4 428 B12R1.301 COC1=C(Br)C=C(C=O)C=C1Br N24925 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.301 COC1=C(Br)C=C(CO)C=C1Br N25755 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.301 COC1=C(C)C=C(C=O)C=C1C Q67384 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.301 COC1=C(Cl)C=C(C=O)C=C1Br Q66936 [0,2,0,0,0,0|2,0,0]=4 432 B12R1.301 COC1=C(Cl)C=C(C=O)C=C1Cl Q67658 [0,2,0,0,0,0|2,0,0]=4 433 B12R1.301 COC1=C(Cl)C=C(CO)C=C1Br N25575 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.301 COC1=C(Cl)C=C(CO)C=C1Cl N25302 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.301 COC1=C(F)C=C(C=O)C=C1Cl Q67282 [0,2,0,0,0,0|2,0,0]=4 436 B12R1.301 COC1=C(F)C=C(C=O)C=C1F Q67382 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.301 COC1=C(F)C=C(CO)C=C1Cl Q68370 [0,2,0,0,0,0|2,0,0]=4 438 B12R1.301 COC1=C(F)C=C(CO)C=C1F Q67446 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.301 COC1=CC(C)=C(C=O)C(C)=C1 Q67570 [0,2,0,0,0,0|2,0,0]=4 440 B12R1.301 COC1=CC(C)=C(CO)C(C)=C1 N25763 [0,2,0,0,0,0|2,0,0]=4 441 B12R1.301 COC1=CC(Cl)=C(C=O)C(Cl)=C1 O30502 [0,2,0,0,0,0|2,0,0]=4 442 B12R1.301 COC1=CC(F)=C(C=O)C(F)=C1 Q66534 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.301 COC1=CC(F)=C(CO)C(F)=C1 Q67528 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.301 COC1=CC(F)=C(SC)C(F)=C1 N27380 [0,2,0,0,0,0|0,1,0]=3 445 B12R1.450 COC1=C(Cl)C=C(C=O)C(F)=C1 N25987 [0,2,0,0,0,0|2,0,0]=4 446 B12R1.450 COC1=C(Cl)C=C(CO)C(F)=C1 N27214 [0,2,0,0,0,0|2,0,0]=4 447 B12R1.450 COC1=C(F)C=C(C=O)C(F)=C1 Q67617 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.450 COC1=C(F)C=C(CO)C(F)=C1 N27730 [0,2,0,0,0,0|2,0,0]=4 449 B12R1.450 COC1=CC(Br)=C(OC)C=C1O Q67393 [0,2,0,0,0,0|0,0,0]=2 450 B12R1.450 COC1=CC(C)=C(OC)C=C1Br Q67062 [0,2,0,0,0,0|0,0,0]=2 451 B12R1.653 COC1=C(Cl)C(F)=C(C=O)C=C1 N26579 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.653 COC1=C(Cl)C(F)=C(CO)C=C1 N26726 [0,2,0,0,0,0|2,0,0]=4 453 B12R1.653 COC1=C(O)C(F)=C(C=O)C=C1 N25456 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.653 COC1=CC=C(C=O)C(C)=C1C Q68423 [0,2,0,0,0,0|2,0,0]=4 455 B12R1.653 COC1=CC=C(C=O)C(F)=C1F Q66766 [0,2,0,0,0,0|2,0,0]=4 456 B12R1.653 COC1=CC=C(CO)C(F)=C1F Q68738 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.653 COC1=CC=C(SC)C(F)=C1F Q68741 [0,2,0,0,0,0|0,1,0]=3 458 B10R1.2 COC1=C(F)C(C)=CC=C1 N25450 [0,0,1,1,0,0|2,0,0]=4 459 B12R2.9 COC1=NC=C(C2CC2)C=C1 N27275 [0,1,0,1,0,0|2,0,0]=4 460 B12R2.44 COC1=CC2=C(C=C1)CCN2 O34504 [0,1,0,1,0,0|1,0,0]=3 461 B12R2.44 COC1=CC2=C(C=C1)CNC2 M15507 [0,1,0,1,0,0|1,0,0]=3 462 B12R2.44 COC1=CC2=C(C=C1)NCC2 P39671 [0,1,0,1,0,0|1,0,0]=3 463 B12R2.44 COC1=CC2=C(C=C1)OC=C2 L14993 [0,1,0,1,0,0|0,0,1]=3 464 B12R2.44 COC1=CC=C2C=NNC2=C1 C-2107 [0,1,0,1,0,0|2,0,0]=4 465 B12R2.44 COC1=CC=C2NN=CC2=C1 C-2102 [0,1,0,1,0,0|1,0,1]=4 466 B12R2.44 COC1=NC=C2NCCC2=C1 Q62962 [0,1,0,1,0,0|2,0,0]=4 467 B8R1.1 CSC1=CC(C)=CS1 N26956 [1,0,0,0,1,0|1,1,0]=4 468 B10R1.172 CCC1=CC=CC(SC)=C1 N25802 [0,0,0,0,1,1|1,1,0]=4 469 B10R1.172 CCC1=NC(OC)=CC=C1 N25274 [0,0,0,0,1,1|2,0,0]=4 470 B10R1.172 COC1=CC(C#N)=NC=C1 10122 [0,0,0,0,1,1|2,0,0]=4 471 B10R1.172 COC1=CC(C=O)=NC=C1 O30611 [0,0,0,0,1,1|2,0,0]=4 472 B10R1.172 COC1=CC(CCl)=NC=C1 S72465 [0,0,0,0,1,1|2,0,0]=4 473 B10R1.172 COC1=CC(CN)=CC=N1 C-3608 [0,0,0,0,1,1|2,0,0]=4 474 B10R1.172 COC1=CC(CN)=NC=C1 O31065 [0,0,0,0,1,1|2,0,0]=4 475 B10R1.172 COC1=CC(CN)=NC=C1 P40117 [0,0,0,0,1,1|2,0,0]=4 476 B10R1.172 COC1=CC(OC)=NC=C1 Q67614 [0,0,0,0,1,1|0,0,0]=2 477 B10R1.172 COC1=CC(SC)=CN=C1 N25653 [0,0,0,0,1,1|0,1,0]=3 478 B10R1.172 COC1=CN=CC(C=O)=C1 G-6116 [0,0,0,0,1,1|2,0,0]=4 479 B10R1.172 COC1=CN=CC(CN)=C1 G-7874 [0,0,0,0,1,1|2,0,0]=4 480 B10R1.172 COC1=CN=CC(CO)=C1 N24537 [0,0,0,0,1,1|2,0,0]=4 481 B10R1.172 COC1=CN=CC(OC)=C1 Q67567 [0,0,0,0,1,1|0,0,0]=2 482 B10R1.172 COC1=NC=CC(C=O)=C1 G-5573 [0,0,0,0,1,1|2,0,0]=4 483 B10R1.172 COC1=NC=CC(CCl)=C1 L22218 [0,0,0,0,1,1|2,0,0]=4 484 B10R1.172 COC1=NC=CC(CN)=C1 O30315 [0,0,0,0,1,1|2,0,0]=4 485 B10R1.172 COC1=NC=CC(CO)=C1 C-3669 [0,0,0,0,1,1|2,0,0]=4 486 B10R1.172 COC1=NC=CC(SC)=C1 N25852 [0,0,0,0,1,1|0,1,0]=3 487 B10R1.172 CSC1=CN=CC(SC)=C1 N25332 [0,0,0,0,1,1|0,2,0]=4