0 B6R0.6 CCC\C=C\C=O BC231929 [0,0,0,0,0,0|0,0,2]=2 1 B5R0.2 C(CC=O)C=O BC222879 [1,0,0,0,0,0|1,0,2]=4 2 B7R0.1 CC\C=C\C=C\C=O BC218794 [0,1,0,0,0,0|0,0,0]=1 3 B7R0.3 COC(=O)\C=C\CBr BC203932 [0,1,0,0,0,0|2,0,1]=4 4 B7R0.7 CCOC(=O)CC=O BC222385 [0,1,0,0,0,0|1,0,2]=4 5 B7R1.1 CCc1cccs1 BC210545 [0,0,0,1,0,0|0,1,1]=3 6 B7R1.1 CSc1[nH]ccn1 BC600114 [0,0,0,1,0,0|3,0,0]=4 7 B7R1.1 c1c(nc[nH]1)C=O BC207063 [0,0,0,1,0,0|2,0,0]=3 8 B7R1.1 c1c(scn1)C=O BC678913 [0,0,0,1,0,0|2,0,0]=3 9 B7R1.1 c1c[nH]nc1C=O BC207627 [0,0,0,1,0,0|2,0,0]=3 10 B7R1.1 c1cc([nH]c1)C=O BC210794 [0,0,0,1,0,0|1,0,0]=2 11 B7R1.1 c1cc([nH]c1)CN BC620340 [0,0,0,1,0,0|2,0,1]=4 12 B7R1.1 c1cc(sc1)C#N BC205596 [0,0,0,1,0,0|1,1,1]=4 13 B7R1.1 c1cc(sc1)C=O BC225721 [0,0,0,1,0,0|1,0,0]=2 14 B7R1.1 c1cn(cn1)C=O BC222414 [0,0,0,1,0,0|2,0,1]=4 15 B7R1.1 c1cnc([nH]1)C=O BC219962 [0,0,0,1,0,0|2,0,0]=3 16 B7R1.1 c1cnsc1C=O BC677321 [0,0,0,1,0,0|2,0,0]=3 17 B7R1.1 c1conc1C=O BC201897 [0,0,0,1,0,0|2,0,0]=3 18 B7R1.1 c1cscc1C=O BC676777 [0,0,0,1,0,0|1,0,1]=3 19 B7R1.3 C1C=COCC1=O BC245013 [0,0,0,1,0,0|1,0,1]=3 20 B7R1.3 Cc1cccnc1 BC228007 [0,0,0,1,0,0|2,0,0]=3 21 B7R1.3 c1c[nH]c(=O)nc1 BC215238 [0,0,0,1,0,0|2,0,0]=3 22 B7R1.3 c1cc(=O)[nH]nc1 BC225809 [0,0,0,1,0,0|2,0,0]=3 23 B7R1.3 c1cc(cnc1)Cl BC209276 [0,0,0,1,0,0|2,0,1]=4 24 B7R1.3 c1cc(cnc1)I BC225230 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.3 c1cc(cnc1)S BC244412 [0,0,0,1,0,0|1,1,1]=4 26 B7R1.3 c1cc(nnc1)Cl BC675997 [0,0,0,1,0,0|3,0,0]=4 27 B7R1.3 c1cc(nnc1)N BC649957 [0,0,0,1,0,0|3,0,0]=4 28 B7R1.3 c1cc[n+](cc1)[O-] BC227085 [0,0,0,1,0,0|1,0,2]=4 29 B7R1.3 c1ccnc(c1)Cl BC653330 [0,0,0,1,0,0|2,0,0]=3 30 B7R1.3 c1cnc(cn1)Cl BC226186 [0,0,0,1,0,0|3,0,0]=4 31 B7R1.3 c1cnc(nc1)N BC209308 [0,0,0,1,0,0|3,0,0]=4 32 B7R1.3 c1cnc(nc1)O BC209309 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.3 c1cnc(nc1)S BC227980 [0,0,0,1,0,0|2,1,0]=4 34 B7R1.3 c1cnc[nH]c1=O BC209585 [0,0,0,1,0,0|2,0,0]=3 35 B7R1.3 c1cnccc1Br BC204910 [0,0,0,1,0,0|2,0,1]=4 36 B7R1.3 c1cnccc1F BC219199 [0,0,0,1,0,0|2,0,1]=4 37 B7R1.3 c1cnccc1F BC227092 [0,0,0,1,0,0|2,0,1]=4 38 B7R1.3 c1cnccc1I