0 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 Z6266 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.25 CC1=C(C#N)C=CC(Cl)=N1 V7204 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.25 CC1=C(C#N)N=CC(N)=C1 2000AB [0,0,0,0,0,0|3,0,1]=4 3 B10R1.25 CC1=C(CBr)C=CC(F)=C1 3485AC [0,0,0,0,0,0|4,0,0]=4 4 B10R1.25 CC1=CC(Br)=CN=C1C=O Y8917 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.25 CC1=CC(C)=C(C#N)C=C1 7417AD [0,0,0,0,0,0|3,0,1]=4 6 B10R1.25 CC1=CC(C)=C(NN)C=C1 9955AL [0,0,0,0,0,0|4,0,0]=4 7 B10R1.25 CC1=CC(Cl)=CC=C1CO Z0039 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.25 CC1=CC=C(C#N)C(Br)=N1 7794AA [0,0,0,0,0,0|3,0,1]=4 9 B10R1.25 CC1=CC=C(C=O)C(C)=N1 Y9726 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.25 CC1=CC=C(C=O)C(Cl)=N1 Y4688 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.25 CC1=CC=C(CN)C(Cl)=C1 0833AC [0,0,0,0,0,0|4,0,0]=4 12 B10R1.25 CC1=CC=C(CO)C(C)=N1 6029AE [0,0,0,0,0,0|2,0,0]=2 13 B10R1.25 CC1=CC=C(CO)C(N)=C1 2629AC [0,0,0,0,0,0|4,0,0]=4 14 B10R1.25 CC1=CN=C(C#N)C(N)=C1 X8479 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.25 CC1=CN=C(CCl)C(C)=C1 Z5081 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.25 CC1=CN=C(CO)C(C)=C1 0932AC [0,0,0,0,0,0|2,0,0]=2 17 B10R1.25 CC1=CN=C(NN)C(Br)=C1 Z9443 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.25 CC1=NC(Cl)=CC=C1C=O Z0990 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.25 CC1=NC(F)=CC=C1CO Z0987 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.25 CC1=NC(N)=CC=C1C#N Y8059 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.25 CC1=NC=C(CO)C(N)=N1 W8173 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.25 CCC1=C(F)C=C(Br)C=C1 9478AB [0,0,0,0,0,0|4,0,0]=4 23 B10R1.25 CCC1=CN=C(C)C=C1Br 6901AC [0,0,0,0,0,0|4,0,0]=4 24 B10R1.25 CCC1=NC=C(C)N=C1C 6750AA [0,0,0,0,0,0|0,0,0]=0 25 B10R1.25 CNC1=NC=C(Br)C=C1N V8817 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.25 COC1=C(C)C=C(F)C=N1 4130AC [0,0,0,0,0,0|3,0,0]=3 27 B10R1.25 COC1=C(C)C=C(N)C=N1 3583AJ [0,0,0,0,0,0|3,0,0]=3 28 B10R1.25 COC1=C(Cl)C=C(N)C=N1 Z4224 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.25 COC1=C(I)C=C(Br)C=N1 8536AB [0,0,0,0,0,0|4,0,0]=4 30 B10R1.25 COC1=C(I)C=C(C)C=C1 X4546 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.25 COC1=CC=C(Br)N=C1N 5448AC [0,0,0,0,0,0|4,0,0]=4 32 B10R1.25 COC1=CC=C(C)N=C1Br Y8405 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.25 COC1=CC=C(C)N=C1N X3671 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.25 COC1=CC=C(I)C=C1C X8379 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.25 COC1=CC=C(N)C=C1C Y6043 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.25 COC1=CC=C(N)N=C1Cl 4511AC [0,0,0,0,0,0|4,0,0]=4 37 B10R1.25 COC1=CC=C(O)C=C1C Z0198 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.25 COC1=NC=C(Br)C=C1Br X9884 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.25 COC1=NC=C(C)C=C1Br W9936 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.25 COC1=NC=C(Cl)C=C1Cl 6237AA [0,0,0,0,0,0|4,0,0]=4 41 B10R1.25 COC1=NC=C(Cl)C=C1N V8674 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.25 COC1=NN=C(Cl)C=C1C X3927 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.25 