0 B8R1.3 C1=CC(=O)C=CC1=O BC250046 [0,0,0,0,0,0|0,0,2]=2 1 B8R1.3 Cc1cc[n+](cc1)[O-] BC222437 [0,0,0,0,0,0|2,0,1]=3 2 B8R1.3 Cc1ccc(cc1)I BC208320 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.3 Cc1ccc(cn1)Br BC200848 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.3 Cc1ccc(cn1)F BC219187 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.3 Cc1ccc(cn1)I BC228957 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.3 Cc1ccc(cn1)N BC202216 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.3 Cc1ccc(cn1)O BC213724 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.3 Cc1ccc(nc1)C BC220412 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.3 Cc1ccc(nc1)Cl BC201252 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.3 Cc1ccc(nc1)F BC219184 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.3 Cc1ccc(nc1)N BC203509 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.3 Cc1cnc(cn1)C BC651592 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.3 Cc1cnc(nc1)Cl BC221851 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.3 Cc1ncc(cn1)N BC228078 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.3 c1c(cnc(n1)Cl)Cl BC228087 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.3 c1c(cnc(n1)Cl)I BC671541 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.3 c1c(cnc(n1)Cl)O BC653325 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.3 c1c(cnc(n1)I)Br BC209318 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.3 c1c(cnc(n1)I)Cl BC225380 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.3 c1c(cnc(n1)N)Br BC209310 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.3 c1c(cnc(n1)N)O BC228066 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.3 c1c(cnc(n1)O)Br BC209314 [0,0,0,0,0,0|3,0,0]=3 23 B8R1.3 c1c(cnc(n1)O)Cl BC674915 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.3 c1c(ncc(n1)Br)N BC222343 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.3 c1c(ncc(n1)Br)O BC679855 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.3 c1c(ncc(n1)Cl)Cl BC686148 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.3 c1c(ncc(n1)Cl)O BC679835 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.3 c1cc(ccc1Br)I BC206965 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.3 c1cc(ccc1Cl)Br BC207086 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.3 c1cc(ccc1Cl)I BC675841 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.3 c1cc(ccc1N)Br BC204243 [0,0,0,0,0,0|2,0,0]=2 32 B8R1.3 c1cc(ccc1N)F BC226190 [0,0,0,0,0,0|2,0,0]=2 33 B8R1.3 c1cc(ccc1N)O BC227837 [0,0,0,0,0,0|1,0,0]=1 34 B8R1.3 c1cc(ccc1N)S BC676770 [0,0,0,0,0,0|1,1,0]=2 35 B8R1.3 c1cc(ccc1O)Br BC228016 [0,0,0,0,0,0|1,0,0]=1 36 B8R1.3 c1cc(ccc1O)I BC226747 [0,0,0,0,0,0|1,0,0]=1 37 B8R1.3 c1cc(ccc1O)O BC207641 [0,0,0,0,0,0|0,0,0]=0 38 B8R1.3 c1cc(n[nH]c1=O)Cl BC225810 [0,0,0,0,0,0|3,0,1]=4 39 B8R1.3 c1cc(ncc1Br)F BC211679 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.3 c1cc(ncc1Br)N BC202223 [0,0,0,0,0,0|3,0,0]=3 41 B8R1.3 c1cc(ncc1Br)O BC219149 [0,0,0,0,0,0|2,0,0]=2 42 B8R1.3 c1cc(ncc1Cl)Br BC202228 [0,0,0,0,0,0|3,0,0]=3 43 B8R1.3 c1cc(ncc1Cl)Cl BC210322 [0,0,0,0,0,0|3,0,0]=3 44 B8R1.3 c1cc(ncc1Cl)F BC201381 [0,0,0,0,0,0|3,0,0]=3 45 B8R1.3 c1cc(ncc1Cl)I BC226646 [0,0,0,0,0,0|3,0,0]=3 46 B8R1.3 c1cc(ncc1F)Cl BC208051 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.3 c1cc(ncc1F)N BC204792 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.3 c1cc(ncc1F)O BC219174 [0,0,0,0,0,0|2,0,0]=2 49 B8R1.3 c1cc(ncc1I)Br BC219151 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.3 c1cc(ncc1I)O BC228859 [0,0,0,0,0,0|2,0,0]=2 51 B8R1.3 c1cc(ncc1N)Br BC213741 [0,0,0,0,0,0|3,0,0]=3 52 B8R1.3 c1cc(ncc1N)Cl BC203573 [0,0,0,0,0,0|3,0,0]=3 53 B8R1.3 c1cc(ncc1N)O BC653280 [0,0,0,0,0,0|2,0,0]=2 54 B8R1.3 c1cc(ncc1O)Br BC208384 [0,0,0,0,0,0|2,0,0]=2 55 B8R1.3 c1cc(ncc1O)Cl BC208468 [0,0,0,0,0,0|2,0,0]=2 56 B8R1.3 c1cc(ncc1O)F BC221861 [0,0,0,0,0,0|2,0,0]=2 57 B8R1.3 c1cc(ncc1O)I BC200349 [0,0,0,0,0,0|2,0,0]=2 58 B8R1.3 c1cc(ncc1O)N BC226650 [0,0,0,0,0,0|2,0,0]=2 59 B8R1.3 c1cc(nnc1Cl)Cl BC225811 [0,0,0,0,0,0|4,0,0]=4 60 B8R1.3 c1cc(nnc1Cl)I BC677311 [0,0,0,0,0,0|4,0,0]=4 61 B8R1.3 c1cc(nnc1N)Cl BC677514 [0,0,0,0,0,0|4,0,0]=4 62 B8R1.3 c1cc(nnc1O)O BC225807 [0,0,0,0,0,0|2,0,0]=2 63 B7R1.3 Cc1cccnc1 BC228007 [1,0,0,0,0,0|2,0,0]=3 64 B7R1.3 c1c(cncn1)F BC215541 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.3 c1c(cncn1)O BC228081 [1,0,0,0,0,0|2,0,0]=3 66 B7R1.3 c1c[nH]c(=O)nc1 BC215238 [1,0,0,0,0,0|2,0,1]=4 67 B7R1.3 c1cc(=O)[nH]nc1 BC225809 [1,0,0,0,0,0|2,0,1]=4 68 B7R1.3 c1cc(cnc1)Cl BC209276 [1,0,0,0,0,0|2,0,0]=3 69 B7R1.3 c1cc(cnc1)I BC225230 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.3 c1cc(cnc1)S BC244412 [1,0,0,0,0,0|1,1,0]=3 71 B7R1.3 c1cc(nnc1)Cl BC675997 [1,0,0,0,0,0|3,0,0]=4 72 B7R1.3 c1cc(nnc1)N BC649957 [1,0,0,0,0,0|3,0,0]=4 73 B7R1.3 c1cc[n+](cc1)[O-] BC227085 [1,0,0,0,0,0|1,0,1]=3 74 B7R1.3 c1ccnc(c1)Cl BC653330 [1,0,0,0,0,0|2,0,0]=3 75 B7R1.3 c1cnc(cn1)Cl BC226186 [1,0,0,0,0,0|3,0,0]=4 76 B7R1.3 c1cnc(nc1)N BC209308 [1,0,0,0,0,0|3,0,0]=4 77 B7R1.3 c1cnc(nc1)O BC209309 [1,0,0,0,0,0|2,0,0]=3 78 B7R1.3 c1cnc(nc1)S BC227980 [1,0,0,0,0,0|2,1,0]=4 79 B7R1.3 c1cnc[nH]c1=O BC209585 [1,0,0,0,0,0|2,0,1]=4 80 B7R1.3 c1cnccc1Br BC204910 [1,0,0,0,0,0|2,0,0]=3 81 B7R1.3 c1cnccc1F