0 B10R1.25 CCc1ccc(cc1Br)O MB23966 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.25 CCc1ccc(cc1C)O MB23913 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.25 CCc1ccc(cc1Cl)O MB23969 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.25 CCc1ccc(cc1F)O MB14963 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.25 CCc1ccc(cc1I)O MB23946 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.25 CCc1ccc(cc1N)O MB23949 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.25 CCc1ccc(cc1O)Br MB23992 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.25 CCc1ccc(cc1O)Cl MB23993 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.25 CCc1ccc(cc1O)F MB23841 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.25 CCc1ccc(cc1O)I MB23846 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.25 CCc1ccc(cc1O)N MB23852 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.25 CCc1ccc(nc1N)C AB03677 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.25 CNc1ccc(cc1F)O MB31256 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.25 CNc1ccc(cc1I)O MB37121 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.25 CNc1ccc(cc1N)O MB30558 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.25 CNc1ccc(cc1O)Cl MB25839 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.25 CNc1ccc(cc1O)N MB33015 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.25 COc1c(cc(cn1)Br)O PB15354 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.25 COc1ccc(cc1Cl)Br AB03565 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.25 COc1ccc(cc1Cl)O MB13556 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.25 COc1ccc(cc1F)Br AB01075 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.25 COc1ccc(cc1I)O MB26647 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.25 COc1ccc(cc1N)O MB34521 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.25 COc1ccc(cc1O)Cl MB09234 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.25 COc1ccc(cc1O)I MB38179 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.25 COc1cnc(cc1O)Cl AB69306 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.25 CSc1ccc(cc1Br)O MB25524 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.25 CSc1ccc(cc1Cl)O MB38487 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.25 CSc1ccc(cc1F)O MB25544 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.25 CSc1ccc(cc1N)O MB34593 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.25 CSc1ccc(cc1O)Br MB35434 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.25 CSc1ccc(cc1O)F MB25440 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.25 CSc1ccc(cc1O)I MB29501 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.25 CSc1ccc(cc1O)N MB36502 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.25 Cc1c(ncc(n1)Br)C=O AB85714 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.25 Cc1c(ncc(n1)Cl)C=O AB85687 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.25 Cc1cc(c(cn1)C#N)N AB40705 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.25 Cc1cc(c(cn1)C=O)Br AB66855 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.25 Cc1cc(c(cn1)C=O)Cl AB66849 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.25 Cc1cc(c(cn1)C=O)F AB75172 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.25 Cc1cc(c(cn1)C=O)N AB83689 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [0,0,0,0,0,0|1,0,0]=1 44 B10R1.25 Cc1cc(c(cn1)CCl)Cl AB83327 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.25 Cc1cc(c(cn1)CCl)F AB83045 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.25 Cc1cc(c(cn1)CN)Br AB68171 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.25 Cc1cc(c(cn1)CN)Cl AB68154 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.25 Cc1cc(c(cn1)CN)F AB83048 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.25 Cc1cc(c(nc1)C#N)C AB22974 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.25 Cc1cc(c(nc1)C#N)N AB64065 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.25 Cc1cc(c(nc1)C=O)Cl AB75087 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.25 Cc1cc(c(nc1)C=O)F AB75163 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [0,0,0,0,0,0|2,0,0]=2 55 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,0,0,0,0,0|1,0,0]=1 56 B10R1.25 Cc1cc(c(nc1)CCl)C AB44395 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.25 Cc1cc(c(nc1)CCl)Cl AB75094 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.25 Cc1cc(c(nc1)CCl)F AB76356 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.25 Cc1cc(c(nc1)CN)C AB53521 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.25 Cc1cc(c(nc1)CN)Cl AB75093 [0,0,0,0,0,0|3,0,1]=4 61 B10R1.25 Cc1cc(c(nc1)CN)F AB75165 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.25 Cc1cc(c(nc1)CO)C AB53524 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.25 Cc1cc(c(nc1)OC)N AB66728 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.25 Cc1cc(ccc1C#N)Cl MB00421 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.25 Cc1cc(ccc1C#N)O MB23389 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.25 Cc1cc(ccc1NC)O MB05083 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.25 Cc1cc(ccc1OC)O MB07842 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.25 Cc1cc(ncc1C=O)Br AB67814 [0,0,0,0,0,0|3,0,0]=3 72 B10R1.25 Cc1cc(ncc1C=O)C AB74124 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.25 Cc1cc(ncc1C=O)Cl AB32140 [0,0,0,0,0,0|3,0,0]=3 74 B10R1.25 Cc1cc(ncc1C=O)F AB75824 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.25 Cc1cc(ncc1CCl)C AB75393 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.25 Cc1cc(ncc1CN)C AB62611 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.25 Cc1ccc(c(c1)F)NN AB27888 [0,0,0,0,0,0|3,0,0]=3 78 B10R1.25 Cc1ccc(c(c1)N)C#N AB04357 [0,0,0,0,0,0|2,0,1]=3 79 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,0,0,0,0,0|1,0,0]=1 80 B10R1.25 Cc1ccc(c(c1)O)C#N AB11820 [0,0,0,0,0,0|1,0,1]=2 81 B10R1.25 Cc1ccc(c(c1)O)CN MB15038 [0,0,0,0,0,0|1,0,1]=2 82 B10R1.25 Cc1ccc(c(c1)O)NC MB33283 [0,0,0,0,0,0|2,0,0]=2 83 B10R1.25 Cc1ccc(c(c1)O)SC MB02032 [0,0,0,0,0,0|2,0,0]=2 84 B10R1.25 Cc1ccc(c(n1)Br)C#N PB29361 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.25 Cc1ccc(c(n1)Br)C=O AB55809 [0,0,0,0,0,0|2,0,0]=2 86 B10R1.25 Cc1ccc(c(n1)Br)CN AB68158 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.25 Cc1ccc(c(n1)Br)OC AB25427 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [0,0,0,0,0,0|2,0,0]=2 89 B10R1.25 Cc1ccc(c(n1)Cl)C#N PB12067 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.25 Cc1ccc(c(n1)Cl)C=O AB32135 [0,0,0,0,0,0|2,0,0]=2 91 B10R1.25 Cc1ccc(c(n1)Cl)CN AB23323 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [0,0,0,0,0,0|2,0,0]=2 93 B10R1.25 Cc1ccc(c(n1)N)CCl AB76121 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,0,0,0,0,0|1,0,0]=1 95 B10R1.25 Cc1cnc(c(n1)C)C=O AB73104 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.25 Cc1ncc(c(n1)N)C=O AB53802 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.25 Cc1ncc(c(n1)O)CO AB48547 [0,0,0,0,0,0|2,0,2]=4 98 B10R1.25 c1c(c(cnc1Br)C=O)Cl AB67260 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.25 c1c(c(cnc1Br)C=O)F AB68032 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.25 c1c(c(cnc1Br)C=O)N AB68108 [0,0,0,0,0,0|3,0,0]=3 101 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [0,0,0,0,0,0|2,0,0]=2 102 B10R1.25 c1c(c(cnc1Cl)C=O)Br AB67955 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.25 c1c(c(cnc1Cl)C=O)Cl PB13495 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.25 c1c(c(cnc1Cl)C=O)F AB68027 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.25 c1c(c(cnc1Cl)C=O)N AB52769 [0,0,0,0,0,0|3,0,0]=3 106 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [0,0,0,0,0,0|2,0,0]=2 107 B10R1.25 c1c(c(cnc1F)C=O)Cl AB75063 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.25 c1c(c(cnc1N)C=O)Cl AB71947 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.25 c1c(c(cnc1N)C=O)N AB43397 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [0,0,0,0,0,0|2,0,0]=2 111 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [0,0,0,0,0,0|2,0,0]=2 112 B10R1.25 c1c(c(nc(n1)Cl)Cl)C=O PB16366 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.25 c1c(c(nc(n1)Cl)N)C=O AB76994 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.25 c1c(c(nc(n1)N)Cl)C=O AB55843 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.25 c1c(c(nc(n1)N)N)C=O AB21344 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.25 c1c(cnc(c1Br)C=O)Br AB48580 [0,0,0,0,0,0|3,0,0]=3 117 B10R1.25 c1c(cnc(c1Cl)C=O)F AB70954 [0,0,0,0,0,0|3,0,0]=3 118 B10R1.25 c1c(cnc(c1F)C=O)Br PB11091 [0,0,0,0,0,0|3,0,0]=3 119 B10R1.25 c1c(cnc(c1F)C=O)Cl AB70957 [0,0,0,0,0,0|3,0,0]=3 120 B10R1.25 c1c(cnc(c1N)C=O)Br AB83734 [0,0,0,0,0,0|3,0,0]=3 121 B10R1.25 c1c(cnc(c1N)C=O)Cl AB83735 [0,0,0,0,0,0|3,0,0]=3 122 B10R1.25 c1c(cnc(c1N)C=O)N AB83749 [0,0,0,0,0,0|3,0,0]=3 123 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [0,0,0,0,0,0|2,0,0]=2 124 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [0,0,0,0,0,0|2,0,0]=2 125 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [0,0,0,0,0,0|2,0,0]=2 126 B10R1.25 c1c(nc(c(n1)C=O)Cl)Cl PB10747 [0,0,0,0,0,0|4,0,0]=4 127 B10R1.25 c1c(nc(c(n1)C=O)N)Br AB72512 [0,0,0,0,0,0|4,0,0]=4 128 B10R1.25 c1c(nc(c(n1)C=O)N)Cl AB72515 [0,0,0,0,0,0|4,0,0]=4 129 B10R1.25 c1cc(c(cc1Br)Br)C#N AB66754 [0,0,0,0,0,0|3,0,1]=4 130 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,0,0,0,0,0|2,0,0]=2 131 B10R1.25 c1cc(c(cc1Br)F)C#N AB03862 [0,0,0,0,0,0|3,0,1]=4 132 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,0,0,0,0,0|2,0,0]=2 133 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [0,0,0,0,0,0|2,0,2]=4 134 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,0,0,0,0,0|1,0,0]=1 135 B10R1.25 c1cc(c(cc1Br)O)CN MB08429 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,0,0,0,0,0|2,0,0]=2 137 B10R1.25 c1cc(c(cc1Cl)Br)CO MB06939 [0,0,0,0,0,0|2,0,2]=4 138 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,0,0,0,0,0|2,0,0]=2 139 B10R1.25 c1cc(c(cc1Cl)O)C#N MB01011 [0,0,0,0,0,0|2,0,1]=3 140 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,0,0,0,0,0|1,0,0]=1 141 B10R1.25 c1cc(c(cc1Cl)O)CN MB26819 [0,0,0,0,0,0|2,0,1]=3 142 B10R1.25 c1cc(c(cc1F)Br)C#N AB06855 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,0,0,0,0,0|2,0,0]=2 144 B10R1.25 c1cc(c(cc1F)Br)CO AB06857 [0,0,0,0,0,0|2,0,2]=4 145 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,0,0,0,0,0|2,0,0]=2 146 B10R1.25 c1cc(c(cc1F)N)CN AB50268 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.25 c1cc(c(cc1F)O)C#N MB13366 [0,0,0,0,0,0|2,0,1]=3 148 B10R1.25 c1cc(c(cc1F)O)CN MB14866 [0,0,0,0,0,0|2,0,1]=3 149 B10R1.25 c1cc(c(cc1I)O)C#N MB11881 [0,0,0,0,0,0|2,0,1]=3 150 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,0,0,0,0,0|1,0,0]=1 151 B10R1.25 c1cc(c(cc1I)O)CN MB10252 [0,0,0,0,0,0|2,0,1]=3 152 B10R1.25 c1cc(c(cc1N)F)C#N AB32067 [0,0,0,0,0,0|3,0,1]=4 153 B10R1.25 c1cc(c(cc1N)F)CBr AB56061 [0,0,0,0,0,0|3,0,1]=4 154 B10R1.25 c1cc(c(cc1N)F)CN AB50282 [0,0,0,0,0,0|3,0,1]=4 155 B10R1.25 c1cc(c(cc1N)O)C#N AB53481 [0,0,0,0,0,0|2,0,1]=3 156 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,0,0,0,0,0|1,0,0]=1 157 B10R1.25 c1cc(c(cc1N)O)CN MB10253 [0,0,0,0,0,0|2,0,1]=3 158 B10R1.25 c1cc(c(cc1O)Br)C#N MB14756 [0,0,0,0,0,0|3,0,1]=4 159 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,0,0,0,0,0|2,0,0]=2 160 B10R1.25 c1cc(c(cc1O)Cl)CN MB02722 [0,0,0,0,0,0|3,0,1]=4 161 B10R1.25 c1cc(c(cc1O)F)C#N AB04647 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.25 c1cc(c(cc1O)F)CN MB02723 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.25 c1cc(c(cc1O)I)C#N MB14759 [0,0,0,0,0,0|3,0,1]=4 164 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,0,0,0,0,0|2,0,0]=2 165 B10R1.25 c1cc(c(cc1O)N)C#N MB14762 [0,0,0,0,0,0|3,0,1]=4 166 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,0,0,0,0,0|2,0,0]=2 167 B10R1.25 c1cc(c(cc1O)N)CN MB29325 [0,0,0,0,0,0|3,0,1]=4 168 B10R1.25 c1cc(nc(c1C=O)Br)Br PB20462 [0,0,0,0,0,0|3,0,0]=3 169 B10R1.25 c1cc(nc(c1C=O)Br)Cl AB64562 [0,0,0,0,0,0|3,0,0]=3 170 B10R1.25 c1cc(nc(c1C=O)Cl)Cl PB17413 [0,0,0,0,0,0|3,0,0]=3 171 B10R1.25 c1cc(nc(c1C=O)F)Br AB70853 [0,0,0,0,0,0|3,0,0]=3 172 B10R1.25 c1cc(nc(c1C=O)N)Br AB69709 [0,0,0,0,0,0|3,0,0]=3 173 B10R1.25 c1cc(nc(c1C=O)N)Cl AB69707 [0,0,0,0,0,0|3,0,0]=3 174 B10R1.25 c1cc(nc(c1C=O)N)N AB76145 [0,0,0,0,0,0|3,0,0]=3 175 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [0,0,0,0,0,0|2,0,0]=2 176 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [0,0,0,0,0,0|2,0,0]=2 177 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [0,0,0,0,0,0|2,0,0]=2 178 B9R1.1 C#Cc1ccc(cc1)Cl PB21668 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.1 Cc1ccc(cn1)C#N PB30561 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.1 Cc1ccc(cn1)C=C PB17233 [1,0,0,0,0,0|2,0,0]=3 181 B9R1.1 Cc1ccc(cn1)C=O PB17503 [1,0,0,0,0,0|1,0,0]=2 182 B9R1.1 Cc1ccc(cn1)CCl AB59938 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.1 Cc1ccc(cn1)CN PB20145 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.1 Cc1ccc(cn1)NN PB15841 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.1 Cc1ccc(cn1)OC AB52739 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.1 Cc1ccc(nc1)C=O AB31466 [1,0,0,0,0,0|1,0,0]=2 187 B9R1.1 Cc1ccc(nc1)CCl AB59994 [1,0,0,0,0,0|2,0,1]=4 188 B9R1.1 Cc1ccc(nc1)CN AB48926 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.1 Cc1ccc(nn1)C=O AB44106 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 Cc1cnc(cn1)C=O PB23818 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.1 Cc1cnc(nc1)C=O PB31489 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.1 Cc1ncc(cn1)C=O PB13046 