0 B10R1.18 CC(=O)CC1=CC=NC=C1 4765AJ [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 CC(=O)CC1=NC=CC=C1 W7508 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 4736AL [0,0,0,0,0,0|3,0,1]=4 3 B10R1.18 CC(=O)NC1=CN=CC=C1 6108AE [0,0,0,0,0,0|2,0,1]=3 4 B10R1.18 CC(=O)SC1=CC=CC=C1 9002AL [0,0,0,0,0,0|3,0,1]=4 5 B10R1.18 CC(Br)CC1=CC=CC=C1 0794AB [0,0,0,0,0,0|2,0,0]=2 6 B10R1.18 CC(C)OC1=NC=CC=C1 Z0239 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.18 CC(N)CC1=CC=CN=C1 V7434 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.18 NC(=O)CC1=CC=CN=C1 4754AB [0,0,0,0,0,0|2,0,1]=3 9 B9R1.8 BrCCC1=NC=CC=C1 W8132 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.8 BrCC[N+]1=CC=CC=C1 V0516 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.8 CC#CC1=CC=CC=C1 4952AL [1,0,0,0,0,0|1,0,2]=4 12 B9R1.8 CCCC1=NC=CC=C1 C946 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.8 CCCC1=NC=CN=C1 6087AD [1,0,0,0,0,0|1,0,0]=2 14 B9R1.8 CCNC1=CC=CC=N1 5047AL [1,0,0,0,0,0|3,0,0]=4 15 B9R1.8 CCOC1=NN=CC=C1 W7464 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.8 CNCC1=CN=CC=C1 7435AH [1,0,0,0,0,0|1,0,0]=2 17 B9R1.8 COCC1=CC=CN=C1 5231AH [1,0,0,0,0,0|1,0,0]=2 18 B9R1.8 COCC1=CC=NC=C1 5493AH [1,0,0,0,0,0|3,0,0]=4 19 B9R1.8 COCC1=NC=CC=C1 V2195 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.8 CSCC1=CC=CC=C1 7914AF [1,0,0,0,0,0|2,0,0]=3 21 B9R1.8 C\C=C/C1=CC=CC=C1 7457AL [1,0,0,0,0,0|1,0,2]=4 22 B9R1.8 C\N=C\C1=CC=CC=C1 R179 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.8 ClCCC1=NC=CC=C1 W3687 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.8 ICCC1=CC=CC=C1 4037AL [1,0,0,0,0,0|2,0,0]=3 25 B9R1.8 N#CCC1=NC=CN=C1 7112AB [1,0,0,0,0,0|2,0,1]=4 26 B9R1.8 NCCC1=CC=CC=C1 5784AL [1,0,0,0,0,0|2,0,0]=3 27 B9R1.8 NCCC1=CC=CN=C1 9756AD [1,0,0,0,0,0|1,0,0]=2 28 B9R1.8 NCCC1=CC=CN=C1 W8702 [1,0,0,0,0,0|1,0,0]=2 29 B9R1.8 NCCC1=CC=NC=C1 W7604 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.8 OCCC1=CC=CC=C1 V0900 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 OCCC1=CC=CN=C1 Y9667 [1,0,0,0,0,0|1,0,0]=2 32 B9R1.8 OCCC1=CC=NC=C1 6680AL [1,0,0,0,0,0|3,0,0]=4 33 B9R1.8 ONCC1=CC=CC=C1 9353AB [1,0,0,0,0,0|3,0,0]=4 34 B9R1.8 S=C=NC1=CC=CN=C1 Y7833 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 9287AB [0,1,0,0,0,0|2,0,1]=4 36 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 7126AD [0,1,0,0,0,0|2,0,1]=4 37 B11R1.20 CC(=O)CC1=CC=C(I)C=C1 1094AB [0,1,0,0,0,0|2,0,1]=4 38 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 Q226 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 V4230 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.20 CC(C)CC1=CC=C(N)C=C1 3122AB [0,1,0,0,0,0|1,0,0]=2 41 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 Z8271 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.20 CC(C)NC1=NN=C(Cl)C=C1 7262AC [0,1,0,0,0,0|2,0,0]=3 43 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Z0788 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.20 CC(C)OC1=CC=C(N)C=C1 V4472 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.20 CC(C)OC1=CC=C(O)C=C1 Y9996 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 Y6445 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.36 CC(=O)C(Br)C1=CC=CC=C1 U801 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Y8969 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 V6832 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.36 