0 B10R1.25 COc1c(nc(cn1)Cl)Cl WXC04294 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.25 COc1ccc(nc1Cl)I WX636290 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.25 Cc1c(ccc(n1)Cl)C=O WX624065 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.25 Cc1c(cnc(n1)Cl)OC WX636248 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.25 Cc1cc(cnc1NC)Br WX637137 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.1 CCc1ccc(nc1)Cl WX636306 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.1 COc1ccc(nc1)Cl WX636208 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.1 Cc1ccc(cn1)CN WX603042 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.1 Cc1ccc(nc1)CN WX609025 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.1 Cc1ccc(nc1)CO WX640119 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.1 Cc1cnc(nc1)CN WX603033 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.1 Cc1cnc(nc1)CN WX603126 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.1 Cc1cnc(nc1)CO WX640115 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.1 c1c(ncc(n1)Br)C#N WX637262 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.1 c1c(ncc(n1)Cl)C=O WX624222 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.1 c1c(ncc(n1)N)C#N WX609404 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.1 c1cc(ncc1Br)CN WX603129 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.1 c1cc(ncc1CO)Cl WX640287 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.1 c1cc(ncc1N)CN WXC02330 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.15 CCc1c(cccn1)O WX649107 [1,0,0,0,0,0|2,0,0]=3 20 B9R1.15 CCc1cccnc1Cl WX636307 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.15 CNc1c(cccn1)N WX609203 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.15 CNc1c(cccn1)N WX609509 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.15 COc1c(cccn1)Br WX637046 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.15 COc1c(nccn1)Cl WX636117 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.15 Cc1c(cccn1)CN WX603047 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.15 Cc1c(cccn1)CO WX640263 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.15 Cc1cccnc1C=O WX624058 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.15 Cc1cccnc1CN WX609026 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.15 Cc1cccnc1CO WX640138 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.15 c1cc(c(nc1)Br)CO WXC02240 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.15 c1cc(c(nc1)CN)F WXFC0141 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.15 c1cc(c(nc1)Cl)CCl WXC03068 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 c1cc(c(nc1)F)CBr WX630218 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 c1cnc(c(n1)C#N)Br