0 B9R1.15 BrC1=NC=CC=C1C=O PI-39999 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.15 BrCc1ccccc1Br PI-11809 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.15 BrCc1ccccc1I PI-29573 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.15 C#CC1=CC=CC=C1Cl PI-30962 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.15 C#CC1=CC=CC=C1F PI-30912 [0,0,0,0,0,0|2,0,1]=3 5 B9R1.15 C#Cc1ccccc1Br PI-30911 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.15 C1=CC(=C(N=C1)C#N)I PI-35289 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.15 C1=CC(=C(N=C1)C#N)O PI-31932 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.15 C1=CC(=C(N=C1)C=O)O PI-20863 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.15 C1=CC(=C(N=C1)CBr)Br PI-47183 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.15 C1=CC(=C(N=C1)CN)F PI-49343 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.15 C1=CC(=C(N=C1)CO)Br PI-44198 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.15 C1=CC(=C(N=C1)CO)O PI-16743 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.15 C1=CC(=C(N=C1)Cl)C=O PI-34991 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.15 C1=CC(=C(N=C1)Cl)CO PI-33153 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.15 C1=CC(=C(N=C1)F)C=O PI-39564 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.15 C1=CC(=C(N=C1)N)C#N PI-28310 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.15 C1=CC(=C(N=C1)NN)Cl PI-45938 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.15 C1=CC=C(C(=C1)C#N)I PI-10113 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.15 C1=CC=C(C(=C1)C=O)Br PI-11807 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.15 C1=CC=C(C(=C1)CBr)Cl PI-11821 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.15 C1=CC=C(C(=C1)CBr)F PI-28536 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.15 C1=CC=C(C(=C1)CCl)F PI-34128 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.15 C1=CC=C(C(=C1)CN)Br PI-11810 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.15 C1=CC=C(C(=C1)CN)Cl PI-11822 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.15 C1=CC=C(C(=C1)CN)F PI-31326 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.15 C1=CC=C(C(=C1)CO)Br PI-30250 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.15 C1=CC=C(C(=C1)CO)Cl PI-23166 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.15 C1=CC=C(C(=C1)CO)N PI-11798 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.15 C1=CC=C(C(=C1)CS)Br PI-20548 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.15 C1=CC=C(C(=C1)CS)Cl PI-11007 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.15 C1=CC=C(C(=C1)NN)Br PI-11813 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.15 C1=CC=C(C(=C1)NN)Cl PI-29581 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.15 C1=CC=C(C(=C1)NN)F PI-16908 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.15 C1=CC=C(C(=C1)NN)F PI-31140 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.15 C1=CN=CC(=C1C#N)Cl PI-32517 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.15 C1=CN=CC(=C1C#N)N PI-35285 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.15 C1=CN=CC(=C1C=O)O PI-34863 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.15 C1=CN=CC(=C1Cl)C#N PI-48248 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.15 C1=CN=CC(=C1Cl)CO PI-34716 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.15 C1=CN=CC(=C1N)C=O PI-14094 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.15 C1=CNC(=O)C(=C1)C#N PI-35286 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.15 C=CC1=CC=CC=C1Br PI-14519 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.15 C=Cc1ccccc1F PI-33746 [0,0,0,0,0,0|2,0,1]=3 44 B9R1.15 CC1=C(N=CC=C1)C#N PI-16162 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.15 CC1=CC=CC=C1C=O PI-27677 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.15 CC1=NC=CN=C1SC PI-11047 [0,0,0,0,0,0|2,1,0]=3 47 B9R1.15 CCC1=CC=CC=C1Br PI-19276 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.15 CCC1=CC=CC=C1Cl PI-19970 [0,0,0,0,0,0|2,0,0]=2 49 B9R1.15 CCC1=CC=CC=C1I PI-19242 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.15 CCC1=NC=CN=C1C PI-11842 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.15 CC[N+]1=CC=CC=C1Br PI-14423 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.15 CC[N+]1=CC=CC=C1C PI-39505 [0,0,0,0,0,0|2,0,0]=2 53 B9R1.15 CCc1ccccc1C PI-36541 [0,0,0,0,0,0|1,0,0]=1 54 B9R1.15 CCc1nccnc1C PI-11841 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.15 CCc1ncncc1F PI-15252 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.15 CNC1=CC=CC=C1F PI-28236 [0,0,0,0,0,0|2,0,0]=2 57 B9R1.15 CNC1=CC=CC=C1N PI-23401 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.15 CNC1=CC=CC=C1N PI-28564 [0,0,0,0,0,0|2,0,0]=2 59 B9R1.15 CNc1cccnc1Cl PI-32645 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.15 COC1=C(C=CC=N1)Br PI-26112 [0,0,0,0,0,0|2,0,0]=2 61 B9R1.15 COC1=C(C=CC=N1)N PI-24213 [0,0,0,0,0,0|2,0,0]=2 62 B9R1.15 COC1=C(N=CC=C1)I PI-26982 [0,0,0,0,0,0|2,0,0]=2 63 B9R1.15 COC1=CC=CC=C1Br PI-34200 [0,0,0,0,0,0|1,0,0]=1 64 B9R1.15 COC1=CC=CC=C1Cl PI-34199 [0,0,0,0,0,0|1,0,0]=1 65 B9R1.15 COC1=CC=CC=C1F PI-12348 [0,0,0,0,0,0|1,0,0]=1 66 B9R1.15 COC1=CC=CC=C1I PI-50209 [0,0,0,0,0,0|1,0,0]=1 67 B9R1.15 COC1=NC=NC=C1Br PI-45125 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.15 COC1=NC=NC=C1Cl PI-45151 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.15 COc1ccc[nH]c1=O PI-26288 [0,0,0,0,0,0|2,0,0]=2 70 B9R1.15 COc1ccccc1S PI-21364 [0,0,0,0,0,0|1,0,0]=1 71 B9R1.15 COc1cccnc1Br PI-26342 [0,0,0,0,0,0|2,0,0]=2 72 B9R1.15 COc1cccnc1Cl PI-27671 [0,0,0,0,0,0|2,0,0]=2 73 B9R1.15 COc1cncnc1Cl PI-36368 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.15 COc1nccnc1C PI-11042 [0,0,0,0,0,0|2,0,0]=2 75 B9R1.15 CSC1=CC=CC=C1Br PI-11815 [0,0,0,0,0,0|1,1,0]=2 76 B9R1.15 CSC1=CC=CC=C1Cl PI-11833 [0,0,0,0,0,0|1,1,0]=2 77 B9R1.15 CSC1=CC=CC=C1F PI-11849 [0,0,0,0,0,0|1,1,0]=2 78 B9R1.15 CSC1=CC=CC=C1O PI-20874 [0,0,0,0,0,0|1,1,0]=2 79 B9R1.15 CSc1ccccc1I PI-13705 [0,0,0,0,0,0|1,1,0]=2 80 B9R1.15 N#Cc1ccccc1Br PI-11808 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.15 N#Cc1ccccc1Cl PI-34735 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.15 N#Cc1ccccc1F PI-27555 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.15 N#Cc1ccccc1N PI-11517 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.15 N#Cc1ccccc1O PI-11836 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.15 N#Cc1cccnc1Cl PI-16699 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.15 N#Cc1cccnc1F PI-24385 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.15 N#Cc1ccncc1F PI-32520 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.15 N#Cc1cnccc1Br PI-35912 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.15 N#Cc1cnccc1C PI-16376 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.15 N#Cc1ncccc1Br PI-32202 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.15 N#Cc1ncccc1Cl PI-32518 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.15 N#Cc1ncccc1F PI-32519 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.15 NC1=NC=CC=C1OC PI-39996 [0,0,0,0,0,0|2,0,0]=2 94 B9R1.15 NCc1ccccc1Br PI-38543 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.15 NCc1ncccc1C PI-36263 [0,0,0,0,0,0|3,0,0]=3 96 B9R1.15 NNc1ccccc1C PI-29808 [0,0,0,0,0,0|2,0,0]=2 97 B9R1.15 O=CC1=C(Cl)C=CN=C1 PI-37019 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.15 O=CC1=CC=CC=C1I PI-27403 [0,0,0,0,0,0|3,0,0]=3 99 B9R1.15 O=Cc1ccccc1Cl PI-34387 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.15 O=Cc1ccccc1F PI-27600 [0,0,0,0,0,0|3,0,0]=3 101 B9R1.15 O=Cc1cccnc1N PI-15940 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.15 O=Cc1cnccc1Br PI-36813 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.15 OCc1ccccc1F PI-28537 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.15 OCc1ccccc1O PI-36548 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.15 OCc1cccnc1N PI-33953 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.15 SCc1ccccc1F PI-23494 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.15 [C-]#[N+]c1ccccc1Br PI-22495 [0,0,0,0,0,0|2,0,1]=3 108 B8R1.2 BrCC1=CC=CC=C1 PI-36476 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.2 C#CC1=CC=CC=C1 PI-48958 [1,0,0,0,0,0|1,0,1]=3 110 B8R1.2 C#CC1=NC=CC=C1 PI-37137 [1,0,0,0,0,0|2,0,1]=4 111 B8R1.2 C1=CC(=CN=C1)CCl PI-16717 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 C1=CC(=CN=C1)NN PI-39291 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.2 C1=CC=NC(=C1)NN PI-46991 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 C1=CC=NC(=C1)NN PI-50652 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 C1=CN=CC=C1CCl PI-31734 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 C1=CN=CC=C1CO PI-16744 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 CCC1=CC=CC=N1 PI-49466 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.2 CCC1=NC=CN=C1 PI-11040 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.2 CC[N+]1=CC=CC=C1 PI-13342 [1,0,0,0,0,0|2,0,0]=3 120 B8R1.2 CC[N+]1=CC=CC=C1 PI-13347 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.2 CNC1=CC=CC=N1 PI-11864 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.2 CNC1=CC=NC=C1 PI-23603 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.2 CNC1=CN=CC=C1 PI-11328 [1,0,0,0,0,0|2,0,0]=3 124 B8R1.2 COC1=CC=CC=N1 PI-33887 [1,0,0,0,0,0|1,0,0]=2 125 B8R1.2 COC1=CC=NC=C1 PI-10034 [1,0,0,0,0,0|1,0,0]=2 126 B8R1.2 COC1=CN=CC=C1 PI-33889 [1,0,0,0,0,0|1,0,0]=2 127 B8R1.2 COC1=NC=CN=C1 PI-11859 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.2 CSC1=CC=CC=N1 PI-16757 [1,0,0,0,0,0|1,1,0]=3 129 B8R1.2 CSC1=NC=CN=C1 PI-11048 [1,0,0,0,0,0|2,1,0]=4 130 B8R1.2 ClCC1=NC=CC=C1 PI-11827 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.2 ClCc1ccccn1 PI-16716 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.2 NCC1=CC=CC=C1 PI-37209 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.2 NCC1=CC=NC=C1 PI-41875 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.2 NCc1ccccn1 PI-33905 [1,0,0,0,0,0|3,0,0]=4 135 B8R1.2 NCc1cccnc1 PI-15236 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.2 NCc1ccncc1 PI-31790 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.2 NNC1=CC=CC=C1 PI-41551 [1,0,0,0,0,0|2,0,0]=3 138 B8R1.2 O=Cc1ccccn1 PI-33895 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.2 O=Cc1cccnc1 PI-33908 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.2 O=Cc1ccncc1 PI-13140 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.2 OCC1=CC=CN=C1 PI-11019 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.2 OCC1=NC=CC=C1 PI-16261 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.2 OCc1ccncc1 PI-16686 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.2 ONc1ccccc1 PI-38448 [1,0,0,0,0,0|2,0,0]=3 145 B8R1.2 [C-]#CC1=CC=CC=C1 PI-48435 [1,0,0,0,0,0|1,0,1]=3 146 B8R1.5 BrC1=NC=CC=C1N PI-28492 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.5 Brc1ccccc1Br PI-38145 [1,0,0,0,0,0|2,0,0]=3 148 B8R1.5 Brc1cccnc1Cl PI-28602 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.5 Brc1cccnc1N PI-30126 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.5 C1=CC(=C(N=C1)Br)Br PI-28122 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.5 C1=CC(=C(N=C1)Br)Cl PI-27992 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.5 C1=CC(=C(N=C1)Br)F PI-34450 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.5 C1=CC(=C(N=C1)Cl)Cl PI-10112 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.5 C1=CC(=C(N=C1)Cl)F PI-16375 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.5 C1=CC(=C(N=C1)Cl)I PI-11389 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.5 C1=CC(=C(N=C1)Cl)O PI-16697 [1,0,0,0,0,0|2,0,0]=3 157 B8R1.5 C1=CC(=C(N=C1)F)I PI-16040 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.5 C1=CC(=C(N=C1)F)N PI-16374 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.5 C1=CC(=C(N=C1)F)O PI-40205 [1,0,0,0,0,0|2,0,0]=3 160 B8R1.5 C1=CC(=C(N=C1)N)Cl PI-31793 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.5 C1=CC(=O)N(C=C1)O PI-43160 [1,0,0,0,0,0|2,0,0]=3 162 B8R1.5 C1=CC(=S)N(C=C1)O PI-13313 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.5 C1=CC(=S)N(C=C1)O PI-15830 [1,0,0,0,0,0|2,0,0]=3 164 B8R1.5 C1=CC=C(C(=C1)Cl)Br PI-41004 [1,0,0,0,0,0|2,0,0]=3 165 B8R1.5 C1=CC=C(C(=C1)Cl)Cl PI-21004 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.5 C1=CC=C(C(=C1)F)I PI-23606 [1,0,0,0,0,0|2,0,0]=3 167 B8R1.5 C1=CC=C(C(=C1)F)S PI-16911 [1,0,0,0,0,0|1,1,0]=3 168 B8R1.5 C1=CC=C(C(=C1)N)I PI-10964 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.5 C1=CC=C(C(=C1)N)N PI-17100 [1,0,0,0,0,0|2,0,0]=3 170 B8R1.5 C1=CC=C(C(=C1)O)F PI-11848 [1,0,0,0,0,0|1,0,0]=2 171 B8R1.5 C1=CC=[N+](C(=C1)Br)[O-] PI-10991 [1,0,0,0,0,0|2,0,1]=4 172 B8R1.5 C1=CC=[N+](C(=C1)Br)[O-] PI-31783 [1,0,0,0,0,0|2,0,1]=4 173 B8R1.5 C1=CC=[N+](C(=C1)Cl)[O-] PI-11832 [1,0,0,0,0,0|2,0,1]=4 174 B8R1.5 C1=CC=[N+](C(=C1)Cl)[O-] PI-42568 [1,0,0,0,0,0|2,0,1]=4 175 B8R1.5 C1=CN=C(C(=N1)C)N PI-40999 [1,0,0,0,0,0|3,0,0]=4 176 B8R1.5 C1=CN=CC(=C1Cl)Br PI-28453 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.5 C1=CN=CC(=C1Cl)Cl PI-28640 [1,0,0,0,0,0|3,0,0]=4 178 B8R1.5 C1=CN=CC(=C1Cl)F PI-10413 [1,0,0,0,0,0|3,0,0]=4 179 B8R1.5 C1=CN=CC(=C1Cl)N PI-28262 [1,0,0,0,0,0|3,0,0]=4 180 B8R1.5 C1=CN=CC(=C1I)F PI-34425 [1,0,0,0,0,0|3,0,0]=4 181 B8R1.5 C1=CNC(=O)C(=C1)Cl PI-35282 [1,0,0,0,0,0|2,0,1]=4 182 B8R1.5 C1=CNC(=O)C(=C1)F PI-34509 [1,0,0,0,0,0|2,0,1]=4 183 B8R1.5 C1=CNC(=O)C(=C1)N PI-10375 [1,0,0,0,0,0|2,0,1]=4 184 B8R1.5 C1=CNC(=S)C(=C1)N PI-36113 [1,0,0,0,0,0|2,1,0]=4 185 B8R1.5 C1=CNC=C(C1=O)N PI-28705 [1,0,0,0,0,0|2,0,1]=4 186 B8R1.5 CC1=C(Br)C=CN=C1 PI-40508 [1,0,0,0,0,0|2,0,0]=3 187 B8R1.5 CC1=C(C=CC=N1)Br PI-23460 [1,0,0,0,0,0|2,0,0]=3 188 B8R1.5 CC1=C(C=CN=C1)Cl PI-40252 [1,0,0,0,0,0|2,0,0]=3 189 B8R1.5 CC1=C(C=CN=C1)N PI-14242 [1,0,0,0,0,0|2,0,0]=3 190 B8R1.5 CC1=C(C=NC=C1)F PI-16771 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.5 CC1=C(C=NC=C1)O PI-34258 [1,0,0,0,0,0|1,0,0]=2 192 B8R1.5 CC1=C(N=CC=C1)F PI-16763 [1,0,0,0,0,0|2,0,0]=3 193 B8R1.5 CC1=C(N=CC=C1)N PI-33812 [1,0,0,0,0,0|2,0,0]=3 194 B8R1.5 CC1=CC=CC=C1I PI-10980 [1,0,0,0,0,0|1,0,0]=2 195 B8R1.5 CC1=CC=CC=[N+]1N PI-45950 [1,0,0,0,0,0|2,0,0]=3 196 B8R1.5 CC1=NC=CN=C1C PI-11734 [1,0,0,0,0,0|2,0,0]=3 197 B8R1.5 CC1=NC=CN=C1Cl PI-11816 [1,0,0,0,0,0|3,0,0]=4 198 B8R1.5 CC1=NC=CNC1=O PI-40998 [1,0,0,0,0,0|2,0,1]=4 199 B8R1.5 Cc1ccccc1F PI-34118 [1,0,0,0,0,0|1,0,0]=2 200 B8R1.5 Cc1cccnc1Br PI-28405 [1,0,0,0,0,0|2,0,0]=3 201 B8R1.5 Cc1cccnc1Cl PI-33878 [1,0,0,0,0,0|2,0,0]=3 202 B8R1.5 Cc1ccncc1Br PI-23509 [1,0,0,0,0,0|2,0,0]=3 203 B8R1.5 Cc1ccncc1N PI-24336 [1,0,0,0,0,0|2,0,0]=3 204 B8R1.5 Cc1ccnnc1Cl PI-34083 [1,0,0,0,0,0|3,0,0]=4 205 B8R1.5 Cc1cnccc1Br PI-33360 [1,0,0,0,0,0|2,0,0]=3 206 B8R1.5 Cc1cnccc1O PI-38275 [1,0,0,0,0,0|1,0,0]=2 207 B8R1.5 Clc1cccc[n+]1C PI-17309 [1,0,0,0,0,0|2,0,0]=3 208 B8R1.5 FC1=NC=CC=C1Br PI-34449 [1,0,0,0,0,0|3,0,0]=4 209 B8R1.5 Fc1ccccc1Br PI-33063 [1,0,0,0,0,0|2,0,0]=3 210 B8R1.5 Fc1ccccc1F PI-11671 [1,0,0,0,0,0|2,0,0]=3 211 B8R1.5 Fc1cnccc1Br PI-10110 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.5 Fc1ncccc1F PI-16764 [1,0,0,0,0,0|3,0,0]=4 213 B8R1.5 IC1=CC=CC=C1Br PI-21523 [1,0,0,0,0,0|2,0,0]=3 214 B8R1.5 IC1=CC=CC=C1I