0 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 BB31-9183 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.56 COC1=C(F)C=CC([C@@H](C)N)=C1 BB31-1276 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 BB31-3596 [0,0,0,0,0,0|1,0,1]=2 3 B12R1.56 COC1=C(O)C=CC(C(C)O)=C1 BB31-4303 [0,0,0,0,0,0|1,0,1]=2 4 B12R1.56 N#CC1=C(Cl)C=CC(C(=O)O)=C1 BB31-5087 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 BB31-8254 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 BB31-1241 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 BB31-0768 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 BB31-6679 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.21 CC1=C(O)C=CC(C(C)C)=C1 BB31-3415 [1,0,0,0,0,0|2,0,1]=4 10 B11R1.21 CC1=CC(C(=O)O)=CN=C1C BB31-4837 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.21 CC1=CC(C(=O)O)=CNC1=O BB31-7535 [1,0,0,0,0,0|1,0,1]=3 12 B11R1.21 CC1=NC=C(C(=O)O)C=C1N BB31-7301 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.21 CN1C=C(C(=O)O)C=CC1=O BB52-8562 [1,0,0,0,0,0|1,0,1]=3 14 B11R1.21 NC(=O)C1=CC(O)=C(I)C=C1 BB31-8880 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 BB31-2543 [1,0,0,0,0,0|1,1,0]=3 16 B11R1.21 NC1=CC(C(=O)O)=CN=C1Cl BB32-3665 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.21 NC1=CC(C(=O)O)=CN=C1N BB32-1482 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.21 O=C(O)C1=CC(Br)=C(F)N=C1 BB31-4538 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=N1 BB31-8280 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 BB31-4757 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 BB31-7853 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 BB31-9203 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 BB31-9052 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.21 O=C(O)C1=CC=C(F)C(F)=N1 BB31-8597 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.21 O=C(O)C1=CN=C(I)C(O)=C1 BB32-3137 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 BB31-7565 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 BB31-5916 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.266 C#CC1=CC=CC(C(N)=O)=C1 BB32-3275 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.266 CCC1=CC=CC(C(=O)O)=C1 BB32-3000 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.266 CCC1=CC=CC(C(C)=O)=C1 BB31-7616 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.266 