BC219199 [1,0,0,0,0,0|2,0,0]=3 82 B7R1.3 c1cnccc1F BC227092 [1,0,0,0,0,0|2,0,0]=3 83 B7R1.3 c1cnccc1I BC206126 [1,0,0,0,0,0|2,0,0]=3 84 B7R1.3 c1cnccc1N BC227053 [1,0,0,0,0,0|2,0,0]=3 85 B7R1.3 c1cncnc1Cl BC667224 [1,0,0,0,0,0|3,0,0]=4 86 B7R1.3 c1cncnc1N BC653395 [1,0,0,0,0,0|3,0,0]=4 87 B7R1.3 c1cncnc1O BC228083 [1,0,0,0,0,0|2,0,0]=3 88 B7R1.3 c1cnncc1Br BC659695 [1,0,0,0,0,0|3,0,0]=4 89 B7R1.3 c1cnncc1N BC659705 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.1 C#Cc1ccc(cc1)F BC215301 [0,1,0,0,0,0|2,0,0]=3 91 B9R1.1 C#Cc1ccc(cc1)O BC671095 [0,1,0,0,0,0|1,0,0]=2 92 B9R1.1 C#Cc1ccc(cn1)Br BC227061 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.1 C=Cc1ccc(cc1)F BC227580 [0,1,0,0,0,0|2,0,0]=3 94 B9R1.1 CNc1ccc(cc1)N BC220840 [0,1,0,0,0,0|2,0,0]=3 95 B9R1.1 COc1cc[n+](cc1)[O-] BC209280 [0,1,0,0,0,0|1,0,1]=3 96 B9R1.1 COc1ccc(cc1)Br BC676620 [0,1,0,0,0,0|1,0,0]=2 97 B9R1.1 COc1ccc(cc1)N BC206279 [0,1,0,0,0,0|1,0,0]=2 98 B9R1.1 COc1ccc(cn1)F BC208854 [0,1,0,0,0,0|2,0,0]=3 99 B9R1.1 COc1ccc(cn1)I BC228888 [0,1,0,0,0,0|2,0,0]=3 100 B9R1.1 COc1ccc(cn1)N BC204592 [0,1,0,0,0,0|2,0,0]=3 101 B9R1.1 COc1ccc(cn1)O BC678852 [0,1,0,0,0,0|1,0,0]=2 102 B9R1.1 COc1cnc(nc1)Cl BC683589 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.1 Cc1ccc(cc1)C#C BC213353 [0,1,0,0,0,0|2,0,0]=3 104 B9R1.1 Cc1ccc(cc1)C#N BC676397 [0,1,0,0,0,0|2,0,0]=3 105 B9R1.1 Cc1ccc(cc1)C=O BC211019 [0,1,0,0,0,0|1,0,1]=3 106 B9R1.1 Cc1ccc(cc1)CBr BC200614 [0,1,0,0,0,0|2,0,0]=3 107 B9R1.1 Cc1ccc(cc1)CN BC211128 [0,1,0,0,0,0|2,0,0]=3 108 B9R1.1 Cc1ccc(cc1)NN BC213413 [0,1,0,0,0,0|2,0,0]=3 109 B9R1.1 Cc1ccc(cc1)NN BC216063 [0,1,0,0,0,0|2,0,0]=3 110 B9R1.1 Cc1ccc(cn1)C=C BC219567 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.1 Cc1ccc(cn1)NN BC686683 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.1 Cc1ccc(cn1)OC BC224186 [0,1,0,0,0,0|2,0,0]=3 113 B9R1.1 Cc1ccc(nc1)C#N BC211802 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.1 Cc1ccc(nc1)C=C BC211746 [0,1,0,0,0,0|3,0,0]=4 115 B9R1.1 Cc1ccc(nc1)C=O BC207526 [0,1,0,0,0,0|2,0,1]=4 116 B9R1.1 Cc1ncc(cn1)CO BC228074 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.1 c1cc(ccc1C#N)N BC226364 [0,1,0,0,0,0|2,0,0]=3 118 B9R1.1 c1cc(ccc1C=O)Br BC213531 [0,1,0,0,0,0|1,0,1]=3 119 B9R1.1 c1cc(ccc1C=O)N BC204291 [0,1,0,0,0,0|1,0,1]=3 120 B9R1.1 c1cc(ccc1C=O)O BC227835 [0,1,0,0,0,0|0,0,1]=2 121 B9R1.1 c1cc(ccc1CBr)Cl BC202439 [0,1,0,0,0,0|2,0,0]=3 122 B9R1.1 c1cc(ccc1CCl)Cl BC678529 [0,1,0,0,0,0|2,0,0]=3 123 B9R1.1 c1cc(ccc1CN)N BC676433 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.1 c1cc(ccc1CN)O BC210625 [0,1,0,0,0,0|1,0,0]=2 125 B9R1.1 c1cc(ccc1CO)I BC220492 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.1 c1cc(ccc1CO)O BC227836 [0,1,0,0,0,0|0,0,0]=1 127 B9R1.1 c1cc(ccc1NN)Br BC213412 [0,1,0,0,0,0|2,0,0]=3 128 B9R1.1 c1cc(ccc1NN)Cl BC675025 [0,1,0,0,0,0|2,0,0]=3 129 B9R1.1 c1cc(ccc1NN)F BC206790 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.1 c1cc(ncc1Br)C#N BC208460 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.1 c1cc(ncc1Br)C=O BC225554 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.1 c1cc(ncc1Br)CO BC219783 [0,1,0,0,0,0|2,0,0]=3 133 B9R1.1 c1cc(ncc1C=O)Cl BC226370 [0,1,0,0,0,0|2,0,1]=4 134 B9R1.1 c1cc(ncc1C=O)F BC225548 [0,1,0,0,0,0|2,0,1]=4 135 B9R1.1 c1cc(ncc1C=O)N BC262229 [0,1,0,0,0,0|2,0,1]=4 136 B9R1.1 c1cc(ncc1C=O)O BC650796 [0,1,0,0,0,0|1,0,1]=3 137 B9R1.1 c1cc(ncc1CCl)Cl BC201251 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.1 c1cc(ncc1CO)F BC221862 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.1 c1cc(ncc1CO)O BC228000 [0,1,0,0,0,0|1,0,0]=2 140 B9R1.1 c1cc(ncc1Cl)C#N BC208461 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.1 c1cc(ncc1N)C#N BC208373 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.1 c1cc(ncc1O)C#N BC208383 [0,1,0,0,0,0|2,0,0]=3 143 B9R1.69 Cc1c(cc(cn1)Br)Cl BC216612 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.69 Cc1c(cc(cn1)Br)N BC216613 [0,1,0,0,0,0|3,0,0]=4 145 B9R1.69 Cc1c(ccc(n1)Br)F BC211685 [0,1,0,0,0,0|3,0,0]=4 146 B9R1.69 Cc1c(ccc(n1)Cl)F BC219165 [0,1,0,0,0,0|3,0,0]=4 147 B9R1.69 Cc1c(ccc(n1)Cl)F BC677936 [0,1,0,0,0,0|3,0,0]=4 148 B9R1.69 Cc1c(ccc(n1)Cl)N BC219100 [0,1,0,0,0,0|3,0,0]=4 149 B9R1.69 Cc1c(ccc(n1)Cl)O BC240165 [0,1,0,0,0,0|2,0,0]=3 150 B9R1.69 Cc1c(ccc(n1)F)N BC219106 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.69 Cc1cc(c(nc1)Br)Br BC219171 [0,1,0,0,0,0|3,0,0]=4 152 B9R1.69 Cc1cc(c(nc1)Br)Cl BC228752 [0,1,0,0,0,0|3,0,0]=4 153 B9R1.69 Cc1cc(c(nc1)Cl)Br BC219126 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.69 Cc1cc(c(nc1)F)Br BC219140 [0,1,0,0,0,0|3,0,0]=4 155 B9R1.69 Cc1cc(c(nc1)F)Cl BC677133 [0,1,0,0,0,0|3,0,0]=4 156 B9R1.69 Cc1cc(c(nc1)F)I BC219175 [0,1,0,0,0,0|3,0,0]=4 157 B9R1.69 Cc1cc(c(nc1)N)O BC228725 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.69 Cc1cc(ccc1Br)O BC207712 [0,1,0,0,0,0|1,0,0]=2 159 B9R1.69 Cc1cc(ccc1Cl)Cl BC207920 [0,1,0,0,0,0|2,0,0]=3 160 B9R1.69 Cc1cc(ccc1Cl)O BC207565 [0,1,0,0,0,0|1,0,0]=2 161 B9R1.69 Cc1cc(ccc1F)Br BC207178 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.69 Cc1cc(ccc1I)O BC211956 [0,1,0,0,0,0|1,0,0]=2 163 B9R1.69 Cc1cc(ccc1N)I BC220172 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.69 Cc1cc(ccc1N)N BC203474 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.69 