PI-21274 [1,0,0,0,0,0|2,0,0]=3 215 B8R1.5 Ic1cccnc1N PI-36512 [1,0,0,0,0,0|3,0,0]=4 216 B8R1.5 NC1=C(C=NC=C1)F PI-40470 [1,0,0,0,0,0|3,0,0]=4 217 B8R1.5 Nc1cccnc1C PI-13066 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.5 Nc1cccnc1Cl PI-24529 [1,0,0,0,0,0|3,0,0]=4 219 B8R1.5 Nc1cccnc1N PI-10159 [1,0,0,0,0,0|3,0,0]=4 220 B8R1.5 Nc1ccncc1Br PI-16045 [1,0,0,0,0,0|3,0,0]=4 221 B8R1.5 Nc1cnccc1I PI-36511 [1,0,0,0,0,0|3,0,0]=4 222 B8R1.5 Nc1cnccc1N PI-16569 [1,0,0,0,0,0|3,0,0]=4 223 B8R1.5 O=c1[nH]cccc1C PI-16687 [1,0,0,0,0,0|1,0,1]=3 224 B8R1.5 O=c1ccccn1C PI-10985 [1,0,0,0,0,0|1,0,1]=3 225 B8R1.5 OC1=C(I)C=CC=C1 PI-10953 [1,0,0,0,0,0|1,0,0]=2 226 B8R1.5 OC1=NC=CC=C1Br PI-37057 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.5 Oc1ccccc1Br PI-10952 [1,0,0,0,0,0|1,0,0]=2 228 B8R1.5 Oc1ccccc1O PI-31351 [1,0,0,0,0,0|1,0,0]=2 229 B8R1.5 Oc1ccccc1S PI-20878 [1,0,0,0,0,0|1,0,0]=2 230 B8R1.5 Oc1cccnc1Br PI-16727 [1,0,0,0,0,0|2,0,0]=3 231 B8R1.5 Oc1cccnc1C PI-13315 [1,0,0,0,0,0|1,0,0]=2 232 B8R1.5 Oc1cccnc1N PI-16260 [1,0,0,0,0,0|2,0,0]=3 233 B8R1.5 Oc1ccncc1Br PI-38971 [1,0,0,0,0,0|2,0,0]=3 234 B8R1.5 Oc1ncccc1O PI-11386 [1,0,0,0,0,0|2,0,0]=3 235 B8R1.5 [S-]c1cccc[n+]1[O-] PI-15322 [1,0,0,0,0,0|2,0,1]=4 236 B8R1.5 [S-]c1cccc[n+]1[O-] PI-15323 [1,0,0,0,0,0|2,0,1]=4 237 B10R1.2 C1=CC(=C(C(=C1)Br)O)C=O PI-27283 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.2 C1=CC(=C(C(=C1)Cl)Cl)C#N PI-13129 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.2 C1=CC(=C(C(=C1)Cl)F)C#N PI-10522 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.2 C1=CC(=C(C(=C1)Cl)F)CBr PI-28865 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.2 C1=CC(=C(C(=C1)Cl)F)NN PI-10632 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.2 C1=CC(=C(C(=C1)Cl)N)C#N PI-11515 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.2 C1=CC(=C(C(=C1)F)Br)C#N PI-10685 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C#N PI-10693 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.2 C1=CC(=C(C(=C1)F)Cl)C=O PI-28939 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.2 C1=CC(=C(C(=C1)F)F)C#N PI-28273 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.2 C1=CC(=C(C(=C1)F)F)C=O PI-28322 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.2 C1=CC(=C(C(=C1)F)F)CBr PI-28061 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.2 C1=CC(=C(C(=C1)F)F)CN PI-21148 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.2 C1=CC(=C(C(=C1)F)F)CO PI-21147 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.2 C1=CC(=C(C(=C1)F)N)C#N PI-10681 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.2 C1=CC(=C(C(=C1)F)O)C=O PI-18520 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.2 CC1=C(C(=CC=C1)C#N)C PI-21940 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.2 CC1=C(C(=CC=C1)C#N)F PI-10707 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.2 CC1=C(C(=CC=C1)C=O)C PI-10267 [0,1,0,0,0,0|2,0,0]=3 256 B10R1.2 CC1=C(C(=CC=C1)CBr)C PI-19918 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.2 CC1=C(C(=CC=C1)CBr)F PI-23752 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.2 CC1=C(C(=CC=C1)NN)C PI-29705 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.2 CC1=C(C(=CC=C1)OC)C PI-33340 [0,1,0,0,0,0|0,0,0]=1 260 B10R1.2 CC1=C(C=CC=C1Cl)OC PI-19448 [0,1,0,0,0,0|0,0,0]=1 261 B10R1.2 CC1=C(C=CC=C1F)C=O PI-28157 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.2 CC1=C(C=CC=C1N)CO PI-44883 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.2 CC1=C(C=CC=C1N)CO PI-44908 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.2 CC1=C(C=CC=C1OC)N PI-19271 [0,1,0,0,0,0|0,0,0]=1 265 B10R1.2 CCC1=CC=CC(=C1N)C PI-34080 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.2 COC1=C(C(=CC=C1)F)Br PI-34352 [0,1,0,0,0,0|1,0,0]=2 267 B10R1.2 COC1=C(C(=CC=C1)F)F PI-28119 [0,1,0,0,0,0|1,0,0]=2 268 B10R1.2 COC1=C(C(=NC=N1)Cl)Br PI-45157 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.2 COC1=CC=CC(=C1Cl)N PI-34739 [0,1,0,0,0,0|1,0,0]=2 270 B10R1.2 COc1cccc(O)c1Br PI-34766 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.2 COc1cccc(c1N)O PI-38206 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.2 COc1cccc(c1O)O PI-19986 [0,1,0,0,0,0|1,0,0]=2 273 B10R1.2 COc1cn[nH]c(=O)c1Cl PI-38804 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 PI-39859 [0,1,0,0,0,0|0,1,0]=2 275 B10R1.2 FC1=C(Cl)C(CBr)=CC=C1 PI-39696 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.2 N#Cc1cccc(Br)c1F PI-21438 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.2 N#Cc1cccc(c1C)F PI-28230 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.2 N#Cc1cccc(c1I)F PI-10699 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.2 N#Cc1cccc(c1N)Br PI-38203 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.2 N#Cc1cccc(c1O)O PI-31955 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.2 NCC1=CC=CC(F)=C1Br PI-46659 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.2 NCc1cccc(Cl)c1F PI-20073 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.2 NNC1=CC=CC(Cl)=C1Cl PI-21067 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.2 O=CC1=CC=CC(F)=C1Br PI-28928 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.2 O=CC1=CC=CC(F)=C1I PI-28940 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.2 O=Cc1cccc(Br)c1F PI-36808 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.2 O=Cc1cccc(C)c1F PI-28944 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.2 O=Cc1cccc(C)c1O PI-27937 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.2 O=Cc1cccc(Cl)c1Cl PI-12552 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.2 O=Cc1cccc(Cl)c1O PI-26254 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.2 O=Cc1cccc(O)c1O PI-21380 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.2 O=Cc1cccc(c1F)Cl PI-28866 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.4 BrCCc1ccccc1C PI-21423 [0,1,0,0,0,0|1,0,0]=2 294 B10R1.4 BrCCc1ccccc1Cl PI-21413 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.4 BrCCc1ccccc1F PI-34239 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.4 C1=CC=C(C(=C1)C=NN)O PI-27488 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.4 C1=CC=C(C(=C1)C=NO)Br PI-27497 [0,1,0,0,0,0|3,0,0]=4 298 B10R1.4 C1=CC=C(C(=C1)C=NO)Cl PI-23126 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.4 C1=CC=C(C(=C1)CC#N)Br PI-22282 [0,1,0,0,0,0|2,0,1]=4 300 B10R1.4 C1=CC=C(C(=C1)CC#N)F PI-16866 [0,1,0,0,0,0|2,0,1]=4 301 B10R1.4 C1=CC=C(C(=C1)CCO)F PI-23810 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.4 C1=CC=C(C(=C1)CNN)F PI-50605 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.4 C1=CC=C(C(=C1)N=C=O)Br PI-14503 [0,1,0,0,0,0|2,0,1]=4 304 B10R1.4 C1=CC=C(C(=C1)N=C=O)Cl PI-11418 [0,1,0,0,0,0|2,0,1]=4 305 B10R1.4 C1=CC=C(C(=C1)N=C=S)Br PI-14504 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.4 C1=CC=C(C(=C1)N=C=S)F PI-19528 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.4 C=CCC1=CC=CC=C1O PI-46039 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.4 CC1=CC=CC=C1N=C=O PI-11410 [0,1,0,0,0,0|1,0,1]=3 309 B10R1.4 CCNC1=CC=CC=C1F PI-22091 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.4 CCOC1=CC=CC=C1F PI-23815 [0,1,0,0,0,0|1,0,0]=2 311 B10R1.4 CCOC1=CC=CC=C1N PI-30971 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.4 CCOC1=NC=CN=C1C PI-11922 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.4 CCOc1ccncc1N PI-33891 [0,1,0,0,0,0|2,0,0]=3 314 B10R1.4 C[N+]1=CC=CC=C1C=NO PI-17371 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.4 N#CCc1ccccc1Cl PI-11829 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.4 N#CCc1ccccc1N PI-16130 [0,1,0,0,0,0|2,0,1]=4 317 B10R1.4 NC1=NC=CN=C1OCC PI-46792 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.4 NCCc1ccccc1Br PI-39292 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.4 NCCc1ccccc1Cl PI-20209 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.4 NCCc1ccccc1F PI-38584 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.4 NOCc1ccccc1Cl PI-39246 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.4 O=C=Nc1ccccc1F PI-26192 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.4 [C-]#[N+]Cc1ccccc1Cl PI-23174 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.20 C#CC1=CC=CC=C1C=O PI-26604 [0,1,0,0,0,0|1,0,2]=4 325 B10R1.20 C#Cc1ccccc1OC PI-30918 [0,1,0,0,0,0|0,0,1]=2 326 B10R1.20 C1=CC=C(C(=C1)C=O)C#N PI-11835 [0,1,0,0,0,0|2,0,1]=4 327 B10R1.20 C1=CC=C(C(=C1)CBr)CBr PI-19978 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.20 C1=CC=C(C(=C1)CCl)C#N PI-11826 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.20 C1=CC=C(C(=C1)CO)CO PI-11672 [0,1,0,0,0,0|2,0,0]=3 330 B10R1.20 CCC1=CC=CC=C1C=O PI-35265 [0,1,0,0,0,0|1,0,1]=3 331 B10R1.20 CCC1=CC=CC=C1NN PI-12293 [0,1,0,0,0,0|2,0,0]=3 332 B10R1.20 CCC1=CC=CC=C1NN PI-50566 [0,1,0,0,0,0|2,0,0]=3 333 B10R1.20 CCC1=NC=CN=C1CC PI-11049 [0,1,0,0,0,0|3,0,0]=4 334 B10R1.20 CCC1=NC=CN=C1OC PI-11043 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.20 CCC1=NC=CN=C1SC PI-11923 [0,1,0,0,0,0|2,1,0]=4 336 B10R1.20 CCc1ccccc1CC PI-38722 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.20 COC1=C(C=NC=C1)C=O PI-50082 [0,1,0,0,0,0|1,0,1]=3 338 B10R1.20 COC1=CC=CC=C1CN PI-31715 [0,1,0,0,0,0|0,0,0]=1 339 B10R1.20 COC1=CC=CC=C1NN PI-29852 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.20 COC1=CC=CC=C1NN PI-50513 [0,1,0,0,0,0|1,0,0]=2 341 B10R1.20 COC1=CC=CC=C1SC PI-11860 [0,1,0,0,0,0|0,0,0]=1 342 B10R1.20 COc1ccccc1CCl PI-34182 [0,1,0,0,0,0|0,0,0]=1 343 B10R1.20 COc1ncccc1C=O PI-26862 [0,1,0,0,0,0|1,0,1]=3 344 B10R1.20 COc1ncccc1OC PI-16034 [0,1,0,0,0,0|1,0,0]=2 345 B10R1.20 CSC1=CC=CC=C1C=O PI-27861 [0,1,0,0,0,0|0,1,1]=3 346 B10R1.20 N#Cc1ccccc1CBr PI-12730 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.20 N#Cc1ccccc1CN PI-38828 [0,1,0,0,0,0|2,0,0]=3 348 B10R1.20 N#Cc1ccccc1CO PI-38221 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.20 N#Cc1ccccc1OC PI-11857 [0,1,0,0,0,0|0,0,1]=2 350 B10R1.20 O=Cc1ccccc1C=O PI-31254 [0,1,0,0,0,0|2,0,1]=4 351 B10R1.25 BrCc1ccc(cc1F)F PI-28304 [0,1,0,0,0,0|3,0,0]=4 352 B10R1.25 C(#N)C1=C(C=C(N)C=C1)F PI-38529 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.25 C1=CC(=C(C=C1Br)Cl)C#N PI-41206 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.25 C1=CC(=C(C=C1Br)Cl)C=O PI-38898 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.25 C1=CC(=C(C=C1Br)F)CBr PI-11844 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.25 C1=CC(=C(C=C1Br)F)CN PI-14436 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.25 C1=CC(=C(C=C1Br)F)CN PI-31021 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.25 C1=CC(=C(C=C1Br)F)CO PI-14434 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.25 C1=CC(=C(C=C1Br)O)C#N PI-43950 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C#N PI-16132 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CCl PI-33404 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-11745 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN PI-34158 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.25 C1=CC(=C(C=C1Cl)F)C#N PI-10694 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.25 C1=CC(=C(C=C1Cl)F)C=O PI-28681 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.25 C1=CC(=C(C=C1Cl)F)CO PI-40484 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.25 C1=CC(=C(C=C1Cl)F)NN PI-50547 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.25 C1=CC(=C(C=C1F)Br)C#N PI-16379 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.25 C1=CC(=C(C=C1F)Br)C=O PI-10440 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.25 C1=CC(=C(C=C1F)Br)CBr PI-28684 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.25 C1=CC(=C(C=C1F)Cl)C#N PI-28676 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O PI-28857 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.25 C1=CC(=C(C=C1F)Cl)CBr PI-20076 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.25 C1=CC(=C(C=C1F)Cl)CN PI-20071 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.25 C1=CC(=C(C=C1F)Cl)NN PI-50545 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.25 C1=CC(=C(C=C1F)F)NN PI-31217 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.25 C1=CC(=C(C=C1F)I)CBr PI-33648 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.25 C1=CC(=C(C=C1F)N)C=O PI-44252 [0,1,0,0,0,0|3,0,0]=4 379 B10R1.25 C1=CC(=C(C=C1F)O)C=O PI-18485 [0,1,0,0,0,0|3,0,0]=4 380 B10R1.25 C1=CC(=C(C=C1I)Br)C=O PI-26357 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.25 C1=CC(=C(C=C1I)F)C=O PI-28942 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.25 C1=CC(=C(C=C1N)N)C=O PI-44093 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.25 C1=CC(=C(C=C1O)O)CO PI-11751 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.25 CC1=C(C=CC(=C1)Br)C#N PI-22131 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.25 CC1=C(C=CC(=C1)Br)OC PI-21586 [0,1,0,0,0,0|0,0,0]=1 386 B10R1.25 CC1=C(C=CC(=C1)Cl)NN PI-29295 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.25 CC1=C(C=CC(=C1)Cl)OC PI-19447 [0,1,0,0,0,0|0,0,0]=1 388 B10R1.25 CC1=C(C=CC(=C1)F)C#N PI-10521 [0,1,0,0,0,0|2,0,0]=3 389 B10R1.25 CC1=C(C=CC(=C1)F)C=O PI-10459 [0,1,0,0,0,0|2,0,0]=3 390 B10R1.25 CC1=C(C=CC(=N1)Cl)C#N PI-44536 [0,1,0,0,0,0|3,0,0]=4 391 B10R1.25 CC1=CC(=C(C=C1)C#N)C PI-23422 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.25 CC1=CC(=C(C=C1)C#N)N PI-30405 [0,1,0,0,0,0|3,0,0]=4 393 B10R1.25 CC1=CC(=C(C=C1)C=O)Br PI-26931 [0,1,0,0,0,0|3,0,0]=4 394 B10R1.25 CC1=CC(=C(C=C1)C=O)F PI-31460 [0,1,0,0,0,0|3,0,0]=4 395 B10R1.25 CC1=CC(=C(C=C1)CCl)C PI-23825 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.25 CC1=CC(=C(C=C1)CO)N PI-26925 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.25 CC1=CC(=C(C=C1)NN)C PI-29747 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.25 CC1=CC(=C(C=C1)NN)Cl PI-20171 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.25 CC1=CC(=C(C=C1)OC)Cl PI-19323 [0,1,0,0,0,0|1,0,0]=2 400 B10R1.25 CC1=CC(=C(C=C1)OC)F PI-23730 [0,1,0,0,0,0|1,0,0]=2 401 B10R1.25 CC1=CC(=C(C=C1)OC)I PI-19656 [0,1,0,0,0,0|1,0,0]=2 402 B10R1.25 CC1=CC(=C(C=C1)[N+]#[C-])Br PI-22160 [0,1,0,0,0,0|2,0,1]=4 403 B10R1.25 CC1=CC(=CN=C1C=O)Br PI-41887 [0,1,0,0,0,0|3,0,0]=4 404 B10R1.25 CC1=CC(=NC=C1C#N)Br PI-44897 [0,1,0,0,0,0|3,0,0]=4 405 B10R1.25 CC1=CC(=NC=C1C#N)Br PI-44922 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.25 CC1=CC(Br)=CN=C1OC PI-46636 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.25 CC1=CC(I)=CC=C1OC PI-19887 [0,1,0,0,0,0|0,0,0]=1 408 B10R1.25 CC1=CC=C(OC)C(Br)=C1 PI-16425 [0,1,0,0,0,0|1,0,0]=2 409 B10R1.25 CCC1=C(C=C(C=C1)O)O PI-27436 [0,1,0,0,0,0|2,0,0]=3 410 B10R1.25 CCC1=C(N=C(C=C1)C)N PI-30602 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.25 CNC1=CC=C(F)C=C1F PI-21200 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.25 COC1=C(C=C(C=C1)Cl)F PI-33133 [0,1,0,0,0,0|1,0,0]=2 413 B10R1.25 COC1=C(C=C(C=C1)F)Cl PI-20055 [0,1,0,0,0,0|1,0,0]=2 414 B10R1.25 COC1=C(C=C(C=C1)F)F PI-16982 [0,1,0,0,0,0|1,0,0]=2 415 B10R1.25 COC1=C(C=C(C=C1)F)F PI-34388 [0,1,0,0,0,0|1,0,0]=2 416 B10R1.25 COC1=C(C=C(C=C1)F)N PI-34515 [0,1,0,0,0,0|1,0,0]=2 417 B10R1.25 COC1=C(C=C(C=C1)F)O PI-34264 [0,1,0,0,0,0|1,0,0]=2 418 B10R1.25 COC1=C(C=C(C=C1)N)N PI-17225 [0,1,0,0,0,0|1,0,0]=2 419 B10R1.25 COC1=C(C=C(C=N1)Br)I PI-26761 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.25 COC1=C(O)C=C(N)C=C1 