WXC02871 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.15 c1cnc(c(n1)CN)Cl WX603054 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.15 c1cnc(c(n1)NN)Cl WX684220 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.69 Cc1c(cc(cn1)Br)N WX609484 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.69 Cc1c(ccc(n1)Cl)Br WX637052 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.69 Cc1c(ccc(n1)N)Br WX637051 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.69 Cc1c(cnc(n1)C)O WX649102 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.69 Cc1c(ncc(n1)N)Br WX606019 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.69 Cc1cc(c(nc1)F)I WX638020 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.69 Cc1cc(c(nc1)I)C WX638014 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.69 Cc1cc(cnc1N)O WX609496 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.69 Cc1ccc(c(n1)C)O WX649106 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.69 Cc1cnc(c(n1)N)C WX609371 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.69 c1c(nc(c(n1)Br)Cl)N WX609127 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.69 c1c(nc(c(n1)Br)N)Cl WX609356 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.69 c1c(nc(c(n1)N)Br)Br WX609300 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.69 c1c(nc(c(n1)N)Cl)Br WX609309 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.69 c1c(nc(c(n1)O)Br)Br WX637362 [1,0,0,0,0,0|3,0,0]=4 52 B11R1.37 COc1cc(cnc1OC)Br WX637392 [0,1,0,0,0,0|3,0,0]=4 53 B11R1.37 COc1ccc(nc1OC)N WX609238 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.37 c1c(cnc(c1CO)CO)Br WXC01022 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.81 CCOc1c(cc(cn1)Cl)F WXC04149 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.81 COCc1ccc(nc1Cl)Cl WX636056 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.279 Cc1cc(cnc1OC)C=O WX624205 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.279 Cc1cc(cnc1OC)CO WX640343 [0,1,0,0,0,0|2,0,0]=3 59 B11R2.36 Cc1ccc2c(c1)CNC2 WX604540 [0,0,0,1,0,0|3,0,0]=4 60 B11R2.36 Cc1ccc2c(c1)NCC2 WX604533 [0,0,0,1,0,0|3,0,0]=4 61 B11R2.36 c1c(cnc2c1CCC2)Br WXC01093 [0,0,0,1,0,0|2,0,0]=3 62 B11R2.36 c1c(cnc2c1CCN2)Br WX637403 [0,0,0,1,0,0|3,0,0]=4 63 B11R2.36 c1cc(nc2c1CCC2)Cl WXC03715 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.22 Cc1c(cn(n1)C)C=O WX624209 [0,0,0,0,1,0|2,0,1]=4 65 B9R1.22 Cc1c(sc(n1)C)C=O WX624192 [0,0,0,0,1,0|2,0,1]=4 66 B9R1.22 Cc1c(sc(n1)C)CN WX603014 [0,0,0,0,1,0|2,0,0]=3 67 B9R1.22 Cc1c(sc(n1)C)CO WX640322 [0,0,0,0,1,0|2,0,0]=3 68 B9R1.22 Cc1cc(n(n1)C)C#N WXC00831 [0,0,0,0,1,0|2,0,1]=4 69 B9R1.22 Cc1cc(n(n1)C)C=O WX624210 [0,0,0,0,1,0|2,0,1]=4 70 B9R1.22 Cc1cc(n(n1)C)CCl WX630293 [0,0,0,0,1,0|2,0,0]=3 71 B9R1.22 