CSC1=CC=C(F)C=C1C Z0086 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl X0204 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.25 N#CC1=NC=C(Cl)N=C1N Y9426 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.25 NCC1=C(C)C=C(Br)C=C1 9535AF [0,0,0,0,0,0|4,0,0]=4 47 B10R1.25 OCC1=CC=C(Cl)N=C1Cl Z0687 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.25 OCC1=NC=C(Br)C=C1F 0986AD [0,0,0,0,0,0|4,0,0]=4 49 B10R1.25 OCC1=NC=C(F)C=C1F Y6947 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.1 C=CC1=CN=C(C)C=C1 Q615 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.1 CC1=CC=C(CS)C=C1 7913AF [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 CC1=CN=C(C#N)C=C1 W3530 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.1 CC1=CN=C(C#N)C=N1 Y5118 [1,0,0,0,0,0|1,0,1]=3 54 B9R1.1 CC1=CN=C(C=O)C=N1 Y9267 [1,0,0,0,0,0|1,0,1]=3 55 B9R1.1 CC1=CN=C(CCl)C=C1 Y5002 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.1 CC1=CN=C(CO)C=C1 1457AB [1,0,0,0,0,0|2,0,0]=3 57 B9R1.1 CC1=NC=C(C=O)C=C1 W6750 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.1 CC1=NC=C(CO)C=N1 P435 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 CC1=NC=C(NN)C=C1 W9248 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 CCC1=CC=C(Br)N=C1 0198AB [1,0,0,0,0,0|2,0,0]=3 62 B9R1.1 CCC1=CC=C(Cl)C=C1 6872AE [1,0,0,0,0,0|3,0,0]=4 63 B9R1.1 CCC1=CC=C(F)C=C1 W6384 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.1 CCC1=CN=C(N)C=C1 Y5080 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.1 CCC1=NC=C(Br)C=C1 W5934 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.1 CNC1=CN=C(Cl)C=C1 3620AA [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CNC1=NC=C(Br)C=C1 W8725 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 CNC1=NC=C(F)C=C1 Z2980 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.1 COC1=CN=C(Br)C=N1 X3205 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 COC1=CN=C(Cl)C=N1 Z4604 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.1 COC1=CN=C(F)C=C1 Z0149 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.1 COC1=CN=C(I)C=C1 V3638 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.1 COC1=CN=C(N)C=C1 X3522 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.1 COC1=CN=C(N)C=N1 W6835 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.1 COC1=NC=C(F)C=C1 C523 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.1 CSC1=CC=C(C)C=C1 I356 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 CSC1=CN=C(Br)C=N1 X3206 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.1 CSC1=CN=C(N)C=C1 2168AC [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 ClC1=NC=C(CBr)C=C1 X4352 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 ClCC1=NC=C(Br)C=C1 8626AA [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.1 N#CC1=CN=C(Br)C=N1 W4571 [1,0,0,0,0,0|2,0,1]=4 83 B9R1.1 N#CC1=CN=C(Cl)C=N1 W5755 [1,0,0,0,0,0|2,0,1]=4 84 B9R1.1 NCC1=CC=C(Br)N=C1 X9441 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.1 NCC1=CC=C(N)C=N1 2034AC [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,0,0,0,0,0|3,0,0]=4 87 B9R1.1 NCC1=CN=C(F)C=C1 0174AP [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 NCC1=NC=C(Cl)C=C1 Y9067 