PI-27246 [0,1,0,0,0,0|1,0,0]=2 421 B10R1.25 COC1=CN=C(N=C1Cl)Cl PI-11744 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.25 COC1=CNC(=O)NC1=O PI-15321 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.25 COC1=NC=C(C=C1N)Br PI-44976 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.25 COc1ccc(F)cc1S PI-23728 [0,1,0,0,0,0|1,0,0]=2 425 B10R1.25 COc1ccc(S)cc1F PI-23727 [0,1,0,0,0,0|1,0,0]=2 426 B10R1.25 COc1ccc(cc1Br)Cl PI-20603 [0,1,0,0,0,0|1,0,0]=2 427 B10R1.25 COc1ccc(cc1Br)F PI-28540 [0,1,0,0,0,0|1,0,0]=2 428 B10R1.25 COc1ccc(cc1Cl)N PI-38593 [0,1,0,0,0,0|1,0,0]=2 429 B10R1.25 COc1ccc(cc1F)Br PI-16907 [0,1,0,0,0,0|1,0,0]=2 430 B10R1.25 COc1ccc(cc1F)N PI-28446 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.25 COc1ccc(cc1F)O PI-34292 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.25 COc1ncc(cc1Br)F PI-39398 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.25 CSc1ccc(cc1C)O PI-18452 [0,1,0,0,0,0|0,1,0]=2 434 B10R1.25 ClC1=CC(=C(C=O)C=C1)O PI-26343 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.25 ClCc1ccc(cc1Cl)F PI-20080 [0,1,0,0,0,0|3,0,0]=4 436 B10R1.25 FC1=C(C=O)C=CC(=C1)O PI-28419 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.25 N#CC1=CC=C(O)C=C1F PI-16085 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.25 N#Cc1ccc(Cl)cc1N PI-11782 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.25 N#Cc1ccc(O)cc1O PI-11750 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.25 N#Cc1ccc(cc1Cl)N PI-30296 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.25 N#Cc1ccc(cc1F)Br PI-16087 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.25 N#Cc1ccc(cc1F)C PI-28867 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.25 N#Cc1ncc(O)cc1C PI-36497 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.25 NC1=C(C=O)C=CC(=C1)Br PI-41093 [0,1,0,0,0,0|3,0,0]=4 445 B10R1.25 NCc1ccc(cc1C)C PI-27988 [0,1,0,0,0,0|2,0,0]=3 446 B10R1.25 NCc1ccc(cc1F)F PI-28783 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.25 NNc1ccc(cc1F)F PI-31187 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.25 O=CC1=CC=C(F)C=C1F PI-16892 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.25 O=Cc1ccc(Br)cc1F PI-31236 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.25 O=Cc1ccc(C)cc1O PI-20805 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.25 O=Cc1ccc(O)cc1Cl PI-10303 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.25 O=Cc1ccc(O)cc1O PI-11749 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.25 O=Cc1ccc(cc1Br)Cl PI-36966 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.25 O=Cc1ccc(cc1C)C PI-27218 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.25 O=Cc1ccc(cc1C)Cl PI-27562 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.25 O=Cc1ccc(cc1O)Br PI-26320 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.25 OC1=CC(=C(C=O)C=C1)C PI-18542 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.25 OCc1ccc(Cl)cc1Cl PI-12129 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.25 OCc1ccc(F)cc1F PI-28645 [0,1,0,0,0,0|3,0,0]=4 460 B10R1.25 OCc1ccc(cc1Br)F PI-39278 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.25 OCc1ccc(cc1C)C PI-38556 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.25 SCc1ccc(Br)cc1F PI-21443 [0,1,0,0,0,0|3,0,0]=4 463 B10R1.25 [C-]#[N+]c1ccc(Br)cc1F PI-21480 [0,1,0,0,0,0|2,0,1]=4 464 B10R1.25 [C-]#[N+]c1ccc(F)cc1C PI-23767 [0,1,0,0,0,0|1,0,1]=3 465 B10R1.30 BrC1=C(C=C(C=C1)Cl)OC PI-41885 [0,1,0,0,0,0|1,0,0]=2 466 B10R1.30 BrCc1cc(Cl)ccc1Cl PI-38192 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.30 BrCc1cc(Cl)ccc1F PI-20079 [0,1,0,0,0,0|3,0,0]=4 468 B10R1.30 C1=C(Br)C=CC(=C1CO)O PI-12023 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.30 C1=C(Cl)C=CC(=C1C#N)F PI-28659 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.30 C1=C(Cl)C=CC(=C1C#N)N PI-11788 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.30 C1=CC(=C(C=C1Br)C#N)N PI-21368 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.30 C1=CC(=C(C=C1Br)C=O)Br PI-27892 [0,1,0,0,0,0|3,0,0]=4 473 B10R1.30 C1=CC(=C(C=C1Br)C=O)Cl PI-33366 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.30 C1=CC(=C(C=C1Br)C=O)F PI-31330 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.30 C1=CC(=C(C=C1Br)C=O)O PI-29253 [0,1,0,0,0,0|3,0,0]=4 476 B10R1.30 C1=CC(=C(C=C1Br)CN)N PI-44072 [0,1,0,0,0,0|3,0,0]=4 477 B10R1.30 C1=CC(=C(C=C1Br)CO)F PI-14437 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.30 C1=CC(=C(C=C1Br)CO)N PI-46965 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.30 C1=CC(=C(C=C1Cl)C#N)Cl PI-11756 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.30 C1=CC(=C(C=C1Cl)C#N)O PI-44911 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.30 C1=CC(=C(C=C1Cl)C=O)Cl PI-16092 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.30 C1=CC(=C(C=C1Cl)C=O)F PI-10455 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.30 C1=CC(=C(C=C1Cl)C=O)O PI-12029 [0,1,0,0,0,0|3,0,0]=4 484 B10R1.30 C1=CC(=C(C=C1Cl)CCl)Cl PI-27419 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.30 C1=CC(=C(C=C1Cl)CO)Cl PI-30501 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.30 C1=CC(=C(C=C1Cl)CO)O PI-12028 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29450 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.30 C1=CC(=C(C=C1Cl)NN)Cl PI-29640 [0,1,0,0,0,0|3,0,0]=4 489 B10R1.30 C1=CC(=C(C=C1F)C#N)Cl PI-28660 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.30 C1=CC(=C(C=C1F)C#N)F PI-28715 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.30 C1=CC(=C(C=C1F)C#N)N PI-10682 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.30 C1=CC(=C(C=C1F)C=O)Br PI-28896 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.30 C1=CC(=C(C=C1F)C=O)Cl PI-10456 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.30 C1=CC(=C(C=C1F)C=O)N PI-44253 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.30 C1=CC(=C(C=C1F)C=O)O PI-10579 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.30 C1=CC(=C(C=C1F)CBr)Br PI-14438 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.30 C1=CC(=C(C=C1F)CBr)Cl PI-34130 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.30 C1=CC(=C(C=C1F)CBr)F PI-13390 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.30 C1=CC(=C(C=C1F)CN)F PI-31317 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.30 C1=CC(=C(C=C1F)CO)Br PI-42946 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.30 C1=CC(=C(C=C1F)CO)F PI-33073 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.30 C1=CC(=C(C=C1F)NN)Cl PI-50546 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-10633 [0,1,0,0,0,0|3,0,0]=4 504 B10R1.30 C1=CC(=C(C=C1F)NN)F PI-21223 [0,1,0,0,0,0|3,0,0]=4 505 B10R1.30 C1=CC(=C(C=C1I)C#N)F PI-10697 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.30 C1=CC(=C(C=C1I)C=O)F PI-31572 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.30 C1=CC(=C(C=C1I)C=O)O PI-27272 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.30 C1=CC(=C(C=C1I)CO)Br PI-41207 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.30 C1=CC(=C(C=C1N)C#N)F PI-28621 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.30 CC1=C(C=C(C=C1)Cl)OC PI-10564 [0,1,0,0,0,0|0,0,0]=1 511 B10R1.30 CC1=C(C=C(C=C1)F)C#N PI-28817 [0,1,0,0,0,0|2,0,0]=3 512 B10R1.30 CC1=C(C=C(C=C1)F)C=O PI-10582 [0,1,0,0,0,0|2,0,0]=3 513 B10R1.30 CC1=C(C=C(C=C1)F)CBr PI-23755 [0,1,0,0,0,0|2,0,0]=3 514 B10R1.30 CC1=C(C=C(C=C1)F)NN PI-10636 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.30 CC1=CC(=C(C=C1)C)C#C PI-19877 [0,1,0,0,0,0|1,0,1]=3 516 B10R1.30 CC1=CC(=C(C=C1)C)C#N PI-23423 [0,1,0,0,0,0|2,0,0]=3 517 B10R1.30 CC1=CC(=C(C=C1)C)C=O PI-27729 [0,1,0,0,0,0|2,0,0]=3 518 B10R1.30 CC1=CC(=C(C=C1)C)NN PI-29706 [0,1,0,0,0,0|2,0,0]=3 519 B10R1.30 CC1=CC(=C(C=C1)F)C#N PI-28713 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.30 CC1=CC(=C(C=C1)F)C=O PI-10457 [0,1,0,0,0,0|3,0,0]=4 521 B10R1.30 CC1=CC(=C(C=C1)N)C#N PI-34275 [0,1,0,0,0,0|3,0,0]=4 522 B10R1.30 CC1=CC=C(O)C(CC)=N1 PI-33202 [0,1,0,0,0,0|3,0,0]=4 523 B10R1.30 CC1=NC(=C(C=C1)F)OC PI-34436 [0,1,0,0,0,0|2,0,0]=3 524 B10R1.30 CC1=NC(=C(C=C1)N)NC PI-35679 [0,1,0,0,0,0|3,0,0]=4 525 B10R1.30 CCC1=C(C=CC(=C1)O)O PI-19340 [0,1,0,0,0,0|2,0,0]=3 526 B10R1.30 CCc1cc(Br)ccc1I PI-21420 [0,1,0,0,0,0|2,0,0]=3 527 B10R1.30 CNC1=C(C=CC(=C1)F)Br PI-39646 [0,1,0,0,0,0|2,0,0]=3 528 B10R1.30 COC1=C(C=CC(=C1)Br)N PI-44941 [0,1,0,0,0,0|1,0,0]=2 529 B10R1.30 COC1=C(C=CC(=C1)Cl)Cl PI-21000 [0,1,0,0,0,0|1,0,0]=2 530 B10R1.30 COC1=C(C=CC(=C1)Cl)N PI-11332 [0,1,0,0,0,0|1,0,0]=2 531 B10R1.30 COC1=C(C=CC(=C1)F)Br PI-21434 [0,1,0,0,0,0|1,0,0]=2 532 B10R1.30 COC1=C(C=CC(=C1)F)F PI-12727 [0,1,0,0,0,0|1,0,0]=2 533 B10R1.30 COC1=C(C=CC(=C1)N)Br PI-33359 [0,1,0,0,0,0|1,0,0]=2 534 B10R1.30 COC1=C(C=CC(=C1)N)Cl PI-34236 [0,1,0,0,0,0|1,0,0]=2 535 B10R1.30 COC1=C(C=CC(=C1)N)F PI-10622 [0,1,0,0,0,0|1,0,0]=2 536 B10R1.30 COC1=C(N=CC(=C1)Br)N PI-34882 [0,1,0,0,0,0|2,0,0]=3 537 B10R1.30 COC1=C(O)C=CC(F)=C1 PI-27601 [0,1,0,0,0,0|1,0,0]=2 538 B10R1.30 COC1=CC(=CN=C1F)Br PI-43260 [0,1,0,0,0,0|2,0,0]=3 539 B10R1.30 COC1=CC(Br)=CN=C1Cl PI-41978 [0,1,0,0,0,0|2,0,0]=3 540 B10R1.30 COC1=NC(=CN=C1Cl)Br PI-45641 [0,1,0,0,0,0|3,0,0]=4 541 B10R1.30 COc1cc(Br)ccc1Cl PI-14389 [0,1,0,0,0,0|1,0,0]=2 542 B10R1.30 COc1cc(Br)ccc1F PI-34341 [0,1,0,0,0,0|1,0,0]=2 543 B10R1.30 COc1nc(Br)cnc1N PI-37313 [0,1,0,0,0,0|3,0,0]=4 544 B10R1.30 FC1=CC(=C(N)C=C1)OC PI-39749 [0,1,0,0,0,0|1,0,0]=2 545 B10R1.30 N#Cc1cc(Br)ccc1Cl PI-35251 [0,1,0,0,0,0|3,0,0]=4 546 B10R1.30 N#Cc1cc(Br)ccc1F PI-16380 [0,1,0,0,0,0|3,0,0]=4 547 B10R1.30 N#Cc1cc(Br)ccc1O PI-21509 [0,1,0,0,0,0|3,0,0]=4 548 B10R1.30 N#Cc1cc(Cl)ccc1Br PI-38901 [0,1,0,0,0,0|3,0,0]=4 549 B10R1.30 N#Cc1cc(F)ccc1Br PI-10686 [0,1,0,0,0,0|3,0,0]=4 550 B10R1.30 N#Cc1cc(N)ccc1N PI-17238 [0,1,0,0,0,0|3,0,0]=4 551 B10R1.30 N#Cc1cc(O)ccc1F PI-39223 [0,1,0,0,0,0|3,0,0]=4 552 B10R1.30 NCc1cc(Cl)ccc1F PI-20075 [0,1,0,0,0,0|3,0,0]=4 553 B10R1.30 NNC1=CC(Br)=CC=C1C PI-39726 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.30 O=CC1=CC(Br)=CC=C1N PI-46730 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.30 O=Cc1cc(Br)ccc1I PI-26850 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.30 O=Cc1cc(C)ccc1O PI-10857 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.30 O=Cc1cc(Cl)ccc1Br PI-33350 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.30 O=Cc1cc(Cl)ccc1N PI-18302 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.30 O=Cc1cc(F)ccc1F PI-10418 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.30 O=Cc1cc(O)ccc1Br PI-27441 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.30 O=Cc1cc(O)ccc1O PI-18118 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.30 OC1=CC=C(C)N=C1CC PI-40313 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.30 OCc1cc(Cl)ccc1Br PI-35234 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.61 B(C1=CC=CC=C1N)(O)O PI-31530 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.61 C1=CC=C(C(=C1)C(=O)N)Br PI-20527 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.61 C1=CC=C(C(=C1)C(=O)N)Cl PI-23128 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.61 C1=CC=C(C(=C1)C(=O)N)F PI-27598 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I PI-18960 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.61 C1=CC=C(C(=C1)C(=O)O)S PI-40146 [0,1,0,0,0,0|3,0,0]=4 570 B10R1.61 C1=CC=C(C(=C1)C(=O)[O-])F PI-28576 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.61 C1=CC=C(C(=C1)C(=S)N)N PI-17294 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.61 C1=CC=C(C(=C1)C(Cl)Cl)F PI-19438 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.61 C1=CC=CC(=C1B(O)O)Br PI-39926 [0,1,0,0,0,0|3,0,0]=4 574 B10R1.61 CC(=O)C1=C(C=NC=C1)N PI-48174 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.61 CC(=O)C1=CC=CC=C1Br PI-12211 [0,1,0,0,0,0|2,0,0]=3 576 B10R1.61 CC(=O)C1=CC=CC=C1Cl PI-11622 [0,1,0,0,0,0|2,0,0]=3 577 B10R1.61 CC(=O)C1=CC=CC=C1F PI-16975 [0,1,0,0,0,0|2,0,0]=3 578 B10R1.61 CC(=O)C1=CC=CC=C1N PI-29399 [0,1,0,0,0,0|2,0,0]=3 579 B10R1.61 CC(=O)c1ccccc1I PI-29345 [0,1,0,0,0,0|2,0,0]=3 580 B10R1.61 CC(=O)c1ccccc1N PI-11796 [0,1,0,0,0,0|2,0,0]=3 581 B10R1.61 CC(C)c1ccccc1S PI-17353 [0,1,0,0,0,0|2,0,0]=3 582 B10R1.61 CC(C1=CC=CC=C1Cl)O PI-32584 [0,1,0,0,0,0|2,0,0]=3 583 B10R1.61 CC(C1=CC=CC=C1F)O PI-32582 [0,1,0,0,0,0|2,0,0]=3 584 B10R1.61 CC(O)C1=CC=CC=C1N PI-46775 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.61 CC(c1ccccc1Br)C PI-21543 [0,1,0,0,0,0|2,0,0]=3 586 B10R1.61 CC1=C(C=CN=C1)C(=O)O PI-48282 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.61 CC1=C(C=NC=C1)C(=O)O PI-48296 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.61 CC1=C(C=NC=C1)[N+](=O)[O-] PI-10377 [0,1,0,0,0,0|3,0,0]=4 589 B10R1.61 CC1=CC=CC=C1C(=O)C PI-12963 [0,1,0,0,0,0|1,0,0]=2 590 B10R1.61 CC1=CC=CC=C1C(=O)Cl PI-34221 [0,1,0,0,0,0|2,0,0]=3 591 B10R1.61 CC1=NC=CN=C1C(=O)C PI-11038 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.61 C[C@@H](C1=CC=CC=C1Br)O PI-50016 [0,1,0,0,0,0|2,0,0]=3 593 B10R1.61 C[C@@H](C1=CC=CC=C1F)O PI-50014 [0,1,0,0,0,0|2,0,0]=3 594 B10R1.61 C[C@H](C1=CC=CC=C1Br)O PI-50015 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.61 C[C@H](C1=CC=CC=C1F)O PI-50013 [0,1,0,0,0,0|2,0,0]=3 596 B10R1.61 ClC(=O)c1ccccc1F PI-11847 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.61 FC(F)c1ccccc1Br PI-21634 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.61 NC(=S)c1ccccc1Br PI-22612 [0,1,0,0,0,0|3,0,0]=4 599 B10R1.61 NC(C1=CC=CC=C1O)=S PI-20875 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.61 OB(c1ccccc1C)O PI-10305 [0,1,0,0,0,0|2,0,0]=3 601 B10R1.61 OB(c1ccccc1F)O PI-28003 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.61 OB(c1ccccc1O)O PI-37992 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.61 OB(c1cnccc1C)O PI-25173 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.61 OC(=O)c1ccccc1F PI-16976 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.61 SC1=CC=CC=C1B(O)O PI-40744 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.61 [O-][N+](=O)c1ccccc1Cl PI-34106 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.61 [O-][N+](=O)c1ccccc1F PI-33137 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.61 [O-][N+](=O)c1ccccc1S PI-17367 [0,1,0,0,0,0|3,0,0]=4 609 B10R1.61 [O-][N+](=O)c1cccnc1C PI-31380 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.245 BrCc1c(F)cccc1Cl PI-20077 [0,1,0,0,0,0|3,0,0]=4 611 B10R1.245 BrCc1c(F)cccc1F PI-13392 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.245 C1=CC(=C(C(=C1)Br)C#N)F PI-10687 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)Cl PI-35930 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.245 C1=CC(=C(C(=C1)Br)C=O)N PI-40830 [0,1,0,0,0,0|3,0,0]=4 615 B10R1.245 C1=CC(=C(C(=C1)Br)CBr)Cl PI-20621 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.245 C1=CC(=C(C(=C1)Cl)C#N)F PI-16136 [0,1,0,0,0,0|3,0,0]=4 617 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)Cl PI-34227 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.245 C1=CC(=C(C(=C1)Cl)CCl)F PI-33406 [0,1,0,0,0,0|3,0,0]=4 619 B10R1.245 C1=CC(=C(C(=C1)Cl)CO)Cl PI-32223 [0,1,0,0,0,0|3,0,0]=4 620 B10R1.245 C1=CC(=C(C(=C1)Cl)CO)F PI-28646 [0,1,0,0,0,0|3,0,0]=4 621 B10R1.245 C1=CC(=C(C(=C1)Cl)NN)Cl PI-29641 [0,1,0,0,0,0|3,0,0]=4 622 B10R1.245 C1=CC(=C(C(=C1)F)C#N)F PI-31781 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.245 