BC206126 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.3 c1cnccc1N BC227053 [0,0,0,1,0,0|2,0,1]=4 40 B7R1.3 c1cncnc1Cl BC667224 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.3 c1cncnc1N BC653395 [0,0,0,1,0,0|3,0,0]=4 42 B7R1.3 c1cncnc1O BC228083 [0,0,0,1,0,0|2,0,1]=4 43 B7R1.4 Cc1c(nc[nH]1)Br BC645293 [0,0,0,1,0,0|3,0,0]=4 44 B7R1.4 Cc1c(scn1)C BC225737 [0,0,0,1,0,0|3,0,0]=4 45 B7R1.4 Cc1cscc1C BC653364 [0,0,0,1,0,0|2,0,0]=3 46 B7R1.4 Cn1c(=O)ccs1 BC200617 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.4 Cn1c(ccn1)N BC222455 [0,0,0,1,0,0|3,0,0]=4 48 B7R1.4 Cn1ccnc1N BC243320 [0,0,0,1,0,0|3,0,0]=4 49 B7R1.4 Cn1ccnc1S BC204140 [0,0,0,1,0,0|2,1,0]=4 50 B7R1.4 c1csc(c1Br)N BC297033 [0,0,0,1,0,0|3,0,0]=4 51 B4R0.2 CCOC=C BC208832 [2,0,0,0,0,0|1,0,1]=4 52 B4R0.2 CSCC=O BC296573 [2,0,0,0,0,0|1,0,1]=4 53 B4R0.2 C\C=C\CN BC220709 [2,0,0,0,0,0|1,0,1]=4 54 B6R0.1 CCOC(=O)C=O BC222485 [1,1,0,0,0,0|1,0,1]=4 55 B6R0.4 C(\C=C\C(=O)O)O BC224091 [1,1,0,0,0,0|1,0,1]=4 56 B6R0.4 C=CCCC(=O)O BC678220 [1,1,0,0,0,0|0,0,2]=4 57 B6R0.4 C=CCOC(=O)Cl BC676725 [1,1,0,0,0,0|1,0,1]=4 58 B6R0.4 CC(=O)OCC=C BC219433 [1,1,0,0,0,0|1,0,1]=4 59 B8R0.4 CCC\C=C\C=C\C=O BC218795 [0,2,0,0,0,0|0,0,0]=2 60 B8R0.28 CN(C)C\C=C\C(=O)O BC225128 [0,2,0,0,0,0|1,0,1]=4 61 B6R1.1 C1CC=CC=C1 BC207599 [1,0,0,1,0,0|0,0,1]=3 62 B6R1.1 c1ccncc1 BC220698 [1,0,0,1,0,0|1,0,0]=3 63 B6R1.2 C1C=CC(=O)O1 BC201413 [1,0,0,1,0,0|1,0,1]=4 64 B6R1.2 C1CC(=O)C=C1 BC652225 [1,0,0,1,0,0|0,0,1]=3 65 B6R1.2 Cc1[nH]ccn1 BC228979 [1,0,0,1,0,0|2,0,0]=4 66 B6R1.2 Cc1c[nH]cn1 BC200416 [1,0,0,1,0,0|2,0,0]=4 67 B6R1.2 Cc1c[nH]nc1 BC677698 [1,0,0,1,0,0|2,0,0]=4 68 B6R1.2 Cc1ccno1 BC226936 [1,0,0,1,0,0|1,0,1]=4 69 B6R1.2 Cn1cccn1 BC202050 [1,0,0,1,0,0|2,0,0]=4 70 B6R1.2 Cn1ccnc1 BC680917 [1,0,0,1,0,0|2,0,0]=4 71 B6R1.2 c1cc(oc1)Br BC675565 [1,0,0,1,0,0|1,0,1]=4 72 B6R1.2 c1cc(sc1)Br BC676814 [1,0,0,1,0,0|1,1,0]=4 73 B6R1.2 c1cc(sc1)Br BC677960 [1,0,0,1,0,0|1,1,0]=4 74 B6R1.2 c1cc(sc1)F BC211749 [1,0,0,1,0,0|1,1,0]=4 75 B6R1.2 c1cocc1Br BC227194 [1,0,0,1,0,0|2,0,0]=4 76 B6R1.2 c1cscc1Br BC210528 [1,0,0,1,0,0|2,0,0]=4 77 