0 B9R1.6 B(c1cccnc1)(O)O WX654050 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 B(c1cncnc1)(O)O WX654015 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.6 CC(c1ccccn1)N WX609027 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.6 CC(c1cccnc1)N WX609031 [0,0,0,0,0,0|1,0,1]=2 4 B9R1.6 CC(c1cccnc1)O WX642141 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.6 CC(c1ccncc1)N WX609038 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 c1c(cncn1)C(=O)O WX614058 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 c1cc(cnc1)[N+](=O)[O-] WXC00124 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 c1ccnc(c1)C(=N)N WX619917 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 c1cnc(nc1)C(=O)O WX614147 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.6 c1cnc(nc1)C(=S)N WXC00508 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.6 c1cnccc1C(=N)N WX619915 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 c1cncnc1C(=O)O WX614254 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.2 C=Cc1cccnc1 WX685205 [1,0,0,0,0,0|1,0,0]=2 14 B8R1.2 CNc1cccnc1 WX609454 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.2 CNc1cnccn1 WX606056 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.2 c1cc(cnc1)CO WX640285 [1,0,0,0,0,0|0,0,2]=3 17 B8R1.2 c1ccnc(c1)NN WXC04165 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.2 c1cnc(cn1)C=O WX624187 [1,0,0,0,0,0|1,0,0]=2 19 B8R1.2 c1cnc(cn1)CN WX603036 [1,0,0,0,0,0|1,0,1]=3 20 B8R1.2 c1cnc(cn1)CO WX640335 [1,0,0,0,0,0|1,0,2]=4 21 B8R1.2 c1cnccc1NN WX684229 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.13 B(c1ccc(nc1)C)(O)O WX654026 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.13 CC(=O)c1ccc(cn1)Br WX619067 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.13 CC(=O)c1ccc(nc1)Cl WX626037 [0,1,0,0,0,0|1,0,0]=2 25 B10R1.13 CC(=O)c1ccc(nn1)Cl WXC01382 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.13 Cc1ccc(cn1)C(=O)O WX614214 [0,1,0,0,0,0|1,0,0]=2 27 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] WX609936 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.13 Cc1ccc(nc1)C(=O)O WX614117 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.13 c1cc(ccc1C(=N)N)Br WX684427 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.13 c1cc(ccc1C(=N)N)Br WX690071 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.13 c1cc(ccc1C(=O)N)N WXC02462 [0,1,0,0,0,0|1,0,0]=2 32 B10R1.13 c1cc(ncc1O)C(=O)O WX614146 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.13 c1cc(nnc1C(=O)O)O WX614045 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.15 C[C@H](CN)c1ccccc1 WX600102 [0,1,0,0,0,0|2,0,1]=4 35 B10R1.15 N=C(\c1ccccc1)/OC WXC04573 [0,1,0,0,0,0|1,0,2]=4 36 