0 B9R1.11 CCC(=O)c1ccc[nH]1 WX626090 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.11 COC(=O)c1cc[nH]c1 WX618371 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.11 COC(=O)c1ccc[nH]1 WX618294 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.11 c1cc(oc1)C(CN)O WX600098 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.11 c1cc(sc1)\C(=N\O)\N WX690133 [0,0,0,0,0,0|3,1,0]=4 5 B8R1.7 CC(=O)c1c[nH]cn1 WX626016 [1,0,0,0,0,0|2,0,0]=3 6 B8R1.7 CC(=O)c1cc[nH]n1 WX626051 [1,0,0,0,0,0|2,0,0]=3 7 B8R1.7 CC(=O)c1cncs1 WX626015 [1,0,0,0,0,0|1,1,0]=3 8 B8R1.7 CC(c1cccs1)N WX609033 [1,0,0,0,0,0|1,1,1]=4 9 B8R1.7 CC(c1cccs1)O WX642064 [1,0,0,0,0,0|0,1,2]=4 10 B8R1.7 c1c(cn[nH]1)C(=O)O WX614069 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.7 c1c(con1)C(=O)O WX614066 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.7 c1c(nc[nH]1)C(=O)O WX614057 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.7 c1c(nco1)C(=O)O WX614087 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.7 c1c(ncs1)C(=O)N WX619024 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.7 c1c(nns1)C(=O)O WX613780 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.7 c1c(scn1)C(=O)O WX614255 [1,0,0,0,0,0|1,1,0]=3 17 B8R1.7 c1c[nH]cc1C(=O)O WX614253 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.7 c1c[nH]nc1C(=O)O WX614216 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.7 c1cn[nH]c1C(=O)O WX614248 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.7 c1cnc([nH]1)C(=O)O WX614140 [1,0,0,0,0,0|2,0,0]=3 21 B8R1.7 c1cnn(c1)C(=O)Cl WX616007 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.8 c1cc([nH]c1)\C=N\O WX690085 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.8 c1cc(oc1)CCO WX640320 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.11 CCOC(=O)C1=CCCC1 WX686604 [0,1,0,0,0,0|1,0,2]=4 25 B10R1.11 CCOC(=O)c1c[nH]nn1 WX618033 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.11 CCOC(=O)c1cc[nH]c1 WX618469 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.11 CCOC(=O)c1cc[nH]n1 WX618308 [0,1,0,0,0,0|2,0,0]=3 28 B10R1.11 CCOC(=O)c1cnc[nH]1 WX618277 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.11 CCOC(=O)c1cocn1 WX618478 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.11 CCOC(=O)c1csnn1 WX618020 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.11 CCOC(=O)c1ncon1 WX618516 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.11 c1cc([nH]c1)C(=O)CC#N WX683067 [0,1,0,0,0,0|2,0,1]=4 33 B10R1.11 