B6R1.2 c1cscc1N BC677154 [1,0,0,1,0,0|2,0,0]=4 78 B6R1.2 c1cscc1N BC686803 [1,0,0,1,0,0|2,0,0]=4 79 B8R1.2 C#Cc1ccccn1 BC225212 [0,1,0,1,0,0|1,0,1]=4 80 B8R1.2 C=Cc1cccnc1 BC675972 [0,1,0,1,0,0|1,0,1]=4 81 B8R1.2 CCc1cccnc1 BC223674 [0,1,0,1,0,0|1,0,1]=4 82 B8R1.2 COc1cccnc1 BC653137 [0,1,0,1,0,0|2,0,0]=4 83 B8R1.2 [C-]#[N+]c1ccccc1 BC297263 [0,1,0,1,0,0|1,0,1]=4 84 B8R1.2 c1c(cncn1)C=O BC200327 [0,1,0,1,0,0|1,0,1]=4 85 B8R1.2 c1cc(cnc1)C=O BC221128 [0,1,0,1,0,0|0,0,1]=3 86 B8R1.2 c1cc(cnc1)CBr BC258182 [0,1,0,1,0,0|2,0,0]=4 87 B8R1.2 c1cc(cnc1)CBr BC281217 [0,1,0,1,0,0|2,0,0]=4 88 B8R1.2 c1cc(cnc1)CCl BC204269 [0,1,0,1,0,0|2,0,0]=4 89 B8R1.2 c1cc(cnc1)CN BC205833 [0,1,0,1,0,0|2,0,0]=4 90 B8R1.2 c1cc(cnc1)CO BC209311 [0,1,0,1,0,0|2,0,0]=4 91 B8R1.2 c1cc(nnc1)C=O BC667339 [0,1,0,1,0,0|1,0,0]=3 92 B8R1.2 c1ccc(cc1)CBr BC220250 [0,1,0,1,0,0|1,0,0]=3 93 B8R1.2 c1ccc(cc1)CCl BC210975 [0,1,0,1,0,0|1,0,0]=3 94 B8R1.2 c1ccc(cc1)CO BC222892 [0,1,0,1,0,0|1,0,0]=3 95 B8R1.2 c1ccc(cc1)N=O BC684726 [0,1,0,1,0,0|0,0,1]=3 96 B8R1.2 c1ccc(cc1)[Mg]Br BC653680 [0,1,0,1,0,0|1,0,1]=4 97 B8R1.2 c1ccnc(c1)CCl BC213218 [0,1,0,1,0,0|1,0,0]=3 98 B8R1.2 c1ccnc(c1)CCl BC227992 [0,1,0,1,0,0|1,0,0]=3 99 B8R1.2 c1cnc(cn1)C=O BC681558 [0,1,0,1,0,0|1,0,0]=3 100 B8R1.2 c1cnc(nc1)C=O BC228094 [0,1,0,1,0,0|1,0,0]=3 101 B8R1.2 c1cnc(nc1)CCl BC212037 [0,1,0,1,0,0|2,0,0]=4 102 B8R1.2 c1cnc(nc1)CN BC671460 [0,1,0,1,0,0|2,0,0]=4 103 B8R1.2 c1cncnc1C=O BC652156 [0,1,0,1,0,0|1,0,0]=3 104 B8R1.2 c1cncnc1CO BC228082 [0,1,0,1,0,0|2,0,0]=4 105 B8R1.5 CC1C=CN=NC1=O BC653669 [0,1,0,1,0,0|1,0,1]=4 106 B8R1.5 Cc1c(cccn1)Br BC225550 [0,1,0,1,0,0|1,0,0]=3 107 B8R1.5 Cc1c(cccn1)Cl BC656264 [0,1,0,1,0,0|1,0,0]=3 108 B8R1.5 Cc1c(cccn1)F BC677139 [0,1,0,1,0,0|1,0,0]=3 109 B8R1.5 Cc1c(cccn1)N BC219118 [0,1,0,1,0,0|1,0,0]=3 110 B8R1.5 Cc1c(cccn1)O BC225229 [0,1,0,1,0,0|0,0,1]=3 111 B8R1.5 Cc1c(cncn1)N BC202066 [0,1,0,1,0,0|2,0,0]=4 112 B8R1.5 Cc1c(nccn1)Cl BC686305 [0,1,0,1,0,0|2,0,0]=4 113 B8R1.5 Cc1cccc[n+]1[O-] BC213117 [0,1,0,1,0,0|0,0,1]=3 114 B8R1.5 Cc1cccnc1Br BC227989 [0,1,0,1,0,0|1,0,0]=3 115 B8R1.5 Cc1cccnc1N BC225899 [0,1,0,1,0,0|1,0,0]=3 116 B8R1.5 Cc1cccnc1O BC225228 [0,1,0,1,0,0|0,0,1]=3 117 B8R1.5 Cc1ccncc1C BC667797 [0,1,0,1,0,0|1,0,0]=3 118 B8R1.5 Cc1ccncc1F BC219203 [0,1,0,1,0,0|1,0,0]=3 119 B8R1.5 Cc1ccncc1N BC207827 [0,1,0,1,0,0|1,0,0]=3 120 B8R1.5 Cc1ccncc1O BC656328 [0,1,0,1,0,0|0,0,1]=3 121 B8R1.5 Cc1cnccc1Br BC201979 [0,1,0,1,0,0|1,0,0]=3 122 B8R1.5 Cc1cnccc1Br BC219154 [0,1,0,1,0,0|1,0,0]=3 123 B8R1.5 Cc1cnccc1Cl BC219170 [0,1,0,1,0,0|1,0,0]=3 124 B8R1.5 Cn1cccnc1=O BC224691 [0,1,0,1,0,0|1,0,0]=3 125 B8R1.5 c1c(c(=O)nc[nH]1)Br BC666251 [0,1,0,1,0,0|2,0,0]=4 126 B8R1.5 c1c(c(=O)nc[nH]1)O BC655988 [0,1,0,1,0,0|2,0,0]=4 127 B8R1.5 c1cc(c(nc1)Br)F BC227112 [0,1,0,1,0,0|2,0,0]=4 128 B8R1.5 c1cc(c(nc1)Br)N BC207481 [0,1,0,1,0,0|2,0,0]=4 129 B8R1.5 c1cc(c(nc1)Br)O BC206638 [0,1,0,1,0,0|1,0,1]=4 130 B8R1.5 c1cc(c(nc1)Cl)Br BC210233 [0,1,0,1,0,0|2,0,0]=4 131 B8R1.5 c1cc(c(nc1)Cl)Cl BC210321 [0,1,0,1,0,0|2,0,0]=4 132 B8R1.5 c1cc(c(nc1)Cl)I BC207966 [0,1,0,1,0,0|2,0,0]=4 133 B8R1.5 c1cc(c(nc1)Cl)N BC226077 [0,1,0,1,0,0|2,0,0]=4 134 B8R1.5 c1cc(c(nc1)Cl)O BC206637 [0,1,0,1,0,0|1,0,1]=4 135 B8R1.5 c1cc(c(nc1)F)Br BC219145 [0,1,0,1,0,0|2,0,0]=4 136 B8R1.5 c1cc(c(nc1)F)Cl BC214599 [0,1,0,1,0,0|2,0,0]=4 137 B8R1.5 c1cc(c(nc1)F)F BC211682 [0,1,0,1,0,0|2,0,0]=4 138 B8R1.5 c1cc(c(nc1)F)I BC213726 [0,1,0,1,0,0|2,0,0]=4 139 B8R1.5 c1cc(c(nc1)F)N BC219109 [0,1,0,1,0,0|2,0,0]=4 140 B8R1.5 c1cc(c(nc1)F)O BC677131 [0,1,0,1,0,0|1,0,1]=4 141 B8R1.5 c1cc(c(nc1)I)O BC206480 [0,1,0,1,0,0|1,0,1]=4 142 B8R1.5 c1cc(c(nc1)N)Br BC202222 [0,1,0,1,0,0|2,0,0]=4 143 B8R1.5 c1cc(c(nc1)N)Cl BC205827 [0,1,0,1,0,0|2,0,0]=4 144 B8R1.5 c1cc(c(nc1)N)F BC227098 [0,1,0,1,0,0|2,0,0]=4 145 B8R1.5 c1cc(c(nc1)N)I BC219764 [0,1,0,1,0,0|2,0,0]=4 146 B8R1.5 c1cc(c(nc1)N)N BC227150 [0,1,0,1,0,0|2,0,0]=4 147 B8R1.5 c1cc(c(nc1)N)O BC227987 [0,1,0,1,0,0|1,0,1]=4 148 B8R1.5 c1cc(c(nc1)O)F BC202279 [0,1,0,1,0,0|1,0,1]=4 149 B8R1.5 c1cc(c(nc1)O)N BC202198 [0,1,0,1,0,0|1,0,1]=4 150 B8R1.5 c1cc(c(nc1)O)O BC209278 [0,1,0,1,0,0|1,0,1]=4 151 B8R1.5 c1cc[n+](c(c1)Cl)[O-] BC213191 [0,1,0,1,0,0|1,0,1]=4 152 B8R1.5 c1cc[n+](c(c1)[S-])[O-] BC206730 [0,1,0,1,0,0|1,0,1]=4 153 B8R1.5 c1cc[n+](c(c1)[S-])[O-] BC207991 [0,1,0,1,0,0|1,0,1]=4 154 B8R1.5 c1ccc(c(c1)N)Br BC677892 [0,1,0,1,0,0|1,0,1]=4 155 B8R1.5 c1ccc(c(c1)N)I BC213646 [0,1,0,1,0,0|1,0,1]=4 156 B8R1.5 c1ccc(c(c1)N)S BC250051 [0,1,0,1,0,0|0,1,1]=4 157 B8R1.5 c1ccc(c(c1)O)I BC213644 [0,1,0,1,0,0|0,0,2]=4 158 B8R1.5 c1ccc(c(c1)O)O BC205707 [0,1,0,1,0,0|0,0,2]=4 159 B8R1.5 c1cncc(c1Br)Cl BC219129 [0,1,0,1,0,0|2,0,0]=4 160 B8R1.5 c1cncc(c1Br)F BC219146 [0,1,0,1,0,0|2,0,0]=4 161 B8R1.5 c1cncc(c1Br)N BC228928 [0,1,0,1,0,0|2,0,0]=4 162 B8R1.5 c1cncc(c1Br)O BC228930 [0,1,0,1,0,0|1,0,1]=4 163 B8R1.5 c1cncc(c1Cl)Br BC219128 [0,1,0,1,0,0|2,0,0]=4 164 B8R1.5 c1cncc(c1Cl)F BC219166 [0,1,0,1,0,0|2,0,0]=4 165 B8R1.5 c1cncc(c1Cl)N BC205922 [0,1,0,1,0,0|2,0,0]=4 166 B8R1.5 c1cncc(c1F)Br BC227113 [0,1,0,1,0,0|2,0,0]=4 167 B8R1.5 c1cncc(c1F)Cl BC226640 [0,1,0,1,0,0|2,0,0]=4 168 B8R1.5 c1cncc(c1F)F BC227745 [0,1,0,1,0,0|2,0,0]=4 169 B8R1.5 c1cncc(c1I)O BC212690 [0,1,0,1,0,0|1,0,1]=4 170 B8R1.5 c1cncc(c1N)Br BC652374 [0,1,0,1,0,0|2,0,0]=4 171 B8R1.5 c1cncc(c1N)Cl BC202197 [0,1,0,1,0,0|2,0,0]=4 172 B8R1.5 c1cncc(c1N)F BC219110 [0,1,0,1,0,0|2,0,0]=4 173 B8R1.5 c1cncc(c1N)N BC222447 [0,1,0,1,0,0|2,0,0]=4 174 B8R1.5 c1cncc(c1N)O BC228924 [0,1,0,1,0,0|1,0,1]=4 175 B8R1.5 c1cncc(c1O)N BC201447 [0,1,0,1,0,0|1,0,1]=4 176 B8R1.5 c1cncc(c1O)O BC678752 [0,1,0,1,0,0|1,0,1]=4 177 B8R1.11 Cc1c(scn1)C=O BC218797 [0,1,0,1,0,0|1,0,0]=3 178 B8R1.11 Cn1cccc1C=O BC675646 [0,1,0,1,0,0|0,0,0]=2 179 B8R1.11 c1csc(c1Br)C=O BC219795 [0,1,0,1,0,0|1,0,0]=3 180 B8R1.11 c1csc(c1Cl)C=O BC679930 [0,1,0,1,0,0|1,0,0]=3 181 B8R1.49 C1\C=C/CC\C=C/C1 BC213286 [0,1,0,1,0,0|1,0,1]=4 182 B8R1.49 C1\C=C/CC\C=C/C1 BC213308 [0,1,0,1,0,0|1,0,1]=4 183 B8R1.49 C1\C=C/CC\C=C/C1 BC213309 [0,1,0,1,0,0|1,0,1]=4 184 B8R1.49 C1\C=C/CC\C=C/C1 BC213317 [0,1,0,1,0,0|1,0,1]=4 185 B8R1.1 Cc1cc(sc1)C=O BC645199 [0,1,0,1,0,0|1,0,0]=3 186 B8R1.1 Cc1csc(n1)C=O BC203023 [0,1,0,1,0,0|1,0,0]=3 187 B8R1.1 Cc1ncc(s1)C=O BC650857 [0,1,0,1,0,0|1,0,0]=3 188 B8R1.1 c1c(coc1C=O)Br BC645867 [0,1,0,1,0,0|1,0,0]=3 189 B8R1.1 c1c(csc1C=O)Br