0 B9R1.2 CCc1nccc(n1)Cl WXC04098 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.2 CCc1nccc(n1)O WXC04103 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.2 CNc1ccnc(n1)Cl WX636026 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.2 CNc1nccc(n1)Cl WX636033 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.2 COc1cccc(n1)I WXC00054 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.2 COc1ccnc(n1)N WXC01071 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.2 COc1nccc(n1)N WX609476 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.2 CSc1cc(cnc1)Br WX637159 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.2 CSc1nccc(n1)I WX638004 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.2 CSc1nccc(n1)N WX609363 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.2 Cc1cc(ccn1)CN WX609039 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.2 Cc1cc(cnc1)C#N WX683559 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.2 Cc1cc(cnc1)CN WX603037 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.2 Cc1cc(cnc1)CN WX603115 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.2 Cc1cc(cnc1)CO WX640286 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.2 Cc1cccc(n1)C=O WX624173 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.2 Cc1cccc(n1)CCl WX630176 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.2 Cc1cccc(n1)CN WX609028 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.2 Cc1cccc(n1)NN WXC01942 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.2 Cc1ccnc(c1)CN WX603045 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.2 Cc1ccnc(n1)CN WX603032 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.2 Cc1ccnc(n1)CO WX640137 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.2 Cc1cncc(n1)C=O WX624023 [0,0,0,0,0,0|1,0,1]=2 23 B9R1.2 c1c(cncc1Br)C#N WX637012 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.2 c1c(cncc1Br)CO WX640147 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.2 c1c(cncc1Cl)C=O WX624175 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.2 c1c(cncc1Cl)CO WXC01376 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.2 c1c(nc(cn1)Cl)CO WX636325 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.2 c1cc(nc(c1)Br)C#N WX637370 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.2 c1cc(nc(c1)Br)CBr WX630170 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.2 c1cc(nc(c1)Cl)C#N WX636061 [0,0,0,0,0,0|3,0,1]=4 31 B8R1.2 C=Cc1cccnc1 WX685205 [1,0,0,0,0,0|1,0,2]=4 32 B8R1.2 CNc1cccnc1 WX609454 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 CNc1ccncn1 WX606069 