CCC1=CC=CC([N+](=O)[O-])=C1 BB31-7022 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 BB31-5735 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.266 COC1=CC(C(C)=O)=NC=C1 BB32-3151 [1,0,0,0,0,0|2,0,0]=3 34 B11R1.266 COC1=CC([C@@H](C)N)=CC=C1 BB31-0479 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.266 COC1=NC(B(O)O)=CC=C1 BB31-4653 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.266 COC1=NC=CC(C(=O)O)=C1 BB52-3918 [1,0,0,0,0,0|1,0,0]=2 37 B11R1.266 O=CC1=CC(C(=O)O)=CN=C1 BB31-6334 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.280 C=CC1=CC(OC)=C(F)C=C1 BB32-3523 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 BB31-3965 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.280 COC1=C(I)C=CC(C=O)=C1 BB32-0470 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.280 COC1=CC(OC)=C(S)C=C1 BB31-4068 [1,0,0,0,0,0|2,1,0]=4 42 B11R1.280 N#CC1=C(Cl)C=CC(C=O)=C1 BB31-1526 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.280 N#CC1=C(O)C=CC(C=O)=C1 BB31-7068 [1,0,0,0,0,0|2,0,0]=3 44 B13R1.13 CC1=C(C(=O)O)C=C(C(=O)O)C=C1 BB32-1879 [0,1,0,0,0,0|3,0,0]=4 45 B13R1.13 NC1=C(C(=O)O)C=C(C(=O)O)C=C1 BB31-4923 [0,1,0,0,0,0|3,0,0]=4 46 B13R1.13 O=C(O)C1=CC(C(=O)O)=C(F)C=C1 BB31-8017 [0,1,0,0,0,0|3,0,0]=4 47 B13R1.49 CNC(=O)C1=CC(OC)=C(N)C=C1 BB31-6603 [0,1,0,0,0,0|2,0,0]=3 48 B13R1.49 CNC1=C(N)C=CC(C(=O)OC)=C1 BB32-3297 [0,1,0,0,0,0|2,0,0]=3 49 B13R1.49 COC(=O)C1=CC(C#N)=C(C)C=C1 BB32-1831 [0,1,0,0,0,0|3,0,0]=4 50 B13R1.49 COC(=O)C1=CC(C=O)=C(N)C=C1 BB31-6668 [0,1,0,0,0,0|3,0,0]=4 51 B13R1.49 COC1=C(O)C=CC(C(=O)CBr)=C1 BB31-7156 [0,1,0,0,0,0|1,0,0]=2 52 B13R1.50 COC1=C(Br)C=CC(S(C)(=O)=O)=C1 BB31-5129 [0,1,0,0,0,0|2,0,1]=4 53 B13R1.298 COC1=CC(B(O)O)=CC(F)=C1F BB31-7451 [0,1,0,0,0,0|2,0,1]=4 54 B13R1.298 COC1=CC(C(=O)O)=CC(F)=C1F BB31-6446 [0,1,0,0,0,0|1,0,0]=2 55 B13R1.354 COCC1=C(F)C=CC(B(O)O)=C1 BB32-2015 [0,1,0,0,0,0|2,0,1]=4 56 B13R1.651 COC1=C(Cl)C=C(Cl)C(B(O)O)=C1 BB32-2633 [0,1,0,0,0,0|2,0,1]=4 57 B13R1.651 COC1=C(Cl)C=C(F)C(B(O)O)=C1 BB31-8022 [0,1,0,0,0,0|2,0,1]=4 58 B13R1.651 COC1=C(F)C=C(F)C(B(O)O)=C1 BB32-0002 [0,1,0,0,0,0|2,0,1]=4 59 B13R1.3091 C#CC1=C(OC)C=C([N+](=O)[O-])C=C1 BB31-0360 [0,1,0,0,0,0|2,0,1]=4 60 B13R1.3091 COC1=C(C#N)C=CC(C(=O)O)=C1 BB31-0312 [0,1,0,0,0,0|1,0,0]=2 61 B13R1.3091 COC1=C(C=O)C=CC(B(O)O)=C1 BB31-7000 [0,1,0,0,0,0|1,0,2]=4 