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.1 [C-]#[N+]c1ccc(cc1)Cl MB03556 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.1 c1c(cnc(n1)C=O)Br AB59082 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.1 c1c(cnc(n1)C=O)Cl PB22417 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.1 c1c(cnc(n1)C=O)F PB26883 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.1 c1c(cnc(n1)C=O)N AB58984 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 c1c(cnc(n1)C=O)O AB59744 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 c1c(cnc(n1)Cl)C=O PB31481 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 c1c(cnc(n1)N)C=O PB12291 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 c1c(cnc(n1)O)C=O AB58472 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 c1c(ncc(n1)Cl)C=O PB20478 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.1 c1cc(ccc1CBr)Br AB00113 [1,0,0,0,0,0|2,0,1]=4 204 B9R1.1 c1cc(ccc1CBr)Cl AB01810 [1,0,0,0,0,0|2,0,1]=4 205 B9R1.1 c1cc(ccc1CI)O MB06957 [1,0,0,0,0,0|2,0,1]=4 206 B9R1.1 c1cc(ccc1CN)O AB11678 [1,0,0,0,0,0|2,0,1]=4 207 B9R1.1 c1cc(ncc1Br)C=O PB30785 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.1 c1cc(ncc1C=O)Br PB27654 [1,0,0,0,0,0|2,0,0]=3 209 B9R1.1 c1cc(ncc1C=O)Cl PB18586 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.1 c1cc(ncc1C=O)F PB23560 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.1 c1cc(ncc1C=O)N PB19003 [1,0,0,0,0,0|2,0,0]=3 212 B9R1.1 c1cc(ncc1Cl)C=O AB44880 [1,0,0,0,0,0|2,0,0]=3 213 B9R1.1 c1cc(ncc1F)C=O AB42648 [1,0,0,0,0,0|2,0,0]=3 214 B9R1.1 c1cc(ncc1N)C=O AB67740 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.1 c1cc(ncc1O)C=O AB59867 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.1 c1cc(nnc1C=O)Cl PB13298 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.15 C#Cc1ccccc1Br AB10375 [1,0,0,0,0,0|2,0,1]=4 218 B9R1.15 C#Cc1cccnc1O AB69073 [1,0,0,0,0,0|2,0,1]=4 219 B9R1.15 CCc1c(cccn1)O MB01433 [1,0,0,0,0,0|2,0,1]=4 220 B9R1.15 CCc1ccncc1O MB12325 [1,0,0,0,0,0|2,0,1]=4 221 B9R1.15 CCc1cnccc1O MB24095 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.15 CNc1ccncc1O MB27525 [1,0,0,0,0,0|3,0,0]=4 223 B9R1.15 CNc1cnccc1O MB29366 [1,0,0,0,0,0|3,0,0]=4 224 B9R1.15 COc1c(cccn1)O AB06074 [1,0,0,0,0,0|3,0,0]=4 225 B9R1.15 COc1cccnc1O AB43293 [1,0,0,0,0,0|3,0,0]=4 226 B9R1.15 COc1ccncc1O MB09117 [1,0,0,0,0,0|3,0,0]=4 227 B9R1.15 COc1cnccc1O MB25455 [1,0,0,0,0,0|3,0,0]=4 228 B9R1.15 CSc1c(cccn1)O MB01598 [1,0,0,0,0,0|3,0,0]=4 229 B9R1.15 CSc1ccncc1O MB25632 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.15 CSc1cnccc1O MB31499 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.15 Cc1c(cccn1)C=O PB27878 [1,0,0,0,0,0|2,0,0]=3 232 B9R1.15 Cc1c(nccn1)C=O PB13166 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.15 Cc1cccnc1C=O PB14292 [1,0,0,0,0,0|2,0,0]=3 234 B9R1.15 Cc1ccncc1C=O PB23498 [1,0,0,0,0,0|2,0,0]=3 235 B9R1.15 Cc1cnccc1C=O AB11481 [1,0,0,0,0,0|2,0,0]=3 236 B9R1.15 c1c(c(ncn1)Cl)C=O AB65173 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.15 c1c(c(ncn1)N)C=O AB55705 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.15 c1cc(c(nc1)Br)C=O AB20862 [1,0,0,0,0,0|2,0,0]=3 239 B9R1.15 c1cc(c(nc1)C=O)Br AB42598 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.15 c1cc(c(nc1)C=O)F PB22063 [1,0,0,0,0,0|2,0,0]=3 241 B9R1.15 c1cc(c(nc1)C=O)N AB42378 [1,0,0,0,0,0|2,0,0]=3 242 B9R1.15 c1cc(c(nc1)C=O)O PB12355 [1,0,0,0,0,0|1,0,0]=2 243 B9R1.15 c1cc(c(nc1)CN)O MB01728 [1,0,0,0,0,0|2,0,1]=4 244 B9R1.15 c1cc(c(nc1)CO)O MB00702 [1,0,0,0,0,0|1,0,2]=4 245 B9R1.15 c1cc(c(nc1)Cl)C=O PB27532 [1,0,0,0,0,0|2,0,0]=3 246 B9R1.15 c1cc(c(nc1)F)C=O AB13640 [1,0,0,0,0,0|2,0,0]=3 247 B9R1.15 c1cc(c(nc1)N)C=O AB09963 [1,0,0,0,0,0|2,0,0]=3 248 B9R1.15 c1cc(c(nc1)O)C#N PB21004 [1,0,0,0,0,0|2,0,1]=4 249 B9R1.15 c1cc(c(nc1)O)C=O AB55041 [1,0,0,0,0,0|1,0,0]=2 250 B9R1.15 c1cc(c(nc1)O)CO AB52938 [1,0,0,0,0,0|1,0,2]=4 251 B9R1.15 c1ccc(c(c1)C=O)I PB15618 [1,0,0,0,0,0|1,0,0]=2 252 B9R1.15 c1ccc(c(c1)CI)O MB07048 [1,0,0,0,0,0|1,0,1]=3 253 B9R1.15 c1ccc(c(c1)CN)O MB01565 [1,0,0,0,0,0|1,0,1]=3 254 B9R1.15 c1cnc(c(n1)C=O)Cl AB32644 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.15 c1cnc(c(n1)C=O)N PB10822 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.15 c1cncc(c1Br)C=O AB25683 [1,0,0,0,0,0|2,0,0]=3 257 B9R1.15 c1cncc(c1Br)C=O AB53933 [1,0,0,0,0,0|2,0,0]=3 258 B9R1.15 c1cncc(c1C#N)O MB12322 [1,0,0,0,0,0|2,0,1]=4 259 B9R1.15 c1cncc(c1C=O)Br PB17335 [1,0,0,0,0,0|2,0,0]=3 260 B9R1.15 c1cncc(c1C=O)Cl AB23043 [1,0,0,0,0,0|2,0,0]=3 261 B9R1.15 c1cncc(c1C=O)F PB32422 [1,0,0,0,0,0|2,0,0]=3 262 B9R1.15 c1cncc(c1C=O)N PB20170 [1,0,0,0,0,0|2,0,0]=3 263 B9R1.15 c1cncc(c1C=O)O AB08714 [1,0,0,0,0,0|1,0,0]=2 264 B9R1.15 c1cncc(c1CN)O MB09249 [1,0,0,0,0,0|2,0,1]=4 265 B9R1.15 c1cncc(c1Cl)C=O AB17590 [1,0,0,0,0,0|2,0,0]=3 266 B9R1.15 c1cncc(c1F)C=O AB32109 [1,0,0,0,0,0|2,0,0]=3 267 B9R1.15 c1cncc(c1N)C=O AB12471 [1,0,0,0,0,0|2,0,0]=3 268 B9R1.15 c1cncc(c1N)C=O PB27639 [1,0,0,0,0,0|2,0,0]=3 269 B9R1.15 c1cncc(c1O)C#N MB01597 [1,0,0,0,0,0|2,0,1]=4 270 B9R1.15 c1cncc(c1O)C=O AB59870 [1,0,0,0,0,0|1,0,0]=2 271 B9R1.15 c1cncc(c1O)CN MB35531 [1,0,0,0,0,0|2,0,1]=4 272 B9R1.69 Cc1cc(c(cn1)Br)Cl PB25215 [1,0,0,0,0,0|3,0,0]=4 273 B9R1.69 Cc1cc(c(cn1)Br)F AB74992 [1,0,0,0,0,0|3,0,0]=4 274 B9R1.69 Cc1cc(c(cn1)Br)N PB10415 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.69 Cc1cc(c(cn1)C)Br AB05202 [1,0,0,0,0,0|2,0,1]=4 276 B9R1.69 Cc1cc(c(cn1)C)N AB05308 [1,0,0,0,0,0|2,0,1]=4 277 B9R1.69 Cc1cc(c(cn1)C)O AB66580 [1,0,0,0,0,0|1,0,1]=3 278 B9R1.69 Cc1cc(c(cn1)Cl)Br AB71664 [1,0,0,0,0,0|3,0,0]=4 279 B9R1.69 Cc1cc(c(cn1)Cl)I AB71748 [1,0,0,0,0,0|3,0,0]=4 280 B9R1.69 Cc1cc(c(cn1)Cl)N AB40682 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.69 Cc1cc(c(cn1)Cl)O AB69303 [1,0,0,0,0,0|2,0,0]=3 282 B9R1.69 Cc1cc(c(cn1)F)Br AB74121 [1,0,0,0,0,0|3,0,0]=4 283 B9R1.69 Cc1cc(c(cn1)F)N AB70850 [1,0,0,0,0,0|3,0,0]=4 284 B9R1.69 Cc1cc(c(cn1)N)Br AB68541 [1,0,0,0,0,0|3,0,0]=4 285 B9R1.69 Cc1cc(c(cn1)N)Cl AB64291 [1,0,0,0,0,0|3,0,0]=4 286 B9R1.69 Cc1cc(c(cn1)N)F AB73537 [1,0,0,0,0,0|3,0,0]=4 287 B9R1.69 Cc1cc(c(cn1)N)N AB51224 [1,0,0,0,0,0|3,0,0]=4 288 B9R1.69 Cc1cc(c(cn1)O)Cl AB75747 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.69 Cc1cc(c(cn1)O)F AB74750 [1,0,0,0,0,0|2,0,1]=4 290 B9R1.69 Cc1cc(c(nc1)Br)C AB05204 [1,0,0,0,0,0|3,0,0]=4 291 B9R1.69 Cc1cc(c(nc1)Br)Cl AB53543 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.69 Cc1cc(c(nc1)Br)F AB55034 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.69 Cc1cc(c(nc1)C)Br AB05199 [1,0,0,0,0,0|2,0,1]=4 294 B9R1.69 Cc1cc(c(nc1)C)N AB66586 [1,0,0,0,0,0|2,0,1]=4 295 B9R1.69 Cc1cc(c(nc1)C)O AB65617 [1,0,0,0,0,0|1,0,1]=3 296 B9R1.69 Cc1cc(c(nc1)Cl)Br AB09970 [1,0,0,0,0,0|3,0,0]=4 297 B9R1.69 Cc1cc(c(nc1)Cl)N AB15085 [1,0,0,0,0,0|3,0,0]=4 298 B9R1.69 Cc1cc(c(nc1)Cl)O AB53552 [1,0,0,0,0,0|2,0,0]=3 299 B9R1.69 Cc1cc(c(nc1)F)Br AB13665 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.69 Cc1cc(c(nc1)F)N AB66726 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.69 Cc1cc(c(nc1)F)O AB71300 [1,0,0,0,0,0|2,0,0]=3 302 B9R1.69 Cc1cc(c(nc1)N)Br AB02784 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.69 Cc1cc(c(nc1)N)C AB62796 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.69 Cc1cc(c(nc1)N)Cl AB32106 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.69 Cc1cc(c(nc1)N)F AB66724 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.69 Cc1cc(c(nc1)N)N AB16874 [1,0,0,0,0,0|3,0,0]=4 307 B9R1.69 Cc1cc(c(nc1)O)Br AB16221 [1,0,0,0,0,0|2,0,1]=4 308 B9R1.69 Cc1cc(c(nc1)O)C AB71284 [1,0,0,0,0,0|2,0,1]=4 309 B9R1.69 Cc1cc(c(nc1)O)Cl AB70490 [1,0,0,0,0,0|2,0,1]=4 310 B9R1.69 Cc1cc(c(nc1)O)F AB71311 [1,0,0,0,0,0|2,0,1]=4 311 B9R1.69 Cc1cc(c(nc1)O)N AB53563 [1,0,0,0,0,0|2,0,1]=4 312 B9R1.69 Cc1cc(ccc1I)O MB06793 [1,0,0,0,0,0|3,0,0]=4 313 B9R1.69 Cc1cc(ncc1Br)C AB53714 [1,0,0,0,0,0|3,0,0]=4 314 B9R1.69 Cc1cc(ncc1N)C AB41994 [1,0,0,0,0,0|3,0,0]=4 315 B9R1.69 Cc1cc(ncc1O)C AB44457 [1,0,0,0,0,0|2,0,1]=4 316 B9R1.69 Cc1ccc(c(c1)Br)S AB16734 [1,0,0,0,0,0|1,1,0]=3 317 B9R1.69 Cc1ccc(c(c1)F)Br AB01835 [1,0,0,0,0,0|2,0,0]=3 318 B9R1.69 Cc1ccc(c(c1)I)O MB00839 [1,0,0,0,0,0|1,0,1]=3 319 B9R1.69 Cc1ccc(c(c1)N)Br AB09930 [1,0,0,0,0,0|2,0,0]=3 320 B9R1.69 Cc1ccc(c(c1)O)Br MB09252 [1,0,0,0,0,0|1,0,0]=2 321 B9R1.69 Cc1ccc(c(c1)O)I MB23426 [1,0,0,0,0,0|1,0,0]=2 322 B9R1.69 Cc1ccc(c(c1)O)N AB00890 [1,0,0,0,0,0|1,0,0]=2 323 B9R1.69 Cc1ccc(c(n1)Br)N AB13459 [1,0,0,0,0,0|3,0,0]=4 324 B9R1.69 Cc1ccc(c(n1)Br)O PB10360 [1,0,0,0,0,0|2,0,1]=4 325 B9R1.69 Cc1ccc(c(n1)C)Br AB05311 [1,0,0,0,0,0|3,0,0]=4 326 B9R1.69 Cc1ccc(c(n1)Cl)Br AB13590 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.69 Cc1ccc(c(n1)Cl)N AB13580 [1,0,0,0,0,0|3,0,0]=4 328 B9R1.69 Cc1ccc(c(n1)Cl)O AB42392 [1,0,0,0,0,0|2,0,1]=4 329 B9R1.69 Cc1ccc(c(n1)F)N AB13597 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.69 Cc1ccc(c(n1)N)Br AB13584 [1,0,0,0,0,0|3,0,0]=4 331 B9R1.69 Cc1ccc(c(n1)N)Cl AB41203 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.69 Cc1ccc(c(n1)N)N AB15083 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.69 Cc1ccc(c(n1)N)O AB53537 [1,0,0,0,0,0|2,0,1]=4 334 B9R1.69 Cc1ccc(c(n1)O)Br AB13586 [1,0,0,0,0,0|2,0,0]=3 335 B9R1.69 Cc1ccc(c(n1)O)Cl AB41205 [1,0,0,0,0,0|2,0,0]=3 336 B9R1.69 Cc1ccc(cc1I)O MB07177 [1,0,0,0,0,0|2,0,1]=4 337 B9R1.69 Cc1ccc(cc1O)Br MB05210 [1,0,0,0,0,0|1,0,1]=3 338 B9R1.69 Cc1ccc(cc1O)I MB12091 [1,0,0,0,0,0|1,0,1]=3 339 B9R1.69 Cc1ccc(nc1Br)C AB65454 [1,0,0,0,0,0|2,0,1]=4 340 B9R1.69 Cc1ccc(nc1N)C AB25382 [1,0,0,0,0,0|2,0,1]=4 341 B9R1.69 Cc1ccc(nc1O)C AB71286 [1,0,0,0,0,0|1,0,1]=3 342 B9R1.69 Cc1ccc(nc1O)Cl AB75750 [1,0,0,0,0,0|2,0,1]=4 343 B9R1.69 Cc1ccc(nc1O)F AB82880 [1,0,0,0,0,0|2,0,1]=4 344 B9R1.69 Cc1cnc(cc1O)Cl AB71181 [1,0,0,0,0,0|2,0,1]=4 345 B9R1.69 Cc1cnc(cc1O)F AB71302 [1,0,0,0,0,0|2,0,1]=4 346 B9R1.69 Cc1cnc(nc1O)C AB21544 [1,0,0,0,0,0|2,0,1]=4 347 B9R1.69 Cc1ncc(c(n1)O)F AB04979 [1,0,0,0,0,0|3,0,0]=4 348 B9R1.69 Cn1cc(ccc1=O)Br PB32830 [1,0,0,0,0,0|3,0,0]=4 349 B9R1.69 Cn1cc(ccc1=O)N PB19693 [1,0,0,0,0,0|3,0,0]=4 350 B9R1.69 Cn1ccc(=O)c(c1)I MB19762 [1,0,0,0,0,0|2,0,0]=3 351 B9R1.69 c1c(c(cnc1Br)Br)O AB63125 [1,0,0,0,0,0|3,0,0]=4 352 B9R1.69 c1c(c(cnc1Br)Cl)O AB69302 [1,0,0,0,0,0|3,0,0]=4 353 B9R1.69 c1c(c(cnc1Br)F)O AB69315 [1,0,0,0,0,0|3,0,0]=4 354 B9R1.69 c1c(c(cnc1Cl)Br)O AB69298 [1,0,0,0,0,0|3,0,0]=4 355 B9R1.69 c1c(c(cnc1Cl)Cl)O AB10186 [1,0,0,0,0,0|3,0,0]=4 356 B9R1.69 c1c(c(cnc1Cl)F)O AB69309 [1,0,0,0,0,0|3,0,0]=4 357 B9R1.69 c1c(c(cnc1Cl)N)O AB69320 [1,0,0,0,0,0|3,0,0]=4 358 B9R1.69 c1c(c(cnc1Cl)O)O AB69329 [1,0,0,0,0,0|2,0,1]=4 359 B9R1.69 c1c(c(cnc1N)Cl)O AB42978 [1,0,0,0,0,0|3,0,0]=4 360 B9R1.69 c1c(cnc(c1O)Br)F MB09912 [1,0,0,0,0,0|3,0,0]=4 361 B9R1.69 c1c(cnc(c1O)Cl)Br PB17565 [1,0,0,0,0,0|3,0,0]=4 362 B9R1.69 c1c(cnc(c1O)Cl)Cl AB66760 [1,0,0,0,0,0|3,0,0]=4 363 B9R1.69 c1c(cnc(c1O)Cl)F AB13634 [1,0,0,0,0,0|3,0,0]=4 364 B9R1.69 c1c(cnc(c1O)Cl)N AB76704 [1,0,0,0,0,0|3,0,0]=4 365 B9R1.69 c1c(cnc(c1O)Cl)O AB71129 [1,0,0,0,0,0|3,0,0]=4 366 B9R1.69 c1cc(c(cc1Br)Br)I AB51495 [1,0,0,0,0,0|3,0,0]=4 367 B9R1.69 c1cc(c(cc1Br)Cl)O AB00210 [1,0,0,0,0,0|2,0,1]=4 368 B9R1.69 c1cc(c(cc1Br)I)N AB10839 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.69 c1cc(c(cc1Br)I)O MB06781 [1,0,0,0,0,0|2,0,1]=4 370 B9R1.69 c1cc(c(cc1Br)N)I AB51497 [1,0,0,0,0,0|3,0,0]=4 371 B9R1.69 c1cc(c(cc1Br)N)N AB11949 [1,0,0,0,0,0|3,0,0]=4 372 B9R1.69 c1cc(c(cc1Br)N)O MB01067 [1,0,0,0,0,0|2,0,1]=4 373 B9R1.69 c1cc(c(cc1Br)N)S AB54823 [1,0,0,0,0,0|2,1,0]=4 374 B9R1.69 c1cc(c(cc1Br)O)I MB25447 [1,0,0,0,0,0|2,0,0]=3 375 B9R1.69 c1cc(c(cc1Br)O)N AB13424 [1,0,0,0,0,0|2,0,0]=3 376 B9R1.69 c1cc(c(cc1Br)S)N AB07437 [1,0,0,0,0,0|2,1,0]=4 377 B9R1.69 c1cc(c(cc1Cl)I)N PB21792 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.69 c1cc(c(cc1Cl)I)O MB05977 [1,0,0,0,0,0|2,0,1]=4 379 B9R1.69 c1cc(c(cc1Cl)N)I AB28269 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.69 c1cc(c(cc1Cl)O)F MB03336 [1,0,0,0,0,0|2,0,0]=3 381 B9R1.69 c1cc(c(cc1Cl)O)I MB07629 [1,0,0,0,0,0|2,0,0]=3 382 B9R1.69 c1cc(c(cc1Cl)S)N AB13353 [1,0,0,0,0,0|2,1,0]=4 383 B9R1.69 c1cc(c(cc1F)F)I MB00398 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.69 c1cc(c(cc1F)I)N AB01932 [1,0,0,0,0,0|3,0,0]=4 385 B9R1.69 c1cc(c(cc1F)I)O MB14767 [1,0,0,0,0,0|2,0,1]=4 386 B9R1.69 c1cc(c(cc1F)N)N AB01910 [1,0,0,0,0,0|3,0,0]=4 387 B9R1.69 c1cc(c(cc1F)N)S AB54821 [1,0,0,0,0,0|2,1,0]=4 388 B9R1.69 c1cc(c(cc1F)O)I MB25431 [1,0,0,0,0,0|2,0,0]=3 389 B9R1.69 c1cc(c(cc1F)S)N AB54817 [1,0,0,0,0,0|2,1,0]=4 390 B9R1.69 c1cc(c(cc1I)Br)O MB10373 [1,0,0,0,0,0|2,0,1]=4 391 B9R1.69 c1cc(c(cc1I)Cl)O MB09341 [1,0,0,0,0,0|2,0,1]=4 392 B9R1.69 c1cc(c(cc1I)F)O MB09308 [1,0,0,0,0,0|2,0,1]=4 393 B9R1.69 c1cc(c(cc1I)I)O MB01999 [1,0,0,0,0,0|2,0,1]=4 394 B9R1.69 c1cc(c(cc1I)N)Cl AB64100 [1,0,0,0,0,0|3,0,0]=4 395 B9R1.69 c1cc(c(cc1I)N)O MB14432 [1,0,0,0,0,0|2,0,1]=4 396 B9R1.69 c1cc(c(cc1I)O)Br MB08154 [1,0,0,0,0,0|2,0,0]=3 397 B9R1.69 c1cc(c(cc1I)O)F MB14983 [1,0,0,0,0,0|2,0,0]=3 398 B9R1.69 c1cc(c(cc1I)O)I MB07529 [1,0,0,0,0,0|2,0,0]=3 399 B9R1.69 c1cc(c(cc1I)O)N MB14436 [1,0,0,0,0,0|2,0,0]=3 400 B9R1.69 c1cc(c(cc1N)Cl)I AB02146 [1,0,0,0,0,0|3,0,0]=4 401 B9R1.69 c1cc(c(cc1N)F)Cl AB08243 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.69 c1cc(c(cc1N)F)I AB42340 [1,0,0,0,0,0|3,0,0]=4 403 B9R1.69 c1cc(c(cc1N)F)N MB08293 [1,0,0,0,0,0|3,0,0]=4 404 B9R1.69 c1cc(c(cc1N)I)Cl MB09944 [1,0,0,0,0,0|3,0,0]=4 405 B9R1.69 c1cc(c(cc1N)O)Br MB08323 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.69 c1cc(c(cc1N)O)F MB13362 [1,0,0,0,0,0|2,0,0]=3 407 B9R1.69 c1cc(c(cc1N)O)I MB37209 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.69 