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 O=CC1=NC=C(Cl)N=C1 4431AC [1,0,0,0,0,0|2,0,1]=4 90 B9R1.1 OCC1=NC=C(Cl)C=C1 Y8215 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.1 OCC1=NC=C(Cl)N=C1 W8125 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.1 OCC1=NC=C(F)C=C1 W8534 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.15 BrCC1=CC=CN=C1Br Y4790 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.15 C#CC1=NC=CN=C1N X8513 [1,0,0,0,0,0|1,0,2]=4 95 B9R1.15 CC1=C(C=O)C=CC=N1 W7274 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.15 CC1=C(CCl)N=CC=C1 6035AB [1,0,0,0,0,0|2,0,0]=3 97 B9R1.15 CC1=C(CN)N=CC=C1 7725AA [1,0,0,0,0,0|2,0,0]=3 98 B9R1.15 CC1=C(CO)N=CC=C1 9578AB [1,0,0,0,0,0|2,0,0]=3 99 B9R1.15 CC1=CC=CN=C1C=O W6954 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.15 CC1=CC=CN=C1CCl Z4758 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.15 CC1=CC=CN=C1CN Y7623 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 CC1=CC=CN=C1NN 6684AB [1,0,0,0,0,0|3,0,0]=4 103 B9R1.15 CC1=NC=CC=C1C#N 8848AA [1,0,0,0,0,0|2,0,1]=4 104 B9R1.15 CC1=NC=CN=C1C=O 2084AB [1,0,0,0,0,0|1,0,1]=3 105 B9R1.15 CCC1=C(Br)C=CC=N1 5014AB [1,0,0,0,0,0|2,0,0]=3 106 B9R1.15 CCC1=C(Br)C=NC=N1 V9538 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.15 CCC1=CC=CC=C1Cl 2607AF [1,0,0,0,0,0|3,0,0]=4 108 B9R1.15 CCC1=CC=CN=C1Cl 6759AC [1,0,0,0,0,0|2,0,0]=3 109 B9R1.15 CCC1=CC=CN=C1N 5897AB [1,0,0,0,0,0|2,0,0]=3 110 B9R1.15 CCC1=CN=CN=C1Cl 7779AB [1,0,0,0,0,0|3,0,0]=4 111 B9R1.15 CCC1=NC=CN=C1Cl 9678AB [1,0,0,0,0,0|1,0,0]=2 112 B9R1.15 CNC1=C(Cl)C=CC=N1 4045AE [1,0,0,0,0,0|3,0,0]=4 113 B9R1.15 CNC1=CC=CC=C1C Z6802 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 CNC1=CC=CN=C1Cl N415 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.15 COC1=CC=CN=C1C 5357AH [1,0,0,0,0,0|2,0,0]=3 116 B9R1.15 COC1=CC=CN=C1F Z0246 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.15 COC1=NC=CC=C1F Z5254 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.15 COC1=NC=CC=C1O Z0120 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.15 COC1=NC=CN=C1Br Z3980 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.15 COC1=NC=CN=C1I V6756 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.15 COC1=NC=CN=C1N W6434 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.15 CSC1=CC=CN=C1F Z0373 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.15 CSC1=NC=CN=C1C Z2583 [1,0,0,0,0,0|1,0,0]=2 124 B9R1.15 ClCC1=NC=CC=C1Br V3162 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.15 ClCC1=NC=CC=C1Cl 9689AA [1,0,0,0,0,0|3,0,0]=4 126 B9R1.15 FC1=CC=CN=C1CCl V3424 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.15 N#CC1=NC=CN=C1N W4927 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.15 NCC1=C(Cl)C=CC=N1 6797AB [1,0,0,0,0,0|3,0,0]=4 129 B9R1.15 NCC1=NC=CC=C1F 3344AB [1,0,0,0,0,0|3,0,0]=4 130 B9R1.15 NCC1=NC=CN=C1Cl W8381 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.15 NCC1=NC=CN=C1Cl W9640 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.15 NNC1=NC=CN=C1Cl W7528 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.15 O=CC1=NC=CN=C1Cl X0372 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.15 OCC1=NC=CC=C1F W5329 