Cc1cc(n(n1)C)NC WX607142 [0,0,0,0,1,0|2,0,0]=3 72 B9R1.22 Cn1c(cc(n1)N)SC WXC00846 [0,0,0,0,1,0|3,0,0]=4 73 B8R1.2 CNc1cccnc1 WX609454 [2,0,0,0,0,0|2,0,0]=4 74 B8R1.2 CNc1cnccn1 WX606056 [2,0,0,0,0,0|1,0,0]=3 75 B8R1.2 c1cc(cnc1)CO WX640285 [2,0,0,0,0,0|2,0,0]=4 76 B8R1.2 c1ccnc(c1)CO WX640282 [2,0,0,0,0,0|2,0,0]=4 77 B8R1.2 c1cnc(cn1)C=O WX624187 [2,0,0,0,0,0|1,0,1]=4 78 B8R1.2 c1cnc(cn1)CN WX603036 [2,0,0,0,0,0|1,0,0]=3 79 B8R1.2 c1cnc(cn1)CO WX640335 [2,0,0,0,0,0|1,0,0]=3 80 B8R1.3 Cc1ccc(cn1)N WX609427 [2,0,0,0,0,0|2,0,0]=4 81 B8R1.3 Cc1ccc(cn1)O WX649092 [2,0,0,0,0,0|2,0,0]=4 82 B8R1.3 Cc1ccc(nc1)Br WX637311 [2,0,0,0,0,0|2,0,0]=4 83 B8R1.3 Cc1ccc(nc1)O WX649096 [2,0,0,0,0,0|2,0,0]=4 84 B8R1.3 Cc1cnc(cn1)Cl WX636238 [2,0,0,0,0,0|1,0,0]=3 85 B8R1.3 Cc1cnc(cn1)N WX606073 [2,0,0,0,0,0|1,0,0]=3 86 B8R1.3 Cc1cnc(cn1)N WX609221 [2,0,0,0,0,0|1,0,0]=3 87 B8R1.3 c1c(ncc(n1)Br)O WX645031 [2,0,0,0,0,0|2,0,0]=4 88 B8R1.5 Cc1c(cccn1)N WX609161 [2,0,0,0,0,0|2,0,0]=4 89 B8R1.5 Cc1c(cccn1)O WX649093 [2,0,0,0,0,0|2,0,0]=4 90 B8R1.5 Cc1cccnc1Cl WX636230 [2,0,0,0,0,0|2,0,0]=4 91 B8R1.5 Cc1cccnc1O WX649097 [2,0,0,0,0,0|2,0,0]=4 92 B8R1.5 c1cnc(c(n1)N)Cl WX609303 [2,0,0,0,0,0|2,0,0]=4 93 B8R1.4 Cc1cc(cnc1)N WX609450 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.4 Cc1cc(cnc1)O WX649090 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.4 Cc1cccc(n1)Br WX637312 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.4 Cc1cccc(n1)O WX649098 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.4 Cc1cncc(n1)Cl WX636239 [2,0,0,0,0,0|1,0,0]=3 98 B8R1.4 Cc1cncc(n1)N WX609148 [2,0,0,0,0,0|1,0,0]=3 99 B8R1.4 c1c(nc(cn1)Br)Cl WX637068 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.1 CCOc1ccc(nc1)Br WX637261 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.1 Cc1cnc(nc1)CCN WX607133 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.20 COc1c(cccn1)CCl WX630257 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.61 CC(C)c1c(cccn1)O WX645029 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.22 Cc1cc(=O)c(c([nH]1)C)C WXC03673 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.22 Cc1cc(nc(c1Br)C)C WXC04384 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.59 Cc1c(cn(n1)C)C(C)O WX642155 [0,1,0,0,1,0|1,0,0]=3 107 B10R1.130 Cc1cc(n(n1)CCBr)C WX630090 [0,1,0,0,1,0|2,0,0]=4 108 B10R1.130 Cc1cc(n(n1)CCN)C WX600115 [0,1,0,0,1,0|2,0,0]=4 109 B10R1.256 Cc1c(c(n(n1)C)C)CN WX603183 [0,1,0,0,1,0|2,0,0]=4 110 B10R2.2 C1Cc2c(sc(n2)N)C1 WX609531 [0,0,0,1,1,0|2,0,0]=4 111 B12R2.24 Cc1ccc2c(c1)CNCC2 WX604174 [0,1,0,1,0,0|2,0,0]=4 112 B12R2.24 Cc1ccc2c(c1)CNCC2 WX604735 [0,1,0,1,0,0|2,0,0]=4 113 B12R2.24 c1c(cnc2c1COCC2)N WX609077 [0,1,0,1,0,0|2,0,0]=4 114 B12R2.132 Cc1ccc2c(c1)C(CC2)O WX642123 [0,1,0,1,0,0|2,0,0]=4 