62 B13R1.3091 COC1=C(CO)C=CC([N+](=O)[O-])=C1 BB31-2017 [0,1,0,0,0,0|1,0,1]=3 63 B13R1.3091 COC1=C(OC)C=C(C(=N)N)C=C1 BB32-2307 [0,1,0,0,0,0|2,0,0]=3 64 B13R1.3091 COC1=C(OC)N=C(C(=O)O)C=C1 BB32-1852 [0,1,0,0,0,0|1,0,0]=2 65 B13R1.3230 COC1=C(F)C=CC(C(=O)O)=C1N BB31-1570 [0,1,0,0,0,0|1,0,0]=2 66 B13R2.430 CC(=O)C1=CC2=C(C=C1)NCC2 BB52-1562 [0,0,0,1,0,0|3,0,0]=4 67 B13R2.430 CC(O)C1=CC2=C(C=C1)OCO2 BB32-3577 [0,0,0,1,0,0|1,0,1]=3 68 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCN2 BB31-3047 [0,0,0,1,0,0|2,0,0]=3 69 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCO2 BB32-1072 [0,0,0,1,0,0|1,0,0]=2 70 B13R2.430 O=C(O)C1=CN=C2C=COC2=C1 BB31-2354 [0,0,0,1,0,0|2,0,1]=4 71 B11R1.64 COC1=C(C(=O)O)SC=C1C BB05-3104 [0,0,0,0,1,0|2,0,0]=3 72 B10R1.13 CC(=O)C1=NC=C(O)C=C1 BB32-3774 [2,0,0,0,0,0|2,0,0]=4 73 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 BB31-0817 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.113 CC1=CC=CC([C@@H](C)O)=C1 BB32-1902 [2,0,0,0,0,0|1,0,1]=4 75 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 BB32-2691 [2,0,0,0,0,0|1,0,1]=4 76 B10R1.113 NC(=O)C1=CN=CC(O)=C1 BB31-0206 [2,0,0,0,0,0|2,0,0]=4 77 B10R1.113 O=C(O)C1=CC(I)=CN=C1 BB32-0482 [2,0,0,0,0,0|2,0,0]=4 78 B10R1.113 O=C(O)C1=NC=CC(F)=C1 BB31-5136 [2,0,0,0,0,0|2,0,0]=4 79 B10R1.176 CC1=C(Br)C=CC(C=O)=N1 BB31-2097 [2,0,0,0,0,0|2,0,0]=4 80 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 BB31-1720 [2,0,0,0,0,0|1,0,1]=4 81 B10R1.176 CC1=CC(C=O)=CN=C1Br BB31-6416 [2,0,0,0,0,0|2,0,0]=4 82 B10R1.176 COC1=CC(O)=C(O)C=C1 BB32-1848 [2,0,0,0,0,0|2,0,0]=4 83 B10R1.176 NC1=C(O)C=CC(CO)=C1 BB32-2829 [2,0,0,0,0,0|1,0,1]=4 84 B10R1.176 OCC1=CC(O)=C(O)C=C1 BB31-5748 [2,0,0,0,0,0|0,0,1]=3 85 B10R1.172 CSC1=CC(C=O)=CC=C1 BB31-7190 [2,0,0,0,0,0|0,1,0]=3 86 B10R1.172 O=CC1=CC(CO)=CC=C1 BB32-2221 [2,0,0,0,0,0|2,0,0]=4 87 B10R1.30 CCC1=C(O)C=CC(Br)=C1 BB31-3966 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.30 COC1=C(C)C=CC(I)=C1 BB32-1094 [2,0,0,0,0,0|2,0,0]=4 89 B10R1.30 COC1=C(C)C=CC(O)=C1 BB31-4015 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.30 COC1=C(I)C=CC(C)=C1 BB31-7787 [2,0,0,0,0,0|1,0,1]=4 91 B10R1.30 COC1=C(I)C=CC(N)=C1 BB31-9407 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5893 [2,0,0,0,0,0|1,0,0]=3 93 B10R1.30 COC1=C(N)C=CC(O)=C1 BB31-5894 [2,0,0,0,0,0|1,0,0]=3 94 