Cc1cc(ccc1N)O BC649929 [0,1,0,0,0,0|1,0,0]=2 166 B9R1.69 Cc1cc(ccc1O)O BC201519 [0,1,0,0,0,0|0,0,0]=1 167 B9R1.69 Cc1cc(ccc1O)S BC220806 [0,1,0,0,0,0|0,1,0]=2 168 B9R1.69 Cc1cc(cnc1Br)Cl BC219125 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.69 Cc1cc(cnc1Br)I BC228774 [0,1,0,0,0,0|3,0,0]=4 170 B9R1.69 Cc1cc(cnc1Br)N BC227027 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.69 Cc1cc(cnc1Br)O BC228773 [0,1,0,0,0,0|2,0,0]=3 172 B9R1.69 Cc1cc(cnc1Cl)Br BC204485 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.69 Cc1cc(cnc1Cl)F BC219162 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.69 Cc1cc(cnc1Cl)N BC219101 [0,1,0,0,0,0|3,0,0]=4 175 B9R1.69 Cc1cc(cnc1F)Br BC219142 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.69 Cc1cc(cnc1F)Cl BC219163 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.69 Cc1cc(cnc1F)N BC219108 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.69 Cc1cc(cnc1N)Br BC226638 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.69 Cc1cc(cnc1N)N BC227178 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.69 Cc1cc(ncc1Br)Br BC213723 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.69 Cc1cc(ncc1N)Br BC228768 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.69 Cc1cc(ncc1N)C BC208427 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.69 Cc1ccc(c(c1)Br)C BC202051 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.69 Cc1ccc(c(c1)Br)O BC228036 [0,1,0,0,0,0|1,0,0]=2 185 B9R1.69 Cc1ccc(c(c1)C)S BC685862 [0,1,0,0,0,0|1,1,0]=3 186 B9R1.69 Cc1ccc(c(c1)N)F BC207170 [0,1,0,0,0,0|2,0,0]=3 187 B9R1.69 Cc1ccc(c(c1)N)I BC680398 [0,1,0,0,0,0|2,0,0]=3 188 B9R1.69 Cc1ccc(c(c1)O)O BC204625 [0,1,0,0,0,0|1,0,0]=2 189 B9R1.69 Cc1ccc(c(n1)Br)Br BC219172 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.69 Cc1ccc(c(n1)Br)F BC219139 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.69 Cc1ccc(c(n1)Br)N BC650925 [0,1,0,0,0,0|3,0,0]=4 192 B9R1.69 Cc1ccc(c(n1)Cl)Br BC219127 [0,1,0,0,0,0|3,0,0]=4 193 B9R1.69 Cc1ccc(c(n1)Cl)Cl BC227158 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.69 Cc1ccc(c(n1)Cl)F BC219161 [0,1,0,0,0,0|3,0,0]=4 195 B9R1.69 Cc1ccc(c(n1)Cl)N BC208643 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.69 Cc1ccc(c(n1)F)Br BC219141 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.69 Cc1ccc(c(n1)N)Br BC202224 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.69 Cc1ccc(c(n1)N)O BC228726 [0,1,0,0,0,0|2,0,0]=3 199 B9R1.69 Cc1ccc(c(n1)O)Br BC208734 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.69 Cc1ccc(cc1C)Br BC201497 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.69 Cc1ccc(cc1F)Br BC227411 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.69 Cc1ccc(cc1N)Br BC211655 [0,1,0,0,0,0|2,0,0]=3 203 B9R1.69 Cc1ccc(cc1N)F BC207142 [0,1,0,0,0,0|2,0,0]=3 204 B9R1.69 Cc1ccc(cc1O)Cl BC683431 [0,1,0,0,0,0|2,0,0]=3 205 B9R1.69 Cc1cnc(cc1Cl)Cl BC227174 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.69 c1c(c(cnc1Cl)Br)Cl BC244898 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.69 c1c(c(cnc1Cl)F)Br BC227054 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.69 c1c(c(cnc1Cl)F)I BC228801 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.69 c1c(c(cnc1Cl)N)I BC637063 [0,1,0,0,0,0|3,0,0]=4 210 B9R1.69 c1c(c(cnc1Cl)N)N BC229038 [0,1,0,0,0,0|3,0,0]=4 211 B9R1.69 c1c(c(cnc1F)Cl)I BC228831 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.69 c1c(c(cnc1F)F)Cl BC214615 [0,1,0,0,0,0|3,0,0]=4 213 B9R1.69 c1c(c(cnc1O)Cl)O BC209060 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.69 c1c(c(cnc1O)F)Br BC228855 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.69 c1c(cnc(c1Br)Cl)Cl BC219132 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.69 c1c(cnc(c1Br)Cl)F BC253402 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.69 c1c(cnc(c1Br)Cl)O BC228782 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.69 c1c(cnc(c1Br)F)Cl BC219120 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.69 c1c(cnc(c1Br)F)O BC228820 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.69 c1c(cnc(c1Br)I)Br BC228860 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.69 c1c(cnc(c1Br)N)Cl BC219091 [0,1,0,0,0,0|3,0,0]=4 222 B9R1.69 c1c(cnc(c1Br)N)F BC219093 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.69 c1c(cnc(c1Br)O)F BC219134 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.69 c1c(cnc(c1Cl)Br)Cl BC208803 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.69 c1c(cnc(c1Cl)Br)O BC228750 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.69 c1c(cnc(c1Cl)Cl)Br BC227034 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.69 c1c(cnc(c1Cl)Cl)Cl BC204270 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.69 c1c(cnc(c1Cl)Cl)N BC227051 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.69 c1c(cnc(c1Cl)Cl)O BC227155 [0,1,0,0,0,0|2,0,0]=3 230 B9R1.69 c1c(cnc(c1Cl)N)O BC228700 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.69 c1c(cnc(c1F)Br)F BC668600 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.69 c1c(cnc(c1F)Cl)Br BC219121 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.69 c1c(cnc(c1F)Cl)O BC228788 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.69 c1c(cnc(c1F)F)Br BC227059 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.69 c1c(cnc(c1F)F)F BC227023 [0,1,0,0,0,0|3,0,0]=4 236 B9R1.69 c1c(cnc(c1F)N)Br BC236256 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.69 c1c(cnc(c1F)O)Br BC226863 [0,1,0,0,0,0|2,0,0]=3 238 B9R1.69 c1c(cnc(c1I)N)Br BC220342 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.69 c1c(cnc(c1N)Br)F BC219094 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.69 c1c(cnc(c1N)N)Cl BC227147 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.69 c1c(cnc(c1N)N)F BC227148 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.69 c1c(cnc(c1O)Cl)Br BC256298 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.69 c1c(cnc(c1O)N)Br BC658447 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.69 c1c(cnc(c1O)N)F BC228724 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.69 c1c(nc(c(n1)O)Br)Br BC256273 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.69 c1cc(c(cc1Br)Cl)F BC203452 [0,1,0,0,0,0|2,0,0]=3 247 B9R1.69 c1cc(c(cc1Br)F)F BC226440 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.69 c1cc(c(cc1Br)F)O BC200633 [0,1,0,0,0,0|1,0,0]=2 249 B9R1.69 c1cc(c(cc1Br)N)N BC222419 [0,1,0,0,0,0|2,0,0]=3 250 B9R1.69 c1cc(c(cc1Br)N)O BC216412 [0,1,0,0,0,0|1,0,0]=2 251 B9R1.69 c1cc(c(cc1Br)O)Cl BC680561 [0,1,0,0,0,0|2,0,0]=3 252 B9R1.69 c1cc(c(cc1Cl)Cl)F BC675767 [0,1,0,0,0,0|2,0,0]=3 253 B9R1.69 c1cc(c(cc1Cl)Cl)O BC683159 [0,1,0,0,0,0|1,0,0]=2 254 B9R1.69 c1cc(c(cc1Cl)Cl)S BC646085 [0,1,0,0,0,0|1,1,0]=3 255 B9R1.69 c1cc(c(cc1Cl)I)N BC227783 [0,1,0,0,0,0|2,0,0]=3 256 B9R1.69 c1cc(c(cc1Cl)N)Br BC645243 [0,1,0,0,0,0|2,0,0]=3 257 B9R1.69 c1cc(c(cc1Cl)N)N BC222890 [0,1,0,0,0,0|2,0,0]=3 258 B9R1.69 c1cc(c(cc1F)Br)F BC203460 [0,1,0,0,0,0|2,0,0]=3 259 B9R1.69 c1cc(c(cc1F)Br)O BC210241 [0,1,0,0,0,0|1,0,0]=2 260 B9R1.69 c1cc(c(cc1F)Cl)N BC209668 [0,1,0,0,0,0|2,0,0]=3 261 B9R1.69 c1cc(c(cc1F)Cl)O BC207122 [0,1,0,0,0,0|1,0,0]=2 262 B9R1.69 c1cc(c(cc1F)I)Cl BC675821 [0,1,0,0,0,0|2,0,0]=3 263 B9R1.69 c1cc(c(cc1F)N)F BC226439 [0,1,0,0,0,0|2,0,0]=3 264 B9R1.69 c1cc(c(cc1F)O)Br BC210242 [0,1,0,0,0,0|2,0,0]=3 265 B9R1.69 c1cc(c(cc1F)O)N BC686429 [0,1,0,0,0,0|2,0,0]=3 266 B9R1.69 c1cc(c(cc1F)O)O BC201436 [0,1,0,0,0,0|1,0,0]=2 267 B9R1.69 c1cc(c(cc1I)F)F BC201012 [0,1,0,0,0,0|2,0,0]=3 268 B9R1.69 c1cc(c(cc1I)F)O BC652354 [0,1,0,0,0,0|1,0,0]=2 269 B9R1.69 c1cc(c(cc1I)N)F BC686412 [0,1,0,0,0,0|2,0,0]=3 270 B9R1.69 c1cc(c(cc1N)Cl)Cl BC203358 [0,1,0,0,0,0|2,0,0]=3 271 B9R1.69 c1cc(c(cc1N)O)Cl BC677592 [0,1,0,0,0,0|2,0,0]=3 272 B9R1.69 c1cc(c(cc1N)O)O BC673428 [0,1,0,0,0,0|1,0,0]=2 273 B9R1.69 c1cc(c(cc1O)Br)F BC227792 [0,1,0,0,0,0|1,0,0]=2 274 B9R1.69 c1cc(c(cc1O)Cl)Br BC210230 [0,1,0,0,0,0|1,0,0]=2 275 B9R1.69 c1cc(c(cc1O)Cl)Cl BC210315 [0,1,0,0,0,0|1,0,0]=2 276 B9R1.69 c1cc(c(cc1O)Cl)N BC210179 [0,1,0,0,0,0|1,0,0]=2 277 B9R1.69 c1cc(c(cc1O)F)Cl BC227794 [0,1,0,0,0,0|1,0,0]=2 278 B9R1.69 c1cc(c(cc1O)N)Br BC638504 [0,1,0,0,0,0|1,0,0]=2 279 B9R1.69 c1cc(c(cc1O)N)F BC226676 [0,1,0,0,0,0|1,0,0]=2 280 B9R1.69 c1cc(c(cc1O)O)Br BC210237 [0,1,0,0,0,0|1,0,0]=2 281 B9R1.69 c1cc(nc(c1Br)Cl)Br BC256297 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.69 c1cc(nc(c1Br)Cl)N BC256306 [0,1,0,0,0,0|3,0,0]=4 283 B9R1.69 c1cc(nc(c1Cl)Cl)Cl BC210705 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.69 c1cc(nc(c1N)Br)Br BC202195 [0,1,0,0,0,0|3,0,0]=4 285 B7R0.6 CC(=O)\C=C\C(=O)O BC214213 [0,0,1,0,0,0|1,0,2]=4 286 B7R1.2 C1=CC(=O)OC1=O BC200750 [0,0,0,0,1,0|1,0,2]=4 287 B7R1.2 Cc1ccc([nH]1)C BC203703 [0,0,0,0,1,0|3,0,0]=4 288 B7R1.2 c1c(csc1Br)Br BC685091 [0,0,0,0,1,0|3,0,0]=4 289 B7R1.2 c1cc(sc1Br)Br BC689401 [0,0,0,0,1,0|3,0,0]=4 290 B6R0.4 C(\C=C\C(=O)O)O BC224091 [1,0,1,0,0,0|1,0,1]=4 291 B6R1.1 C1CC=CC=C1 BC207599 [2,0,0,0,0,0|0,0,2]=4 292 B6R1.1 c1ccncc1 BC220698 [2,0,0,0,0,0|1,0,0]=3 293 B8R1.2 C#Cc1ccccn1 BC225212 [1,1,0,0,0,0|2,0,0]=4 294 B8R1.2 C#Cc1ccncc1 BC677907 [1,1,0,0,0,0|2,0,0]=4 295 B8R1.2 C=Cc1cccnc1 BC675972 [1,1,0,0,0,0|2,0,0]=4 296 B8R1.2 CCc1cccnc1 BC223674 [1,1,0,0,0,0|2,0,0]=4 297 B8R1.2 COc1cccnc1 BC653137 [1,1,0,0,0,0|1,0,0]=3 298 B8R1.2 [C-]#[N+]c1ccccc1 BC297263 [1,1,0,0,0,0|1,0,0]=3 299 B8R1.2 c1c(cncn1)CO BC228080 [1,1,0,0,0,0|2,0,0]=4 300 B8R1.2 c1cc(cnc1)C=O BC221128 [1,1,0,0,0,0|1,0,1]=4 301 B8R1.2 c1cc(cnc1)CBr BC258182 [1,1,0,0,0,0|2,0,0]=4 302 B8R1.2 c1cc(cnc1)CBr BC281217 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.2 c1cc(cnc1)CCl BC204269 [1,1,0,0,0,0|2,0,0]=4 304 B8R1.2 c1cc(cnc1)CN BC205833 [1,1,0,0,0,0|2,0,0]=4 305 B8R1.2 c1cc(cnc1)CO BC209311 [1,1,0,0,0,0|1,0,0]=3 306 B8R1.2 c1cc(cnc1)NN BC231979 [1,1,0,0,0,0|2,0,0]=4 307 B8R1.2 c1cc(cnc1)NN BC686688 [1,1,0,0,0,0|2,0,0]=4 308 B8R1.2 c1cc(cnc1)NN BC686691 [1,1,0,0,0,0|2,0,0]=4 309 B8R1.2 c1ccc(cc1)CBr BC220250 [1,1,0,0,0,0|1,0,0]=3 310 B8R1.2 c1ccc(cc1)CCl BC210975 [1,1,0,0,0,0|1,0,0]=3 311 B8R1.2 c1ccc(cc1)CO BC222892 [1,1,0,0,0,0|0,0,0]=2 312 B8R1.2 c1ccc(cc1)N=O BC684726 [1,1,0,0,0,0|0,0,1]=3 313 B8R1.2 c1ccc(cc1)[Mg]Br BC653680 [1,1,0,0,0,0|1,0,0]=3 314 B8R1.2 c1ccnc(c1)CCl BC213218 [1,1,0,0,0,0|2,0,0]=4 315 B8R1.2 c1ccnc(c1)CCl BC227992 [1,1,0,0,0,0|2,0,0]=4 316 B8R1.2 c1cncnc1CO BC228082 [1,1,0,0,0,0|2,0,0]=4 317 B8R1.4 Cc1cc(ccn1)Br BC208673 [1,1,0,0,0,0|2,0,0]=4 318 B8R1.4 Cc1cc(ccn1)Cl BC219169 [1,1,0,0,0,0|2,0,0]=4 319 B8R1.4 Cc1cc(ccn1)O BC208676 [1,1,0,0,0,0|1,0,0]=3 320 B8R1.4 Cc1cc(cnc1)Br BC202211 [1,1,0,0,0,0|2,0,0]=4 321 B8R1.4 Cc1cc(cnc1)N