B10R1.15 c1ccc(cc1)C(=O)CF WXFC0145 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.15 c1ccc(cc1)C(=S)NN WXC00705 [0,1,0,0,0,0|1,1,0]=3 38 B10R1.15 c1ccc(cc1)[C@@H](CF)N WXFC0133 [0,1,0,0,0,0|2,0,1]=4 39 B10R1.15 c1ccc(cc1)[C@H](CF)N WXFC0134 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.15 c1ccc(cc1)\C(=N\O)\N WX690132 [0,1,0,0,0,0|1,0,1]=3 41 B10R1.15 c1ccnc(c1)C(=O)CBr WX631026 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.15 c1cnc(cn1)C(=O)NN WX684402 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.15 c1cnccc1C(=O)CBr WX631022 [0,1,0,0,0,0|3,0,0]=4 44 B10R1.28 CC(C)(c1ccccc1)N WX600125 [0,1,0,0,0,0|2,0,1]=4 45 B10R1.28 CC(C)(c1cccnc1)N WX600235 [0,1,0,0,0,0|1,0,1]=3 46 B10R1.61 B(c1cccnc1Br)(O)O WX654020 [0,1,0,0,0,0|2,0,1]=4 47 B10R1.61 B(c1cccnc1C)(O)O WX654053 [0,1,0,0,0,0|2,0,1]=4 48 B10R1.61 B(c1cccnc1Cl)(O)O WX654018 [0,1,0,0,0,0|2,0,1]=4 49 B10R1.61 B(c1cnccc1C)(O)O WX654008 [0,1,0,0,0,0|2,0,1]=4 50 B10R1.61 Cc1c(cccn1)C(=O)O WX614245 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.61 Cc1cccnc1C(=O)O WX619068 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.61 Cc1ccncc1C(=O)O WX614191 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.61 Cc1cnccc1C(=O)O WX614130 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.61 c1cc(c(nc1)Br)[N+](=O)[O-] WX637155 [0,1,0,0,0,0|2,0,0]=3 55 B10R1.61 c1ccc(c(c1)C(=N)N)Cl WX619951 [0,1,0,0,0,0|2,0,0]=3 56 B10R1.61 c1ccc(c(c1)C(=N)N)F WX619904 [0,1,0,0,0,0|2,0,0]=3 57 B10R1.61 c1cncc(c1C(=O)O)F WX614062 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.61 c1cncc(c1Cl)[N+](=O)[O-] WX636139 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.113 B(c1cc(cnc1)C)(O)O WX654007 [0,1,0,0,0,0|2,0,1]=4 60 B10R1.113 B(c1cc(cnc1)F)(O)O WX654011 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.113 CC(=O)c1cc(ccn1)Br WXC02208 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.113 CC(=O)c1cc(ccn1)Cl WX636192 [0,1,0,0,0,0|3,0,0]=4 63 B10R1.113 CC(=O)c1cc(cnc1)Br WX637241 [0,1,0,0,0,0|1,0,0]=2 64 B10R1.113 CC(=O)c1cccc(c1)Br WX633007 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.113 CC(=O)c1cccc(n1)Br WX624141 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.113 CC(=O)c1ccnc(c1)Cl WX636120 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.113 Cc1cc(cnc1)C(=O)N WX619274 [0,1,0,0,0,0|0,0,0]=1 68 B10R1.113 Cc1cc(cnc1)C(=O)O WX614246 [0,1,0,0,0,0|1,0,0]=2 69 B10R1.113 Cc1cccc(n1)C(=N)N WXC03164 [0,1,0,0,0,0|3,0,0]=4 70 B10R1.113 Cc1cccc(n1)C(=O)O WX614192 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.113 Cc1ccnc(c1)C(=N)N WXC03165 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.113 Cc1ccnc(c1)C(=O)O WX614114 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.113 