CC(C)C(N)C1=CC=CN=C1 1772AJ [0,1,0,0,0,0|0,0,0]=1 51 B11R1.36 CC(C)C(N)C1=NC=CC=C1 1771AJ [0,1,0,0,0,0|2,0,0]=3 52 B11R1.36 CC(C)C(O)C1=CC=CC=C1 9149AB [0,1,0,0,0,0|1,0,0]=2 53 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 7205AB [0,1,0,0,0,0|1,0,0]=2 54 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 W7886 [0,1,0,0,0,0|1,0,0]=2 55 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 5584AL [0,1,0,0,0,0|2,0,1]=4 56 B11R1.36 C[C@@H](C1=CC=CC=C1)N(C)C 4191AL [0,1,0,0,0,0|2,0,0]=3 57 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 5421AJ [0,1,0,0,0,0|2,0,1]=4 58 B11R1.40 CC(CO)OC1=CC=CC=C1 5778AL [0,1,0,0,0,0|2,0,0]=3 59 B11R1.40 CNC(=O)CC1=CC=CC=C1 8080AE [0,1,0,0,0,0|2,0,1]=4 60 B11R1.40 CNC(C)CC1=NC=CC=C1 5554AE [0,1,0,0,0,0|2,0,0]=3 61 B11R1.40 COC(=O)CC1=CC=CN=C1 X5277 [0,1,0,0,0,0|1,0,1]=3 62 B11R1.40 COC(=O)CC1=CN=CC=N1 4720AB [0,1,0,0,0,0|2,0,1]=4 63 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 9403AJ [0,1,0,0,0,0|2,0,1]=4 64 B11R1.86 CC(=O)NC1=CC=CN=C1C Y5364 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.86 CC(C)NC1=NC=CC=C1N 8159AD [0,1,0,0,0,0|3,0,0]=4 66 B11R1.86 CC(C)OC1=C(I)C=CC=N1 9447AE [0,1,0,0,0,0|3,0,0]=4 67 B11R1.86 CC(C)OC1=CC=CC=C1F Y3731 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.86 CC(C)OC1=CC=CC=C1N W5162 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.86 CC(C)SC1=CC=CC=C1N V7063 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.86 CC1=CC=CC=C1OC(C)C V5254 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.86 CC1=NC=CN=C1OC(C)C 6045AC [0,1,0,0,0,0|2,0,0]=3 72 B11R1.86 CN(C)CC1=CC=CC=C1N 9984AH [0,1,0,0,0,0|2,0,0]=3 73 B11R1.86 O=C(O)CC1=CC=CN=C1Cl Y5005 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 8966AA [0,1,0,0,0,0|2,0,1]=4 75 B11R1.157 CC(C)NC1=NC=CC(Br)=C1 Z8259 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.157 CC1=CC=CC(OC(C)C)=C1 V4050 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 4909AB [0,1,0,0,0,0|2,0,1]=4 78 B11R1.509 CC(C)(C)CC1=CC=CC=C1 0255AA [0,1,0,0,0,0|1,0,0]=2 79 B11R1.509 FC(F)(F)CC1=CC=CC=C1 7211AD [0,1,0,0,0,0|3,0,0]=4 80 B11R1.509 FC(F)(F)CC1=CC=CN=C1 8679AC [0,1,0,0,0,0|2,0,0]=3 81 B11R2.4 NC1CC1C2=CC=CC=C2 5104AH [0,0,0,1,0,0|2,0,0]=3 82 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 8373AH [0,0,0,1,0,0|2,0,0]=3 83 B11R2.10 CC1=CC2=C(C=CC=C2)C1 1054AB [0,0,0,1,0,0|1,0,2]=4 84 B11R2.10 CC1=NC2=CC=CN=C2N1 V7266 [0,0,0,1,0,0|2,0,1]=4 85 B11R2.10 CC1=NC2=NC=CC=C2O1 W8875 [0,0,0,1,0,0|2,0,1]=4 86 B11R2.10 CC1CC2=C(C=CC=C2)O1 5226AL [0,0,0,1,0,0|2,0,0]=3 87 B11R2.10 O=C1CC2=C(C=CC=N2)N1 3636AB [0,0,0,1,0,0|2,0,1]=4 88 B11R2.10 O=C1CC2=CC=CN=C2N1 W7017 [0,0,0,1,0,0|2,0,1]=4 89 B11R2.10 O=C1CC2=CN=CC=C2N1 6234AA [0,0,0,1,0,0|2,0,1]=4 90 B11R2.238 C1=CC=C(NC2CC2)C=C1 Z3373 [0,0,0,1,0,0|2,0,0]=3 91 B9R1.6 CC(=O)C1=CC=NN=C1 W6606 [0,0,0,0,1,0|2,0,1]=4 92 B9R1.6 CC(=O)C1=CN=CN=C1 X8651 [0,0,0,0,1,0|2,0,1]=4 93 B9R1.6 CC(Br)C1=NC=CN=C1 5526AC [0,0,0,0,1,0|2,0,0]=3 94 B9R1.6 CC(C)C1=NC=CC=C1 W7610 [0,0,0,0,1,0|2,0,0]=3 95 B9R1.6 CC(N)C1=CC=CC=N1 4915AJ [0,0,0,0,1,0|3,0,0]=4 96 B9R1.6 CC(N)C1=CC=NC=C1 W3800 [0,0,0,0,1,0|3,0,0]=4 97 B9R1.6 CC(N)C1=CC=NC=C1 W6570 [0,0,0,0,1,0|3,0,0]=4 98 B9R1.6 CC(N)C1=NC=CN=C1 Z2224 [0,0,0,0,1,0|2,0,0]=3 99 B9R1.6 CC(O)C1=NC=CC=C1 Z2356 [0,0,0,0,1,0|3,0,0]=4 100 B9R1.6 CN(C)C1=CN=CC=C1 9643AA [0,0,0,0,1,0|1,0,0]=2 101 