C1=CC(=C(C(=C1)F)C#N)N PI-28814 [0,1,0,0,0,0|3,0,0]=4 624 B10R1.245 C1=CC(=C(C(=C1)F)C#N)O PI-10696 [0,1,0,0,0,0|3,0,0]=4 625 B10R1.245 C1=CC(=C(C(=C1)F)CN)F PI-31271 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.245 C1=CC(=C(C(=C1)F)CN)N PI-15923 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.245 C1=CC(=C(C(=C1)F)CO)F PI-28243 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.245 C1=CC(=C(C(=C1)I)C#N)F PI-10698 [0,1,0,0,0,0|3,0,0]=4 629 B10R1.245 C1=CC(=C(C(=C1)I)C=O)F PI-10580 [0,1,0,0,0,0|3,0,0]=4 630 B10R1.245 CC1=C(C(=CC=C1)C)C#N PI-29833 [0,1,0,0,0,0|2,0,0]=3 631 B10R1.245 CC1=C(C(=CC=C1)C)C=O PI-27082 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.245 CC1=C(C(=CC=C1)C)CO PI-19775 [0,1,0,0,0,0|2,0,0]=3 633 B10R1.245 CC1=C(C(=CC=C1)C)NN PI-50511 [0,1,0,0,0,0|2,0,0]=3 634 B10R1.245 CC1=C(C(=O)C=CN1)OC PI-40244 [0,1,0,0,0,0|1,0,0]=2 635 B10R1.245 CC1=CC=CC(Cl)=C1C=O PI-27105 [0,1,0,0,0,0|2,0,0]=3 636 B10R1.245 COC1=C(C=CC=C1Br)F PI-10731 [0,1,0,0,0,0|1,0,0]=2 637 B10R1.245 COC1=C(C=CC=C1I)F PI-10732 [0,1,0,0,0,0|1,0,0]=2 638 B10R1.245 COC1=C(C=CC=C1O)O PI-19401 [0,1,0,0,0,0|1,0,0]=2 639 B10R1.245 COC1=C(Cl)C=CC=C1Cl PI-42640 [0,1,0,0,0,0|1,0,0]=2 640 B10R1.245 COc1c(Br)cccc1Br PI-36881 [0,1,0,0,0,0|1,0,0]=2 641 B10R1.245 COc1c(Cl)ncnc1Cl PI-21330 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.245 COc1c(F)cccc1F PI-28529 [0,1,0,0,0,0|1,0,0]=2 643 B10R1.245 COc1c(N)cccc1F PI-34516 [0,1,0,0,0,0|1,0,0]=2 644 B10R1.245 COc1c(O)ccnc1C PI-38274 [0,1,0,0,0,0|1,0,0]=2 645 B10R1.245 COc1c(O)ncnc1O PI-21331 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.245 ClCc1c(C)cccc1C PI-23826 [0,1,0,0,0,0|2,0,0]=3 647 B10R1.245 ClCc1c(F)cccc1F PI-21149 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.245 N#Cc1c(C)cccc1F PI-34464 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.245 N#Cc1c(C)cccc1N PI-30717 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.245 N#Cc1c(Cl)cccc1Cl PI-33090 [0,1,0,0,0,0|3,0,0]=4 651 B10R1.245 NCc1c(C)cccc1C PI-39516 [0,1,0,0,0,0|2,0,0]=3 652 B10R1.245 NCc1c(Cl)cccc1Cl PI-11763 [0,1,0,0,0,0|3,0,0]=4 653 B10R1.245 NCc1c(F)cccc1Cl PI-20072 [0,1,0,0,0,0|3,0,0]=4 654 B10R1.245 NNc1c(F)cccc1F PI-10482 [0,1,0,0,0,0|3,0,0]=4 655 B10R1.245 NNc1c(F)cccc1F PI-10634 [0,1,0,0,0,0|3,0,0]=4 656 B10R1.245 O=CC1=C(O)C=CC=C1Br PI-37162 [0,1,0,0,0,0|3,0,0]=4 657 B10R1.245 O=Cc1c(Br)cccc1Br PI-35931 [0,1,0,0,0,0|3,0,0]=4 658 B10R1.245 O=Cc1c(Cl)cccc1Cl PI-31780 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.245 O=Cc1c(F)cccc1Br PI-28929 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.245 O=Cc1c(F)cccc1Cl PI-16953 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.245 O=Cc1c(F)cccc1F PI-28528 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.245 O=Cc1c(O)cccc1Cl PI-27285 [0,1,0,0,0,0|3,0,0]=4 663 B10R1.245 O=Cc1c(O)cccc1F PI-27539 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.245 O=Cc1c(O)cccc1O PI-39426 [0,1,0,0,0,0|3,0,0]=4 665 B10R1.245 SCc1c(F)cccc1Cl PI-20085 [0,1,0,0,0,0|3,0,0]=4 666 B8R0.11 COC(C=CC=O)OC PI-47073 [0,0,1,0,0,0|2,0,1]=4 667 B10R2.7 C12=C(CNC1)C=CC=C2 PI-41113 [0,0,0,1,0,0|2,0,0]=3 668 B10R2.7 C1=CC=C2C(=C1)C=CN2 PI-44715 [0,0,0,1,0,0|1,0,2]=4 669 B10R2.7 C1=CC=C2C(=C1)N=CO2 PI-47002 [0,0,0,1,0,0|1,0,1]=3 670 B10R2.7 C1=CC=C2C(=C1)SC=[S+]2 PI-14799 [0,0,0,1,0,0|1,1,1]=4 671 B10R2.7 C1CC2=C(C1)N=CC=C2 PI-12954 [0,0,0,1,0,0|2,0,0]=3 672 B10R2.7 C1CNC2=CC=CC=C21 PI-44710 [0,0,0,1,0,0|1,0,0]=2 673 B10R2.7 C1COC2=CC=CC=C21 PI-21250 [0,0,0,1,0,0|0,0,0]=1 674 B10R2.7 [B]1OC2=CC=CC=C2O1 PI-50000 [0,0,0,1,0,0|2,0,0]=3 675 B10R2.7 c1ccc2c(c1)[nH]cn2 PI-31348 [0,0,0,1,0,0|2,0,1]=4 676 B10R2.7 c1ccc2c(c1)[nH]nc2 PI-31379 [0,0,0,1,0,0|2,0,1]=4 677 B10R2.7 c1ccc2c(c1)non2 PI-38745 [0,0,0,1,0,0|3,0,0]=4 678 B10R2.7 c1ccc2ccsc2c1 PI-14247 [0,0,0,1,0,0|0,1,2]=4 679 B10R2.7 c1ccc2nsnc2c1 PI-11675 [0,0,0,1,0,0|3,0,0]=4 680 B10R2.7 c1cnc2c(c1)CNC2 PI-39410 [0,0,0,1,0,0|3,0,0]=4 681 B10R2.7 c1cnc2c(c1)CNC2 PI-39560 [0,0,0,1,0,0|3,0,0]=4 682 B10R2.320 C1=CC=CC2=C1CC2=O PI-40938 [0,0,0,1,0,0|2,0,0]=3 683 B10R2.320 C1C(C2=CC=CC=C21)Br PI-40935 [0,0,0,1,0,0|2,0,0]=3 684 B8R1.11 CC1=C(C=CO1)SC PI-14230 [0,0,0,0,1,0|1,1,0]=3 685 B8R1.11 CC1=C(SC=C1)C#N PI-30712 [0,0,0,0,1,0|3,0,0]=4 686 B8R1.11 CC1=C(SC=C1)C=O PI-10802 [0,0,0,0,1,0|3,0,0]=4 687 B8R1.11 CCC1=CC=CN1N PI-40301 [0,0,0,0,1,0|3,0,0]=4 688 B8R1.11 CN1C=CC=C1C=O PI-33707 [0,0,0,0,1,0|3,0,0]=4 689 B8R1.11 CN1N=CC=C1CC PI-39594 [0,0,0,0,1,0|3,0,0]=4 690 B8R1.11 COC1=C(SC=C1)Br PI-39262 [0,0,0,0,1,0|2,0,0]=3 691 B8R1.11 N#Cc1cccn1C PI-34307 [0,0,0,0,1,0|3,0,0]=4 692 B7R1.3 Brc1cccnc1 PI-11914 [2,0,0,0,0,0|2,0,0]=4 693 B7R1.3 Brc1ccncc1 PI-10390 [2,0,0,0,0,0|2,0,0]=4 694 B7R1.3 C1=CC(=CN=C1)I PI-11390 [2,0,0,0,0,0|2,0,0]=4 695 B7R1.3 C1=CC(=CN=C1)O PI-44714 [2,0,0,0,0,0|1,0,0]=3 696 B7R1.3 C1=CC(=CN=C1)[O-] PI-42109 [2,0,0,0,0,0|1,0,1]=4 697 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [2,0,0,0,0,0|1,0,1]=4 698 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [2,0,0,0,0,0|1,0,1]=4 699 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [2,0,0,0,0,0|1,0,1]=4 700 B7R1.3 C1=CC(=S)NC=C1 PI-11854 [2,0,0,0,0,0|1,1,0]=4 701 B7R1.3 C1=CC=C(C=C1)[Si] PI-45035 [2,0,0,0,0,0|0,1,0]=3 702 B7R1.3 C1=CC=NC(=C1)I PI-32173 [2,0,0,0,0,0|2,0,0]=4 703 B7R1.3 C1=CN=CC=C1Cl PI-16703 [2,0,0,0,0,0|2,0,0]=4 704 B7R1.3 C1=CN=CC=C1F PI-10293 [2,0,0,0,0,0|2,0,0]=4 705 B7R1.3 C1=CN=CC=C1F PI-28763 [2,0,0,0,0,0|2,0,0]=4 706 B7R1.3 C1=CN=CC=C1I PI-16167 [2,0,0,0,0,0|2,0,0]=4 707 B7R1.3 C1=CNC=CC1=S PI-33123 [2,0,0,0,0,0|1,1,0]=4 708 B7R1.3 C1=COC=CC1=O PI-43972 [2,0,0,0,0,0|1,0,1]=4 709 B7R1.3 CC1=CC=CC=N1 PI-38534 [2,0,0,0,0,0|1,0,0]=3 710 B7R1.3 CC1=CN=CN=C1 PI-21343 [2,0,0,0,0,0|2,0,0]=4 711 B7R1.3 CC1=CN=NC=C1 PI-31701 [2,0,0,0,0,0|2,0,0]=4 712 B7R1.3 CC1=NC=CN=C1 PI-48495 [2,0,0,0,0,0|2,0,0]=4 713 B7R1.3 C[N+]1=CC=CC=C1 PI-13346 [2,0,0,0,0,0|1,0,0]=3 714 B7R1.3 C[n+]1ccccc1 PI-17168 [2,0,0,0,0,0|1,0,0]=3 715 B7R1.3 Cc1ncccn1 PI-35192 [2,0,0,0,0,0|2,0,0]=4 716 B7R1.3 Clc1cccnc1 PI-11921 [2,0,0,0,0,0|2,0,0]=4 717 B7R1.3 Fc1ccccn1 PI-11583 [2,0,0,0,0,0|2,0,0]=4 718 B7R1.3 Fc1cccnc1 PI-16759 [2,0,0,0,0,0|2,0,0]=4 719 B7R1.3 Ic1ccccc1 PI-37973 [2,0,0,0,0,0|1,0,0]=3 720 B7R1.3 N[n+]1ccccc1 PI-10984 [2,0,0,0,0,0|2,0,0]=4 721 B7R1.3 O=C1C=CNC=C1 PI-33984 [2,0,0,0,0,0|1,0,1]=4 722 B7R1.3 Oc1cncnc1 PI-36495 [2,0,0,0,0,0|2,0,0]=4 723 B7R1.3 [S-]c1ccccc1 PI-17985 [2,0,0,0,0,0|0,1,0]=3 724 B9R1.1 BrC1=NC=C(N=C1)OC PI-35953 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.1 BrCc1ccc(Br)cc1 PI-11967 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.1 BrCc1ccc(Cl)cc1 PI-15674 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.1 BrCc1ccc(I)cc1 PI-16508 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.1 Brc1ccc(cc1)[N+]#N PI-10983 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.1 C#CC1=CC=C(C=C1)Br PI-30915 [1,1,0,0,0,0|1,0,1]=4 730 B9R1.1 C#Cc1ccc(F)cc1 PI-30917 [1,1,0,0,0,0|1,0,1]=4 731 B9R1.1 C1=CC(=CC=C1C#N)I PI-31146 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.1 C1=CC(=CC=C1C#N)N PI-10997 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.1 C1=CC(=CC=C1C=O)Cl PI-34386 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.1 C1=CC(=CC=C1C=O)F PI-33068 [1,1,0,0,0,0|2,0,0]=4 735 B9R1.1 C1=CC(=CC=C1CBr)F PI-12706 [1,1,0,0,0,0|2,0,0]=4 736 B9R1.1 C1=CC(=CC=C1CCl)Br PI-20545 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.1 C1=CC(=CC=C1CN)Cl PI-11469 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.1 C1=CC(=CC=C1CN)I PI-33700 [1,1,0,0,0,0|2,0,0]=4 739 B9R1.1 C1=CC(=CC=C1CN)O PI-20736 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.1 C1=CC(=CC=C1CO)F PI-16874 [1,1,0,0,0,0|2,0,0]=4 741 B9R1.1 C1=CC(=CC=C1CO)N PI-11961 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.1 C1=CC(=CC=C1CS)F PI-23496 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.1 C1=CC(=CC=C1NN)Br PI-14502 [1,1,0,0,0,0|2,0,0]=4 744 B9R1.1 C1=CC(=CC=C1NN)Br PI-50387 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.1 C1=CC(=CC=C1NN)Br PI-50485 [1,1,0,0,0,0|2,0,0]=4 746 B9R1.1 C1=CC(=CC=C1NN)Cl PI-16438 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.1 C1=CC(=CC=C1NN)Cl PI-50281 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.1 C1=CC(=CC=C1NN)F PI-31312 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.1 C1=CC(=CC=C1NN)I PI-29108 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.1 C=Cc1ccc(cc1)Br PI-22599 [1,1,0,0,0,0|1,0,1]=4 751 B9R1.1 C=Cc1ccc(cc1)Cl PI-38314 [1,1,0,0,0,0|1,0,1]=4 752 B9R1.1 C=Cc1ccc(cc1)N PI-17562 [1,1,0,0,0,0|1,0,1]=4 753 B9R1.1 CC1=CC=C(C=C1)C#C PI-30916 [1,1,0,0,0,0|1,0,1]=4 754 B9R1.1 CC1=CC=C(C=C1)CBr PI-38678 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.1 CCC1=CC=C(C=C1)Br PI-16231 [1,1,0,0,0,0|1,0,0]=3 756 B9R1.1 CCC1=CC=C(C=C1)Cl PI-19776 [1,1,0,0,0,0|1,0,0]=3 757 B9R1.1 CCC1=CC=C(C=C1)F PI-22092 [1,1,0,0,0,0|1,0,0]=3 758 B9R1.1 CCC1=CC=C(C=C1)S PI-13700 [1,1,0,0,0,0|1,0,0]=3 759 B9R1.1 CCc1ccc(C)cc1 PI-36542 [1,1,0,0,0,0|1,0,0]=3 760 B9R1.1 CNC1=CC=C(C=C1)Cl PI-34211 [1,1,0,0,0,0|1,0,0]=3 761 B9R1.1 CNC1=CC=C(C=C1)N PI-10555 [1,1,0,0,0,0|1,0,0]=3 762 B9R1.1 CNC1=CN=C(C=C1)Cl PI-45925 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.1 CNC1=NC=C(Br)C=C1 PI-46679 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.1 CNc1ccc(cc1)Br PI-21585 [1,1,0,0,0,0|1,0,0]=3 765 B9R1.1 COC1=CC=C(C=C1)F PI-12219 [1,1,0,0,0,0|0,0,0]=2 766 B9R1.1 COC1=CC=C(C=C1)S PI-21363 [1,1,0,0,0,0|0,0,0]=2 767 B9R1.1 COC1=CN=C(C=C1)Br PI-45881 [1,1,0,0,0,0|1,0,0]=3 768 B9R1.1 COC1=CN=C(N=C1)Br PI-45086 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.1 COC1=CN=C(N=C1)Cl PI-45011 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.1 COC1=NC=C(C=C1)F PI-16766 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.1 COC1=NC=C(C=N1)Br PI-31943 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.1 COC1=NC=C(C=N1)I PI-45092 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.1 COC1=NN=C(C=C1)Cl PI-30210 [1,1,0,0,0,0|2,0,0]=4 774 B9R1.1 COc1cc[n+]([O-])cc1 PI-26063 [1,1,0,0,0,0|1,0,0]=3 775 B9R1.1 COc1ccc(Cl)cc1 PI-34198 [1,1,0,0,0,0|0,0,0]=2 776 B9R1.1 COc1ccc(N)cn1 PI-16695 [1,1,0,0,0,0|1,0,0]=3 777 B9R1.1 COc1ccc(O)cn1 PI-26700 [1,1,0,0,0,0|1,0,0]=3 778 B9R1.1 COc1ccc(cc1)Br PI-34196 [1,1,0,0,0,0|0,0,0]=2 779 B9R1.1 COc1ccc(cc1)I PI-33808 [1,1,0,0,0,0|0,0,0]=2 780 B9R1.1 COc1ccc(cc1)O PI-31355 [1,1,0,0,0,0|0,0,0]=2 781 B9R1.1 COc1ccc(cn1)Br PI-22840 [1,1,0,0,0,0|1,0,0]=3 782 B9R1.1 CSC1=CC=C(C=C1)F PI-11986 [1,1,0,0,0,0|0,1,0]=3 783 B9R1.1 CSc1ccc(cc1)O PI-18075 [1,1,0,0,0,0|0,1,0]=3 784 B9R1.1 ClCc1ccc(F)cc1 PI-31364 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.1 N#Cc1ccc(Br)cc1 PI-11462 [1,1,0,0,0,0|2,0,0]=4 786 B9R1.1 N#Cc1ccc(Cl)cc1 PI-11470 [1,1,0,0,0,0|2,0,0]=4 787 B9R1.1 N#Cc1ccc(cc1)F PI-16865 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.1 N#Cc1ccc(cc1)O PI-35246 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.1 NC1=CC=C(SC)C=C1 PI-11963 [1,1,0,0,0,0|0,1,0]=3 790 B9R1.1 NCc1ccc(F)cc1 PI-11985 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.1 NCc1ccc(cc1)Br PI-20544 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.1 NCc1ccc(cc1)Br PI-38542 [1,1,0,0,0,0|2,0,0]=4 793 B9R1.1 NNc1ccc(C)cc1 PI-13126 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.1 O=Cc1ccc(Br)cc1 PI-12729 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.1 O=Cc1ccc(cc1)I PI-27209 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.1 O=Cc1ccc(cc1)O PI-37802 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.1 OCc1ccc(S)cc1 PI-35674 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.1 OCc1ccc(cc1)Cl PI-11977 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.1 OCc1ccc(cc1)I PI-33685 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.1 OCc1ccc(cc1)O PI-29788 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.1 [C-]#[N+]C1=CC=C(C=C1)Br PI-22497 [1,1,0,0,0,0|1,0,1]=4 802 B9R1.2 BrCc1cccc(I)c1 PI-29628 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.2 BrCc1cccc(c1)Br PI-13393 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.2 BrCc1cccc(c1)Cl PI-23167 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.2 C#CC1=CC(=CC=C1)Br PI-30913 [1,1,0,0,0,0|1,0,1]=4 806 B9R1.2 C#CC1=CC(=CC=C1)Cl PI-30914 [1,1,0,0,0,0|1,0,1]=4 807 B9R1.2 C#CC1=CC(=CC=C1)F PI-30388 [1,1,0,0,0,0|1,0,1]=4 808 B9R1.2 C#Cc1cccc(N)c1 PI-10850 [1,1,0,0,0,0|1,0,1]=4 809 B9R1.2 C1=CC(=CC(=C1)Br)C#N PI-30857 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.2 C1=CC(=CC(=C1)Br)CCl PI-35258 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.2 C1=CC(=CC(=C1)Br)CO PI-10954 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.2 C1=CC(=CC(=C1)Cl)CCl PI-34222 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.2 C1=CC(=CC(=C1)Cl)NN PI-29369 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.2 C1=CC(=CC(=C1)F)CBr PI-13389 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.2 C1=CC(=CC(=C1)F)CCl PI-34129 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.2 C1=CC(=CC(=C1)F)CO PI-16873 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.2 C1=CC(=CC(=C1)F)NN PI-29439 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.2 C1=CC(=CC(=C1)I)C=O PI-27854 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.2 C1=CC(=CC(=C1)N)C=O PI-27126 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.2 C1=CC(=CC(=C1)O)C#N PI-35245 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.2 C1=CC(=CC(=C1)O)CBr PI-43991 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.2 C1=CC(=CC(=C1)O)CO PI-11929 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.2 C=CC1=CC(=CC=C1)Br PI-22598 [1,1,0,0,0,0|1,0,1]=4 824 B9R1.2 C=Cc1cccc(c1)C PI-40767 [1,1,0,0,0,0|1,0,1]=4 825 B9R1.2 CC1=CC(=CC=C1)C=O PI-11938 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.2 CC1=CC(=CC=C1)CN PI-35861 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.2 CC1=NC(=CC=C1)OC PI-10858 [1,1,0,0,0,0|1,0,0]=3 828 B9R1.2 CC1=NC=CC(=N1)OC PI-44930 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.2 CCC1=CC(=CC=C1)Br PI-21410 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.2 CCC1=CC(=NC=C1)Br PI-24478 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.2 CCc1cccc(N)n1 PI-30318 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.2 CCc1ccnc(c1)N PI-30483 [1,1,0,0,0,0|2,0,0]=4 833 B9R1.2 CNc1cccc(c1)F PI-29299 [1,1,0,0,0,0|1,0,0]=3 834 B9R1.2 COC1=CC(=CC=C1)Br PI-12683 [1,1,0,0,0,0|0,0,0]=2 835 B9R1.2 COC1=CC(=CC=C1)S PI-13025 [1,1,0,0,0,0|0,0,0]=2 836 B9R1.2 COC1=CC(=NC=C1)Cl PI-27253 [1,1,0,0,0,0|1,0,0]=3 837 B9R1.2 COC1=CC(=NC=C1)N PI-31930 [1,1,0,0,0,0|1,0,0]=3 838 B9R1.2 COC1=CC(=NC=N1)Cl PI-16342 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.2 COC1=CC(=O)NC=C1 PI-47311 [1,1,0,0,0,0|1,0,0]=3 840 B9R1.2 COC1=CC(Cl)=CC=C1 PI-31362 [1,1,0,0,0,0|0,0,0]=2 841 B9R1.2 COC1=CC(F)=CC=C1 PI-12220 [1,1,0,0,0,0|0,0,0]=2 842 B9R1.2 COC1=NC(=CC=C1)Br PI-34471 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.2 COC1=NC(=NC=C1)Br PI-45082 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.2 COC1=NC(=NC=C1)Cl PI-45081 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.2 COC1=NC=CC(=C1)I PI-36520 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.2 COC1=NC=CC(Br)=N1 PI-46750 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.2 COC1=NC=NC(=C1)N