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.2 CNc1cnccn1 WX606056 [1,0,0,0,0,0|1,0,0]=2 35 B8R1.2 c1cc(cnc1)CO WX640285 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 c1ccnc(c1)CO WX640282 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 c1ccnc(c1)NN WXC04165 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.2 c1cnc(cn1)C=O WX624187 [1,0,0,0,0,0|1,0,1]=3 39 B8R1.2 c1cnc(cn1)CN WX603036 [1,0,0,0,0,0|1,0,0]=2 40 B8R1.2 c1cnc(cn1)CO WX640335 [1,0,0,0,0,0|1,0,0]=2 41 B8R1.2 c1cnc(nc1)CCl WX633047 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 c1cnc(nc1)CN WX603024 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.2 c1cnc(nc1)CN WX609048 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 c1cnc(nc1)CO WX640112 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 c1cnc(nc1)CO WXC04758 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 c1cncnc1CO WX640254 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.4 Cc1cc(cnc1)N WX609450 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.4 Cc1cc(cnc1)O WX649090 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.4 Cc1cccc(c1)O WX645080 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.4 Cc1cccc(n1)Br WX637312 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.4 Cc1cccc(n1)O WX649098 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.4 Cc1ccnc(n1)Cl WX636093 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.4 Cc1ccnc(n1)O WX619017 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.4 Cc1cncc(n1)Cl WX636239 [1,0,0,0,0,0|1,0,0]=2 55 B8R1.4 Cc1cncc(n1)N WX609148 [1,0,0,0,0,0|1,0,0]=2 56 B8R1.4 Cc1nccc(n1)Cl WX636234 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.4 Cc1nccc(n1)N WX606010 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.4 Cc1nccc(n1)O WX645021 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.4 c1c(cncc1F)O WX649045 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.4 c1c(nc(cn1)Br)Cl WX637068 [1,0,0,0,0,0|2,0,0]=3 61 B8R1.4 c1cc(nc(c1)Br)O WXC02241 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.2 Cc1c(cncc1Br)CO WXC00312 [0,1,0,0,0,0|3,0,0]=4 63 B10R1.8 CNc1cc(cc(n1)Cl)Cl WX606058 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.8 Cc1cc(nc(n1)SC)Cl WX636007 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.10 CCOc1cccc(n1)Br WX633197 [0,1,0,0,0,0|2,0,0]=3 66 B10R1.10 CCOc1cncc(n1)Cl WX636215 [0,1,0,0,0,0|1,0,0]=2 67 B10R1.10 CNCc1cccc(c1)O WX600071 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.10 CSCc1cccc(c1)Br WX633087 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.10 c1cc(nc(c1)Br)CC#N WX637443 [0,1,0,0,0,0|2,0,1]=4 