c1cc(oc1)C(=O)CC#N WXC01120 [0,1,0,0,0,0|1,0,1]=3 34 B10R1.14 COC(=O)c1[nH]nc(n1)Br WX637250 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.14 COC(=O)c1cc([nH]c1)Br WX637266 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.14 COC(=O)c1cc([nH]n1)N WX609529 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.14 COC(=O)c1cc([nH]n1)O WX649063 [0,1,0,0,0,0|2,0,0]=3 38 B10R1.14 COC(=O)c1cc(c[nH]1)Br WX637166 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.14 COC(=O)c1cc(c[nH]1)I WX638068 [0,1,0,0,0,0|1,0,0]=2 40 B10R1.14 COC(=O)c1cc(co1)Br WX637394 [0,1,0,0,0,0|0,0,0]=1 41 B10R1.14 COC(=O)c1cc(no1)O WXC00884 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.14 COC(=O)c1ccc([nH]1)Br WX637230 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.14 COC(=O)c1ccc(o1)Br WXC00444 [0,1,0,0,0,0|0,0,0]=1 44 B10R1.14 COC(=O)c1ccc(s1)N WX606104 [0,1,0,0,0,0|0,1,0]=2 45 B10R1.14 COC(=O)c1cnc(s1)Cl WX636127 [0,1,0,0,0,0|1,1,0]=3 46 B10R1.14 Cc1cc(on1)C(=O)OC WX618482 [0,1,0,0,0,0|1,0,0]=2 47 B10R1.14 Cc1nc(sn1)C(=O)OC WX618520 [0,1,0,0,0,0|2,1,0]=4 48 B10R1.14 Cn1cnc(n1)C(=O)OC WXC00431 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.149 COC(=O)c1c(cc[nH]1)Br WXC01617 [0,1,0,0,0,0|1,0,0]=2 50 B10R1.149 Cc1cc[nH]c1C(=O)OC WX618007 [0,1,0,0,0,0|1,0,0]=2 51 B10R1.149 Cn1c(ccn1)C(=O)OC WX618160 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.149 Cn1c(ncn1)C(=O)OC WXC00430 [0,1,0,0,0,0|3,0,0]=4 53 B10R1.149 Cn1cncc1C(=O)OC WX618385 [0,1,0,0,0,0|2,0,0]=3 54 B10R1.15 COC(=O)c1ccncn1 WX618355 [0,0,0,0,0,1|1,0,0]=2 55 B10R1.15 COC(=O)c1ncccn1 WXC01002 [0,0,0,0,0,1|1,0,0]=2 56 B10R1.15 N=C(\c1ccccc1)/OC WXC04573 [0,0,0,0,0,1|2,0,0]=3 57 B10R1.15 c1ccc(cc1)C(=O)CF WXFC0145 [0,0,0,0,0,1|3,0,0]=4 58 B10R1.15 c1ccnc(c1)C(=O)CBr WX631026 [0,0,0,0,0,1|3,0,0]=4 59 B10R1.15 c1cnc(cn1)C(=O)NN WX684402 [0,0,0,0,0,1|3,0,0]=4 60 B10R1.15 c1cnccc1C(=O)CBr WX631022 [0,0,0,0,0,1|3,0,0]=4 61 B10R1.27 COC(=O)Cc1ccsc1 WXC02001 [0,0,0,0,0,1|2,0,0]=3 62 B10R1.27 COC(=O)Cc1nnco1 WX618390 [0,0,0,0,0,1|2,0,0]=3 63 B7R1.1 CNc1ncco1 WX606024 [2,0,0,0,0,0|2,0,0]=4 64 B7R1.1 c1c(nc[nH]1)C=O WX624178 [2,0,0,0,0,0|2,0,0]=4 65 B7R1.1 c1c(ocn1)CO WX640330 [2,0,0,0,0,0|1,0,1]=4 66 B7R1.1 c1c(scn1)C=O WX624055 [2,0,0,0,0,0|1,1,0]=4 67 B7R1.1 c1c[nH]nc1C=O WX624059 [2,0,0,0,0,0|2,0,0]=4 68 B7R1.1 c1cc(sc1)CO WX640288 [2,0,0,0,0,0|0,1,1]=4 69 B7R1.1 c1conc1C=O WX624030 [2,0,0,0,0,0|2,0,0]=4 70 B7R1.1 c1csc(n1)C=O WX624188 [2,0,0,0,0,0|1,1,0]=4 71 