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [0,0,0,0,1,0|2,0,0]=3 102 B9R1.6 C[C@@H](N)C1=CC=NC=C1 4791AJ [0,0,0,0,1,0|3,0,0]=4 103 B9R1.6 C[C@@H](N)C1=NC=CC=C1 W6374 [0,0,0,0,1,0|3,0,0]=4 104 B9R1.6 C[C@@H](O)C1=CC=NC=C1 2673AB [0,0,0,0,1,0|3,0,0]=4 105 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [0,0,0,0,1,0|1,0,0]=2 106 B9R1.6 C[C@H](N)C1=NC=CC=C1 5348AB [0,0,0,0,1,0|3,0,0]=4 107 B9R1.6 C[C@H](N)C1=NC=CC=C1 W5086 [0,0,0,0,1,0|3,0,0]=4 108 B9R1.6 C[C@H](O)C1=CC=NC=C1 7927AB [0,0,0,0,1,0|3,0,0]=4 109 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [0,0,0,0,1,0|1,0,0]=2 110 B9R1.6 C[C@H](O)C1=NC=CC=C1 8783AB [0,0,0,0,1,0|3,0,0]=4 111 B9R1.6 FC(F)C1=CC=CC=C1 X8304 [0,0,0,0,1,0|3,0,0]=4 112 B9R1.6 FC(F)C1=CN=CC=C1 9427AE [0,0,0,0,1,0|2,0,0]=3 113 B9R1.6 OB(O)C1=CN=CC=C1 8784AD [0,0,0,0,1,0|3,0,0]=4 114 B9R1.13 CC(C)CC1=NNC=C1 5899AJ [0,0,0,0,1,0|1,0,0]=2 115 B9R1.13 CC(N)CN1C=CC=N1 3672AF [0,0,0,0,1,0|2,0,0]=3 116 B9R1.13 CN(C)CC1=CC=CN1 4514AD [0,0,0,0,1,0|1,0,1]=3 117 B11R1.91 C=C(C)OCC1=CC=CC=C1 7143AL [0,0,0,0,0,1|1,0,2]=4 118 B11R1.91 CC(=O)CSC1=CC=CC=C1 4421AE [0,0,0,0,0,1|2,0,1]=4 119 B11R1.91 CC(C)CCC1=CC=CC=C1 5880AF [0,0,0,0,0,1|1,0,0]=2 120 B11R1.91 O=C(O)COC1=CN=CC=C1 4069AE [0,0,0,0,0,1|2,0,1]=4 121 B8R0.4 CCC\C=C\C=C\CO Z4325 [1,0,1,0,0,0|2,0,0]=4 122 B8R1.2 BrCC1=NC=CN=C1 5266AJ [2,0,0,0,0,0|2,0,0]=4 123 B8R1.2 CNC1=NC=CN=C1 3544AB [2,0,0,0,0,0|2,0,0]=4 124 B8R1.2 COC1=CN=CN=C1 W5346 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.2 ClCC1=CN=CC=N1 0741AB [2,0,0,0,0,0|2,0,0]=4 126 B8R1.2 NCC1=CN=CN=C1 W4845 [2,0,0,0,0,0|2,0,0]=4 127 B8R1.2 NCC1=NC=CN=C1 W5959 [2,0,0,0,0,0|2,0,0]=4 128 B8R1.2 NNC1=CC=CN=C1 Z1664 [2,0,0,0,0,0|2,0,0]=4 129 B8R1.2 OCC1=CN=CN=C1 W4842 [2,0,0,0,0,0|2,0,0]=4 130 B8R1.2 OCC1=CN=NC=C1 7045AB [2,0,0,0,0,0|2,0,0]=4 131 B10R1.1 CC1=CC=C(CCBr)C=C1 W7663 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.1 CC1=CC=C(CCN)C=C1 1184AJ [1,1,0,0,0,0|2,0,0]=4 133 B10R1.1 CCCC1=CC=C(Cl)C=C1 5012AE [1,1,0,0,0,0|1,0,0]=3 134 B10R1.1 CCCC1=CN=C(Cl)N=C1 7472AD [1,1,0,0,0,0|1,0,0]=3 135 B10R1.1 CCOC1=CC=C(Cl)N=N1 8931AA [1,1,0,0,0,0|2,0,0]=4 136 B10R1.1 CCOC1=CN=C(Br)C=C1 V5913 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.1 CCOC1=CN=C(Br)C=N1 1348AA [1,1,0,0,0,0|2,0,0]=4 138 B10R1.1 CCOC1=CN=C(N)C=N1 W7623 [1,1,0,0,0,0|2,0,0]=4 139 B10R1.1 CCOC1=CN=C(N)N=C1 5139AB [1,1,0,0,0,0|2,0,0]=4 140 B10R1.1 CCOC1=NC=C(Cl)N=C1 6462AA [1,1,0,0,0,0|2,0,0]=4 141 B10R1.1 CCSC1=CC=C(Br)C=C1 9641AD [1,1,0,0,0,0|2,0,0]=4 142 B10R1.1 CNCC1=CC=C(Br)C=C1 7292AJ [1,1,0,0,0,0|2,0,0]=4 143 B10R1.1 CNCC1=CC=C(C)C=C1 7294AJ [1,1,0,0,0,0|2,0,0]=4 144 B10R1.1 CNCC1=CC=C(C)C=C1 W7964 [1,1,0,0,0,0|2,0,0]=4 145 B10R1.1 CNCC1=CC=C(Cl)C=C1 7293AJ [1,1,0,0,0,0|2,0,0]=4 146 B10R1.1 CNCC1=CN=C(C)N=C1 Z4024 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.1 COCC1=CC=C(Br)C=C1 Z0209 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.1 COCC1=CC=C(N)C=C1 V7837 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.1 CSCC1=CN=C(Cl)C=C1 7608AC [1,1,0,0,0,0|1,0,0]=3 150 B10R1.1 NCCC1=CC=C(Br)C=C1 0590AB [1,1,0,0,0,0|2,0,0]=4 151 B10R1.1 OC1=CC=C(CCBr)C=C1 6870AA [1,1,0,0,0,0|2,0,0]=4 152 B10R1.1 OCCC1=CC=C(Cl)N=C1 1226AJ [1,1,0,0,0,0|1,0,0]=3 153 B10R1.1 OCCC1=CC=C(I)C=C1 W6745 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.4 BrCCC1=CC=CC=C1Br Z7172 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.4 