70 B10R1.30 CCc1cc(ccc1Br)O WX633044 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.30 CCc1cc(ccc1O)F WX645008 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.30 CNc1c(ccc(n1)Cl)N WXC00865 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.30 COc1c(ccc(n1)Br)N WX609220 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.30 COc1cc(cnc1Cl)Br WX637391 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.30 Cc1ccc(c(c1)OC)Cl WX632007 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.30 Cc1ccc(c(n1)C=O)O WXC01810 [0,1,0,0,0,0|2,0,1]=4 77 B10R1.30 Cc1ccc(c(n1)CO)O WX640367 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.113 B(c1cc(cnc1)C)(O)O WX654007 [0,1,0,0,0,0|3,0,0]=4 79 B10R1.113 CC(=O)c1cc(cnc1)Br WX637241 [0,1,0,0,0,0|2,0,1]=4 80 B10R1.113 CC(=O)c1cccc(n1)Br WX624141 [0,1,0,0,0,0|2,0,1]=4 81 B10R1.113 CC(C)c1nccc(n1)Cl WXC04099 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.113 CC(C)c1nccc(n1)O WXC04102 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.113 Cc1cc(cnc1)C(=O)N WX619274 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.113 Cc1cc(cnc1)C(=O)O WX614246 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.113 Cc1cccc(c1)[C@@H](C)O WXC01314 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.113 Cc1cccc(c1)[C@H](C)O WXC01313 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.113 Cc1cccc(n1)C(=N)N WXC03164 [0,1,0,0,0,0|2,0,1]=4 88 B10R1.113 Cc1cccc(n1)C(=O)O WX614192 [0,1,0,0,0,0|2,0,1]=4 89 B10R1.113 c1c(nc(cn1)Cl)C(=O)O WX614271 [0,1,0,0,0,0|2,0,1]=4 90 B10R1.172 COc1cc(cnc1)C=O WX624057 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.172 COc1cccc(n1)C#C WX686201 [0,1,0,0,0,0|1,0,2]=4 92 B10R1.176 Cc1cc(cnc1C)C#N WX683521 [0,1,0,0,0,0|2,0,1]=4 93 B10R1.176 Cc1ccc(cc1C)CN WX603058 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.176 Cc1ccc(cc1C)CN WX603165 [0,1,0,0,0,0|3,0,0]=4 95 B8R1.1 C(c1nc([nH]n1)N)O WXC01702 [0,0,0,0,1,0|3,0,0]=4 96 B8R1.1 CCc1cc(no1)N WX609361 [0,0,0,0,1,0|3,0,0]=4 97 B8R1.1 Cc1[nH]c(cn1)C=O WX624179 [0,0,0,0,1,0|1,0,2]=4 98 B8R1.1 Cc1[nH]c(cn1)CO WX640040 [0,0,0,0,1,0|1,0,1]=3 99 B8R1.1 Cc1cc([nH]n1)CO WX640223 [0,0,0,0,1,0|3,0,0]=4 100 B8R1.1 Cc1cc([nH]n1)CO WX640340 [0,0,0,0,1,0|3,0,0]=4 101 B8R1.1 Cc1cc(no1)CCl WX630329 [0,0,0,0,1,0|3,0,0]=4 102 B8R1.1 Cc1cc(no1)CN WX603005 [0,0,0,0,1,0|3,0,0]=4 103 B8R1.1 Cc1cc(no1)CO WX640214 [0,0,0,0,1,0|3,0,0]=4 104 B8R1.1 Cc1cc(sc1)CN WX609034 [0,0,0,0,1,0|3,0,0]=4 105 B8R1.1 Cc1cc(sc1)CO WX640133 [0,0,0,0,1,0|3,0,0]=4 106 B8R1.1 Cc1ccc([nH]1)C=O WX624113 [0,0,0,0,1,0|1,0,2]=4 107 B8R1.1 Cc1ccc(s1)C=O WX624186 [0,0,0,0,1,0|2,0,1]=4 108 B8R1.1 Cc1ccc(s1)CN WX609036 [0,0,0,0,1,0|2,0,0]=3 109 B8R1.1 Cc1ccc(s1)CN WX609532 [0,0,0,0,1,0|2,0,0]=3 110 B8R1.1 Cc1ccc(s1)CO WX640089 [0,0,0,0,1,0|2,0,0]=3 111 B8R1.1 Cc1coc(n1)CN WX600286 [0,0,0,0,1,0|2,0,0]=3 112 B8R1.1 Cc1csc(n1)C=O WX624189 [0,0,0,0,1,0|2,0,1]=4 113 B8R1.1 Cc1nc(cs1)CCl WX630019 [0,0,0,0,1,0|2,0,0]=3 114 B8R1.1 Cc1nc(cs1)CCl WX630294 [0,0,0,0,1,0|2,0,0]=3 115 B8R1.1 Cc1nc(no1)CN WX607090 [0,0,0,0,1,0|2,0,0]=3 116 B8R1.1 Cc1nc(sn1)NC WX607032 [0,0,0,0,1,0|2,0,0]=3 117 B8R1.1 Cc1ncc(s1)CCl WX630056 [0,0,0,0,1,0|2,0,0]=3 118 B8R1.1 Cc1ncc(s1)CN WX609044 [0,0,0,0,1,0|2,0,0]=3 119 B8R1.1 Cc1ncc(s1)CO WX640102 [0,0,0,0,1,0|2,0,0]=3 120 B8R1.1 Cc1nnc(o1)CCl WX630238 [0,0,0,0,1,0|3,0,0]=4 121 B8R1.1 Cc1nnc(s1)NC WX607037 [0,0,0,0,1,0|3,0,0]=4 122 B8R1.1 Cn1cc(cn1)CCl WX630248 [0,0,0,0,1,0|3,0,0]=4 123 B8R1.1 Cn1cc(cn1)CO WX640201 [0,0,0,0,1,0|3,0,0]=4 124 B8R1.1 Cn1cc(nc1)CO WX640041 [0,0,0,0,1,0|3,0,0]=4 125 B8R1.1 Cn1ccc(n1)C=O WX624063 [0,0,0,0,1,0|2,0,1]=4 126 B8R1.1 Cn1ccc(n1)CO WX640316 [0,0,0,0,1,0|2,0,0]=3 127 B8R1.1 c1c(nc(s1)CBr)Br WX630096 [0,0,0,0,1,0|3,0,0]=4 128 B8R1.1 c1c(nc(s1)CO)Br WX637096 [0,0,0,0,1,0|3,0,0]=4 129 B8R1.1 c1c(sc(n1)Cl)CN WX600148 [0,0,0,0,1,0|3,0,0]=4 130 B8R1.11 CCn1cnnc1S WX690230 [0,0,0,0,1,0|3,0,0]=4 131 B8R1.11 Cc1c(cno1)CN WX603019 [0,0,0,0,1,0|2,0,0]=3 132 B8R1.11 Cc1c(cno1)CO WX640099 [0,0,0,0,1,0|2,0,0]=3 133 B8R1.11 Cc1c(con1)CN WX603010 [0,0,0,0,1,0|3,0,0]=4 134 B8R1.11 Cc1c(nns1)CO WX641002 [0,0,0,0,1,0|3,0,0]=4 135 B8R1.11 Cc1c(snn1)CO WX641001 [0,0,0,0,1,0|3,0,0]=4 136 B8R1.11 Cc1ccsc1CN WX609035 [0,0,0,0,1,0|3,0,0]=4 137 B8R1.11 Cc1ccsc1CO WX640140 [0,0,0,0,1,0|3,0,0]=4 138 B8R1.11 Cn1cccc1CN WX607145 [0,0,0,0,1,0|3,0,0]=4 139 B8R1.11 Cn1cncc1C=O WX624180 [0,0,0,0,1,0|2,0,1]=4 140 B8R1.11 Cn1cncc1CN WX603044 [0,0,0,0,1,0|2,0,0]=3 141 B8R1.11 Cn1cncc1CO WX640128 [0,0,0,0,1,0|2,0,0]=3 142 B7R1.3 c1cc(cnc1)N WX609448 [2,0,0,0,0,0|2,0,0]=4 143 B7R1.3 c1cc(cnc1)O WX649089 [2,0,0,0,0,0|2,0,0]=4 144 B7R1.3 c1ccnc(c1)O WX649094 [2,0,0,0,0,0|2,0,0]=4 145 B7R1.3 c1cnc(cn1)Cl WX636237 [2,0,0,0,0,0|1,0,0]=3 146 B7R1.3 c1cnc(cn1)N WX609446 [2,0,0,0,0,0|1,0,0]=3 147 B9R1.1 CCc1ccc(nc1)Cl WX636306 [1,1,0,0,0,0|1,0,0]=3 148 B9R1.1 COc1ccc(nc1)Cl WX636208 [1,1,0,0,0,0|2,0,0]=4 149 B9R1.1 Cc1ccc(cn1)CN WX603042 [1,1,0,0,0,0|2,0,0]=4 150 B9R1.1 Cc1ccc(nc1)CN WX609025 [1,1,0,0,0,0|2,0,0]=4 151 B9R1.1 Cc1ccc(nc1)CO WX640119 [1,1,0,0,0,0|2,0,0]=4 152 B9R1.1 c1c(ncc(n1)Br)C#N WX637262 [1,1,0,0,0,0|1,0,1]=4 153 B9R1.1 c1c(ncc(n1)Cl)C=O WX624222 [1,1,0,0,0,0|1,0,1]=4 154 B9R1.1 c1c(ncc(n1)N)C#N