c1cc(c(cc1O)Br)Br MB00539 [1,0,0,0,0,0|3,0,0]=4 409 B9R1.69 c1cc(c(cc1O)Br)Cl MB00535 [1,0,0,0,0,0|3,0,0]=4 410 B9R1.69 c1cc(c(cc1O)Br)I MB26105 [1,0,0,0,0,0|3,0,0]=4 411 B9R1.69 c1cc(c(cc1O)Br)N MB08329 [1,0,0,0,0,0|3,0,0]=4 412 B9R1.69 c1cc(c(cc1O)Cl)I MB25466 [1,0,0,0,0,0|3,0,0]=4 413 B9R1.69 c1cc(c(cc1O)Cl)N MB01478 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.69 c1cc(c(cc1O)F)I MB11930 [1,0,0,0,0,0|3,0,0]=4 415 B9R1.69 c1cc(c(cc1O)F)N AB09438 [1,0,0,0,0,0|3,0,0]=4 416 B9R1.69 c1cc(c(cc1O)I)Br MB00538 [1,0,0,0,0,0|3,0,0]=4 417 B9R1.69 c1cc(c(cc1O)I)F MB25606 [1,0,0,0,0,0|3,0,0]=4 418 B9R1.69 c1cc(c(cc1O)I)I MB25449 [1,0,0,0,0,0|3,0,0]=4 419 B9R1.69 c1cc(c(cc1O)I)N MB25412 [1,0,0,0,0,0|3,0,0]=4 420 B9R1.69 c1cc(c(cc1O)N)Br MB07114 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.69 c1cc(c(cc1O)N)I MB13452 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.69 c1cc(c(cc1O)N)N MB04238 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.69 c1cc(nc(c1Cl)O)Br AB84077 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.69 c1cc(nc(c1Cl)O)Cl AB10185 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.69 c1cc(nc(c1Cl)O)N AB84080 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.69 c1cc(nc(c1Cl)O)O AB84078 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.69 c1cc(nc(c1F)O)Cl AB83102 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.69 c1cc(nc(c1N)O)Br AB26870 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.37 CCc1cc(ccc1C=O)O MB23751 [0,1,0,0,0,0|2,0,0]=3 430 B11R1.37 CCc1ccc(cc1OC)O MB23954 [0,1,0,0,0,0|2,0,1]=4 431 B11R1.37 CNc1cc(ccc1C=O)O MB38802 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.37 CNc1ccc(cc1OC)O MB33444 [0,1,0,0,0,0|3,0,0]=4 433 B11R1.37 COc1c(ccc(n1)Br)C=O AB67010 [0,1,0,0,0,0|2,0,0]=3 434 B11R1.37 COc1c(ccc(n1)Cl)C=O AB64671 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.37 COc1c(ncc(n1)Cl)C=O AB60447 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.37 COc1cc(ccc1C#N)Br AB27561 [0,1,0,0,0,0|2,0,1]=4 437 B11R1.37 COc1cc(ccc1C#N)O MB06526 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.37 COc1cc(ccc1C=O)Br AB44855 [0,1,0,0,0,0|1,0,0]=2 439 B11R1.37 COc1cc(ccc1CN)O MB05069 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.37 COc1cc(ncc1C=O)Br AB67865 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.37 COc1ccc(cc1CO)Br MB00140 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.37 CSc1cc(ccc1C=O)O MB34891 [0,1,0,0,0,0|1,1,0]=3 443 B11R1.37 Cc1cnc(c(n1)OC)C=O AB60450 [0,1,0,0,0,0|2,0,0]=3 444 B11R1.37 c1cc(c(cc1Cl)C#N)C=O MB08901 [0,1,0,0,0,0|2,0,0]=3 445 B11R1.37 c1cc(c(cc1F)C#N)C=O MB06069 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.37 c1cc(c(cc1O)C=O)C=O MB33390 [0,1,0,0,0,0|1,0,1]=3 447 B11R1.37 c1cc(c(cc1O)CN)C=O MB30625 [0,1,0,0,0,0|2,0,0]=3 448 B11R1.81 c1cc(c(cc1Br)F)\C=N\O AB03857 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.81 c1cc(c(cc1F)F)N=C=O AB00185 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.166 B(c1ccc(cc1C)C)(O)O AB12317 [0,1,0,0,0,0|2,0,1]=4 451 B11R1.166 B(c1ccc(cc1Cl)C)(O)O AB14287 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.166 B(c1ccc(cc1F)C)(O)O PB26163 [0,1,0,0,0,0|2,0,1]=4 453 B11R1.166 B(c1ccc(cc1O)C)(O)O PB11677 [0,1,0,0,0,0|1,0,1]=3 454 B11R1.166 B(c1ccc(cc1O)F)(O)O AB20352 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.166 CC(=O)c1c(cc(cn1)Br)Br AB43404 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.166 CC(=O)c1c(cc(cn1)Br)N AB77139 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.166 CC(=O)c1c(cc(cn1)Br)O AB84315 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.166 CC(=O)c1c(cc(cn1)Cl)F AB75038 [0,1,0,0,0,0|3,0,0]=4 459 B11R1.166 CC(=O)c1c(cc(cn1)Cl)N AB73056 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.166 CC(=O)c1c(cc(cn1)Cl)O AB75011 [0,1,0,0,0,0|2,0,0]=3 461 B11R1.166 CC(=O)c1c(cc(cn1)F)Cl AB74653 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.166 CC(=O)c1c(cc(cn1)F)N AB77154 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.166 CC(=O)c1c(cc(cn1)N)N AB83853 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.166 CC(=O)c1c(cc(cn1)N)O AB84318 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.166 CC(=O)c1ccc(cc1F)Br MB02747 [0,1,0,0,0,0|2,0,0]=3 466 B11R1.166 CC(=O)c1ccc(cc1F)N MB05492 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.166 CC(=O)c1ccc(cc1O)Br AB15427 [0,1,0,0,0,0|1,0,0]=2 468 B11R1.166 CC(=O)c1ccc(nc1Cl)Cl AB64664 [0,1,0,0,0,0|3,0,0]=4 469 B11R1.166 CC(=O)c1ccc(nc1F)Br AB72629 [0,1,0,0,0,0|3,0,0]=4 470 B11R1.166 CC(=O)c1ccc(nc1F)Cl AB72627 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.166 CC(=O)c1ccc(nc1N)Br AB83837 [0,1,0,0,0,0|3,0,0]=4 472 B11R1.166 CC(=O)c1ccc(nc1N)Cl AB75425 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.166 CC(=O)c1ccc(nc1N)N AB83840 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.166 CC(=O)c1ccc(nc1O)Br AB84273 [0,1,0,0,0,0|2,0,0]=3 475 B11R1.166 CC(=O)c1ccc(nc1O)Cl AB72633 [0,1,0,0,0,0|2,0,0]=3 476 B11R1.166 CC(=O)c1ccc(nc1O)N AB84276 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.166 CC(=O)c1cnc(cc1Cl)Cl AB13863 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.166 CC(=O)c1cnc(cc1Cl)F AB71566 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.166 CC(=O)c1cnc(cc1N)Br AB63704 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.166 CC(=O)c1cnc(cc1N)Cl AB83812 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.166 CC(=O)c1cnc(cc1O)Br AB72643 [0,1,0,0,0,0|2,0,0]=3 482 B11R1.166 CC(=O)c1cnc(cc1O)Cl AB84198 [0,1,0,0,0,0|2,0,0]=3 483 B11R1.166 CC(=O)c1cnc(cc1O)N AB84199 [0,1,0,0,0,0|2,0,0]=3 484 B11R1.166 CC(=O)c1cnc(nc1O)Cl AB76992 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.166 CC(C)c1ccc(cc1O)Br MB22598 [0,1,0,0,0,0|2,0,1]=4 486 B11R1.166 CC(C)c1ccc(cc1O)Cl MB22600 [0,1,0,0,0,0|2,0,1]=4 487 B11R1.166 CC(C)c1ccc(cc1O)F MB22513 [0,1,0,0,0,0|2,0,1]=4 488 B11R1.166 CC(C)c1ccc(cc1O)I MB22516 [0,1,0,0,0,0|2,0,1]=4 489 B11R1.166 CC(C)c1ccc(cc1O)N MB22522 [0,1,0,0,0,0|2,0,1]=4 490 B11R1.166 CN(C)c1ccc(cc1O)Br MB24904 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.166 CN(C)c1ccc(cc1O)Cl MB24909 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.166 CN(C)c1ccc(cc1O)F MB24817 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.166 CN(C)c1ccc(cc1O)I MB24820 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.166 CN(C)c1ccc(cc1O)N MB24828 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.166 Cc1c(ccc(n1)Br)C(=O)O AB66864 [0,1,0,0,0,0|3,0,0]=4 496 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)C AB11952 [0,1,0,0,0,0|3,0,0]=4 497 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)O AB53710 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.166 Cc1c(ccc(n1)F)C(=O)O AB21743 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.166 Cc1c(ccc(n1)N)C(=O)O AB49780 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.166 Cc1c(ccc(n1)O)C(=O)O AB54497 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.166 Cc1c(cnc(n1)C)C(=O)O AB41920 [0,1,0,0,0,0|3,0,0]=4 502 B11R1.166 Cc1cc(c(cn1)C(=O)C)Cl AB64940 [0,1,0,0,0,0|2,0,0]=3 503 B11R1.166 Cc1cc(c(cn1)C(=O)C)F AB83044 [0,1,0,0,0,0|2,0,0]=3 504 B11R1.166 Cc1cc(c(cn1)C(=O)C)N AB50225 [0,1,0,0,0,0|2,0,0]=3 505 B11R1.166 Cc1cc(c(cn1)C(=O)C)O AB75251 [0,1,0,0,0,0|1,0,0]=2 506 B11R1.166 Cc1cc(c(cn1)C(=O)O)Br AB66861 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.166 Cc1cc(c(cn1)C(=O)O)Cl PB14950 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.166 Cc1cc(c(cn1)C(=O)O)F AB66872 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.166 Cc1cc(c(cn1)C(=O)O)N PB15110 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.166 Cc1cc(c(cn1)C(=O)O)O AB17044 [0,1,0,0,0,0|1,0,0]=2 511 B11R1.166 Cc1cc(c(cn1)[N+](=O)[O-])Cl AB72468 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.166 Cc1cc(c(nc1)C(=O)C)C AB50219 [0,1,0,0,0,0|2,0,0]=3 513 B11R1.166 Cc1cc(c(nc1)C(=O)C)Cl AB75090 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.166 Cc1cc(c(nc1)C(=O)C)F AB75164 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.166 Cc1cc(c(nc1)C(=O)C)N AB77150 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.166 Cc1cc(c(nc1)C(=O)C)O AB75244 [0,1,0,0,0,0|1,0,0]=2 517 B11R1.166 Cc1cc(c(nc1)C(=O)O)C AB53520 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.166 Cc1cc(c(nc1)C(=O)O)Cl AB74925 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.166 Cc1cc(c(nc1)C(=O)O)F PB30310 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.166 Cc1cc(c(nc1)C(=O)O)N AB66555 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.166 Cc1cc(ccc1C(=N)N)Br AB18383 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.166 Cc1cc(ccc1C(=O)N)O MB23401 [0,1,0,0,0,0|2,0,0]=3 523 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])Br MB00735 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.166 Cc1cc(cnc1C(=O)C)Cl AB75124 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.166 Cc1cc(cnc1C(=O)C)F AB74622 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.166 Cc1cc(cnc1C(=O)O)Br AB41227 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.166 Cc1cc(cnc1C(=O)O)Cl AB41233 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.166 Cc1cc(cnc1C(=O)O)F AB74795 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.166 Cc1cc(cnc1C(=O)O)N AB41220 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.166 Cc1cc(ncc1C(=O)C)C AB50221 [0,1,0,0,0,0|2,0,0]=3 531 B11R1.166 Cc1cc(ncc1C(=O)C)Cl AB83349 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.166 Cc1cc(ncc1C(=O)C)F AB83065 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.166 Cc1cc(ncc1C(=O)O)Br AB67818 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.166 Cc1cc(ncc1C(=O)O)C AB05232 [0,1,0,0,0,0|2,0,0]=3 535 B11R1.166 Cc1cc(ncc1C(=O)O)Cl AB65755 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.166 Cc1cc(ncc1C(=O)O)F AB49982 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.166 Cc1cc(ncc1C(=O)O)N AB53293 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.166 Cc1cc(ncc1C(=O)O)O AB65757 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.166 Cc1ccc(c(c1)C)C(=N)N AB18393 [0,1,0,0,0,0|2,0,0]=3 540 B11R1.166 Cc1ccc(c(c1)Cl)C(=N)N AB18279 [0,1,0,0,0,0|2,0,0]=3 541 B11R1.166 Cc1ccc(c(c1)O)C(=O)N MB02488 [0,1,0,0,0,0|0,0,0]=1 542 B11R1.166 Cc1ccc(c(c1)O)C(C)C MB00129 [0,1,0,0,0,0|1,0,1]=3 543 B11R1.166 Cc1ccc(c(c1)O)N(C)C MB23428 [0,1,0,0,0,0|2,0,0]=3 544 B11R1.166 Cc1ccc(c(n1)Br)C(=O)O AB68156 [0,1,0,0,0,0|2,0,0]=3 545 B11R1.166 Cc1ccc(c(n1)Br)[N+](=O)[O-] AB13579 [0,1,0,0,0,0|3,0,0]=4 546 B11R1.166 Cc1ccc(c(n1)C)C(=O)O AB27627 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)C AB64666 [0,1,0,0,0,0|2,0,0]=3 548 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O PB24611 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.166 Cc1ccc(c(n1)N)C(=O)C AB83843 [0,1,0,0,0,0|2,0,0]=3 550 B11R1.166 Cc1ccc(c(n1)N)C(=O)O PB33689 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.166 Cc1ccc(c(n1)N)[N+](=O)[O-] AB02051 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.166 Cc1ccc(c(n1)O)C(=O)C AB84278 [0,1,0,0,0,0|1,0,0]=2 553 B11R1.166 Cc1ccc(c(n1)O)[N+](=O)[O-] AB12817 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.166 Cc1cnc(c(n1)C)C(=O)O AB71826 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.166 Cc1cnc(c(n1)O)C(=O)O AB48562 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.166 Cc1nc(c(nn1)C(=O)O)O AB48555 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.166 Cc1ncc(c(n1)Cl)C(=O)C AB76965 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.166 Cc1ncc(c(n1)Cl)C(=O)O AB56016 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.166 Cc1ncc(c(n1)N)C(=O)O AB04459 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.166 Cc1ncc(c(n1)O)C(=O)O AB48543 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.166 c1c(c(cnc1Br)C(=O)O)Cl AB67976 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.166 c1c(c(cnc1Br)C(=O)O)F AB68043 [0,1,0,0,0,0|3,0,0]=4 563 B11R1.166 c1c(c(cnc1Br)C(=O)O)N AB67268 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.166 c1c(c(cnc1Br)C(=O)O)O AB72394 [0,1,0,0,0,0|2,0,0]=3 565 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl AB05151 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.166 c1c(c(cnc1Cl)C(=O)O)F AB68037 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.166 c1c(c(cnc1Cl)C(=O)O)N PB12156 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.166 c1c(c(cnc1Cl)C(=O)O)O AB69324 [0,1,0,0,0,0|2,0,0]=3 569 B11R1.166 c1c(c(cnc1F)C(=O)O)Cl AB74908 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.166 c1c(c(cnc1F)C(=O)O)F AB49331 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.166 c1c(c(cnc1F)C(=O)O)N PB19556 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.166 c1c(c(cnc1N)C(=O)O)Cl AB67979 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.166 c1c(c(cnc1N)C(=O)O)N AB71881 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.166 c1c(c(cnc1O)C(=O)O)Cl AB67983 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.166 c1c(cnc(c1Br)C(=O)O)Br AB25162 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.166 c1c(cnc(c1Cl)C(=O)O)Cl AB13812 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.166 c1c(cnc(c1Cl)C(=O)O)F AB66800 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.166 c1c(cnc(c1Cl)C(=O)O)N AB73535 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.166 c1c(cnc(c1F)C(=O)N)Br AB65704 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.166 c1c(cnc(c1F)C(=O)O)Br PB15891 [0,1,0,0,0,0|3,0,0]=4 581 B11R1.166 c1c(cnc(c1F)C(=O)O)Cl AB66361 [0,1,0,0,0,0|3,0,0]=4 582 B11R1.166 c1c(cnc(c1F)C(=O)O)N AB73541 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.166 