B9R0.23 CC(=O)NC(=C)C(=O)OC WX618322 [0,1,1,0,0,0|1,0,1]=4 72 B9R1.35 CC(=O)c1ccc(s1)Cl WXC03434 [1,1,0,0,0,0|0,1,0]=3 73 B9R1.35 Cc1[nH]cc(n1)C(=O)O WX614001 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.35 Cc1cc([nH]n1)C(=O)O WX614060 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.35 Cc1cc(c[nH]1)C(=O)O WX613080 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.35 Cc1cc(n[nH]1)C(=O)O WX614029 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.35 Cc1cc(no1)C(=O)C WX626024 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.35 Cc1cc(on1)C(=O)O WX614233 [1,1,0,0,0,0|1,0,0]=3 79 B9R1.35 Cc1cc(sc1)C(=O)O WX614259 [1,1,0,0,0,0|0,1,0]=3 80 B9R1.35 Cc1ccc(o1)C(=O)O WX614194 [1,1,0,0,0,0|0,0,0]=2 81 B9R1.35 Cc1ccc(s1)C(=O)O WX614260 [1,1,0,0,0,0|0,1,0]=3 82 B9R1.35 Cc1nc(cs1)C(=O)O WX612033 [1,1,0,0,0,0|2,0,0]=4 83 B9R1.35 Cc1nc(on1)C(=O)O WX613732 [1,1,0,0,0,0|2,0,0]=4 84 B9R1.35 Cc1ncc(s1)C(=O)O WX614123 [1,1,0,0,0,0|1,1,0]=4 85 B9R1.35 Cn1cc(nc1)C(=O)O WX614252 [1,1,0,0,0,0|2,0,0]=4 86 B9R1.35 Cn1ccc(c1)C(=O)O WX614122 [1,1,0,0,0,0|2,0,0]=4 87 B9R1.35 Cn1ccc(n1)C(=O)O WX614061 [1,1,0,0,0,0|2,0,0]=4 88 B9R1.35 c1c(c[nH]c1C(=O)O)F WXFS0405 [1,1,0,0,0,0|1,0,0]=3 89 B9R1.35 c1c(c[nH]c1Cl)C(=O)O WX614257 [1,1,0,0,0,0|2,0,0]=4 90 B9R1.35 c1c(nc(s1)Br)C(=O)O WX614040 [1,1,0,0,0,0|2,0,0]=4 91 B9R1.35 c1c(nc(s1)Cl)C(=O)O WXC02298 [1,1,0,0,0,0|2,0,0]=4 92 B9R1.41 CC(=O)c1ccnn1C WX626017 [1,1,0,0,0,0|2,0,0]=4 93 B9R1.41 Cc1c([nH]cn1)C(=O)O WX614250 [1,1,0,0,0,0|2,0,0]=4 94 B9R1.41 Cc1c(cc[nH]1)C(=O)O WX614100 [1,1,0,0,0,0|2,0,0]=4 95 B9R1.41 Cc1c(ocn1)C(=O)O WX614136 [1,1,0,0,0,0|1,0,0]=3 96 B9R1.41 Cc1c[nH]cc1C(=O)O WX614124 [1,1,0,0,0,0|2,0,0]=4 97 B9R1.41 Cc1cocc1C(=O)O WX613137 [1,1,0,0,0,0|2,0,0]=4 98 B9R1.41 Cc1cscc1C(=O)O WX614279 [1,1,0,0,0,0|2,0,0]=4 99 B9R1.41 Cn1c(ccn1)C(=O)O WX614032 [1,1,0,0,0,0|2,0,0]=4 100 B9R1.41 Cn1ccnc1C(=O)O WX614056 [1,1,0,0,0,0|2,0,0]=4 101 B9R1.41 Cn1cncc1C(=O)O WX614251 [1,1,0,0,0,0|2,0,0]=4 102 B9R1.41 c1c(c([nH]n1)C(=O)O)Cl WX614249 [1,1,0,0,0,0|2,0,0]=4 103 B9R1.41 c1c(c(cs1)Br)C(=O)O WXC02715 [1,1,0,0,0,0|2,0,0]=4 104 B9R1.41 c1coc(c1Br)C(=O)O WX614376 [1,1,0,0,0,0|0,0,0]=2 105 B11R1.16 CCOC(=O)c1cnccn1 WX618267 [0,1,0,0,0,1|1,0,0]=3 106 B11R1.22 CNC(=O)c1ccc(cc1)N WX609521 [0,1,0,0,0,1|2,0,0]=4 107 B11R1.22 COC(=O)c1ccc(cn1)N WX609344 [0,1,0,0,0,1|1,0,0]=3 108 B11R1.22 COC(=O)c1ccc(nc1)Cl WXC00297 [0,1,0,0,0,1|1,0,0]=3 109 B11R1.22 COC(=O)c1ccc(nn1)Br WX633109 [0,1,0,0,0,1|1,0,0]=3 110 B11R1.22 COC(=O)c1cnc(cn1)Br WX633106 [0,1,0,0,0,1|1,0,0]=3 111 B11R1.22 COC(=O)c1cnc(cn1)N WX609355 [0,1,0,0,0,1|1,0,0]=3 112 B11R1.22 COC(=O)c1ncc(cn1)Cl WX636084 [0,1,0,0,0,1|1,0,0]=3 113 B11R1.22 COC(=O)c1ncc(cn1)F WX618512 [0,1,0,0,0,1|1,0,0]=3 114 B11R1.22 Cc1ccc(cn1)C(=O)OC WX618268 [0,1,0,0,0,1|1,0,0]=3 115 B11R1.22 Cc1ccc(nc1)C(=O)OC WX618024 [0,1,0,0,0,1|1,0,0]=3 116 B11R1.22 Cc1cnc(cn1)C(=O)OC WX618477 [0,1,0,0,0,1|1,0,0]=3 117 B11R1.23 CNC(=O)c1cccc(c1)O WX645087 [0,1,0,0,0,1|2,0,0]=4 118 B11R1.23 COC(=O)c1cc(ccn1)N WX609078 [0,1,0,0,0,1|1,0,0]=3 119 B11R1.23 COC(=O)c1cc(cnc1)Cl WXC01375 [0,1,0,0,0,1|1,0,0]=3 120 B11R1.23 COC(=O)c1cccc(n1)F WXC01793 [0,1,0,0,0,1|1,0,0]=3 121 B11R1.23 COC(=O)c1cncc(=O)[nH]1 WX618240 [0,1,0,0,0,1|1,0,0]=3 122 B11R1.23 Cc1cc(cnc1)C(=O)OC WX618562 [0,1,0,0,0,1|1,0,0]=3 123 B11R1.222 CCC(=O)c1ccccc1Br WX626030 [0,1,0,0,0,1|2,0,0]=4 124 B11R1.222 CCC(=O)c1ccccc1Cl WXC00823 [0,1,0,0,0,1|2,0,0]=4 125 B11R1.222 COC(=O)c1ccc[nH]c1=O WX618226 [0,1,0,0,0,1|1,0,0]=3 126 B11R1.222 COC(=O)c1ccncc1Cl WX632025 [0,1,0,0,0,1|1,0,0]=3 127 B11R1.222 COC(=O)c1ccncc1F WXC00989 [0,1,0,0,0,1|1,0,0]=3 128 B11R1.222 COC(=O)c1ccncc1O WX649041 [0,1,0,0,0,1|1,0,0]=3 129 B11R1.222 Cc1cccnc1C(=O)OC WX618463 [0,1,0,0,0,1|1,0,0]=3 130 B11R1.30 CCOC(=O)Cc1nnco1 WX613761 [0,1,0,0,0,1|2,0,0]=4 131 B11R1.30 CCOC(=O)Cn1cccn1 WX618052 [0,1,0,0,0,1|2,0,0]=4 132 B11R1.31 COC(=O)C(=O)c1cccs1 WXC00019 [0,1,0,0,0,1|0,1,0]=3 133 B11R1.31 COC(=O)C(=O)c1ccsc1 WXC00018 [0,1,0,0,0,1|2,0,0]=4 134 B11R1.39 Cc1cc(no1)CC(=O)OC WX618377 [0,1,0,0,0,1|2,0,0]=4 135 B11R1.228 COC(=O)Cc1ccsc1Br WXC02002 [0,1,0,0,0,1|2,0,0]=4 136 B11R1.15 CCOC(=O)c1cc([nH]n1)N WX609158 [0,2,0,0,0,0|2,0,0]=4 137 B11R1.15 CCOC(=O)c1cc([nH]n1)O WX649074 [0,2,0,0,0,0|2,0,0]=4 138 B11R1.15 CCOC(=O)c1cc(no1)Br WX637016 [0,2,0,0,0,0|1,0,0]=3 139 B11R1.15 CCOC(=O)c1cnc([nH]1)N WX609291 [0,2,0,0,0,0|2,0,0]=4 140 B11R1.15 CCOC(=O)c1cnc(s1)Br WX618395 [0,2,0,0,0,0|1,1,0]=4 141 B11R1.15 CCOC(=O)c1cnc(s1)C WX618275 [0,2,0,0,0,0|1,1,0]=4 142 B11R1.15 CCOC(=O)c1csc(n1)Br WX637047 [0,2,0,0,0,0|2,0,0]=4 143 B11R1.15 CCOC(=O)c1csc(n1)C WX618254 [0,2,0,0,0,0|2,0,0]=4 144 B11R1.15 CCOC(=O)c1nc(no1)Br WXC00774 [0,2,0,0,0,0|2,0,0]=4 145 B11R1.15 CCOC(=O)c1nc(no1)C WX618210 [0,2,0,0,0,0|2,0,0]=4 146 B11R1.15 CCOC(=O)n1ccc(n1)N WXC03443 [0,2,0,0,0,0|2,0,0]=4 147 B11R1.199 CCOC(=O)c1c(c[nH]n1)Br WX637154 [0,2,0,0,0,0|2,0,0]=4 148 B11R1.199 CCOC(=O)c1c(c[nH]n1)Cl