CC1=CC=CC=C1CCN S579 [1,1,0,0,0,0|2,0,0]=4 156 B10R1.4 CCCC1=CC=NC=C1C 1078AE [1,1,0,0,0,0|2,0,0]=4 157 B10R1.4 CCCC1=NC=CN=C1C 5716AL [1,1,0,0,0,0|1,0,0]=3 158 B10R1.4 CCNC1=CC=CC=C1F 8903AD [1,1,0,0,0,0|2,0,0]=4 159 B10R1.4 CCNC1=NC=CN=C1N W9368 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.4 CCOC1=C(Cl)C=CC=C1 9221AB [1,1,0,0,0,0|2,0,0]=4 161 B10R1.4 CCOC1=C(N)C=CN=C1 Z5305 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.4 CCOC1=C(N)N=CC=C1 7078AC [1,1,0,0,0,0|1,0,0]=3 163 B10R1.4 CCOC1=CC=CC=C1F Z0605 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.4 CCOC1=CC=CC=C1N 8719AL [1,1,0,0,0,0|2,0,0]=4 165 B10R1.4 CCOC1=NC=CN=C1N W9234 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.4 CNCC1=C(C)N=CC=C1 5583AJ [1,1,0,0,0,0|1,0,0]=3 167 B10R1.4 CNCC1=C(O)C=CC=C1 5657AL [1,1,0,0,0,0|2,0,0]=4 168 B10R1.4 CNCC1=CC=CC=C1F W6033 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.4 COCC1=C(O)C=CC=C1 5292AJ [1,1,0,0,0,0|2,0,0]=4 170 B10R1.4 COCC1=CC=CC=C1Br Z0660 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.4 ClC1=C(CCBr)C=CC=C1 8570AA [1,1,0,0,0,0|2,0,0]=4 172 B10R1.4 FC1=CC=CC=C1CCBr W9375 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.4 N#CCC1=CC=CN=C1Cl X8095 [1,1,0,0,0,0|1,0,1]=4 174 B10R1.4 NCCC1=CC=CC=C1Br Z8825 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.4 NCCC1=CC=CC=C1N X9142 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.10 BrCCC1=CC=CC(Br)=C1 1605AL [1,1,0,0,0,0|2,0,0]=4 177 B10R1.10 CCCC1=CC(F)=CC=C1 2809AB [1,1,0,0,0,0|1,0,0]=3 178 B10R1.10 CCCC1=CC(N)=NC=C1 2922AJ [1,1,0,0,0,0|2,0,0]=4 179 B10R1.10 CCCC1=CC=CC(N)=N1 5785AB [1,1,0,0,0,0|2,0,0]=4 180 B10R1.10 CCNC1=CC=CC(O)=C1 9329AB [1,1,0,0,0,0|2,0,0]=4 181 B10R1.10 CCOC1=CN=CC(Br)=C1 Z0262 [1,1,0,0,0,0|1,0,0]=3 182 B10R1.10 CCSC1=CC(Br)=CC=C1 V3919 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.10 CNCC1=CC(Br)=CN=C1 W8153 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.10 CNCC1=CC=CC(Br)=C1 7287AJ [1,1,0,0,0,0|2,0,0]=4 185 B10R1.10 CNCC1=CC=CC(C)=C1 5109AB [1,1,0,0,0,0|2,0,0]=4 186 B10R1.10 CNCC1=CC=CC(Cl)=C1 7403AJ [1,1,0,0,0,0|2,0,0]=4 187 B10R1.10 COCC1=CC(Br)=CC=C1 Z0210 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.10 COCC1=CC(N)=CC=C1 V6465 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.10 ClC1=CC(CCBr)=CC=C1 4892AJ [1,1,0,0,0,0|2,0,0]=4 190 B10R1.10 NC1=CC(CCO)=CC=C1 7359AB [1,1,0,0,0,0|2,0,0]=4 191 B10R1.10 NCCC1=CC=CC(Br)=C1 V4368 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.10 OCCC1=CC(O)=CC=C1 X9865 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.10 OCCC1=CC=CC(Cl)=C1 X8323 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [1,1,0,0,0,0|1,0,1]=4 195 B10R1.15 CC(CBr)C1=CC=CC=C1 Y3159 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.15 CCC(=O)C1=CC=CN=C1 Y5018 [1,1,0,0,0,0|0,0,1]=3 198 B10R1.15 CCC(C)C1=NC=CN=C1 R546 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.15 CCC(N)C1=CC=NC=C1 4998AJ [1,1,0,0,0,0|2,0,0]=4 200 B10R1.15 CCC(N)C1=NC=CC=C1 4914AJ [1,1,0,0,0,0|2,0,0]=4 201 B10R1.15 CCN(C)C1=CC=CC=C1 W7366 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [1,1,0,0,0,0|2,0,0]=4 203 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 7435AJ [1,1,0,0,0,0|1,0,0]=3 204 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.15 CNC(C)C1=CC=CN=C1 0995AD [1,1,0,0,0,0|1,0,0]=3 206 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [1,1,0,0,0,0|2,0,0]=4 