c1c(cncc1Cl)C(=O)O WX614059 [0,1,0,0,0,0|1,0,0]=2 74 B10R1.113 c1c(cncc1F)C(=O)N WXC01409 [0,1,0,0,0,0|0,0,0]=1 75 B10R1.113 c1c(cncc1F)C(=O)O WX614202 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.113 c1c(cnnc1Cl)C(=O)O WXC00935 [0,1,0,0,0,0|2,0,0]=3 77 B10R1.113 c1c(nc(cn1)Cl)C(=O)O WX614271 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.113 c1cc(cc(c1)Cl)C(=S)N WX619930 [0,1,0,0,0,0|1,1,0]=3 79 B10R1.113 c1cc(nc(c1)Cl)C(=O)O WX614070 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.113 c1cnc(cc1Br)C(=O)O WX614145 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.113 c1cnc(cc1C(=O)O)F WX614285 [0,1,0,0,0,0|3,0,0]=4 82 B8R1.7 CC(=O)c1c[nH]cn1 WX626016 [0,0,0,0,1,0|2,0,0]=3 83 B8R1.7 CC(=O)c1cc[nH]n1 WX626051 [0,0,0,0,1,0|2,0,0]=3 84 B8R1.7 CC(=O)c1cncs1 WX626015 [0,0,0,0,1,0|2,0,0]=3 85 B8R1.7 CC(c1[nH]ccn1)N WX603123 [0,0,0,0,1,0|2,0,1]=4 86 B8R1.7 CC(c1[nH]ccn1)N WX609071 [0,0,0,0,1,0|2,0,1]=4 87 B8R1.7 CC(c1cc[nH]n1)N WXC00799 [0,0,0,0,1,0|2,0,1]=4 88 B8R1.7 CC(c1cccs1)N WX609033 [0,0,0,0,1,0|2,0,1]=4 89 B8R1.7 CC(c1cncs1)N WX609041 [0,0,0,0,1,0|2,0,1]=4 90 B8R1.7 c1c(cn[nH]1)C(=O)O WX614069 [0,0,0,0,1,0|2,0,0]=3 91 B8R1.7 c1c(con1)C(=O)O WX614066 [0,0,0,0,1,0|2,0,0]=3 92 B8R1.7 c1c(nc[nH]1)C(=O)O WX614057 [0,0,0,0,1,0|2,0,0]=3 93 B8R1.7 c1c(nco1)C(=O)O WX614087 [0,0,0,0,1,0|2,0,0]=3 94 B8R1.7 c1c(ncs1)C(=O)N WX619024 [0,0,0,0,1,0|1,0,0]=2 95 B8R1.7 c1c(nns1)C(=O)O WX613780 [0,0,0,0,1,0|3,0,0]=4 96 B8R1.7 c1c(scn1)C(=O)O WX614255 [0,0,0,0,1,0|2,0,0]=3 97 B8R1.7 c1c[nH]cc1C(=O)O WX614253 [0,0,0,0,1,0|1,0,1]=3 98 B8R1.7 c1c[nH]nc1C(=O)O WX614216 [0,0,0,0,1,0|2,0,0]=3 99 B8R1.7 c1cn[nH]c1C(=O)O WX614248 [0,0,0,0,1,0|2,0,0]=3 100 B8R1.7 c1cnc([nH]1)C(=O)O WX614140 [0,0,0,0,1,0|2,0,0]=3 101 B8R1.7 c1cnn(c1)C(=N)N WX619907 [0,0,0,0,1,0|2,0,0]=3 102 B8R1.7 c1cnn(c1)C(=O)Cl WX616007 [0,0,0,0,1,0|2,0,0]=3 103 B10R1.18 c1ccc(cc1)CC(=S)N WX619929 [0,0,0,0,0,1|1,1,0]=3 104 B10R1.18 c1ccc(cc1)NC(=N)N WX684412 [0,0,0,0,0,1|2,0,0]=3 105 B10R1.18 c1cnc(nc1)CC(=O)N WXC04468 [0,0,0,0,0,1|3,0,0]=4 106 B7R1.3 c1c(cncn1)N WX609156 [2,0,0,0,0,0|1,0,0]=3 107 B7R1.3 c1c(cncn1)O WX645041 [2,0,0,0,0,0|1,0,1]=4 108 B7R1.3 c1cc(cnc1)N WX609448 [2,0,0,0,0,0|0,0,0]=2 109 B7R1.3 c1cc(cnc1)O WX649089 [2,0,0,0,0,0|0,0,1]=3 110 B7R1.3 c1cc(nnc1)Br WX637045 [2,0,0,0,0,0|2,0,0]=4 111 B7R1.3 c1cc(nnc1)Cl WX636063 [2,0,0,0,0,0|2,0,0]=4 112 B7R1.3 c1cc(nnc1)N WX609159 [2,0,0,0,0,0|1,0,0]=3 113 B7R1.3 c1ccc(cc1)O WX645078 [2,0,0,0,0,0|1,0,1]=4 114 B7R1.3 c1cnc(cn1)Cl WX636237 [2,0,0,0,0,0|2,0,0]=4 115 B7R1.3 c1cnc(cn1)N WX609446 [2,0,0,0,0,0|1,0,0]=3 116 B9R1.1 CCc1ccc(nc1)Cl WX636306 [1,1,0,0,0,0|1,0,1]=4 117 B9R1.1 COc1ccc(nc1)Cl