WX609404 [1,1,0,0,0,0|1,0,1]=4 155 B9R1.1 c1cc(ncc1Br)CN WX603129 [1,1,0,0,0,0|2,0,0]=4 156 B9R1.1 c1cc(ncc1CO)Cl WX640287 [1,1,0,0,0,0|2,0,0]=4 157 B9R1.1 c1cc(ncc1N)CN WXC02330 [1,1,0,0,0,0|2,0,0]=4 158 B9R1.6 CC(c1ccccn1)N WX609027 [1,1,0,0,0,0|1,0,0]=3 159 B9R1.6 CC(c1ccccn1)O WX642039 [1,1,0,0,0,0|1,0,0]=3 160 B9R1.6 CC(c1cccnc1)N WX609031 [1,1,0,0,0,0|1,0,0]=3 161 B9R1.6 CC(c1cccnc1)O WX642141 [1,1,0,0,0,0|1,0,0]=3 162 B9R1.6 CC(c1ncccn1)N WX609073 [1,1,0,0,0,0|2,0,0]=4 163 B9R1.6 CC(c1ncccn1)O WX642042 [1,1,0,0,0,0|2,0,0]=4 164 B9R1.8 CNCc1ccccn1 WX600188 [1,1,0,0,0,0|1,0,0]=3 165 B9R1.8 CNCc1cccnc1 WX609032 [1,1,0,0,0,0|1,0,0]=3 166 B9R1.8 CNCc1ncccn1 WX603029 [1,1,0,0,0,0|2,0,0]=4 167 B9R1.8 CNCc1ncccn1 WX603127 [1,1,0,0,0,0|2,0,0]=4 168 B9R1.8 CNCc1ncccn1 WXC02264 [1,1,0,0,0,0|2,0,0]=4 169 B9R1.8 c1cc(cnc1)CC#N WX683086 [1,1,0,0,0,0|1,0,1]=4 170 B9R1.8 c1cc(cnc1)CNN WX684003 [1,1,0,0,0,0|2,0,0]=4 171 B9R1.8 c1ccnc(c1)CCN WX600199 [1,1,0,0,0,0|1,0,0]=3 172 B9R1.15 CCc1c(cccn1)O WX649107 [1,1,0,0,0,0|1,0,0]=3 173 B9R1.15 CCc1cccnc1Cl WX636307 [1,1,0,0,0,0|1,0,0]=3 174 B9R1.15 CNc1c(cccn1)N WX609203 [1,1,0,0,0,0|2,0,0]=4 175 B9R1.15 CNc1c(cccn1)N WX609509 [1,1,0,0,0,0|2,0,0]=4 176 B9R1.15 COc1c(cccn1)Br WX637046 [1,1,0,0,0,0|2,0,0]=4 177 B9R1.15 COc1c(nccn1)Cl WX636117 [1,1,0,0,0,0|1,0,0]=3 178 B9R1.15 Cc1c(cccn1)CN WX603047 [1,1,0,0,0,0|2,0,0]=4 179 B9R1.15 Cc1c(cccn1)CO WX640263 [1,1,0,0,0,0|2,0,0]=4 180 B9R1.15 Cc1cccnc1CN WX609026 [1,1,0,0,0,0|2,0,0]=4 181 B9R1.15 Cc1cccnc1CO WX640138 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.15 c1cc(c(nc1)Br)CO WXC02240 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.15 c1cc(c(nc1)CN)F WXFC0141 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.15 c1cc(c(nc1)Cl)CCl WXC03068 [1,1,0,0,0,0|2,0,0]=4 185 B9R1.15 c1cc(c(nc1)F)CBr WX630218 [1,1,0,0,0,0|2,0,0]=4 186 B9R1.15 c1cnc(c(n1)C#N)Br WXC02871 [1,1,0,0,0,0|1,0,1]=4 187 B9R1.15 c1cnc(c(n1)CN)Cl WX603054 [1,1,0,0,0,0|1,0,0]=3 188 B9R1.15 c1cnc(c(n1)NN)Cl WX684220 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.15 c1cncc(c1Br)CO WX640177 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.15 c1cncc(c1Cl)CN WX603073 [1,1,0,0,0,0|2,0,0]=4 191 B9R1.15 c1cncc(c1Cl)CO WX640034 [1,1,0,0,0,0|2,0,0]=4 192 B9R1.69 Cc1c(ccc(n1)Cl)Br WX637052 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.69 Cc1c(ccc(n1)N)Br WX637051 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.69 Cc1c(cnc(n1)C)O WX649102 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.69 Cc1c(ncc(n1)N)Br WX606019 [1,1,0,0,0,0|1,0,0]=3 196 B9R1.69 Cc1cc(c(nc1)F)I WX638020 