0 B10R1.20 C#CC1=C(OC)C=CC=C1 1967AC [0,0,0,0,0,0|1,0,1]=2 1 B10R1.20 CCC1=C(C#N)C=CC=C1 0896AE [0,0,0,0,0,0|3,0,0]=3 2 B10R1.20 CCC1=C(CC)C=CC=C1 8567AJ [0,0,0,0,0,0|2,0,0]=2 3 B10R1.20 CCC1=C(SC)N=CC=N1 5052AL [0,0,0,0,0,0|3,1,0]=4 4 B10R1.20 CCC1=CC=CC=C1OC 5616AL [0,0,0,0,0,0|1,0,0]=1 5 B10R1.20 CNC1=C(C#N)C=CC=C1 5293AJ [0,0,0,0,0,0|3,0,0]=3 6 B10R1.20 CNC1=C(C=O)C=CC=N1 0212AE [0,0,0,0,0,0|4,0,0]=4 7 B10R1.20 CNC1=C(OC)C=CC=C1 1244AA [0,0,0,0,0,0|1,0,0]=1 8 B10R1.20 CNC1=NC=CC=C1C#N V6393 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.20 CNC1=NC=CC=C1CO W5421 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.20 COC1=C(C=O)C=CN=C1 9666AA [0,0,0,0,0,0|3,0,0]=3 11 B10R1.20 COC1=C(CN)C=CC=N1 2549AA [0,0,0,0,0,0|3,0,0]=3 12 B10R1.20 COC1=CC=CC=C1CN W6218 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.20 COC1=CC=CC=C1SC L298 [0,0,0,0,0,0|0,1,0]=1 14 B10R1.20 COC1=CC=CN=C1C#N V4606 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.20 COC1=CC=CN=C1C=O V3952 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.20 COC1=CC=NC=C1C#N W8194 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.20 COC1=CC=NC=C1OC 1881AA [0,0,0,0,0,0|1,0,0]=1 18 B10R1.20 COC1=NC=CC=C1C#N V1358 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.20 COC1=NC=CC=C1C=O V1359 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.20 COC1=NC=CC=C1CN W5710 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.20 COC1=NC=CC=C1CO X7935 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.20 N#CC1=CC=CC=C1CN X9059 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.20 N#CC1=CC=CC=C1CO X8400 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.20 NCC1=C(CN)C=CC=C1 0839AB [0,0,0,0,0,0|4,0,0]=4 25 B9R1.15 C#CC1=C(C)C=CC=C1 1940AC [1,0,0,0,0,0|1,0,1]=3 26 B9R1.15 C#CC1=C(F)C=CC=C1 X7110 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.15 C=CC1=C(Cl)C=CC=C1 0459AB [1,0,0,0,0,0|2,0,1]=4 28 B9R1.15 C=CC1=CC=CC=C1F 7948AJ [1,0,0,0,0,0|2,0,1]=4 29 B9R1.15 C=CC1=CC=CC=C1N Y8954 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.15 CC1=C(C=O)C=CC=N1 W7274 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.15 CC1=C(C=O)C=CN=C1 Y9992 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.15 CC1=C(CBr)C=NC=C1 Z4138 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 CC1=C(CCl)N=CC=C1 6035AB [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 CC1=C(CN)N=CC=C1 7725AA [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 CC1=C(CO)C=NC=C1 6388AB [1,0,0,0,0,0|3,0,0]=4 36 B9R1.15 CC1=C(CO)N=CC=C1 9578AB [1,0,0,0,0,0|3,0,0]=4 37 B9R1.15 CC1=CC=CN=C1C=O W6954 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.15 CC1=CC=CN=C1CCl Z4758 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.15 CC1=CC=CN=C1CN Y7623 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.15 CC1=CC=CN=C1NN 6684AB [1,0,0,0,0,0|3,0,0]=4 41 B9R1.15 CC1=CC=NC=C1CN 4365AD [1,0,0,0,0,0|3,0,0]=4 42 B9R1.15 CC1=NC=CC=C1C#N 8848AA [1,0,0,0,0,0|3,0,0]=4 43 B9R1.15 CCC1=C(Br)C=CC=N1 5014AB [1,0,0,0,0,0|3,0,0]=4 44 B9R1.15 CCC1=CC=CC=C1Cl 2607AF [1,0,0,0,0,0|2,0,0]=3 45 B9R1.15 CCC1=CC=CN=C1Cl 6759AC [1,0,0,0,0,0|3,0,0]=4 46 B9R1.15 CCC1=CC=CN=C1N 5897AB [1,0,0,0,0,0|3,0,0]=4 47 B9R1.15 CNC1=C(Cl)C=CC=N1 4045AE [1,0,0,0,0,0|3,0,0]=4 48 B9R1.15 CNC1=CC=CC=C1Br V9809 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.15 CNC1=CC=CC=C1C Z6802 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.15 CNC1=CC=CC=C1Cl 7929AJ [1,0,0,0,0,0|2,0,0]=3 51 B9R1.15 CNC1=CC=CC=C1F Z7993 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.15 CNC1=CC=CN=C1Cl N415 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.15 COC1=C(Cl)C=NC=C1 4785AC [1,0,0,0,0,0|2,0,0]=3 54 B9R1.15 COC1=C(F)C=NC=C1 1352AA [1,0,0,0,0,0|2,0,0]=3 55 B9R1.15 COC1=C(N)C=CN=C1 Y9329 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.15 COC1=CC=CN=C1C 5357AH [1,0,0,0,0,0|1,0,0]=2 57 B9R1.15 COC1=CC=CN=C1F Z0246 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.15 COC1=CC=CNC1=O 0705AB [1,0,0,0,0,0|1,0,1]=3 59 B9R1.15 COC1=CC=CNC1=O 4471AF [1,0,0,0,0,0|1,0,1]=3 60 B9R1.15 COC1=NC=CC=C1F Z5254 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.15 COC1=NC=CC=C1O Z0120 [1,0,0,0,0,0|1,0,0]=2 62 B9R1.15 COC1=NC=CN=C1Br Z3980 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.15 