WX636208 [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 Cc1ccc(cc1)NN WX684225 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.1 Cc1ccc(cn1)CN WX603042 [1,1,0,0,0,0|0,0,1]=3 120 B9R1.1 c1c(ncc(n1)Cl)C=O WX624222 [1,1,0,0,0,0|1,0,0]=3 121 B9R1.1 c1cc(ncc1Br)C=O WX624044 [1,1,0,0,0,0|2,0,0]=4 122 B9R1.1 c1cc(ncc1C=O)Cl WX624043 [1,1,0,0,0,0|0,0,0]=2 123 B9R1.1 c1cc(ncc1CO)Cl WX640287 [1,1,0,0,0,0|0,0,2]=4 124 B9R1.1 c1cc(ncc1Cl)C=O WX624172 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.2 CSc1cc(cnc1)Br WX637159 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.2 Cc1cc(ccn1)C=O WX624158 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.2 Cc1cc(cnc1)C#N WX683559 [1,1,0,0,0,0|0,0,2]=4 128 B9R1.2 Cc1cc(cnc1)CN WX603037 [1,1,0,0,0,0|0,0,1]=3 129 B9R1.2 Cc1cc(cnc1)CN WX603115 [1,1,0,0,0,0|0,0,1]=3 130 B9R1.2 Cc1cc(cnc1)CO WX640286 [1,1,0,0,0,0|0,0,2]=4 131 B9R1.2 Cc1cccc(n1)C=O WX624173 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.2 Cc1ccnc(c1)C=O WX624021 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.2 Cc1cncc(n1)C=O WX624023 [1,1,0,0,0,0|1,0,0]=3 134 B9R1.2 c1c(cncc1Br)C#N WX637012 [1,1,0,0,0,0|0,0,2]=4 135 B9R1.2 c1c(cncc1Br)CO WX640147 [1,1,0,0,0,0|0,0,2]=4 136 B9R1.2 c1c(cncc1Cl)C=O WX624175 [1,1,0,0,0,0|0,0,0]=2 137 B9R1.2 c1c(cncc1Cl)CO WXC01376 [1,1,0,0,0,0|0,0,2]=4 138 B9R1.2 c1cc(c[n+](c1)[O-])CN WXC04237 [1,1,0,0,0,0|0,0,2]=4 139 B9R1.2 c1cnc(cc1C=O)O WX624062 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.8 CNCc1cccnc1 WX609032 [1,1,0,0,0,0|0,0,1]=3 141 B9R1.8 c1cc(cnc1)CC#N WX683086 [1,1,0,0,0,0|0,0,2]=4 142 B9R1.8 c1cc(cnc1)CNN WX684003 [1,1,0,0,0,0|0,0,1]=3 143 B9R1.15 C#Cc1cccnc1N WX685203 [1,1,0,0,0,0|1,0,1]=4 144 B9R1.15 CCc1cccnc1Cl WX636307 [1,1,0,0,0,0|1,0,1]=4 145 B9R1.15 Cc1c(cccn1)CN WX603047 [1,1,0,0,0,0|0,0,1]=3 146 B9R1.15 Cc1c(cccn1)CO WX640263 [1,1,0,0,0,0|0,0,2]=4 147 B9R1.15 Cc1cccnc1C=O WX624058 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.15 c1cc(c(nc1)Br)CO WXC02240 [1,1,0,0,0,0|0,0,2]=4 149 B9R1.15 c1cc(c(nc1)Cl)C=O WX624177 [1,1,0,0,0,0|0,0,0]=2 150 B9R1.15 c1cc(c(nc1)Cl)CCl WXC03068 [1,1,0,0,0,0|1,0,1]=4 151 B9R1.15 c1cc(c(nc1)F)CBr WX630218 [1,1,0,0,0,0|1,0,1]=4 152 B9R1.15 c1cc(c(nc1)N)C#N WX609343 [1,1,0,0,0,0|0,0,2]=4 153 B9R1.15 c1cc(c(nc1)O)C#N WX683506 [1,1,0,0,0,0|0,0,2]=4 154 B9R1.15 c1ccc(c(c1)CN)O WXC02211 [1,1,0,0,0,0|1,0,1]=4 155 B9R1.15 c1cnc(c(n1)CN)Cl WX603054 [1,1,0,0,0,0|1,0,1]=4 156 B9R1.15 c1cnc(c(n1)NN)Cl WX684220 [1,1,0,0,0,0|2,0,0]=4 157 B9R1.15 c1cncc(c1Br)CO WX640177 [1,1,0,0,0,0|0,0,2]=4 158 B9R1.15 c1cncc(c1Cl)C=O WX624176 [1,1,0,0,0,0|0,0,0]=2 159 B9R1.15 c1cncc(c1Cl)CN WX603073 [1,1,0,0,0,0|0,0,1]=3 160 B9R1.15 c1cncc(c1Cl)CO