0 B10R1.3 C#CC1=CC=C(CN)C=C1 BB31-3872 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.3 C#CC1=CN=C(OC)C=C1 BB32-3693 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.3 CCC1=NC=C(C=O)C=N1 BB52-2735 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.3 CSC1=NC=C(C=O)C=N1 BB52-2222 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.3 N#CC1=CN=C(C=O)C=C1 BB31-3850 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.3 N#CC1=CN=C(CBr)C=C1 BB31-3049 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.3 N#CC1=CN=C(CO)C=C1 BB31-4922 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.3 N#CC1=NC=C(CO)C=C1 BB32-3114 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.3 O=CC1=NC=C(CO)C=C1 BB32-2057 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.3 OCC1=CN=C(CO)C=C1 BB32-1481 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.1 C#CC1=CC=C(O)C=C1 BB32-1037 [1,0,0,0,0,0|0,0,3]=4 11 B9R1.1 C#CC1=CN=C(C)C=C1 BB32-0688 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.1 C#CC1=CNC(=O)C=C1 BB31-1363 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.1 C#CC1=NC=C(C)C=C1 BB31-4596 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.1 C=CC1=CC=C(I)C=C1 BB31-4240 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.1 C=CC1=CN=C(F)C=C1 BB31-0349 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.1 C=CC1=NC=C(C)C=C1 BB32-1317 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.1 CC1=NC=C(C=O)C=N1 BB52-2214 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.1 CCC1=CN=C(N)C=C1 BB31-3880 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.1 CCC1=NC=C(N)C=N1 BB31-0646 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 CCC1=NN=C(O)C=C1 BB32-2906 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.1 CNC1=CN=C(C)C=C1 BB31-9222 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.1 CNC1=CN=C(Cl)C=C1 BB31-8904 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.1 CNC1=NC=C(I)C=C1 BB32-1223 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 CNC1=NC=C(N)C=C1 BB31-8913 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 CSC1=CN=C(Br)C=C1 BB31-9698 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 CSC1=NC=C(N)C=C1 BB32-1744 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.1 ClCC1=CN=C(Br)C=C1 BB31-3358 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.1 NC1=CN=C(CO)C=C1 BB31-5981 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.1 NC1=NC=C(C=O)C=N1 BB52-2221 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.1 NCC1=CN=C(Br)C=C1 BB31-1130 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.1 NCC1=CN=C(N)C=C1 BB31-2999 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.1 NCC1=NC=C(Br)C=C1 BB31-1026 