c1c(cnc(c1N)C(=O)N)Br PB28226 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.166 c1c(cnc(c1N)C(=O)O)Br PB25268 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.166 c1c(cnc(c1N)C(=O)O)Cl PB13238 [0,1,0,0,0,0|3,0,0]=4 586 B11R1.166 c1c(cnc(c1N)C(=O)O)Cl PB25748 [0,1,0,0,0,0|3,0,0]=4 587 B11R1.166 c1c(cnc(c1N)C(=O)O)N AB83569 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O AB05197 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.166 c1cc(c(cc1Br)F)C(=N)N AB18335 [0,1,0,0,0,0|3,0,0]=4 590 B11R1.166 c1cc(c(cc1Br)F)C(=O)O AB03858 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] AB10547 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.166 c1cc(c(cc1Br)N)C(=O)N AB65645 [0,1,0,0,0,0|2,0,0]=3 593 B11R1.166 c1cc(c(cc1Br)N)C(=O)O MB02895 [0,1,0,0,0,0|2,0,0]=3 594 B11R1.166 c1cc(c(cc1Br)N)[N+](=O)[O-] MB07034 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.166 c1cc(c(cc1Br)O)C(=O)N MB04760 [0,1,0,0,0,0|1,0,0]=2 596 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] MB02640 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.166 c1cc(c(cc1Cl)Cl)C(=N)N AB18390 [0,1,0,0,0,0|3,0,0]=4 598 B11R1.166 c1cc(c(cc1Cl)F)C(=N)N AB18342 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.166 c1cc(c(cc1Cl)O)C(=O)N MB09408 [0,1,0,0,0,0|1,0,0]=2 600 B11R1.166 c1cc(c(cc1F)Br)C(=O)O AB02279 [0,1,0,0,0,0|2,0,0]=3 601 B11R1.166 c1cc(c(cc1F)Cl)C(=N)N AB18354 [0,1,0,0,0,0|3,0,0]=4 602 B11R1.166 c1cc(c(cc1F)F)C(=N)N AB18346 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.166 c1cc(c(cc1F)F)C(=O)O AB01069 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.166 c1cc(c(cc1F)O)C(=O)N MB25529 [0,1,0,0,0,0|1,0,0]=2 605 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] AB00840 [0,1,0,0,0,0|2,0,0]=3 606 B11R1.166 c1cc(c(cc1I)O)C(=O)N MB37556 [0,1,0,0,0,0|1,0,0]=2 607 B11R1.166 c1cc(c(cc1N)O)C(=O)N MB25620 [0,1,0,0,0,0|1,0,0]=2 608 B11R1.166 c1cc(c(cc1O)Br)C(=O)O MB28859 [0,1,0,0,0,0|2,0,0]=3 609 B11R1.166 c1cc(c(cc1O)Br)[N+](=O)[O-] MB08147 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.166 c1cc(c(cc1O)Cl)C(=O)N MB04155 [0,1,0,0,0,0|2,0,0]=3 611 B11R1.166 c1cc(c(cc1O)Cl)[N+](=O)[O-] MB01255 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.166 c1cc(c(cc1O)F)C(=O)N MB08417 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] AB01868 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.166 c1cc(c(cc1O)I)C(=O)N MB32997 [0,1,0,0,0,0|2,0,0]=3 615 B11R1.166 c1cc(c(cc1O)I)C(=O)O MB31618 [0,1,0,0,0,0|2,0,0]=3 616 B11R1.166 c1cc(c(cc1O)N)C(=O)N MB00909 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.166 c1cc(c(cc1O)N)C(=O)O MB00542 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.166 c1cc(nc(c1C(=O)N)N)Cl AB65210 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.166 c1cc(nc(c1C(=O)O)Br)Br PB17862 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.166 c1cc(nc(c1C(=O)O)Br)Cl AB66786 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Br AB64863 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.166 c1cc(nc(c1C(=O)O)Cl)Cl PB10074 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.166 c1cc(nc(c1C(=O)O)Cl)N AB53397 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.166 c1cc(nc(c1C(=O)O)F)F AB43522 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.166 c1cc(nc(c1C(=O)O)F)N AB76881 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.166 c1cc(nc(c1C(=O)O)N)Br AB69713 [0,1,0,0,0,0|3,0,0]=4 627 B11R1.166 c1cc(nc(c1C(=O)O)N)Cl PB26608 [0,1,0,0,0,0|3,0,0]=4 628 B11R1.166 c1cc(nc(c1C(=O)O)N)N AB67450 [0,1,0,0,0,0|3,0,0]=4 629 B11R1.277 COc1cc(c(cc1O)Br)Cl MB19828 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.277 c1c(c(cc(c1O)O)F)C=O MB02740 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.278 c1cc(c(c(c1C=O)F)O)O MB02737 [0,1,0,0,0,0|2,0,0]=3 632 B11R1.279 CCc1ccc(c(c1)O)C#N AB50292 [0,1,0,0,0,0|1,0,1]=3 633 B11R1.279 CCc1ccc(c(c1)O)C=O MB23811 [0,1,0,0,0,0|0,0,0]=1 634 B11R1.279 CCc1ccc(c(c1)O)CC MB23814 [0,1,0,0,0,0|1,0,1]=3 635 B11R1.279 CCc1ccc(c(c1)O)CN MB23834 [0,1,0,0,0,0|1,0,1]=3 636 B11R1.279 CCc1ccc(c(c1)O)NC MB23854 [0,1,0,0,0,0|2,0,0]=3 637 B11R1.279 CCc1ccc(c(c1)O)OC MB23985 [0,1,0,0,0,0|2,0,0]=3 638 B11R1.279 CCc1ccc(c(c1)O)SC MB23987 [0,1,0,0,0,0|2,0,0]=3 639 B11R1.279 CCc1ccc(c(n1)O)C#N AB53118 [0,1,0,0,0,0|2,0,1]=4 640 B11R1.279 CCc1ccc(cc1O)C#N MB23779 [0,1,0,0,0,0|1,0,2]=4 641 B11R1.279 CCc1ccc(cc1O)C=O MB23812 [0,1,0,0,0,0|1,0,2]=4 642 B11R1.279 CCc1ccc(cc1O)CN MB23838 [0,1,0,0,0,0|1,0,1]=3 643 B11R1.279 CCc1ccc(cc1O)NC MB23855 [0,1,0,0,0,0|1,0,1]=3 644 B11R1.279 CCc1ccc(cc1O)OC MB04144 [0,1,0,0,0,0|1,0,1]=3 645 B11R1.279 CCc1ccc(cc1O)SC MB23989 [0,1,0,0,0,0|1,0,1]=3 646 B11R1.279 CNc1ccc(c(c1)O)C=O MB38816 [0,1,0,0,0,0|0,0,0]=1 647 B11R1.279 CNc1ccc(c(c1)O)NC MB27488 [0,1,0,0,0,0|2,0,0]=3 648 B11R1.279 CNc1ccc(c(c1)O)SC MB31040 [0,1,0,0,0,0|2,0,0]=3 649 B11R1.279 CNc1ccc(cc1O)C#N MB32288 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.279 CNc1ccc(cc1O)C=O MB01978 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.279 CNc1ccc(cc1O)CN MB30036 [0,1,0,0,0,0|2,0,0]=3 652 B11R1.279 CNc1ccc(cc1O)OC MB36336 [0,1,0,0,0,0|2,0,0]=3 653 B11R1.279 COc1cc(c(cn1)C=O)Br AB67009 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.279 COc1cc(c(cn1)C=O)Cl AB66998 [0,1,0,0,0,0|2,0,0]=3 655 B11R1.279 COc1cc(c(cn1)C=O)N AB83675 [0,1,0,0,0,0|2,0,0]=3 656 B11R1.279 COc1cc(c(cn1)C=O)O AB74871 [0,1,0,0,0,0|1,0,0]=2 657 B11R1.279 COc1cc(c(nc1)C=O)N AB83737 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.279 COc1cc(c(nc1)C=O)O AB84580 [0,1,0,0,0,0|1,0,0]=2 659 B11R1.279 COc1ccc(c(c1)Br)C#N MB06936 [0,1,0,0,0,0|2,0,1]=4 660 B11R1.279 COc1ccc(c(c1)F)CBr AB50043 [0,1,0,0,0,0|2,0,1]=4 661 B11R1.279 COc1ccc(c(c1)F)CN AB20685 [0,1,0,0,0,0|2,0,1]=4 662 B11R1.279 COc1ccc(c(c1)F)CO AB20682 [0,1,0,0,0,0|1,0,2]=4 663 B11R1.279 COc1ccc(c(c1)N)C#N AB21542 [0,1,0,0,0,0|2,0,1]=4 664 B11R1.279 COc1ccc(c(c1)N)C=O AB54699 [0,1,0,0,0,0|1,0,0]=2 665 B11R1.279 COc1ccc(c(c1)O)C#N AB45806 [0,1,0,0,0,0|1,0,1]=3 666 B11R1.279 COc1ccc(c(c1)O)CN MB05065 [0,1,0,0,0,0|1,0,1]=3 667 B11R1.279 COc1ccc(c(c1)O)OC MB00643 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.279 COc1ccc(c(c1)O)SC MB25870 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.279 COc1ccc(c(n1)Br)C=O AB68201 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.279 COc1ccc(c(n1)Cl)C=O AB59889 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.279 COc1ccc(c(n1)F)C=O AB71338 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.279 COc1ccc(c(n1)N)C=O AB76143 [0,1,0,0,0,0|2,0,0]=3 673 B11R1.279 COc1ccc(c(n1)O)C=O AB84537 [0,1,0,0,0,0|1,0,0]=2 674 B11R1.279 COc1ccc(cc1Cl)CN CB10485 [0,1,0,0,0,0|3,0,0]=4 675 B11R1.279 COc1ccc(cc1O)C#N MB02393 [0,1,0,0,0,0|2,0,1]=4 676 B11R1.279 COc1ccc(cc1O)SC MB37214 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.279 COc1cnc(c(n1)Cl)C=O AB60389 [0,1,0,0,0,0|3,0,0]=4 678 B11R1.279 COc1ncc(c(n1)N)C=O AB42558 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.279 CSc1ccc(c(c1)O)C=O MB32919 [0,1,0,0,0,0|0,0,0]=1 680 B11R1.279 CSc1ccc(cc1O)C#N MB28697 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.279 CSc1ccc(cc1O)C=O MB32965 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.279 CSc1ccc(cc1O)CN MB29248 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.279 CSc1ncc(c(n1)Cl)C=O PB19458 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.279 CSc1ncc(c(n1)N)C=O PB31299 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.279 Cc1c(ncc(n1)OC)C=O AB85667 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.279 c1c(cnc(c1N)C=O)C=O AB83740 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.279 c1c(cnc(c1O)C=O)C=O AB84585 [0,1,0,0,0,0|1,0,1]=3 688 B11R1.279 c1c(cnc(c1O)C=O)CCl AB84592 [0,1,0,0,0,0|1,0,0]=2 689 B11R1.279 c1c(ncc(c1N)C=O)C=O AB83681 [0,1,0,0,0,0|2,0,1]=4 690 B11R1.279 c1c(ncc(c1O)C=O)C=O AB84440 [0,1,0,0,0,0|1,0,1]=3 691 B11R1.279 c1c(ncc(c1O)C=O)CCl AB84446 [0,1,0,0,0,0|1,0,0]=2 692 B11R1.279 c1cc(c(cc1C#N)F)C=O AB32080 [0,1,0,0,0,0|1,0,1]=3 693 B11R1.279 c1cc(c(cc1C#N)O)C#N MB29629 [0,1,0,0,0,0|1,0,2]=4 694 B11R1.279 c1cc(c(cc1C#N)O)C=O MB06108 [0,1,0,0,0,0|0,0,1]=2 695 B11R1.279 c1cc(c(cc1C#N)O)CN MB25482 [0,1,0,0,0,0|1,0,2]=4 696 B11R1.279 c1cc(c(cc1C=O)O)C#N MB25582 [0,1,0,0,0,0|1,0,2]=4 697 B11R1.279 c1cc(c(cc1C=O)O)C=O MB31163 [0,1,0,0,0,0|0,0,1]=2 698 B11R1.279 c1cc(c(cc1CBr)F)C#N AB13323 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.279 c1cc(c(cc1CN)O)C=O MB27592 [0,1,0,0,0,0|0,0,0]=1 700 B11R1.279 c1cc(c(cc1CN)O)CN MB29403 [0,1,0,0,0,0|1,0,1]=3 701 B11R1.279 c1cc(c(cc1CO)F)C#N AB44199 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.279 c1cc(c(nc1CCl)O)C=O AB84549 [0,1,0,0,0,0|1,0,0]=2 703 B11R1.279 c1cc(nc(c1C=O)N)C=O AB83711 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.279 c1cc(nc(c1C=O)O)C=O AB84543 [0,1,0,0,0,0|1,0,1]=3 705 B11R1.464 Cc1cc(c(c(n1)Cl)C=O)Cl AB44296 [0,1,0,0,0,0|2,0,0]=3 706 B11R1.464 Cc1cc(cc(c1C=O)C)Br MB09867 [0,1,0,0,0,0|2,0,0]=3 707 B11R1.464 Cc1cc(nc(c1C=O)C)Cl AB75372 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.464 Cc1nc(c(c(n1)Cl)C=O)Cl AB54916 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.464 c1c(cc(c(c1Cl)C=O)Cl)Br MB09859 [0,1,0,0,0,0|2,0,0]=3 710 B11R1.464 c1c(cc(c(c1F)C=O)Cl)Cl CB11634 [0,1,0,0,0,0|2,0,0]=3 711 B11R2.36 Cc1ccc2c(c1)CNC2 AB49687 [0,0,0,1,0,0|2,0,1]=4 712 B11R2.36 Cc1ccc2c(c1)N=CC2 PB25888 [0,0,0,1,0,0|2,0,1]=4 713 B11R2.36 Cc1ccc2c(c1)N=NC2 MB04939 [0,0,0,1,0,0|2,0,1]=4 714 B11R2.36 Cc1ccc2c(c1)NCC2 MB04575 [0,0,0,1,0,0|2,0,1]=4 715 B11R2.36 Cc1ccc2c(c1)cco2 MB00739 [0,0,0,1,0,0|3,0,0]=4 716 B11R2.36 Cc1ccc2c(c1)scn2 AB09070 [0,0,0,1,0,0|2,1,0]=4 717 B11R2.36 c1cc(cc2c1cco2)Br PB12534 [0,0,0,1,0,0|2,0,0]=3 718 B11R2.36 c1cc(cc2c1cco2)N MB09331 [0,0,0,1,0,0|2,0,0]=3 719 B11R2.36 c1cc(cc2c1cco2)O MB06436 [0,0,0,1,0,0|2,0,0]=3 720 B11R2.36 c1cc(cc2c1ccs2)Br MB09702 [0,0,0,1,0,0|2,1,0]=4 721 B11R2.36 c1cc2c(cc1Br)OCC2 MB06567 [0,0,0,1,0,0|2,0,1]=4 722 B11R2.36 c1cc2c(cc1Br)ocn2 AB13141 [0,0,0,1,0,0|3,0,0]=4 723 B11R2.36 c1cc2c(cc1Cl)ocn2 AB49155 [0,0,0,1,0,0|3,0,0]=4 724 B11R2.36 c1cc2cnoc2cc1Br AB25994 [0,0,0,1,0,0|2,0,0]=3 725 B11R2.36 c1cc2cnoc2cc1Cl AB25992 [0,0,0,1,0,0|2,0,0]=3 726 B11R2.36 c1cc2cnoc2cc1N AB26008 [0,0,0,1,0,0|2,0,0]=3 727 B11R2.36 c1cc2cnsc2cc1Br MB19419 [0,0,0,1,0,0|2,1,0]=4 728 B11R2.36 c1cc2cnsc2cc1Cl MB19415 [0,0,0,1,0,0|2,1,0]=4 729 B11R2.36 c1cc2conc2cc1Br MB19398 [0,0,0,1,0,0|2,0,1]=4 730 B11R2.36 c1cc2conc2cc1Cl MB19396 [0,0,0,1,0,0|2,0,1]=4 731 B9R1.22 Cc1c(cn(n1)C)C=O AB04183 [0,0,0,0,1,0|3,0,0]=4 732 B9R1.22 Cc1c(oc(n1)C)C=O AB27656 [0,0,0,0,1,0|3,0,0]=4 733 B9R1.22 Cc1cc(n(n1)C)C=O AB12155 [0,0,0,0,1,0|3,0,0]=4 734 B9R1.22 Cc1cc(sc1C=O)Br AB55882 [0,0,0,0,1,0|3,0,0]=4 735 B9R1.132 CC1=C(C(=NC1)C=O)C PB21628 [0,0,0,0,1,0|2,0,1]=4 736 B9R1.132 Cc1cnc(n1C)C=O AB62623 [0,0,0,0,1,0|3,0,0]=4 737 B9R1.132 Cn1c(c(cn1)C=O)Cl AB71399 [0,0,0,0,1,0|3,0,0]=4 738 B8R1.2 c1c(cncn1)C=O PB32342 [2,0,0,0,0,0|2,0,0]=4 739 B8R1.2 c1cc(cnc1)C=O AB00744 [2,0,0,0,0,0|1,0,0]=3 740 B8R1.2 c1cc(nnc1)C=O PB20119 [2,0,0,0,0,0|2,0,0]=4 741 B8R1.2 c1ccnc(c1)C=O AB00680 [2,0,0,0,0,0|1,0,0]=3 742 B8R1.2 c1cnc(cn1)C=O PB19982 [2,0,0,0,0,0|2,0,0]=4 743 B8R1.2 c1cnc(nc1)C=O PB34235 [2,0,0,0,0,0|2,0,0]=4 744 B8R1.2 c1cnccc1C=O AB00754 [2,0,0,0,0,0|1,0,0]=3 745 B8R1.2 c1cncnc1C=O AB16150 [2,0,0,0,0,0|2,0,0]=4 746 B8R1.2 c1cnncc1C=O PB17346 [2,0,0,0,0,0|2,0,0]=4 747 B8R1.3 Cc1ccc(=O)[nH]n1 PB21643 [2,0,0,0,0,0|2,0,0]=4 748 B8R1.3 Cc1ccc(cn1)Br AB06624 [2,0,0,0,0,0|2,0,0]=4 749 B8R1.3 Cc1ccc(cn1)Cl AB17956 [2,0,0,0,0,0|2,0,0]=4 750 B8R1.3 Cc1ccc(cn1)F PB18589 [2,0,0,0,0,0|2,0,0]=4 751 B8R1.3 Cc1ccc(cn1)N PB32227 [2,0,0,0,0,0|2,0,0]=4 752 B8R1.3 Cc1ccc(cn1)O PB30543 [2,0,0,0,0,0|1,0,1]=4 753 B8R1.3 Cc1ccc(nc1)Br PB17145 [2,0,0,0,0,0|2,0,0]=4 754 B8R1.3 Cc1ccc(nc1)Cl AB07104 [2,0,0,0,0,0|2,0,0]=4 755 B8R1.3 Cc1ccc(nc1)F AB01857 [2,0,0,0,0,0|2,0,0]=4 756 B8R1.3 Cc1ccc(nc1)N AB17938 [2,0,0,0,0,0|2,0,0]=4 757 B8R1.3 Cc1ccc(nc1)O AB13138 [2,0,0,0,0,0|1,0,1]=4 758 B8R1.5 Cc1c(cccn1)O PB18442 [2,0,0,0,0,0|1,0,1]=4 759 B8R1.5 Cc1cccnc1O AB03538 [2,0,0,0,0,0|1,0,1]=4 760 B8R1.5 Cc1ccncc1O PB23391 [2,0,0,0,0,0|1,0,1]=4 761 B8R1.5 c1cc(c(nc1)Br)O PB28951 [2,0,0,0,0,0|2,0,0]=4 762 B8R1.5 c1cc(c(nc1)Cl)O PB21615 [2,0,0,0,0,0|2,0,0]=4 763 B8R1.5 c1cc(c(nc1)I)O MB00322 [2,0,0,0,0,0|2,0,0]=4 764 B8R1.5 c1cc(c(nc1)N)O AB00700 [2,0,0,0,0,0|2,0,0]=4 765 B8R1.5 c1cc(c(nc1)N)O AB17906 [2,0,0,0,0,0|2,0,0]=4 766 B8R1.5 c1cc(c(nc1)O)Br PB12284 [2,0,0,0,0,0|2,0,0]=4 767 B8R1.5 c1cc(c(nc1)O)F AB13427 [2,0,0,0,0,0|2,0,0]=4 768 B8R1.5 c1cc(c(nc1)O)I AB53303 [2,0,0,0,0,0|2,0,0]=4 769 B8R1.5 c1cc(c(nc1)O)N PB30752 [2,0,0,0,0,0|2,0,0]=4 770 B8R1.5 c1cncc(c1Br)O AB13187 [2,0,0,0,0,0|2,0,0]=4 771 B8R1.5 c1cncc(c1Cl)O AB12281 [2,0,0,0,0,0|2,0,0]=4 772 B8R1.5 c1cncc(c1F)O AB64515 [2,0,0,0,0,0|2,0,0]=4 773 B8R1.5 c1cncc(c1I)O MB06807 [2,0,0,0,0,0|2,0,0]=4 774 B8R1.5 c1cncc(c1O)Br AB09574 [2,0,0,0,0,0|2,0,0]=4 775 B8R1.5 c1cncc(c1O)F AB18011 [2,0,0,0,0,0|2,0,0]=4 776 B8R1.4 Cc1cc(ccn1)Br AB17599 [2,0,0,0,0,0|2,0,0]=4 777 B8R1.4 Cc1cc(ccn1)Br PB26077 [2,0,0,0,0,0|2,0,0]=4 778 B8R1.4 Cc1cc(ccn1)Cl AB01756 [2,0,0,0,0,0|2,0,0]=4 779 B8R1.4 Cc1cc(ccn1)F AB17919 [2,0,0,0,0,0|2,0,0]=4 780 B8R1.4 Cc1cc(ccn1)O PB24839 [2,0,0,0,0,0|1,0,0]=3 781 B8R1.4 Cc1cc(cnc1)Br AB09597 [2,0,0,0,0,0|2,0,0]=4 782 B8R1.4 Cc1cc(cnc1)Cl AB17994 [2,0,0,0,0,0|2,0,0]=4 783 B8R1.4 Cc1cc(cnc1)F AB13643 [2,0,0,0,0,0|2,0,0]=4 784 B8R1.4 Cc1cc(cnc1)N AB17573 [2,0,0,0,0,0|2,0,0]=4 785 B8R1.4 Cc1cc(cnc1)O MB01362 [2,0,0,0,0,0|1,0,0]=3 786 B8R1.4 Cc1cccc(n1)Br AB01812 [2,0,0,0,0,0|2,0,0]=4 787 B8R1.4 Cc1cccc(n1)Cl AB00666 [2,0,0,0,0,0|2,0,0]=4 788 B8R1.4 