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.15 OCC1=NC=CC=C1O V3086 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.69 CC1=C(Br)N=C(N)C=C1 0027AP [1,0,0,0,0,0|3,0,0]=4 137 B9R1.69 CC1=C(Br)N=CC(N)=N1 W8204 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.69 CC1=C(C)N=C(N)C=C1 B820 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.69 CC1=C(C)N=C(N)C=N1 W7493 [1,0,0,0,0,0|1,0,0]=2 140 B9R1.69 CC1=C(C)N=C(N)N=N1 5878AD [1,0,0,0,0,0|2,0,0]=3 141 B9R1.69 CC1=C(Cl)N=C(N)C=C1 W6313 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.69 CC1=C(F)C=C(Br)C=N1 9726AC [1,0,0,0,0,0|3,0,0]=4 143 B9R1.69 CC1=C(I)C=CC(F)=N1 Z6069 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.69 CC1=C(N)C=CC(F)=N1 N244 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.69 CC1=C(N)C=CC(N)=N1 Z3053 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.69 CC1=CC(Br)=C(C)N=C1 5296AH [1,0,0,0,0,0|2,0,0]=3 147 B9R1.69 CC1=CC(Br)=CN=C1C W5017 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.69 CC1=CC(Br)=CN=C1I Z0555 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.69 CC1=CC(C)=C(N)C=C1 5422AF [1,0,0,0,0,0|3,0,0]=4 150 B9R1.69 CC1=CC(Cl)=CN=C1O V6771 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.69 CC1=CC(I)=C(N)N=C1 7183AD [1,0,0,0,0,0|3,0,0]=4 152 B9R1.69 CC1=CC(I)=C(O)N=C1 9941AD [1,0,0,0,0,0|3,0,0]=4 153 B9R1.69 CC1=CC(I)=CN=C1Br Z0759 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.69 CC1=CC(I)=CN=C1Cl Z0718 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.69 CC1=CC(O)=C(N)N=C1 6871AD [1,0,0,0,0,0|3,0,0]=4 156 B9R1.69 CC1=CC(O)=CN=C1Cl X3363 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.69 CC1=CC=C(Br)C(F)=N1 N250 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.69 CC1=CC=C(Br)C(O)=N1 N252 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.69 CC1=CC=C(C)C(C)=C1 X8415 [1,0,0,0,0,0|2,0,0]=3 160 B9R1.69 CC1=CC=C(C)C(N)=N1 X4183 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.69 CC1=CC=C(Cl)N=C1Cl W9933 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.69 CC1=CC=C(O)C(Br)=N1 Z2516 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.69 CC1=CC=C(S)C(C)=C1 U378 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.69 CC1=CC=C(S)C=C1C L435 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.69 CC1=CN=C(Br)C(C)=C1 W9941 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 V7145 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.69 CC1=CN=C(Br)C(F)=C1 Y8807 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.69 CC1=CN=C(Br)C(N)=C1 W5617 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.69 CC1=CN=C(C)C(I)=N1 8775AB [1,0,0,0,0,0|1,0,0]=2 170 B9R1.69 CC1=CN=C(C)C(N)=N1 X9791 [1,0,0,0,0,0|1,0,0]=2 171 B9R1.69 CC1=CN=C(Cl)C(C)=N1 W5925 [1,0,0,0,0,0|1,0,0]=2 172 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 Y9578 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.69 CC1=CN=C(Cl)C(N)=C1 V1694 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.69 CC1=CN=C(Cl)C(O)=C1 V8962 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.69 CC1=CN=C(N)C(Br)=N1 W8202 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.69 CC1=CN=C(N)C(C)=C1 W9931 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.69 