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 BB32-3273 [1,1,0,0,0,0|1,0,1]=4 95 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 BB32-3457 [1,1,0,0,0,0|1,0,1]=4 96 B12R1.48 O=CC1=C(O)C=C(C(=O)O)C=C1 BB31-5934 [1,1,0,0,0,0|0,0,1]=3 97 B12R1.48 O=[N+]([O-])C1=CC(O)=C(CO)C=C1 BB32-3021 [1,1,0,0,0,0|1,0,1]=4 98 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(O)=C1 BB32-3794 [1,1,0,0,0,0|2,0,0]=4 99 B12R1.232 CC1=CC(C)=C(I)C=C1C(=O)O BB31-7214 [1,1,0,0,0,0|2,0,0]=4 100 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1O BB31-6536 [1,1,0,0,0,0|1,0,0]=3 101 B12R1.232 CC1=CC(I)=C(C(=O)O)C=C1C BB32-2041 [1,1,0,0,0,0|1,0,0]=3 102 B12R1.232 NC1=C(Br)C=C(C(=O)O)C(F)=C1 BB32-0756 [1,1,0,0,0,0|2,0,0]=4 103 B12R1.232 NC1=CC(F)=C(Cl)C=C1C(=O)O BB32-1888 [1,1,0,0,0,0|2,0,0]=4 104 B12R1.367 CCC(=O)C1=CC(F)=C(O)C=C1 BB32-3270 [1,1,0,0,0,0|2,0,0]=4 105 B12R1.367 COC(=O)C1=CN=C(Cl)C(O)=C1 BB31-4746 [1,1,0,0,0,0|2,0,0]=4 106 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 BB32-2729 [1,1,0,0,0,0|1,0,0]=3 107 B12R1.893 CC1=C(C(=O)O)C=CC(Br)=C1F BB32-0041 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.893 CC1=C(N)C=CC(C(=O)O)=C1F BB32-0782 [1,1,0,0,0,0|1,0,0]=3 109 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C BB52-5681 [1,1,0,0,0,0|2,0,0]=4 110 B12R1.893 CC1=CC=C(C(=O)O)C(N)=C1Br BB32-1863 [1,1,0,0,0,0|2,0,0]=4 111 B12R1.893 O=C(O)C1=CC=C(O)C(O)=C1Cl BB31-5142 [1,1,0,0,0,0|0,0,0]=2 112 B12R1.1005 CC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 BB31-4973 [1,1,0,0,0,0|2,0,0]=4 113 B12R1.1005 CC1=C(I)C=C(C(=O)O)C=C1F BB31-6675 [1,1,0,0,0,0|2,0,0]=4 114 B12R1.1005 CC1=C(O)C(N)=CC([N+](=O)[O-])=C1 BB12-5208 [1,1,0,0,0,0|1,0,1]=4 115 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1I BB31-8384 [1,1,0,0,0,0|2,0,0]=4 116 B12R1.1005 NC1=CC(C(=O)O)=CC(Cl)=C1N BB12-5853 [1,1,0,0,0,0|2,0,0]=4 117 B12R1.1005 O=C(O)C1=CC(Br)=C(O)C(Cl)=C1 BB17-0741 [1,1,0,0,0,0|1,0,0]=3 118 B12R1.11 COC1=CC(C(=O)O)=CC(Br)=N1 BB31-6618 [1,1,0,0,0,0|1,0,0]=3 119 B12R1.11 COC1=CC(C)=CC(B(O)O)=C1 BB31-5375 [1,1,0,0,0,0|1,0,1]=4 120 B12R1.11 COC1=CC(C)=CC(C(C)=O)=C1 BB32-2711 [1,1,0,0,0,0|1,0,0]=3 121 B12R1.11 COC1=CC(Cl)=NC(C(=O)O)=C1 BB31-8520 [1,1,0,0,0,0|1,0,0]=3 122 B12R1.11 N#CC1=CC(C(=O)O)=CC(N)=C1 BB31-0010 [1,1,0,0,0,0|2,0,0]=4 123 B12R1.258 CC(=O)C1=CC(C(C)C)=CC=C1 BB32-2095 [1,1,0,0,0,0|2,0,0]=4 124 B12R1.258 