Cc1cccc(n1)F AB01860 [2,0,0,0,0,0|2,0,0]=4 789 B8R1.4 Cc1cccc(n1)N AB00717 [2,0,0,0,0,0|2,0,0]=4 790 B8R1.4 Cc1cccc(n1)O AB00679 [2,0,0,0,0,0|1,0,0]=3 791 B8R1.4 Cc1cccc(n1)S AB25230 [2,0,0,0,0,0|1,1,0]=4 792 B8R1.4 Cc1ccnc(c1)Br AB03099 [2,0,0,0,0,0|2,0,0]=4 793 B8R1.4 Cc1ccnc(c1)Cl PB10051 [2,0,0,0,0,0|2,0,0]=4 794 B8R1.4 Cc1ccnc(c1)F AB01854 [2,0,0,0,0,0|2,0,0]=4 795 B8R1.4 Cc1ccnc(c1)N AB00703 [2,0,0,0,0,0|2,0,0]=4 796 B8R1.4 Cc1ccnc(c1)O AB03735 [2,0,0,0,0,0|1,0,0]=3 797 B8R1.4 c1c(cncc1Br)O PB30658 [2,0,0,0,0,0|2,0,0]=4 798 B8R1.4 c1c(cncc1F)O AB13569 [2,0,0,0,0,0|2,0,0]=4 799 B8R1.4 c1c(cncc1O)N AB17983 [2,0,0,0,0,0|2,0,0]=4 800 B8R1.4 c1c(cncc1O)O MB02073 [2,0,0,0,0,0|2,0,0]=4 801 B8R1.4 c1cc(nc(c1)Br)O AB05100 [2,0,0,0,0,0|2,0,0]=4 802 B8R1.4 c1cnc(cc1Cl)O AB13188 [2,0,0,0,0,0|2,0,0]=4 803 B8R1.4 c1cnc(cc1N)O PB15716 [2,0,0,0,0,0|2,0,0]=4 804 B8R1.4 c1cnc(cc1O)Br AB05095 [2,0,0,0,0,0|2,0,0]=4 805 B8R1.4 c1cnc(cc1O)Cl AB09576 [2,0,0,0,0,0|2,0,0]=4 806 B8R1.4 c1cnc(cc1O)F AB17930 [2,0,0,0,0,0|2,0,0]=4 807 B8R1.4 c1cnc(cc1O)I MB26582 [2,0,0,0,0,0|2,0,0]=4 808 B8R1.4 c1cnc(cc1O)N AB17934 [2,0,0,0,0,0|2,0,0]=4 809 B10R1.1 Cc1ccc(cc1)CC=O AB02059 [1,1,0,0,0,0|0,0,0]=2 810 B10R1.1 Cc1ccc(cc1)\C=C\Br AB73509 [1,1,0,0,0,0|1,0,0]=3 811 B10R1.1 Cc1ccc(cn1)N=C=O AB43377 [1,1,0,0,0,0|1,0,1]=4 812 B10R1.1 Cc1ccc(nc1)\C=N\O AB72002 [1,1,0,0,0,0|1,0,1]=4 813 B10R1.1 c1cc(ccc1CC=O)Br AB11790 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.1 c1cc(ccc1CC=O)Cl AB11793 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.1 c1cc(ccc1CC=O)F AB11805 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.1 c1cc(ccc1CC=O)N AB27688 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.1 c1cc(ccc1\C=C\Br)Br AB32162 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.1 c1cc(ccc1\C=C\Br)Cl AB32165 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.1 c1cc(ccc1\C=C\Br)F AB66443 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.1 c1cc(ccc1\C=N\O)Br AB06151 [1,1,0,0,0,0|1,0,1]=4 821 B10R1.3 C#Cc1ccc(cc1)C=O AB22364 [1,1,0,0,0,0|0,0,1]=3 822 B10R1.3 CCc1ccc(cc1)NN AB10141 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.3 CNc1ncc(cn1)C=O AB30585 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.3 COc1ccc(cc1)C#N AB00162 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.3 COc1ccc(cc1)NN AB11940 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.3 COc1ccc(nc1)C=O PB17495 [1,1,0,0,0,0|1,0,0]=3 827 B10R1.3 COc1ccc(nn1)C=O AB61123 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.3 COc1cnc(cn1)C=O AB60467 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.3 COc1cnc(nc1)C=O AB59742 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.3 COc1ncc(cn1)C=O AB15446 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.3 CSc1ccc(cc1)CCl AB05549 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.3 CSc1ccc(cc1)CO AB00982 [1,1,0,0,0,0|0,0,2]=4 833 B10R1.3 CSc1ncc(cn1)C=O PB17314 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.3 c1c(cnc(n1)CCl)C=O AB59413 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.3 c1c(cnc(n1)CN)C=O AB63214 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.3 c1cc(ccc1CN)CO AB23442 [1,1,0,0,0,0|0,0,2]=4 837 B10R1.3 c1cc(ncc1C#N)C=O AB67705 [1,1,0,0,0,0|1,0,1]=4 838 B10R1.3 c1cc(ncc1C=O)C#N AB66011 [1,1,0,0,0,0|1,0,1]=4 839 B10R1.3 c1cc(ncc1C=O)CCl AB69673 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.3 c1cc(ncc1CCl)C=O AB59921 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.13 B(c1ccc(cc1)C)(O)O AB01767 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.13 CC(=C)c1ccc(cc1)O CB10241 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.13 CC(=O)c1ccc(cn1)Br AB21518 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.13 CC(=O)c1ccc(cn1)Cl AB41101 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.13 CC(=O)c1ccc(cn1)F AB62503 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.13 CC(=O)c1ccc(cn1)N AB60315 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.13 CC(=O)c1ccc(cn1)O AB60308 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.13 CC(=O)c1ccc(nc1)Br AB21520 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.13 CC(=O)c1ccc(nc1)Cl AB14033 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.13 CC(=O)c1ccc(nc1)F AB41115 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.13 CC(=O)c1ccc(nc1)N AB49552 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.13 CC(=O)c1ccc(nc1)O AB60297 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.13 Cc1ccc(cc1)C(=N)N AB01792 [1,1,0,0,0,0|1,0,0]=3 854 B10R1.13 Cc1ccc(cc1)C(=S)N AB04365 [1,1,0,0,0,0|0,1,0]=3 855 B10R1.13 Cc1ccc(cn1)C(=O)C AB03568 [1,1,0,0,0,0|1,0,0]=3 856 B10R1.13 Cc1ccc(cn1)C(=O)Cl AB44670 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.13 Cc1ccc(cn1)C(=O)O AB00723 [1,1,0,0,0,0|1,0,0]=3 858 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] PB18660 [1,1,0,0,0,0|2,0,0]=4 859 B10R1.13 Cc1ccc(nc1)C(=O)C AB25779 [1,1,0,0,0,0|1,0,0]=3 860 B10R1.13 Cc1ccc(nc1)C(=O)O AB09798 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.13 Cc1ccc(nn1)C(=O)C AB75459 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.13 Cc1ccc(nn1)C(=O)O AB52759 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.13 Cc1cnc(cn1)C(=O)C AB02269 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.13 Cc1cnc(cn1)C(=O)N CB10282 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.13 Cc1cnc(cn1)C(=O)O PB12995 [1,1,0,0,0,0|2,0,0]=4 866 B10R1.13 Cc1cnc(nc1)C(=O)O PB29748 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.13 Cc1ncc(cn1)C(=O)O PB27884 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.13 c1cc(ccc1C(=N)N)Br AB06234 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.13 c1cc(ccc1C(=N)N)Cl AB03527 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.13 c1cc(ccc1C(=N)N)F AB18284 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.13 c1cc(ccc1C(=N)N)I AB18403 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.13 c1cc(ccc1C(=N)N)N AB01119 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.13 c1cc(ccc1C(=N)N)O AB03766 [1,1,0,0,0,0|2,0,0]=4 874 B10R1.13 c1cc(ccc1C(=S)N)Br AB18142 [1,1,0,0,0,0|1,1,0]=4 875 B10R1.13 c1cc(ccc1C(=S)N)Cl AB01841 [1,1,0,0,0,0|1,1,0]=4 876 B10R1.13 c1cc(ccc1C(=S)N)F AB08498 [1,1,0,0,0,0|1,1,0]=4 877 B10R1.13 c1cc(ccc1C(=S)N)N AB01833 [1,1,0,0,0,0|1,1,0]=4 878 B10R1.13 c1cc(ccc1C(=S)N)O AB21285 [1,1,0,0,0,0|1,1,0]=4 879 B10R1.13 c1cc(ncc1Br)C(=O)O PB32197 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.13 c1cc(ncc1Br)C(=O)[O-] AB42654 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.13 c1cc(ncc1C(=O)Cl)F AB42627 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.13 c1cc(ncc1C(=O)N)Br MB01098 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.13 c1cc(ncc1C(=O)O)Br PB18554 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.13 c1cc(ncc1C(=O)O)Cl AB00659 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.13 c1cc(ncc1C(=O)O)F AB09999 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.13 c1cc(ncc1C(=O)O)N AB17940 [1,1,0,0,0,0|2,0,0]=4 887 B10R1.13 c1cc(ncc1C(=O)O)N PB21621 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.13 c1cc(ncc1C(=O)O)O PB17040 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.13 c1cc(ncc1Cl)C(=O)O AB17962 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.13 c1cc(ncc1F)C(=O)O AB17969 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.13 c1cc(ncc1N)C(=O)O AB12645 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.13 c1cc(ncc1O)C(=O)N MB11444 [1,1,0,0,0,0|2,0,0]=4 893 B10R1.13 c1cc(ncc1O)C(=O)O PB26027 [1,1,0,0,0,0|2,0,0]=4 894 B10R1.176 Cc1c(cc(cn1)C=O)Cl AB74641 [1,1,0,0,0,0|1,0,0]=3 895 B10R1.176 Cc1c(cc(cn1)C=O)F AB62781 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [1,1,0,0,0,0|2,0,0]=4 897 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [1,1,0,0,0,0|2,0,0]=4 899 B10R1.176 Cc1c(nc(cn1)C=O)C AB77048 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [1,1,0,0,0,0|1,0,0]=3 902 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.176 Cc1cc(ncc1Br)C=O AB41159 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.176 Cc1cc(ncc1C)C=O AB74125 [1,1,0,0,0,0|1,0,0]=3 908 B10R1.176 Cc1cc(ncc1Cl)C=O AB41161 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.176 Cc1cc(ncc1F)C=O AB75169 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.176 Cc1ccc(cc1Br)C#N AB29736 [1,1,0,0,0,0|1,0,1]=4 911 B10R1.176 Cc1ccc(cc1O)C#N MB06106 [1,1,0,0,0,0|1,0,1]=4 912 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [1,1,0,0,0,0|0,0,0]=2 913 B10R1.176 Cc1ccc(cc1O)NC MB25401 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.176 Cc1ccc(cc1O)OC MB11905 [1,1,0,0,0,0|2,0,0]=4 915 B10R1.176 Cc1ccc(cc1O)SC MB25438 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [1,1,0,0,0,0|1,0,0]=3 917 B10R1.176 Cc1ccc(nc1Cl)C=O AB75097 [1,1,0,0,0,0|1,0,0]=3 918 B10R1.176 Cc1ccc(nc1F)C=O AB72847 [1,1,0,0,0,0|1,0,0]=3 919 B10R1.176 Cc1cnc(cc1Br)C=O AB70162 [1,1,0,0,0,0|1,0,0]=3 920 B10R1.176 Cc1cnc(cc1Cl)C=O AB67497 [1,1,0,0,0,0|1,0,0]=3 921 B10R1.176 Cc1cnc(cc1F)C=O AB82952 [1,1,0,0,0,0|1,0,0]=3 922 B10R1.176 Cn1ccc(cc1=O)C=O PB35148 [1,1,0,0,0,0|1,0,0]=3 923 B10R1.176 c1c(cnc(c1Br)Cl)C=O AB64592 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.176 c1c(cnc(c1Cl)Br)C=O AB70941 [1,1,0,0,0,0|2,0,0]=4 925 B10R1.176 c1c(cnc(c1Cl)F)C=O AB70931 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.176 c1c(cnc(c1Cl)N)C=O AB76562 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.176 c1c(cnc(c1Cl)O)C=O AB20957 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.176 c1c(cnc(c1F)Br)C=O AB70942 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.176 c1c(cnc(c1F)Cl)C=O AB67661 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.176 c1c(cnc(c1F)F)C=O AB70938 [1,1,0,0,0,0|2,0,0]=4 931 B10R1.176 c1c(cnc(c1N)Cl)C=O AB67746 [1,1,0,0,0,0|2,0,0]=4 932 B10R1.176 c1c(cnc(c1O)Cl)C=O AB62785 [1,1,0,0,0,0|2,0,0]=4 933 B10R1.176 c1c(ncc(c1Cl)Br)C=O AB67641 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.176 c1c(ncc(c1Cl)Cl)C=O AB67602 [1,1,0,0,0,0|2,0,0]=4 935 B10R1.176 c1c(ncc(c1Cl)F)C=O AB67655 [1,1,0,0,0,0|2,0,0]=4 936 B10R1.176 c1c(ncc(c1Cl)N)C=O AB67744 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.176 c1c(ncc(c1Cl)O)C=O AB67780 [1,1,0,0,0,0|2,0,0]=4 938 B10R1.176 c1c(ncc(c1F)Cl)C=O AB82983 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.176 c1c(ncc(c1F)F)C=O AB73186 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.176 c1c(ncc(c1N)Cl)C=O AB83912 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.176 c1c(ncc(c1O)Cl)C=O AB75002 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [1,1,0,0,0,0|1,0,0]=3 943 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [1,1,0,0,0,0|1,0,0]=3 944 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [1,1,0,0,0,0|1,0,0]=3 945 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [1,1,0,0,0,0|1,0,0]=3 946 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [1,1,0,0,0,0|1,0,0]=3 947 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [1,1,0,0,0,0|1,0,0]=3 948 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [1,1,0,0,0,0|1,0,0]=3 949 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [1,1,0,0,0,0|1,0,0]=3 950 B10R1.176 c1cc(c(nc1C=O)Cl)F AB70948 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.176 c1cc(c(nc1C=O)Cl)N AB75366 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.176 c1cc(c(nc1C=O)Cl)O AB74848 [1,1,0,0,0,0|2,0,0]=4 953 B10R1.176 c1cc(c(nc1C=O)F)Cl AB70952 [1,1,0,0,0,0|2,0,0]=4 954 B10R1.176 c1cc(c(nc1C=O)F)F AB70940 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.176 c1cc(c(nc1C=O)N)Cl AB83955 [1,1,0,0,0,0|2,0,0]=4 956 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [1,1,0,0,0,0|2,0,0]=4 957 B10R1.2 CCc1cccc(c1O)Br MB02008 [1,1,0,0,0,0|1,0,1]=4 958 B10R1.2 CCc1cccc(c1O)Cl MB02005 [1,1,0,0,0,0|1,0,1]=4 959 B10R1.2 CCc1cccc(c1O)F MB24014 [1,1,0,0,0,0|1,0,1]=4 960 B10R1.2 CCc1cccc(c1O)I MB24016 [1,1,0,0,0,0|1,0,1]=4 961 B10R1.2 CCc1cccc(c1O)N MB24022 [1,1,0,0,0,0|1,0,1]=4 962 B10R1.2 CNc1cccc(c1O)Br MB26263 [1,1,0,0,0,0|2,0,0]=4 963 B10R1.2 CNc1cccc(c1O)Cl MB33654 [1,1,0,0,0,0|2,0,0]=4 964 B10R1.2 CNc1cccc(c1O)F MB28274 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.2 CNc1cccc(c1O)I MB32214 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.2 CNc1cccc(c1O)N MB33525 [1,1,0,0,0,0|2,0,0]=4 967 B10R1.2 COc1cccc(c1O)Br PB18847 [1,1,0,0,0,0|2,0,0]=4 968 B10R1.2 COc1cccc(c1O)Cl MB25402 [1,1,0,0,0,0|2,0,0]=4 969 B10R1.2 COc1cccc(c1O)I MB09225 [1,1,0,0,0,0|2,0,0]=4 970 B10R1.2 COc1cccc(c1O)N MB25613 [1,1,0,0,0,0|2,0,0]=4 971 B10R1.2 CSc1cccc(c1O)Cl MB27718 [1,1,0,0,0,0|2,0,0]=4 972 B10R1.2 CSc1cccc(c1O)F MB25614 [1,1,0,0,0,0|2,0,0]=4 973 B10R1.2 CSc1cccc(c1O)I MB28360 [1,1,0,0,0,0|2,0,0]=4 974 B10R1.2 CSc1cccc(c1O)N MB28757 [1,1,0,0,0,0|2,0,0]=4 975 B10R1.2 Cc1c(c(ccn1)C=O)Cl AB71247 [1,1,0,0,0,0|2,0,0]=4 976 B10R1.2 Cc1c(c(ccn1)C=O)N AB70908 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.2 Cc1c(c(ccn1)C=O)O AB24800 [1,1,0,0,0,0|1,0,0]=3 978 B10R1.2 Cc1c(cccc1O)C=O MB08410 [1,1,0,0,0,0|1,0,0]=3 979 B10R1.2 Cc1c(ccnc1C=O)Br AB40731 [1,1,0,0,0,0|2,0,0]=4 980 B10R1.2 Cc1c(ccnc1C=O)Cl AB40720 [1,1,0,0,0,0|2,0,0]=4 981 B10R1.2 Cc1c(ccnc1C=O)F AB82923 [1,1,0,0,0,0|2,0,0]=4 982 B10R1.2 Cc1c(ccnc1Cl)C=O AB55074 [1,1,0,0,0,0|2,0,0]=4 983 B10R1.2 Cc1c(ccnc1F)C=O AB71343 [1,1,0,0,0,0|2,0,0]=4 984 B10R1.2 Cc1c(cncc1Cl)C=O AB75131 [1,1,0,0,0,0|2,0,0]=4 985 B10R1.2 Cc1c(nccc1C=O)C AB62887 [1,1,0,0,0,0|2,0,0]=4 986 B10R1.2 Cc1cccc(c1O)C#N MB07838 [1,1,0,0,0,0|1,0,1]=4 987 B10R1.2 Cc1cccc(c1O)CN MB05058 [1,1,0,0,0,0|1,0,1]=4 988 B10R1.2 Cc1cccc(c1O)NC MB31993 [1,1,0,0,0,0|2,0,0]=4 989 B10R1.2 Cc1cccc(c1O)SC MB31066 [1,1,0,0,0,0|2,0,0]=4 990 B10R1.2 Cc1ccnc(c1C)C=O AB66597 [1,1,0,0,0,0|2,0,0]=4 991 B10R1.2 Cc1ccnc(c1Cl)C=O AB44896 [1,1,0,0,0,0|2,0,0]=4 992 B10R1.2 Cc1ccnc(c1N)C=O AB83759 [1,1,0,0,0,0|2,0,0]=4 993 B10R1.2 Cc1ccnc(c1O)C=O AB75246 [1,1,0,0,0,0|1,0,0]=3 994 B10R1.2 Cc1cncc(c1C)C=O AB76785 [1,1,0,0,0,0|2,0,0]=4 995 B10R1.2 Cc1cncc(c1Cl)C=O AB67499 [1,1,0,0,0,0|2,0,0]=4 996 B10R1.2 Cc1cncc(c1F)C=O AB75176 [1,1,0,0,0,0|2,0,0]=4 997 B10R1.2 Cc1cncc(c1N)C=O AB83665 [1,1,0,0,0,0|2,0,0]=4 998 B10R1.2 Cc1cncc(c1O)C=O AB75247 [1,1,0,0,0,0|1,0,0]=3 999 B10R1.2 c1c(c(c(cn1)Br)Cl)C=O AB67643 [1,1,0,0,0,0|2,0,0]=4 1000 B10R1.2 c1c(c(c(cn1)Br)N)C=O AB83649 [1,1,0,0,0,0|2,0,0]=4 1001 B10R1.2 c1c(c(c(cn1)Br)O)C=O AB84418 [1,1,0,0,0,0|1,0,0]=3 1002 B10R1.2 c1c(c(c(cn1)Cl)Cl)C=O AB67605 [1,1,0,0,0,0|2,0,0]=4 1003 B10R1.2 c1c(c(c(cn1)Cl)F)C=O AB82970 [1,1,0,0,0,0|2,0,0]=4 1004 B10R1.2 c1c(c(c(cn1)Cl)N)C=O AB83651 [1,1,0,0,0,0|2,0,0]=4 1005 B10R1.2 c1c(c(c(cn1)Cl)O)C=O AB84026 [1,1,0,0,0,0|1,0,0]=3 1006 B10R1.2 c1c(c(c(cn1)F)Cl)C=O AB67658 [1,1,0,0,0,0|2,0,0]=4 1007 B10R1.2 c1c(c(c(cn1)N)Cl)C=O AB67745 [1,1,0,0,0,0|2,0,0]=4 1008 B10R1.2 c1c(c(c(cn1)N)N)C=O AB83667 [1,1,0,0,0,0|2,0,0]=4 1009 B10R1.2 c1c(c(c(cn1)N)O)C=O AB84419 [1,1,0,0,0,0|1,0,0]=3 1010 B10R1.2 c1c(c(c(cn1)O)Cl)C=O AB67784 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.2 c1cc(c(c(c1)Br)O)C#N PB14860 [1,1,0,0,0,0|1,0,1]=4 1012 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [1,1,0,0,0,0|0,0,0]=2 1013 B10R1.2 c1cc(c(c(c1)Br)O)CN MB05060 [1,1,0,0,0,0|1,0,1]=4 1014 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [1,1,0,0,0,0|1,0,0]=3 1015 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [1,1,0,0,0,0|1,0,0]=3 1016 B10R1.2 c1cc(c(c(c1)Cl)O)C#N MB08412 [1,1,0,0,0,0|1,0,1]=4 1017 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [1,1,0,0,0,0|0,0,0]=2 1018 B10R1.2 c1cc(c(c(c1)Cl)O)CN MB34616 [1,1,0,0,0,0|1,0,1]=4 1019 B10R1.2 c1cc(c(c(c1)F)O)C#N MB11932 [1,1,0,0,0,0|1,0,1]=4 1020 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [1,1,0,0,0,0|0,0,0]=2 1021 B10R1.2 c1cc(c(c(c1)F)O)CN MB05070 [1,1,0,0,0,0|1,0,1]=4 1022 B10R1.2 c1cc(c(c(c1)I)O)C#N MB14863 [1,1,0,0,0,0|1,0,1]=4 1023 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [1,1,0,0,0,0|0,0,0]=2 1024 B10R1.2 c1cc(c(c(c1)I)O)CN MB29107 [1,1,0,0,0,0|1,0,1]=4 1025 B10R1.2 c1cc(c(c(c1)N)O)C#N MB02411 [1,1,0,0,0,0|1,0,1]=4 1026 B10R1.2 c1cc(c(c(c1)N)O)CN MB34782 [1,1,0,0,0,0|1,0,1]=4 1027 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [1,1,0,0,0,0|1,0,0]=3 1028 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [1,1,0,0,0,0|1,0,0]=3 1029 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [1,1,0,0,0,0|1,0,0]=3 1030 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [1,1,0,0,0,0|1,0,0]=3 1031 B10R1.2 c1cnc(c(c1Br)N)C=O AB83752 [1,1,0,0,0,0|2,0,0]=4 1032 B10R1.2 c1cnc(c(c1Br)O)C=O AB84603 [1,1,0,0,0,0|1,0,0]=3 1033 B10R1.2 c1cnc(c(c1C=O)Cl)F AB66309 [1,1,0,0,0,0|2,0,0]=4 1034 B10R1.2 c1cnc(c(c1C=O)Cl)N AB83932 [1,1,0,0,0,0|2,0,0]=4 1035 B10R1.2 c1cnc(c(c1C=O)Cl)O AB70959 [1,1,0,0,0,0|2,0,0]=4 1036 B10R1.2 c1cnc(c(c1C=O)F)Cl AB20966 [1,1,0,0,0,0|2,0,0]=4 1037 B10R1.2 c1cnc(c(c1C=O)N)Br AB71718 [1,1,0,0,0,0|2,0,0]=4 1038 B10R1.2 c1cnc(c(c1C=O)N)Cl AB71714 [1,1,0,0,0,0|2,0,0]=4 1039 B10R1.2 c1cnc(c(c1C=O)N)N AB83595 [1,1,0,0,0,0|2,0,0]=4 1040 B10R1.2 c1cnc(c(c1C=O)O)Br AB69695 [1,1,0,0,0,0|1,0,0]=3 1041 B10R1.2 c1cnc(c(c1C=O)O)Cl AB69323 [1,1,0,0,0,0|1,0,0]=3 1042 B10R1.2 c1cnc(c(c1C=O)O)N AB84363 [1,1,0,0,0,0|1,0,0]=3 1043 B10R1.2 c1cnc(c(c1Cl)F)C=O AB70766 [1,1,0,0,0,0|2,0,0]=4 1044 B10R1.2 c1cnc(c(c1Cl)N)C=O AB83753 [1,1,0,0,0,0|2,0,0]=4 1045 B10R1.2 c1cnc(c(c1Cl)O)C=O AB75013 [1,1,0,0,0,0|1,0,0]=3 1046 B10R1.2 c1cnc(c(c1F)Cl)C=O AB83001 [1,1,0,0,0,0|2,0,0]=4 1047 B10R1.2 c1cnc(c(c1N)Cl)C=O AB83926 [1,1,0,0,0,0|2,0,0]=4 1048 B10R1.2 c1cnc(c(c1N)O)C=O AB84604 [1,1,0,0,0,0|1,0,0]=3 1049 B10R1.2 c1cnc(c(c1O)Cl)C=O AB75006 [1,1,0,0,0,0|2,0,0]=4 1050 B10R1.4 Cc1ccccc1CC=O AB11813 [1,1,0,0,0,0|1,0,0]=3 1051 B10R1.4 c1ccc(c(c1)CCN)O MB00877 [1,1,0,0,0,0|1,0,1]=4 1052 B10R1.4 c1ccc(c(c1)\C=N\O)Cl AB01188 [1,1,0,0,0,0|1,0,1]=4 1053 B10R1.20 C#Cc1ccccc1C=O AB17472 [1,1,0,0,0,0|1,0,0]=3 1054 B10R1.20 C#Cc1ccncc1C=O AB69095 [1,1,0,0,0,0|2,0,0]=4 1055 B10R1.20 C#Cc1cnccc1C=O AB69064 [1,1,0,0,0,0|2,0,0]=4 1056 B10R1.20 COc1c(cccn1)C=O PB26137 [1,1,0,0,0,0|1,0,0]=3 1057 B10R1.20 COc1c(nccn1)C=O AB55611 [1,1,0,0,0,0|2,0,0]=4 1058 B10R1.20 COc1ccccc1C#N AB00156 [1,1,0,0,0,0|1,0,1]=4 1059 B10R1.20 COc1ccccc1C=O AB00311 [1,1,0,0,0,0|0,0,0]=2 1060 B10R1.20 COc1cccnc1C=O AB22246 [1,1,0,0,0,0|1,0,0]=3 1061 B10R1.20 COc1ccncc1C=O AB17569 [1,1,0,0,0,0|1,0,0]=3 1062 B10R1.20 COc1cnccc1C=O AB17541 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.20 CSc1c(cccn1)C=O MB07044 [1,1,0,0,0,0|1,1,0]=4 1064 B10R1.20 c1cc(c(nc1)C#N)C=O AB31409 [1,1,0,0,0,0|2,0,0]=4 1065 B10R1.20 c1cc(c(nc1)C=O)C#N AB54498 [1,1,0,0,0,0|2,0,0]=4 1066 B10R1.20 c1cc(c(nc1)CCl)C=O AB69680 [1,1,0,0,0,0|2,0,0]=4 1067 B10R1.20 c1cc(c(nc1)CN)C=O AB31410 [1,1,0,0,0,0|2,0,0]=4 1068 B10R1.20 c1cncc(c1C#N)C=O AB74128 [1,1,0,0,0,0|2,0,0]=4 1069 B10R1.20 c1cncc(c1C=O)C#N AB67707 [1,1,0,0,0,0|2,0,0]=4 1070 B10R1.20 c1cncc(c1CCl)C=O AB69679 [1,1,0,0,0,0|2,0,0]=4 1071 B10R1.30 CCc1cc(ccc1O)Br MB00480 [1,1,0,0,0,0|1,0,1]=4 1072 B10R1.30 CCc1cc(ccc1O)C MB23622 [1,1,0,0,0,0|1,0,1]=4 1073 B10R1.30 CCc1cc(ccc1O)Cl MB00701 [1,1,0,0,0,0|1,0,1]=4 1074 B10R1.30 CCc1cc(ccc1O)I MB23657 [1,1,0,0,0,0|1,0,1]=4 1075 B10R1.30 CCc1cc(ccc1O)N MB23663 [1,1,0,0,0,0|1,0,1]=4 1076 B10R1.30 CNc1cc(ccc1O)Br MB32072 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.30 CNc1cc(ccc1O)F MB26737 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.30 CNc1cc(ccc1O)I MB35760 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.30 CNc1cc(ccc1O)N MB28647 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.30 COc1cc(ccc1O)Br PB30583 [1,1,0,0,0,0|2,0,0]=4 1081 B10R1.30 COc1cc(ccc1O)I MB05217 [1,1,0,0,0,0|2,0,0]=4 1082 B10R1.30 CSc1cc(ccc1O)Br MB28713 [1,1,0,0,0,0|2,0,0]=4 1083 B10R1.30 CSc1cc(ccc1O)Cl MB35043 [1,1,0,0,0,0|2,0,0]=4 1084 B10R1.30 CSc1cc(ccc1O)F MB35476 [1,1,0,0,0,0|2,0,0]=4 1085 B10R1.30 CSc1cc(ccc1O)N MB29519 [1,1,0,0,0,0|2,0,0]=4 1086 B10R1.30 Cc1c(cc(cn1)Cl)C=O AB62434 [1,1,0,0,0,0|2,0,0]=4 1087 B10R1.30 Cc1cc(c(cn1)Br)C=O AB68164 [1,1,0,0,0,0|2,0,0]=4 1088 B10R1.30 Cc1cc(c(cn1)C)C=O AB74126 [1,1,0,0,0,0|2,0,0]=4 1089 B10R1.30 Cc1cc(c(cn1)Cl)C=O AB68146 [1,1,0,0,0,0|2,0,0]=4 1090 B10R1.30 Cc1cc(c(cn1)N)C=O AB83642 [1,1,0,0,0,0|2,0,0]=4 1091 B10R1.30 Cc1cc(c(cn1)O)C=O AB76792 [1,1,0,0,0,0|1,0,0]=3 1092 B10R1.30 Cc1cc(c(nc1)Br)C=O AB71097 [1,1,0,0,0,0|2,0,0]=4 1093 B10R1.30 Cc1cc(c(nc1)C)C=O AB71657 [1,1,0,0,0,0|2,0,0]=4 1094 B10R1.30 Cc1cc(c(nc1)Cl)C=O AB41813 [1,1,0,0,0,0|2,0,0]=4 1095 B10R1.30 Cc1cc(c(nc1)F)C=O AB65261 [1,1,0,0,0,0|2,0,0]=4 1096 B10R1.30 Cc1cc(c(nc1)N)C=O AB51533 [1,1,0,0,0,0|2,0,0]=4 1097 B10R1.30 Cc1cc(c(nc1)O)C=O AB71365 [1,1,0,0,0,0|1,0,0]=3 1098 B10R1.30 Cc1ccc(c(c1)C#N)O MB36141 [1,1,0,0,0,0|1,0,1]=4 1099 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [1,1,0,0,0,0|1,0,0]=3 1100 B10R1.30 Cc1ccc(c(c1)SC)O MB34646 [1,1,0,0,0,0|2,0,0]=4 1101 B10R1.30 Cc1ccc(c(n1)C=O)Br AB68163 [1,1,0,0,0,0|2,0,0]=4 1102 B10R1.30 Cc1ccc(c(n1)C=O)Cl AB68143 [1,1,0,0,0,0|2,0,0]=4 1103 B10R1.30 Cc1ccc(c(n1)C=O)N AB76244 [1,1,0,0,0,0|2,0,0]=4 1104 B10R1.30 Cc1ccc(c(n1)C=O)O AB62933 [1,1,0,0,0,0|1,0,0]=3 1105 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [1,1,0,0,0,0|1,0,0]=3 1106 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [1,1,0,0,0,0|1,0,0]=3 1107 B10R1.30 Cc1ccc(nc1C=O)C AB75403 [1,1,0,0,0,0|2,0,0]=4 1108 B10R1.30 Cc1ccc(nc1C=O)Cl AB75110 [1,1,0,0,0,0|2,0,0]=4 1109 B10R1.30 Cc1ccc(nc1C=O)F AB75170 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.30 Cc1cnc(cc1C=O)Cl AB67498 [1,1,0,0,0,0|2,0,0]=4 1111 B10R1.30 Cc1cnc(cc1C=O)F AB71344 [1,1,0,0,0,0|2,0,0]=4 1112 B10R1.30 c1c(c(cnc1Br)Br)C=O AB56403 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.30 c1c(c(cnc1Br)Cl)C=O AB54689 [1,1,0,0,0,0|2,0,0]=4 1114 B10R1.30 c1c(c(cnc1Br)F)C=O AB52575 [1,1,0,0,0,0|2,0,0]=4 1115 B10R1.30 c1c(c(cnc1Br)N)C=O AB76683 [1,1,0,0,0,0|2,0,0]=4 1116 B10R1.30 c1c(c(cnc1Br)O)C=O AB69284 [1,1,0,0,0,0|1,0,0]=3 1117 B10R1.30 c1c(c(cnc1Cl)Br)C=O PB13444 [1,1,0,0,0,0|2,0,0]=4 1118 B10R1.30 c1c(c(cnc1Cl)Cl)C=O AB24822 [1,1,0,0,0,0|2,0,0]=4 1119 B10R1.30 c1c(c(cnc1Cl)F)C=O AB20993 [1,1,0,0,0,0|2,0,0]=4 1120 B10R1.30 c1c(c(cnc1Cl)N)C=O AB64790 [1,1,0,0,0,0|2,0,0]=4 1121 B10R1.30 c1c(c(cnc1Cl)O)C=O AB67782 [1,1,0,0,0,0|1,0,0]=3 1122 B10R1.30 c1c(c(cnc1N)Br)C=O AB66638 [1,1,0,0,0,0|2,0,0]=4 1123 B10R1.30 c1c(c(cnc1N)Cl)C=O AB72352 [1,1,0,0,0,0|2,0,0]=4 1124 B10R1.30 c1c(c(cnc1N)F)C=O AB72351 [1,1,0,0,0,0|2,0,0]=4 1125 B10R1.30 c1c(c(cnc1N)N)C=O AB76707 [1,1,0,0,0,0|2,0,0]=4 1126 B10R1.30 c1c(c(cnc1N)O)C=O AB84402 [1,1,0,0,0,0|1,0,0]=3 1127 B10R1.30 c1c(cnc(c1C=O)Br)F AB70943 [1,1,0,0,0,0|2,0,0]=4 1128 B10R1.30 c1c(cnc(c1C=O)Cl)Br PB20287 [1,1,0,0,0,0|2,0,0]=4 1129 B10R1.30 c1c(cnc(c1C=O)Cl)F AB13605 [1,1,0,0,0,0|2,0,0]=4 1130 B10R1.30 c1c(cnc(c1C=O)F)Br PB29718 [1,1,0,0,0,0|2,0,0]=4 1131 B10R1.30 c1c(cnc(c1C=O)F)Cl AB20969 [1,1,0,0,0,0|2,0,0]=4 1132 B10R1.30 c1c(cnc(c1C=O)N)Br AB50973 [1,1,0,0,0,0|2,0,0]=4 1133 B10R1.30 c1c(cnc(c1C=O)N)Cl AB58421 [1,1,0,0,0,0|2,0,0]=4 1134 B10R1.30 c1c(cnc(c1C=O)N)F AB70294 [1,1,0,0,0,0|2,0,0]=4 1135 B10R1.30 c1c(cnc(c1C=O)O)Br AB70946 [1,1,0,0,0,0|1,0,0]=3 1136 B10R1.30 c1c(cnc(c1C=O)O)Cl AB70935 [1,1,0,0,0,0|1,0,0]=3 1137 B10R1.30 c1c(cnc(c1C=O)O)N AB84511 [1,1,0,0,0,0|1,0,0]=3 1138 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [1,1,0,0,0,0|1,0,0]=3 1139 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [1,1,0,0,0,0|1,0,0]=3 1140 B10R1.30 c1cc(c(cc1Br)CN)O AB10938 [1,1,0,0,0,0|1,0,1]=4 1141 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [1,1,0,0,0,0|0,0,0]=2 1142 B10R1.30 c1cc(c(cc1Cl)CN)O AB23336 [1,1,0,0,0,0|1,0,1]=4 1143 B10R1.30 c1cc(c(cc1F)C#N)O MB10100 [1,1,0,0,0,0|1,0,1]=4 1144 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [1,1,0,0,0,0|1,0,0]=3 1145 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [1,1,0,0,0,0|1,0,0]=3 1146 B10R1.30 c1cc(c(cc1F)CN)O MB12059 [1,1,0,0,0,0|1,0,1]=4 1147 B10R1.30 c1cc(c(cc1I)C#N)O MB02487 [1,1,0,0,0,0|1,0,1]=4 1148 B10R1.30 c1cc(c(cc1I)CN)O MB08421 [1,1,0,0,0,0|1,0,1]=4 1149 B10R1.30 c1cc(c(cc1N)C#N)O MB01949 [1,1,0,0,0,0|1,0,1]=4 1150 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [1,1,0,0,0,0|0,0,0]=2 1151 B10R1.30 c1cc(c(cc1N)CN)O MB10073 [1,1,0,0,0,0|1,0,1]=4 1152 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [1,1,0,0,0,0|1,0,0]=3 1153 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [1,1,0,0,0,0|1,0,0]=3 1154 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [1,1,0,0,0,0|1,0,0]=3 1155 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [1,1,0,0,0,0|1,0,0]=3 1156 B10R1.30 c1cc(nc(c1Br)C=O)Cl AB68225 [1,1,0,0,0,0|2,0,0]=4 1157 B10R1.30 c1cc(nc(c1Cl)C=O)Br AB68236 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.30 c1cc(nc(c1Cl)C=O)Cl AB66502 [1,1,0,0,0,0|2,0,0]=4 1159 B10R1.30 c1cc(nc(c1F)C=O)Br PB23527 [1,1,0,0,0,0|2,0,0]=4 1160 B10R1.30 c1cc(nc(c1F)C=O)Cl AB20968 [1,1,0,0,0,0|2,0,0]=4 1161 B10R1.30 c1cc(nc(c1N)C=O)Br AB83719 [1,1,0,0,0,0|2,0,0]=4 1162 B10R1.30 c1cc(nc(c1N)C=O)Cl AB76329 [1,1,0,0,0,0|2,0,0]=4 1163 B10R1.30 c1cc(nc(c1N)C=O)N AB83733 [1,1,0,0,0,0|2,0,0]=4 1164 B10R1.30 c1cc(nc(c1O)C=O)Br AB84561 [1,1,0,0,0,0|1,0,0]=3 1165 B10R1.30 c1cc(nc(c1O)C=O)Cl AB74851 [1,1,0,0,0,0|1,0,0]=3 1166 B10R1.30 c1cc(nc(c1O)C=O)N AB84562 [1,1,0,0,0,0|1,0,0]=3 1167 B10R1.61 B(c1ccccc1O)(O)O AB08053 [1,1,0,0,0,0|1,0,1]=4 1168 B10R1.61 CC(=O)c1c(cccn1)Cl PB28312 [1,1,0,0,0,0|2,0,0]=4 1169 B10R1.61 CC(=O)c1c(cccn1)F PB26212 [1,1,0,0,0,0|2,0,0]=4 1170 B10R1.61 CC(=O)c1c(cccn1)N AB08681 [1,1,0,0,0,0|2,0,0]=4 1171 B10R1.61 CC(=O)c1cccnc1Br AB18171 [1,1,0,0,0,0|2,0,0]=4 1172 B10R1.61 CC(=O)c1cccnc1Cl PB32351 [1,1,0,0,0,0|2,0,0]=4 1173 B10R1.61 CC(=O)c1cccnc1F AB41104 [1,1,0,0,0,0|2,0,0]=4 1174 B10R1.61 CC(=O)c1cccnc1N AB11689 [1,1,0,0,0,0|2,0,0]=4 1175 B10R1.61 CC(=O)c1ccncc1Br PB12099 [1,1,0,0,0,0|2,0,0]=4 1176 B10R1.61 CC(=O)c1ccncc1F PB22036 [1,1,0,0,0,0|2,0,0]=4 1177 B10R1.61 CC(=O)c1ccncc1N AB41121 [1,1,0,0,0,0|2,0,0]=4 1178 B10R1.61 CC(=O)c1cnccc1Br AB64732 [1,1,0,0,0,0|2,0,0]=4 1179 B10R1.61 CC(=O)c1cnccc1Cl AB64447 [1,1,0,0,0,0|2,0,0]=4 1180 B10R1.61 CC(=O)c1cnccc1F AB41107 [1,1,0,0,0,0|2,0,0]=4 1181 B10R1.61 CN(C)c1ccccc1O MB08302 [1,1,0,0,0,0|2,0,0]=4 1182 B10R1.61 Cc1c(cccn1)C(=O)C AB03570 [1,1,0,0,0,0|2,0,0]=4 1183 B10R1.61 Cc1c(cccn1)C(=O)O PB27380 [1,1,0,0,0,0|2,0,0]=4 1184 B10R1.61 Cc1ccccc1C(=N)N AB18273 [1,1,0,0,0,0|2,0,0]=4 1185 B10R1.61 Cc1ccccc1C(=S)N AB16881 [1,1,0,0,0,0|1,1,0]=4 1186 B10R1.61 Cc1cccnc1C(=O)O PB10121 [1,1,0,0,0,0|2,0,0]=4 1187 B10R1.61 Cc1ccncc1C(=O)C AB45306 [1,1,0,0,0,0|2,0,0]=4 1188 B10R1.61 Cc1ccncc1C(=O)O PB17119 [1,1,0,0,0,0|2,0,0]=4 1189 B10R1.61 Cc1cnccc1C(=O)O PB12103 [1,1,0,0,0,0|2,0,0]=4 1190 B10R1.61 c1cc(c(nc1)Br)C(=O)O AB09561 [1,1,0,0,0,0|2,0,0]=4 1191 B10R1.61 c1cc(c(nc1)C(=O)N)N PB24920 [1,1,0,0,0,0|2,0,0]=4 1192 B10R1.61 c1cc(c(nc1)C(=O)O)Cl PB30690 [1,1,0,0,0,0|2,0,0]=4 1193 B10R1.61 c1cc(c(nc1)C(=O)O)F PB12310 [1,1,0,0,0,0|2,0,0]=4 1194 B10R1.61 c1cc(c(nc1)C(=O)O)I AB10544 [1,1,0,0,0,0|2,0,0]=4 1195 B10R1.61 c1cc(c(nc1)C(=O)O)N PB32134 [1,1,0,0,0,0|2,0,0]=4 1196 B10R1.61 c1cc(c(nc1)Cl)C(=O)O AB00651 [1,1,0,0,0,0|2,0,0]=4 1197 B10R1.61 c1cc(c(nc1)F)C(=O)O AB01814 [1,1,0,0,0,0|2,0,0]=4 1198 B10R1.61 c1cc(c(nc1)N)C(=O)O PB30535 [1,1,0,0,0,0|2,0,0]=4 1199 B10R1.61 