CC1=CN=C(N)C(Cl)=N1 W9211 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.69 CC1=CN=C(O)C(C)=N1 W7279 [1,0,0,0,0,0|1,0,0]=2 179 B9R1.69 CC1=NC(Br)=CC=C1Cl V9428 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.69 CC1=NC(Br)=CC=C1O Y3758 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.69 CC1=NC(Br)=CN=C1N W8203 [1,0,0,0,0,0|2,0,0]=3 182 B9R1.69 CC1=NC(Cl)=C(C)C=N1 1761AC [1,0,0,0,0,0|3,0,0]=4 183 B9R1.69 CC1=NC(Cl)=CC=C1Cl Z8703 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.69 CC1=NC(Cl)=CC=C1F W9068 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.69 CC1=NC(Cl)=CC=C1I Z0428 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.69 CC1=NC(I)=CC=C1Br 0279AA [1,0,0,0,0,0|3,0,0]=4 187 B9R1.69 CC1=NC=C(Br)C(C)=N1 X6083 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.69 CC1=NC=C(Br)C=C1O W9387 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.69 CC1=NC=C(Cl)C=C1Cl 0285AA [1,0,0,0,0,0|3,0,0]=4 190 B9R1.69 CC1=NC=C(Cl)C=C1N V8831 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.69 CC1=NC=C(Cl)N=C1C 8855AB [1,0,0,0,0,0|1,0,0]=2 192 B9R1.69 CC1=NC=C(O)C(C)=N1 Z4724 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.69 ClC1=CN=C(I)C(Cl)=N1 X9962 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.69 ClC1=NC(Cl)=C(Cl)N=C1 3814AC [1,0,0,0,0,0|3,0,0]=4 195 B9R1.69 ClC1=NC=C(Br)N=C1Br X8874 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.69 NC1=NC(Br)=CN=C1Br X0206 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.69 NC1=NC(Br)=CN=C1Cl X8875 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.69 NC1=NC=C(Br)N=C1Cl W4525 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.37 COC1=C(OC)N=C(I)C=C1 0162AE [0,1,0,0,0,0|3,0,0]=4 200 B11R1.37 COC1=C(OC)N=C(N)C=C1 Z9380 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.37 COC1=CC(Br)=CN=C1OC Z0659 [0,1,0,0,0,0|3,0,0]=4 202 B11R1.37 COC1=NC=C(Br)C=C1CO 1262AE [0,1,0,0,0,0|3,0,0]=4 203 B11R1.37 COC1=NC=C(Br)N=C1OC W9235 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.81 CC1=CC=C(CCN)C(C)=C1 1998AC [0,1,0,0,0,0|2,0,0]=3 205 B11R1.81 CCOC1=C(N)C=C(C)C=C1 7117AE [0,1,0,0,0,0|3,0,0]=4 206 B11R1.81 CCOC1=CC=C(Br)C=C1C Z0852 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.81 CCOC1=NC=C(Br)C=C1N W9146 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 7695AC [0,1,0,0,0,0|2,0,0]=3 209 B11R1.166 CC1=CC=C(B(O)O)C(C)=N1 V7334 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 8698AB [0,1,0,0,0,0|2,0,1]=4 211 B11R2.36 BrC1=CC2=C(C=C1)CCC2 W7361 [0,0,0,1,0,0|3,0,0]=4 212 B11R2.36 BrC1=CN=C2NCCC2=C1 X9107 [0,0,0,1,0,0|3,0,0]=4 213 B11R2.36 CC1=CC2=C(C=C1)CCN2 3678AC [0,0,0,1,0,0|3,0,0]=4 214 B11R2.36 ClC1=CC=C2CCCC2=N1 2919AA [0,0,0,1,0,0|2,0,0]=3 215 B11R2.36 IC1=CC2=C(CCC2)N=C1 4912AA [0,0,0,1,0,0|2,0,0]=3 216 B11R2.36 OC1=CC2=C(C=C1)CCC2 X3320 [0,0,0,1,0,0|3,0,0]=4 217 B9R1.22 CC1=CC(C)=NN1CO Z2308 [0,0,0,0,1,0|3,0,0]=4 218 B9R1.22 CC1=CC(C=O)=C(C)S1 Z5494 [0,0,0,0,1,0|2,0,1]=4 219 B9R1.22 CC1=NC(CO)=C(C)O1 Y4729 [0,0,0,0,1,0|2,0,0]=3 220 B9R1.22 CC1=NN(C)C(C#N)=C1 Z2970 [0,0,0,0,1,0|2,0,1]=4 221 B9R1.22 CC1=NN(C)C=C1CN 5312AB [0,0,0,0,1,0|2,0,0]=3 222 B9R1.132 CN1C(Cl)=CN=C1CO 0565AE [0,0,0,0,1,0|3,0,0]=4 223 B8R1.2 