WX636240 [0,2,0,0,0,0|2,0,0]=4 149 B11R1.199 CCOC(=O)c1c(nc[nH]1)C WX618483 [0,2,0,0,0,0|2,0,0]=4 150 B11R1.199 CCOC(=O)c1c(ncs1)N WX606076 [0,2,0,0,0,0|1,1,0]=4 151 B11R1.199 CCOC(=O)c1c(ocn1)C WX618211 [0,2,0,0,0,0|2,0,0]=4 152 B11R1.199 CCOC(=O)c1c(scn1)C WX618474 [0,2,0,0,0,0|2,0,0]=4 153 B11R1.199 CCOC(=O)c1c(scn1)I WX638070 [0,2,0,0,0,0|2,0,0]=4 154 B11R1.199 CCOC(=O)c1cc[nH]c1C WX618048 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.199 CCOC(=O)c1ccnn1C WX618332 [0,2,0,0,0,0|2,0,0]=4 156 B11R1.199 CCOC(=O)c1cscc1C WX618132 [0,2,0,0,0,0|2,0,0]=4 157 B11R1.44 COC(=O)c1cc(sc1)C=O WX624038 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.44 COC(=O)c1coc(n1)CCl WX630102 [0,2,0,0,0,0|2,0,0]=4 159 B11R1.44 COC(=O)c1csc(n1)CN WX600192 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.44 COc1cc(on1)C(=O)OC WXC00886 [0,2,0,0,0,0|1,0,0]=3 161 B11R1.225 Cc1cc(c([nH]1)C)C(=O)OC WXC04289 [0,2,0,0,0,0|2,0,0]=4 162 B11R1.225 Cc1cc(c(s1)Br)C(=O)OC WX637218 [0,2,0,0,0,0|2,0,0]=4 163 B11R1.225 Cc1cc(c(s1)N)C(=O)OC WX609362 [0,2,0,0,0,0|2,0,0]=4 164 B11R1.225 Cc1cc(n(n1)C)C(=O)OC WXC00828 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.225 Cc1cc(oc1C(=O)OC)Br WXC03034 [0,2,0,0,0,0|0,0,0]=2 166 B11R1.225 Cn1c(cc(n1)O)C(=O)OC WXC00843 [0,2,0,0,0,0|2,0,0]=4 167 B11R1.225 Cn1cc(cc1C(=O)OC)Br WX618278 [0,2,0,0,0,0|1,0,0]=3 168 B11R1.226 COC(=O)c1cc(c([nH]1)Cl)Cl WX636266 [0,2,0,0,0,0|1,0,0]=3 169 B11R1.226 COC(=O)c1cc(c(o1)Br)Br WX637393 [0,2,0,0,0,0|0,0,0]=2 170 B11R1.865 COC(=O)c1c(c(cs1)Br)F WXC02005 [0,2,0,0,0,0|0,1,0]=3 171 B11R1.865 Cc1c(c(on1)C(=O)OC)N WXC01108 [0,2,0,0,0,0|1,0,0]=3 172 B11R1.865 Cn1c(cnc1S)C(=O)OC WXC02107 [0,2,0,0,0,0|2,0,0]=4 173 B11R1.875 Cn1c(c(cn1)Br)C(=O)OC WX637373 [0,2,0,0,0,0|2,0,0]=4 174 B9R1.15 CCc1c(cccn1)O WX649107 [0,0,1,1,0,0|2,0,0]=4 175 B9R1.15 COc1c(cccn1)Br WX637046 [0,0,1,1,0,0|2,0,0]=4 176 B9R1.2 COc1cc(ccn1)O WX645099 [0,0,1,1,0,0|2,0,0]=4 177 B9R1.2 COc1cccc(n1)I WXC00054 [0,0,1,1,0,0|2,0,0]=4 178 B11R2.1 c1cc2c(nc1)C(=O)CC2 WX626094 [0,0,0,1,0,1|2,0,0]=4 179 B11R2.1 c1ccc2c(c1)CNC2=O WX619030 [0,0,0,1,0,1|2,0,0]=4 180 B11R2.106 c1coc2c1CCCC2=O WXC02601 [0,1,0,1,0,0|1,0,0]=3 181 B9R1.6 c1c(cncn1)C(=O)O WX614058 [1,0,0,0,0,1|2,0,0]=4 182 B9R1.6 c1cnc(nc1)C(=O)O WX614147 [1,0,0,0,0,1|1,0,0]=3 183 B9R1.6 c1cncnc1C(=O)O WX614254 [1,0,0,0,0,1|1,0,0]=3 184 B11R1.25 COC(=O)CCc1c[nH]cn1 WXC03742 [0,0,0,0,0,2|2,0,0]=4 185 B11R1.25 COC(=O)\C=C\c1cccs1 WXC03261 [0,0,0,0,0,2|0,1,0]=3