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.1 O=C1C=CC(CO)=CN1 BB31-8238 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.1 O=CC1=CNC(=O)N=C1 BB31-3327 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.1 O=CC1=NC=C(Br)C=N1 BB31-5037 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.1 O=CC1=NN=C(Cl)C=C1 BB31-4584 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.1 OCC1=NC=C(O)C=C1 BB31-5168 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.3 C#CC1=CN=C(C(=O)O)C=C1 BB31-3691 [0,1,0,0,0,0|1,0,2]=4 39 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 BB32-3619 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 BB31-5026 [0,1,0,0,0,0|1,0,0]=2 41 B11R1.3 CC(C)C1=NC=C(C=O)C=N1 BB52-2268 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 BB52-2759 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.3 CN(C)C1=NC=C(C=O)C=C1 BB31-2890 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.3 CNC1=NC=C(C(=O)O)C=C1 BB31-4402 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.3 CNC1=NC=C(C(N)=O)C=C1 BB32-3557 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.3 COC1=CC=C(S(C)=O)C=C1 BB32-2118 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.3 COC1=CN=C(C(=N)N)C=C1 BB31-9081 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.3 COC1=CN=C(C(C)=O)C=N1 BB32-1991 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.3 COC1=NC=C(C(=O)O)C=N1 BB31-7958 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.3 CS(=O)C1=CC=C(C#N)C=C1 BB31-7405 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 BB31-4161 [0,1,0,0,0,0|1,0,1]=3 52 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 BB31-7862 [0,1,0,0,0,0|1,0,1]=3 53 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 BB31-0182 [0,1,0,0,0,0|1,0,1]=3 54 B11R1.3 NCC1=CC=C(B(O)O)C=C1 BB32-2236 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 BB31-5217 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.3 O=[N+]([O-])C1=CN=C(CO)C=C1 BB32-1687 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.83 CCSC1=NC=C(C=O)C=N1 BB52-2269 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.83 COC1=CC=C(CC=O)C=C1 BB32-2943 [0,1,0,0,0,0|1,0,0]=2 59 B11R1.83 COC1=CC=C(CNO)C=C1 BB32-2374 [0,1,0,0,0,0|1,0,2]=4 60 B11R1.83 N#CCC1=CC=C(CO)C=C1 BB31-2817 [0,1,0,0,0,0|0,0,3]=4 61 B11R1.279 C#CC1=C(C)C=C(OC)C=C1 BB31-7195 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.279 CC1=C(C#N)C=CC(C=O)=C1 BB31-4451 [0,1,0,0,0,0|1,0,1]=3 63 B11R1.279 CCC1=CC(O)=C(C=O)C=C1 BB31-3289 [0,1,0,0,0,0|0,0,0]=1 64 B11R1.279 COC1=C(Br)C=C(C=O)C=N1 BB32-3818 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.279 COC1=C(C)C=C(CN)C=C1 BB31-8268 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.279 COC1=C(Cl)C=C(C=O)C=N1 BB31-1956 