208 B10R1.15 NCC(O)C1=CC=CN=C1 5727AC [1,1,0,0,0,0|1,0,0]=3 209 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.15 O=C(CBr)C1=CC=CN=C1 C113 [1,1,0,0,0,0|1,0,1]=4 211 B10R1.17 BrCCSC1=CC=CC=C1 5534AL [1,1,0,0,0,0|2,0,0]=4 212 B10R1.17 CCOCC1=CC=CC=C1 S562 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.17 CNCCC1=CC=NC=C1 5553AE [1,1,0,0,0,0|2,0,0]=4 214 B10R1.17 COCSC1=CC=CC=C1 8208AL [1,1,0,0,0,0|2,0,0]=4 215 B10R1.17 ClCSCC1=CC=CC=C1 2470AE [1,1,0,0,0,0|2,0,0]=4 216 B10R1.17 NCCCC1=CC=CN=C1 X2118 [1,1,0,0,0,0|0,0,0]=2 217 B10R1.17 NCCCC1=CC=NC=C1 3209AB [1,1,0,0,0,0|2,0,0]=4 218 B10R1.17 NNCCC1=CC=CC=C1 4752AE [1,1,0,0,0,0|2,0,0]=4 219 B10R1.17 OCCNC1=CC=CC=C1 V7623 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.13 CC(=O)C1=CC=C(F)N=C1 W8700 [0,1,0,0,1,0|1,0,1]=4 221 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,1,0,0,1,0|1,0,1]=4 222 B10R1.13 CC(Br)C1=CC=C(F)C=C1 9966AB [0,1,0,0,1,0|2,0,0]=4 223 B10R1.13 CC(C)C1=CC=C(N)C=N1 Z4708 [0,1,0,0,1,0|2,0,0]=4 224 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 W7245 [0,1,0,0,1,0|1,0,0]=3 225 B10R1.13 CC(C)C1=NN=C(Cl)C=C1 Z4894 [0,1,0,0,1,0|1,0,0]=3 226 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 Z2196 [0,1,0,0,1,0|2,0,0]=4 227 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [0,1,0,0,1,0|2,0,0]=4 228 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [0,1,0,0,1,0|2,0,0]=4 229 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [0,1,0,0,1,0|2,0,0]=4 230 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [0,1,0,0,1,0|2,0,0]=4 231 B10R1.13 CC(O)C1=CC=C(O)C=C1 Z4466 [0,1,0,0,1,0|2,0,0]=4 232 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [0,1,0,0,1,0|2,0,0]=4 233 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [0,1,0,0,1,0|1,0,0]=3 234 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 6145AJ [0,1,0,0,1,0|2,0,0]=4 235 B10R1.13 CN(C)C1=CC=C(F)C=C1 2692AE [0,1,0,0,1,0|2,0,0]=4 236 B10R1.13 CN(C)C1=CC=C(O)C=C1 Z4951 [0,1,0,0,1,0|2,0,0]=4 237 B10R1.13 CN(C)C1=NN=C(Cl)C=C1 V7445 [0,1,0,0,1,0|2,0,0]=4 238 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [0,1,0,0,1,0|2,0,0]=4 239 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [0,1,0,0,1,0|2,0,0]=4 240 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [0,1,0,0,1,0|2,0,0]=4 241 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 1808AC [0,1,0,0,1,0|2,0,0]=4 242 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 X8527 [0,1,0,0,1,0|2,0,0]=4 243 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 6983AC [0,1,0,0,1,0|2,0,0]=4 244 B10R1.13 C[S+](C)C1=CC=C(O)C=C1 6544AL [0,1,0,0,1,0|2,0,0]=4 245 B10R1.13 FC(F)C1=CN=C(Br)C=C1 4209AA [0,1,0,0,1,0|2,0,0]=4 246 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 8632AE [0,1,0,0,1,0|2,0,0]=4 247 B10R1.28 CC(C)(C)C1=NC=CN=C1 S575 [0,1,0,0,1,0|1,0,0]=3 248 B10R1.28 CC(C)(N)C1=CC=CC=N1 5199AJ [0,1,0,0,1,0|2,0,0]=4 249 B10R1.28 CC(C)(O)C1=CC=CN=C1 Y7594 [0,1,0,0,1,0|0,0,0]=2 250 B10R1.28 CC(C)(O)C1=NC=CC=C1 4873AB [0,1,0,0,1,0|2,0,0]=4 251 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 8822AL [0,1,0,0,1,0|2,0,0]=4 252 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 9417AF [0,1,0,0,1,0|1,1,0]=4 253 B10R1.28 FC(F)(F)C1=CC=CN=C1 V2215 [0,1,0,0,1,0|2,0,0]=4 254 B10R1.61 CC(=O)C1=CC=CN=C1Br W8693 [0,1,0,0,1,0|1,0,1]=4 255 B10R1.61 CC(=O)C1=CC=CN=C1C Y7806 [0,1,0,0,1,0|1,0,1]=4 256 B10R1.61 