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.69 Cc1cc(c(nc1)I)C WX638014 [1,1,0,0,0,0|1,0,0]=3 198 B9R1.69 Cc1cc(cnc1N)O WX609496 [1,1,0,0,0,0|2,0,0]=4 199 B9R1.69 Cc1ccc(c(n1)C)O WX649106 [1,1,0,0,0,0|1,0,0]=3 200 B9R1.69 Cc1cnc(c(n1)N)C WX609371 [1,1,0,0,0,0|1,0,0]=3 201 B9R1.69 c1c(nc(c(n1)Br)Cl)N WX609127 [1,1,0,0,0,0|2,0,0]=4 202 B9R1.69 c1c(nc(c(n1)Br)N)Cl WX609356 [1,1,0,0,0,0|2,0,0]=4 203 B9R1.69 c1c(nc(c(n1)N)Br)Br WX609300 [1,1,0,0,0,0|2,0,0]=4 204 B9R1.69 c1c(nc(c(n1)N)Cl)Br WX609309 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.69 c1c(nc(c(n1)O)Br)Br WX637362 [1,1,0,0,0,0|2,0,0]=4 206 B9R1.7 CNCc1cnc(s1)Cl WX600141 [0,1,0,0,1,0|2,0,0]=4 207 B9R1.7 CNCc1cnn(c1)C WX603143 [0,1,0,0,1,0|2,0,0]=4 208 B9R1.7 Cc1nc(no1)CCN WX607104 [0,1,0,0,1,0|1,0,0]=3 209 B9R1.7 Cc1nc(no1)CNC WX607092 [0,1,0,0,1,0|1,0,0]=3 210 B9R1.7 Cn1cc(nc1)CCN WX600156 [0,1,0,0,1,0|2,0,0]=4 211 B9R1.21 CCn1cc(cn1)CO WX640358 [0,1,0,0,1,0|2,0,0]=4 212 B9R1.22 Cc1c(sc(n1)C)CN WX603014 [0,1,0,0,1,0|2,0,0]=4 213 B9R1.22 Cc1c(sc(n1)C)CO WX640322 [0,1,0,0,1,0|2,0,0]=4 214 B9R1.22 Cn1cc(c(n1)OC)N WX609507 [0,1,0,0,1,0|2,0,0]=4 215 B9R1.23 Cc1cc(nn1C)NC WX607141 [0,1,0,0,1,0|2,0,0]=4 216 B9R1.23 Cn1c(cc(n1)SC)N WXC01047 [0,1,0,0,1,0|2,0,0]=4 217 B9R1.41 Cc1c(c[nH]n1)C(C)O WX642153 [0,1,0,0,1,0|1,0,1]=4 218 B11R1.9 CCc1cc(cc(n1)CC)Br WX637028 [0,2,0,0,0,0|1,0,0]=3 219 B11R1.23 Cc1cc(cnc1)C(=O)OC WX618562 [0,2,0,0,0,0|1,0,1]=4 220 B11R1.189 COc1cc(cnc1)CCN WX607135 [0,2,0,0,0,0|1,0,0]=3 221 B11R1.189 COc1cccc(n1)CC#N WX683016 [0,2,0,0,0,0|1,0,1]=4 222 B11R1.189 COc1cccc(n1)CCN WX607112 [0,2,0,0,0,0|1,0,0]=3 223 B11R1.280 CCc1cc(ccc1Br)OC WX633194 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.280 CSc1c(nnc(n1)SC)N WX609357 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.280 Cc1ccc(nc1NC)CN WX603138 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.155 CC(C)(c1cc(cnc1)Br)O WX637183 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.155 CC(C)(c1cccc(n1)Br)O WX637181 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.279 Cc1cc(cnc1OC)CO WX640343 [0,2,0,0,0,0|2,0,0]=4 229 B11R2.106 Cc1cccc2c1CCN2 WX604534 [0,1,0,1,0,0|2,0,0]=4 230 B11R2.106 Cc1cccc2c1CNC2 WX604541 [0,1,0,1,0,0|2,0,0]=4 231 B11R2.36 Cc1ccc2c(c1)CNC2 WX604540 [0,1,0,1,0,0|2,0,0]=4 232 B11R2.36 Cc1ccc2c(c1)NCC2 WX604533 [0,1,0,1,0,0|2,0,0]=4 233 B11R2.36 c1c(cnc2c1CCC2)Br WXC01093 [0,1,0,1,0,0|2,0,0]=4 234 B11R2.36 c1c(cnc2c1CCN2)Br WX637403 [0,1,0,1,0,0|2,0,0]=4 235 B11R2.36 c1cc(nc2c1CCC2)Cl WXC03715 [0,1,0,1,0,0|2,0,0]=4 236 B7R1.1 CCc1c[nH]nc1 WX690051 [1,0,0,0,1,0|1,0,0]=3 237 B7R1.1 