WX640034 [1,1,0,0,0,0|0,0,2]=4 161 B9R1.15 c1cncc(c1N)C=O WX624056 [1,1,0,0,0,0|0,0,0]=2 162 B9R1.15 c1cncc(c1N)C=O WXC03252 [1,1,0,0,0,0|0,0,0]=2 163 B9R1.11 CCC(=O)c1ccc[nH]1 WX626090 [0,1,0,0,1,0|1,0,1]=4 164 B9R1.11 COC(=O)c1cc[nH]c1 WX618371 [0,1,0,0,1,0|1,0,1]=4 165 B9R1.11 COC(=O)c1ccc[nH]1 WX618294 [0,1,0,0,1,0|1,0,1]=4 166 B9R1.11 c1cc(sc1)\C(=N\O)\N WX690133 [0,1,0,0,1,0|1,0,1]=4 167 B9R1.11 c1cscc1\C(=N\O)\N WX690188 [0,1,0,0,1,0|1,0,1]=4 168 B9R1.35 CC(=O)c1ccc(s1)Cl WXC03434 [0,1,0,0,1,0|2,0,0]=4 169 B9R1.35 Cc1[nH]cc(n1)C(=O)O WX614001 [0,1,0,0,1,0|2,0,0]=4 170 B9R1.35 Cc1cc([nH]n1)C(=O)O WX614060 [0,1,0,0,1,0|2,0,0]=4 171 B9R1.35 Cc1cc(c[nH]1)C(=O)O WX613080 [0,1,0,0,1,0|1,0,1]=4 172 B9R1.35 Cc1cc(n[nH]1)C(=O)O WX614029 [0,1,0,0,1,0|2,0,0]=4 173 B9R1.35 Cc1cc(no1)C(=O)C WX626024 [0,1,0,0,1,0|2,0,0]=4 174 B9R1.35 Cc1cc(on1)C(=O)O WX614233 [0,1,0,0,1,0|2,0,0]=4 175 B9R1.35 Cc1cc(sc1)C(=O)O WX614259 [0,1,0,0,1,0|2,0,0]=4 176 B9R1.35 Cc1ccc(o1)C(=O)O WX614194 [0,1,0,0,1,0|2,0,0]=4 177 B9R1.35 Cc1ccc(s1)C(=O)O WX614260 [0,1,0,0,1,0|2,0,0]=4 178 B9R1.35 Cc1nc(cs1)C(=O)O WX612033 [0,1,0,0,1,0|2,0,0]=4 179 B9R1.35 Cc1ncc(s1)C(=O)O WX614123 [0,1,0,0,1,0|2,0,0]=4 180 B9R1.35 Cn1cc(cn1)C(=O)O WX614163 [0,1,0,0,1,0|2,0,0]=4 181 B9R1.35 Cn1cc(nc1)C(=O)O WX614252 [0,1,0,0,1,0|2,0,0]=4 182 B9R1.35 Cn1ccc(c1)C(=O)O WX614122 [0,1,0,0,1,0|1,0,1]=4 183 B9R1.35 Cn1ccc(n1)C(=O)O WX614061 [0,1,0,0,1,0|2,0,0]=4 184 B9R1.35 c1(nnc(s1)Cl)C(=O)N WX636089 [0,1,0,0,1,0|2,0,0]=4 185 B9R1.35 c1c(c[nH]c1C(=O)O)F WXFS0405 [0,1,0,0,1,0|1,0,1]=4 186 B9R1.35 c1c(c[nH]c1Cl)C(=O)O WX614257 [0,1,0,0,1,0|1,0,1]=4 187 B9R1.35 c1c(nc(s1)Br)C(=O)O WX614040 [0,1,0,0,1,0|2,0,0]=4 188 B9R1.35 c1c(nc(s1)Cl)C(=O)O WXC02298 [0,1,0,0,1,0|2,0,0]=4 189 B9R1.41 CC(=O)c1ccnn1C WX626017 [0,1,0,0,1,0|2,0,0]=4 190 B9R1.41 Cc1c([nH]cn1)C(=O)O WX614250 [0,1,0,0,1,0|2,0,0]=4 191 B9R1.41 Cc1c(c[nH]n1)C(=O)C WX626082 [0,1,0,0,1,0|2,0,0]=4 192 B9R1.41 Cc1c(c[nH]n1)C(=O)O WX613012 [0,1,0,0,1,0|2,0,0]=4 193 B9R1.41 Cc1c(cc[nH]1)C(=O)O WX614100 [0,1,0,0,1,0|1,0,1]=4 194 B9R1.41 Cc1c(con1)C(=O)O WX614141 [0,1,0,0,1,0|2,0,0]=4 195 B9R1.41 Cc1c(ocn1)C(=O)O WX614136 [0,1,0,0,1,0|2,0,0]=4 196 B9R1.41 Cc1c[nH]cc1C(=O)O WX614124 [0,1,0,0,1,0|1,0,1]=4 197 B9R1.41 Cc1cocc1C(=O)O WX613137 [0,1,0,0,1,0|2,0,0]=4 198 B9R1.41 Cc1cscc1C(=O)O WX614279 [0,1,0,0,1,0|2,0,0]=4 199 B9R1.41 Cn1c(ccn1)C(=O)O WX614032 [0,1,0,0,1,0|2,0,0]=4 200 B9R1.41 Cn1ccnc1C(=O)O WX614056 [0,1,0,0,1,0|2,0,0]=4 201 B9R1.41 Cn1cncc1C(=O)O WX614251 [0,1,0,0,1,0|2,0,0]=4 202 B9R1.41 c1c(c([nH]n1)C(=O)O)Cl WX614249 [0,1,0,0,1,0|2,0,0]=4 203 B9R1.41 c1c(c(cs1)Br)C(=O)O WXC02715 [0,1,0,0,1,0|2,0,0]=4 204 B9R1.41 c1coc(c1Br)C(=O)O