COC1=NC=CN=C1I V6756 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 COC1=NC=CN=C1N W6434 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 CSC1=CC=CC=C1Cl L223 [1,0,0,0,0,0|1,1,0]=3 66 B9R1.15 CSC1=CC=CN=C1F Z0373 [1,0,0,0,0,0|2,1,0]=4 67 B9R1.15 CSC1=NC=CN=C1C Z2583 [1,0,0,0,0,0|2,1,0]=4 68 B9R1.15 N#CC1=NC=CC=C1O W9595 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 NCC1=C(I)C=CC=C1 5274AB [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 NNC1=C(Cl)C=CC=C1 2065AL [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 O=CC1=C(O)C=NC=C1 W3998 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 OCC1=C(S)C=CC=C1 3883AE [1,0,0,0,0,0|2,1,0]=4 73 B9R1.15 OCC1=NC=CC=C1O V3086 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.37 COC1=C(C#N)C=CC(Cl)=C1 0308AA [0,1,0,0,0,0|2,0,0]=3 75 B11R1.37 COC1=C(C=O)C=C(Br)C=N1 X1283 [0,1,0,0,0,0|3,0,0]=4 76 B11R1.37 COC1=C(CO)C=CC(Cl)=C1 5594AH [0,1,0,0,0,0|2,0,0]=3 77 B11R1.37 COC1=C(CO)C=CC(O)=C1 5621AH [0,1,0,0,0,0|2,0,0]=3 78 B11R1.37 COC1=C(OC)N=C(I)C=C1 0162AE [0,1,0,0,0,0|1,0,0]=2 79 B11R1.37 COC1=C(OC)N=C(N)C=C1 Z9380 [0,1,0,0,0,0|1,0,0]=2 80 B11R1.37 COC1=CC(Br)=CC=C1CO X8165 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.37 COC1=CC(Br)=CN=C1OC Z0659 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.37 COC1=CC(C)=CC=C1C#N W6756 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.37 COC1=CC(C)=CC=C1C=O Z0701 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.37 COC1=CC(F)=CC=C1CBr W9149 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.37 COC1=CC=C(Br)C=C1C#N V3346 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.37 COC1=CC=C(Br)C=C1CBr V3954 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.37 COC1=CC=C(Br)C=C1SC Z0766 [0,1,0,0,0,0|0,1,0]=2 88 B11R1.37 COC1=CC=C(C)C=C1C=O Z0802 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.37 COC1=CC=C(Cl)C=C1C=O W7988 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.37 COC1=CC=C(Cl)C=C1[N+]#N 7840AF [0,1,0,0,0,0|2,0,0]=3 91 B11R1.37 COC1=CC=C(F)C=C1CO X8293 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.37 COC1=CC=C(N)C=C1C#N 0917AB [0,1,0,0,0,0|2,0,0]=3 93 B11R1.37 COC1=CC=C(O)C=C1C=O 4417AB [0,1,0,0,0,0|2,0,0]=3 94 B11R1.37 COC1=NC(Cl)=CC=C1C=O 3504AJ [0,1,0,0,0,0|3,0,0]=4 95 B11R1.37 COC1=NC=C(Br)C=C1CO 1262AE [0,1,0,0,0,0|3,0,0]=4 96 B11R1.37 COC1=NC=C(Br)N=C1OC W9235 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.41 C=CCC1=CC=CC=C1OC 0626AQ [0,1,0,0,0,0|1,0,1]=3 98 B11R1.41 CCOC1=C(C=O)C=NC=C1 1963AD [0,1,0,0,0,0|3,0,0]=4 99 B11R1.41 CNCC1=C(OC)C=CC=C1 0580AC [0,1,0,0,0,0|1,0,0]=2 100 B11R1.41 COC1=C(CCBr)C=CC=C1 1683AE [0,1,0,0,0,0|1,0,0]=2 101 B11R1.41 COC1=CC=CC=C1CCO Z5088 [0,1,0,0,0,0|1,0,0]=2 102 B11R1.41 COC1=CC=CC=C1CNN 2282AC [0,1,0,0,0,0|2,0,0]=3 103 B11R1.53 CC(C)C1=CC=CC=C1NN V6795 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.53 CN(C)C1=C(CBr)C=CC=C1 2846AA [0,1,0,0,0,0|3,0,0]=4 105 B11R1.53 CN(C)C1=C(CN)C=CC=C1 8514AB [0,1,0,0,0,0|3,0,0]=4 106 B11R1.53 CN(C)C1=CC=CC=C1C#N V4282 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.53 CNC1=C(C(N)=O)C=CC=C1 1673AC [0,1,0,0,0,0|3,0,0]=4 108 B11R1.53 COC1=C(B(O)O)C=CN=C1 Y6779 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.53 COC1=C(B(O)O)C=NC=C1 X0739 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.53 COC1=C(B(O)O)C=NC=C1 Y3260 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.53 COC1=C(C(=O)O)C=CN=C1 W7675 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.53 COC1=C(C(C)O)C=CC=C1 6281AA [0,1,0,0,0,0|1,0,0]=2 113 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 V1937 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.53 COC1=CC=CN=C1C(=O)O W3589 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.53 COC1=CC=NC=C1C(=O)O Z6400 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.53 COC1=NC=CC=C1C(C)=O 5873AA [0,1,0,0,0,0|2,0,0]=3 117 B11R1.265 COC1=C(Br)C=CC=C1C#N 3849AC [0,1,0,0,0,0|2,0,0]=3 118 B11R1.265 COC1=C(C#N)C(Br)=CC=C1 X9592 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.265 COC1=C(C#N)C(Cl)=CC=C1 W7700 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.265 COC1=C(C#N)C(N)=CC=C1 Z4229 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.265 COC1=C(C=O)C(Br)=CC=C1 Z9336 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.265 