PI-11959 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.2 COc1cc(Br)cnc1 PI-38259 [1,1,0,0,0,0|1,0,0]=3 849 B9R1.2 COc1cc(Cl)ccn1 PI-26867 [1,1,0,0,0,0|1,0,0]=3 850 B9R1.2 COc1cc(N)ccn1 PI-26277 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.2 COc1cc(N)cnc1 PI-33855 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.2 COc1cccc(c1)O PI-34658 [1,1,0,0,0,0|0,0,0]=2 853 B9R1.2 COc1ccnc(I)n1 PI-36437 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.2 CSC1=CC(=CC=C1)Br PI-11915 [1,1,0,0,0,0|0,1,0]=3 855 B9R1.2 CSC1=CC(=CC=C1)Cl PI-20243 [1,1,0,0,0,0|0,1,0]=3 856 B9R1.2 CSc1cccc(c1)N PI-11908 [1,1,0,0,0,0|0,1,0]=3 857 B9R1.2 Clc1cccc(c1)C#N PI-31301 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.2 N#Cc1cccc(F)c1 PI-16864 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.2 N#Cc1cccc(c1)I PI-10114 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.2 NCc1cccc(Cl)c1 PI-15673 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.2 NCc1cccc(c1)Br PI-21372 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.2 NCc1cccc(c1)Br PI-38545 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.2 NCc1cccc(c1)F PI-23480 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.2 NNc1cccc(c1)Br PI-29422 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.2 NNc1cccc(c1)C PI-29814 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.2 O=Cc1cccc(c1)Br PI-34503 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.2 O=Cc1cccc(c1)Cl PI-27742 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.2 O=Cc1cccc(c1)F PI-11925 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.2 O=Cc1cccc(c1)N PI-11906 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.2 O=Cc1cccc(c1)O PI-34273 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.2 OCc1cccc(c1)C PI-38620 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.2 OCc1cccc(c1)Cl PI-11919 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.2 SCc1cccc(F)c1 PI-23495 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.2 [C-]#[N+]C1=CC(=CC=C1)Br PI-22496 [1,1,0,0,0,0|1,0,1]=4 875 B9R1.6 C1=CC=C(C=C1)C(=O)Br PI-46923 [1,1,0,0,0,0|2,0,0]=4 876 B9R1.6 CC(=O)C1=CC=CC=N1 PI-48516 [1,1,0,0,0,0|2,0,0]=4 877 B9R1.6 CC(=O)c1cccnc1 PI-32250 [1,1,0,0,0,0|2,0,0]=4 878 B9R1.6 CC(=O)c1ccncc1 PI-38297 [1,1,0,0,0,0|2,0,0]=4 879 B9R1.6 CC(C)c1ccncc1 PI-16693 [1,1,0,0,0,0|2,0,0]=4 880 B9R1.6 CC(C1=CC=CC=C1)N PI-32638 [1,1,0,0,0,0|1,0,0]=3 881 B9R1.6 CC(c1ccccn1)N PI-38576 [1,1,0,0,0,0|2,0,0]=4 882 B9R1.6 CC(c1ccncc1)N PI-38572 [1,1,0,0,0,0|2,0,0]=4 883 B9R1.6 CN(C)c1ccncc1 PI-16263 [1,1,0,0,0,0|2,0,0]=4 884 B9R1.6 CN(C1=CC=CC=C1)N PI-29778 [1,1,0,0,0,0|1,0,0]=3 885 B9R1.6 C[C@@H](C1=CC=CC=C1)O PI-50011 [1,1,0,0,0,0|1,0,0]=3 886 B9R1.6 C[C@@H](C1=CC=NC=C1)O PI-49831 [1,1,0,0,0,0|2,0,0]=4 887 B9R1.6 C[C@@H](N)c1ccccn1 PI-36896 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.6 C[C@@H](O)C1=NC=CC=C1 PI-42552 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.6 C[C@@H](c1ccccc1)N PI-11219 [1,1,0,0,0,0|1,0,0]=3 890 B9R1.6 C[C@H](C1=CC=NC=C1)O PI-49830 [1,1,0,0,0,0|2,0,0]=4 891 B9R1.6 C[C@H](O)C1=NC=CC=C1 PI-42531 [1,1,0,0,0,0|2,0,0]=4 892 B9R1.6 C[C@H](c1ccccc1)N PI-11221 [1,1,0,0,0,0|1,0,0]=3 893 B9R1.6 C[C@H](c1ccccc1)O PI-38963 [1,1,0,0,0,0|1,0,0]=3 894 B9R1.6 C[SiH](c1ccccc1)C PI-39122 [1,1,0,0,0,0|1,0,0]=3 895 B9R1.6 NC(=N)c1ccccc1 PI-30200 [1,1,0,0,0,0|2,0,0]=4 896 B9R1.6 NC(=S)c1ccccc1 PI-29356 [1,1,0,0,0,0|2,0,0]=4 897 B9R1.6 OB(O)c1ccccc1 PI-16480 [1,1,0,0,0,0|2,0,0]=4 898 B9R1.8 BrC#Cc1ccccc1 PI-38808 [1,1,0,0,0,0|1,0,1]=4 899 B9R1.8 C1=CC(=CN=C1)CCO PI-20772 [1,1,0,0,0,0|2,0,0]=4 900 B9R1.8 C1=CC=C(C=C1)C=CBr PI-12915 [1,1,0,0,0,0|1,0,1]=4 901 B9R1.8 C1=CC=C(C=C1)CCS PI-48520 [1,1,0,0,0,0|1,0,0]=3 902 B9R1.8 C1=CC=C(C=C1)CNN PI-12194 [1,1,0,0,0,0|2,0,0]=4 903 B9R1.8 C1=CC=C(C=C1)CNN PI-12195 [1,1,0,0,0,0|2,0,0]=4 904 B9R1.8 C1=CC=C(C=C1)CON PI-48767 [1,1,0,0,0,0|1,0,0]=3 905 B9R1.8 C1=CC=NC(=C1)CCN PI-33890 [1,1,0,0,0,0|2,0,0]=4 906 B9R1.8 C=CCC1=CC=CC=C1 PI-36465 [1,1,0,0,0,0|1,0,1]=4 907 B9R1.8 CC#CC1=CC=CC=C1 PI-48954 [1,1,0,0,0,0|1,0,0]=3 908 B9R1.8 CCCC1=CC=CC=N1 PI-13326 [1,1,0,0,0,0|2,0,0]=4 909 B9R1.8 CCCC1=CC=NC=C1 PI-28052 [1,1,0,0,0,0|2,0,0]=4 910 B9R1.8 CCC[N+]1=CC=CC=C1 PI-13348 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.8 CCOC1=CC=CC=N1 PI-16377 [1,1,0,0,0,0|1,0,0]=3 912 B9R1.8 CCOC1=CC=NC=C1 PI-16378 [1,1,0,0,0,0|1,0,0]=3 913 B9R1.8 CCOC1=NC=CN=C1 PI-11039 [1,1,0,0,0,0|2,0,0]=4 914 B9R1.8 CNCC1=CC=CN=C1 PI-46624 [1,1,0,0,0,0|2,0,0]=4 915 B9R1.8 COCC1=CC=CC=C1 PI-19695 [1,1,0,0,0,0|0,0,0]=2 916 B9R1.8 COCc1ccccn1 PI-38670 [1,1,0,0,0,0|1,0,0]=3 917 B9R1.8 C\C=C\C1=CC=CC=C1 PI-42685 [1,1,0,0,0,0|1,0,0]=3 918 B9R1.8 C\C=C\C1=CC=CC=C1 PI-46536 [1,1,0,0,0,0|1,0,0]=3 919 B9R1.8 NCCc1cccnc1 PI-23439 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.8 NCCc1ccncc1 PI-15907 [1,1,0,0,0,0|2,0,0]=4 921 B9R1.8 NOCc1ccccc1 PI-11329 [1,1,0,0,0,0|1,0,0]=3 922 B9R1.8 OCCC1=CC=NC=C1 PI-27680 [1,1,0,0,0,0|2,0,0]=4 923 B9R1.8 ONCC1=CC=CC=C1 PI-42266 [1,1,0,0,0,0|2,0,0]=4 924 B9R1.3 BrC1=C(C=CC=C1F)N PI-10616 [1,1,0,0,0,0|2,0,0]=4 925 B9R1.3 Brc1c(Cl)cccc1Br PI-36772 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.3 Brc1c(O)cccc1F PI-27596 [1,1,0,0,0,0|1,0,0]=3 927 B9R1.3 Brc1cccc(c1C)Br PI-30854 [1,1,0,0,0,0|1,0,0]=3 928 B9R1.3 Brc1cccc(c1F)Br PI-38886 [1,1,0,0,0,0|2,0,0]=4 929 B9R1.3 Brc1cncc(c1C)Br PI-39130 [1,1,0,0,0,0|2,0,0]=4 930 B9R1.3 C1=C(C(=C(C=C1)F)O)O PI-19501 [1,1,0,0,0,0|1,0,0]=3 931 B9R1.3 C1=CC(=C(C(=C1)Br)Br)Br PI-49334 [1,1,0,0,0,0|2,0,0]=4 932 B9R1.3 C1=CC(=C(C(=C1)Br)Br)F PI-43232 [1,1,0,0,0,0|2,0,0]=4 933 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)O PI-34265 [1,1,0,0,0,0|1,0,0]=3 934 B9R1.3 C1=CC(=C(C(=C1)Br)I)O PI-44588 [1,1,0,0,0,0|1,0,0]=3 935 B9R1.3 C1=CC(=C(C(=C1)Br)N)F PI-28732 [1,1,0,0,0,0|2,0,0]=4 936 B9R1.3 C1=CC(=C(C(=C1)Br)O)F PI-10646 [1,1,0,0,0,0|1,0,0]=3 937 B9R1.3 C1=CC(=C(C(=C1)Br)O)N PI-33348 [1,1,0,0,0,0|1,0,0]=3 938 B9R1.3 C1=CC(=C(C(=C1)Cl)Br)Cl PI-33015 [1,1,0,0,0,0|2,0,0]=4 939 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)F PI-21033 [1,1,0,0,0,0|2,0,0]=4 940 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)S PI-21353 [1,1,0,0,0,0|1,1,0]=4 941 B9R1.3 C1=CC(=C(C(=C1)Cl)F)F PI-28648 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.3 C1=CC(=C(C(=C1)Cl)N)F PI-16936 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.3 C1=CC(=C(C(=C1)Cl)N)S PI-41796 [1,1,0,0,0,0|1,1,0]=4 944 B9R1.3 C1=CC(=C(C(=C1)Cl)O)F PI-16877 [1,1,0,0,0,0|1,0,0]=3 945 B9R1.3 C1=CC(=C(C(=C1)Cl)S)Cl PI-17253 [1,1,0,0,0,0|1,1,0]=4 946 B9R1.3 C1=CC(=C(C(=C1)F)Cl)F PI-28470 [1,1,0,0,0,0|2,0,0]=4 947 B9R1.3 C1=CC(=C(C(=C1)F)F)F PI-28163 [1,1,0,0,0,0|2,0,0]=4 948 B9R1.3 C1=CC(=C(C(=C1)F)F)N PI-28539 [1,1,0,0,0,0|2,0,0]=4 949 B9R1.3 C1=CC(=C(C(=C1)F)I)F PI-34348 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.3 C1=CC(=C(C(=C1)I)Br)F PI-42952 [1,1,0,0,0,0|2,0,0]=4 951 B9R1.3 C1=CC(=C(C(=C1)I)Cl)Cl PI-31839 [1,1,0,0,0,0|2,0,0]=4 952 B9R1.3 C1=CC(=C(C(=C1)I)N)F PI-34647 [1,1,0,0,0,0|2,0,0]=4 953 B9R1.3 C1=CC(=C(C(=C1)O)Cl)N PI-34749 [1,1,0,0,0,0|1,0,0]=3 954 B9R1.3 C1=CC(=C(C(=C1)O)F)N PI-49267 [1,1,0,0,0,0|1,0,0]=3 955 B9R1.3 C1=CC=C(C(=C1Br)C)N PI-19715 [1,1,0,0,0,0|1,0,0]=3 956 B9R1.3 C1=CC=C(O)C(=C1O)Cl PI-10240 [1,1,0,0,0,0|1,0,0]=3 957 B9R1.3 CC1=C(Br)C(F)=NC=C1 PI-39751 [1,1,0,0,0,0|2,0,0]=4 958 B9R1.3 CC1=C(C(=CC=C1)Br)F PI-10666 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.3 CC1=C(C(=CC=C1)Br)N PI-21583 [1,1,0,0,0,0|1,0,0]=3 960 B9R1.3 CC1=C(C(=CC=C1)Br)O PI-46963 [1,1,0,0,0,0|0,0,0]=2 961 B9R1.3 CC1=C(C(=CC=C1)C)Cl PI-11596 [1,1,0,0,0,0|1,0,0]=3 962 B9R1.3 CC1=C(C(=CC=C1)C)F PI-11594 [1,1,0,0,0,0|1,0,0]=3 963 B9R1.3 CC1=C(C(=CC=C1)C)O PI-48960 [1,1,0,0,0,0|0,0,0]=2 964 B9R1.3 CC1=C(C(=CC=C1)C)S PI-19078 [1,1,0,0,0,0|0,1,0]=3 965 B9R1.3 CC1=C(C(=CC=C1)Cl)Br PI-19844 [1,1,0,0,0,0|1,0,0]=3 966 B9R1.3 CC1=C(C(=CC=C1)Cl)F PI-28868 [1,1,0,0,0,0|1,0,0]=3 967 B9R1.3 CC1=C(C(=CC=C1)Cl)I PI-19664 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.3 CC1=C(C(=CC=C1)F)Br PI-33074 [1,1,0,0,0,0|1,0,0]=3 969 B9R1.3 CC1=C(C(=CC=C1)F)F PI-16367 [1,1,0,0,0,0|1,0,0]=3 970 B9R1.3 CC1=C(C(=CC=C1)F)I PI-34489 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.3 CC1=C(C(=CC=C1)F)N PI-10462 [1,1,0,0,0,0|1,0,0]=3 972 B9R1.3 CC1=C(C(=CC=C1)I)F PI-10671 [1,1,0,0,0,0|1,0,0]=3 973 B9R1.3 CC1=C(C(=CC=C1)N)C PI-27689 [1,1,0,0,0,0|0,0,0]=2 974 B9R1.3 CC1=C(C(=CC=C1)N)F PI-28254 [1,1,0,0,0,0|1,0,0]=3 975 B9R1.3 CC1=C(C(=CC=C1)N)N PI-20954 [1,1,0,0,0,0|1,0,0]=3 976 B9R1.3 CC1=C(C(=CC=C1)N)O PI-42097 [1,1,0,0,0,0|0,0,0]=2 977 B9R1.3 CC1=C(C(=CC=C1)O)Cl PI-42107 [1,1,0,0,0,0|1,0,0]=3 978 B9R1.3 CC1=C(C(=NC=C1)Cl)N PI-10382 [1,1,0,0,0,0|2,0,0]=4 979 B9R1.3 CC1=C(C(=NC=N1)C)O PI-45131 [1,1,0,0,0,0|2,0,0]=4 980 B9R1.3 CC1=C(C)C(F)=CC=C1 PI-11597 [1,1,0,0,0,0|0,0,0]=2 981 B9R1.3 CC1=C(C=CC=C1Br)Cl PI-20670 [1,1,0,0,0,0|1,0,0]=3 982 B9R1.3 CC1=C(C=CC=C1Br)F PI-10665 [1,1,0,0,0,0|1,0,0]=3 983 B9R1.3 CC1=C(C=CC=C1F)F PI-10670 [1,1,0,0,0,0|1,0,0]=3 984 B9R1.3 CC1=C(C=CC=C1F)N PI-28534 [1,1,0,0,0,0|1,0,0]=3 985 B9R1.3 CC1=C(C=CC=C1F)O PI-33695 [1,1,0,0,0,0|0,0,0]=2 986 B9R1.3 CC1=C(C=CC=C1I)F PI-10674 [1,1,0,0,0,0|1,0,0]=3 987 B9R1.3 CC1=C(Cl)C(Cl)=CC=C1 PI-27484 [1,1,0,0,0,0|1,0,0]=3 988 B9R1.3 CC1=[N+](C(=CC=C1)C)[O-] PI-29049 [1,1,0,0,0,0|1,0,1]=4 989 B9R1.3 Cc1c(C)cccc1Br PI-38905 [1,1,0,0,0,0|0,0,0]=2 990 B9R1.3 Cc1c(F)cccc1Cl PI-33407 [1,1,0,0,0,0|1,0,0]=3 991 B9R1.3 Cc1c(O)cccc1O PI-13269 [1,1,0,0,0,0|0,0,0]=2 992 B9R1.3 Cc1cccc(c1Br)C PI-11595 [1,1,0,0,0,0|1,0,0]=3 993 B9R1.3 Cc1ccnc(c1F)Cl PI-34473 [1,1,0,0,0,0|2,0,0]=4 994 B9R1.3 ClC1=CC=CC(Br)=C1I PI-41926 [1,1,0,0,0,0|2,0,0]=4 995 B9R1.3 Clc1c(N)cccc1F PI-10619 [1,1,0,0,0,0|2,0,0]=4 996 B9R1.3 Clc1c(O)cccc1Cl PI-37792 [1,1,0,0,0,0|1,0,0]=3 997 B9R1.3 Fc1c(C)cccc1O PI-38225 [1,1,0,0,0,0|1,0,0]=3 998 B9R1.3 Fc1c(Cl)cccc1Br PI-11590 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.3 Fc1c(Cl)cccc1I PI-20091 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.3 Fc1c(F)cccc1Br PI-16365 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.3 Fc1c(N)cccc1Br PI-38904 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.3 Fc1c(O)cccc1F PI-10291 [1,1,0,0,0,0|1,0,0]=3 1003 B9R1.3 Fc1cccc(c1Br)F PI-16368 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.3 Fc1cccc(c1N)F PI-31231 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.3 IC1=C(Br)C=CC=C1Br PI-46843 [1,1,0,0,0,0|2,0,0]=4 1006 B9R1.3 Nc1c(C)cccc1Cl PI-12044 [1,1,0,0,0,0|1,0,0]=3 1007 B9R1.3 Nc1c(C)cccc1O PI-11311 [1,1,0,0,0,0|1,0,0]=3 1008 B9R1.3 Nc1c(Cl)cccc1I PI-36760 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.3 Nc1c(O)cccc1Br PI-36538 [1,1,0,0,0,0|1,0,0]=3 1010 B9R1.3 OC1=C(F)C(Br)=CC=C1 PI-40482 [1,1,0,0,0,0|1,0,0]=3 1011 B9R1.3 OC1=C(F)C=CC=C1F PI-16916 [1,1,0,0,0,0|1,0,0]=3 1012 B9R1.3 Oc1c(Br)cccc1Br PI-20984 [1,1,0,0,0,0|1,0,0]=3 1013 B9R1.3 Oc1c(C)cccc1Cl PI-20168 [1,1,0,0,0,0|0,0,0]=2 1014 B9R1.3 Oc1c(F)cccc1I PI-10652 [1,1,0,0,0,0|1,0,0]=3 1015 B9R1.3 Oc1c(N)cccc1F PI-34504 [1,1,0,0,0,0|1,0,0]=3 1016 B9R1.3 Oc1cccc(c1N)O PI-32329 [1,1,0,0,0,0|1,0,0]=3 1017 B9R1.69 BrC1=CC(=C(C=C1)C)Cl PI-20673 [1,1,0,0,0,0|1,0,0]=3 1018 B9R1.69 BrC1=CN=C(C(=C1)C)C PI-41495 [1,1,0,0,0,0|1,0,0]=3 1019 B9R1.69 Brc1ccc(=O)n(C)c1 PI-35908 [1,1,0,0,0,0|1,0,1]=4 1020 B9R1.69 Brc1ccc(N)c(C)c1 PI-11003 [1,1,0,0,0,0|1,0,0]=3 1021 B9R1.69 Brc1ccc(N)c(N)c1 PI-34413 [1,1,0,0,0,0|2,0,0]=4 1022 B9R1.69 Brc1ccc(c(c1)Br)F PI-28149 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.69 Brc1ccc(c(c1)C)I PI-21533 [1,1,0,0,0,0|1,0,0]=3 1024 B9R1.69 Brc1ccc(c(c1)F)Br PI-20968 [1,1,0,0,0,0|2,0,0]=4 1025 B9R1.69 Brc1ccc(c(c1)F)Cl PI-28679 [1,1,0,0,0,0|2,0,0]=4 1026 B9R1.69 Brc1ccc(c(c1)F)F PI-10759 [1,1,0,0,0,0|2,0,0]=4 1027 B9R1.69 Brc1ccc(c(c1)F)O PI-31106 [1,1,0,0,0,0|1,0,0]=3 1028 B9R1.69 Brc1ccc(c(c1)N)F PI-21432 [1,1,0,0,0,0|2,0,0]=4 1029 B9R1.69 Brc1ccc(c(c1)O)F PI-33069 [1,1,0,0,0,0|1,0,0]=3 1030 B9R1.69 Brc1cnc(Br)c(C)c1 PI-16819 [1,1,0,0,0,0|2,0,0]=4 1031 B9R1.69 Brc1ncc(N)c(C)c1 PI-20000 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.69 C1=C(C(=CC=C1Br)O)C PI-22157 [1,1,0,0,0,0|0,0,0]=2 1033 B9R1.69 C1=C(C(=CC=C1F)O)C PI-16986 [1,1,0,0,0,0|0,0,0]=2 1034 B9R1.69 C1=C(C(=CN=C1Cl)O)N PI-43996 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.69 C1=C(C(=CNC1=O)Cl)O PI-33382 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.69 C1=C(C(=O)NC=C1Br)O PI-46997 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl PI-21594 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.69 C1=CC(=C(C=C1Br)Cl)I PI-20639 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.69 C1=CC(=C(C=C1Br)Cl)N PI-20600 [1,1,0,0,0,0|2,0,0]=4 1040 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-21433 [1,1,0,0,0,0|2,0,0]=4 1041 B9R1.69 C1=CC(=C(C=C1Br)F)N PI-32450 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.69 C1=CC(=C(C=C1Br)N)O PI-33346 [1,1,0,0,0,0|1,0,0]=3 1043 B9R1.69 C1=CC(=C(C=C1Br)O)Cl PI-32432 [1,1,0,0,0,0|1,0,0]=3 1044 B9R1.69 C1=CC(=C(C=C1Cl)Br)O PI-33867 [1,1,0,0,0,0|1,0,0]=3 1045 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br PI-21592 [1,1,0,0,0,0|2,0,0]=4 1046 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F PI-16889 [1,1,0,0,0,0|2,0,0]=4 1047 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S PI-21086 [1,1,0,0,0,0|1,1,0]=4 1048 B9R1.69 C1=CC(=C(C=C1Cl)F)Cl PI-16933 [1,1,0,0,0,0|2,0,0]=4 1049 B9R1.69 C1=CC(=C(C=C1Cl)F)I PI-20092 [1,1,0,0,0,0|2,0,0]=4 1050 B9R1.69 C1=CC(=C(C=C1Cl)F)N PI-31238 [1,1,0,0,0,0|2,0,0]=4 1051 B9R1.69 C1=CC(=C(C=C1Cl)F)O PI-28420 [1,1,0,0,0,0|1,0,0]=3 1052 B9R1.69 C1=CC(=C(C=C1Cl)I)Cl PI-21046 [1,1,0,0,0,0|2,0,0]=4 1053 B9R1.69 C1=CC(=C(C=C1Cl)N)F PI-28267 [1,1,0,0,0,0|2,0,0]=4 1054 B9R1.69 C1=CC(=C(C=C1Cl)N)N PI-16272 [1,1,0,0,0,0|2,0,0]=4 1055 B9R1.69 C1=CC(=C(C=C1Cl)O)Br PI-34266 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.69 C1=CC(=C(C=C1Cl)O)N PI-11790 [1,1,0,0,0,0|1,0,0]=3 1057 B9R1.69 C1=CC(=C(C=C1Cl)S)Cl PI-21357 [1,1,0,0,0,0|1,1,0]=4 1058 B9R1.69 C1=CC(=C(C=C1F)Br)Br PI-20967 [1,1,0,0,0,0|2,0,0]=4 1059 B9R1.69 C1=CC(=C(C=C1F)Br)Cl PI-20627 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.69 C1=CC(=C(C=C1F)Br)F PI-28496 [1,1,0,0,0,0|2,0,0]=4 1061 B9R1.69 C1=CC(=C(C=C1F)Br)N PI-16538 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.69 C1=CC(=C(C=C1F)Cl)Br PI-20629 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.69 C1=CC(=C(C=C1F)Cl)Cl PI-16890 [1,1,0,0,0,0|2,0,0]=4 1064 B9R1.69 C1=CC(=C(C=C1F)Cl)O PI-16901 [1,1,0,0,0,0|1,0,0]=3 1065 B9R1.69 C1=CC(=C(C=C1F)F)Cl PI-16888 [1,1,0,0,0,0|2,0,0]=4 1066 B9R1.69 C1=CC(=C(C=C1F)F)O PI-16940 [1,1,0,0,0,0|1,0,0]=3 1067 B9R1.69 C1=CC(=C(C=C1F)I)Br PI-14444 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.69 C1=CC(=C(C=C1F)I)N PI-10294 [1,1,0,0,0,0|2,0,0]=4 1069 B9R1.69 C1=CC(=C(C=C1F)N)Cl PI-28546 [1,1,0,0,0,0|2,0,0]=4 1070 B9R1.69 C1=CC(=C(C=C1F)N)I PI-10621 [1,1,0,0,0,0|2,0,0]=4 1071 B9R1.69 C1=CC(=C(C=C1F)N)N PI-30535 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.69 C1=CC(=C(C=C1F)O)N PI-28627 [1,1,0,0,0,0|1,0,0]=3 1073 B9R1.69 C1=CC(=C(C=C1I)Cl)Cl PI-30279 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.69 C1=CC(=C(C=C1I)Cl)F PI-17308 [1,1,0,0,0,0|2,0,0]=4 1075 B9R1.69 C1=CC(=C(C=C1I)Cl)N PI-12088 [1,1,0,0,0,0|2,0,0]=4 