WX614376 [0,1,0,0,1,0|2,0,0]=4 205 B11R1.20 CC(=O)Oc1ccc(cc1)O WX645067 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.20 c1cc(nnc1CC(=O)N)Cl WXC00478 [0,1,0,0,0,1|1,0,0]=3 207 B11R1.36 CC(c1ccccc1)C(=N)N WX619918 [0,1,0,0,0,1|2,0,0]=4 208 B11R1.40 c1ccc(cc1)C\C(=N/O)\N WX690150 [0,1,0,0,0,1|1,0,1]=4 209 B11R1.86 c1cnc(=O)n(c1)CC(=O)O WXC03415 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.86 c1cnc(c(n1)CC(=O)O)Cl WXC01521 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.157 c1cc(cc(c1)Br)NC(=S)N WXC04420 [0,1,0,0,0,1|1,1,0]=4 212 B11R1.3 CCc1ccc(cn1)C(=O)O WXC00284 [0,2,0,0,0,0|1,0,0]=3 213 B11R1.21 c1c(cnc(c1F)Cl)[N+](=O)[O-] WXC03108 [0,2,0,0,0,0|2,0,0]=4 214 B11R1.21 c1c(cnc(c1I)N)[N+](=O)[O-] WX609199 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.21 c1cc(c(cc1C(=O)O)O)I WX612079 [0,2,0,0,0,0|2,0,0]=4 216 B11R1.22 CNC(=O)c1ccc(cc1)N WX609521 [0,2,0,0,0,0|1,0,0]=3 217 B11R1.22 COC(=O)c1ccc(nc1)Cl WXC00297 [0,2,0,0,0,0|1,0,0]=3 218 B11R1.22 COC(=O)c1ccc(nn1)Br WX633109 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.22 COC(=O)c1cnc(cn1)Br WX633106 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.22 COC(=O)c1cnc(cn1)N WX609355 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.22 Cc1ccc(cc1)C(=S)NN WXC00707 [0,2,0,0,0,0|1,1,0]=4 222 B11R1.22 Cc1ccc(cc1)\C(=N/O)\N WX690131 [0,2,0,0,0,0|1,0,1]=4 223 B11R1.22 Cc1ccc(cn1)C(=O)OC WX618268 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.22 Cc1cnc(cn1)C(=O)OC WX618477 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.22 c1cc(ccc1C(=S)NN)Cl WXC00711 [0,2,0,0,0,0|1,1,0]=4 226 B11R1.22 c1cc(ccc1C(=S)NN)F WXC00709 [0,2,0,0,0,0|1,1,0]=4 227 B11R1.22 c1cc(ccc1\C(=N\O)\N)O WX690142 [0,2,0,0,0,0|1,0,1]=4 228 B11R1.22 c1cc(nnc1C(=O)CBr)Cl WXC01378 [0,2,0,0,0,0|2,0,0]=4 229 B11R1.166 CC(=O)c1ccc(cc1O)Br WX626004 [0,2,0,0,0,0|2,0,0]=4 230 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)O WX614340 [0,2,0,0,0,0|1,0,0]=3 231 B11R1.166 Cc1c(ccc(n1)N)[N+](=O)[O-] WX609144 [0,2,0,0,0,0|2,0,0]=4 232 B11R1.166 Cc1c(ccc(n1)O)[N+](=O)[O-] WX609907 [0,2,0,0,0,0|2,0,0]=4 233 B11R1.166 Cc1cc(ncc1C(=O)O)N WXC01124 [0,2,0,0,0,0|1,0,0]=3 234 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])Br WXC01648 [0,2,0,0,0,0|2,0,0]=4 235 B11R1.166 Cc1cc(ncc1[N+](=O)[O-])F WXC01646 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.166 Cc1ccc(c(c1)F)C(=O)O WX612018 [0,2,0,0,0,0|2,0,0]=4 237 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl WX614282 [0,2,0,0,0,0|1,0,0]=3 238 B11R1.166 c1c(c(cnc1Cl)[N+](=O)[O-])Cl WXC02234 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.166 c1c(c(cnc1Cl)[N+](=O)[O-])N WX609173 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.166 