COC1=C(C=O)C(Cl)=CC=C1 W5232 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.265 COC1=C(C=O)C=CC=C1C 0417AC [0,1,0,0,0,0|2,0,0]=3 124 B11R1.265 COC1=C(C=O)C=CC=C1O 5891AJ [0,1,0,0,0,0|2,0,0]=3 125 B11R1.265 COC1=C(CN)C(F)=CC=C1 W3290 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.265 COC1=C(OC)C(Br)=CC=C1 Z4856 [0,1,0,0,0,0|0,0,0]=1 127 B11R1.265 COC1=C(OC)C(Cl)=CC=C1 4809AL [0,1,0,0,0,0|0,0,0]=1 128 B11R1.265 COC1=C(OC)C(I)=CC=C1 2010AB [0,1,0,0,0,0|0,0,0]=1 129 B11R1.265 COC1=CC=CC(C)=C1C#N W6749 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.265 COC1=CC=CC(C)=C1C=O Z4871 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.265 COC1=CC=NC(N)=C1C#N V9918 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.265 COC1=NC=CC(Cl)=C1C=O Z6321 [0,1,0,0,0,0|3,0,0]=4 133 B11R2.1 CC1=CCC2=C1C=CC=C2 1962AC [0,0,0,1,0,0|2,0,1]=4 134 B11R2.1 CC1=COC2=CC=CC=C12 W4465 [0,0,0,1,0,0|1,0,1]=3 135 B11R2.1 CC1=CSC2=CC=CC=C12 I293 [0,0,0,1,0,0|1,1,1]=4 136 B11R2.1 CC1=NNC2=C1C=CC=C2 W5365 [0,0,0,1,0,0|3,0,0]=4 137 B11R2.1 CC1=NOC2=CC=CC=C21 Z4787 [0,0,0,1,0,0|2,0,0]=3 138 B11R2.1 CN1N=CC2=C1C=CC=C2 Z9755 [0,0,0,1,0,0|3,0,0]=4 139 B11R2.1 ClC1CCC2=C1C=CC=C2 X6210 [0,0,0,1,0,0|3,0,0]=4 140 B11R2.1 NN1CCC2=C1C=CC=C2 3264AF [0,0,0,1,0,0|3,0,0]=4 141 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 X8642 [0,0,0,1,0,0|3,0,0]=4 142 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 Z4595 [0,0,0,1,0,0|3,0,0]=4 143 B11R2.1 O=C1CSC2=CC=CC=C12 X9761 [0,0,0,1,0,0|2,1,0]=4 144 B11R2.1 OC1=NOC2=CC=CC=C21 W4501 [0,0,0,1,0,0|3,0,0]=4 145 B11R2.20 C1=CC2=C(C=C1)CCC=C2 5653AF [0,0,0,1,0,0|2,0,1]=4 146 B11R2.20 C1=CC2=C(C=C1)NCCN2 W5637 [0,0,0,1,0,0|2,0,0]=3 147 B11R2.20 C1=CC2=C(C=C1)OCCC2 V6174 [0,0,0,1,0,0|1,0,0]=2 148 B11R2.20 C1=CC2=C(C=N1)CCCN2 X9942 [0,0,0,1,0,0|3,0,0]=4 149 B11R2.20 C1=CC2=C(CCCN2)N=C1 6807AA [0,0,0,1,0,0|3,0,0]=4 150 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z4118 [0,0,0,1,0,0|3,0,0]=4 151 B11R2.20 C1=CC2=C(N=C1)NCCO2 0424AB [0,0,0,1,0,0|2,0,0]=3 152 B11R2.20 C1=CC2=C(N=C1)OCCN2 8778AC [0,0,0,1,0,0|2,0,0]=3 153 B11R2.20 C1=CC2=C(N=C1)OCCO2 P322 [0,0,0,1,0,0|1,0,0]=2 154 B11R2.20 C1=CC=C2SCCNC2=C1 X7913 [0,0,0,1,0,0|1,1,0]=3 155 B11R2.20 C1=CN=C2NCCNC2=C1 W5731 [0,0,0,1,0,0|3,0,0]=4 156 B9R1.14 COC1=C(C=O)SC=C1 4328AB [0,0,0,0,1,0|3,0,0]=4 157 B8R1.2 COC1=CC=NC=N1 Y3333 [2,0,0,0,0,0|2,0,0]=4 158 B8R1.2 COC1=CCC=CC1 Y5373 [2,0,0,0,0,0|0,0,2]=4 159 B8R1.2 COC1=CN=CN=C1 W5346 [2,0,0,0,0,0|2,0,0]=4 160 B8R1.2 CSC1=NC=CC=C1 L314 [2,0,0,0,0,0|1,1,0]=4 161 B8R1.2 Cl[Hg]C1=CC=CC=C1 7627AF [2,0,0,0,0,0|2,0,0]=4 162 B8R1.2 N#CC1=CC=CC=C1 E085 [2,0,0,0,0,0|2,0,0]=4 163 B8R1.5 CC1=C(Br)C=CN=C1 N224 [2,0,0,0,0,0|2,0,0]=4 164 B8R1.5 CC1=C(I)C=NC=C1 5015AB [2,0,0,0,0,0|2,0,0]=4 165 B8R1.5 CC1=CC=CC=[N+]1N 4748AL [2,0,0,0,0,0|2,0,0]=4 166 B8R1.5 CC1=CC=CN=C1F I218 [2,0,0,0,0,0|2,0,0]=4 167 B8R1.5 CC1=CC=CN=C1I L284 [2,0,0,0,0,0|2,0,0]=4 168 B8R1.5 CC1=CC=CN=C1O Z5345 [2,0,0,0,0,0|1,0,0]=3 169 B8R1.5 CC1=NC=CC=C1Cl W8084 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.5 CC1=NC=CC=C1F W3456 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.5 CC1=[N+](C)C=CC=C1 1196AF [2,0,0,0,0,0|1,0,0]=3 172 B8R1.5 FC1=CC=CC=C1Cl W5650 [2,0,0,0,0,0|2,0,0]=4 173 B8R1.5 NC1=C(O)C=CN=C1 2154AJ [2,0,0,0,0,0|2,0,0]=4 174 B8R1.5 NC1=CC=CC=C1Br 6262AC [2,0,0,0,0,0|2,0,0]=4 175 B8R1.5 NC1=CC=CC=C1O 7115AB [2,0,0,0,0,0|1,0,0]=3 176 B8R1.5 O=C1C=COC=C1O Z4796 [2,0,0,0,0,0|1,0,1]=4 177 B8R1.5 O=C1OC=CC=C1O W6519 [2,0,0,0,0,0|1,0,1]=4 178 B8R1.5 OC1=C(Br)C=CN=C1 W3500 [2,0,0,0,0,0|2,0,0]=4 179 B8R1.5 OC1=C(Cl)C=CN=C1 W9815 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.5 OC1=C(I)C=CN=C1 W4056 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.5 OC1=NC=CC=C1F N319 [2,0,0,0,0,0|2,0,0]=4 182 B10R1.2 CC1=C(Br)C=CC=C1C=O Z0868 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.2 CC1=C(C)C(CO)=CC=C1 Z4120 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.2 CC1=C(CO)C=CC=C1F 6828AB [1,1,0,0,0,0|2,0,0]=4 185 B10R1.2 CC1=C(Cl)C=CC=C1C#N 7875AB [1,1,0,0,0,0|2,0,0]=4 186 B10R1.2 CC1=C(Cl)C=CC=C1C=O Z0935 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.2 CC1=C(N)C=CC=C1CO 2883AC [1,1,0,0,0,0|2,0,0]=4 188 B10R1.2 CC1=C(O)C=CC=C1C=O W9287 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.2 