CC(C)C1=CC(C(=O)O)=CN=C1 BB31-7034 [1,1,0,0,0,0|2,0,0]=4 125 B12R1.258 CN(C)C1=NC=CC(C(=O)O)=C1 BB51-1894 [1,1,0,0,0,0|2,0,0]=4 126 B12R1.258 NC(=O)C1=CC=CC(C(=O)O)=C1 BB32-2509 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.258 O=C(O)C1=CC=CC(C(F)F)=C1 BB32-2754 [1,1,0,0,0,0|2,0,0]=4 128 B12R1.279 CCOC1=NC=CC(C(=O)O)=C1 BB52-3921 [1,1,0,0,0,0|1,0,0]=3 129 B12R1.279 O=C(O)C1=CC(CCO)=CC=C1 BB32-1360 [1,1,0,0,0,0|1,0,0]=3 130 B12R1.279 O=C(O)C1=NC=CC(CCO)=C1 BB32-2791 [1,1,0,0,0,0|2,0,0]=4 131 B12R1.435 COC1=CC(C(=O)NN)=NC=C1 BB31-4041 [1,1,0,0,0,0|2,0,0]=4 132 B12R1.435 COC1=CC=CC(C(=O)CN)=C1 BB31-7626 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.435 COC1=CC=CC(C(=O)NN)=N1 BB31-6801 [1,1,0,0,0,0|2,0,0]=4 134 B12R1.440 COC1=CC=CC(C(C)=O)=C1N BB32-1938 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.440 COC1=CC=CC(C(C)=O)=C1O BB31-6997 [1,1,0,0,0,0|1,0,0]=3 136 B12R1.440 N#CC1=C(Cl)C(C(=O)O)=CC=C1 BB31-1516 [1,1,0,0,0,0|2,0,0]=4 137 B12R1.440 O=CC1=CC=CC(C(=O)O)=C1O BB32-3320 [1,1,0,0,0,0|2,0,0]=4 138 B12R1.453 CCC1=CC(C(=O)O)=C(O)C=C1 BB31-6008 [1,1,0,0,0,0|1,0,0]=3 139 B12R1.453 CCC1=CC(C(C)=O)=C(O)C=C1 BB31-4270 [1,1,0,0,0,0|2,0,0]=4 140 B12R1.453 COC1=CC(B(O)O)=C(C)C=C1 BB32-3291 [1,1,0,0,0,0|1,0,1]=4 141 B12R1.453 COC1=CC(C(=O)O)=C(N)C=N1 BB31-5982 [1,1,0,0,0,0|1,0,0]=3 142 B12R1.453 COC1=CC=C(N)C(C(=O)O)=N1 BB31-8582 [1,1,0,0,0,0|1,0,0]=3 143 B12R1.453 N#CC1=CC(C(=O)O)=C(Br)C=C1 BB31-6805 [1,1,0,0,0,0|2,0,0]=4 144 B12R1.453 N#CC1=CC(C(=O)O)=C(I)C=C1 BB32-1167 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.453 O=C(O)C1=C(O)C=CC(CO)=C1 BB31-5687 [1,1,0,0,0,0|2,0,0]=4 146 B12R1.78 CCC1=CC(OC)=C(OC)C=C1 BB32-3124 [1,1,0,0,0,0|1,0,1]=4 147 B12R1.78 COC1=C(C#N)C=CC(C=O)=C1 BB32-1172 [1,1,0,0,0,0|1,0,0]=3 148 B12R1.78 COC1=C(OC)C=C(NN)C=C1 BB31-5061 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.300 COC1=CC(C=O)=CC(F)=C1O BB31-5165 [1,1,0,0,0,0|0,0,0]=2 150 B12R1.449 COC1=C(Br)C=C(O)C(C=O)=C1 BB31-5908 [1,1,0,0,0,0|1,0,0]=3 151 B12R1.449 COC1=C(F)C=C(F)C(C=O)=C1 BB31-3633 [1,1,0,0,0,0|1,0,0]=3 152 B14R1.3405 COC(=O)CC1=CC(OC)=C(O)C=C1 BB31-3088 [0,1,0,0,0,1|0,0,0]=2 153 B14R1.12 CC(C)(C)C1=C(O)C=CC(C(=O)O)=C1 BB32-3618 [0,2,0,0,0,0|1,0,0]=3 154 B14R1.12 CS(=O)(=O)C1=C(F)C=CC(C(=O)O)=C1 BB31-3044 [0,2,0,0,0,0|1,1,0]=4 155 B14R1.31 O=C(O)C1=CC([N+](=O)[O-])=C(CO)C=C1 