BC208421 [1,1,0,0,0,0|2,0,0]=4 322 B8R1.4 Cc1cc(cnc1)O BC201216 [1,1,0,0,0,0|1,0,0]=3 323 B8R1.4 Cc1cccc(c1)F BC675323 [1,1,0,0,0,0|1,0,0]=3 324 B8R1.4 Cc1cccc(c1)O BC207588 [1,1,0,0,0,0|0,0,0]=2 325 B8R1.4 Cc1cccc(n1)Cl BC227997 [1,1,0,0,0,0|2,0,0]=4 326 B8R1.4 Cc1cccc(n1)N BC202221 [1,1,0,0,0,0|2,0,0]=4 327 B8R1.4 Cc1ccnc(c1)Br BC207069 [1,1,0,0,0,0|2,0,0]=4 328 B8R1.4 Cc1ccnc(c1)F BC219183 [1,1,0,0,0,0|2,0,0]=4 329 B8R1.4 c1c(cncc1Br)Br BC204490 [1,1,0,0,0,0|2,0,0]=4 330 B8R1.4 c1c(cncc1Br)O BC221860 [1,1,0,0,0,0|1,0,0]=3 331 B8R1.4 c1c(cncc1Cl)Cl BC204492 [1,1,0,0,0,0|2,0,0]=4 332 B8R1.4 c1c(cncc1Cl)N BC204497 [1,1,0,0,0,0|2,0,0]=4 333 B8R1.4 c1c(cncc1F)F BC225098 [1,1,0,0,0,0|2,0,0]=4 334 B8R1.4 c1c(cncc1N)N BC227073 [1,1,0,0,0,0|2,0,0]=4 335 B8R1.4 c1c[nH]c(=O)cc1Br BC683009 [1,1,0,0,0,0|1,0,1]=4 336 B8R1.4 c1cc(cc(c1)Br)Br BC675855 [1,1,0,0,0,0|1,0,0]=3 337 B8R1.4 c1cc(cc(c1)Br)S BC667223 [1,1,0,0,0,0|0,1,0]=3 338 B8R1.4 c1cc(cc(c1)Cl)Cl BC205103 [1,1,0,0,0,0|1,0,0]=3 339 B8R1.4 c1cc(cc(c1)I)Br BC675850 [1,1,0,0,0,0|1,0,0]=3 340 B8R1.4 c1cc(cc(c1)I)N BC213647 [1,1,0,0,0,0|1,0,0]=3 341 B8R1.4 c1cc(cc(c1)O)O BC207605 [1,1,0,0,0,0|0,0,0]=2 342 B8R1.4 c1cc(nc(c1)Br)F BC219144 [1,1,0,0,0,0|2,0,0]=4 343 B8R1.4 c1cc(nc(c1)Br)N BC207509 [1,1,0,0,0,0|2,0,0]=4 344 B8R1.4 c1cc(nc(c1)Cl)N BC201207 [1,1,0,0,0,0|2,0,0]=4 345 B8R1.4 c1cc(nc(c1)F)N BC222333 [1,1,0,0,0,0|2,0,0]=4 346 B8R1.4 c1cc(nc(c1)N)N BC200771 [1,1,0,0,0,0|2,0,0]=4 347 B8R1.4 c1cnc(cc1Br)Br BC204489 [1,1,0,0,0,0|2,0,0]=4 348 B8R1.4 c1cnc(cc1Br)Cl BC204493 [1,1,0,0,0,0|2,0,0]=4 349 B8R1.4 c1cnc(cc1Br)N BC225238 [1,1,0,0,0,0|2,0,0]=4 350 B8R1.4 c1cnc(cc1Br)O BC228856 [1,1,0,0,0,0|1,0,0]=3 351 B8R1.4 c1cnc(cc1Cl)Br BC204494 [1,1,0,0,0,0|2,0,0]=4 352 B8R1.4 c1cnc(cc1Cl)Cl BC204488 [1,1,0,0,0,0|2,0,0]=4 353 B8R1.4 c1cnc(cc1Cl)N BC225236 [1,1,0,0,0,0|2,0,0]=4 354 B8R1.4 c1cnc(cc1F)Br BC226649 [1,1,0,0,0,0|2,0,0]=4 355 B8R1.4 c1cnc(cc1F)Cl BC226637 [1,1,0,0,0,0|2,0,0]=4 356 B8R1.4 c1cnc(cc1F)F BC212172 [1,1,0,0,0,0|2,0,0]=4 357 B8R1.4 c1cnc(cc1F)N BC670027 [1,1,0,0,0,0|2,0,0]=4 358 B8R1.4 c1cnc(cc1I)F BC225099 [1,1,0,0,0,0|2,0,0]=4 359 B8R1.4 c1cnc(cc1N)Br BC205180 [1,1,0,0,0,0|2,0,0]=4 360 B8R1.4 c1cnc(cc1N)Cl BC227047 [1,1,0,0,0,0|2,0,0]=4 361 B8R1.4 c1cnc(cc1N)F BC227044 [1,1,0,0,0,0|2,0,0]=4 362 B8R1.4 c1cnc(cc1N)N BC227163 [1,1,0,0,0,0|2,0,0]=4 363 B8R1.4 c1cnc(cc1O)Br BC208749 [1,1,0,0,0,0|1,0,0]=3 364 B8R1.4 c1cnc(cc1O)F BC656317 [1,1,0,0,0,0|1,0,0]=3 365 B8R1.4 c1cnc(cc1O)N BC222335 [1,1,0,0,0,0|1,0,0]=3 366 B8R1.4 c1cnc(cc1O)O BC208052 [1,1,0,0,0,0|1,0,0]=3 367 B8R1.5 Cc1c(cccn1)Br BC225550 [1,1,0,0,0,0|2,0,0]=4 368 B8R1.5 Cc1c(cccn1)Cl BC656264 [1,1,0,0,0,0|2,0,0]=4 369 B8R1.5 Cc1c(cccn1)F BC677139 [1,1,0,0,0,0|2,0,0]=4 370 B8R1.5 Cc1c(cccn1)N BC219118 [1,1,0,0,0,0|2,0,0]=4 371 B8R1.5 Cc1c(cccn1)O BC225229 [1,1,0,0,0,0|1,0,0]=3 372 B8R1.5 Cc1cccc[n+]1[O-] BC213117 [1,1,0,0,0,0|1,0,1]=4 373 B8R1.5 Cc1cccnc1Br BC227989 [1,1,0,0,0,0|2,0,0]=4 374 B8R1.5 Cc1cccnc1N BC225899 [1,1,0,0,0,0|2,0,0]=4 375 B8R1.5 Cc1cccnc1O BC225228 [1,1,0,0,0,0|1,0,0]=3 376 B8R1.5 Cc1ccncc1C BC667797 [1,1,0,0,0,0|2,0,0]=4 377 B8R1.5 Cc1ccncc1F BC219203 [1,1,0,0,0,0|2,0,0]=4 378 B8R1.5 Cc1ccncc1N BC207827 [1,1,0,0,0,0|2,0,0]=4 379 B8R1.5 Cc1ccncc1O BC656328 [1,1,0,0,0,0|1,0,0]=3 380 B8R1.5 Cc1cnccc1Br BC201979 [1,1,0,0,0,0|2,0,0]=4 381 B8R1.5 Cc1cnccc1Br BC219154 [1,1,0,0,0,0|2,0,0]=4 382 B8R1.5 Cc1cnccc1Cl BC219170 [1,1,0,0,0,0|2,0,0]=4 383 B8R1.5 c1c(c(=O)nc[nH]1)O BC655988 [1,1,0,0,0,0|2,0,0]=4 384 B8R1.5 c1cc(c(nc1)Br)F BC227112 [1,1,0,0,0,0|2,0,0]=4 385 B8R1.5 c1cc(c(nc1)Br)N BC207481 [1,1,0,0,0,0|2,0,0]=4 386 B8R1.5 c1cc(c(nc1)Br)O BC206638 [1,1,0,0,0,0|1,0,0]=3 387 B8R1.5 c1cc(c(nc1)Cl)Br BC210233 [1,1,0,0,0,0|2,0,0]=4 388 B8R1.5 c1cc(c(nc1)Cl)Cl BC210321 [1,1,0,0,0,0|2,0,0]=4 389 B8R1.5 c1cc(c(nc1)Cl)I BC207966 [1,1,0,0,0,0|2,0,0]=4 390 B8R1.5 c1cc(c(nc1)Cl)N BC226077 [1,1,0,0,0,0|2,0,0]=4 391 B8R1.5 c1cc(c(nc1)Cl)O BC206637 [1,1,0,0,0,0|1,0,0]=3 392 B8R1.5 c1cc(c(nc1)F)Br BC219145 [1,1,0,0,0,0|2,0,0]=4 393 B8R1.5 c1cc(c(nc1)F)Cl BC214599 [1,1,0,0,0,0|2,0,0]=4 394 B8R1.5 c1cc(c(nc1)F)F BC211682 [1,1,0,0,0,0|2,0,0]=4 395 B8R1.5 c1cc(c(nc1)F)I BC213726 [1,1,0,0,0,0|2,0,0]=4 396 B8R1.5 c1cc(c(nc1)F)N BC219109 [1,1,0,0,0,0|2,0,0]=4 397 B8R1.5 c1cc(c(nc1)F)O BC677131 [1,1,0,0,0,0|1,0,0]=3 398 B8R1.5 c1cc(c(nc1)I)O BC206480 [1,1,0,0,0,0|1,0,0]=3 399 B8R1.5 c1cc(c(nc1)N)Br BC202222 [1,1,0,0,0,0|2,0,0]=4 400 B8R1.5 c1cc(c(nc1)N)Cl BC205827 [1,1,0,0,0,0|2,0,0]=4 401 B8R1.5 c1cc(c(nc1)N)F BC227098 [1,1,0,0,0,0|2,0,0]=4 402 B8R1.5 c1cc(c(nc1)N)I BC219764 [1,1,0,0,0,0|2,0,0]=4 403 B8R1.5 c1cc(c(nc1)N)N BC227150 [1,1,0,0,0,0|2,0,0]=4 404 B8R1.5 c1cc(c(nc1)N)O BC227987 [1,1,0,0,0,0|1,0,0]=3 405 B8R1.5 c1cc(c(nc1)O)F BC202279 [1,1,0,0,0,0|1,0,0]=3 406 B8R1.5 c1cc(c(nc1)O)N BC202198 [1,1,0,0,0,0|1,0,0]=3 407 B8R1.5 c1cc(c(nc1)O)O BC209278 [1,1,0,0,0,0|1,0,0]=3 408 B8R1.5 c1cc[n+](c(c1)Cl)[O-] BC213191 [1,1,0,0,0,0|1,0,1]=4 409 B8R1.5 c1cc[n+](c(c1)[S-])[O-] BC206730 [1,1,0,0,0,0|1,0,1]=4 410 B8R1.5 c1cc[n+](c(c1)[S-])[O-] BC207991 [1,1,0,0,0,0|1,0,1]=4 411 B8R1.5 c1ccc(c(c1)N)Br BC677892 [1,1,0,0,0,0|1,0,0]=3 412 B8R1.5 c1ccc(c(c1)N)I BC213646 [1,1,0,0,0,0|1,0,0]=3 413 B8R1.5 c1ccc(c(c1)N)S BC250051 [1,1,0,0,0,0|0,1,0]=3 414 B8R1.5 c1ccc(c(c1)O)I BC213644 [1,1,0,0,0,0|0,0,0]=2 415 B8R1.5 c1ccc(c(c1)O)O BC205707 [1,1,0,0,0,0|0,0,0]=2 416 B8R1.5 c1cncc(c1Br)Cl BC219129 [1,1,0,0,0,0|2,0,0]=4 417 B8R1.5 c1cncc(c1Br)F BC219146 [1,1,0,0,0,0|2,0,0]=4 418 B8R1.5 c1cncc(c1Br)N BC228928 [1,1,0,0,0,0|2,0,0]=4 419 B8R1.5 c1cncc(c1Br)O BC228930 [1,1,0,0,0,0|1,0,0]=3 420 B8R1.5 c1cncc(c1Cl)Br BC219128 [1,1,0,0,0,0|2,0,0]=4 421 B8R1.5 c1cncc(c1Cl)F BC219166 [1,1,0,0,0,0|2,0,0]=4 422 B8R1.5 c1cncc(c1Cl)N BC205922 [1,1,0,0,0,0|2,0,0]=4 423 B8R1.5 c1cncc(c1F)Br BC227113 [1,1,0,0,0,0|2,0,0]=4 424 B8R1.5 c1cncc(c1F)Cl BC226640 [1,1,0,0,0,0|2,0,0]=4 425 B8R1.5 c1cncc(c1F)F BC227745 [1,1,0,0,0,0|2,0,0]=4 426 B8R1.5 c1cncc(c1I)O BC212690 [1,1,0,0,0,0|1,0,0]=3 427 B8R1.5 c1cncc(c1N)Br BC652374 [1,1,0,0,0,0|2,0,0]=4 428 B8R1.5 c1cncc(c1N)Cl BC202197 [1,1,0,0,0,0|2,0,0]=4 429 B8R1.5 c1cncc(c1N)F BC219110 [1,1,0,0,0,0|2,0,0]=4 430 B8R1.5 c1cncc(c1N)N BC222447 [1,1,0,0,0,0|2,0,0]=4 431 B8R1.5 c1cncc(c1N)O BC228924 [1,1,0,0,0,0|1,0,0]=3 432 B8R1.5 c1cncc(c1O)N BC201447 [1,1,0,0,0,0|1,0,0]=3 433 B8R1.5 c1cncc(c1O)O BC678752 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.1 CCOc1ccc(cn1)N BC215883 [0,2,0,0,0,0|2,0,0]=4 435 B10R1.1 CCOc1ccc(nc1)Cl BC228804 [0,2,0,0,0,0|2,0,0]=4 436 B10R1.1 COCc1ccc(cc1)O BC674868 [0,2,0,0,0,0|0,0,0]=2 437 B10R1.1 Cc1ccc(cc1)CC#N BC205621 [0,2,0,0,0,0|2,0,0]=4 438 B10R1.1 c1cc(ccc1CC#N)Br BC227508 [0,2,0,0,0,0|2,0,0]=4 439 B10R1.1 c1cc(ccc1CC#N)N BC676372 [0,2,0,0,0,0|2,0,0]=4 440 B10R1.1 c1cc(ccc1CCBr)Cl BC658954 [0,2,0,0,0,0|2,0,0]=4 441 B10R1.1 c1cc(ccc1CCN)Br BC205235 [0,2,0,0,0,0|2,0,0]=4 442 B10R1.1 c1cc(ccc1CCO)Br BC646236 [0,2,0,0,0,0|1,0,0]=3 443 B10R1.1 c1cc(ccc1CCO)O BC676907 [0,2,0,0,0,0|0,0,0]=2 444 B10R1.1 c1cc(ccc1N=C=O)F BC219243 [0,2,0,0,0,0|1,0,1]=4 445 B10R1.1 c1cc(ccc1\C=N\O)F BC684728 [0,2,0,0,0,0|1,0,0]=3 446 B10R1.3 C#Cc1ccc(cc1)CO BC686208 [0,2,0,0,0,0|1,0,0]=3 447 B10R1.3 C=Cc1ccc(cc1)CCl BC214833 [0,2,0,0,0,0|2,0,0]=4 448 B10R1.3 C=Cc1ccc(cc1)CO BC221109 [0,2,0,0,0,0|1,0,0]=3 449 B10R1.3 COc1ccc(cc1)C#C BC215299 [0,2,0,0,0,0|1,0,0]=3 450 B10R1.3 COc1ccc(cc1)CCl BC676749 [0,2,0,0,0,0|1,0,0]=3 451 B10R1.3 COc1ccc(cc1)CN BC208901 [0,2,0,0,0,0|1,0,0]=3 452 B10R1.3 COc1ccc(cc1)CS BC208815 [0,2,0,0,0,0|0,1,0]=3 453 B10R1.3 COc1ccc(cc1)NN BC206166 [0,2,0,0,0,0|1,0,0]=3 454 B10R1.3 COc1ccc(cc1)[Mg]Br BC653679 [0,2,0,0,0,0|1,0,0]=3 455 B10R1.3 COc1ccc(cn1)NN BC675241 [0,2,0,0,0,0|2,0,0]=4 456 B10R1.3 c1cc(ccc1C#N)NN BC201802 [0,2,0,0,0,0|2,0,0]=4 457 B10R1.3 c1cc(ccc1C=O)C#N BC209249 [0,2,0,0,0,0|1,0,1]=4 458 B10R1.3 c1cc(ccc1CBr)C#N BC201242 [0,2,0,0,0,0|2,0,0]=4 459 B10R1.3 c1cc(ccc1CCl)C#N BC202327 [0,2,0,0,0,0|2,0,0]=4 460 B10R1.3 c1cc(ccc1CN)C#N BC676381 [0,2,0,0,0,0|2,0,0]=4 461 B10R1.3 c1cc(ccc1CO)CCl BC217419 [0,2,0,0,0,0|1,0,0]=3 462 B10R1.13 B(c1ccc(cc1)Br)(O)O BC685826 [0,2,0,0,0,0|1,0,0]=3 463 B10R1.13 B(c1ccc(cc1)C)(O)O BC210678 [0,2,0,0,0,0|1,0,0]=3 464 B10R1.13 B(c1ccc(cc1)Cl)(O)O BC677573 [0,2,0,0,0,0|1,0,0]=3 465 B10R1.13 B(c1ccc(cc1)F)(O)O BC227618 [0,2,0,0,0,0|1,0,0]=3 466 B10R1.13 B(c1ccc(cn1)C)(O)O BC210680 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.13 B(c1ccc(nc1)Br)(O)O BC200364 [0,2,0,0,0,0|2,0,0]=4 468 B10R1.13 B(c1ccc(nc1)C)(O)O BC656202 [0,2,0,0,0,0|2,0,0]=4 469 B10R1.13 B(c1ccc(nc1)F)(O)O BC200359 [0,2,0,0,0,0|2,0,0]=4 470 B10R1.13 B(c1ccc(nc1)N)(O)O BC686183 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.13 CC(=O)c1ccc(cc1)Br BC227589 [0,2,0,0,0,0|1,0,1]=4 472 B10R1.13 CC(=O)c1ccc(cc1)Cl BC676864 [0,2,0,0,0,0|1,0,1]=4 473 B10R1.13 CC(=O)c1ccc(cc1)F BC204121 [0,2,0,0,0,0|1,0,1]=4 474 B10R1.13 CC(=O)c1ccc(cc1)O BC675526 [0,2,0,0,0,0|0,0,1]=3 475 B10R1.13 CC(C)c1ccc(cc1)Br BC213524 [0,2,0,0,0,0|2,0,0]=4 476 B10R1.13 CC(c1ccc(cc1)Br)N BC204235 [0,2,0,0,0,0|2,0,0]=4 477 B10R1.13 C[C@@H](c1ccc(cc1)Br)N BC216482 [0,2,0,0,0,0|2,0,0]=4 478 B10R1.13 C[C@H](c1ccc(cc1)Br)N BC678930 [0,2,0,0,0,0|2,0,0]=4 479 B10R1.13 Cc1ccc(cc1)C(=O)O BC675261 [0,2,0,0,0,0|1,0,0]=3 480 B10R1.13 Cc1ccc(cc1)C(C)C BC677632 [0,2,0,0,0,0|2,0,0]=4 481 B10R1.13 Cc1ccc(cc1)N(C)C BC206482 [0,2,0,0,0,0|2,0,0]=4 482 B10R1.13 Cc1ccc(cn1)C(=O)O BC227043 [0,2,0,0,0,0|2,0,0]=4 483 B10R1.13 Cc1ccc(cn1)C(C)O BC681105 [0,2,0,0,0,0|2,0,0]=4 484 B10R1.13 Cc1ccc(nc1)C(=O)O BC207540 [0,2,0,0,0,0|2,0,0]=4 485 B10R1.13 c1c(ncc(n1)O)C(=O)O BC220987 [0,2,0,0,0,0|2,0,0]=4 486 B10R1.13 c1cc(ccc1C(=N)N)N BC213772 [0,2,0,0,0,0|2,0,0]=4 487 B10R1.13 c1cc(ccc1C(=N)N)O BC223815 [0,2,0,0,0,0|1,0,0]=3 488 B10R1.13 c1cc(ccc1C(=O)N)O BC219028 [0,2,0,0,0,0|0,0,1]=3 489 B10R1.13 c1cc(ccc1C(=O)O)I BC210636 [0,2,0,0,0,0|1,0,0]=3 490 B10R1.13 c1cc(ccc1C(=O)O)N BC227499 [0,2,0,0,0,0|1,0,0]=3 491 B10R1.13 c1cc(ccc1C(=O)O)O BC228180 [0,2,0,0,0,0|0,0,0]=2 492 B10R1.13 c1cc(ccc1F)S(=O)[O-] BC200582 [0,2,0,0,0,0|1,0,1]=4 493 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] BC203717 [0,2,0,0,0,0|1,0,1]=4 494 B10R1.13 c1cc(ncc1Br)C(=O)O BC213733 [0,2,0,0,0,0|2,0,0]=4 495 B10R1.13 c1cc(ncc1C(=O)O)F BC214606 [0,2,0,0,0,0|2,0,0]=4 496 B10R1.13 c1cc(ncc1C(=O)O)N BC213736 [0,2,0,0,0,0|2,0,0]=4 497 B10R1.13 c1cc(ncc1C(=O)O)O BC215635 [0,2,0,0,0,0|1,0,0]=3 498 B10R1.13 c1cc(ncc1Cl)C(=O)O BC224603 [0,2,0,0,0,0|2,0,0]=4 499 B10R1.13 c1cc(ncc1F)C(=O)O BC224604 [0,2,0,0,0,0|2,0,0]=4 500 B10R1.13 c1cc(ncc1N)C(=O)O BC210785 [0,2,0,0,0,0|2,0,0]=4 501 B10R1.13 