CC1=C(O)C=CC=C1CO 7973AB [1,1,0,0,0,0|2,0,0]=4 190 B10R1.2 CC1=CC=CC(CCl)=C1C X2212 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.2 CC1=CC=CC(NN)=C1C 0446AF [1,1,0,0,0,0|2,0,0]=4 192 B10R1.2 CCC1=CC=CC(C)=C1O 5046AH [1,1,0,0,0,0|1,0,0]=3 193 B10R1.2 CNC1=CC=CC(Cl)=C1C V9739 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.2 COC1=C(Br)C(N)=CC=C1 Z3897 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.2 COC1=C(C)C(N)=CC=C1 V8128 [1,1,0,0,0,0|0,0,0]=2 196 B10R1.2 COC1=C(F)C(N)=CC=C1 W8530 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.2 COC1=C(F)C(O)=CC=C1 Z0600 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.2 COC1=C(I)C(Br)=CC=C1 6214AB [1,1,0,0,0,0|1,0,0]=3 199 B10R1.2 COC1=C(N)C(Br)=CC=C1 Y9431 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.2 COC1=C(N)C(Cl)=CC=C1 Z4228 [1,1,0,0,0,0|1,0,0]=3 201 B10R1.2 COC1=C(N)C(Cl)=NC=C1 Y5389 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.2 COC1=C(N)C(N)=CC=C1 2323AJ [1,1,0,0,0,0|1,0,0]=3 203 B10R1.2 COC1=CC=CC(C)=C1Br V5612 [1,1,0,0,0,0|1,0,0]=3 204 B10R1.2 COC1=CC=CC(O)=C1Br 6415AA [1,1,0,0,0,0|1,0,0]=3 205 B10R1.2 COC1=CC=CC(O)=C1O 5842AC [1,1,0,0,0,0|0,0,0]=2 206 B10R1.2 COC1=NC=CC(C)=C1Br V7465 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.2 COC1=NC=CC(C)=C1N W8307 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.2 COC1=NC=CC(N)=C1Br 0947AB [1,1,0,0,0,0|2,0,0]=4 209 B10R1.2 N#CC1=C(O)C(F)=CC=C1 9080AD [1,1,0,0,0,0|2,0,0]=4 210 B10R1.2 N#CC1=CC=CC(Br)=C1O Z9514 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.2 N#CC1=CC=CC(O)=C1O W7831 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.4 BrCCC1=CC=CC=C1Br Z7172 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.4 C=CCC1=C(C)C=CC=C1 7968AA [1,1,0,0,0,0|1,0,1]=4 214 B10R1.4 CC1=C(NC=O)C=CC=C1 5730AL [1,1,0,0,0,0|1,0,1]=4 215 B10R1.4 CC1=CC=CC=C1CCN S579 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.4 CCCC1=CC=NC=C1C 1078AE [1,1,0,0,0,0|2,0,0]=4 217 B10R1.4 CCNC1=CC=CC=C1F 8903AD [1,1,0,0,0,0|2,0,0]=4 218 B10R1.4 CCOC1=C(Br)C=CC=N1 8550AB [1,1,0,0,0,0|2,0,0]=4 219 B10R1.4 CCOC1=C(Cl)C=CC=C1 9221AB [1,1,0,0,0,0|1,0,0]=3 220 B10R1.4 CCOC1=C(I)C=CC=N1 9446AE [1,1,0,0,0,0|2,0,0]=4 221 B10R1.4 CCOC1=C(N)C=CN=C1 Z5305 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.4 CCOC1=C(N)C=NC=C1 W3561 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.4 CCOC1=C(N)N=CC=C1 7078AC [1,1,0,0,0,0|2,0,0]=4 224 B10R1.4 CCOC1=CC=CC=C1F Z0605 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.4 CCOC1=CC=CC=C1N 8719AL [1,1,0,0,0,0|1,0,0]=3 226 B10R1.4 CNCC1=C(C)N=CC=C1 5583AJ [1,1,0,0,0,0|2,0,0]=4 227 B10R1.4 CNCC1=C(O)C=CC=C1 5657AL [1,1,0,0,0,0|1,0,0]=3 228 B10R1.4 CNCC1=CC=CC=C1F W6033 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.4 COCC1=C(O)C=CC=C1 5292AJ [1,1,0,0,0,0|0,0,0]=2 230 B10R1.4 COCC1=CC=CC=C1Br Z0660 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.4 ClC1=C(CCBr)C=CC=C1 8570AA [1,1,0,0,0,0|2,0,0]=4 232 B10R1.4 FC1=CC=CC=C1CCBr W9375 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.4 NCCC1=CC=CC=C1Br Z8825 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.4 NCCC1=CC=CC=C1N X9142 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.25 CC1=C(CBr)C=CC(F)=C1 3485AC [1,1,0,0,0,0|2,0,0]=4 236 B10R1.25 CC1=C([N+]#N)C=CC(Cl)=C1 5132AF [1,1,0,0,0,0|2,0,0]=4 237 B10R1.25 CC1=CC(C)=C(C#N)C=C1 7417AD [1,1,0,0,0,0|2,0,0]=4 238 B10R1.25 CC1=CC(C)=C(NN)C=C1 9955AL [1,1,0,0,0,0|2,0,0]=4 239 B10R1.25 CC1=CC(Cl)=CC=C1CO Z0039 [1,1,0,0,0,0|2,0,0]=4 240 B10R1.25 CC1=CC(O)=CC=C1C=O W6182 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.25 CC1=CC=C(C#N)C(O)=C1 W3997 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.25 CC1=CC=C(C=O)C(O)=C1 X2734 [1,1,0,0,0,0|2,0,0]=4 243 B10R1.25 CCC1=C(F)C=C(Br)C=C1 9478AB [1,1,0,0,0,0|2,0,0]=4 244 B10R1.25 CNC1=C(F)C=C(F)C=C1 1904AL [1,1,0,0,0,0|2,0,0]=4 245 B10R1.25 CNC1=C(N)C=C(Br)C=C1 2680AJ [1,1,0,0,0,0|2,0,0]=4 246 B10R1.25 CNC1=CC=C(Cl)C=C1Cl V5409 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.25 CNC1=CC=C(F)C=C1Br Y6882 [1,1,0,0,0,0|2,0,0]=4 248 B10R1.25 COC1=C(Br)C=C(F)C=C1 H620 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.25 COC1=C(C)C=C(F)C=N1 4130AC [1,1,0,0,0,0|1,0,0]=3 250 B10R1.25 COC1=C(C)C=C(N)C=N1 3583AJ [1,1,0,0,0,0|1,0,0]=3 