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.279 COC1=C(F)C=C(C=O)C=N1 BB31-8545 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.279 COC1=C(N)C=C(CO)C=C1 BB31-0379 [0,1,0,0,0,0|1,0,2]=4 69 B11R1.279 COC1=CC(Br)=C(CO)C=C1 BB31-3199 [0,1,0,0,0,0|1,0,2]=4 70 B11R1.279 COC1=CC(N)=C(C=O)C=C1 BB32-3011 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.279 COC1=NC(C)=C(C=O)C=C1 BB31-2972 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.279 CSC1=NC(C)=C(C=O)C=N1 BB31-6662 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.279 N#CC1=C(Cl)C=C(C=O)C=C1 BB31-0169 [0,1,0,0,0,0|1,0,1]=3 74 B11R1.279 N#CC1=C(F)C=C(CO)C=C1 BB31-8134 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.279 N#CC1=CC(F)=C(CN)C=C1 BB32-3817 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.279 N#CC1=CC(O)=C(C=O)C=C1 BB31-4713 [0,1,0,0,0,0|1,0,1]=3 77 B11R2.190 O=CC1=CC2=C(C=C1)CC2 BB31-8398 [0,0,0,1,0,0|0,0,0]=1 78 B9R1.21 C#CC1=CC=C(C=O)S1 BB31-4087 [0,0,0,0,1,0|1,0,2]=4 79 B9R1.21 CCC1=NOC(C=O)=C1 BB32-3690 [0,0,0,0,1,0|2,0,0]=3 80 B9R1.21 N#CC1=CC=C(C=O)O1 BB32-1495 [0,0,0,0,1,0|2,0,1]=4 81 B9R1.21 O=CC1=CC=C(C=O)N1 BB32-1975 [0,0,0,0,1,0|2,0,1]=4 82 B8R1.2 NCC1=CC=NC=C1 BB32-3106 [2,0,0,0,0,0|2,0,0]=4 83 B8R1.2 O=CC1=NC=CC=N1 BB31-5137 [2,0,0,0,0,0|2,0,0]=4 84 B8R1.2 O=CC1=NC=NC=C1 BB31-4750 [2,0,0,0,0,0|2,0,0]=4 85 B8R1.2 O=CC1=NN=CC=C1 BB52-3335 [2,0,0,0,0,0|2,0,0]=4 86 B8R1.3 CC1=CN=C(I)C=C1 BB32-1027 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.1 C=CCC1=CC=C(O)C=C1 BB31-5055 [1,1,0,0,0,0|0,0,2]=4 88 B10R1.1 CC1=CC=C(SCCl)C=C1 BB31-6111 [1,1,0,0,0,0|1,0,1]=4 89 B10R1.1 CC1=NC=C(CCO)C=C1 BB31-0061 [1,1,0,0,0,0|1,0,1]=4 90 B10R1.1 CCOC1=CN=C(Cl)C=C1 BB32-3970 [1,1,0,0,0,0|2,0,0]=4 91 B10R1.1 CCOC1=NC=C(F)C=C1 BB31-8599 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.1 CSCC1=CC=C(F)C=C1 BB32-3225 [1,1,0,0,0,0|1,0,0]=3 93 B10R1.1 OCCC1=CN=C(Cl)C=C1 BB31-8395 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.1 OCCC1=NC=C(Br)C=C1 BB31-8160 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.13 CC(=O)C1=CN=C(C)N=C1 BB31-2353 [1,1,0,0,0,0|2,0,0]=4 96 B10R1.13 CC(=O)C1=CN=C(N)C=C1 BB31-3878 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.13 CC(=O)C1=NC=C(O)C=C1 BB32-3774 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.13 CC(C)C1=NC=C(Br)C=C1 BB31-0706 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.13 CC(O)C1=CN=C(Cl)C=C1 BB32-1451 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 BB31-5404 [1,1,0,0,0,0|1,0,0]=3 101 B10R1.13 CC1=NC=C(C(=O)O)C=N1 BB52-2338 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.13 CC1=NC=C(C(C)N)C=C1 BB31-7487 [1,1,0,0,0,0|1,0,1]=4 103 B10R1.13 CN(C)C1=CC=C(I)C=C1 BB12-5133 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 