c1cc(c(nc1)O)C(=O)O AB01020 [1,1,0,0,0,0|1,0,0]=3 1200 B10R1.61 c1cc(c(nc1)O)[N+](=O)[O-] PB30530 [1,1,0,0,0,0|2,0,0]=4 1201 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])O AB00667 [1,1,0,0,0,0|2,0,0]=4 1202 B10R1.61 c1ccc(c(c1)C(=N)N)Br AB18326 [1,1,0,0,0,0|2,0,0]=4 1203 B10R1.61 c1ccc(c(c1)C(=N)N)Cl AB05888 [1,1,0,0,0,0|2,0,0]=4 1204 B10R1.61 c1ccc(c(c1)C(=N)N)F AB18318 [1,1,0,0,0,0|2,0,0]=4 1205 B10R1.61 c1ccc(c(c1)C(=N)N)O AB55085 [1,1,0,0,0,0|1,0,0]=3 1206 B10R1.61 c1ccc(c(c1)C(=O)O)Br AB00223 [1,1,0,0,0,0|1,0,0]=3 1207 B10R1.61 c1ccc(c(c1)C(=S)N)Br AB21272 [1,1,0,0,0,0|1,1,0]=4 1208 B10R1.61 c1ccc(c(c1)C(=S)N)Cl AB01839 [1,1,0,0,0,0|1,1,0]=4 1209 B10R1.61 c1ccc(c(c1)C(=S)N)N AB07816 [1,1,0,0,0,0|1,1,0]=4 1210 B10R1.61 c1cnc(c(n1)C(=O)N)O CB10307 [1,1,0,0,0,0|2,0,0]=4 1211 B10R1.61 c1cnc(c(n1)C(=O)O)O PB18475 [1,1,0,0,0,0|2,0,0]=4 1212 B10R1.61 c1cncc(c1Br)C(=O)O AB18009 [1,1,0,0,0,0|2,0,0]=4 1213 B10R1.61 c1cncc(c1C(=O)N)O MB13532 [1,1,0,0,0,0|1,0,0]=3 1214 B10R1.61 c1cncc(c1C(=O)O)Br PB10062 [1,1,0,0,0,0|2,0,0]=4 1215 B10R1.61 c1cncc(c1C(=O)O)Cl AB13346 [1,1,0,0,0,0|2,0,0]=4 1216 B10R1.61 c1cncc(c1C(=O)O)I AB09565 [1,1,0,0,0,0|2,0,0]=4 1217 B10R1.61 c1cncc(c1C(=O)O)N PB17122 [1,1,0,0,0,0|2,0,0]=4 1218 B10R1.61 c1cncc(c1C(=O)O)O PB29057 [1,1,0,0,0,0|1,0,0]=3 1219 B10R1.61 c1cncc(c1Cl)C(=O)O AB03598 [1,1,0,0,0,0|2,0,0]=4 1220 B10R1.61 c1cncc(c1F)C(=O)O AB18036 [1,1,0,0,0,0|2,0,0]=4 1221 B10R1.61 c1cncc(c1I)C(=O)O AB15003 [1,1,0,0,0,0|2,0,0]=4 1222 B10R1.61 c1cncc(c1N)C(=O)N PB21456 [1,1,0,0,0,0|2,0,0]=4 1223 B10R1.61 c1cncc(c1N)C(=O)O PB26016 [1,1,0,0,0,0|2,0,0]=4 1224 B10R1.61 c1cncc(c1O)C(=O)N MB06099 [1,1,0,0,0,0|1,0,0]=3 1225 B10R1.61 c1cncc(c1O)C(=O)O AB01802 [1,1,0,0,0,0|1,0,0]=3 1226 B10R1.61 c1cncc(c1O)[N+](=O)[O-] PB12105 [1,1,0,0,0,0|2,0,0]=4 1227 B10R1.61 c1cnnc(c1C(=O)O)O AB76276 [1,1,0,0,0,0|2,0,0]=4 1228 B10R1.245 CCc1c(cccc1Br)O MB23614 [1,1,0,0,0,0|1,0,1]=4 1229 B10R1.245 CCc1c(cccc1Cl)O MB23615 [1,1,0,0,0,0|1,0,1]=4 1230 B10R1.245 CCc1c(cccc1F)O MB23585 [1,1,0,0,0,0|1,0,1]=4 1231 B10R1.245 CCc1c(cccc1I)O MB23587 [1,1,0,0,0,0|1,0,1]=4 1232 B10R1.245 CCc1c(cccc1O)C MB23554 [1,1,0,0,0,0|1,0,1]=4 1233 B10R1.245 CCc1c(cccc1O)N MB23558 [1,1,0,0,0,0|1,0,1]=4 1234 B10R1.245 CNc1c(cccc1Br)O MB31500 [1,1,0,0,0,0|2,0,0]=4 1235 B10R1.245 CNc1c(cccc1Cl)O MB33359 [1,1,0,0,0,0|2,0,0]=4 1236 B10R1.245 CNc1c(cccc1F)O MB29137 [1,1,0,0,0,0|2,0,0]=4 1237 B10R1.245 CNc1c(cccc1I)O MB30346 [1,1,0,0,0,0|2,0,0]=4 1238 B10R1.245 CNc1c(cccc1O)N MB01610 [1,1,0,0,0,0|2,0,0]=4 1239 B10R1.245 COc1c(cccc1Br)O MB09199 [1,1,0,0,0,0|2,0,0]=4 1240 B10R1.245 COc1c(cccc1Cl)O MB34190 [1,1,0,0,0,0|2,0,0]=4 1241 B10R1.245 COc1c(cccc1I)O MB33689 [1,1,0,0,0,0|2,0,0]=4 1242 B10R1.245 COc1c(cccc1O)N MB14425 [1,1,0,0,0,0|2,0,0]=4 1243 B10R1.245 CSc1c(cccc1Br)O MB32344 [1,1,0,0,0,0|2,0,0]=4 1244 B10R1.245 CSc1c(cccc1Cl)O MB25403 [1,1,0,0,0,0|2,0,0]=4 1245 B10R1.245 CSc1c(cccc1I)O MB36697 [1,1,0,0,0,0|2,0,0]=4 1246 B10R1.245 CSc1c(cccc1O)N MB26572 [1,1,0,0,0,0|2,0,0]=4 1247 B10R1.245 Cc1c(c(ccn1)Br)C=O AB66858 [1,1,0,0,0,0|2,0,0]=4 1248 B10R1.245 Cc1c(c(ccn1)Cl)C=O AB66851 [1,1,0,0,0,0|2,0,0]=4 1249 B10R1.245 Cc1c(c(ccn1)F)C=O AB68033 [1,1,0,0,0,0|2,0,0]=4 1250 B10R1.245 Cc1c(c(ccn1)N)C=O AB68110 [1,1,0,0,0,0|2,0,0]=4 1251 B10R1.245 Cc1c(c(ccn1)O)C=O AB84477 [1,1,0,0,0,0|1,0,0]=3 1252 B10R1.245 Cc1cccc(c1C#N)O MB02406 [1,1,0,0,0,0|1,0,1]=4 1253 B10R1.245 Cc1cccc(c1C=O)O MB14829 [1,1,0,0,0,0|0,0,0]=2 1254 B10R1.245 Cc1cccc(c1CN)O MB25667 [1,1,0,0,0,0|1,0,1]=4 1255 B10R1.245 Cc1cccc(c1OC)O MB33579 [1,1,0,0,0,0|2,0,0]=4 1256 B10R1.245 Cc1cccc(c1SC)O MB08534 [1,1,0,0,0,0|2,0,0]=4 1257 B10R1.245 Cc1ccnc(c1C=O)C AB63129 [1,1,0,0,0,0|2,0,0]=4 1258 B10R1.245 Cc1ccnc(c1C=O)Cl AB44897 [1,1,0,0,0,0|2,0,0]=4 1259 B10R1.245 Cc1ccnc(c1C=O)F AB44902 [1,1,0,0,0,0|2,0,0]=4 1260 B10R1.245 Cc1ccnc(c1C=O)N AB70910 [1,1,0,0,0,0|2,0,0]=4 1261 B10R1.245 Cc1ccnc(c1C=O)O AB71364 [1,1,0,0,0,0|1,0,0]=3 1262 B10R1.245 Cc1cncc(c1C=O)C AB24811 [1,1,0,0,0,0|2,0,0]=4 1263 B10R1.245 Cc1cncc(c1C=O)Cl AB75138 [1,1,0,0,0,0|2,0,0]=4 1264 B10R1.245 Cc1cncc(c1C=O)F AB75180 [1,1,0,0,0,0|2,0,0]=4 1265 B10R1.245 Cc1cncc(c1C=O)N AB83619 [1,1,0,0,0,0|2,0,0]=4 1266 B10R1.245 Cc1cncc(c1C=O)O AB75255 [1,1,0,0,0,0|1,0,0]=3 1267 B10R1.245 c1c(c(c(cn1)Br)C=O)N AB83602 [1,1,0,0,0,0|2,0,0]=4 1268 B10R1.245 c1c(c(c(cn1)Br)C=O)O AB84381 [1,1,0,0,0,0|1,0,0]=3 1269 B10R1.245 c1c(c(c(cn1)Cl)C=O)Cl AB17460 [1,1,0,0,0,0|2,0,0]=4 1270 B10R1.245 c1c(c(c(cn1)Cl)C=O)F AB70955 [1,1,0,0,0,0|2,0,0]=4 1271 B10R1.245 c1c(c(c(cn1)Cl)C=O)N AB83603 [1,1,0,0,0,0|2,0,0]=4 1272 B10R1.245 c1c(c(c(cn1)Cl)C=O)O AB75024 [1,1,0,0,0,0|1,0,0]=3 1273 B10R1.245 c1c(c(c(cn1)F)C=O)F AB31964 [1,1,0,0,0,0|2,0,0]=4 1274 B10R1.245 c1c(c(c(cn1)N)C=O)N AB83622 [1,1,0,0,0,0|2,0,0]=4 1275 B10R1.245 c1c(c(c(cn1)O)C=O)N AB84386 [1,1,0,0,0,0|1,0,0]=3 1276 B10R1.245 c1cc(c(c(c1)Br)C#N)O MB12048 [1,1,0,0,0,0|1,0,1]=4 1277 B10R1.245 c1cc(c(c(c1)Br)C=O)Br CB11474 [1,1,0,0,0,0|1,0,0]=3 1278 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [1,1,0,0,0,0|1,0,0]=3 1279 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [1,1,0,0,0,0|1,0,0]=3 1280 B10R1.245 c1cc(c(c(c1)Br)C=O)N PB34549 [1,1,0,0,0,0|1,0,0]=3 1281 B10R1.245 c1cc(c(c(c1)Br)C=O)O AB43626 [1,1,0,0,0,0|0,0,0]=2 1282 B10R1.245 c1cc(c(c(c1)Br)CN)O MB12052 [1,1,0,0,0,0|1,0,1]=4 1283 B10R1.245 c1cc(c(c(c1)Cl)C#N)O PB19932 [1,1,0,0,0,0|1,0,1]=4 1284 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [1,1,0,0,0,0|1,0,0]=3 1285 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [1,1,0,0,0,0|0,0,0]=2 1286 B10R1.245 c1cc(c(c(c1)Cl)CN)O MB15041 [1,1,0,0,0,0|1,0,1]=4 1287 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [1,1,0,0,0,0|0,0,0]=2 1288 B10R1.245 c1cc(c(c(c1)F)CN)O MB03739 [1,1,0,0,0,0|1,0,1]=4 1289 B10R1.245 c1cc(c(c(c1)I)C#N)O MB37282 [1,1,0,0,0,0|1,0,1]=4 1290 B10R1.245 c1cc(c(c(c1)I)C=O)O MB14699 [1,1,0,0,0,0|0,0,0]=2 1291 B10R1.245 c1cc(c(c(c1)I)CN)O MB31821 [1,1,0,0,0,0|1,0,1]=4 1292 B10R1.245 c1cc(c(c(c1)O)C#N)N MB34868 [1,1,0,0,0,0|1,0,1]=4 1293 B10R1.245 c1cc(c(c(c1)O)C=O)N MB27161 [1,1,0,0,0,0|0,0,0]=2 1294 B10R1.245 c1cc(c(c(c1)O)CN)N MB31845 [1,1,0,0,0,0|1,0,1]=4 1295 B10R1.245 c1cnc(c(c1Br)C=O)Cl AB62918 [1,1,0,0,0,0|2,0,0]=4 1296 B10R1.245 c1cnc(c(c1Br)C=O)N AB83695 [1,1,0,0,0,0|2,0,0]=4 1297 B10R1.245 c1cnc(c(c1Br)C=O)O AB84479 [1,1,0,0,0,0|1,0,0]=3 1298 B10R1.245 c1cnc(c(c1Cl)C=O)Cl AB41952 [1,1,0,0,0,0|2,0,0]=4 1299 B10R1.245 c1cnc(c(c1Cl)C=O)F AB70637 [1,1,0,0,0,0|2,0,0]=4 1300 B10R1.245 c1cnc(c(c1Cl)C=O)N PB22850 [1,1,0,0,0,0|2,0,0]=4 1301 B10R1.245 c1cnc(c(c1Cl)C=O)O AB84482 [1,1,0,0,0,0|1,0,0]=3 1302 B10R1.245 c1cnc(c(c1F)C=O)Cl AB68028 [1,1,0,0,0,0|2,0,0]=4 1303 B10R1.245 c1cnc(c(c1I)C=O)Cl MB02652 [1,1,0,0,0,0|2,0,0]=4 1304 B10R1.245 c1cnc(c(c1N)C=O)Br AB83694 [1,1,0,0,0,0|2,0,0]=4 1305 B10R1.245 c1cnc(c(c1N)C=O)Cl AB52768 [1,1,0,0,0,0|2,0,0]=4 1306 B10R1.245 c1cnc(c(c1N)C=O)O AB84486 [1,1,0,0,0,0|1,0,0]=3 1307 B10R1.245 c1cnc(c(c1O)C=O)Br AB84458 [1,1,0,0,0,0|1,0,0]=3 1308 B10R1.245 c1cnc(c(c1O)C=O)Cl AB66422 [1,1,0,0,0,0|1,0,0]=3 1309 B10R1.245 c1cnc(c(c1O)C=O)N AB84460 [1,1,0,0,0,0|1,0,0]=3 1310 B10R1.118 Cc1cc(c(cc1Cl)Cl)N CB11300 [1,1,0,0,0,0|2,0,0]=4 1311 B10R1.118 Cc1cc(c(cc1N)Cl)Br CB11038 [1,1,0,0,0,0|2,0,0]=4 1312 B10R1.119 Cc1ccc(c(c1O)C)O AB24905 [1,1,0,0,0,0|1,0,1]=4 1313 B10R1.119 Cc1ccc(c(c1O)Cl)N AB13339 [1,1,0,0,0,0|1,0,1]=4 1314 B10R1.59 Cc1cc(c(o1)C)C(=O)O AB03078 [0,1,0,0,1,0|2,0,0]=4 1315 B10R1.59 Cc1cc(c(s1)N)C(=O)N AB03142 [0,1,0,0,1,0|2,0,0]=4 1316 B10R1.59 Cc1cc(c(s1)N)C(=O)O AB22303 [0,1,0,0,1,0|2,0,0]=4 1317 B12R1.46 B(c1cc(ccc1C=O)C)(O)O AB08826 [0,2,0,0,0,0|0,0,0]=2 1318 B12R1.46 B(c1cc(ccc1C=O)Cl)(O)O AB14723 [0,2,0,0,0,0|1,0,0]=3 1319 B12R1.46 B(c1cc(ccc1OC)C)(O)O AB11186 [0,2,0,0,0,0|2,0,0]=4 1320 B12R1.46 CC(C)c1cc(ccc1C=O)O MB22442 [0,2,0,0,0,0|2,0,0]=4 1321 B12R1.46 CN(C)c1cc(ccc1C=O)O MB36667 [0,2,0,0,0,0|2,0,0]=4 1322 B12R1.46 Cc1cc(c(nc1)C=O)[N+](=O)[O-] AB58413 [0,2,0,0,0,0|1,0,1]=4 1323 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])C=O AB46097 [0,2,0,0,0,0|0,0,1]=3 1324 B12R1.46 c1cc(c(cc1Br)[N+](=O)[O-])C=O AB06155 [0,2,0,0,0,0|1,0,1]=4 1325 B12R1.46 c1cc(c(cc1Cl)[N+](=O)[O-])C=O AB02299 [0,2,0,0,0,0|1,0,1]=4 1326 B12R1.46 c1cc(c(cc1F)[N+](=O)[O-])C=O AB09704 [0,2,0,0,0,0|1,0,1]=4 1327 B12R1.46 c1cc(c(cc1O)C(=O)N)C=O MB26394 [0,2,0,0,0,0|1,0,1]=4 1328 B12R1.46 c1cc(c(cc1O)C(=O)O)C=O MB31349 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.57 CC(=O)c1ccc(nc1OC)Cl AB64676 [0,2,0,0,0,0|2,0,0]=4 1330 B12R1.57 CCc1cc(ccc1C(=O)N)O MB23744 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.57 CCc1cc(ccc1C(=O)O)O MB23747 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.57 CNc1cc(ccc1C(=O)N)O MB36251 [0,2,0,0,0,0|2,0,0]=4 1333 B12R1.57 CNc1cc(ccc1C(=O)O)O MB33236 [0,2,0,0,0,0|2,0,0]=4 1334 B12R1.57 COc1c(ccc(n1)Br)C(=O)O AB67021 [0,2,0,0,0,0|2,0,0]=4 1335 B12R1.57 COc1c(ccc(n1)Cl)C(=O)O AB64672 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.57 COc1c(ccc(n1)F)C(=O)O AB67028 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.57 COc1c(ccc(n1)N)C(=O)O AB43430 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.57 COc1cc(ccc1C(=O)N)O MB26783 [0,2,0,0,0,0|1,0,0]=3 1339 B12R1.57 COc1cc(ccc1C(=O)O)O MB03687 [0,2,0,0,0,0|1,0,0]=3 1340 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F AB02974 [0,2,0,0,0,0|2,0,0]=4 1341 B12R1.57 COc1cc(ncc1C(=O)O)Br AB67868 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.57 COc1cc(ncc1C(=O)O)Cl AB55875 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.57 COc1cc(ncc1C(=O)O)F AB67874 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.57 COc1cc(ncc1C(=O)O)N AB67877 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.57 CSc1cc(ccc1C(=O)N)O MB27987 [0,2,0,0,0,0|1,1,0]=4 1346 B12R1.57 CSc1cc(ccc1C(=O)O)O MB31488 [0,2,0,0,0,0|1,1,0]=4 1347 B12R1.57 Cc1ccc(c(c1)C=O)[N+](=O)[O-] AB48476 [0,2,0,0,0,0|1,0,1]=4 1348 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] AB00874 [0,2,0,0,0,0|1,0,0]=3 1349 B12R1.57 c1cc(c(cc1O)C#N)C(=O)N MB34280 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.57 c1cc(c(cc1O)C#N)C(=O)O MB38049 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.57 c1cc(c(cc1O)C=O)C(=O)N MB35479 [0,2,0,0,0,0|1,0,1]=4 1352 B12R1.57 c1cc(c(cc1O)C=O)C(=O)O MB26938 [0,2,0,0,0,0|1,0,1]=4 1353 B12R1.57 c1cc(c(cc1O)CN)C(=O)N MB29099 [0,2,0,0,0,0|2,0,0]=4 1354 B12R1.57 c1cc(c(cc1O)CN)C(=O)O MB27880 [0,2,0,0,0,0|2,0,0]=4 1355 B12R1.78 COc1c(cnc(n1)OC)C=O AB03704 [0,2,0,0,0,0|2,0,0]=4 1356 B12R1.78 COc1cc(ncc1C=O)OC AB74664 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.78 COc1ccc(c(n1)OC)C=O AB43523 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.78 COc1cnc(c(n1)OC)C=O AB60453 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.233 Cc1ccc(c(c1)O)OC(C)C MB13554 [0,2,0,0,0,0|1,0,1]=4 1360 B12R1.544 c1cc(c(c(c1CC=O)F)F)Br AB31764 [0,2,0,0,0,0|2,0,0]=4 1361 B12R1.544 c1cc(c(c(c1CC=O)F)F)Cl AB31767 [0,2,0,0,0,0|2,0,0]=4 1362 B12R1.544 c1cc(c(c(c1CC=O)F)F)F AB24856 [0,2,0,0,0,0|2,0,0]=4 1363 B12R1.544 c1cc(c(c(c1CC=O)F)F)I AB31760 [0,2,0,0,0,0|2,0,0]=4 1364 B12R1.544 c1cc(c(c(c1CC=O)F)F)N AB31770 [0,2,0,0,0,0|2,0,0]=4 1365 B12R1.1703 CCC(=O)c1ccc(cc1F)Br MB09679 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.1703 CNC(=O)c1ccc(cc1Br)O MB30771 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O MB37760 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.1703 CNC(=O)c1ccc(cc1F)O MB34809 [0,2,0,0,0,0|2,0,0]=4 1369 B12R1.1703 CNC(=O)c1ccc(cc1I)O MB34084 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.1703 CNC(=O)c1ccc(cc1N)Br AB65732 [0,2,0,0,0,0|2,0,0]=4 1371 B12R1.1703 CNC(=O)c1ccc(cc1N)Cl AB49593 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.1703 CNC(=O)c1ccc(cc1N)O MB30252 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.1703 CNC(=O)c1ccc(cc1O)Br MB14847 [0,2,0,0,0,0|1,0,0]=3 1374 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl MB09389 [0,2,0,0,0,0|1,0,0]=3 1375 B12R1.1703 CNC(=O)c1ccc(cc1O)F MB25343 [0,2,0,0,0,0|1,0,0]=3 1376 B12R1.1703 CNC(=O)c1ccc(cc1O)I MB25350 [0,2,0,0,0,0|1,0,0]=3 1377 B12R1.1703 CNC(=O)c1ccc(cc1O)N MB25357 [0,2,0,0,0,0|1,0,0]=3 1378 B12R1.1703 COC(=O)c1ccc(cc1Br)F AB23216 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.1703 COC(=O)c1ccc(cc1Cl)F PB10114 [0,2,0,0,0,0|2,0,0]=4 1380 B12R1.1703 Cc1cc(c(cn1)C(=O)OC)Br AB40710 [0,2,0,0,0,0|2,0,0]=4 1381 B12R1.1703 Cc1cc(c(cn1)C(=O)OC)Cl AB40714 [0,2,0,0,0,0|2,0,0]=4 1382 B12R1.1703 Cc1cc(ccc1C(=O)OC)Br AB55602 [0,2,0,0,0,0|2,0,0]=4 1383 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)OC AB16571 [0,2,0,0,0,0|1,0,0]=3 1384 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NC MB09401 [0,2,0,0,0,0|0,0,0]=2 1385 B12R1.1703 Cc1ccc(c(n1)O)C(=O)OC AB55505 [0,2,0,0,0,0|1,0,0]=3 1386 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CN CB10300 [0,2,0,0,0,0|2,0,0]=4 1387 B12R1.1703 c1cc(c(cc1F)F)C(=O)C=O AB14112 [0,2,0,0,0,0|2,0,0]=4 1388 B12R1.1703 c1cc(c(cc1O)O)C(=O)CBr AB16102 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.126 Cc1ccc(c(c1)O)C(F)(F)F MB23404 [0,2,0,0,0,0|1,0,1]=4 1390 B12R1.126 Cc1ccc(c(c1)O)S(=O)(=O)N MB23408 [0,2,0,0,0,0|1,0,0]=3 1391 B12R1.126 c1cc(c(cc1Br)O)S(=O)(=O)N MB32192 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.126 c1cc(c(cc1F)O)S(=O)(=O)N MB37180 [0,2,0,0,0,0|2,0,0]=4 1393 B12R1.126 c1cc(c(cc1I)O)S(=O)(=O)N MB32990 [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.126 c1cc(c(cc1N)O)S(=O)(=O)N MB36626 [0,2,0,0,0,0|2,0,0]=4 1395 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)F MB07188 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.232 CC(=O)c1cc(c(cc1O)O)Cl MB02763 