BC678555 [0,1,0,1,0,0|1,0,0]=3 190 B8R1.1 c1c(sc(n1)N)C=O BC220680 [0,1,0,1,0,0|2,0,0]=4 191 B8R1.3 C1=CC(=O)C=CC1=O BC250046 [0,1,0,1,0,0|0,0,1]=3 192 B8R1.3 Cc1cc[n+](cc1)[O-] BC222437 [0,1,0,1,0,0|2,0,0]=4 193 B8R1.3 Cc1ccc(cc1)I BC208320 [0,1,0,1,0,0|1,0,0]=3 194 B8R1.3 Cc1ccc(cn1)Br BC200848 [0,1,0,1,0,0|1,0,0]=3 195 B8R1.3 Cc1ccc(cn1)F BC219187 [0,1,0,1,0,0|1,0,0]=3 196 B8R1.3 Cc1ccc(cn1)I BC228957 [0,1,0,1,0,0|1,0,0]=3 197 B8R1.3 Cc1ccc(cn1)N BC202216 [0,1,0,1,0,0|1,0,0]=3 198 B8R1.3 Cc1ccc(cn1)O BC213724 [0,1,0,1,0,0|1,0,0]=3 199 B8R1.3 Cc1ccc(nc1)C BC220412 [0,1,0,1,0,0|1,0,0]=3 200 B8R1.3 Cc1ccc(nc1)Cl BC201252 [0,1,0,1,0,0|2,0,0]=4 201 B8R1.3 Cc1ccc(nc1)F BC219184 [0,1,0,1,0,0|2,0,0]=4 202 B8R1.3 Cc1ccc(nc1)N BC203509 [0,1,0,1,0,0|2,0,0]=4 203 B8R1.3 Cc1cnc(cn1)C BC651592 [0,1,0,1,0,0|2,0,0]=4 204 B8R1.3 Cc1ncc(cn1)N BC228078 [0,1,0,1,0,0|2,0,0]=4 205 B8R1.3 c1cc(ccc1Br)I BC206965 [0,1,0,1,0,0|1,0,1]=4 206 B8R1.3 c1cc(ccc1Cl)Br BC207086 [0,1,0,1,0,0|1,0,1]=4 207 B8R1.3 c1cc(ccc1Cl)I BC675841 [0,1,0,1,0,0|1,0,1]=4 208 B8R1.3 c1cc(ccc1N)Br BC204243 [0,1,0,1,0,0|1,0,1]=4 209 B8R1.3 c1cc(ccc1N)F BC226190 [0,1,0,1,0,0|1,0,1]=4 210 B8R1.3 c1cc(ccc1N)O BC227837 [0,1,0,1,0,0|0,0,2]=4 211 B8R1.3 c1cc(ccc1N)S BC676770 [0,1,0,1,0,0|0,1,1]=4 212 B8R1.3 c1cc(ccc1O)Br BC228016 [0,1,0,1,0,0|0,0,2]=4 213 B8R1.3 c1cc(ccc1O)I BC226747 [0,1,0,1,0,0|0,0,2]=4 214 B8R1.3 c1cc(ccc1O)O BC207641 [0,1,0,1,0,0|0,0,2]=4 215 B8R1.3 c1cc(n[nH]c1=O)Cl BC225810 [0,1,0,1,0,0|2,0,0]=4 216 B8R1.3 c1cc(ncc1Br)F BC211679 [0,1,0,1,0,0|2,0,0]=4 217 B8R1.3 c1cc(ncc1Br)N BC202223 [0,1,0,1,0,0|2,0,0]=4 218 B8R1.3 c1cc(ncc1Br)O BC219149 [0,1,0,1,0,0|1,0,1]=4 219 B8R1.3 c1cc(ncc1Cl)Br BC202228 [0,1,0,1,0,0|2,0,0]=4 220 B8R1.3 c1cc(ncc1Cl)Cl BC210322 [0,1,0,1,0,0|2,0,0]=4 221 B8R1.3 c1cc(ncc1Cl)F BC201381 [0,1,0,1,0,0|2,0,0]=4 222 B8R1.3 c1cc(ncc1Cl)I BC226646 [0,1,0,1,0,0|2,0,0]=4 223 B8R1.3 c1cc(ncc1F)Cl BC208051 [0,1,0,1,0,0|2,0,0]=4 224 B8R1.3 c1cc(ncc1F)N BC204792 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.3 c1cc(ncc1F)O BC219174 [0,1,0,1,0,0|1,0,1]=4 226 B8R1.3 c1cc(ncc1I)Br BC219151 [0,1,0,1,0,0|2,0,0]=4 227 B8R1.3 c1cc(ncc1I)O BC228859 [0,1,0,1,0,0|1,0,1]=4 228 B8R1.3 c1cc(ncc1N)Br BC213741 [0,1,0,1,0,0|2,0,0]=4 229 B8R1.3 c1cc(ncc1N)Cl BC203573 [0,1,0,1,0,0|2,0,0]=4 230 B8R1.3 c1cc(ncc1N)O BC653280 [0,1,0,1,0,0|1,0,1]=4 231 B8R1.3 c1cc(ncc1O)Br BC208384 [0,1,0,1,0,0|2,0,0]=4 232 B8R1.3 c1cc(ncc1O)Cl BC208468 [0,1,0,1,0,0|2,0,0]=4 233 B8R1.3 c1cc(ncc1O)F BC221861 [0,1,0,1,0,0|2,0,0]=4 234 B8R1.3 c1cc(ncc1O)I BC200349 [0,1,0,1,0,0|2,0,0]=4 235 B8R1.3 c1cc(ncc1O)N BC226650 [0,1,0,1,0,0|2,0,0]=4 236 B8R1.4 C1C=NC(=CC1=O)Cl BC208831 [0,1,0,1,0,0|1,0,0]=3 237 B8R1.4 Cc1cc(ccn1)Br BC208673 [0,1,0,1,0,0|1,0,0]=3 238 B8R1.4 Cc1cc(ccn1)Cl BC219169 [0,1,0,1,0,0|1,0,0]=3 239 B8R1.4 Cc1cc(ccn1)O BC208676 [0,1,0,1,0,0|1,0,0]=3 240 B8R1.4 Cc1cc(cnc1)Br BC202211 [0,1,0,1,0,0|2,0,0]=4 241 B8R1.4 Cc1cc(cnc1)N BC208421 [0,1,0,1,0,0|2,0,0]=4 242 B8R1.4 Cc1cc(cnc1)O BC201216 [0,1,0,1,0,0|1,0,1]=4 243 B8R1.4 Cc1cc(ncn1)Cl BC204226 [0,1,0,1,0,0|2,0,0]=4 244 B8R1.4 Cc1cccc(c1)F BC675323 [0,1,0,1,0,0|1,0,0]=3 245 B8R1.4 Cc1cccc(c1)O BC207588 [0,1,0,1,0,0|0,0,1]=3 246 B8R1.4 Cc1cccc(n1)Cl BC227997 [0,1,0,1,0,0|1,0,0]=3 247 B8R1.4 Cc1cccc(n1)N BC202221 [0,1,0,1,0,0|1,0,0]=3 248 B8R1.4 Cc1ccnc(c1)Br BC207069 [0,1,0,1,0,0|2,0,0]=4 249 B8R1.4 Cc1ccnc(c1)F BC219183 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.4 Cc1ccnc(n1)Br BC677913 [0,1,0,1,0,0|2,0,0]=4 251 B8R1.4 Cc1ccnc(n1)Cl BC228088 [0,1,0,1,0,0|2,0,0]=4 252 B8R1.4 Cc1cncc(n1)N BC675568 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.4 c1c(cn[nH]c1=O)I BC244710 [0,1,0,1,0,0|2,0,0]=4 254 B8R1.4 c1c[nH]c(=O)cc1Br BC683009 [0,1,0,1,0,0|1,0,0]=3 255 B8R1.4 c1cc(cc(c1)Br)Br BC675855 [0,1,0,1,0,0|1,0,1]=4 256 B8R1.4 c1cc(cc(c1)Br)S BC667223 [0,1,0,1,0,0|0,1,1]=4 257 B8R1.4 c1cc(cc(c1)Cl)Cl BC205103 [0,1,0,1,0,0|1,0,1]=4 258 B8R1.4 c1cc(cc(c1)I)Br BC675850 [0,1,0,1,0,0|1,0,1]=4 259 B8R1.4 c1cc(cc(c1)I)N BC213647 [0,1,0,1,0,0|1,0,1]=4 260 B8R1.4 c1cc(cc(c1)O)O BC207605 [0,1,0,1,0,0|0,0,2]=4 261 B8R1.4 c1cc(nc(c1)Br)F BC219144 [0,1,0,1,0,0|2,0,0]=4 262 B8R1.4 c1cc(nc(c1)Br)N BC207509 [0,1,0,1,0,0|2,0,0]=4 263 B8R1.4 