BB31-0481 [1,1,0,0,0,0|1,0,0]=3 105 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-1090 [1,1,0,0,0,0|1,0,0]=3 106 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 BB31-2900 [1,1,0,0,0,0|1,0,0]=3 107 B10R1.13 N=C(N)C1=CC=C(I)C=C1 BB31-9721 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.13 N=C(N)C1=CC=C(N)C=C1 BB31-7117 [1,1,0,0,0,0|2,0,0]=4 109 B10R1.13 NC(=O)C1=NC=C(N)C=C1 BB31-2838 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 BB31-0817 [1,1,0,0,0,0|2,0,0]=4 111 B10R1.25 CC1=C(C=O)C=CC(F)=N1 BB31-6533 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.25 CC1=CC(C)=C(C=O)C=N1 BB31-0486 [1,1,0,0,0,0|1,0,0]=3 113 B10R1.25 CC1=CC(F)=C(NN)C=C1 BB32-2275 [1,1,0,0,0,0|2,0,0]=4 114 B10R1.25 CC1=CC(N)=C(CO)C=C1 BB31-6811 [1,1,0,0,0,0|0,0,2]=4 115 B10R1.25 CCC1=C(F)C=C(Br)C=C1 BB32-3524 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.25 CCC1=C(N)C=C(Br)C=C1 BB31-2864 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.25 CCC1=NC=C(C)C=C1C BB31-8237 [1,1,0,0,0,0|1,0,1]=4 118 B10R1.25 CNC1=C(Cl)C=C(F)C=C1 BB31-6776 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.25 CNC1=C(F)C=C(Br)C=C1 BB32-1250 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.25 CNC1=C(N)C=C(C)C=C1 BB32-2054 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.25 COC1=C(F)C=C(S)C=C1 BB31-6341 [1,1,0,0,0,0|1,1,0]=4 122 B10R1.25 CSC1=C(Br)C=C(F)C=C1 BB31-5668 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.25 FC1=CC(I)=C(CBr)C=C1 BB32-3713 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 BB32-2980 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.25 NC1=CC(Br)=CN=C1C=O BB31-1858 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.25 NC1=CC(Cl)=C(CO)C=C1 BB32-2709 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.25 NCC1=C(O)C=C(Br)C=C1 BB31-9160 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.25 O=CC1=C(Cl)C=C(F)N=C1 BB31-1261 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.25 O=CC1=C(F)N=C(Cl)C=C1 BB31-5262 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.25 O=CC1=CC=C(F)N=C1Cl BB31-0855 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.25 O=CC1=NC=C(Br)C=C1Cl BB31-6419 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.25 O=CC1=NC=C(Br)C=C1F BB31-4775 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.176 C#CC1=CC(N)=C(C)C=C1 BB31-3744 [1,1,0,0,0,0|1,0,1]=4 134 B10R1.176 C=CC1=CC(Cl)=C(Cl)C=C1 BB31-3792 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.176 CC1=C(Br)C=CC(C=O)=N1 BB31-2097 [1,1,0,0,0,0|2,0,0]=4 136 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 BB31-1720 [1,1,0,0,0,0|2,0,0]=4 137 B10R1.176 CC1=CC(C=O)=CN=C1Br BB31-6416 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.176 CCC1=CC(C)=C(C)C=C1 