251 B10R1.25 COC1=C(Cl)C=C(N)C=N1 Z4224 [1,1,0,0,0,0|2,0,0]=4 252 B10R1.25 COC1=C(I)C=C(Br)C=N1 8536AB [1,1,0,0,0,0|2,0,0]=4 253 B10R1.25 COC1=C(I)C=C(C)C=C1 X4546 [1,1,0,0,0,0|1,0,0]=3 254 B10R1.25 COC1=C(O)C=C(O)C=C1 9124AB [1,1,0,0,0,0|0,0,0]=2 255 B10R1.25 COC1=CC=C(Br)C=C1Cl Z0644 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.25 COC1=CC=C(Br)C=C1I Z5421 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.25 COC1=CC=C(Br)N=C1N 5448AC [1,1,0,0,0,0|2,0,0]=4 258 B10R1.25 COC1=CC=C(C)N=C1Br Y8405 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.25 COC1=CC=C(C)N=C1N X3671 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.25 COC1=CC=C(Cl)C=C1I N695 [1,1,0,0,0,0|1,0,0]=3 261 B10R1.25 COC1=CC=C(Cl)C=C1O 4776AB [1,1,0,0,0,0|0,0,0]=2 262 B10R1.25 COC1=CC=C(F)C=C1Cl X4244 [1,1,0,0,0,0|1,0,0]=3 263 B10R1.25 COC1=CC=C(F)C=C1N V5190 [1,1,0,0,0,0|1,0,0]=3 264 B10R1.25 COC1=CC=C(I)C=C1C X8379 [1,1,0,0,0,0|0,0,0]=2 265 B10R1.25 COC1=CC=C(I)C=C1N X5382 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.25 COC1=CC=C(N)C=C1C Y6043 [1,1,0,0,0,0|0,0,0]=2 267 B10R1.25 COC1=CC=C(N)C=C1Cl 5846AJ [1,1,0,0,0,0|1,0,0]=3 268 B10R1.25 COC1=CC=C(N)C=C1N 5296AL [1,1,0,0,0,0|1,0,0]=3 269 B10R1.25 COC1=CC=C(N)C=C1N N030 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.25 COC1=CC=C(N)N=C1Cl 4511AC [1,1,0,0,0,0|2,0,0]=4 271 B10R1.25 COC1=CC=C(O)C=C1C Z0198 [1,1,0,0,0,0|0,0,0]=2 272 B10R1.25 COC1=CC=C(S)C=C1F 5336AH [1,1,0,0,0,0|1,0,0]=3 273 B10R1.25 COC1=CN=C(Cl)C=C1Br Z6486 [1,1,0,0,0,0|2,0,0]=4 274 B10R1.25 COC1=NC=C(Br)C=C1Br X9884 [1,1,0,0,0,0|2,0,0]=4 275 B10R1.25 COC1=NC=C(C)C=C1Br W9936 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.25 COC1=NC=C(Cl)C=C1Cl 6237AA [1,1,0,0,0,0|2,0,0]=4 277 B10R1.25 COC1=NC=C(Cl)C=C1N V8674 [1,1,0,0,0,0|2,0,0]=4 278 B10R1.25 COC1=NN=C(Cl)C=C1C X3927 [1,1,0,0,0,0|2,0,0]=4 279 B10R1.25 CSC1=CC=C(Br)C=C1Cl Y3518 [1,1,0,0,0,0|1,1,0]=4 280 B10R1.25 CSC1=CC=C(Br)C=C1F Z0393 [1,1,0,0,0,0|1,1,0]=4 281 B10R1.25 CSC1=CC=C(F)C=C1Br Z1091 [1,1,0,0,0,0|1,1,0]=4 282 B10R1.25 CSC1=CC=C(F)C=C1C Z0086 [1,1,0,0,0,0|0,1,0]=3 283 B10R1.25 CSC1=CC=C(F)C=C1F Z0047 [1,1,0,0,0,0|1,1,0]=4 284 B10R1.25 N#CC1=CC=C(Br)C=C1O X3074 [1,1,0,0,0,0|2,0,0]=4 285 B10R1.25 N#CC1=CC=C(Cl)C=C1O W5307 [1,1,0,0,0,0|2,0,0]=4 286 B10R1.25 N#CC1=CC=C(O)C=C1O W7608 [1,1,0,0,0,0|2,0,0]=4 287 B10R1.25 NCC1=C(C)C=C(Br)C=C1 9535AF [1,1,0,0,0,0|2,0,0]=4 288 B10R1.25 OCC1=C(O)C=C(Br)C=C1 8742AA [1,1,0,0,0,0|2,0,0]=4 289 B10R1.30 CC1=C(CO)C=C(Cl)C=C1 8836AH [1,1,0,0,0,0|2,0,0]=4 290 B10R1.30 CC1=CC(CO)=C(O)C=C1 9929AL [1,1,0,0,0,0|2,0,0]=4 291 B10R1.30 CC1=CC=C(F)C=C1NN X8242 [1,1,0,0,0,0|2,0,0]=4 292 B10R1.30 CC1=CC=C(N)C=C1C#N W6592 [1,1,0,0,0,0|2,0,0]=4 293 B10R1.30 CCC1=C(O)C=CC(C)=N1 R736 [1,1,0,0,0,0|2,0,0]=4 294 B10R1.30 CCC1=CC(Br)=CC=C1I Z0273 [1,1,0,0,0,0|2,0,0]=4 295 B10R1.30 CCC1=CC(Br)=CC=C1N X4941 [1,1,0,0,0,0|2,0,0]=4 296 B10R1.30 CCC1=CC(F)=CC=C1O 5252AB [1,1,0,0,0,0|1,0,0]=3 297 B10R1.30 CNC1=CC(Br)=CC=C1F Z7702 [1,1,0,0,0,0|2,0,0]=4 298 B10R1.30 COC1=C(C)C=CC(C)=C1 8752AA [1,1,0,0,0,0|0,0,0]=2 299 B10R1.30 COC1=C(C)C=CC(I)=C1 5867AH [1,1,0,0,0,0|0,0,0]=2 300 B10R1.30 COC1=C(F)C=CC(C)=C1 9757AB [1,1,0,0,0,0|1,0,0]=3 301 B10R1.30 COC1=C(F)C=CC(I)=C1 2100AC [1,1,0,0,0,0|1,0,0]=3 302 B10R1.30 COC1=C(N)C=CC(O)=C1 6080AJ [1,1,0,0,0,0|1,0,0]=3 303 B10R1.30 COC1=C(O)C=CC(I)=C1 2745AL [1,1,0,0,0,0|0,0,0]=2 304 B10R1.30 COC1=CC(Br)=CN=C1Cl X3331 [1,1,0,0,0,0|2,0,0]=4 305 B10R1.30 COC1=CC(Br)=CN=C1F Z0976 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.30 COC1=CC(Br)=NC=C1Br Y3818 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.30 COC1=CC(C)=CC=C1Br X8417 [1,1,0,0,0,0|1,0,0]=3 308 B10R1.30 COC1=CC(C)=CC=C1Cl Y6374 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.30 COC1=CC(C)=CC=C1N V7435 [1,1,0,0,0,0|1,0,0]=3 310 B10R1.30 COC1=CC(Cl)=CC=C1F Y5128 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.30 COC1=CC(Cl)=CC=C1I W8277 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.30 COC1=CC(Cl)=NC=C1Br 4039AC [1,1,0,0,0,0|2,0,0]=4 313 B10R1.30 COC1=CC(Cl)=NC=C1Cl Y3687 [1,1,0,0,0,0|2,0,0]=4 314 B10R1.30 COC1=CC(F)=CC=C1N V3864 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.30 COC1=CC(F)=CC=C1O L719 [1,1,0,0,0,0|0,0,0]=2 316 B10R1.30 COC1=CC(I)=CC=C1Cl X8154 [1,1,0,0,0,0|1,0,0]=3 317 B10R1.30 COC1=CC(N)=CC=C1C W3586 [1,1,0,0,0,0|0,0,0]=2 318 B10R1.30 COC1=CC(O)=CC=C1Cl X4399 [1,1,0,0,0,0|1,0,0]=3 319 B10R1.30 COC1=CC(O)=CC=C1N 9246AB [1,1,0,0,0,0|1,0,0]=3 320 B10R1.30 COC1=NC(Br)=CC=C1N B686 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.30 COC1=NC(C)=CC=C1Br V7464 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.30 COC1=NC(Cl)=CC=C1Br Z8278 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.30 COC1=NC(Cl)=CC=C1N 5317AC [1,1,0,0,0,0|2,0,0]=4 324 B10R1.30 COC1=NC(Cl)=NC=C1C Z2535 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.30 CSC1=CC(F)=CC=C1Br V3387 [1,1,0,0,0,0|1,1,0]=4 326 B10R1.30 N#CC1=CC(F)=CC=C1O 5308AC [1,1,0,0,0,0|2,0,0]=4 327 B10R1.30 N#CC1=CC(N)=CC=C1O Z5226 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.30 O=CC1=CC(I)=CC=C1O Y8008 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.30 OCC1=CC(Cl)=CC=C1O 5066AE [1,1,0,0,0,0|2,0,0]=4 330 B10R1.61 CC(=O)C1=CC=CN=C1C Y7806 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.61 CC(Cl)C1=CC=CC=C1Cl 0284AB [1,1,0,0,0,0|2,0,0]=4 332 B10R1.61 CC(N)C1=C(O)C=CC=C1 5161AJ [1,1,0,0,0,0|1,0,0]=3 333 B10R1.61 CC(N)C1=CC=CC=C1Cl V8121 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.61 CC(N)C1=CC=CC=C1Cl X6241 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.61 CC(N)C1=CC=CC=C1F V7591 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.61 CC(O)C1=C(Br)C=CC=C1 4894AJ [1,1,0,0,0,0|2,0,0]=4 337 B10R1.61 CC(O)C1=CC=CC=C1F X8296 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.61 CC(O)C1=CC=CC=C1N Z6783 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.61 CC1=CC=CC=C1C(=N)N 1807AJ [1,1,0,0,0,0|2,0,0]=4 340 B10R1.61 CC1=CC=CC=C1C(=N)N 5089AH [1,1,0,0,0,0|2,0,0]=4 341 B10R1.61 CN(C)C1=C(F)C=CC=C1 9536AF [1,1,0,0,0,0|2,0,0]=4 342 B10R1.61 CN(C)C1=CC=CC=C1O Z4668 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 1179AL [1,1,0,0,0,0|2,0,0]=4 344 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl X9707 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.61 C[C@@H](N)C1=CC=CC=C1O X9575 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 8241AA [1,1,0,0,0,0|2,0,0]=4 347 B10R1.61 NC(=S)C1=C(O)C=CC=C1 5069AH [1,1,0,0,0,0|2,0,0]=4 348 B10R1.61 O=C(O)C1=C(O)C=CC=C1 7849AF [1,1,0,0,0,0|2,0,0]=4 349 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 7836AF [1,1,0,0,0,0|2,0,0]=4 350 B10R1.245 CC1=C(C#N)C(Br)=CC=C1 W8414 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.245 CC1=C(C#N)C(N)=CC=C1 4987AH [1,1,0,0,0,0|2,0,0]=4 352 B10R1.245 CC1=C(C#N)C(O)=CC=C1 W8150 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.245 CC1=C(C=O)C(Cl)=CC=C1 Z8092 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.245 CC1=C(C=O)C(F)=CC=C1 X9218 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.245 CC1=CC=CC(C)=C1NN S754 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.245 CC1=CC=CC(O)=C1C=O 9617AA [1,1,0,0,0,0|2,0,0]=4 357 B10R1.245 COC1=C(Br)C=CC=C1N X9170 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.245 COC1=C(Br)C=NC=C1Br Z4505 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.245 COC1=C(C)C=CC=C1N V3908 [1,1,0,0,0,0|0,0,0]=2 360 B10R1.245 COC1=C(C)NC=CC1=O Y4017 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.245 COC1=C(C)OC=CC1=O 6531AB [1,1,0,0,0,0|1,0,0]=3 362 B10R1.245 COC1=C(Cl)C=CC=C1Br V3806 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.245 COC1=C(F)C=CC=C1Br X4239 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.245 COC1=C(I)C=CC=C1F X4251 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.245 COC1=C(O)N=CN=C1O D275 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.245 CSC1=C(F)C=CC=C1Br Z1320 [1,1,0,0,0,0|1,1,0]=4 367 B10R1.245 N#CC1=C(O)C=CC=C1Br V7532 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.245 N#CC1=C(O)C=CC=C1Cl W9279 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.245 N#CC1=C(O)C=CC=C1F X4274 [1,1,0,0,0,0|2,0,0]=4 370 B12R1.46 CCC1=C(C(C)C)C=C(N)C=C1 6398AD [0,2,0,0,0,0|2,0,0]=4 371 B12R1.46 COC1=C(C(C)=O)C=C(Br)C=C1 8537AA [0,2,0,0,0,0|1,0,0]=3 372 B12R1.46 COC1=CC=C(C)C=C1C(=O)O X2814 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.46 COC1=CC=C(Cl)C=C1[N+](=O)[O-] U049 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.46 COC1=CC=C(F)C=C1C(C)=O X8297 [0,2,0,0,0,0|1,0,0]=3 