CC(=O)C1=CC=CN=C1Cl W6955 [0,1,0,0,1,0|1,0,1]=4 257 B10R1.61 CC(=O)C1=CC=CN=C1F Y4110 [0,1,0,0,1,0|1,0,1]=4 258 B10R1.61 CC(Cl)C1=CC=CC=C1Cl 0284AB [0,1,0,0,1,0|2,0,0]=4 259 B10R1.61 CC(N)C1=C(O)C=CC=C1 5161AJ [0,1,0,0,1,0|2,0,0]=4 260 B10R1.61 CC(N)C1=CC=CC=C1Cl V8121 [0,1,0,0,1,0|2,0,0]=4 261 B10R1.61 CC(N)C1=CC=CC=C1Cl X6241 [0,1,0,0,1,0|2,0,0]=4 262 B10R1.61 CC(N)C1=CC=CC=C1F V7591 [0,1,0,0,1,0|2,0,0]=4 263 B10R1.61 CC(O)C1=C(Br)C=CC=C1 4894AJ [0,1,0,0,1,0|2,0,0]=4 264 B10R1.61 CC(O)C1=C(Cl)N=CC=C1 5872AA [0,1,0,0,1,0|1,0,0]=3 265 B10R1.61 CC(O)C1=CC=CC=C1F X8296 [0,1,0,0,1,0|2,0,0]=4 266 B10R1.61 CC(O)C1=CC=CC=C1N Z6783 [0,1,0,0,1,0|2,0,0]=4 267 B10R1.61 CN(C)C1=C(F)C=CC=C1 9536AF [0,1,0,0,1,0|2,0,0]=4 268 B10R1.61 CN(C)C1=CC=CC=C1O Z4668 [0,1,0,0,1,0|2,0,0]=4 269 B10R1.61 CN(C)C1=NC=CN=C1N W9238 [0,1,0,0,1,0|2,0,0]=4 270 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 1179AL [0,1,0,0,1,0|2,0,0]=4 271 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl X9707 [0,1,0,0,1,0|2,0,0]=4 272 B10R1.61 C[C@@H](N)C1=CC=CC=C1O X9575 [0,1,0,0,1,0|2,0,0]=4 273 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 8241AA [0,1,0,0,1,0|2,0,0]=4 274 B10R1.61 FC(F)C1=C(Br)N=CC=C1 1062AD [0,1,0,0,1,0|2,0,0]=4 275 B10R1.61 FC1=NC=CC=C1C(F)F 4047AD [0,1,0,0,1,0|2,0,0]=4 276 B10R1.113 CC(=O)C1=CC(F)=CN=C1 4092AB [0,1,0,0,1,0|1,0,1]=4 277 B10R1.113 CC(=O)C1=CN=CC(C)=C1 5943AB [0,1,0,0,1,0|1,0,1]=4 278 B10R1.113 CC(C)C1=CC=CC(Br)=N1 Z6690 [0,1,0,0,1,0|2,0,0]=4 279 B10R1.113 CC(N)C1=CC=CC(Br)=C1 4929AJ [0,1,0,0,1,0|2,0,0]=4 280 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V4629 [0,1,0,0,1,0|2,0,0]=4 281 B10R1.113 CC(N)C1=CC=CC(F)=C1 1626AC [0,1,0,0,1,0|2,0,0]=4 282 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 4933AJ [0,1,0,0,1,0|2,0,0]=4 283 B10R1.113 CC(O)C1=CC(F)=CC=C1 2665AE [0,1,0,0,1,0|2,0,0]=4 284 B10R1.113 CC(O)C1=CC(O)=CC=C1 4940AJ [0,1,0,0,1,0|2,0,0]=4 285 B10R1.113 CC(O)C1=CC=CC(N)=C1 W4803 [0,1,0,0,1,0|2,0,0]=4 286 B10R1.113 CC1=CC(C(C)N)=CC=C1 8402AE [0,1,0,0,1,0|2,0,0]=4 287 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 W3022 [0,1,0,0,1,0|2,0,0]=4 288 B10R1.113 CC1=CC=CC(C(C)O)=C1 8099AF [0,1,0,0,1,0|2,0,0]=4 289 B10R1.113 CN(C)C1=CC(F)=CC=C1 0769AB [0,1,0,0,1,0|2,0,0]=4 290 B10R1.113 CN(C)C1=CC=CC(Cl)=C1 0572AC [0,1,0,0,1,0|2,0,0]=4 291 B10R1.113 C[C@@H](O)C1=CC(Br)=CC=C1 6220AA [0,1,0,0,1,0|2,0,0]=4 292 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 6759AA [0,1,0,0,1,0|2,0,0]=4 293 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Z1666 [0,1,0,0,1,0|2,0,0]=4 294 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 X4842 [0,1,0,0,1,0|2,0,0]=4 295 B10R1.113 C[C@H](O)C1=CC=CC(Cl)=C1 6282AA [0,1,0,0,1,0|2,0,0]=4 296 B10R1.113 FC(F)C1=CN=CC(Br)=C1 9490AC [0,1,0,0,1,0|2,0,0]=4 297 B10R1.27 CC(CO)CN1C=CC=N1 7253AC [0,1,0,0,1,0|1,0,0]=3 298 B10R1.54 CC(C)CC1=NC(Br)=NN1 4235AD [0,1,0,0,1,0|2,0,0]=4 299 B10R1.54 CC(C)CN1C=C(I)C=N1 V9143 [0,1,0,0,1,0|1,0,0]=3 300 B10R1.54 CC1=CC(CC(C)N)=NN1 7647AC [0,1,0,0,1,0|2,0,0]=4 301 B12R1.21 CC(C)COC1=CC=C(N)C=C1 4819AE [0,1,0,0,0,1|1,0,0]=3 302 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 8511AE [0,1,0,0,0,1|1,0,0]=3 303 B12R1.21 CN(C)CCC1=CC=C(N)C=C1 5530AH [0,1,0,0,0,1|2,0,0]=4 304 B12R1.27 NCC(O)COC1=CC=CC=C1 3219AE [0,1,0,0,0,1|2,0,0]=4 305 B12R1.27 NCC(O)COC1=CC=CC=C1 Z2335 [0,1,0,0,0,1|2,0,0]=4 306 B12R1.43 CC(C)C(=O)OC1=CC=CC=C1 