c1c(c(nc(n1)Cl)Cl)C(=O)N WXC02000 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.166 c1c(nc(c(n1)C(=O)O)Cl)Cl WX614383 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.166 c1cc(c(cc1Cl)O)C(=O)N WX632029 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.166 c1cc(nc(c1C(=O)N)Cl)Cl WXC03960 [0,2,0,0,0,0|0,0,0]=2 244 B11R1.166 c1cc(nc(c1[N+](=O)[O-])N)Cl WX609143 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.16 CCOC(=O)c1cnccn1 WX618267 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.16 c1ccc(cc1)C(=N)NC#N WXC03188 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.16 c1ccc(cc1)C(=O)CC#N WX683081 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.23 CNC(=O)c1cccc(c1)O WX645087 [0,2,0,0,0,0|1,0,0]=3 249 B11R1.23 COC(=O)c1cc(cnc1)Cl WXC01375 [0,2,0,0,0,0|1,0,0]=3 250 B11R1.23 COC(=O)c1cncc(=O)[nH]1 WX618240 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.23 Cc1cc(cnc1)C(=O)OC WX618562 [0,2,0,0,0,0|1,0,0]=3 252 B11R1.23 Cc1cccc(c1)C(=O)NN WXC04412 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.23 c1cc(cc(c1)Br)C(=O)CN WX602205 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.23 c1cc(cc(c1)Br)\C(=N\O)\N WX690148 [0,2,0,0,0,0|1,0,1]=4 255 B11R1.222 CCC(=O)c1ccccc1Br WX626030 [0,2,0,0,0,0|2,0,0]=4 256 B11R1.222 CCC(=O)c1ccccc1Cl WXC00823 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.222 COC(=O)c1ccc[nH]c1=O WX618226 [0,2,0,0,0,0|1,0,1]=4 258 B11R1.222 Cc1ccccc1C(=S)NN WXC00708 [0,2,0,0,0,0|1,1,0]=4 259 B11R1.222 c1ccc(c(c1)C(=NO)N)Br WX690159 [0,2,0,0,0,0|1,0,1]=4 260 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl WX631003 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.222 c1ccc(c(c1)C(=O)CCl)N WX631029 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.222 c1ccc(c(c1)\C(=N/O)\N)Cl WX690161 [0,2,0,0,0,0|1,0,1]=4 263 B11R1.155 CS(=O)(=O)c1cc(cnc1)Br WX637160 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.53 CNc1ccncc1[N+](=O)[O-] WX602097 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.53 COc1ccccc1C(=N)N WX619916 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.53 COc1ccccc1C(=N)N WX690199 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.156 CC(=O)c1c(cccc1Br)F WX633079 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.156 CC(=O)c1c(ccnc1Cl)Cl WX636165 [0,2,0,0,0,0|1,0,0]=3 269 B11R1.156 Cc1c(c(ccn1)Cl)[N+](=O)[O-] WX636079 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.156 c1cnc(c(c1N)[N+](=O)[O-])Cl WX609214 [0,2,0,0,0,0|2,0,0]=4 271 B11R1.156 c1cnc(c(c1O)[N+](=O)[O-])Cl WXC00639 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.156 c1nc(c(c(n1)Cl)C(=O)O)Cl WX614308 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.159 Cc1c(cccc1Br)C(=O)C