1076 B9R1.69 C1=CC(=C(C=C1I)F)F PI-28714 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.69 C1=CC(=C(C=C1I)F)N PI-16385 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.69 C1=CC(=C(C=C1I)F)O PI-43132 [1,1,0,0,0,0|1,0,0]=3 1079 B9R1.69 C1=CC(=C(C=C1N)Cl)F PI-15213 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.69 C1=CC(=C(C=C1N)Cl)N PI-30776 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.69 C1=CC(=C(C=C1N)F)Cl PI-28447 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.69 C1=CC(=C(C=C1N)I)N PI-34733 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.69 C1=CC(=C(C=C1N)N)F PI-28702 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.69 C1=CC(=C(C=C1N)N)N PI-30777 [1,1,0,0,0,0|2,0,0]=4 1085 B9R1.69 C1=CC(=C(C=C1O)Cl)F PI-16912 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.69 C1=CC(=C(C=C1O)F)Cl PI-10651 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.69 C1=CC(=C(C=C1O)F)N PI-16958 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.69 C1=CC(=C(C=C1S)Cl)Cl PI-21087 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.69 C1=CC(=C(C=C1S)Cl)F PI-20118 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.69 C1=CC(=C(C=C1S)F)F PI-28680 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.69 C1=CC(=C(C=C1S)S)Cl PI-11011 [1,1,0,0,0,0|1,1,0]=4 1092 B9R1.69 C1=CC(=O)C(=CC1=O)Cl PI-17305 [1,1,0,0,0,0|1,0,1]=4 1093 B9R1.69 CC1=C(C=C(C=C1)Br)N PI-31358 [1,1,0,0,0,0|1,0,0]=3 1094 B9R1.69 CC1=C(C=C(C=C1)Cl)Br PI-20668 [1,1,0,0,0,0|1,0,0]=3 1095 B9R1.69 CC1=C(C=C(C=C1)Cl)F PI-16988 [1,1,0,0,0,0|1,0,0]=3 1096 B9R1.69 CC1=C(C=C(C=C1)Cl)I PI-19456 [1,1,0,0,0,0|1,0,0]=3 1097 B9R1.69 CC1=C(C=C(C=C1)Cl)O PI-28617 [1,1,0,0,0,0|0,0,0]=2 1098 B9R1.69 CC1=C(C=C(C=C1)F)C PI-11592 [1,1,0,0,0,0|0,0,0]=2 1099 B9R1.69 CC1=C(C=C(C=C1)F)Cl PI-28544 [1,1,0,0,0,0|1,0,0]=3 1100 B9R1.69 CC1=C(C=C(C=C1)F)F PI-28545 [1,1,0,0,0,0|1,0,0]=3 1101 B9R1.69 CC1=C(C=C(C=C1)F)I PI-10676 [1,1,0,0,0,0|1,0,0]=3 1102 B9R1.69 CC1=C(C=C(C=C1)F)N PI-16382 [1,1,0,0,0,0|1,0,0]=3 1103 B9R1.69 CC1=C(C=C(C=C1)I)F PI-10672 [1,1,0,0,0,0|1,0,0]=3 1104 B9R1.69 CC1=C(C=C(C=C1)I)N PI-19927 [1,1,0,0,0,0|1,0,0]=3 1105 B9R1.69 CC1=C(C=C(C=C1)N)Br PI-10966 [1,1,0,0,0,0|1,0,0]=3 1106 B9R1.69 CC1=C(C=C(C=C1)N)Cl PI-34322 [1,1,0,0,0,0|1,0,0]=3 1107 B9R1.69 CC1=C(C=C(C=C1)N)F PI-16383 [1,1,0,0,0,0|1,0,0]=3 1108 B9R1.69 CC1=C(C=C(C=C1)N)I PI-19496 [1,1,0,0,0,0|1,0,0]=3 1109 B9R1.69 CC1=C(C=C(C=C1)N)O PI-11314 [1,1,0,0,0,0|0,0,0]=2 1110 B9R1.69 CC1=C(C=C(C=C1)O)N PI-11312 [1,1,0,0,0,0|1,0,0]=3 1111 B9R1.69 CC1=C(C=C(C=C1)S)C PI-11009 [1,1,0,0,0,0|0,0,0]=2 1112 B9R1.69 CC1=C(C=C(C=N1)Br)N PI-40246 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.69 CC1=C(C=CC(=C1)Br)Cl PI-20675 [1,1,0,0,0,0|1,0,0]=3 1114 B9R1.69 CC1=C(C=CC(=C1)Br)F PI-31216 [1,1,0,0,0,0|1,0,0]=3 1115 B9R1.69 CC1=C(C=CC(=C1)Cl)F PI-28542 [1,1,0,0,0,0|1,0,0]=3 1116 B9R1.69 CC1=C(C=CC(=C1)Cl)N PI-34323 [1,1,0,0,0,0|1,0,0]=3 1117 B9R1.69 CC1=C(C=CC(=C1)Cl)O PI-11333 [1,1,0,0,0,0|0,0,0]=2 1118 B9R1.69 CC1=C(C=CC(=C1)F)Br PI-16983 [1,1,0,0,0,0|1,0,0]=3 1119 B9R1.69 CC1=C(C=CC(=C1)F)Cl PI-16931 [1,1,0,0,0,0|1,0,0]=3 1120 B9R1.69 CC1=C(C=CC(=C1)F)F PI-28543 [1,1,0,0,0,0|1,0,0]=3 1121 B9R1.69 CC1=C(C=CC(=C1)F)I PI-10678 [1,1,0,0,0,0|1,0,0]=3 1122 B9R1.69 CC1=C(C=CC(=C1)F)N PI-16985 [1,1,0,0,0,0|1,0,0]=3 1123 B9R1.69 CC1=C(C=CC(=C1)I)Cl PI-19072 [1,1,0,0,0,0|1,0,0]=3 1124 B9R1.69 CC1=C(C=CC(=C1)I)F PI-10673 [1,1,0,0,0,0|1,0,0]=3 1125 B9R1.69 CC1=C(C=CC(=C1)I)N PI-30113 [1,1,0,0,0,0|1,0,0]=3 1126 B9R1.69 CC1=C(C=CC(=C1)N)Cl PI-24577 [1,1,0,0,0,0|1,0,0]=3 1127 B9R1.69 CC1=C(C=CC(=C1)N)F PI-16984 [1,1,0,0,0,0|1,0,0]=3 1128 B9R1.69 CC1=C(C=CC(=C1)N)O PI-10082 [1,1,0,0,0,0|0,0,0]=2 1129 B9R1.69 CC1=C(C=CC(=C1)O)F PI-10655 [1,1,0,0,0,0|1,0,0]=3 1130 B9R1.69 CC1=C(C=CC(=C1)O)N PI-11473 [1,1,0,0,0,0|1,0,0]=3 1131 B9R1.69 CC1=C(C=CC(=C1)S)F PI-23789 [1,1,0,0,0,0|1,0,0]=3 1132 B9R1.69 CC1=C(C=CC(=N1)Br)Br PI-34456 [1,1,0,0,0,0|2,0,0]=4 1133 B9R1.69 CC1=C(C=CC(=N1)Br)F PI-10396 [1,1,0,0,0,0|2,0,0]=4 1134 B9R1.69 CC1=C(C=CC(=N1)Br)N PI-34984 [1,1,0,0,0,0|2,0,0]=4 1135 B9R1.69 CC1=C(C=CC(=N1)Cl)F PI-34442 [1,1,0,0,0,0|2,0,0]=4 1136 B9R1.69 CC1=C(C=CC(=N1)F)Br PI-35833 [1,1,0,0,0,0|2,0,0]=4 1137 B9R1.69 CC1=C(C=CC(=N1)F)N PI-32879 [1,1,0,0,0,0|2,0,0]=4 1138 B9R1.69 CC1=C(C=CC(=N1)N)Br PI-10444 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.69 CC1=C(C=CC(=N1)N)Cl PI-34982 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.69 CC1=C(N=C(C=C1)N)Cl PI-39853 [1,1,0,0,0,0|2,0,0]=4 1141 B9R1.69 CC1=CC(=C(C=C1)Br)Cl PI-20674 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.69 CC1=CC(=C(C=C1)C)O PI-33176 [1,1,0,0,0,0|0,0,0]=2 1143 B9R1.69 CC1=CC(=C(C=C1)C)S PI-21355 [1,1,0,0,0,0|0,1,0]=3 1144 B9R1.69 CC1=CC(=C(C=C1)Cl)Br PI-20672 [1,1,0,0,0,0|2,0,0]=4 1145 B9R1.69 CC1=CC(=C(C=C1)Cl)C PI-24680 [1,1,0,0,0,0|1,0,0]=3 1146 B9R1.69 CC1=CC(=C(C=C1)Cl)F PI-10669 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.69 CC1=CC(=C(C=C1)Cl)N PI-17325 [1,1,0,0,0,0|2,0,0]=4 1148 B9R1.69 CC1=CC(=C(C=C1)Cl)O PI-42096 [1,1,0,0,0,0|1,0,0]=3 1149 B9R1.69 CC1=CC(=C(C=C1)F)Cl PI-10668 [1,1,0,0,0,0|2,0,0]=4 1150 B9R1.69 CC1=CC(=C(C=C1)F)F PI-16918 [1,1,0,0,0,0|2,0,0]=4 1151 B9R1.69 CC1=CC(=C(C=C1)F)I PI-10677 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.69 CC1=CC(=C(C=C1)F)N PI-16989 [1,1,0,0,0,0|2,0,0]=4 1153 B9R1.69 CC1=CC(=C(C=C1)F)O PI-10653 [1,1,0,0,0,0|1,0,0]=3 1154 B9R1.69 CC1=CC(=C(C=C1)I)Br PI-21532 [1,1,0,0,0,0|2,0,0]=4 1155 B9R1.69 CC1=CC(=C(C=C1)I)Cl PI-19073 [1,1,0,0,0,0|2,0,0]=4 1156 B9R1.69 CC1=CC(=C(C=C1)I)F PI-10675 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.69 CC1=CC(=C(C=C1)I)I PI-19174 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.69 CC1=CC(=C(C=C1)N)C PI-27338 [1,1,0,0,0,0|1,0,0]=3 1159 B9R1.69 CC1=CC(=C(C=C1)N)Cl PI-20150 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.69 CC1=CC(=C(C=C1)N)O PI-28344 [1,1,0,0,0,0|1,0,0]=3 1161 B9R1.69 CC1=CC(=C(C=C1)N)S PI-41435 [1,1,0,0,0,0|1,1,0]=4 1162 B9R1.69 CC1=CC(=C(C=C1)O)Cl PI-19823 [1,1,0,0,0,0|1,0,0]=3 1163 B9R1.69 CC1=CC(=C(C=C1)O)N PI-44624 [1,1,0,0,0,0|1,0,0]=3 1164 B9R1.69 CC1=CC(=C(C=C1)S)C PI-21999 [1,1,0,0,0,0|0,1,0]=3 1165 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30102 [1,1,0,0,0,0|1,1,0]=4 1166 B9R1.69 CC1=CC(=C(C=C1)[S-])[S-] PI-30441 [1,1,0,0,0,0|1,1,0]=4 1167 B9R1.69 CC1=CC(=C(N=C1)C)C PI-16692 [1,1,0,0,0,0|1,0,0]=3 1168 B9R1.69 CC1=CC(=CN=C1Br)N PI-27538 [1,1,0,0,0,0|2,0,0]=4 1169 B9R1.69 CC1=CC(=CN=C1Cl)Br PI-24299 [1,1,0,0,0,0|2,0,0]=4 1170 B9R1.69 CC1=CC(=CN=C1Cl)F PI-32877 [1,1,0,0,0,0|2,0,0]=4 1171 B9R1.69 CC1=CC(=CN=C1Cl)N PI-34979 [1,1,0,0,0,0|2,0,0]=4 1172 B9R1.69 CC1=CC(=CN=C1F)Br PI-32872 [1,1,0,0,0,0|2,0,0]=4 1173 B9R1.69 CC1=CC(=CN=C1F)N PI-32878 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.69 CC1=CC(=CN=C1N)Br PI-25459 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.69 CC1=CC(=NC=C1Br)Br PI-39259 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.69 CC1=CC(=NC=C1N)Cl PI-30838 [1,1,0,0,0,0|2,0,0]=4 1177 B9R1.69 CC1=CC(N)=NC=C1B PI-30996 [1,1,0,0,0,0|2,0,0]=4 1178 B9R1.69 CC1=CC(N)=NC=C1Cl PI-31795 [1,1,0,0,0,0|2,0,0]=4 1179 B9R1.69 CC1=CN=C(C(=N1)C)C PI-11726 [1,1,0,0,0,0|2,0,0]=4 1180 B9R1.69 CC1=NC(=C(C=C1)N)C PI-16694 [1,1,0,0,0,0|2,0,0]=4 1181 B9R1.69 CC1=NC(=C(C=C1)N)C PI-33783 [1,1,0,0,0,0|2,0,0]=4 1182 B9R1.69 CC1=NC(=C(C=C1)O)C PI-21953 [1,1,0,0,0,0|1,0,0]=3 1183 B9R1.69 CC1=[N+](C=C(C=C1)Br)[O-] PI-34301 [1,1,0,0,0,0|1,0,1]=4 1184 B9R1.69 CN1C=CC(=CC1=O)Br PI-40242 [1,1,0,0,0,0|1,0,1]=4 1185 B9R1.69 Cc1ccc(Br)cc1F PI-31215 [1,1,0,0,0,0|1,0,0]=3 1186 B9R1.69 Cc1ccc(I)c(N)c1 PI-13704 [1,1,0,0,0,0|2,0,0]=4 1187 B9R1.69 Cc1ccc(N)c(Br)c1 PI-21582 [1,1,0,0,0,0|2,0,0]=4 1188 B9R1.69 Cc1ccc(c(c1)Br)F PI-28541 [1,1,0,0,0,0|2,0,0]=4 1189 B9R1.69 Cc1ccc(c(c1)C)Br PI-38906 [1,1,0,0,0,0|1,0,0]=3 1190 B9R1.69 Cc1ccc(c(c1)F)Br PI-16987 [1,1,0,0,0,0|2,0,0]=4 1191 B9R1.69 Cc1ccc(c(c1)F)N PI-16381 [1,1,0,0,0,0|2,0,0]=4 1192 B9R1.69 Cc1ccc(c(c1)N)Br PI-32614 [1,1,0,0,0,0|2,0,0]=4 1193 B9R1.69 Cc1ccc(c(c1)N)N PI-33398 [1,1,0,0,0,0|2,0,0]=4 1194 B9R1.69 Cc1ccc(c(c1)O)O PI-11188 [1,1,0,0,0,0|1,0,0]=3 1195 B9R1.69 Cc1ccc(c(n1)C)Br PI-14419 [1,1,0,0,0,0|2,0,0]=4 1196 B9R1.69 Cc1ncc(c(c1)C)N PI-38589 [1,1,0,0,0,0|2,0,0]=4 1197 B9R1.69 ClC1=CC(=C(C=C1)F)O PI-10650 [1,1,0,0,0,0|1,0,0]=3 1198 B9R1.69 ClC1=CC(I)=CC=C1Br PI-41927 [1,1,0,0,0,0|2,0,0]=4 1199 B9R1.69 Clc1ccc(c(c1)Br)Cl PI-21593 [1,1,0,0,0,0|2,0,0]=4 1200 B9R1.69 Clc1ccc(c(c1)Br)F PI-20628 [1,1,0,0,0,0|2,0,0]=4 1201 B9R1.69 Clc1ccc(c(c1)Br)I PI-38902 [1,1,0,0,0,0|2,0,0]=4 1202 B9R1.69 Clc1ccc(c(c1)Br)N PI-21370 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.69 Clc1ccc(c(c1)C)Br PI-20669 [1,1,0,0,0,0|1,0,0]=3 1204 B9R1.69 Clc1ccc(c(c1)C)C PI-11593 [1,1,0,0,0,0|0,0,0]=2 1205 B9R1.69 Clc1ccc(c(c1)C)I PI-30351 [1,1,0,0,0,0|1,0,0]=3 1206 B9R1.69 Clc1ccc(c(c1)F)Br PI-20626 [1,1,0,0,0,0|2,0,0]=4 1207 B9R1.69 Clc1ccc(c(c1)F)F PI-12302 [1,1,0,0,0,0|2,0,0]=4 1208 B9R1.69 Clc1ccc(c(c1)N)S PI-14245 [1,1,0,0,0,0|1,1,0]=4 1209 B9R1.69 Clc1ccc(c(c1)O)O PI-11978 [1,1,0,0,0,0|1,0,0]=3 1210 B9R1.69 Clc1ccc(c(n1)C)N PI-38623 [1,1,0,0,0,0|2,0,0]=4 1211 B9R1.69 Clc1cnc(Br)c(C)c1 PI-35935 [1,1,0,0,0,0|2,0,0]=4 1212 B9R1.69 Clc1ncc(c(c1)C)Br PI-38910 [1,1,0,0,0,0|2,0,0]=4 1213 B9R1.69 Fc1ccc(C)c(S)c1 PI-23790 [1,1,0,0,0,0|0,1,0]=3 1214 B9R1.69 Fc1ccc(I)c(Br)c1 PI-14445 [1,1,0,0,0,0|2,0,0]=4 1215 B9R1.69 Fc1ccc(N)c(F)c1 PI-15215 [1,1,0,0,0,0|2,0,0]=4 1216 B9R1.69 Fc1ccc(S)c(C)c1 PI-23788 [1,1,0,0,0,0|0,1,0]=3 1217 B9R1.69 Fc1ccc(c(c1)Br)C PI-16886 [1,1,0,0,0,0|1,0,0]=3 1218 B9R1.69 Fc1ccc(c(c1)Br)O PI-21470 [1,1,0,0,0,0|1,0,0]=3 1219 B9R1.69 Fc1ccc(c(c1)Cl)F PI-28303 [1,1,0,0,0,0|2,0,0]=4 1220 B9R1.69 Fc1ccc(c(c1)Cl)S PI-20117 [1,1,0,0,0,0|1,1,0]=4 1221 B9R1.69 Fc1ccc(c(c1)F)Br PI-32222 [1,1,0,0,0,0|2,0,0]=4 1222 B9R1.69 Fc1ccc(c(c1)F)F PI-10729 [1,1,0,0,0,0|2,0,0]=4 1223 B9R1.69 Fc1ccc(c(c1)F)S PI-16902 [1,1,0,0,0,0|1,1,0]=4 1224 B9R1.69 Fc1ccc(c(c1)N)Br PI-10617 [1,1,0,0,0,0|2,0,0]=4 1225 B9R1.69 Fc1ccc(c(c1)N)F PI-16941 [1,1,0,0,0,0|2,0,0]=4 1226 B9R1.69 Fc1ccc(c(c1)N)O PI-15926 [1,1,0,0,0,0|1,0,0]=3 1227 B9R1.69 Fc1ccc(c(c1)O)Br PI-31067 [1,1,0,0,0,0|1,0,0]=3 1228 B9R1.69 Fc1ccc(c(c1)O)C PI-10656 [1,1,0,0,0,0|0,0,0]=2 1229 B9R1.69 Fc1ccc(c(c1)O)Cl PI-10649 [1,1,0,0,0,0|1,0,0]=3 1230 B9R1.69 Fc1ccc(c(c1)O)F PI-16913 [1,1,0,0,0,0|1,0,0]=3 1231 B9R1.69 Fc1ccc(c(c1)O)O PI-16942 [1,1,0,0,0,0|1,0,0]=3 1232 B9R1.69 Fc1cnc(c(c1)C)Br PI-34447 [1,1,0,0,0,0|2,0,0]=4 1233 B9R1.69 Fc1ncc(C)c(I)c1 PI-34432 [1,1,0,0,0,0|2,0,0]=4 1234 B9R1.69 Fc1ncc(c(c1)C)Br PI-38328 [1,1,0,0,0,0|2,0,0]=4 1235 B9R1.69 IC1=CC(O)=C(Cl)C=C1 PI-46497 [1,1,0,0,0,0|1,0,0]=3 1236 B9R1.69 IC1=CC=C(Br)C(Br)=C1 PI-41928 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.69 IC1=CC=C(Br)C=C1F PI-21451 [1,1,0,0,0,0|2,0,0]=4 1238 B9R1.69 IC1=CC=C(F)C=C1F PI-28291 [1,1,0,0,0,0|2,0,0]=4 1239 B9R1.69 Ic1ccc(Br)c(C)c1 PI-21531 [1,1,0,0,0,0|1,0,0]=3 1240 B9R1.69 Ic1ccc(F)c(Br)c1 PI-21453 [1,1,0,0,0,0|2,0,0]=4 1241 B9R1.69 Ic1ccc(c(c1)F)Br PI-14443 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.69 NC1=C(Cl)C=C(O)C=C1 PI-39809 [1,1,0,0,0,0|2,0,0]=4 1243 B9R1.69 NC1=CC(Br)=CC=C1Cl PI-20602 [1,1,0,0,0,0|2,0,0]=4 1244 B9R1.69 NC1=CC=C(Br)C=C1I PI-39519 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.69 NC1=CC=C(Cl)C(N)=C1 PI-11322 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.69 NC1=NC(Br)=C(C)C=C1 PI-39854 [1,1,0,0,0,0|2,0,0]=4 1247 B9R1.69 Nc1ccc(Br)c(C)c1 PI-21584 [1,1,0,0,0,0|1,0,0]=3 1248 B9R1.69 Nc1ccc(C)c(O)c1 PI-11313 [1,1,0,0,0,0|0,0,0]=2 1249 B9R1.69 Nc1ccc(F)c(C)n1 PI-34452 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.69 Nc1ccc(O)c(Cl)c1 PI-11818 [1,1,0,0,0,0|1,0,0]=3 1251 B9R1.69 Nc1ccc(O)c(F)c1 PI-28497 [1,1,0,0,0,0|1,0,0]=3 1252 B9R1.69 Nc1ccc(c(c1)Br)F PI-12304 [1,1,0,0,0,0|2,0,0]=4 1253 B9R1.69 Nc1ccc(c(c1)C)N PI-19993 [1,1,0,0,0,0|1,0,0]=3 1254 B9R1.69 Nc1ccc(c(c1)Cl)Br PI-20601 [1,1,0,0,0,0|2,0,0]=4 1255 B9R1.69 Nc1ccc(c(c1)Cl)I PI-30125 [1,1,0,0,0,0|2,0,0]=4 1256 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38011 [1,1,0,0,0,0|2,0,0]=4 1257 B9R1.69 Nc1ccc(c(c1)Cl)N PI-38070 [1,1,0,0,0,0|2,0,0]=4 1258 B9R1.69 Nc1ccc(c(c1)F)Br PI-10618 [1,1,0,0,0,0|2,0,0]=4 1259 B9R1.69 Nc1ccc(c(c1)F)I PI-10620 [1,1,0,0,0,0|2,0,0]=4 1260 B9R1.69 O=C1C=CC(N)=CN1C PI-46613 [1,1,0,0,0,0|1,0,1]=4 1261 B9R1.69 OC1=CC(Cl)=CC=C1I PI-40949 [1,1,0,0,0,0|1,0,0]=3 1262 B9R1.69 OC1=CC=C(Br)C=C1O PI-37116 [1,1,0,0,0,0|1,0,0]=3 1263 B9R1.69 OC1=CC=C(C)C=C1Br PI-14476 [1,1,0,0,0,0|1,0,0]=3 1264 B9R1.69 OC1=CC=C(N)C(Cl)=C1 PI-42395 [1,1,0,0,0,0|2,0,0]=4 1265 B9R1.69 OC1=CC=C(N)C=C1N PI-32464 [1,1,0,0,0,0|1,0,0]=3 1266 B9R1.69 Oc1cc(Cl)ccc1Cl PI-34659 [1,1,0,0,0,0|1,0,0]=3 1267 B9R1.69 Oc1ccc(Br)c(F)c1 PI-10426 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.69 Oc1ccc(Br)c(O)c1 PI-28737 [1,1,0,0,0,0|1,0,0]=3 1269 B9R1.69 Oc1ccc(C)c(C)c1 PI-34164 [1,1,0,0,0,0|0,0,0]=2 1270 B9R1.69 Oc1ccc(C)c(F)c1 PI-10654 [1,1,0,0,0,0|1,0,0]=3 1271 B9R1.69 Oc1ccc(F)c(N)c1 PI-33926 [1,1,0,0,0,0|2,0,0]=4 1272 B9R1.69 Oc1ccc(c(c1)Br)Cl PI-39217 [1,1,0,0,0,0|2,0,0]=4 1273 B9R1.69 Oc1ccc(c(c1)Br)F PI-10647 [1,1,0,0,0,0|2,0,0]=4 1274 B9R1.69 Oc1ccc(c(c1)C)Br PI-14477 [1,1,0,0,0,0|1,0,0]=3 1275 B9R1.69 Oc1ccc(c(c1)F)F PI-16914 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.69 Oc1ccc(c(c1)O)C PI-19649 [1,1,0,0,0,0|0,0,0]=2 1277 B9R1.69 Oc1ccc(c(c1)O)F PI-10442 [1,1,0,0,0,0|1,0,0]=3 1278 B9R1.69 Oc1ccc(c(c1)O)O PI-31220 [1,1,0,0,0,0|1,0,0]=3 1279 B9R1.69 Sc1ccc(C)c(F)c1 PI-23787 [1,1,0,0,0,0|1,0,0]=3 1280 B9R1.69 Sc1ccc(c(c1)C)O PI-18459 [1,1,0,0,0,0|0,0,0]=2 1281 B9R1.14 COC1=CSC=C1OC PI-29650 [0,1,0,0,1,0|1,0,0]=3 1282 B9R1.27 CCc1c(C)c[nH]c1C PI-31899 [0,1,0,0,1,0|2,0,0]=4 1283 B9R1.33 CCOc1ocnc1C PI-13057 [0,1,0,0,1,0|2,0,0]=4 1284 B9R1.41 CC(=O)C1=CC=CN1C PI-12067 [0,1,0,0,1,0|2,0,0]=4 1285 B9R1.41 CC1=C(SC=C1)C(=O)C PI-35069 [0,1,0,0,1,0|2,0,0]=4 1286 B11R1.8 CC1=C(C=C(C=C1F)F)C#N PI-34487 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.8 CC1=CC(=C(C(=C1)OC)C)C PI-19293 [0,2,0,0,0,0|0,0,0]=2 1288 B11R1.8 COC1=C(C(=CC(=C1)Br)F)F PI-21622 [0,2,0,0,0,0|1,0,0]=3 1289 B11R1.8 COC1=CC(=CC(=C1Cl)F)Br PI-43262 [0,2,0,0,0,0|1,0,0]=3 1290 B11R1.13 CC1=C(C(=CC=C1)N=C=S)C PI-23926 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.13 CC1=C(C=CC=C1Cl)N=C=O PI-20174 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.13 CC1=C(C=CC=C1Cl)N=C=S PI-19267 [0,2,0,0,0,0|1,0,1]=4 1293 B11R1.13 CCOC1=C(C(=CC=C1)F)F PI-21166 [0,2,0,0,0,0|1,0,0]=3 1294 B11R1.13 Cc1c(cccc1F)N=C=S PI-23770 [0,2,0,0,0,0|1,0,1]=4 1295 B11R1.72 CC1=CN=C(C(=C1OC)C)Cl PI-13037 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.72 CC1=[N+](C=CC(=C1OC)Cl)[O-] PI-11973 [0,2,0,0,0,0|1,0,0]=3 1297 B11R1.72 COC1=C(C=CC(=C1F)F)Br PI-42641 [0,2,0,0,0,0|1,0,0]=3 1298 B11R1.72 COC1=C(C=CC(=C1F)F)F PI-10734 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.159 B(C1=C(C(=CC=C1)Cl)C)(O)O PI-19429 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.159 CC(=O)C1=C(C(=CC=C1)Cl)Cl PI-20997 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.159 CC(=O)C1=C(C(=CC=C1)N)O PI-10229 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)O PI-30124 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.159 CC(=O)c1cccc(Br)c1F PI-34270 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.159 