8092AL [0,1,0,0,0,1|1,0,1]=4 307 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 6370AD [0,1,0,0,0,1|2,0,0]=4 308 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 8629AB [0,1,0,0,0,1|1,0,0]=3 309 B12R1.107 CC(C)CC(N)C1=CC=CN=C1 5910AJ [0,1,0,0,0,1|0,0,0]=2 310 B12R1.125 CC1=C(OCC(C)O)C=CC=C1 4280AL [0,1,0,0,0,1|2,0,0]=4 311 B12R1.226 CC(C)CSC1=CC(Br)=CC=C1 Z8144 [0,1,0,0,0,1|1,0,0]=3 312 B12R1.226 CC1=CC=CC(OCC(C)O)=C1 4284AL [0,1,0,0,0,1|2,0,0]=4 313 B12R1.891 CC(C)(C)NSC1=CC=CC=C1 8673AL [0,1,0,0,0,1|2,0,0]=4 314 B12R1.891 C[Si](C)(C)C#CC1=CC=CN=C1 X7217 [0,1,0,0,0,1|0,1,1]=4 315 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 Y8233 [0,2,0,0,0,0|2,0,0]=4 316 B12R1.19 CC(C)OC1=CC=C(Br)C(Cl)=C1 Z0496 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.19 CC(C)OC1=CC=C(Br)C(F)=C1 Y3572 [0,2,0,0,0,0|2,0,0]=4 318 B12R1.49 COC(=O)CC1=CC=C(Cl)N=C1 Z6313 [0,2,0,0,0,0|1,0,1]=4 319 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 6147AJ [0,2,0,0,0,0|2,0,0]=4 320 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 W5702 [0,2,0,0,0,0|2,0,0]=4 321 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 5559AB [0,2,0,0,0,0|2,0,0]=4 322 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 6908AB [0,2,0,0,0,0|2,0,0]=4 323 B12R1.106 CC(C)(C)OC1=CC=C(Cl)C=C1 F450 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.106 CC(C)(C)OC1=CC=C(N)C=C1 V6697 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.106 CC(C)(C)OC1=CC=C(O)C=C1 8269AD [0,2,0,0,0,0|2,0,0]=4 326 B12R1.106 CC(C)(C)OC1=NN=C(Cl)C=C1 8932AA [0,2,0,0,0,0|2,0,0]=4 327 B12R1.106 FC(F)(F)CC1=CN=C(Cl)C=C1 X4809 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.233 CC(C)OC1=CC=C(Br)C=C1F Z0350 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.233 CC(C)OC1=CC=C(F)C=C1Br Z0349 [0,2,0,0,0,0|2,0,0]=4 330 B12R1.225 CN(C)C(=O)C1=CC(Br)=CN=C1 Z0483 [0,2,0,0,0,0|1,0,1]=4 331 B12R1.225 C[C@H](C1=CC(O)=CC=C1)N(C)C 3159AC [0,2,0,0,0,0|2,0,0]=4 332 B12R1.225 C[C@H](N)[C@H](O)C1=CC=CC(O)=C1 E767 [0,2,0,0,0,0|2,0,0]=4 333 B12R1.253 CN(C)S(=O)(=O)C1=CC=CN=C1 V6138 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 W7376 [0,2,0,0,0,0|1,0,0]=3 335 B12R1.564 NC(C1=CN=CC=C1)C(F)(F)F 8436AH [0,2,0,0,0,0|2,0,0]=4 336 B12R1.564 NC(C1=CN=CC=C1)C(F)(F)F 9683AC [0,2,0,0,0,0|2,0,0]=4 337 B12R1.32 C#CCN(C)CC1=CC=CC=C1 V1637 [0,2,0,0,0,0|2,0,0]=4 338 B12R1.32 CN(CCN)CC1=CC=CC=C1 6899AA [0,2,0,0,0,0|2,0,0]=4 339 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 3046AC [0,2,0,0,0,0|1,0,0]=3 340 B12R1.118 N#CC(CO)CC1=CC=CC=C1 5460AJ [0,2,0,0,0,0|1,0,1]=4 341 B12R1.194 CCC(C)(O)CC1=CC=CC=C1 5701AL [0,2,0,0,0,0|1,0,0]=3 342 B12R1.371 CC(CN)OC1=C(Cl)C=CC=C1 2001AF [0,2,0,0,0,0|2,0,0]=4 343 B12R1.371 CNC(C)CC1=NC=CC=C1C 3717AF [0,2,0,0,0,0|2,0,0]=4 344 B12R1.75 COC1=CC=CC=C1CC(C)O Y7646 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.127 CC(C)OC1=CC(Br)=CC=C1Cl Z0747 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.127 CC(C)OC1=CC(F)=CC=C1N V3404 [0,2,0,0,0,0|2,0,0]=4 347 B12R1.127 CC(C)OC1=CC(F)=CC=C1N W5879 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.127 CN(C)CC1=CC(O)=CC=C1Br Y4219 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.1009 CC(C)OC1=C(F)C=CC=C1Br Z0052 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.101 CC(C)OC1=CC(Br)=CC(Br)=C1 Y3660 [0,2,0,0,0,0|2,0,0]=4 351 B10R2.6 C1=CC=C(C2CC2)C=C1 V8423 [1,0,0,1,0,0|1,0,0]=3 