375 B12R1.46 COC1=CC=C(I)C=C1[N+](=O)[O-] X5312 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.46 COC1=CC=C(N)C=C1[N+](=O)[O-] W7110 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.57 COC1=C(B(O)O)C=CC(Cl)=C1 X1377 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.57 COC1=CC(Br)=CC=C1B(O)O Z1028 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.57 COC1=CC(Br)=CC=C1C(=O)O X2798 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.57 COC1=CC(O)=CC=C1[N+](=O)[O-] W3553 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.78 C#CC1=CC=C(OC)C(OC)=C1 W6255 [0,2,0,0,0,0|0,0,0]=2 382 B12R1.78 COC1=CC=C(C=O)C=C1CCl 4951AE [0,2,0,0,0,0|2,0,0]=4 383 B12R1.78 COC1=CC=C(OC)C(C#N)=C1 X2772 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.234 COC1=C(C=O)C(F)=CC(Br)=C1 Z0902 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.268 CCOC1=C(C#N)C=CC(Br)=C1 6111AJ [0,2,0,0,0,0|2,0,0]=4 386 B12R1.268 CCOC1=CC(Br)=CC=C1OC X6364 [0,2,0,0,0,0|0,0,0]=2 387 B12R1.268 CCOC1=CC(Cl)=CN=C1OC Z8600 [0,2,0,0,0,0|1,0,0]=3 388 B12R1.268 COC1=C(CC#N)C=C(Br)C=C1 8479AE [0,2,0,0,0,0|1,0,1]=4 389 B12R1.268 COC1=C(N=C=S)C=C(Cl)C=C1 7142AE [0,2,0,0,0,0|1,0,1]=4 390 B12R1.448 COC1=C(OC)C=C(Br)C(O)=C1 Z9458 [0,2,0,0,0,0|0,0,0]=2 391 B12R1.448 COC1=C(OC)C=C(F)C(F)=C1 4450AL [0,2,0,0,0,0|0,0,0]=2 392 B12R1.448 COC1=C(OC)C=C(N)C(C)=C1 5763AB [0,2,0,0,0,0|0,0,0]=2 393 B12R1.448 COC1=CC(F)=C(F)C=C1C=O Z0193 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.652 COC1=C(C#N)C(F)=C(F)C=C1 W4570 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.75 CCC1=C(NC(C)=O)C=CC=C1 3627AL [0,2,0,0,0,0|2,0,0]=4 396 B12R1.75 CCC1=C(OC(C)=O)C=CC=C1 6982AL [0,2,0,0,0,0|1,0,0]=3 397 B12R1.75 COC1=C(NC(=N)N)C=CC=C1 7462AH [0,2,0,0,0,0|1,0,1]=4 398 B12R1.75 COC1=CC=CC=C1CC(C)O Y7646 [0,2,0,0,0,0|1,0,0]=3 399 B12R1.75 COC1=CC=CC=C1OC(=O)O D884 [0,2,0,0,0,0|0,0,1]=3 400 B12R1.75 N#CC1=CC=CC=C1OC(F)F 1804AL [0,2,0,0,0,0|2,0,0]=4 401 B12R1.77 COC(=O)C1=C(OC)C=CN=C1 Y6805 [0,2,0,0,0,0|1,0,0]=3 402 B12R1.77 COC(=O)C1=CC=CC=C1C#N X2843 [0,2,0,0,0,0|2,0,0]=4 403 B12R1.77 COC(=O)C1=CC=CC=C1CCl S867 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.77 COC(=O)C1=CC=CC=C1CN 0552AF [0,2,0,0,0,0|2,0,0]=4 405 B12R1.77 COC(=O)C1=NC=CC=C1OC W4763 [0,2,0,0,0,0|1,0,0]=3 406 B12R1.121 CCCOC1=C(C#N)C=CC=C1 7590AE [0,2,0,0,0,0|2,0,0]=4 407 B12R1.121 O=CC1=C(OCCBr)C=CC=C1 6563AE [0,2,0,0,0,0|2,0,0]=4 408 B12R1.121 O=CC1=C(OCCO)C=CC=C1 4985AL [0,2,0,0,0,0|2,0,0]=4 409 B12R1.169 CCOC1=CC=CC=C1CC#N 1530AC [0,2,0,0,0,0|1,0,1]=4 410 B12R1.283 CCOC1=CC=CC=C1C(C)=O Z2554 [0,2,0,0,0,0|1,0,0]=3 411 B12R1.283 COCC1=C(C(=O)O)C=CC=C1 4285AC [0,2,0,0,0,0|2,0,0]=4 412 B12R1.1112 COC1=C(CC#N)C(F)=CC=C1 6831AB [0,2,0,0,0,0|1,0,1]=4 413 B12R1.76 COC1=CC=CC=C1C(F)(F)F V3625 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.87 COC1=C(B(O)O)C=CC=C1Cl X0581 [0,2,0,0,0,0|2,0,0]=4 415 B12R1.87 COC1=C(Br)C=CC=C1B(O)O Z4639 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.87 COC1=C(C(=O)O)C=CC=C1C 2375AB [0,2,0,0,0,0|2,0,0]=4 417 B12R1.87 COC1=C(C(C)=O)C=CC=C1Br 2423AB [0,2,0,0,0,0|1,0,0]=3 418 B12R1.87 COC1=C(C(C)=O)C=CC=C1F 3023AB [0,2,0,0,0,0|1,0,0]=3 419 B12R1.87 COC1=C(Cl)C=CC=C1C(=O)O X8060 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.87 COC1=C(N)C=CC=C1C(=O)O X8031 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.87 COC1=C([N+](=O)[O-])C=CC=C1Br W9854 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.87 COC1=C([N+](=O)[O-])C=CC=C1C V3907 [0,2,0,0,0,0|2,0,0]=4 423 B12R1.87 COC1=C([N+](=O)[O-])C=CC=C1F V6148 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.437 COC1=C(B(O)O)C(Cl)=CC=C1 V1848 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.437 COC1=C(C(=O)O)C(Cl)=CC=C1 W5442 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.437 COC1=C(C(C)=O)C(Br)=CC=C1 X3640 [0,2,0,0,0,0|1,0,0]=3 427 B12R1.437 COC1=C(C(C)=O)C(Cl)=CC=C1 Z5248 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.437 COC1=C(C(C)=O)C(F)=CC=C1 Z8240 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.437 COC1=C([N+](=O)[O-])C(O)=CC=C1 V5069 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.437 COC1=CC=CC(C)=C1[N+](=O)[O-] P806 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.437 COC1=CC=CC(Cl)=C1[N+](=O)[O-] 7952AB [0,2,0,0,0,0|2,0,0]=4 432 