BB31-6922 [0,2,0,0,0,0|2,0,0]=4 156 B14R1.706 COC(=O)C1=C(C)C=CC(C(=O)O)=C1 BB31-3341 [0,2,0,0,0,0|1,0,0]=3 157 B14R1.706 COC(=O)C1=C(N)C=CC(C(=O)O)=C1 BB31-7707 [0,2,0,0,0,0|1,0,0]=3 158 B14R1.748 COC(=O)C1=CC(C(C)=O)=C(N)C=C1 BB31-8218 [0,2,0,0,0,0|2,0,0]=4 159 B14R1.6035 CC(C)C1=CC(C(=O)O)=C(O)C=C1O BB31-9016 [0,2,0,0,0,0|1,0,0]=3 160 B14R1.1864 COC(=O)C1=CC(C=O)=C(OC)C=C1 BB31-2561 [0,2,0,0,0,0|2,0,0]=4 161 B14R1.1864 COC1=C(OC)C=C([C@@H](N)CO)C=C1 BB31-9387 [0,2,0,0,0,0|1,0,1]=4 162 B14R1.2283 COC(=O)C1=CC(OC)=C(Br)C=C1N BB31-1275 [0,2,0,0,0,0|1,0,0]=3 163 B14R1.2283 COC(=O)C1=CC(OC)=C(F)C=C1N BB31-3093 [0,2,0,0,0,0|1,0,0]=3 164 B14R1.569 COC1=CC(C(=O)O)=C(F)C(F)=C1F BB32-1598 [0,2,0,0,0,0|1,0,0]=3 165 B14R1.441 CCOC1=C(OC)C=CC(C(N)=O)=C1 BB32-1024 [0,2,0,0,0,0|1,0,0]=3 166 B14R1.1851 COC1=CC(C)=C(C(=O)O)C=C1OC BB31-4096 [0,2,0,0,0,0|0,0,0]=2 167 B14R1.1851 COC1=CC(F)=C(C(=O)O)C=C1OC BB31-6879 [0,2,0,0,0,0|0,0,0]=2 168 B14R1.2023 COC1=C(OC)C(N)=C(C(=O)O)C=C1 BB32-3437 [0,2,0,0,0,0|0,0,0]=2 169 B14R1.2023 COC1=C(OC)C(N)=C(C(C)=O)C=C1 BB32-2741 [0,2,0,0,0,0|1,0,0]=3 170 B14R1.2023 COC1=CC=C(C(=O)O)C(Br)=C1OC BB31-7106 [0,2,0,0,0,0|0,0,0]=2 171 B12R1.283 COCC1=C(C(=O)O)C=CC=C1 BB31-6470 [0,0,1,1,0,0|1,0,1]=4 172 B12R2.43 COC1=CC=CC(C2CO2)=C1 BB32-1900 [1,0,0,1,0,0|1,0,1]=4 173 B12R2.44 C#CC1=CC2=C(C=C1)OCO2 BB32-3332 [1,0,0,1,0,0|1,0,1]=4 174 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 BB31-8032 [1,0,0,1,0,0|2,0,0]=4 175 B12R2.44 O=CC1=CC2=C(C=C1)N=CO2 BB31-6626 [1,0,0,1,0,0|1,0,1]=4 176 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OC=C2 BB31-5580 [0,0,0,1,0,1|1,0,1]=4 177 B14R2.24358 CC1=CNC2=C1C=C(C(=O)O)C=C2 BB32-3171 [0,1,0,1,0,0|2,0,0]=4 178 B14R2.24358 CC1=NNC2=C1C=C(C(=O)O)C=C2 BB31-6409 [0,1,0,1,0,0|2,0,0]=4 179 B14R2.24358 CN1C=CC2=C1C=C(C(=O)O)C=C2 BB52-0581 [0,1,0,1,0,0|2,0,0]=4 180 B14R2.24358 CN1C=NC2=C1C=C(C(=O)O)C=C2 BB32-2556 [0,1,0,1,0,0|2,0,0]=4 181 B14R2.24358 CN1N=CC2=CC=C(C(=O)O)C=C21 BB51-1160 [0,1,0,1,0,0|2,0,0]=4 182 B14R2.24358 O=C(O)C1=CC2=C(C=C1)CCC2=O BB32-2938 [0,1,0,1,0,0|2,0,0]=4 183 B14R2.24358 O=C(O)C1=CC2=C(C=C1)COB2O BB32-0107 [0,1,0,1,0,0|2,0,0]=4 184 B14R2.966 COC(=O)C1=CC2=C(C=C1)CCN2 BB31-9178 [0,1,0,1,0,0|2,0,0]=4 185 B14R2.966 COC(=O)C1=CC2=C(C=C1)OC=C2 BB31-6236 [0,1,0,1,0,0|1,0,1]=4 186 B14R2.2167 COC1=C(Cl)C=C2CCC(=O)C2=C1 BB31-6006 [0,1,0,1,0,0|2,0,0]=4 187 B14R2.2167 COC1=C(F)C=C2CCC(=O)C2=C1 BB31-6013 [0,1,0,1,0,0|2,0,0]=4 188 B14R2.2167 COC1=CC2=C(C=C1O)CCC2=O BB31-1784 [0,1,0,1,0,0|1,0,0]=3 189 B14R2.8824 O=C(O)C1=CC(Br)=C2OCOC2=C1 BB31-6067 [0,1,0,1,0,0|0,0,0]=2 190 B14R2.601 CC1=CC2=C(C=C(C(=O)O)C=C2)N1 BB32-3744 [0,1,0,1,0,0|2,0,0]=4 191 B14R2.601 CC1=CC2=C(C=CC(C(=O)O)=C2)N1 BB32-2930 [0,1,0,1,0,0|2,0,0]=4 192 B14R2.601 CC1=NC2=C(C=C(C(=O)O)C=C2)S1 BB52-0734 [0,1,0,1,0,0|1,1,0]=4 193 B14R2.601 CC1=NC2=CC(C(=O)O)=CC=C2N1 BB52-0255 [0,1,0,1,0,0|2,0,0]=4 194 B14R2.601 CN1C=C2C=C(C(=O)O)C=CC2=N1 BB31-1385 [0,1,0,1,0,0|2,0,0]=4 195 B14R2.601 CN1C=C2C=CC(C(=O)O)=CC2=N1 BB31-8867 [0,1,0,1,0,0|2,0,0]=4 196 B14R2.601 O=C1NC2=C(C=C(C(=O)O)C=C2)O1 BB32-2418 [0,1,0,1,0,0|1,0,1]=4 197 B14R2.601 O=C1NC2=CC(C(=O)O)=CC=C2O1 BB51-2785 [0,1,0,1,0,0|1,0,1]=4 198 B14R2.781 O=C(O)C1=CC2=C(C=C1)CCCO2 BB32-2723 [0,1,0,1,0,0|1,0,0]=3 199 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCC2 BB31-1131 [0,1,0,1,0,0|2,0,0]=4 200 B14R2.781 O=C(O)C1=CC2=C(C=C1)OCCO2 BB52-1788 [0,1,0,1,0,0|0,0,0]=2 201 B14R2.624 NC1=C([N+](=O)[O-])C=C2OCOC2=C1 BB52-5583 [0,1,0,1,0,0|1,0,1]=4 202 B14R2.624 O=C(O)C1=C(Br)C=C2OCOC2=C1 BB32-2996 [0,1,0,1,0,0|0,0,0]=2 203 B14R2.5719 O=C(O)C1=CC2=C(C=C1)B(O)OC2 BB31-3486 [0,1,0,1,0,0|2,0,0]=4 204 B14R2.5719 O=C(O)C1=CC2=C(C=C1)C(=O)CC2 BB32-1314 [0,1,0,1,0,0|1,0,1]=4 205 B14R2.5998 CC1=C(C(=O)O)C=CC2=C1OCO2 BB32-0399 [0,1,0,1,0,0|0,0,0]=2 206 B10R1.194 CC1=CC=C(C(=O)O)N1C BB31-8717 [1,0,0,0,1,0|2,0,0]=4 207 B10R1.194 CC1=CNC(C(=O)O)=C1C BB31-4790 [1,0,0,0,1,0|2,0,0]=4 208 B10R1.194 CC1=CSC(C(=O)O)=C1C BB31-6323 [1,0,0,0,1,0|2,0,0]=4 209 B10R1.31 COC1=CC=C(C(=O)O)S1 BB31-4536 [1,0,0,0,1,0|1,0,0]=3 210 B10R1.31 COC1=NOC(C(=O)O)=C1 BB31-8364 [1,0,0,0,1,0|2,0,0]=4 211 B10R1.31 CSC1=CC=C(C(=O)O)S1 BB31-4118 [1,0,0,0,1,0|1,1,0]=4 212 B12R1.438 COC1=CC=CC(CC(=O)O)=N1 BB31-5579 [1,0,0,0,0,1|1,0,0]=3 213 B12R1.57 CNC1=C(C(=O)O)C=CC(F)=C1 BB31-1863 [0,0,0,0,1,1|2,0,0]=4 214 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 BB31-9317 [0,0,0,0,1,1|1,0,0]=3 215 B12R1.57 COC1=C(C(=O)O)C=CC(N)=N1 BB31-8765 [0,0,0,0,1,1|1,0,0]=3 216 B12R1.57 COC1=CC(Br)=CN=C1C(=O)O BB31-0395 [0,0,0,0,1,1|2,0,0]=4 217 B12R1.87 CCC1=C(Br)C=CC=C1C(=O)O BB31-5768 [0,0,0,0,1,1|2,0,0]=4 218 B14R1.42 COC1=C(O)C=CC(CC[N+](=O)[O-])=C1 BB32-2250 [0,0,0,0,0,2|1,0,1]=4