BB31-7435 [1,1,0,0,0,0|0,0,1]=3 139 B10R1.176 CCC1=CC(C)=C(N)C=C1 BB31-7084 [1,1,0,0,0,0|1,0,0]=3 140 B10R1.176 CCC1=CC(F)=C(Br)C=C1 BB31-7483 [1,1,0,0,0,0|1,0,0]=3 141 B10R1.176 CN1C=C(CN)C=CC1=O BB20-0050 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 BB32-2051 [1,1,0,0,0,0|1,0,1]=4 143 B10R1.176 COC1=CC(O)=C(Cl)C=C1 BB31-3552 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.176 COC1=CC(O)=C(O)C=C1 BB32-1848 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.176 NC1=C(Br)C=C(C=O)C=N1 BB31-0346 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.176 NC1=C(O)C=CC(CO)=C1 BB32-2829 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.176 O=CC1=CC=C(Cl)C(Br)=N1 BB31-9976 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 BB32-0161 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.176 O=CC1=CN=C(Cl)C(F)=C1 BB31-7323 [1,1,0,0,0,0|2,0,0]=4 150 B10R1.176 OCC1=CC(O)=C(O)C=C1 BB31-5748 [1,1,0,0,0,0|1,0,1]=4 151 B10R1.31 CC(C)C1=COC(C=O)=C1 BB32-0360 [0,1,0,0,1,0|1,0,0]=3 152 B10R1.31 CC(C)C1=NC=C(C=O)S1 BB32-1745 [0,1,0,0,1,0|2,0,0]=4 153 B10R1.31 CC(C)N1C=C(C=O)C=N1 BB52-8493 [0,1,0,0,1,0|2,0,0]=4 154 B10R1.31 CC(C)N1C=NC(C=O)=C1 BB32-0823 [0,1,0,0,1,0|2,0,0]=4 155 B10R1.31 CCN1C=C(C(N)=O)C=N1 BB31-9092 [0,1,0,0,1,0|2,0,0]=4 156 B10R1.31 COC1=CC=C(C(=O)O)S1 BB31-4536 [0,1,0,0,1,0|2,0,0]=4 157 B10R1.31 CSC1=CC=C(C(=O)O)S1 BB31-4118 [0,1,0,0,1,0|2,0,0]=4 158 B10R1.31 O=C(O)C1=CC(CO)=CS1 BB31-7624 [0,1,0,0,1,0|2,0,0]=4 159 B10R1.96 CCCC1=NC=C(C=O)S1 BB32-3578 [0,1,0,0,1,0|2,0,0]=4 160 B10R1.96 CCOC1=NC=C(C=O)S1 BB55-8402 [0,1,0,0,1,0|2,0,0]=4 161 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 BB31-5109 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.5 CNC(=O)C1=CC=C(C=O)C=C1 BB31-3351 [0,2,0,0,0,0|0,0,1]=3 163 B12R1.5 COC(=O)C1=CN=C(CCl)C=C1 BB31-7659 [0,2,0,0,0,0|2,0,0]=4 164 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 BB31-9073 [0,2,0,0,0,0|2,0,0]=4 165 B12R1.5 COC(=O)C1=NC=C(CBr)C=C1 BB31-4912 [0,2,0,0,0,0|2,0,0]=4 166 B12R1.5 COC(=O)C1=NC=C(CN)C=C1 BB31-9857 [0,2,0,0,0,0|2,0,0]=4 167 B12R1.5 COC(=O)C1=NC=C(CO)C=C1 BB32-2012 [0,2,0,0,0,0|2,0,0]=4 168 B12R1.5 COC1=CC=C(C(N)CO)C=C1 BB31-2402 [0,2,0,0,0,0|2,0,0]=4 169 B12R1.5 COC1=CC=C(C(N)CO)C=C1 BB31-9770 [0,2,0,0,0,0|2,0,0]=4 170 B12R1.5 N#CC1=CC=C(C(=O)CCl)C=C1 BB32-1845 [0,2,0,0,0,0|1,0,1]=4 171 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 BB31-4613 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.6 O=CC1=CC=C(S(=O)(=O)O)C=C1 BB32-2495 [0,2,0,0,0,0|2,0,0]=4 173 B12R1.48 CCC1=C(Cl)C=C([N+](=O)[O-])C=C1 BB32-1667 [0,2,0,0,0,0|1,0,0]=3 174 B12R1.48 CNC1=C(Br)C=C([N+](=O)[O-])C=C1 BB31-7191 [0,2,0,0,0,0|2,0,0]=4 175 B12R1.48 COC1=C(F)C=C(C(C)O)C=C1 BB32-3099 [0,2,0,0,0,0|2,0,0]=4 176 B12R1.48 COC1=C(F)C=C([C@@H](C)N)C=C1 BB32-0030 [0,2,0,0,0,0|2,0,0]=4 177 B12R1.48 COC1=C(F)C=C([C@H](C)N)C=C1 BB32-0730 [0,2,0,0,0,0|2,0,0]=4 178 B12R1.48 O=CC1=C(Cl)C=C(B(O)O)C=C1 BB31-7939 [0,2,0,0,0,0|2,0,0]=4 179 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 BB32-3457 [0,2,0,0,0,0|1,0,1]=4 180 B12R1.48 O=CC1=C(Cl)C=C([N+](=O)[O-])C=C1 BB32-2562 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.48 O=CC1=C(O)C=C(C(=O)O)C=C1 BB31-5934 [0,2,0,0,0,0|1,0,1]=4 182 B12R1.48 O=[N+]([O-])C1=CC(I)=C(CBr)C=C1 BB31-6876 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.48 O=[N+]([O-])C1=CC(O)=C(CO)C=C1 BB32-3021 [0,2,0,0,0,0|2,0,0]=4 184 B12R1.113 CCOC1=CC=C(C(N)=S)C=C1 BB31-5929 [0,2,0,0,0,0|0,1,0]=3 185 B12R1.113 CCOC1=NN=C(C(=O)O)C=C1 BB31-2746 [0,2,0,0,0,0|2,0,0]=4 186 B12R1.113 CCSC1=CC=C(C(=O)O)C=C1 BB31-1917 [0,2,0,0,0,0|0,0,0]=2 187 B12R1.113 CCSC1=NC=C(C(=O)O)C=N1 BB52-2773 [0,2,0,0,0,0|2,0,0]=4 188 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 BB32-2215 [0,2,0,0,0,0|2,0,0]=4 189 B12R1.113 O=C(O)C1=CC=C(C#CBr)C=C1 BB31-2849 [0,2,0,0,0,0|0,0,2]=4 190 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 BB31-2095 [0,2,0,0,0,0|1,0,1]=4 191 B12R1.256 CC(=O)C1=CC=C(C(F)F)C=C1 BB31-3478 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.256 CC(=O)C1=CC=C(C(N)=O)C=C1 BB31-7498 [0,2,0,0,0,0|0,0,1]=3 193 B12R1.256 CC(C)C1=NC=C(C(=O)O)C=N1 BB52-2339 [0,2,0,0,0,0|2,0,0]=4 194 B12R1.256 CS(=O)C1=CC=C(C(=O)O)C=C1 BB31-5070 [0,2,0,0,0,0|1,0,0]=3 195 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 BB31-5415 [0,2,0,0,0,0|0,0,0]=2 196 B12R1.256 NC(=S)C1=CC=C(C(=O)O)C=C1 BB32-2828 [0,2,0,0,0,0|1,0,1]=4 197 B12R1.452 CC1=C(C(=O)O)C=CC(C=O)=C1 BB32-2768 [0,2,0,0,0,0|1,0,1]=4 198 B12R1.452 CC1=C(N(C)C)C=CC(C=O)=C1 BB31-8346 [0,2,0,0,0,0|1,0,0]=3 199 B12R1.452 CCC1=NC=C(C(=O)O)C(=O)N1 BB52-1801 [0,2,0,0,0,0|2,0,0]=4 200 B12R1.452 CCC1=NC=C(C(=O)O)C(C)=N1 BB52-2794 [0,2,0,0,0,0|2,0,0]=4 201 B12R1.452 CNC1=CC(C)=C([N+](=O)[O-])C=C1 BB31-7593 [0,2,0,0,0,0|2,0,0]=4 202 B12R1.452 COC1=CC(C)=C(C(C)=O)C=C1 BB32-1464 [0,2,0,0,0,0|1,0,0]=3 203 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=N1 BB31-9469 [0,2,0,0,0,0|2,0,0]=4 204 B12R1.452 COC1=CC(F)=C([C@H](C)N)C=C1 BB31-0593 [0,2,0,0,0,0|2,0,0]=4 205 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 BB31-1357 [0,2,0,0,0,0|2,0,0]=4 206 B12R1.452 NC1=C([N+](=O)[O-])C=CC(CO)=C1 BB32-2018 [0,2,0,0,0,0|2,0,0]=4 207 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 BB32-0934 [0,2,0,0,0,0|1,0,0]=3 208 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 BB32-1158 [0,2,0,0,0,0|1,0,0]=3 209 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 BB31-9902 [0,2,0,0,0,0|1,0,1]=4 210 B12R1.4 CC(C)OC1=CC=C(NN)C=C1 