B12R1.437 COC1=CC=CC(F)=C1[N+](=O)[O-] W7593 [0,2,0,0,0,0|2,0,0]=4 433 B12R1.741 COC1=C(F)C=CC(F)=C1C=O W9168 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.1879 CNC1=CC=CC(OC)=C1C#N 3182AH [0,2,0,0,0,0|2,0,0]=4 435 B12R1.1879 COC1=CC=CC(OC)=C1CO 5351AD [0,2,0,0,0,0|2,0,0]=4 436 B10R1.172 C=CC1=CC(OC)=CC=C1 9451AB [0,0,1,1,0,0|1,0,1]=4 437 B10R1.176 COC1=CC=C(F)C(C)=C1 1547AB [0,0,1,1,0,0|2,0,0]=4 438 B10R1.176 COC1=CC=C(O)C(C)=C1 Y5462 [0,0,1,1,0,0|2,0,0]=4 439 B10R2.7 C1=CC2=C(C=C1)COC2 6725AB [1,0,0,1,0,0|2,0,0]=4 440 B10R2.7 C1=CC2=C(N=C1)NCC2 X8780 [1,0,0,1,0,0|2,0,0]=4 441 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 X9385 [0,1,0,1,0,0|2,0,0]=4 442 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 W4577 [0,1,0,1,0,0|2,0,0]=4 443 B12R2.24 BrC1=CC2=C(N=C1)OCCN2 3669AJ [0,1,0,1,0,0|2,0,0]=4 444 B12R2.24 BrC1=CC=C2NCCOC2=C1 X9901 [0,1,0,1,0,0|1,0,0]=3 445 B12R2.24 BrC1=CC=C2OCCNC2=C1 X8770 [0,1,0,1,0,0|1,0,0]=3 446 B12R2.24 CC1=CC=C2NCCOC2=C1 V7446 [0,1,0,1,0,0|1,0,0]=3 447 B12R2.24 CC1CNC2=C(C=CC=C2)S1 6248AE [0,1,0,1,0,0|1,1,0]=4 448 B12R2.24 CC1CNC2=CC=CC=C2N1 1064AQ [0,1,0,1,0,0|2,0,0]=4 449 B12R2.24 ClC1=CC=C2CCCNC2=C1 5077AC [0,1,0,1,0,0|2,0,0]=4 450 B12R2.24 ClC1=CC=C2NCCOC2=C1 X9067 [0,1,0,1,0,0|1,0,0]=3 451 B12R2.24 FC1=CC2=C(C=C1)NCCO2 5699AE [0,1,0,1,0,0|1,0,0]=3 452 B12R2.24 NC1=CC=C2CCCCC2=C1 X6988 [0,1,0,1,0,0|2,0,0]=4 453 B12R2.24 NC1COC2=C(C=CC=C2)C1 9680AA [0,1,0,1,0,0|1,0,0]=3 454 B12R2.24 OC1=CC=C2OCCOC2=C1 X8632 [0,1,0,1,0,0|0,0,0]=2 455 B12R2.24 OC1CNC2=CC=CC=C2C1 3033AH [0,1,0,1,0,0|2,0,0]=4 456 B12R2.132 O=C1COC2=C1C=C(F)C=C2 9089AB [0,1,0,1,0,0|2,0,0]=4 457 B12R2.132 O=C1COC2=CC=C(Br)C=C12 W6870 [0,1,0,1,0,0|2,0,0]=4 458 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 0136AC [0,1,0,1,0,0|2,0,0]=4 459 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 W7711 [0,1,0,1,0,0|2,0,0]=4 460 B12R2.612 O=C1COC2=CC(Br)=CC=C12 Z4382 [0,1,0,1,0,0|2,0,0]=4 461 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 W5440 [0,1,0,1,0,0|2,0,0]=4 462 B12R2.1 COC1OCC2=CC=CC=C21 4557AL [0,1,0,1,0,0|2,0,0]=4 463 B12R2.18 CC1=NC2=CC=CC=C2N1C V4924 [0,1,0,1,0,0|2,0,0]=4 464 B12R2.18 CC1NC2=C(C=CC=C2)C1C 1212AB [0,1,0,1,0,0|2,0,0]=4 465 B12R2.315 COC1=C2NCCC2=CC=C1 3723AJ [0,1,0,1,0,0|1,0,0]=3 466 B12R2.315 COC1=CC=CC2=C1CCN2 5089AC [0,1,0,1,0,0|1,0,0]=3 467 B12R2.315 COC1=CC=CC2=C1CCN2 Y4009 [0,1,0,1,0,0|1,0,0]=3 468 B12R2.315 COC1=CC=CC2=C1CNC2 Z3970 [0,1,0,1,0,0|1,0,0]=3 469 B12R2.315 COC1=CC=CC2=C1NN=C2 Y7436 [0,1,0,1,0,0|1,0,1]=4 470 B12R2.315 O=CC1=C2OCCC2=CC=C1 W4173 [0,1,0,1,0,0|2,0,0]=4 471 B12R2.315 OCC1=C2OCOC2=CC=C1 Y4050 [0,1,0,1,0,0|2,0,0]=4 472 B12R2.1081 BrC1=C2OCCNC2=CC=C1 V6957 [0,1,0,1,0,0|1,0,0]=3 473 B12R2.1081 BrC1=C2OCCOC2=CC=C1 V6764 [0,1,0,1,0,0|0,0,0]=2 474 B12R2.1081 BrC1=CC=CC2=C1CCCN2 2430AA [0,1,0,1,0,0|2,0,0]=4 475 B12R2.1081 BrC1=CC=CC2=C1CCCN2 X8838 [0,1,0,1,0,0|2,0,0]=4 476 B12R2.1081 CC1=NCCC2=C1C=CC=C2 Z2315 [0,1,0,1,0,0|2,0,0]=4 477 B12R2.1081 CC1CCNC2=C1C=CC=C2 0022AB [0,1,0,1,0,0|2,0,0]=4 478 B12R2.1081 CC1CCNC2=C1C=CC=C2 Z5091 [0,1,0,1,0,0|2,0,0]=4 479 B12R2.1081 CC1NCCC2=C1C=CC=C2 X8977 [0,1,0,1,0,0|2,0,0]=4 480 B12R2.1081 CN1CCCC2=C1C=CC=C2 6666AB [0,1,0,1,0,0|2,0,0]=4 481 B12R2.1081 CN1CCNC2=C1C=CC=C2 X9648 [0,1,0,1,0,0|2,0,0]=4 482 B12R2.1081 FC1=CC=CC2=C1OCCN2 4915AC [0,1,0,1,0,0|1,0,0]=3 483 B12R2.1081 NC1CCOC2=C1C=CC=C2 W6827 [0,1,0,1,0,0|1,0,0]=3 484 B12R2.1081 NC1CCOC2=CC=CC=C21 5088AC [0,1,0,1,0,0|1,0,0]=3 485 B12R2.1081 NN1CCCC2=C1C=CC=C2 6035AE [0,1,0,1,0,0|2,0,0]=4 486 B12R2.1081 N[C@@H]1CCOC2=CC=CC=C21 0758AB [0,1,0,1,0,0|1,0,0]=3 487 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 B573 [0,1,0,1,0,0|2,0,0]=4 488 B12R2.1081 O=C1CCNC2=C1C=CC=C2 W8031 [0,1,0,1,0,0|2,0,0]=4 489 B12R2.1081 O=C1COCC2=C1C=CC=C2 W4380 [0,1,0,1,0,0|2,0,0]=4 490 B12R2.1081 OC1=C2OCCOC2=CC=C1 X8630 [0,1,0,1,0,0|0,0,0]=2 491 B12R2.1081 OC1=CC=CC2=C1NCCC2 W7741 [0,1,0,1,0,0|2,0,0]=4 492 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 V1329 [0,1,0,1,0,0|2,0,0]=4 493 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 9076AB [0,1,0,1,0,0|2,0,0]=4 494 B12R2.2403 CC1(C)CNC2=C1C=CC=C2 2275AL [0,1,0,1,0,0|2,0,0]=4 495 B12R2.196 O=C1COC2=C(Br)C=CC=C12 W6674 [0,1,0,1,0,0|2,0,0]=4 496 B8R1.11 COC1=CC=NN1C 6266AA [1,0,0,0,1,0|2,0,0]=4