BrCC1=NC=CN=C1 5266AJ [2,0,0,0,0,0|1,0,0]=3 224 B8R1.2 CNC1=NC=CN=C1 3544AB [2,0,0,0,0,0|1,0,0]=3 225 B8R1.2 CSC1=NC=CC=C1 L314 [2,0,0,0,0,0|2,0,0]=4 226 B8R1.2 CSC1=NC=CN=N1 X6051 [2,0,0,0,0,0|2,0,0]=4 227 B8R1.2 ClCC1=CN=CC=N1 0741AB [2,0,0,0,0,0|1,0,0]=3 228 B8R1.2 NCC1=NC=CN=C1 W5959 [2,0,0,0,0,0|1,0,0]=3 229 B8R1.3 BrC1=NC=C(I)N=C1 Y9643 [2,0,0,0,0,0|2,0,0]=4 230 B8R1.3 CC1=CC=C(F)C=N1 I740 [2,0,0,0,0,0|2,0,0]=4 231 B8R1.3 CC1=CN=C(Cl)C=N1 W7227 [2,0,0,0,0,0|1,0,0]=3 232 B8R1.3 CC1=NC=C(Cl)C=C1 V7477 [2,0,0,0,0,0|2,0,0]=4 233 B8R1.3 ClC1=CN=C(Cl)C=N1 W4185 [2,0,0,0,0,0|2,0,0]=4 234 B8R1.3 ClC1=NC=C(I)N=C1 X8773 [2,0,0,0,0,0|2,0,0]=4 235 B8R1.3 OC1=CN=C(Br)C=N1 X3203 [2,0,0,0,0,0|2,0,0]=4 236 B8R1.3 OC1=NC=C(Cl)N=C1 W9210 [2,0,0,0,0,0|2,0,0]=4 237 B8R1.5 BrC1=NC=CN=C1Br W9749 [2,0,0,0,0,0|2,0,0]=4 238 B8R1.5 CC1=CC=CN=C1F I218 [2,0,0,0,0,0|2,0,0]=4 239 B8R1.5 CC1=CC=CN=C1I L284 [2,0,0,0,0,0|2,0,0]=4 240 B8R1.5 CC1=CC=CN=C1O Z5345 [2,0,0,0,0,0|2,0,0]=4 241 B8R1.5 CC1=NC=CC=C1Cl W8084 [2,0,0,0,0,0|2,0,0]=4 242 B8R1.5 CC1=NC=CC=C1F W3456 [2,0,0,0,0,0|2,0,0]=4 243 B8R1.5 CC1=NC=CN=C1Br Z3979 [2,0,0,0,0,0|1,0,0]=3 244 B8R1.5 CC1=NC=CN=C1Cl W9751 [2,0,0,0,0,0|1,0,0]=3 245 B8R1.5 CC1=NC=CN=C1N X7049 [2,0,0,0,0,0|1,0,0]=3 246 B8R1.5 NC1=NC=CN=C1Br X2934 [2,0,0,0,0,0|2,0,0]=4 247 B8R1.5 NC1=NC=CN=C1I W5604 [2,0,0,0,0,0|2,0,0]=4 248 B8R1.5 NC1=NC=CN=C1N X9790 [2,0,0,0,0,0|2,0,0]=4 249 B8R1.5 NC1=NC=CN=C1O W6256 [2,0,0,0,0,0|2,0,0]=4 250 B8R1.4 BrC1=CN=CC(Br)=N1 X4368 [2,0,0,0,0,0|2,0,0]=4 251 B8R1.4 CC1=CN=CC(Br)=N1 Y4677 [2,0,0,0,0,0|1,0,0]=3 252 B8R1.4 CC1=CN=CC(Cl)=C1 W9922 [2,0,0,0,0,0|2,0,0]=4 253 B8R1.4 CC1=CN=CC(N)=N1 W6921 [2,0,0,0,0,0|1,0,0]=3 254 B8R1.4 CC1=CN=CC(O)=C1 W6236 [2,0,0,0,0,0|2,0,0]=4 255 B8R1.4 CC1=NC(I)=CC=C1 9463AB [2,0,0,0,0,0|2,0,0]=4 256 B8R1.4 ClC1=CN=CC(Br)=N1 X7955 [2,0,0,0,0,0|2,0,0]=4 257 B8R1.4 IC1=CN=CC(I)=N1 W7134 [2,0,0,0,0,0|2,0,0]=4 258 B8R1.4 NC1=CN=CC(N)=N1 W9891 [2,0,0,0,0,0|2,0,0]=4 259 B8R1.4 NC1=NC(Br)=CN=C1 W6852 [2,0,0,0,0,0|2,0,0]=4 260 B8R1.4 OC1=NC(Cl)=CN=C1 W6500 [2,0,0,0,0,0|2,0,0]=4 261 B10R1.1 CC1=CC=C(CCBr)C=C1 W7663 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.1 CC1=CC=C(CCN)C=C1 1184AJ [1,1,0,0,0,0|2,0,0]=4 263 B10R1.1 CCOC1=CN=C(Br)C=C1 V5913 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.1 CCOC1=CN=C(Br)C=N1 1348AA [1,1,0,0,0,0|1,0,0]=3 265 B10R1.1 CCOC1=CN=C(N)C=N1 W7623 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.1 CCOC1=NC=C(Cl)N=C1 6462AA [1,1,0,0,0,0|1,0,0]=3 267 B10R1.1 CCOC1=NC=C(F)C=C1 3377AC [1,1,0,0,0,0|2,0,0]=4 268 B10R1.1 CNCC1=CC=C(C)C=C1 7294AJ [1,1,0,0,0,0|2,0,0]=4 269 B10R1.1 CNCC1=CC=C(C)C=C1 W7964 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.1 CNCC1=CN=C(C)N=C1 Z4024 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [1,1,0,0,0,0|2,0,0]=4 272 B10R1.1 OCCC1=CC=C(Cl)N=C1 1226AJ [1,1,0,0,0,0|2,0,0]=4 273 B10R1.1 OCCC1=NC=C(Br)C=C1 3590AA [1,1,0,0,0,0|2,0,0]=4 274 B10R1.3 CCC1=CC=C(C=O)N=C1 5847AH [1,1,0,0,0,0|1,0,1]=4 275 B10R1.3 COC1=CC=C(CN)C=N1 8647AA [1,1,0,0,0,0|2,0,0]=4 276 B10R1.3 COC1=CN=C(CCl)C=C1 1704AC [1,1,0,0,0,0|2,0,0]=4 277 B10R1.3 COC1=CN=C(CN)C=C1 4773AJ [1,1,0,0,0,0|2,0,0]=4 278 B10R1.3 COC1=CN=C(CO)C=C1 X9716 