352 B10R2.7 C1=CC2=C(C=C1)COC2 6725AB [1,0,0,1,0,0|2,0,0]=4 353 B10R2.7 C1=CC2=C(C=N1)CNC2 X5477 [1,0,0,1,0,0|1,0,0]=3 354 B10R2.7 C1=CC2=C(C=N1)CNC2 X6082 [1,0,0,1,0,0|1,0,0]=3 355 B10R2.7 C1=CC2=C(N=C1)NCC2 X8780 [1,0,0,1,0,0|1,0,0]=3 356 B10R2.7 C1=NC=NC2=C1CNC2 3097AA [1,0,0,1,0,0|2,0,0]=4 357 B10R2.7 C1=NC=NC2=C1CNC2 W3417 [1,0,0,1,0,0|2,0,0]=4 358 B12R2.24 CC1CNC2=C(C=CC=C2)S1 6248AE [0,0,0,1,0,1|2,0,0]=4 359 B12R2.24 CC1CNC2=CC=CC=C2N1 1064AQ [0,0,0,1,0,1|2,0,0]=4 360 B12R2.24 NC1COC2=C(C=CC=C2)C1 9680AA [0,0,0,1,0,1|2,0,0]=4 361 B12R2.24 OC1CNC2=CC=CC=C2C1 3033AH [0,0,0,1,0,1|2,0,0]=4 362 B12R2.2057 C1=CC=C(OC[C@H]2CO2)C=C1 P609 [0,0,0,1,0,1|2,0,0]=4 363 B12R2.2403 CC1(C)CNC2=C1C=CC=C2 2275AL [0,0,0,1,0,1|1,0,0]=3 364 B12R2.294 ClC1=NN=C(NC2CC2)C=C1 V9374 [0,1,0,1,0,0|2,0,0]=4 365 B12R2.294 IC1=CC=C(OC2CC2)C=C1 4594AA [0,1,0,1,0,0|2,0,0]=4 366 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 2765AC [0,1,0,1,0,0|2,0,0]=4 367 B12R2.606 OC1CC2=C(C=C(Br)C=C2)C1 W8856 [0,1,0,1,0,0|2,0,0]=4 368 B12R2.18 CC1CC2=C(C=CC=C2)C1=O 9059AA [0,1,0,1,0,0|1,0,1]=4 369 B12R2.18 CC1NC2=C(C=CC=C2)C1C 1212AB [0,1,0,1,0,0|2,0,0]=4 370 B12R2.18 N[C@@H]1C2=CC=CC=C2C[C@@H]1O 6832AA [0,1,0,1,0,0|2,0,0]=4 371 B12R2.18 N[C@@H]1C2=CC=CC=C2C[C@@H]1O 9149AE [0,1,0,1,0,0|2,0,0]=4 372 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O 4008AL [0,1,0,1,0,0|2,0,0]=4 373 B12R2.18 OC1C2=C(C=CC=C2)CC1Br 7739AB [0,1,0,1,0,0|2,0,0]=4 374 B12R2.18 OC1CC2=C(C=CC=C2)C1O 4451AL [0,1,0,1,0,0|2,0,0]=4 375 B12R2.2075 NC(C1=CC=CC=C1)C2CC2 5276AB [0,1,0,1,0,0|1,0,0]=3 376 B12R2.2075 NC(C1=CC=CN=C1)C2CC2 6582AJ [0,1,0,1,0,0|0,0,0]=2 377 B12R2.2075 NC(C1=CC=NC=C1)C2CC2 5116AJ [0,1,0,1,0,0|2,0,0]=4 378 B12R2.2075 N[C@@H](C1=CC=CC=C1)C2CC2 W9898 [0,1,0,1,0,0|1,0,0]=3 379 B12R2.32 OCC1CC2=CC=CC=C2O1 W7718 [0,1,0,1,0,0|2,0,0]=4 380 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 9499AD [0,1,0,1,0,0|2,0,0]=4 381 B12R2.95 CC1(C)OC2=CC=CC=C2O1 Z4148 [0,1,0,1,0,0|2,0,0]=4 382 B12R2.95 CC1(N)CC2=C(C=CC=C2)C1 1784AJ [0,1,0,1,0,0|1,0,0]=3 383 B12R2.225 BrC1=CC=CC=C1OC2CC2 Y8944 [0,1,0,1,0,0|2,0,0]=4 384 B8R1.8 CCCC1=NC=CS1 9241AA [1,0,0,0,1,0|1,0,0]=3 385 B8R1.8 CCCN1C=CC=N1 Z0507 [1,0,0,0,1,0|1,0,0]=3 386 B8R1.8 CNCC1=CC=CS1 V7562 [1,0,0,0,1,0|2,0,0]=4 387 B8R1.8 CNCC1=CC=CS1 W7142 [1,0,0,0,1,0|2,0,0]=4 388 B8R1.8 CSCC1=CC=CO1 9711AJ [1,0,0,0,1,0|2,0,0]=4 389 B8R1.8 ClCCN1C=CC=N1 X5413 [1,0,0,0,1,0|2,0,0]=4 390 B8R1.8 ClCCN1C=CN=C1 9891AA [1,0,0,0,1,0|2,0,0]=4 391 B8R1.8 NCCC1=CN=CN1 Y9749 [1,0,0,0,1,0|2,0,0]=4 392 B8R1.8 NCCC1=CSC=C1 Y8818 [1,0,0,0,1,0|2,0,0]=4 393 B8R1.8 NCCC1=NC=CS1 Y1661 [1,0,0,0,1,0|2,0,0]=4 394 B8R1.8 NCCC1=NC=CS1 Y8064 [1,0,0,0,1,0|2,0,0]=4 395 B8R1.8 NCCN1C=CN=C1 V2457 [1,0,0,0,1,0|2,0,0]=4 396 B8R1.8 OCCC1=CNC=N1 W8955 [1,0,0,0,1,0|2,0,0]=4 397 B8R1.8 OCCN1C=CC=N1 V7005 [1,0,0,0,1,0|2,0,0]=4 398 B8R1.7 CC(C)=C1C=CC=C1 1050AB [0,0,0,0,2,0|0,0,1]=3 399 B8R1.7 CC(C)C1=CC=CO1 U090 [0,0,0,0,2,0|1,0,0]=3 400 B8R1.7 CC(N)C1=COC=C1 2007AB [0,0,0,0,2,0|2,0,0]=4 401 B8R1.7 CC(N)C1=NC=CS1 V9472 [0,0,0,0,2,0|2,0,0]=4 402 B8R1.7 CC(N)C1=NC=CS1 W6267 [0,0,0,0,2,0|2,0,0]=4 403 B8R1.7 CN(C)N1C=CC=C1 1393AQ [0,0,0,0,2,0|2,0,0]=4 404 B12R1.252 CC(C)CNCC1=CC=CC=C1 3705AL [0,0,0,0,0,2|1,0,0]=3 405 B12R1.252 CN(C)CCOC1=CC=CC=C1 X9881 [0,0,0,0,0,2|2,0,0]=4 406 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 X5394 [0,0,0,0,0,2|2,0,0]=4