CC(=O)c1cccc(c1F)F PI-21122 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.159 CC(=O)c1cccc(c1O)N PI-39350 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O PI-41897 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O PI-29482 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.159 CC1=C(C(=CC=C1)C(=O)C)C PI-30311 [0,2,0,0,0,0|1,0,0]=3 1309 B11R1.159 CC1=C(C(=CC=C1)C(=O)Cl)C PI-21939 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)C PI-27770 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.159 CC1=C(C=CC=C1Br)C(=O)O PI-22125 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.159 CC1=C(C=CC=C1Br)[N+](=O)[O-] PI-26737 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.159 CC1=C(C=CC=C1Cl)[N+](=O)[O-] PI-34382 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.159 CC1=C(C=CC=C1O)C(=O)O PI-11926 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.159 CC1=C(C=CC=C1O)[N+](=O)[O-] PI-31225 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.159 CC1=C(C=CC=C1[N+](=O)[O-])N PI-31240 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.159 CN(C)C1=C(C(=CC=C1)Cl)Cl PI-21030 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.159 ClC(=O)c1cccc(c1C)Br PI-39385 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.159 O=C(N)C1=CC=CC(C)=C1C PI-30715 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.159 O=C(O)C1=CC=CC(N)=C1C PI-16107 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.159 OB(C1=CC=CC(C)=C1C)O PI-25274 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.159 OB(c1cccc(c1C)F)O PI-19177 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.159 OC(=O)c1cccc(F)c1C PI-10192 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.159 [O-][N+](=O)c1cccc(F)c1C PI-32534 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.265 C1=CC(=C(C(=C1)Br)CBr)CBr PI-44068 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.265 COC1=C(C(=CC=C1)F)C#N PI-10703 [0,2,0,0,0,0|0,0,1]=3 1327 B11R1.265 COC1=C(C(=NC=C1)Cl)OC PI-26028 [0,2,0,0,0,0|1,0,0]=3 1328 B11R1.265 COC1=C(C(=O)NC=C1)C#N PI-12778 [0,2,0,0,0,0|1,0,1]=4 1329 B11R1.265 COC1=C(C=CC=C1F)C#N PI-34278 [0,2,0,0,0,0|0,0,1]=3 1330 B11R1.265 COC1=C(C=CC=C1F)C=O PI-10581 [0,2,0,0,0,0|0,0,1]=3 1331 B11R1.265 COC1=C(N=CN=C1OC)N PI-30653 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.265 COC1=CC=CC(=C1OC)N PI-23185 [0,2,0,0,0,0|0,0,0]=2 1333 B11R1.265 COC1=NC=CC(=C1C=O)I PI-26178 [0,2,0,0,0,0|1,0,1]=4 1334 B11R1.265 COc1c(OC)cccc1F PI-23612 [0,2,0,0,0,0|0,0,0]=2 1335 B11R1.265 COc1c(OC)cccc1O PI-21294 [0,2,0,0,0,0|0,0,0]=2 1336 B11R1.265 COc1cccc(Cl)c1C#N PI-19015 [0,2,0,0,0,0|0,0,1]=3 1337 B11R1.265 COc1cccc(F)c1C=O PI-27188 [0,2,0,0,0,0|0,0,1]=3 1338 B11R1.265 COc1cccc(F)c1CN PI-30162 [0,2,0,0,0,0|0,0,0]=2 1339 B11R1.265 O=CC1=C(OC)C=CC=C1O PI-29855 [0,2,0,0,0,0|0,0,1]=3 1340 B11R1.267 CC1=C(C=CC=C1C#N)C#N PI-11945 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.267 CC1=C(OC)C=CN=C1CCl PI-41098 [0,2,0,0,0,0|1,0,0]=3 1342 B11R1.267 CCC1=C(C(=CC=C1)CC)Br PI-19810 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.267 CCC1=C(C(=CC=C1)CC)N PI-33866 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.267 COC1=C(C(=CC=C1)OC)Br PI-34350 [0,2,0,0,0,0|1,0,0]=3 1345 B11R1.267 COC1=C(C(=CC=C1)OC)N PI-21281 [0,2,0,0,0,0|1,0,0]=3 1346 B11R1.267 COC1=CC=CC(=C1F)C=O PI-27049 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.267 OCC1=NC=CC(OC)=C1C PI-39845 [0,2,0,0,0,0|1,0,0]=3 1348 B11R1.278 CC1=C(C(=C(C=C1)C=O)C)F PI-26591 [0,2,0,0,0,0|2,0,0]=4 1349 B11R1.278 CC1=C(C=CC(=C1F)F)C#N PI-34466 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.278 COC1=C(C(=C(C=C1)Br)F)F PI-34351 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.278 COc1ccc(Cl)c(Cl)c1Cl PI-12545 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.17 C1=CC=C(C(=C1)C#CCO)Br PI-14510 [0,2,0,0,0,0|2,0,0]=4 1353 B11R1.17 C1=CC=C(C(=C1)C#CCO)Cl PI-20216 [0,2,0,0,0,0|2,0,0]=4 1354 B11R1.17 CC1=CC=CC=C1CN=C=O PI-11437 [0,2,0,0,0,0|1,0,1]=4 1355 B11R1.17 OCCSc1ccccc1Br PI-22561 [0,2,0,0,0,0|1,1,0]=4 1356 B11R1.17 [C-]#[N+]CCc1ccccc1F PI-23812 [0,2,0,0,0,0|2,0,0]=4 1357 B11R1.41 C1=CC=C(C(=C1)CCBr)C=O PI-32624 [0,2,0,0,0,0|1,0,1]=4 1358 B11R1.41 CCC1=NC=CN=C1OCC PI-11839 [0,2,0,0,0,0|2,0,0]=4 1359 B11R1.41 CCOc1ccccc1C#N PI-16029 [0,2,0,0,0,0|0,0,1]=3 1360 B11R1.41 COC1=CC=CC=C1CCN PI-31713 [0,2,0,0,0,0|0,0,0]=2 1361 B11R1.41 COC1=CC=CC=C1N=C=O PI-11426 [0,2,0,0,0,0|0,0,1]=3 1362 B11R1.41 O\N=C\c1ccccc1OC PI-27438 [0,2,0,0,0,0|0,0,1]=3 1363 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCN PI-11209 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCO PI-35237 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.81 C1=CC(=C(C=C1F)Cl)CCO PI-17322 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.81 CC1=C(C=CC(=C1)Br)N=C=O PI-14478 [0,2,0,0,0,0|1,0,1]=4 1367 B11R1.81 CC1=C(C=CC(=C1)Br)N=C=S PI-14479 [0,2,0,0,0,0|1,0,1]=4 1368 B11R1.81 CC1=C(C=CC(=C1)F)N=C=S PI-23772 [0,2,0,0,0,0|1,0,1]=4 1369 B11R1.81 CC1=CC(=C(C=C1)CCN)C PI-23898 [0,2,0,0,0,0|1,0,0]=3 1370 B11R1.81 CC1=CC(=C(C=C1)N=C=S)C PI-23927 [0,2,0,0,0,0|1,0,1]=4 1371 B11R1.81 CC1=CC(=C(C=C1)NC=O)C PI-23924 [0,2,0,0,0,0|1,0,1]=4 1372 B11R1.81 CCCC1=C(C=C(C=C1)O)O PI-19259 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.81 CCNC1=C(C=C(C=C1)Cl)N PI-20049 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.86 C1=CC(=C(N=C1)Cl)OC(F)F PI-48892 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.86 CC(=O)Cc1ccccc1F PI-38595 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.86 CC(=O)NC1=CC=CC=C1Br PI-50525 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.86 CC(=O)NC1=CC=CC=C1F PI-34151 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.86 CC(=O)NC1=CC=CC=C1O PI-11773 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.86 CC(=O)Nc1ccccc1N PI-39094 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.86 CC(=O)OC1=CC=CC=C1Cl PI-10924 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.86 CC1=CC=CC=C1N=C(N)N PI-47265 [0,2,0,0,0,0|1,0,1]=4 1382 B11R1.86 CC1=CC=CC=C1NC(=S)N PI-24519 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.86 ClC(=O)Cc1ccccc1C PI-24889 [0,2,0,0,0,0|1,0,1]=4 1384 B11R1.86 FC(F)Oc1ccccc1N PI-21174 [0,2,0,0,0,0|1,0,0]=3 1385 B11R1.86 FC(Oc1ccccc1Br)F PI-21192 [0,2,0,0,0,0|1,0,0]=3 1386 B11R1.86 NC1=CC=CC=C1SC(C)C PI-40822 [0,2,0,0,0,0|1,1,0]=4 1387 B11R1.86 OC(=O)Cc1ccccc1C PI-30825 [0,2,0,0,0,0|1,0,1]=4 1388 B11R1.182 CC1=C(C=C(C=C1)Cl)N=C=O PI-24398 [0,2,0,0,0,0|1,0,1]=4 1389 B11R1.182 CC1=C(C=C(C=C1)F)N=C=S PI-23774 [0,2,0,0,0,0|1,0,1]=4 1390 B11R1.182 CC1=CC(=C(C=C1)C)CCN PI-23899 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.182 CC1=CC(=C(C=C1)C)N=C=S PI-23928 [0,2,0,0,0,0|1,0,1]=4 1392 B11R1.182 CCOC1=C(C=CC(=C1)N)Br PI-16386 [0,2,0,0,0,0|1,0,0]=3 1393 B11R1.182 Cc1ccc(F)cc1CC#N PI-23764 [0,2,0,0,0,0|1,0,1]=4 1394 B11R1.182 Cc1ccc(O)cc1NCC PI-11924 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.222 BrCC(=O)c1ccccc1Br PI-31567 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.222 BrCC(=O)c1ccccc1Cl PI-20199 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.222 BrCC(=O)c1ccccc1F PI-17348 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.222 BrCC(=O)c1ccccc1O PI-31566 [0,2,0,0,0,0|2,0,0]=4 1399 B11R1.222 CC(=NO)C1=CC=CC=C1O PI-29083 [0,2,0,0,0,0|2,0,0]=4 1400 B11R1.222 CC1=C(C=CC=N1)C(=O)OC PI-13128 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.222 CC1=CC=CC=C1C(=O)CBr PI-31565 [0,2,0,0,0,0|1,0,0]=3 1402 B11R1.222 CC1=CC=CC=C1C(=O)NN PI-24611 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.222 CCC(=O)C1=CC=CC=C1F PI-16905 [0,2,0,0,0,0|2,0,0]=4 1404 B11R1.222 CCC(=O)c1ccccc1O PI-15452 [0,2,0,0,0,0|2,0,0]=4 1405 B11R1.222 COC(=O)C1=C(C=CC=N1)Cl PI-34713 [0,2,0,0,0,0|2,0,0]=4 1406 B11R1.222 COC(=O)C1=C(C=CN=C1)N PI-33897 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.222 COC(=O)C1=C(C=NC=C1)O PI-34886 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.222 COC(=O)C1=C(N=CC=C1)Cl PI-24397 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.222 COC(=O)C1=C(N=CC=C1)N PI-35287 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.222 COC(=O)C1=CC=CC=C1Br PI-50462 [0,2,0,0,0,0|1,0,0]=3 1411 B11R1.222 COC(=O)C1=CC=CC=C1Cl PI-34231 [0,2,0,0,0,0|1,0,0]=3 1412 B11R1.222 COC(=O)C1=CC=CC=C1F PI-34134 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.222 COC(=O)C1=CC=CC=C1S PI-50244 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.222 COC(=O)c1ccccc1I PI-10942 [0,2,0,0,0,0|1,0,0]=3 1415 B11R1.222 COC(=O)c1ccncc1Br PI-38429 [0,2,0,0,0,0|2,0,0]=4 1416 B11R1.222 COC(=O)c1ccncc1Cl PI-36383 [0,2,0,0,0,0|2,0,0]=4 1417 B11R1.222 COC(=O)c1ccncc1N PI-35280 [0,2,0,0,0,0|2,0,0]=4 1418 B11R1.222 COC(=O)c1ncccc1N PI-39311 [0,2,0,0,0,0|2,0,0]=4 1419 B11R1.222 COC(=O)c1ncccc1O PI-31931 [0,2,0,0,0,0|2,0,0]=4 1420 B11R1.222 O=C(C1=CC=CNC1=O)OC PI-40201 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.222 O=C(C1=NC=CC=C1Br)OC PI-39663 [0,2,0,0,0,0|2,0,0]=4 1422 B11R1.605 C1=CC(=C(C(=C1)Cl)CCO)Cl PI-35238 [0,2,0,0,0,0|2,0,0]=4 1423 B11R1.605 CC1=C(C(=CC=C1)C)N=C=O PI-11412 [0,2,0,0,0,0|1,0,1]=4 1424 B11R1.605 CC1=C(C(=CC=C1)C)N=C=S PI-23929 [0,2,0,0,0,0|1,0,1]=4 1425 B11R1.605 CC1=C(C(=CC=C1)Cl)N=C=O PI-20173 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.605 CCCc1c(O)cccc1O PI-19109 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.605 NCCc1c(F)cccc1Cl PI-17329 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.37 C1=CC(=C(C=C1F)CBr)C#N PI-35256 [0,2,0,0,0,0|2,0,0]=4 1429 B11R1.37 CC1=CC(=C(C=C1)OC)OC PI-23359 [0,2,0,0,0,0|0,0,0]=2 1430 B11R1.37 CNC1=C(C=C(C=C1)Cl)C#N PI-12025 [0,2,0,0,0,0|1,0,1]=4 1431 B11R1.37 COC1=C(C=C(C=C1)Br)C=O PI-31926 [0,2,0,0,0,0|0,0,1]=3 1432 B11R1.37 COC1=C(C=C(C=C1)Br)CO PI-45731 [0,2,0,0,0,0|0,0,0]=2 1433 B11R1.37 COC1=C(C=C(C=C1)Cl)C#N PI-19723 [0,2,0,0,0,0|0,0,1]=3 1434 B11R1.37 COC1=C(C=C(C=C1)F)C#N PI-34276 [0,2,0,0,0,0|0,0,1]=3 1435 B11R1.37 COC1=C(C=C(C=C1)F)OC PI-23227 [0,2,0,0,0,0|0,0,0]=2 1436 B11R1.37 COC1=C(C=C(C=C1)I)C=O PI-26632 [0,2,0,0,0,0|0,0,1]=3 1437 B11R1.37 COC1=C(C=C(C=C1)S)OC PI-21358 [0,2,0,0,0,0|0,0,0]=2 1438 B11R1.37 COC1=C(C=C(C=N1)Br)C=O PI-26036 [0,2,0,0,0,0|1,0,1]=4 1439 B11R1.37 COC1=C(C=CC(=C1)F)C#N PI-23714 [0,2,0,0,0,0|0,0,1]=3 1440 B11R1.37 COC1=NC=C(N=C1OC)Br PI-43278 [0,2,0,0,0,0|2,0,0]=4 1441 B11R1.37 COc1cc(Br)ccc1OC PI-21655 [0,2,0,0,0,0|0,0,0]=2 1442 B11R1.37 COc1cc(F)ccc1C=O PI-38318 [0,2,0,0,0,0|0,0,1]=3 1443 B11R1.37 COc1cc(I)ccc1OC PI-23242 [0,2,0,0,0,0|0,0,0]=2 1444 B11R1.37 COc1cc(N)ccc1C#N PI-38838 [0,2,0,0,0,0|0,0,1]=3 1445 B11R1.37 COc1cc(N)ccc1OC PI-23186 [0,2,0,0,0,0|0,0,0]=2 1446 B11R1.37 COc1cc(O)ccc1C=O PI-11990 [0,2,0,0,0,0|0,0,1]=3 1447 B11R1.37 COc1cc(O)ccc1OC PI-28261 [0,2,0,0,0,0|0,0,0]=2 1448 B11R1.37 O=CC1=C(OC)N=CC(F)=C1 PI-40474 [0,2,0,0,0,0|1,0,1]=4 1449 B11R1.37 O=Cc1cc(Cl)ccc1OC PI-27028 [0,2,0,0,0,0|0,0,1]=3 1450 B11R1.53 B(C1=C(N=CC=C1)OC)(O)O PI-25218 [0,2,0,0,0,0|2,0,0]=4 1451 B11R1.53 B(C1=CC=CC=C1CBr)(O)O PI-14464 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.53 B(C1=CC=CC=C1CC)(O)O PI-32999 [0,2,0,0,0,0|2,0,0]=4 1453 B11R1.53 B(C1=CC=CC=C1CO)(O)O PI-25935 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.53 BrCc1ccccc1[N+](=O)[O-] PI-12707 [0,2,0,0,0,0|2,0,0]=4 1455 B11R1.53 C1=CC=C(C(=C1)CCl)C(=O)Cl PI-46932 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.53 C1=CC=C(C(=C1)CN)[N+](=O)[O-] PI-26345 [0,2,0,0,0,0|2,0,0]=4 1457 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O PI-32625 [0,2,0,0,0,0|2,0,0]=4 1458 B11R1.53 CC(=O)C1=CC=CC=C1C#N PI-30977 [0,2,0,0,0,0|1,0,1]=4 1459 B11R1.53 CNC1=CC=CC=C1C(=O)N PI-30904 [0,2,0,0,0,0|1,0,1]=4 1460 B11R1.53 CNC1=CC=CC=C1C(=O)O PI-50482 [0,2,0,0,0,0|1,0,1]=4 1461 B11R1.53 COC1=C(C=CC=N1)[N+](=O)[O-] PI-40023 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.53 COC1=C(C=CN=C1)C(=O)O PI-28728 [0,2,0,0,0,0|1,0,1]=4 1463 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] PI-24318 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] PI-29475 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.53 COC1=C(N=CC=C1)[N+](=O)[O-] PI-16711 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.53 COC1=CC=CC=C1C(=O)N PI-30368 [0,2,0,0,0,0|0,0,1]=3 1467 B11R1.53 COc1ccccc1C(=O)C PI-12757 [0,2,0,0,0,0|0,0,0]=2 1468 B11R1.53 COc1ccccc1C(=O)Cl PI-11858 [0,2,0,0,0,0|0,0,1]=3 1469 B11R1.53 COc1ccncc1B(O)O PI-25481 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.53 COc1ncccc1C(=O)O PI-16704 [0,2,0,0,0,0|1,0,1]=4 1471 B11R1.53 COc1nccnc1C(C)C PI-11044 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.53 CSC1=CC=CC=C1[N+](=O)[O-] PI-11877 [0,2,0,0,0,0|1,1,0]=4 1473 B11R1.53 CSc1ccccc1B(O)O PI-11570 [0,2,0,0,0,0|1,1,0]=4 1474 B11R1.53 O=Cc1ccccc1N(C)C PI-23369 [0,2,0,0,0,0|1,0,1]=4 1475 B11R1.53 OCc1ccccc1[N+](=O)[O-] PI-11876 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.166 B(C1=C(C=C(C=C1)C)C)(O)O PI-25669 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.166 B(C1=C(C=C(C=C1)Cl)C)(O)O PI-19305 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.166 B(C1=C(C=C(C=C1)F)C)(O)O PI-23765 [0,2,0,0,0,0|2,0,0]=4 1479 B11R1.166 Brc1ccc(C(=O)C)c(F)c1 PI-30799 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)O PI-43291 [0,2,0,0,0,0|2,0,0]=4 1481 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Br PI-20599 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl PI-33128 [0,2,0,0,0,0|2,0,0]=4 1483 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O PI-30853 [0,2,0,0,0,0|2,0,0]=4 1484 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Br PI-14425 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Cl PI-28768 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)F PI-16939 [0,2,0,0,0,0|2,0,0]=4 1487 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)O PI-42987 [0,2,0,0,0,0|2,0,0]=4 1488 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)Cl PI-12994 [0,2,0,0,0,0|2,0,0]=4 1489 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)F PI-16148 [0,2,0,0,0,0|2,0,0]=4 1490 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)N PI-30973 [0,2,0,0,0,0|2,0,0]=4 1491 B11R1.166 CC(C1=CC=C(F)C=C1O)=O PI-23585 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.166 CC(N)C1=CC=C(Cl)C=C1Cl PI-41295 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)Cl PI-39384 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.166 CC1=C(C=CC(=C1)Cl)[N+](=O)[O-] PI-26718 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O PI-10190 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.166 CC1=C(C=CC(=C1)N)[N+](=O)[O-] PI-26795 [0,2,0,0,0,0|2,0,0]=4 1497 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)C PI-12264 [0,2,0,0,0,0|1,0,0]=3 1498 B11R1.166 CC1=C(C=CC(=C1)O)[N+](=O)[O-] PI-12007 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)C PI-11718 [0,2,0,0,0,0|1,0,0]=3 1500 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C PI-16114 [0,2,0,0,0,0|2,0,0]=4 1501 B11R1.166 Cc1ccc(c(c1)O)C(=O)C PI-29847 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.166 Fc1ccc(c(c1)C)[N+](=O)[O-] PI-16978 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.166 Ic1ccc(c(c1)O)C(=O)C PI-30931 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.166 Nc1ccc(c(c1)C)C(=O)O PI-38300 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.166 OC1=CC=C(C(C)C)C(O)=C1 PI-40893 