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.3 COC1=NC=C(C=O)N=C1 3578AB [1,1,0,0,0,0|1,0,1]=4 280 B10R1.3 COC1=NC=C(CCl)C=C1 0532AA [1,1,0,0,0,0|2,0,0]=4 281 B10R1.3 COC1=NC=C(CN)C=C1 3334AC [1,1,0,0,0,0|2,0,0]=4 282 B10R1.13 CC(=O)C1=CC=C(C)C=N1 7521AB [1,1,0,0,0,0|1,0,1]=4 283 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 W3479 [1,1,0,0,0,0|1,0,1]=4 284 B10R1.13 CC(C)C1=CC=C(N)C=N1 Z4708 [1,1,0,0,0,0|2,0,0]=4 285 B10R1.13 CC(O)C1=NC=C(Br)C=C1 8022AA [1,1,0,0,0,0|2,0,0]=4 286 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [1,1,0,0,0,0|2,0,0]=4 287 B10R1.13 CC1=CN=C(C(N)=O)C=N1 X0289 [1,1,0,0,0,0|1,0,1]=4 288 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [1,1,0,0,0,0|1,0,0]=3 289 B10R1.176 CCC1=CN=C(C)C(C)=N1 L039 [1,1,0,0,0,0|0,0,0]=2 290 B10R1.4 CC1=CC=CC=C1CCN S579 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.4 CCCC1=NC=CN=C1C 5716AL [1,1,0,0,0,0|0,0,0]=2 292 B10R1.4 CCNC1=NC=CN=C1N W9368 [1,1,0,0,0,0|1,0,0]=3 293 B10R1.4 CCOC1=C(Br)C=CC=N1 8550AB [1,1,0,0,0,0|2,0,0]=4 294 B10R1.4 CCOC1=C(I)C=CC=N1 9446AE [1,1,0,0,0,0|2,0,0]=4 295 B10R1.4 CCOC1=C(N)N=CC=C1 7078AC [1,1,0,0,0,0|2,0,0]=4 296 B10R1.4 CCOC1=NC=CN=C1N W9234 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.4 CNCC1=C(C)N=CC=C1 5583AJ [1,1,0,0,0,0|1,0,0]=3 298 B10R1.20 CCC1=C(CC)C=CC=C1 8567AJ [1,1,0,0,0,0|2,0,0]=4 299 B10R1.20 CCC1=C(SC)N=CC=N1 5052AL [1,1,0,0,0,0|0,0,0]=2 300 B10R1.20 CCC1=CC=CC=C1OC 5616AL [1,1,0,0,0,0|2,0,0]=4 301 B10R1.20 CNC1=NC=CC=C1CO W5421 [1,1,0,0,0,0|2,0,0]=4 302 B10R1.20 COC1=C(CN)C=CC=N1 2549AA [1,1,0,0,0,0|2,0,0]=4 303 B10R1.20 COC1=NC=CC=C1CN W5710 [1,1,0,0,0,0|2,0,0]=4 304 B10R1.20 COC1=NC=CC=C1CO X7935 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.30 CCC1=C(O)C=CC(C)=N1 R736 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.30 COC1=NC(Br)=CN=C1Cl Y5647 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.30 COC1=NC(C)=CN=C1N 4807AC [1,1,0,0,0,0|2,0,0]=4 308 B10R1.30 COC1=NC(Cl)=CN=C1N W8970 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.61 CC(=O)C1=CC=CN=C1C Y7806 [1,1,0,0,0,0|1,0,1]=4 310 B10R1.61 CC(=O)C1=NC=CN=C1Cl 3776AA [1,1,0,0,0,0|1,0,1]=4 311 B10R1.61 CC(O)C1=C(Cl)N=CC=C1 5872AA [1,1,0,0,0,0|2,0,0]=4 312 B10R1.61 CC1=NC=CN=C1C(=O)O W6160 [1,1,0,0,0,0|1,0,1]=4 313 B10R1.61 CN(C)C1=NC=CN=C1N W9238 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.22 CC1=CC(C)=C(N)C(C)=N1 7167AB [1,1,0,0,0,0|2,0,0]=4 315 B10R1.118 CC1=C(Br)N=C(Br)C(N)=N1 1541AC [1,1,0,0,0,0|2,0,0]=4 316 B10R1.118 CC1=C(C)N=C(Cl)C(Cl)=N1 3635AB [1,1,0,0,0,0|1,0,0]=3 317 B10R1.118 CC1=C(C)N=C(Cl)C(N)=N1 5118AB [1,1,0,0,0,0|1,0,0]=3 318 B10R1.118 CC1=C(C)N=C(N)C(Br)=C1 Y5019 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.118 CC1=CC(Br)=C(Br)N=C1C 2911AA [1,1,0,0,0,0|2,0,0]=4 320 B10R1.118 CC1=CC(C)=C(Br)N=C1Br X9223 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.130 CC1=CC(C)=NN1CCO 6741AD [0,1,0,0,1,0|2,0,0]=4 322 B10R1.94 CCCN1N=CC(C)=C1N 1801AE [0,1,0,0,1,0|2,0,0]=4 323 B10R1.258 CCN1N=CC(C=O)=C1C Y5661 [0,1,0,0,1,0|1,0,1]=4 324 B12R1.233 CC1=CN=C(OC(C)C)C(Br)=C1 V7642 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.654 COC1=C(C)C(CCl)=NC=C1C N553 [0,2,0,0,0,0|2,0,0]=4 326 B10R2.7 