CNc1cc[nH]n1 WX606026 [1,0,0,0,1,0|2,0,0]=4 238 B7R1.1 CNc1ccon1 WX606025 [1,0,0,0,1,0|2,0,0]=4 239 B7R1.1 CNc1ccon1 WX606070 [1,0,0,0,1,0|2,0,0]=4 240 B7R1.1 CNc1ncco1 WX606024 [1,0,0,0,1,0|2,0,0]=4 241 B7R1.1 CSc1c[nH]nc1 WXC00643 [1,0,0,0,1,0|2,0,0]=4 242 B7R1.1 CSc1cc[nH]n1 WXC00642 [1,0,0,0,1,0|2,0,0]=4 243 B7R1.1 c1c([nH]cn1)CO WX640062 [1,0,0,0,1,0|1,0,1]=4 244 B7R1.1 c1c(cn[nH]1)CO WX640336 [1,0,0,0,1,0|2,0,0]=4 245 B7R1.1 c1c(nc[nH]1)CN WX603089 [1,0,0,0,1,0|1,0,1]=4 246 B7R1.1 c1c(nc[nH]1)CO WX640292 [1,0,0,0,1,0|1,0,1]=4 247 B7R1.1 c1c(nco1)CO WX640327 [1,0,0,0,1,0|2,0,0]=4 248 B7R1.1 c1c(ncs1)CN WX603101 [1,0,0,0,1,0|2,0,0]=4 249 B7R1.1 c1c(ocn1)CO WX640330 [1,0,0,0,1,0|2,0,0]=4 250 B7R1.1 c1c(scn1)CCl WXC04167 [1,0,0,0,1,0|2,0,0]=4 251 B7R1.1 c1c(scn1)CN WX609040 [1,0,0,0,1,0|2,0,0]=4 252 B7R1.1 c1c[nH]nc1CN WX603026 [1,0,0,0,1,0|2,0,0]=4 253 B7R1.1 c1c[nH]nc1CN WXC04668 [1,0,0,0,1,0|2,0,0]=4 254 B7R1.1 c1cc(sc1)CO WX640288 [1,0,0,0,1,0|2,0,0]=4 255 B7R1.1 c1cnc([nH]1)CN WX609045 [1,0,0,0,1,0|1,0,1]=4 256 B7R1.1 c1cnc([nH]1)CO WXC03352 [1,0,0,0,1,0|1,0,1]=4 257 B7R1.1 c1cnoc1CBr WX630186 [1,0,0,0,1,0|2,0,0]=4 258 B7R1.1 c1cnoc1CN WX603009 [1,0,0,0,1,0|2,0,0]=4 259 B7R1.1 c1conc1CBr WX630236 [1,0,0,0,1,0|2,0,0]=4 260 B7R1.1 c1conc1CN WX603172 [1,0,0,0,1,0|2,0,0]=4 261 B7R1.1 c1csc(n1)CO WX640084 [1,0,0,0,1,0|2,0,0]=4 262 B7R1.1 c1nc(no1)CN WX607091 [1,0,0,0,1,0|2,0,0]=4 263 B7R1.2 Cc1[nH]cc(n1)Br WX637072 [1,0,0,0,1,0|1,0,1]=4 264 B7R1.2 Cc1[nH]cc(n1)I WXC02628 [1,0,0,0,1,0|1,0,1]=4 265 B7R1.2 Cc1cn(cn1)C WX690226 [1,0,0,0,1,0|2,0,0]=4 266 B7R1.2 Cc1cnc([nH]1)I WX638055 [1,0,0,0,1,0|1,0,1]=4 267 B7R1.2 Cc1cnc(o1)N WX606013 [1,0,0,0,1,0|2,0,0]=4 268 B7R1.2 Cc1cnc(s1)Br WX637317 [1,0,0,0,1,0|2,0,0]=4 269 B7R1.2 Cc1cnc(s1)N WX609460 [1,0,0,0,1,0|2,0,0]=4 270 B7R1.2 Cc1coc(n1)N WX609465 [1,0,0,0,1,0|2,0,0]=4 271 B7R1.2 Cc1csc(n1)Br WX637318 [1,0,0,0,1,0|2,0,0]=4 272 B7R1.2 Cc1csc(n1)Cl WX636051 [1,0,0,0,1,0|2,0,0]=4 273 B7R1.2 Cc1csc(n1)N WX609462 [1,0,0,0,1,0|2,0,0]=4 274 B7R1.2 Cc1nc(sn1)Br WX637380 [1,0,0,0,1,0|2,0,0]=4 275 B7R1.2 Cc1nc(sn1)N WX609094 [1,0,0,0,1,0|2,0,0]=4 276 B7R1.2 Cn1ccc(n1)Br WX637315 [1,0,0,0,1,0|2,0,0]=4 277 B7R1.2 Cn1ccc(n1)I WX638065 [1,0,0,0,1,0|2,0,0]=4 278 B7R1.2 Cn1ccc(n1)N WX609467 [1,0,0,0,1,0|2,0,0]=4 279 B7R1.2 Cn1cnc(n1)Br WX637399 [1,0,0,0,1,0|2,0,0]=4 280 B7R1.2 Cn1cnc(n1)N WX609394 [1,0,0,0,1,0|2,0,0]=4 281 B7R1.2 Cn1ncc(n1)Br WX637358 [1,0,0,0,1,0|2,0,0]=4 282 B7R1.4 Cc1cn[nH]c1I WX638024 [1,0,0,0,1,0|2,0,0]=4 283 B7R1.4 Cn1cncc1Cl WX636231 [1,0,0,0,1,0|2,0,0]=4 284 B7R1.4 Cn1cncc1I WX638026 [1,0,0,0,1,0|2,0,0]=4