c1cc(nc(c1)Cl)N BC201207 [0,1,0,1,0,0|2,0,0]=4 264 B8R1.4 c1cc(nc(c1)F)N BC222333 [0,1,0,1,0,0|2,0,0]=4 265 B8R1.4 c1cc(nc(c1)N)N BC200771 [0,1,0,1,0,0|2,0,0]=4 266 B8R1.4 c1cnc(cc1Br)Br BC204489 [0,1,0,1,0,0|2,0,0]=4 267 B8R1.4 c1cnc(cc1Br)Cl BC204493 [0,1,0,1,0,0|2,0,0]=4 268 B8R1.4 c1cnc(cc1Br)N BC225238 [0,1,0,1,0,0|2,0,0]=4 269 B8R1.4 c1cnc(cc1Br)O BC228856 [0,1,0,1,0,0|1,0,1]=4 270 B8R1.4 c1cnc(cc1Cl)Br BC204494 [0,1,0,1,0,0|2,0,0]=4 271 B8R1.4 c1cnc(cc1Cl)Cl BC204488 [0,1,0,1,0,0|2,0,0]=4 272 B8R1.4 c1cnc(cc1Cl)N BC225236 [0,1,0,1,0,0|2,0,0]=4 273 B8R1.4 c1cnc(cc1F)Br BC226649 [0,1,0,1,0,0|2,0,0]=4 274 B8R1.4 c1cnc(cc1F)Cl BC226637 [0,1,0,1,0,0|2,0,0]=4 275 B8R1.4 c1cnc(cc1F)F BC212172 [0,1,0,1,0,0|2,0,0]=4 276 B8R1.4 c1cnc(cc1F)N BC670027 [0,1,0,1,0,0|2,0,0]=4 277 B8R1.4 c1cnc(cc1I)F BC225099 [0,1,0,1,0,0|2,0,0]=4 278 B8R1.4 c1cnc(cc1N)Br BC205180 [0,1,0,1,0,0|2,0,0]=4 279 B8R1.4 c1cnc(cc1N)Cl BC227047 [0,1,0,1,0,0|2,0,0]=4 280 B8R1.4 c1cnc(cc1N)F BC227044 [0,1,0,1,0,0|2,0,0]=4 281 B8R1.4 c1cnc(cc1N)N BC227163 [0,1,0,1,0,0|2,0,0]=4 282 B8R1.4 c1cnc(cc1O)Br BC208749 [0,1,0,1,0,0|2,0,0]=4 283 B8R1.4 c1cnc(cc1O)F BC656317 [0,1,0,1,0,0|2,0,0]=4 284 B8R1.4 c1cnc(cc1O)N BC222335 [0,1,0,1,0,0|2,0,0]=4 285 B8R1.4 c1cnc(cc1O)O BC208052 [0,1,0,1,0,0|1,0,1]=4 286 B8R1.7 C1C=CCC1C(=O)O BC226569 [0,1,0,1,0,0|0,0,2]=4 287 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [0,1,0,1,0,0|2,0,0]=4 288 B8R1.7 c1c(nco1)C(=O)O BC677324 [0,1,0,1,0,0|2,0,0]=4 289 B8R1.7 c1c(scn1)C(=O)O BC677323 [0,1,0,1,0,0|2,0,0]=4 290 B8R1.7 c1c[nH]nc1C(=O)O BC203654 [0,1,0,1,0,0|2,0,0]=4 291 B8R1.7 c1cc([nH]c1)C(=O)O BC220697 [0,1,0,1,0,0|1,0,0]=3 292 B8R1.7 c1cc(oc1)C(=O)Cl BC226346 [0,1,0,1,0,0|1,0,0]=3 293 B8R1.7 c1cnsc1C(=O)O BC202175 [0,1,0,1,0,0|2,0,0]=4 294 B8R1.7 c1cocc1C(=O)Cl BC650563 [0,1,0,1,0,0|1,0,1]=4 295 B8R1.7 c1conc1C(=O)O BC207645 [0,1,0,1,0,0|2,0,0]=4 296 B8R1.7 c1csc(n1)C(=O)O BC651955 [0,1,0,1,0,0|2,0,0]=4 297 B8R1.7 c1cscc1C(=O)Cl BC681079 [0,1,0,1,0,0|1,0,1]=4 298 B8R1.7 c1cscc1C(=O)O BC213229 [0,1,0,1,0,0|1,0,1]=4 299 B8R1.18 Cn1c(=O)cc(s1)Cl BC221924 [0,1,0,1,0,0|2,0,0]=4