115 B12R2.132 Cc1ccc2c(c1)[C@H](CC2)N WXC03237 [0,1,0,1,0,0|2,0,0]=4 116 B12R2.612 Cc1ccc2c(c1)CCC2O WX642032 [0,1,0,1,0,0|2,0,0]=4 117 B12R2.246 Cc1cc(nc2c1CCC2)O WX649105 [0,1,0,1,0,0|2,0,0]=4 118 B12R2.44 c1cc2c(cc1CBr)CCC2 WX630246 [0,1,0,1,0,0|2,0,0]=4 119 B12R2.44 c1cc2c(cc1CN)CCC2 WX603098 [0,1,0,1,0,0|2,0,0]=4 120 B8R1.1 CCc1cc(no1)N WX609361 [1,0,0,0,1,0|2,0,0]=4 121 B8R1.1 Cc1[nH]c(cn1)CO WX640040 [1,0,0,0,1,0|1,0,1]=4 122 B8R1.1 Cc1cc([nH]n1)CO WX640223 [1,0,0,0,1,0|2,0,0]=4 123 B8R1.1 Cc1cc([nH]n1)CO WX640340 [1,0,0,0,1,0|2,0,0]=4 124 B8R1.1 Cc1cc(no1)CCl WX630329 [1,0,0,0,1,0|2,0,0]=4 125 B8R1.1 Cc1cc(no1)CN WX603005 [1,0,0,0,1,0|2,0,0]=4 126 B8R1.1 Cc1cc(no1)CO WX640214 [1,0,0,0,1,0|2,0,0]=4 127 B8R1.1 Cc1cc(sc1)CN WX609034 [1,0,0,0,1,0|2,0,0]=4 128 B8R1.1 Cc1cc(sc1)CO WX640133 [1,0,0,0,1,0|2,0,0]=4 129 B8R1.1 Cc1coc(n1)CN WX600286 [1,0,0,0,1,0|2,0,0]=4 130 B8R1.1 Cc1nc(cs1)CCl WX630019 [1,0,0,0,1,0|2,0,0]=4 131 B8R1.1 Cc1nc(cs1)CCl WX630294 [1,0,0,0,1,0|2,0,0]=4 132 B8R1.1 Cc1nc(no1)CN WX607090 [1,0,0,0,1,0|2,0,0]=4 133 B8R1.1 Cc1nc(sn1)NC WX607032 [1,0,0,0,1,0|2,0,0]=4 134 B8R1.1 Cc1ncc(s1)CCl WX630056 [1,0,0,0,1,0|2,0,0]=4 135 B8R1.1 Cc1ncc(s1)CN WX609044 [1,0,0,0,1,0|2,0,0]=4 136 B8R1.1 Cc1ncc(s1)CO WX640102 [1,0,0,0,1,0|2,0,0]=4 137 B8R1.1 Cn1cc(cn1)CCl WX630248 [1,0,0,0,1,0|2,0,0]=4 138 B8R1.1 Cn1cc(cn1)CO WX640201 [1,0,0,0,1,0|2,0,0]=4 139 B8R1.1 Cn1cc(nc1)CO WX640041 [1,0,0,0,1,0|2,0,0]=4 140 B8R1.11 Cc1c(con1)CN WX603010 [1,0,0,0,1,0|2,0,0]=4 141 B8R1.11 Cc1c(nc[nH]1)CO WX640293 [1,0,0,0,1,0|1,0,1]=4 142 B8R1.11 Cc1c(scn1)CN WX609043 [1,0,0,0,1,0|2,0,0]=4 143 B8R1.11 Cc1c(scn1)CO WXC00854 [1,0,0,0,1,0|2,0,0]=4 144 B8R1.11 Cc1ccsc1CN WX609035 [1,0,0,0,1,0|2,0,0]=4 145 B8R1.11 Cc1ccsc1CO WX640140 [1,0,0,0,1,0|2,0,0]=4 146 B8R1.11 Cn1c(ccn1)CN WX603006 [1,0,0,0,1,0|2,0,0]=4 147 B8R1.11 Cn1c(ccn1)CO WX640357 [1,0,0,0,1,0|2,0,0]=4 148 B8R1.11 Cn1ccnc1CN WX609047 [1,0,0,0,1,0|2,0,0]=4 149 B8R1.18 Cc1c(cn(n1)C)Br WX637333 [1,0,0,0,1,0|2,0,0]=4 150 B8R1.18 Cc1c(cn(n1)C)N WX609169 [1,0,0,0,1,0|2,0,0]=4 151 B8R1.18 Cc1c(cn(n1)C)N WX609493 [1,0,0,0,1,0|2,0,0]=4 152 B8R1.18 Cc1c(sc(n1)N)C WX606003 [1,0,0,0,1,0|2,0,0]=4 153 B8R1.18 Cc1cc(n(n1)C)I WX638066 [1,0,0,0,1,0|2,0,0]=4 154 B8R1.18 Cc1cc(nn1C)N WX609107 [1,0,0,0,1,0|2,0,0]=4 155 B8R1.18 Cc1cn(c(n1)Br)C WX637337 [1,0,0,0,1,0|2,0,0]=4 156 B8R1.18 Cc1nc(cn1C)Br WX637065 [1,0,0,0,1,0|2,0,0]=4 157 B8R1.50 Cc1c(cnn1C)Br WX637332 [1,0,0,0,1,0|2,0,0]=4 158 B8R1.50 Cc1c(cnn1C)I WX638074 [1,0,0,0,1,0|2,0,0]=4 159 B8R1.50 Cc1c(cnn1C)N WX609482 [1,0,0,0,1,0|2,0,0]=4 160 B8R1.50 Cc1c(n(cn1)C)Br WX637338 [1,0,0,0,1,0|2,0,0]=4 161 B8R1.50 Cc1c(onc1N)C WXC03705 [1,0,0,0,1,0|2,0,0]=4 162 B8R1.50 Cc1ncc(n1C)Br WX637066 [1,0,0,0,1,0|2,0,0]=4