WXC02293 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.159 Cc1c(cncc1Br)[N+](=O)[O-] WX637007 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.159 Cn1cccc(c1=O)C(=O)O WX614268 [0,2,0,0,0,0|1,0,1]=4 276 B11R1.159 c1c(c(c(cn1)Br)Cl)[N+](=O)[O-] WX637006 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.159 c1c(c(c(cn1)Br)N)[N+](=O)[O-] WXC00370 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.159 c1c(c(c(cn1)Br)O)[N+](=O)[O-] WX637005 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=N)N WX619947 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.167 CC(=O)c1cc(ccc1Br)O WX645034 [0,2,0,0,0,0|2,0,0]=4 281 B11R1.167 CC(=O)c1cc(ccc1F)Br WX626031 [0,2,0,0,0,0|2,0,0]=4 282 B11R1.167 Cc1c(cc(cn1)Br)[N+](=O)[O-] WX637142 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.167 Cc1cc(c(nc1)Cl)C(=O)O WX614044 [0,2,0,0,0,0|1,0,0]=3 284 B11R1.167 c1c(cnc(c1[N+](=O)[O-])O)F WXC03336 [0,2,0,0,0,0|2,0,0]=4 285 B11R1.167 c1cc(c(cc1Cl)C(=O)N)O WX645007 [0,2,0,0,0,0|1,0,0]=3 286 B11R1.167 c1cc(nc(c1N)C(=O)N)Cl WX609483 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.266 CC(=O)c1cccc(c1)CBr WX630200 [0,2,0,0,0,0|2,0,0]=4 288 B9R1.13 c1cc([nH]c1)CC(=O)N WX619054 [0,0,1,1,0,0|0,0,2]=4 289 B11R2.10 c1cc2c(nc1)CC(=O)N2 WX619106 [0,0,0,1,0,1|1,0,0]=3 290 B11R2.10 c1ccc2c(c1)[nH]c(n2)N WX609442 [0,0,0,1,0,1|2,0,0]=4 291 B11R2.10 c1ccc2c(c1)[nH]c(n2)S WXC01123 [0,0,0,1,0,1|1,1,0]=4 292 B11R2.10 c1ccc2c(c1)nc(s2)N WX609449 [0,0,0,1,0,1|1,1,0]=4 293 B11R2.1 c1c(c2cncnc2[nH]1)Br WX637396 [0,1,0,1,0,0|2,0,0]=4 294 B11R2.1 c1cc2c(c[nH]c2nc1)Br WX637327 [0,1,0,1,0,0|1,0,0]=3 295 B11R2.1 c1cc2c(c[nH]c2nc1)Cl WX636321 [0,1,0,1,0,0|1,0,0]=3 296 B11R2.1 c1cc2c(c[nH]c2nc1)I WX638057 [0,1,0,1,0,0|1,0,0]=3 297 B11R2.1 c1ccc2c(c1)CNC2=O WX619030 [0,1,0,1,0,0|1,0,0]=3 298 B7R1.1 c1c(cn[nH]1)C=O WX624203 [1,0,0,0,1,0|1,0,0]=3 299 B7R1.1 c1c(nc[nH]1)C=O WX624178 [1,0,0,0,1,0|1,0,0]=3 300 B7R1.1 c1c(nc[nH]1)CN WX603089 [1,0,0,0,1,0|1,0,1]=4 301 B7R1.1 c1c(ncs1)CN WX603101 [1,0,0,0,1,0|1,0,1]=4 302 B7R1.1 c1c(scn1)C=O WX624055 [1,0,0,0,1,0|1,0,0]=3 303 B7R1.1 c1c(scn1)CN WX609040 [1,0,0,0,1,0|1,0,1]=4 304 B7R1.1 c1c[nH]nc1C=O WX624059 [1,0,0,0,1,0|1,0,0]=3 305 B7R1.1 c1c[nH]nc1CN WX603026 [1,0,0,0,1,0|1,0,1]=4 306 B7R1.1 c1c[nH]nc1CN WXC04668 [1,0,0,0,1,0|1,0,1]=4 307 B7R1.1 c1cnc([nH]1)CN WX609045 [1,0,0,0,1,0|1,0,1]=4 308 B7R1.1 c1cnoc1CN WX603009 [1,0,0,0,1,0|1,0,1]=4 309 B7R1.1 c1conc1C=O WX624030 [1,0,0,0,1,0|1,0,0]=3 310 B7R1.1 c1conc1CN WX603172 [1,0,0,0,1,0|1,0,1]=4 311 B7R1.1 c1csc(n1)C=O WX624188 [1,0,0,0,1,0|1,0,0]=3 312 B11R1.91 c1c(cncn1)CCC(=O)O WX613623 [0,0,0,0,0,2|2,0,0]=4 313 B11R1.91 c1ccc(cc1)NCC(=O)N WX602022 [0,0,0,0,0,2|1,0,0]=3