BB31-8459 [0,2,0,0,0,0|2,0,0]=4 211 B12R1.4 CC(C)SC1=NC=C(C=O)C=N1 BB52-2738 [0,2,0,0,0,0|2,0,0]=4 212 B12R1.4 COC1=CN=C(CC(=O)O)C=C1 BB32-0118 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.4 O=CC1=CN=C(OC(F)F)C=C1 BB31-9975 [0,2,0,0,0,0|2,0,0]=4 214 B12R1.71 CCOCC1=CC=C(OC)C=C1 BB32-2498 [0,2,0,0,0,0|2,0,0]=4 215 B12R1.71 COCCC1=NC=C(C=O)C=N1 BB52-2737 [0,2,0,0,0,0|2,0,0]=4 216 B12R1.71 N#CC1=CC=C(OCCBr)C=C1 BB31-7865 [0,2,0,0,0,0|1,0,1]=4 217 B12R1.78 CCC1=CC(OC)=C(OC)C=C1 BB32-3124 [0,2,0,0,0,0|2,0,0]=4 218 B12R1.78 COC1=C(C#N)C=CC(C=O)=C1 BB32-1172 [0,2,0,0,0,0|1,0,1]=4 219 B12R1.301 COC1=CC(Cl)=C(C=O)C(Cl)=C1 BB32-3990 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.301 COC1=CC(Cl)=C(C=O)C(O)=C1 BB31-0454 [0,2,0,0,0,0|1,0,0]=3 221 B12R1.301 COC1=CC(O)=C(C=O)C(C)=C1 BB32-1837 [0,2,0,0,0,0|1,0,0]=3 222 B12R1.653 COC1=CC=C(C=O)C(Cl)=C1Cl BB32-1928 [0,2,0,0,0,0|1,0,0]=3 223 B12R2.9 NCC1=CC=C(C2CC2)C=C1 BB31-8846 [0,1,0,1,0,0|1,0,1]=4 224 B12R2.9 O=CC1=CN=C(C2CC2)N=C1 BB52-2736 [0,1,0,1,0,0|2,0,0]=4 225 B12R2.44 BrCC1=CC2=C(C=C1)N=CO2 BB31-3546 [0,1,0,1,0,0|1,0,1]=4 226 B12R2.44 C#CC1=CC2=C(C=C1)CCC2 BB31-9563 [0,1,0,1,0,0|1,0,1]=4 227 B12R2.44 COC1=CC2=C(C=C1)CNC2 BB31-1763 [0,1,0,1,0,0|2,0,0]=4 228 B12R2.44 COC1=CC2=C(C=C1)OC=N2 BB31-1933 [0,1,0,1,0,0|2,0,0]=4 229 B12R2.44 COC1=CC2=C(C=C1)SC=C2 BB31-3820 [0,1,0,1,0,0|2,0,0]=4 230 B12R2.44 COC1=CC2=C(C=CS2)C=C1 BB31-7406 [0,1,0,1,0,0|1,1,0]=4 231 B12R2.44 N#CC1=CC2=C(C=C1)CNC2 BB31-0715 [0,1,0,1,0,0|1,0,1]=4 232 B12R2.44 N#CC1=CC2=C(C=C1)NCC2 BB31-3048 [0,1,0,1,0,0|1,0,1]=4 233 B12R2.44 NCC1=CC2=C(C=C1)CCC2 BB31-1915 [0,1,0,1,0,0|1,0,1]=4 234 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 BB31-8032 [0,1,0,1,0,0|0,0,0]=2 235 B12R2.44 O=CC1=CC2=C(C=C1)N=CO2 BB31-6626 [0,1,0,1,0,0|1,0,1]=4 236 B12R2.44 O=CC1=CC2=C(C=C1)N=CS2 BB31-3916 [0,1,0,1,0,0|1,0,1]=4 237 B12R2.44 O=CC1=CC2=C(C=C1)SC=C2 BB31-0189 [0,1,0,1,0,0|0,0,2]=4 238 B12R2.44 O=CC1=CC2=C(C=CS2)C=C1 BB32-3418 [0,1,0,1,0,0|0,0,2]=4 239 B12R2.44 OCC1=CC2=C(C=C1)NC=C2 BB52-5879 [0,1,0,1,0,0|2,0,0]=4 240 B12R2.44 OCC1=CC2=C(C=C1)OC=C2 BB32-1398 [0,1,0,1,0,0|2,0,0]=4 241 B12R2.44 OCC1=CC2=C(C=C1)SC=C2 BB31-3819 [0,1,0,1,0,0|2,0,0]=4 242 B12R2.44 OCC1=CC2=C(C=CN2)C=C1 BB52-5878 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.1 C(=O)C1=CC=C(F)S1 BB05-4502 [1,0,0,0,1,0|2,0,0]=4 244 B8R1.1 CC1=NC(C=O)=CO1 BB52-2373 [1,0,0,0,1,0|2,0,0]=4 245 B8R1.1 CN1C=CC(C=O)=C1 BB32-1972 [1,0,0,0,1,0|1,0,0]=3 246 B8R1.1 O=CC1=CC(Cl)=CS1 BB32-3153 [1,0,0,0,1,0|2,0,0]=4 247 B8R1.1 O=CC1=CC=C(Br)N1 BB31-7304 [1,0,0,0,1,0|2,0,0]=4 248 B10R1.172 CSC1=CC(C=O)=CC=C1 BB31-7190 [0,0,0,0,1,1|1,0,0]=3 249 B10R1.172 O=CC1=CC(CO)=CC=C1 BB32-2221 [0,0,0,0,1,1|1,0,0]=3