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.232 c1c(c(cc(c1Br)O)O)C(=O)O AB00226 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O AB01123 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.232 c1c(c(cc(c1F)F)O)[N+](=O)[O-] AB13308 [0,2,0,0,0,0|2,0,0]=4 1400 B12R1.232 c1c(c(cc(c1N)O)O)C(=O)O MB08936 [0,2,0,0,0,0|1,0,0]=3 1401 B12R1.452 B(=O)c1ccc(c(c1)Cl)C(=O)Cl AB30721 [0,2,0,0,0,0|2,0,0]=4 1402 B12R1.452 CC(=O)c1c(cc(cn1)C=O)O AB84321 [0,2,0,0,0,0|1,0,1]=4 1403 B12R1.452 CC(=O)c1c(cc(cn1)CCl)O AB84327 [0,2,0,0,0,0|1,0,0]=3 1404 B12R1.452 CC(=O)c1c(cc(cn1)OC)N AB77142 [0,2,0,0,0,0|2,0,0]=4 1405 B12R1.452 CC(=O)c1c(cc(cn1)OC)O AB74834 [0,2,0,0,0,0|1,0,0]=3 1406 B12R1.452 CC(=O)c1ccc(cc1F)OC PB30564 [0,2,0,0,0,0|1,0,0]=3 1407 B12R1.452 CC(=O)c1ccc(nc1Cl)OC AB67053 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.452 CC(=O)c1ccc(nc1F)OC AB72632 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.452 CC(=O)c1ccc(nc1N)OC AB75424 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.452 CC(=O)c1ccc(nc1O)C=O AB84282 [0,2,0,0,0,0|1,0,1]=4 1411 B12R1.452 CC(=O)c1ccc(nc1O)CCl AB84289 [0,2,0,0,0,0|1,0,0]=3 1412 B12R1.452 CC(=O)c1ccc(nc1O)OC AB84275 [0,2,0,0,0,0|1,0,0]=3 1413 B12R1.452 CC(=O)c1cnc(cc1N)OC AB83815 [0,2,0,0,0,0|2,0,0]=4 1414 B12R1.452 CC(=O)c1cnc(cc1O)C=O AB84203 [0,2,0,0,0,0|1,0,1]=4 1415 B12R1.452 CC(=O)c1cnc(cc1O)CCl AB84209 [0,2,0,0,0,0|1,0,0]=3 1416 B12R1.452 CC(=O)c1cnc(cc1O)OC AB72642 [0,2,0,0,0,0|1,0,0]=3 1417 B12R1.452 CC(C)c1ccc(cc1O)CN MB36998 [0,2,0,0,0,0|1,0,1]=4 1418 B12R1.452 CC(C)c1ccc(cc1O)NC MB35415 [0,2,0,0,0,0|1,0,1]=4 1419 B12R1.452 CC(C)c1ccc(cc1O)OC MB37919 [0,2,0,0,0,0|1,0,1]=4 1420 B12R1.452 CC(C)c1ccc(cc1O)SC MB37763 [0,2,0,0,0,0|1,0,1]=4 1421 B12R1.452 CCc1ccc(c(c1)O)C(=O)N MB23792 [0,2,0,0,0,0|0,0,0]=2 1422 B12R1.452 CCc1ccc(c(c1)O)C(=O)O MB23797 [0,2,0,0,0,0|0,0,0]=2 1423 B12R1.452 CCc1ccc(c(c1)O)C(C)C MB23788 [0,2,0,0,0,0|1,0,1]=4 1424 B12R1.452 CCc1ccc(c(c1)O)N(C)C MB23848 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.452 CCc1ccc(c(n1)O)C(=O)O AB53119 [0,2,0,0,0,0|1,0,0]=3 1426 B12R1.452 CN(C)c1ccc(cc1O)CN MB38570 [0,2,0,0,0,0|2,0,0]=4 1427 B12R1.452 CN(C)c1ccc(cc1O)OC MB27728 [0,2,0,0,0,0|2,0,0]=4 1428 B12R1.452 CN(C)c1ccc(cc1O)SC MB28789 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.452 CNc1ccc(c(c1)O)C(=O)N MB37392 [0,2,0,0,0,0|0,0,0]=2 1430 B12R1.452 CNc1ccc(c(c1)O)C(=O)O MB10618 [0,2,0,0,0,0|0,0,0]=2 1431 B12R1.452 CNc1ccc(c(c1)O)N(C)C MB30484 [0,2,0,0,0,0|2,0,0]=4 1432 B12R1.452 COc1cc(c(cn1)C(=O)O)Br AB67019 [0,2,0,0,0,0|2,0,0]=4 1433 B12R1.452 COc1cc(c(cn1)C(=O)O)Cl AB67014 [0,2,0,0,0,0|2,0,0]=4 1434 B12R1.452 COc1cc(c(cn1)C(=O)O)F AB67025 [0,2,0,0,0,0|2,0,0]=4 1435 B12R1.452 COc1cc(c(cn1)C(=O)O)N PB26882 [0,2,0,0,0,0|2,0,0]=4 1436 B12R1.452 COc1cc(c(cn1)C(=O)O)O AB67046 [0,2,0,0,0,0|1,0,0]=3 1437 B12R1.452 COc1cc(c(nc1)C(=O)O)N AB77164 [0,2,0,0,0,0|2,0,0]=4 1438 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] MB00782 [0,2,0,0,0,0|2,0,0]=4 1439 B12R1.452 COc1ccc(c(c1)N)C(=O)O AB06724 [0,2,0,0,0,0|1,0,0]=3 1440 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] MB00826 [0,2,0,0,0,0|2,0,0]=4 1441 B12R1.452 COc1ccc(c(n1)Cl)C(=O)O AB44161 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.452 COc1ccc(c(n1)N)C(=O)O AB69714 [0,2,0,0,0,0|2,0,0]=4 1443 B12R1.452 CSc1ccc(c(c1)O)C(=O)N MB38873 [0,2,0,0,0,0|0,0,0]=2 1444 B12R1.452 CSc1ccc(c(c1)O)C(=O)O MB07648 [0,2,0,0,0,0|0,0,0]=2 1445 B12R1.452 c1cc(c(cc1C#N)O)C(=O)N MB30427 [0,2,0,0,0,0|0,0,1]=3 1446 B12R1.452 c1cc(c(cc1C#N)O)C(=O)O MB26600 [0,2,0,0,0,0|0,0,1]=3 1447 B12R1.452 c1cc(c(cc1C#N)O)[N+](=O)[O-] AB25570 [0,2,0,0,0,0|1,0,1]=4 1448 B12R1.452 c1cc(c(cc1C=O)O)C(=O)N MB37703 [0,2,0,0,0,0|0,0,1]=3 1449 B12R1.452 c1cc(c(cc1C=O)O)C(=O)O MB30837 [0,2,0,0,0,0|0,0,1]=3 1450 B12R1.452 c1cc(c(cc1C=O)O)[N+](=O)[O-] AB00841 [0,2,0,0,0,0|1,0,1]=4 1451 B12R1.452 c1cc(c(cc1CBr)O)[N+](=O)[O-] AB72527 [0,2,0,0,0,0|1,0,0]=3 1452 B12R1.452 c1cc(c(cc1CN)F)[N+](=O)[O-] AB70447 [0,2,0,0,0,0|2,0,0]=4 1453 B12R1.452 c1cc(c(cc1CN)O)C(=O)N MB36467 [0,2,0,0,0,0|0,0,0]=2 1454 B12R1.452 c1cc(c(cc1NN)Br)C(=O)N MB19783 [0,2,0,0,0,0|2,0,0]=4 1455 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CB10793 [0,2,0,0,0,0|2,0,0]=4 1456 B12R1.893 Cc1ccc(c(c1O)Cl)[N+](=O)[O-] AB14699 [0,2,0,0,0,0|2,0,0]=4 1457 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br AB31740 [0,2,0,0,0,0|2,0,0]=4 1458 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Cl AB31744 [0,2,0,0,0,0|2,0,0]=4 1459 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)I AB31747 [0,2,0,0,0,0|2,0,0]=4 1460 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N AB17887 [0,2,0,0,0,0|2,0,0]=4 1461 B12R1.893 c1cc(c(c(c1C(=O)O)N)F)F AB51174 [0,2,0,0,0,0|2,0,0]=4 1462 B12R1.893 c1cc(c(c(c1C(=O)O)O)N)O MB08940 [0,2,0,0,0,0|1,0,0]=3 1463 B12R1.1000 Cc1cc(c(c(n1)Cl)C(=O)O)Cl AB13101 [0,2,0,0,0,0|2,0,0]=4 1464 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)Br MB08312 [0,2,0,0,0,0|2,0,0]=4 1465 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)O CB10467 [0,2,0,0,0,0|2,0,0]=4 1466 B12R1.1000 Cc1cc(nc(c1C(=O)N)Cl)C AB02759 [0,2,0,0,0,0|2,0,0]=4 1467 B12R1.1000 c1c(cc(c(c1Cl)C(=O)N)Cl)Br MB14420 [0,2,0,0,0,0|2,0,0]=4 1468 B12R1.1000 c1c(cc(c(c1Cl)C(=O)O)Cl)Br MB09861 [0,2,0,0,0,0|2,0,0]=4 1469 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br CB10650 [0,2,0,0,0,0|2,0,0]=4 1470 B12R1.1000 c1c(cc(c(c1N)C(=O)O)F)F AB15580 [0,2,0,0,0,0|2,0,0]=4 1471 B12R1.450 COc1cc(c(cc1Br)OC)O AB23806 [0,2,0,0,0,0|2,0,0]=4 1472 B12R1.653 COc1ccc(c(c1O)N)C=O AB53243 [0,2,0,0,0,0|1,0,0]=3 1473 B12R1.654 Cc1cnc(c(c1OC)C)C=O CB11625 [0,2,0,0,0,0|2,0,0]=4 1474 B12R1.48 B(c1cc(c(nc1)C=O)O)(O)O AB84584 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.48 B(c1ccc(c(c1)F)C=O)(O)O AB10730 [0,2,0,0,0,0|2,0,0]=4 1476 B12R1.48 CC(=O)c1cc(c(cn1)C=O)N AB83682 [0,2,0,0,0,0|2,0,0]=4 1477 B12R1.48 CC(=O)c1cc(c(cn1)C=O)O AB84443 [0,2,0,0,0,0|1,0,0]=3 1478 B12R1.48 CC(=O)c1cc(c(nc1)C=O)N AB83741 [0,2,0,0,0,0|2,0,0]=4 1479 B12R1.48 CC(=O)c1cc(c(nc1)C=O)O AB84588 [0,2,0,0,0,0|1,0,0]=3 1480 B12R1.48 CC(=O)c1ccc(c(n1)N)C=O AB83712 [0,2,0,0,0,0|2,0,0]=4 1481 B12R1.48 CC(=O)c1ccc(c(n1)O)C=O AB84544 [0,2,0,0,0,0|1,0,0]=3 1482 B12R1.48 CC(C)c1ccc(c(c1)O)C#N AB50290 [0,2,0,0,0,0|1,0,1]=4 1483 B12R1.48 CC(C)c1ccc(c(c1)O)C=O MB22474 [0,2,0,0,0,0|0,0,0]=2 1484 B12R1.48 CC(C)c1ccc(c(c1)O)CN MB29796 [0,2,0,0,0,0|1,0,1]=4 1485 B12R1.48 CC(C)c1ccc(c(c1)O)OC MB13567 [0,2,0,0,0,0|2,0,0]=4 1486 B12R1.48 CC(C)c1ccc(c(c1)O)SC MB31451 [0,2,0,0,0,0|2,0,0]=4 1487 B12R1.48 CCc1ccc(cc1O)C(C)C MB23789 [0,2,0,0,0,0|1,0,1]=4 1488 B12R1.48 CCc1ccc(cc1O)N(C)C MB23826 [0,2,0,0,0,0|1,0,1]=4 1489 B12R1.48 CN(C)c1ccc(c(c1)O)C#N MB11877 [0,2,0,0,0,0|1,0,1]=4 1490 B12R1.48 CN(C)c1ccc(c(c1)O)C=O MB00354 [0,2,0,0,0,0|0,0,0]=2 1491 B12R1.48 CN(C)c1ccc(c(c1)O)OC MB33601 [0,2,0,0,0,0|2,0,0]=4 1492 B12R1.48 CN(C)c1ccc(c(n1)N)C=O AB76617 [0,2,0,0,0,0|2,0,0]=4 1493 B12R1.48 CNc1ccc(cc1O)N(C)C MB38063 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.48 Cc1cc(ccc1C=O)[N+](=O)[O-] AB65917 [0,2,0,0,0,0|2,0,0]=4 1495 B12R1.48 Cc1cc(ncc1C=O)N(C)C AB44363 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.48 c1c(c(cnc1C(=O)O)C=O)O AB75433 [0,2,0,0,0,0|1,0,1]=4 1497 B12R1.48 c1c(cnc(c1O)C=O)C(=O)O AB84590 [0,2,0,0,0,0|1,0,1]=4 1498 B12R1.48 c1cc(c(cc1[N+](=O)[O-])F)C=O AB07857 [0,2,0,0,0,0|2,0,0]=4 1499 B12R1.48 c1cc(c(cc1[N+](=O)[O-])N)C=O AB50505 [0,2,0,0,0,0|2,0,0]=4 1500 B12R1.48 c1cc(nc(c1C=O)O)C(=O)O AB84546 [0,2,0,0,0,0|1,0,1]=4 1501 B12R1.301 COc1cc(c(c(c1)F)C=O)F AB18165 [0,2,0,0,0,0|1,0,0]=3 1502 B12R1.301 c1c(cc(c(c1Cl)C=O)Cl)C#N PB25560 [0,2,0,0,0,0|1,0,1]=4 1503 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,0,1,1,0,0|1,0,1]=4 1504 B10R2.7 c1cc2c(cco2)nc1 PB26741 [1,0,0,1,0,0|2,0,0]=4 1505 B12R2.132 c1cc2cnn(c2cc1Cl)O MB69250 [0,1,0,1,0,0|2,0,0]=4 1506 B12R2.132 c1cc2cnn(c2cc1F)O MB69253 [0,1,0,1,0,0|2,0,0]=4 1507 B12R2.612 Cc1cc2c(cn1)C(=O)NC2 AB76264 [0,1,0,1,0,0|2,0,0]=4 1508 B12R2.612 Cc1ccc2c(c1)CNC2=O MB07070 [0,1,0,1,0,0|1,0,0]=3 1509 B12R2.612 Cc1ccc2c(c1)onc2Cl AB25984 [0,1,0,1,0,0|1,0,0]=3 1510 B12R2.612 Cc1ccc2c(n1)OCC2=O AB70120 [0,1,0,1,0,0|1,0,0]=3 1511 B12R2.612 c1c2c(cnc1Cl)C(=O)OC2 PB27327 [0,1,0,1,0,0|2,0,0]=4 1512 B12R2.612 c1cc(nc2c1C(=O)CO2)Cl AB70109 [0,1,0,1,0,0|2,0,0]=4 1513 B12R2.612 c1cc2c(cc1Br)CNC2=O PB29649 [0,1,0,1,0,0|2,0,0]=4 1514 B12R2.612 c1cc2c(cc1Br)OCC2=O AB45183 [0,1,0,1,0,0|1,0,0]=3 1515 B12R2.612 c1cc2c(cc1Br)onc2Cl MB11909 [0,1,0,1,0,0|2,0,0]=4 1516 B12R2.612 c1cc2c(cc1Br)onc2N MB07663 [0,1,0,1,0,0|2,0,0]=4 1517 B12R2.612 c1cc2c(cc1Cl)CCC2=O AB01874 [0,1,0,1,0,0|2,0,0]=4 1518 B12R2.612 c1cc2c(cc1Cl)CNC2=O MB05670 [0,1,0,1,0,0|2,0,0]=4 1519 B12R2.612 c1cc2c(cc1Cl)N=NC2=O AB60847 [0,1,0,1,0,0|2,0,0]=4 1520 B12R2.612 c1cc2c(cc1Cl)OCC2=O AB27747 [0,1,0,1,0,0|1,0,0]=3 1521 B12R2.612 c1cc2c(cc1Cl)onc2Cl AB25981 [0,1,0,1,0,0|2,0,0]=4 1522 B12R2.612 c1cc2c(cc1F)CCC2=O AB01853 [0,1,0,1,0,0|2,0,0]=4 1523 B12R2.612 c1cc2c(cc1F)CNC2=O AB71859 [0,1,0,1,0,0|2,0,0]=4 1524 B12R2.612 c1cc2c(cc1F)OCC2=O AB51227 [0,1,0,1,0,0|1,0,0]=3 1525 B12R2.612 c1cc2c(cc1F)onc2Cl AB71606 [0,1,0,1,0,0|2,0,0]=4 1526 B12R2.612 c1cc2c(cc1I)CCC2=O MB07544 [0,1,0,1,0,0|2,0,0]=4 1527 B12R2.612 c1cc2c(cc1N)CNC2=O PB14793 [0,1,0,1,0,0|2,0,0]=4 1528 B12R2.612 c1cc2c(cc1O)CNC2=O AB56006 [0,1,0,1,0,0|2,0,0]=4 1529 B12R2.246 Cc1cc(c2c(c1)N=CC2)C AB31499 [0,1,0,1,0,0|2,0,0]=4 1530 B12R2.246 Cc1cc2c(c(c1)O)CNC2 MB09737 [0,1,0,1,0,0|1,0,1]=4 1531 B12R2.246 Cc1cc2ccoc2c(c1)Br MB10395 [0,1,0,1,0,0|2,0,0]=4 1532 B12R2.246 c1c(cc(c2=CCN=c21)O)Br AB31563 [0,1,0,1,0,0|2,0,0]=4 1533 B12R2.246 c1coc2c1cc(cc2O)F AB31653 [0,1,0,1,0,0|2,0,0]=4 1534 B12R2.606 Cc1ccc2=NC(=O)N=c2c1 AB07026 [0,1,0,1,0,0|1,0,0]=3 1535 B12R2.606 Cc1ccc2c(c1)nc(o2)Cl AB43172 [0,1,0,1,0,0|2,0,0]=4 1536 B12R2.606 Cc1ccc2c(c1)nc(o2)N AB09696 [0,1,0,1,0,0|2,0,0]=4 1537 B12R2.606 Cc1ccc2c(c1)nc(o2)S AB45304 [0,1,0,1,0,0|1,1,0]=4 1538 B12R2.606 Cc1ccc2c(c1)nc(s2)S AB62960 [0,1,0,1,0,0|1,1,0]=4 1539 B12R2.606 Cc1ccc2c(c1)oc(n2)Cl AB65043 [0,1,0,1,0,0|1,0,0]=3 1540 B12R2.606 Cc1ccc2c(c1)oc(n2)S AB03206 [0,1,0,1,0,0|0,1,0]=3 1541 B12R2.606 Cc1ccc2c(c1)sc(n2)S AB42352 [0,1,0,1,0,0|0,2,0]=4 1542 B12R2.606 Cc1ccc2c(n1)CC(=O)N2 AB66460 [0,1,0,1,0,0|2,0,0]=4 1543 B12R2.606 Cc1ccc2c(n1)NC(=O)C2 AB73881 [0,1,0,1,0,0|2,0,0]=4 1544 B12R2.606 Cc1nc2ccc(cc2o1)Br AB25987 [0,1,0,1,0,0|2,0,0]=4 1545 B12R2.606 Cc1nc2ccc(cc2o1)Cl AB49156 [0,1,0,1,0,0|2,0,0]=4 1546 B12R2.606 c1c(cnc2c1oc(=O)[nH]2)N AB65779 [0,1,0,1,0,0|2,0,0]=4 1547 B12R2.606 c1cc2=NC(=O)N=c2cc1Br AB10496 [0,1,0,1,0,0|2,0,0]=4 1548 B12R2.606 c1cc2=NC(=O)N=c2cc1F AB21861 [0,1,0,1,0,0|2,0,0]=4 1549 B12R2.606 c1cc2=NC(=O)N=c2cc1I AB21858 [0,1,0,1,0,0|2,0,0]=4 1550 B12R2.606 c1cc2c(cc1Br)CC(=O)C2 AB42440 [0,1,0,1,0,0|2,0,0]=4 1551 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 PB32208 [0,1,0,1,0,0|2,0,0]=4 1552 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 PB24760 [0,1,0,1,0,0|2,0,0]=4 1553 B12R2.606 c1cc2c(cc1Br)oc(n2)Cl AB63667 [0,1,0,1,0,0|2,0,0]=4 1554 B12R2.606 c1cc2c(cc1Br)oc(n2)N MB01972 [0,1,0,1,0,0|2,0,0]=4 1555 B12R2.606 c1cc2c(cc1Cl)CC(=O)N2 AB04636 [0,1,0,1,0,0|2,0,0]=4 1556 B12R2.606 c1cc2c(cc1Cl)NC(=O)C2 AB04797 [0,1,0,1,0,0|2,0,0]=4 1557 B12R2.606 c1cc2c(cc1Cl)oc(n2)Cl AB32054 [0,1,0,1,0,0|2,0,0]=4 1558 B12R2.606 c1cc2c(cc1Cl)oc(n2)N AB09701 [0,1,0,1,0,0|2,0,0]=4 1559 B12R2.606 c1cc2c(cc1Cl)oc(n2)S AB07270 [0,1,0,1,0,0|1,1,0]=4 1560 B12R2.606 c1cc2c(cc1F)CC(=O)N2 AB11374 [0,1,0,1,0,0|2,0,0]=4 1561 B12R2.606 c1cc2c(cc1F)NC(=O)C2 AB02036 [0,1,0,1,0,0|2,0,0]=4 1562 B12R2.606 c1cc2c(cc1I)CC(=O)N2 MB06441 [0,1,0,1,0,0|2,0,0]=4 1563 B12R2.606 c1cc2c(cc1N)CC(=O)N2 PB27577 [0,1,0,1,0,0|2,0,0]=4 1564 B12R2.606 c1cc2c(cc1N)NC(=O)C2 PB17556 [0,1,0,1,0,0|2,0,0]=4 1565 B12R2.606 c1cc2c(cc1N)oc(n2)S AB48296 [0,1,0,1,0,0|1,1,0]=4 1566 B12R2.606 c1cc2c(cc1O)NC(=O)C2 AB21813 [0,1,0,1,0,0|2,0,0]=4 1567 B12R2.82 c1cc(c(c2c1cco2)Br)F MB06990 [0,1,0,1,0,0|2,0,0]=4 1568 B12R2.44 c1cc(cc2c1cco2)C#N MB09726 [0,1,0,1,0,0|1,0,1]=4 1569 B12R2.44 c1cc(cc2c1cco2)C=O MB06876 [0,1,0,1,0,0|1,0,1]=4 1570 B12R2.44 c1cc2cnoc2cc1C#N AB26004 [0,1,0,1,0,0|1,0,1]=4 1571 B8R1.1 CC1=CN=C(C1)C=O AB43814 [1,0,0,0,1,0|1,0,1]=4 1572 B8R1.1 CC1=NC(=CC1)C=O AB43978 [1,0,0,0,1,0|1,0,1]=4 1573 B8R1.1 Cc1[nH]c(cn1)C=O AB05024 [1,0,0,0,1,0|2,0,0]=4 1574 B8R1.1 Cc1cc(on1)C=O CB11269 [1,0,0,0,1,0|2,0,0]=4 1575 B8R1.1 Cc1ccc(s1)C=O AB00417 [1,0,0,0,1,0|1,0,0]=3 1576 B8R1.1 Cc1cnc(s1)C=O AB43202 [1,0,0,0,1,0|2,0,0]=4 1577 B8R1.1 Cc1coc(n1)C=O PB28183 [1,0,0,0,1,0|2,0,0]=4 1578 B8R1.1 Cc1csc(n1)C=O PB14084 [1,0,0,0,1,0|2,0,0]=4 1579 B8R1.1 Cc1nc(co1)C=O AB13940 [1,0,0,0,1,0|2,0,0]=4 1580 B8R1.1 Cc1nc(cs1)C=O AB25415 [1,0,0,0,1,0|2,0,0]=4 1581 B8R1.1 Cc1ncc(o1)C=O AB27658 [1,0,0,0,1,0|2,0,0]=4 1582 B8R1.1 Cc1ncc(s1)C=O CB11336 [1,0,0,0,1,0|2,0,0]=4 1583 B8R1.1 Cn1cc(cn1)C=O PB23185 [1,0,0,0,1,0|2,0,0]=4 1584 B8R1.1 Cn1cc(nc1)C=O PB24797 [1,0,0,0,1,0|2,0,0]=4 1585 B8R1.1 Cn1ccc(n1)C=O AB14508 [1,0,0,0,1,0|2,0,0]=4 1586 B8R1.1 c1c(csc1Br)C=O PB31345 [1,0,0,0,1,0|2,0,0]=4 1587 B8R1.1 c1c(csc1C=O)Br PB24526 [1,0,0,0,1,0|2,0,0]=4 1588 B8R1.1 c1c(csc1C=O)Cl PB20572 [1,0,0,0,1,0|2,0,0]=4 1589 B8R1.1 c1c(csc1Cl)C=O PB18241 [1,0,0,0,1,0|2,0,0]=4 1590 B8R1.1 c1cc(sc1C=O)Br PB32069 [1,0,0,0,1,0|2,0,0]=4 1591 B8R1.1 c1cc(sc1C=O)Cl PB17085 [1,0,0,0,1,0|2,0,0]=4 1592 B8R1.11 Cc1c(ccs1)C=O AB53893 [1,0,0,0,1,0|2,0,0]=4 1593 B8R1.11 c1c(c(cs1)Br)C=O AB08778 [1,0,0,0,1,0|2,0,0]=4 1594 B8R1.11 c1coc(c1Br)C=O AB31934 [1,0,0,0,1,0|2,0,0]=4 1595 B8R1.11 c1csc(c1Br)C=O PB25976 [1,0,0,0,1,0|2,0,0]=4 1596 B8R1.11 c1csc(c1Cl)C=O PB32269 [1,0,0,0,1,0|2,0,0]=4