C1=CC2=C(N=C1)NCC2 X8780 [1,0,0,1,0,0|2,0,0]=4 327 B12R2.24 CC1=CC2=C(C=C1)CCNC2 W4357 [0,1,0,1,0,0|2,0,0]=4 328 B12R2.24 CC1=CC=C2CNCCC2=C1 6012AH [0,1,0,1,0,0|2,0,0]=4 329 B12R2.24 CC1=NC2=C(C=C1)CCCN2 Y8529 [0,1,0,1,0,0|1,0,0]=3 330 B12R2.24 ClC1=CC=C2CCCCC2=N1 Z4404 [0,1,0,1,0,0|2,0,0]=4 331 B12R2.24 ClC1=CC=C2CNCCC2=N1 W8340 [0,1,0,1,0,0|2,0,0]=4 332 B12R2.24 ClC1=NC2=C(CCCC2)N=C1 5023AH [0,1,0,1,0,0|1,0,0]=3 333 B8R1.1 CC1=CC(CO)=NO1 W5683 [1,0,0,0,1,0|2,0,0]=4 334 B8R1.1 CC1=CN=C(CO)S1 W4281 [1,0,0,0,1,0|2,0,0]=4 335 B8R1.1 CC1=CSC(CO)=C1 Y9977 [1,0,0,0,1,0|2,0,0]=4 336 B8R1.1 CC1=CSC(CO)=N1 Y5277 [1,0,0,0,1,0|2,0,0]=4 337 B8R1.1 CC1=NC(CBr)=CS1 Y9993 [1,0,0,0,1,0|2,0,0]=4 338 B8R1.1 CC1=NC(CN)=CS1 Y6880 [1,0,0,0,1,0|2,0,0]=4 339 B8R1.1 CC1=NC(CN)=NO1 0086AD [1,0,0,0,1,0|2,0,0]=4 340 B8R1.1 CC1=NC(CO)=CS1 Y4033 [1,0,0,0,1,0|2,0,0]=4 341 B8R1.1 CC1=NC=C(CO)S1 8183AB [1,0,0,0,1,0|2,0,0]=4 342 B8R1.1 CC1=NOC(CBr)=C1 Y8895 [1,0,0,0,1,0|2,0,0]=4 343 B8R1.1 CC1=NOC(CCl)=N1 X2011 [1,0,0,0,1,0|2,0,0]=4 344 B8R1.1 CC1=NOC(CO)=C1 Y7569 [1,0,0,0,1,0|2,0,0]=4 345 B8R1.1 CCC1=NSC(N)=N1 5658AD [1,0,0,0,1,0|2,0,0]=4 346 B8R1.1 CCN1C=C(N)C=N1 3909AC [1,0,0,0,1,0|2,0,0]=4 347 B8R1.1 CN1C=C(CN)C=N1 0373AD [1,0,0,0,1,0|2,0,0]=4 348 B8R1.1 CN1C=C(CN)C=N1 X8957 [1,0,0,0,1,0|2,0,0]=4 349 B8R1.1 CN1C=C(CN)C=N1 Y5423 [1,0,0,0,1,0|2,0,0]=4 350 B8R1.1 CN1C=C(CO)C=N1 X8991 [1,0,0,0,1,0|2,0,0]=4 351 B8R1.1 CN1C=NC(CO)=C1 Y7819 [1,0,0,0,1,0|2,0,0]=4 352 B8R1.1 CN1C=NC(CO)=N1 X9910 [1,0,0,0,1,0|2,0,0]=4 353 B8R1.11 CC1=C(CO)N=CN1 3032AB [1,0,0,0,1,0|1,0,1]=4 354 B8R1.11 CC1=NNC=C1CO 4676AE [1,0,0,0,1,0|2,0,0]=4 355 B8R1.11 CCC1=CNN=C1N X8546 [1,0,0,0,1,0|2,0,0]=4 356 B8R1.11 CCC1=NN=NN1C Y5054 [1,0,0,0,1,0|2,0,0]=4 357 B8R1.11 CN1C=CN=C1CCl 9984AA [1,0,0,0,1,0|2,0,0]=4 358 B8R1.11 CN1N=CC=C1CCl 0463AF [1,0,0,0,1,0|2,0,0]=4 359 B8R1.11 CN1N=CC=C1CCl 6276AJ [1,0,0,0,1,0|2,0,0]=4 360 B8R1.11 CN1N=CC=C1CN Y5590 [1,0,0,0,1,0|2,0,0]=4 361 B8R1.11 COC1=CC=NN1C 6266AA [1,0,0,0,1,0|2,0,0]=4 362 B8R1.18 CC1=C(C)SC(N)=N1 Y9901 [1,0,0,0,1,0|2,0,0]=4 363 B8R1.18 CC1=C(C)SC(S)=N1 Y9375 [1,0,0,0,1,0|2,0,0]=4 364 B8R1.18 CC1=CC(Br)=NN1C Z2700 [1,0,0,0,1,0|2,0,0]=4 365 B8R1.18 CC1=CC(C)=C(Br)S1 0587AQ [1,0,0,0,1,0|2,0,0]=4 366 B8R1.18 CC1=CC(N)=NN1C Z2262 [1,0,0,0,1,0|2,0,0]=4 367 B8R1.18 CC1=CN(C)C(Br)=N1 Y8377 [1,0,0,0,1,0|2,0,0]=4 368 B8R1.18 CC1=NC(Br)=C(C)S1 V8938 [1,0,0,0,1,0|2,0,0]=4 369 B8R1.18 CC1=NC(Br)=CN1C X4637 [1,0,0,0,1,0|2,0,0]=4 370 B8R1.18 CC1=NC(C)=C(Br)S1 Y8561 [1,0,0,0,1,0|2,0,0]=4 371 B8R1.18 CC1=NC(C)=C(C)O1 0593AB [1,0,0,0,1,0|1,0,0]=3 372 B8R1.18 CC1=NN(C)C(Br)=C1 Y9520 [1,0,0,0,1,0|2,0,0]=4 373 B8R1.18 CC1=NN(C)C=C1Br V6734 [1,0,0,0,1,0|2,0,0]=4 374 B8R1.18 CC1=NN(C)C=C1I 7666AE [1,0,0,0,1,0|2,0,0]=4 375 B8R1.18 CC1=NN(C)C=C1N 0168AB [1,0,0,0,1,0|2,0,0]=4 376 B8R1.18 CC1=NN(C)C=C1N 9883AB [1,0,0,0,1,0|2,0,0]=4 377 B8R1.50 CC1=C(C)C(N)=NN1 Z5327 [1,0,0,0,1,0|2,0,0]=4 378 B8R1.50 CC1=C(C)C(N)=NO1 V1317 [1,0,0,0,1,0|2,0,0]=4 379 B8R1.50 CC1=C(N)N(C)C=N1 6311AJ [1,0,0,0,1,0|2,0,0]=4 380 B8R1.50 CC1=NC=C(Br)N1C Y8402 [1,0,0,0,1,0|2,0,0]=4 381 B8R1.50 CC1=NNC(C)=C1Cl 5060AD [1,0,0,0,1,0|2,0,0]=4 382 B8R1.50 CC1=NOC(C)=C1N V0678 [1,0,0,0,1,0|2,0,0]=4