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.166 Oc1ccc(C(=O)C)c(O)c1 PI-15410 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.166 Oc1ccc(c(c1)C)B(O)O PI-19648 [0,2,0,0,0,0|2,0,0]=4 1508 B11R1.277 CC1=CC(=C(C=C1C#N)F)Br PI-10692 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.277 CC1=CC(=C(C=C1C#N)F)F PI-34488 [0,2,0,0,0,0|2,0,0]=4 1510 B11R1.277 CC1=CC(=C(C=C1C)C#C)C PI-19475 [0,2,0,0,0,0|1,0,1]=4 1511 B11R1.277 COC1=CC(=C(C=C1F)Br)F PI-21620 [0,2,0,0,0,0|1,0,0]=3 1512 B11R1.277 COC1=CC(=C(C=C1N)F)Br PI-40953 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.277 COC1=CC(=O)C(=CC1=O)O PI-20787 [0,2,0,0,0,0|1,0,0]=3 1514 B11R1.277 COc1cc(Br)c(F)cc1Cl PI-31695 [0,2,0,0,0,0|1,0,0]=3 1515 B11R1.277 COc1cc(N)c(Cl)cc1Cl PI-36533 [0,2,0,0,0,0|1,0,0]=3 1516 B11R1.279 CC1=C(C=CC(=C1)C=O)OC PI-16554 [0,2,0,0,0,0|0,0,0]=2 1517 B11R1.279 CC1=C(C=CC(=C1)OC)C#C PI-19876 [0,2,0,0,0,0|1,0,1]=4 1518 B11R1.279 CC1=C(C=CC(=C1)OC)C=O PI-27668 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.279 CC1=C(C=CC(=C1)OC)NN PI-29977 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.279 CC1=C(C=CC(=C1)OC)OC PI-33344 [0,2,0,0,0,0|0,0,0]=2 1521 B11R1.279 COC1=C(C=C(C=C1)C#N)Cl PI-19025 [0,2,0,0,0,0|1,0,0]=3 1522 B11R1.279 COC1=C(C=C(C=C1)C#N)F PI-10704 [0,2,0,0,0,0|1,0,0]=3 1523 B11R1.279 COC1=C(C=C(C=C1)C#N)O PI-34038 [0,2,0,0,0,0|1,0,0]=3 1524 B11R1.279 COC1=C(C=C(C=C1)C=O)Br PI-18486 [0,2,0,0,0,0|1,0,0]=3 1525 B11R1.279 COC1=C(C=C(C=C1)C=O)F PI-28427 [0,2,0,0,0,0|1,0,0]=3 1526 B11R1.279 COC1=C(C=C(C=C1)C=O)O PI-15305 [0,2,0,0,0,0|1,0,0]=3 1527 B11R1.279 COC1=C(C=C(C=C1)CBr)F PI-23718 [0,2,0,0,0,0|1,0,0]=3 1528 B11R1.279 COC1=C(C=C(C=C1)CN)Cl PI-30601 [0,2,0,0,0,0|1,0,0]=3 1529 B11R1.279 COC1=CC(=C(C=C1)OC)Br PI-21654 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.279 COc1ccc(OC)c(F)c1 PI-21289 [0,2,0,0,0,0|1,0,0]=3 1531 B11R1.279 COc1ccc(OC)c(O)c1 PI-32412 [0,2,0,0,0,0|1,0,0]=3 1532 B11R1.279 COc1ccc(OC)c(S)c1 PI-21302 [0,2,0,0,0,0|1,0,0]=3 1533 B11R1.279 ClCc1ccc(OC)c(F)c1 PI-16369 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.279 NCc1ccc(c(c1)Cl)OC PI-37600 [0,2,0,0,0,0|1,0,0]=3 1535 B11R1.279 O=CC1=CN=C(OC)C(F)=C1 PI-46768 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.464 BrCc1c(C)cc(cc1C)C PI-32532 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C PI-28575 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.464 CC1=CC(=C(C(=C1)C)CCl)C PI-11621 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.464 CC1=CC(=C(C(=C1)C)CO)C PI-27578 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.464 CC1=CC(=CC(=C1C#N)Br)F PI-10690 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.464 CC1=CC(=CC(=C1C=O)Br)F PI-28931 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.464 CC1=CC(=CC(=C1OC)C)Br PI-21373 [0,2,0,0,0,0|0,0,0]=2 1543 B11R1.464 COC1=C(C=C(C=C1Br)Br)Br PI-12082 [0,2,0,0,0,0|1,0,0]=3 1544 B11R1.464 COC1=C(C=C(C=C1Br)F)F PI-21619 [0,2,0,0,0,0|1,0,0]=3 1545 B11R1.464 COC1=C(C=C(C=C1F)Br)F PI-21621 [0,2,0,0,0,0|1,0,0]=3 1546 B11R1.464 COC1=C(C=C(C=C1N)Br)F PI-44566 [0,2,0,0,0,0|1,0,0]=3 1547 B11R1.464 COc1c(C)cc(S)cc1C PI-23877 [0,2,0,0,0,0|0,0,0]=2 1548 B11R1.464 COc1c(F)cc(Br)cc1Cl PI-20625 [0,2,0,0,0,0|1,0,0]=3 1549 B11R1.464 NCc1c(C)cc(cc1C)C PI-38580 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.464 NNc1c(C)cc(C)cc1C PI-29906 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.464 O=Cc1c(C)cc(O)cc1C PI-10323 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.167 B(C1=C(C=CC(=C1)Cl)C)(O)O PI-19142 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.167 B(C1=C(C=CC(=C1)F)C)(O)O PI-25223 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)C PI-39383 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)F PI-40483 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)N PI-50076 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)O PI-15407 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)O PI-11257 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)F PI-28256 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)O PI-16161 [0,2,0,0,0,0|2,0,0]=4 1561 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)Cl PI-31000 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.167 CC(C1=CC(F)=CC=C1I)=O PI-41210 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.167 CC(C1=CC(F)=CC=C1N)=O PI-46722 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O PI-31513 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.167 CC1=C(C=C(C=C1)Br)[N+](=O)[O-] PI-11598 [0,2,0,0,0,0|2,0,0]=4 1566 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)Cl PI-23751 [0,2,0,0,0,0|2,0,0]=4 1567 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)N PI-23733 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.167 CC1=C(C=C(C=C1)F)[N+](=O)[O-] PI-16977 [0,2,0,0,0,0|2,0,0]=4 1569 B11R1.167 CC1=C(C=C(C=C1)I)C(=O)O PI-35497 [0,2,0,0,0,0|2,0,0]=4 1570 B11R1.167 CC1=C(C=C(C=C1)I)[N+](=O)[O-] PI-26624 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.167 CC1=C(C=C(C=C1)O)[N+](=O)[O-] PI-10544 [0,2,0,0,0,0|2,0,0]=4 1572 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)C PI-23365 [0,2,0,0,0,0|1,0,0]=3 1573 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)O PI-16116 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.167 CC1=CC(=C(C=C1)C)[N+](=O)[O-] PI-13194 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)C PI-30627 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)C PI-16152 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.167 Cc1ccc(C)c(c1)B(O)O PI-33619 [0,2,0,0,0,0|2,0,0]=4 1578 B11R1.167 Clc1ccc(c(c1)C(=O)C)Cl PI-11720 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.167 Clc1ccc(c(c1)[N+](=O)[O-])C PI-31778 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.167 Fc1ccc(Cl)c(c1)C(=O)C PI-29442 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.167 Fc1ccc(c(c1)C(=O)O)C PI-16069 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.167 OC1=CC=C(Br)C=C1C(C)C PI-37179 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.167 Oc1ccc(O)c(c1)C(=O)C PI-31206 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.280 C1=CC(=CC(=C1C)OC)C=O PI-10103 [0,2,0,0,0,0|0,0,0]=2 1585 B11R1.280 CCC1=C(C=CC(=C1)C#N)N PI-15893 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.280 CCC1=CC(=C(C=C1)Br)OC PI-48437 [0,2,0,0,0,0|1,0,0]=3 1587 B11R1.280 CCC1=CC(=C(C=C1)O)OC PI-12830 [0,2,0,0,0,0|1,0,0]=3 1588 B11R1.280 COC1=C(C=CC(=C1)C#N)F PI-10706 [0,2,0,0,0,0|1,0,0]=3 1589 B11R1.280 COC1=C(C=CC(=C1)NN)F PI-50686 [0,2,0,0,0,0|1,0,0]=3 1590 B11R1.280 COC1=CC(=C(C=C1)I)OC PI-23241 [0,2,0,0,0,0|1,0,0]=3 1591 B11R1.280 COc1cc(C#N)ccc1O PI-29016 [0,2,0,0,0,0|1,0,0]=3 1592 B11R1.280 COc1cc(C=O)ccc1F PI-28101 [0,2,0,0,0,0|1,0,0]=3 1593 B11R1.280 COc1cc(C=O)ccc1O PI-34109 [0,2,0,0,0,0|1,0,0]=3 1594 B11R1.280 COc1ccc(F)c(OC)c1 PI-23228 [0,2,0,0,0,0|1,0,0]=3 1595 B11R1.280 COc1ccc(S)c(OC)c1 PI-23358 [0,2,0,0,0,0|1,0,0]=3 1596 B11R1.280 COc1ccc(c(c1)OC)Br PI-21375 [0,2,0,0,0,0|1,0,0]=3 1597 B11R1.280 COc1ccc(c(n1)OC)N PI-26916 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.87 CC(C)(C1=CC=CC=C1Br)O PI-48990 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.87 CC1=CC=CC=C1C(F)(F)F PI-28128 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.87 CC1=CC=CC=C1S(=O)(=O)Cl PI-50626 [0,2,0,0,0,0|1,1,0]=4 1601 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 PI-42394 [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.87 C[Si](C)(C)C1=CC=CC=C1O PI-50096 [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.156 CC(=O)c1c(Cl)cccc1Cl PI-20998 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.156 CC(=O)c1c(F)cccc1Cl PI-20054 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.156 CC(=O)c1c(F)cccc1F PI-31057 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.156 CC(=O)c1c(O)cccc1O PI-11029 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.156 CC1=C(C(=CC=C1)Br)[N+](=O)[O-] PI-22211 [0,2,0,0,0,0|2,0,0]=4 1608 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)C PI-30312 [0,2,0,0,0,0|1,0,0]=3 1609 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)O PI-27811 [0,2,0,0,0,0|2,0,0]=4 1610 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)N PI-30032 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.156 CC1=C(C(=CC=C1)Cl)[N+](=O)[O-] PI-28920 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.156 CC1=C(C(=CC=C1)N)[N+](=O)[O-] PI-32623 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.156 OB(O)c1c(C)cccc1C PI-25020 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.156 OB(c1c(C)cccc1F)O PI-39214 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.156 OC(=O)c1c(C)cccc1Cl PI-11820 [0,2,0,0,0,0|2,0,0]=4 1616 B11R1.156 OC(=O)c1c(C)cccc1F PI-10193 [0,2,0,0,0,0|2,0,0]=4 1617 B11R1.156 OC(=O)c1c(C)cccc1N PI-18553 [0,2,0,0,0,0|2,0,0]=4 1618 B11R1.156 [O-][N+](=O)c1c(C)cccc1F PI-38283 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.156 [O-][N+](=O)c1c(C)cccc1O PI-28579 [0,2,0,0,0,0|2,0,0]=4 1620 B9R1.11 COC(=O)C1=CC=CO1 PI-13054 [0,0,1,1,0,0|2,0,0]=4 1621 B9R1.11 COC(=O)c1cccs1 PI-30692 [0,0,1,1,0,0|2,0,0]=4 1622 B9R1.11 O=C(C1=CC=CN1)OC PI-42625 [0,0,1,1,0,0|2,0,0]=4 1623 B9R2.50 C1CC2=CC=CC=C21 PI-40928 [1,0,0,1,0,0|1,0,0]=3 1624 B11R2.106 BrC1=CC=CC2=C1CC=C2 PI-40279 [0,1,0,1,0,0|1,0,1]=4 1625 B11R2.106 Brc1cccc2CCNc12 PI-35985 [0,1,0,1,0,0|1,0,0]=3 1626 B11R2.106 C1=CC2=NON=C2C(=C1)N PI-14058 [0,1,0,1,0,0|2,0,0]=4 1627 B11R2.106 C1C2=C(CS1)C(=CC=C2)Br PI-48436 [0,1,0,1,0,0|1,1,0]=4 1628 B11R2.106 C1CNC2=C1C(=CC=C2)Br PI-36066 [0,1,0,1,0,0|1,0,0]=3 1629 B11R2.106 C1CNC2=C1C(=CC=C2)Cl PI-11092 [0,1,0,1,0,0|1,0,0]=3 1630 B11R2.106 CC1=C2C(=CC=C1)SC=N2 PI-45359 [0,1,0,1,0,0|1,0,1]=4 1631 B11R2.106 CC1=C2C=CNC2=CC=C1 PI-16828 [0,1,0,1,0,0|1,0,1]=4 1632 B11R2.106 CC1=C2CNCC2=CC=C1 PI-36193 [0,1,0,1,0,0|1,0,0]=3 1633 B11R2.106 Cc1cccc2c1NCC2 PI-38356 [0,1,0,1,0,0|1,0,0]=3 1634 B11R2.106 Cc1cccc2c1[nH]cc2 PI-16266 [0,1,0,1,0,0|1,0,1]=4 1635 B11R2.106 Cc1cccc2c1[nH]cn2 PI-38923 [0,1,0,1,0,0|1,0,1]=4 1636 B11R2.10 BrB1Oc2c(O1)cccc2 PI-38370 [0,1,0,1,0,0|2,0,0]=4 1637 B11R2.10 C1=CC=C2C(=C1)C=C(O2)Br PI-45424 [0,1,0,1,0,0|0,0,2]=4 1638 B11R2.10 C1=CC=C2C(=C1)NC(=S)O2 PI-32430 [0,1,0,1,0,0|1,0,1]=4 1639 B11R2.10 C1C(=O)CC2=CC=CC=C21 PI-11611 [0,1,0,1,0,0|1,0,1]=4 1640 B11R2.10 C1C(CC2=CC=CC=C21)O PI-11612 [0,1,0,1,0,0|1,0,0]=3 1641 B11R2.10 C1C2=CC=CC=C2C=C1Br PI-24035 [0,1,0,1,0,0|1,0,1]=4 1642 B11R2.10 CC1=CC2=CC=CC=C2C1 PI-30321 [0,1,0,1,0,0|1,0,0]=3 1643 B11R2.10 CC1=CC2=CC=CC=C2N1 PI-31662 [0,1,0,1,0,0|1,0,1]=4 1644 B11R2.10 CC1=CC2=CC=CC=C2S1 PI-29081 [0,1,0,1,0,0|0,1,1]=4 1645 B11R2.10 CC1=NC2=CC=CC=C2N1 PI-11865 [0,1,0,1,0,0|2,0,0]=4 1646 B11R2.10 CC1=NC2=CC=CC=C2O1 PI-11866 [0,1,0,1,0,0|1,0,0]=3 1647 B11R2.10 CC1CC2=CC=CC=C2O1 PI-17206 [0,1,0,1,0,0|0,0,0]=2 1648 B11R2.10 CC1NC2=C(C=CC=C2)C1 PI-11338 [0,1,0,1,0,0|1,0,0]=3 1649 B11R2.10 ClB1Oc2c(O1)cccc2 PI-38371 [0,1,0,1,0,0|2,0,0]=4 1650 B11R2.10 Clc1nc2ccccc2o1 PI-33937 [0,1,0,1,0,0|1,0,1]=4 1651 B11R2.10 NC1CC2=C(C=CC=C2)C1 PI-37165 [0,1,0,1,0,0|1,0,0]=3 1652 B11R2.10 Nc1nc2ccccc2o1 PI-17283 [0,1,0,1,0,0|1,0,1]=4 1653 B11R2.10 O=C1Cc2c(N1)cccc2 PI-11084 [0,1,0,1,0,0|1,0,1]=4 1654 B11R2.10 O=C1Cc2ccccc2O1 PI-18682 [0,1,0,1,0,0|0,0,1]=3 1655 B11R2.10 O=c1oc2ccccc2[nH]1 PI-11480 [0,1,0,1,0,0|1,0,1]=4 1656 B11R2.20 C1=Cc2c(CC1)cccc2 PI-25582 [0,1,0,1,0,0|1,0,0]=3 1657 B11R2.20 C1CC2=C(C=CC=N2)NC1 PI-47349 [0,1,0,1,0,0|2,0,0]=4 1658 B11R2.20 C1CC2=C(C=CN=C2)NC1 PI-47348 [0,1,0,1,0,0|2,0,0]=4 1659 B11R2.20 C1CCc2c(C1)cncc2 PI-38323 [0,1,0,1,0,0|2,0,0]=4 1660 B11R2.20 C1CCc2ccccc2N1 PI-32264 [0,1,0,1,0,0|1,0,0]=3 1661 B11R2.20 C1CCc2cccnc2C1 PI-10313 [0,1,0,1,0,0|2,0,0]=4 1662 B11R2.20 C1CN=CC2=CC=CC=C21 PI-17411 [0,1,0,1,0,0|1,0,0]=3 1663 B11R2.20 C1CNCC2=CC=CC=C21 PI-17083 [0,1,0,1,0,0|1,0,0]=3 1664 B11R2.20 C1CNCC2=CC=CC=C21 PI-38027 [0,1,0,1,0,0|1,0,0]=3 1665 B11R2.20 C1COC2=C(N1)N=CC=C2 PI-34187 [0,1,0,1,0,0|1,0,0]=3 1666 B11R2.20 C1COc2ccccc2O1 PI-31359 [0,1,0,1,0,0|0,0,0]=2 1667 B11R2.988 OCC1C2=CC=CC=C2C1 PI-40936 [0,1,0,1,0,0|1,0,0]=3 1668 B11R2.1 B1(C2=CC=CC=C2CO1)O PI-25687 [0,1,0,1,0,0|2,0,0]=4 1669 B11R2.1 C1=CC=C2C(=C1)C(=CO2)Br PI-17445 [0,1,0,1,0,0|0,0,2]=4 1670 B11R2.1 C1=CC=C2C(=C1)C(=NO2)N PI-14154 [0,1,0,1,0,0|1,0,1]=4 1671 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-27871 [0,1,0,1,0,0|0,0,1]=3 1672 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-33947 [0,1,0,1,0,0|0,0,1]=3 1673 B11R2.1 C1CC(=O)C2=CC=CC=C21 PI-12356 [0,1,0,1,0,0|1,0,0]=3 1674 B11R2.1 C1CC2=CC=CC=C2C1N PI-41308 [0,1,0,1,0,0|1,0,0]=3 1675 B11R2.1 CC1=CSC2=CC=CC=C12 PI-26140 [0,1,0,1,0,0|0,1,1]=4 1676 B11R2.1 CN1C2=CC=CC=C2N=N1 PI-17166 [0,1,0,1,0,0|2,0,0]=4 1677 B11R2.1 CN1C=NC2=CC=CC=C21 PI-11703 [0,1,0,1,0,0|1,0,1]=4 1678 B11R2.1 Cc1c[nH]c2c1cccc2 PI-10761 [0,1,0,1,0,0|1,0,1]=4 1679 B11R2.1 ClC1=NOC2=C1C=CC=C2 PI-15670 [0,1,0,1,0,0|1,0,1]=4 1680 B11R2.1 Cn1ccc2ccccc12 PI-11080 [0,1,0,1,0,0|1,0,1]=4 1681 B11R2.1 NC1CCC2=C1C=CC=C2 PI-40451 [0,1,0,1,0,0|1,0,0]=3 1682 B11R2.1 NC1CCc2ccccc12 PI-24340 [0,1,0,1,0,0|1,0,0]=3 1683 B11R2.1 N[C@@H]1CCc2ccccc12 PI-17002 [0,1,0,1,0,0|1,0,0]=3 1684 B11R2.1 O=C1C2=CC=CC=C2SC1 PI-42644 [0,1,0,1,0,0|0,1,1]=4 1685 B11R2.1 O=C1OCc2c1cccc2 PI-33738 [0,1,0,1,0,0|2,0,0]=4 1686 B11R2.36 Brc1ccc2c(c1)CCN2 PI-11096 [0,1,0,1,0,0|1,0,0]=3 1687 B11R2.36 Brc1cnc2c(c1)CCC2 PI-39405 [0,1,0,1,0,0|2,0,0]=4 1688 B11R2.36 C1=CC2=C(C=C1Cl)N=CO2 PI-12027 [0,1,0,1,0,0|1,0,1]=4 1689 B11R2.36 C1=CC2=C(C=CO2)C=C1Br PI-19337 [0,1,0,1,0,0|0,0,2]=4 1690 B11R2.36 C1CC2=C(C1)C=C(C=C2)N PI-17685 [0,1,0,1,0,0|1,0,0]=3 1691 B11R2.36 C1CNC2=C1C=C(C=C2)Cl PI-11098 [0,1,0,1,0,0|1,0,0]=3 1692 B11R2.36 C1CNC2=C1C=C(C=C2)O PI-36194 [0,1,0,1,0,0|1,0,0]=3 1693 B11R2.36 C1CNC2=C1C=CC(=C2)Br PI-36067 [0,1,0,1,0,0|1,0,0]=3 1694 B11R2.36 C1COC2=C1C=C(C=C2)Br PI-21650 [0,1,0,1,0,0|0,0,0]=2 1695 B11R2.36 C1OC2=C(O1)C=C(C=C2)Cl PI-30880 [0,1,0,1,0,0|1,0,0]=3 1696 B11R2.36 C1OC2=C(O1)C=C(C=C2)N PI-12185 [0,1,0,1,0,0|1,0,0]=3 1697 B11R2.36 CC1=CC2=C(C=C1)OC=N2 PI-10825 [0,1,0,1,0,0|1,0,1]=4 1698 B11R2.36 Clc1ccc2CCNc2c1 PI-36115 [0,1,0,1,0,0|1,0,0]=3 1699 B11R2.36 NC1=CC=C2OC=CC2=C1 PI-40038 [0,1,0,1,0,0|0,0,2]=4 1700 B11R2.36 Oc1ccc2c(c1)OCO2 PI-15354 [0,1,0,1,0,0|1,0,0]=3 1701 B11R2.36 SC1=CC=C2OCOC2=C1 PI-42647 [0,1,0,1,0,0|1,0,0]=3 1702 B7R1.1 CCC1=CC=CS1 PI-10993 [1,0,0,0,1,0|2,0,0]=4 1703 B7R1.1 CCC1=CSC=C1 PI-35073 [1,0,0,0,1,0|2,0,0]=4 1704 B7R1.1 CCN1C=CC=C1 PI-12065 [1,0,0,0,1,0|2,0,0]=4 1705 B7R1.1 COC1=NC=CS1 PI-11131 [1,0,0,0,1,0|2,0,0]=4 1706 B7R1.1 COc1cccs1 PI-33573 [1,0,0,0,1,0|1,0,0]=3 1707 B7R1.1 COc1cscc1 PI-27269 [1,0,0,0,1,0|1,0,0]=3 1708 B7R1.1 CSC1=CSC=C1 PI-29322 [1,0,0,0,1,0|1,1,0]=4 1709 B7R1.4 Brc1cscc1C PI-39112 [1,0,0,0,1,0|2,0,0]=4 1710 B7R1.4 CC1=C(OC=N1)C PI-35004 [1,0,0,0,1,0|2,0,0]=4 1711 B7R1.4 CC1=C(SC=C1)Cl PI-10992 [1,0,0,0,1,0|2,0,0]=4 1712 B7R1.4 CC1=C(SC=N1)C PI-11140 [1,0,0,0,1,0|2,0,0]=4 1713 B7R1.4 CC1=CNN=C1C PI-41141 [1,0,0,0,1,0|2,0,0]=4 1714 B7R1.4 CC1=CSC=C1C PI-35053 [1,0,0,0,1,0|1,0,0]=3 1715 B7R1.4 CC1=NC=CN1C PI-31811 [1,0,0,0,1,0|2,0,0]=4 1716 B7R1.4 Cc1ccsc1Br PI-10990 [1,0,0,0,1,0|2,0,0]=4 1717 B7R1.4 Cn1nccc1C PI-37575 [1,0,0,0,1,0|2,0,0]=4 1718 B7R1.4 Cn1nccc1O PI-37212 [1,0,0,0,1,0|2,0,0]=4 1719 B7R1.4 Oc1cscc1O PI-33661 [1,0,0,0,1,0|2,0,0]=4 1720 B7R1.4 SC1=C(C)OC=C1 PI-14227 [1,0,0,0,1,0|1,1,0]=4