c1cc(ncc1O)C(=O)O BC224042 [0,2,0,0,0,0|1,0,0]=3 502 B10R1.25 C=Cc1ccc(cc1F)F BC227581 [0,2,0,0,0,0|2,0,0]=4 503 B10R1.25 CCc1ccc(cc1O)O BC201065 [0,2,0,0,0,0|1,0,0]=3 504 B10R1.25 COc1c(cc(cn1)Br)Cl BC219122 [0,2,0,0,0,0|2,0,0]=4 505 B10R1.25 COc1c(cc(cn1)Br)F BC219136 [0,2,0,0,0,0|2,0,0]=4 506 B10R1.25 COc1c(cc(cn1)Cl)Br BC228873 [0,2,0,0,0,0|2,0,0]=4 507 B10R1.25 COc1c(cc(cn1)F)Br BC219135 [0,2,0,0,0,0|2,0,0]=4 508 B10R1.25 COc1ccc(cc1Br)Cl BC200800 [0,2,0,0,0,0|1,0,0]=3 509 B10R1.25 COc1ccc(cc1Br)N BC208555 [0,2,0,0,0,0|1,0,0]=3 510 B10R1.25 COc1ccc(cc1I)Cl BC646260 [0,2,0,0,0,0|1,0,0]=3 511 B10R1.25 COc1ccc(cc1O)Br BC678376 [0,2,0,0,0,0|1,0,0]=3 512 B10R1.25 Cc1cc(ccc1C#N)Cl BC210293 [0,2,0,0,0,0|2,0,0]=4 513 B10R1.25 Cc1cc(ccc1C#N)F BC220197 [0,2,0,0,0,0|2,0,0]=4 514 B10R1.25 Cc1cc(ccc1C#N)N BC667367 [0,2,0,0,0,0|2,0,0]=4 515 B10R1.25 Cc1cc(ccc1C=O)F BC211665 [0,2,0,0,0,0|1,0,1]=4 516 B10R1.25 Cc1cc(ccc1C=O)O BC215465 [0,2,0,0,0,0|0,0,1]=3 517 B10R1.25 Cc1cc(ccc1CN)Br BC646006 [0,2,0,0,0,0|2,0,0]=4 518 B10R1.25 Cc1cc(cnc1C#N)O BC228143 [0,2,0,0,0,0|2,0,0]=4 519 B10R1.25 Cc1cc(cnc1OC)N BC219114 [0,2,0,0,0,0|2,0,0]=4 520 B10R1.25 Cc1ccc(c(c1)Br)C=O BC675522 [0,2,0,0,0,0|1,0,1]=4 521 B10R1.25 Cc1ccc(c(c1)C)NN BC227297 [0,2,0,0,0,0|2,0,0]=4 522 B10R1.25 Cc1ccc(c(c1)Cl)C#N BC227676 [0,2,0,0,0,0|2,0,0]=4 523 B10R1.25 Cc1ccc(c(c1)Cl)C=O BC658832 [0,2,0,0,0,0|1,0,1]=4 524 B10R1.25 Cc1ccc(c(c1)F)C#N BC220198 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.25 Cc1ccc(c(c1)F)C=O BC211664 [0,2,0,0,0,0|1,0,1]=4 526 B10R1.25 c1cc(c(cc1Br)Cl)C=O BC227733 [0,2,0,0,0,0|1,0,1]=4 527 B10R1.25 c1cc(c(cc1Br)F)C#N BC206791 [0,2,0,0,0,0|2,0,0]=4 528 B10R1.25 c1cc(c(cc1Br)F)C=O BC227694 [0,2,0,0,0,0|1,0,1]=4 529 B10R1.25 c1cc(c(cc1Br)F)CN BC227356 [0,2,0,0,0,0|2,0,0]=4 530 B10R1.25 c1cc(c(cc1Br)O)C=O BC675928 [0,2,0,0,0,0|1,0,1]=4 531 B10R1.25 c1cc(c(cc1Cl)Br)C=O BC658860 [0,2,0,0,0,0|1,0,1]=4 532 B10R1.25 c1cc(c(cc1Cl)F)CCl BC200642 [0,2,0,0,0,0|2,0,0]=4 533 B10R1.25 c1cc(c(cc1Cl)F)CO BC226999 [0,2,0,0,0,0|1,0,0]=3 534 B10R1.25 c1cc(c(cc1Cl)O)C=O BC676335 [0,2,0,0,0,0|1,0,1]=4 535 B10R1.25 c1cc(c(cc1F)Br)C#N BC213670 [0,2,0,0,0,0|2,0,0]=4 536 B10R1.25 c1cc(c(cc1F)Cl)C#N BC211030 [0,2,0,0,0,0|2,0,0]=4 537 B10R1.25 c1cc(c(cc1F)Cl)NN BC200227 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.25 c1cc(c(cc1F)F)CBr BC210967 [0,2,0,0,0,0|2,0,0]=4 539 B10R1.25 c1cc(c(cc1F)F)CN BC227346 [0,2,0,0,0,0|2,0,0]=4 540 B10R1.25 c1cc(c(cc1F)N)C#N BC226704 [0,2,0,0,0,0|2,0,0]=4 541 B10R1.25 c1cc(c(cc1F)O)C=O BC215403 [0,2,0,0,0,0|1,0,1]=4 542 B10R1.25 c1cc(c(cc1I)F)C#N BC227647 [0,2,0,0,0,0|2,0,0]=4 543 B10R1.25 c1cc(c(cc1N)F)C#N BC211038 [0,2,0,0,0,0|2,0,0]=4 544 B10R1.25 c1cc(c(cc1N)O)C#N BC236841 [0,2,0,0,0,0|2,0,0]=4 545 B10R1.25 c1cc(c(cc1O)Cl)C=O BC676095 [0,2,0,0,0,0|0,0,1]=3 546 B10R1.25 c1cc(c(cc1O)O)C=O BC676081 [0,2,0,0,0,0|0,0,1]=3 547 B10R1.176 CCc1ccc(c(c1)N)N BC256282 [0,2,0,0,0,0|2,0,0]=4 548 B10R1.176 COc1ccc(c(c1)Br)Br BC676631 [0,2,0,0,0,0|1,0,0]=3 549 B10R1.176 COc1ccc(c(c1)Br)N BC686358 [0,2,0,0,0,0|1,0,0]=3 550 B10R1.176 COc1ccc(c(c1)F)O BC255276 [0,2,0,0,0,0|0,0,0]=2 551 B10R1.176 COc1ccc(c(c1)I)N BC222720 [0,2,0,0,0,0|1,0,0]=3 552 B10R1.176 COc1ccc(c(c1)N)Cl BC250953 [0,2,0,0,0,0|1,0,0]=3 553 B10R1.176 COc1ccc(c(c1)N)F BC686415 [0,2,0,0,0,0|1,0,0]=3 554 B10R1.176 COc1ccc(c(c1)N)I BC668045 [0,2,0,0,0,0|1,0,0]=3 555 B10R1.176 COc1ccc(c(c1)N)I BC686420 [0,2,0,0,0,0|1,0,0]=3 556 B10R1.176 COc1ccc(c(c1)O)Br BC210248 [0,2,0,0,0,0|1,0,0]=3 557 B10R1.176 Cc1c(ccc(n1)OC)Br BC219153 [0,2,0,0,0,0|2,0,0]=4 558 B10R1.176 Cc1c(ccc(n1)OC)F BC219177 [0,2,0,0,0,0|2,0,0]=4 559 B10R1.176 Cc1cc(ccc1Br)C#N BC676368 [0,2,0,0,0,0|2,0,0]=4 560 B10R1.176 Cc1cc(ccc1Cl)C#N BC676393 [0,2,0,0,0,0|2,0,0]=4 561 B10R1.176 Cc1cc(ccc1F)C#N BC219245 [0,2,0,0,0,0|2,0,0]=4 562 B10R1.176 Cc1cc(ccc1F)CN BC676428 [0,2,0,0,0,0|2,0,0]=4 563 B10R1.176 Cc1cc(ccc1O)C=O BC204612 [0,2,0,0,0,0|0,0,1]=3 564 B10R1.176 Cc1ccc(cc1C)CCl BC215413 [0,2,0,0,0,0|2,0,0]=4 565 B10R1.176 Cc1ccc(cc1Cl)C#N BC646050 [0,2,0,0,0,0|2,0,0]=4 566 B10R1.176 Cc1ccc(cc1Cl)CN BC227375 [0,2,0,0,0,0|2,0,0]=4 567 B10R1.176 Cc1ccc(cc1I)C=O BC218138 [0,2,0,0,0,0|1,0,1]=4 568 B10R1.176 Cc1ccc(cc1N)C#N BC226706 [0,2,0,0,0,0|2,0,0]=4 569 B10R1.176 c1cc(c(cc1C#N)Br)Cl BC200292 [0,2,0,0,0,0|2,0,0]=4 570 B10R1.176 c1cc(c(cc1C#N)Br)N BC211035 [0,2,0,0,0,0|2,0,0]=4 571 B10R1.176 c1cc(c(cc1C#N)Cl)F BC207202 [0,2,0,0,0,0|2,0,0]=4 572 B10R1.176 c1cc(c(cc1C#N)F)Br BC686473 [0,2,0,0,0,0|2,0,0]=4 573 B10R1.176 c1cc(c(cc1C#N)F)F BC207103 [0,2,0,0,0,0|2,0,0]=4 574 B10R1.176 c1cc(c(cc1C#N)F)N BC211037 [0,2,0,0,0,0|2,0,0]=4 575 B10R1.176 c1cc(c(cc1C#N)F)O BC226681 [0,2,0,0,0,0|1,0,0]=3 576 B10R1.176 c1cc(c(cc1C#N)N)F BC211039 [0,2,0,0,0,0|2,0,0]=4 577 B10R1.176 c1cc(c(cc1C#N)N)N BC676386 [0,2,0,0,0,0|2,0,0]=4 578 B10R1.176 c1cc(c(cc1C#N)O)O BC220357 [0,2,0,0,0,0|1,0,0]=3 579 B10R1.176 c1cc(c(cc1C=O)Br)Cl BC228158 [0,2,0,0,0,0|1,0,1]=4 580 B10R1.176 c1cc(c(cc1C=O)Br)O BC205837 [0,2,0,0,0,0|0,0,1]=3 581 B10R1.176 c1cc(c(cc1C=O)Cl)Cl BC204289 [0,2,0,0,0,0|1,0,1]=4 582 B10R1.176 c1cc(c(cc1C=O)F)Br BC227697 [0,2,0,0,0,0|1,0,1]=4 583 B10R1.176 c1cc(c(cc1C=O)F)Cl BC206745 [0,2,0,0,0,0|1,0,1]=4 584 B10R1.176 c1cc(c(cc1C=O)F)F BC227722 [0,2,0,0,0,0|1,0,1]=4 585 B10R1.176 c1cc(c(cc1CCl)F)Cl BC210962 [0,2,0,0,0,0|2,0,0]=4 586 B10R1.176 c1cc(c(cc1CN)Cl)F BC211116 [0,2,0,0,0,0|2,0,0]=4 587 B10R1.22 Cc1cc(c(c(c1)Br)F)C BC227402 [0,2,0,0,0,0|2,0,0]=4 588 B10R1.22 Cc1cc(c(c(c1)C)Br)C BC205357 [0,2,0,0,0,0|2,0,0]=4 589 B10R1.22 Cc1cc(c(c(c1)C)N)C BC200500 [0,2,0,0,0,0|2,0,0]=4 590 B10R1.22 Cc1cc(c(c(c1)O)C)C BC201110 [0,2,0,0,0,0|2,0,0]=4 591 B10R1.22 Cc1cc(cc(c1Cl)C)O BC215707 [0,2,0,0,0,0|1,0,0]=3 592 B10R1.22 Cc1cc(cc(c1N)C)Br BC213539 [0,2,0,0,0,0|2,0,0]=4 593 B10R1.22 Cc1cc(cc(c1N)C)Cl BC227787 [0,2,0,0,0,0|2,0,0]=4 594 B10R1.22 Cc1cc(cc(c1N)C)I BC213574 [0,2,0,0,0,0|2,0,0]=4 595 B10R1.22 Cc1cc(cc(c1N)I)I BC220173 [0,2,0,0,0,0|2,0,0]=4 596 B10R1.22 Cc1cc(cc(c1N)N)Br BC227782 [0,2,0,0,0,0|2,0,0]=4 597 B10R1.22 Cc1cc(cc(c1O)C)Br BC209387 [0,2,0,0,0,0|1,0,0]=3 598 B10R1.22 Cc1cc(nc(c1C)O)O BC206240 [0,2,0,0,0,0|2,0,0]=4 599 B10R1.22 c1c(cc(c(c1Br)O)Br)Cl BC220179 [0,2,0,0,0,0|1,0,0]=3 600 B10R1.22 c1c(cc(c(c1Cl)Cl)Cl)Cl BC216090 [0,2,0,0,0,0|2,0,0]=4 601 B10R1.22 c1c(cc(c(c1F)Br)F)N BC251072 [0,2,0,0,0,0|2,0,0]=4 602 B10R1.22 c1c(cc(c(c1F)Cl)F)N BC224206 [0,2,0,0,0,0|2,0,0]=4 603 B10R1.22 c1c(cc(c(c1F)Cl)F)O BC213671 [0,2,0,0,0,0|1,0,0]=3 604 B10R1.22 c1c(cc(c(c1N)F)F)F BC227758 [0,2,0,0,0,0|2,0,0]=4 605 B10R1.22 c1c(cc(c(c1N)O)Cl)Cl BC210188 [0,2,0,0,0,0|1,0,0]=3 606 B10R1.30 C=Cc1cc(ccc1F)F BC227583 [0,2,0,0,0,0|2,0,0]=4 607 B10R1.30 CCc1c(ccc(n1)C)O BC227743 [0,2,0,0,0,0|2,0,0]=4 608 B10R1.30 CCc1cc(ccc1Cl)O BC225279 [0,2,0,0,0,0|1,0,0]=3 609 B10R1.30 CCc1cc(ccc1I)O BC600019 [0,2,0,0,0,0|1,0,0]=3 610 B10R1.30 COc1cc(ccc1Br)Cl BC689392 [0,2,0,0,0,0|2,0,0]=4 611 B10R1.30 COc1cc(ccc1F)N BC220812 [0,2,0,0,0,0|2,0,0]=4 612 B10R1.30 COc1cc(ccc1I)N BC686423 [0,2,0,0,0,0|2,0,0]=4 613 B10R1.30 COc1cc(ccc1N)Br BC214512 [0,2,0,0,0,0|2,0,0]=4 614 B10R1.30 COc1cc(ccc1O)O BC222291 [0,2,0,0,0,0|0,0,0]=2 615 B10R1.30 Cc1ccc(cc1C=O)Br BC652501 [0,2,0,0,0,0|2,0,0]=4 616 B10R1.30 Cc1ccc(cc1NN)Br BC225138 [0,2,0,0,0,0|2,0,0]=4 617 B10R1.30 c1cc(c(cc1Br)C#N)Cl BC676389 [0,2,0,0,0,0|2,0,0]=4 618 B10R1.30 c1cc(c(cc1Br)C#N)N BC209648 [0,2,0,0,0,0|2,0,0]=4 619 B10R1.30 c1cc(c(cc1Br)C#N)O BC227674 [0,2,0,0,0,0|1,0,0]=3 620 B10R1.30 c1cc(c(cc1Br)C=O)Cl BC679792 [0,2,0,0,0,0|2,0,0]=4 621 B10R1.30 c1cc(c(cc1Br)C=O)F BC207196 [0,2,0,0,0,0|2,0,0]=4 622 B10R1.30 c1cc(c(cc1Br)CBr)F BC679762 [0,2,0,0,0,0|2,0,0]=4 623 B10R1.30 c1cc(c(cc1Br)CO)F BC226996 [0,2,0,0,0,0|2,0,0]=4 624 B10R1.30 c1cc(c(cc1Cl)C#N)Br BC679473 [0,2,0,0,0,0|2,0,0]=4 625 B10R1.30 c1cc(c(cc1Cl)C=O)N BC676094 [0,2,0,0,0,0|2,0,0]=4 626 B10R1.30 c1cc(c(cc1Cl)CN)F BC211118 [0,2,0,0,0,0|2,0,0]=4 627 B10R1.30 c1cc(c(cc1F)C=O)Cl BC211666 [0,2,0,0,0,0|2,0,0]=4 628 B10R1.30 c1cc(c(cc1F)C=O)I BC676078 [0,2,0,0,0,0|2,0,0]=4 629 B10R1.30 c1cc(c(cc1F)C=O)O BC215404 [0,2,0,0,0,0|1,0,0]=3 630 B10R1.30 c1cc(c(cc1F)CBr)F BC210966 [0,2,0,0,0,0|2,0,0]=4 631 B10R1.30 c1cc(c(cc1I)CBr)Cl BC212208 [0,2,0,0,0,0|2,0,0]=4 632 B10R1.30 c1cc(c(cc1I)CCl)Cl BC662638 [0,2,0,0,0,0|2,0,0]=4 633 B10R1.30 c1cc(c(cc1I)CO)Cl BC600271 [0,2,0,0,0,0|2,0,0]=4 634 B10R1.30 c1cc(c(cc1N)C#N)F BC202318 [0,2,0,0,0,0|2,0,0]=4 635 B10R1.30 c1cc(c(cc1N)C#N)N BC600193 [0,2,0,0,0,0|2,0,0]=4 636 B10R1.30 c1cc(c(cc1O)C=O)Br BC226695 [0,2,0,0,0,0|1,0,0]=3 637 B10R1.30 c1cc(c(cc1O)C=O)F BC227713 [0,2,0,0,0,0|1,0,0]=3 638 B10R1.118 Cc1cc(c(cc1Br)C)Br BC215419 [0,2,0,0,0,0|2,0,0]=4 639 B10R1.118 Cc1cc(c(cc1Cl)Br)F BC675890 [0,2,0,0,0,0|2,0,0]=4 640 B10R1.118 Cc1cc(c(cc1Cl)C)Cl BC218653 [0,2,0,0,0,0|2,0,0]=4 641 B10R1.118 Cc1cc(c(cc1F)Cl)N BC221801 [0,2,0,0,0,0|2,0,0]=4 642 B10R1.118 Cc1cc(c(cc1N)Br)F BC686357 [0,2,0,0,0,0|2,0,0]=4 643 B10R1.118 c1c(c(cc(c1Br)Br)N)N BC600207 [0,2,0,0,0,0|2,0,0]=4 644 B10R1.118 c1c(c(cc(c1Cl)Cl)Cl)Cl BC216089 [0,2,0,0,0,0|2,0,0]=4 645 B10R1.118 c1c(c(cc(c1Cl)Cl)N)N BC216365 [0,2,0,0,0,0|2,0,0]=4 646 B10R1.118 c1c(c(cc(c1Cl)O)Cl)N BC630700 [0,2,0,0,0,0|1,0,0]=3 647 B10R1.118 c1c(c(cc(c1F)Br)F)F BC205339 [0,2,0,0,0,0|2,0,0]=4 648 B10R1.118 c1c(c(nc(c1Cl)Cl)O)Cl BC201837 [0,2,0,0,0,0|2,0,0]=4 649 B10R1.119 Cc1c(c(ccc1O)O)C BC209237 [0,2,0,0,0,0|0,0,0]=2 650 B10R1.119 Cc1c(ccc(c1N)N)F BC227779 [0,2,0,0,0,0|2,0,0]=4 651 B10R1.119 Cc1ccc(c(c1C)C)C BC630679 [0,2,0,0,0,0|2,0,0]=4 652 B10R1.119 Cc1ccc(c(c1Cl)N)Cl BC213137 [0,2,0,0,0,0|2,0,0]=4 653 B10R1.119 Cc1ccc(c(c1O)C)O BC206302 [0,2,0,0,0,0|1,0,0]=3 654 B10R1.119 c1cc(c(c(c1Br)F)F)Br BC675874 [0,2,0,0,0,0|2,0,0]=4 655 B10R1.119 c1cc(c(c(c1F)F)F)F BC207134 [0,2,0,0,0,0|2,0,0]=4 656 B10R1.119 c1cc(c(c(c1F)F)N)Br BC204727 [0,2,0,0,0,0|2,0,0]=4 657 B10R1.119 c1cc(c(c(c1F)N)F)F BC227759 [0,2,0,0,0,0|2,0,0]=4 658 B10R1.119 c1cc(c(c(c1N)F)Cl)Cl BC227766 [0,2,0,0,0,0|2,0,0]=4 659 B10R1.119 c1cc(c(c(c1N)F)F)Br BC213813 [0,2,0,0,0,0|2,0,0]=4 660 B10R1.119 c1cc(c(c(c1O)F)F)F BC200173 [0,2,0,0,0,0|1,0,0]=3 661 B10R2.31 c1cc2c(cc1Br)CC2 BC201494 [0,1,0,1,0,0|2,0,0]=4 662 B10R2.31 c1cc2c(cc1N)CC2 BC225112 [0,1,0,1,0,0|2,0,0]=4 663 B6R1.2 c1cc(oc1)Br BC675565 [1,0,0,0,1,0|2,0,0]=4 664 B6R1.2 c1cc(sc1)Br BC676814 [1,0,0,0,1,0|2,0,0]=4 665 B6R1.2 c1cc(sc1)Br BC677960 [1,0,0,0,1,0|2,0,0]=4 666 B6R1.2 c1cc(sc1)F BC211749 [1,0,0,0,1,0|2,0,0]=4 667 B6R1.2 c1cocc1Br BC227194 [1,0,0,0,1,0|2,0,0]=4 668 B6R1.2 c1cscc1Br BC210528 [1,0,0,0,1,0|2,0,0]=4 669 B6R1.2 c1cscc1N BC677154 [1,0,0,0,1,0|2,0,0]=4 670 B6R1.2 c1cscc1N BC686803 [1,0,0,0,1,0|2,0,0]=4