0 B11R1.605 Cc1c(c(ccn1)Cl)CCN AB83338 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.605 Cc1c(c(ccn1)F)CCN AB83021 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.605 Cc1ccnc(c1CCN)C AB82522 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.605 Cc1ccnc(c1CCN)Cl AB83345 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.605 Cc1ccnc(c1CCN)F AB83058 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.605 Cc1cncc(c1CCN)C AB76699 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.605 Cc1cncc(c1CCN)Cl AB83254 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.605 Cc1cncc(c1CCN)F AB82916 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.605 c1c(c(c(cn1)Cl)CCN)F AB83129 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.605 c1cc(c(c(c1)Br)CC#N)F MB09725 [0,0,0,0,0,0|0,1,2]=3 10 B11R1.605 c1cnc(c(c1Cl)CCN)F AB83206 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.4 CCCc1cncnc1Cl AB55649 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.4 CNCc1c(cccn1)F PB12566 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.4 CNCc1cccnc1Cl AB53845 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.4 CNCc1cnccc1Cl AB67984 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.4 CNCc1cnccc1F AB68060 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.4 Cc1c(cccn1)CCN AB66943 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.4 Cc1ccccc1CC=O AB11813 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.4 Cc1cccnc1CCN AB31462 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.4 Cc1ccncc1CCN AB55157 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.4 c1cc(c(nc1)Br)CCN AB45464 [1,0,0,0,0,0|1,1,0]=3 21 B10R1.4 c1cc(c(nc1)CCN)Br PB14588 [1,0,0,0,0,0|1,1,0]=3 22 B10R1.4 c1cc(c(nc1)CCN)F AB45483 [1,0,0,0,0,0|1,0,0]=2 23 B10R1.4 c1cc(c(nc1)CCO)F AB55231 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.4 c1cc(c(nc1)Cl)CC#N PB13101 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.4 c1cc(c(nc1)Cl)CCN AB45428 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.4 c1ccc(c(c1)CC#N)Br AB00169 [1,0,0,0,0,0|0,1,2]=4 27 B10R1.4 c1ccc(c(c1)CC#N)F AB00172 [1,0,0,0,0,0|0,0,2]=3 28 B10R1.4 c1ccc(c(c1)CCN)N AB22073 [1,0,0,0,0,0|1,0,0]=2 29 B10R1.4 c1ccc(c(c1)CCN)O MB00877 [1,0,0,0,0,0|1,0,0]=2 30 B10R1.4 c1ccc(c(c1)CNN)Br PB27972 [1,0,0,0,0,0|1,1,0]=3 31 B10R1.4 c1ccc(c(c1)CNN)Cl PB29439 [1,0,0,0,0,0|1,0,0]=2 32 B10R1.4 c1ccc(c(c1)CNN)F PB23531 [1,0,0,0,0,0|1,0,0]=2 33 B10R1.4 c1ccc(c(c1)\C=N\O)Cl AB01188 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.4 c1cncc(c1Br)CCN AB45481 [1,0,0,0,0,0|1,1,0]=3 35 B10R1.4 c1cncc(c1Cl)CCN AB68002 [1,0,0,0,0,0|1,0,0]=2 36 B10R1.4 c1cncc(c1F)CCN AB55177 [1,0,0,0,0,0|1,0,0]=2 37 B10R1.245 CCc1c(cccc1Br)O MB23614 [1,0,0,0,0,0|1,1,0]=3 38 B10R1.245 CCc1c(cccc1Cl)O MB23615 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.245 CCc1c(cccc1F)O MB23585 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.245 CCc1c(cccc1I)O MB23587 [1,0,0,0,0,0|1,1,0]=3 41 B10R1.245 CCc1c(cccc1O)C MB23554 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.245 CCc1c(cccc1O)N MB23558 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.245 CNc1c(cccc1Br)O MB31500 [1,0,0,0,0,0|2,1,0]=4 44 B10R1.245 CNc1c(cccc1Cl)O MB33359 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.245 CNc1c(cccc1F)O MB29137 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.245 CNc1c(cccc1I)O MB30346 [1,0,0,0,0,0|2,1,0]=4 47 B10R1.245 CNc1c(cccc1O)N MB01610 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.245 COc1c(cccc1Br)F AB21504 [1,0,0,0,0,0|1,1,0]=3 49 B10R1.245 COc1c(cccc1Br)O MB09199 [1,0,0,0,0,0|2,1,0]=4 50 B10R1.245 COc1c(cccc1Cl)O MB34190 [1,0,0,0,0,0|2,0,0]=3 51 B10R1.245 COc1c(cccc1F)N MB00204 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.245 COc1c(cccc1I)O MB33689 [1,0,0,0,0,0|2,1,0]=4 53 B10R1.245 COc1c(cccc1O)N MB14425 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.245 CSc1c(cccc1Br)O MB32344 [1,0,0,0,0,0|2,1,0]=4 55 B10R1.245 CSc1c(cccc1Cl)O MB25403 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.245 CSc1c(cccc1I)O MB36697 [1,0,0,0,0,0|2,1,0]=4 57 B10R1.245 CSc1c(cccc1O)N MB26572 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.245 Cc1c(c(ccn1)Cl)CCl AB83333 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.245 Cc1c(c(ccn1)Cl)CN AB83336 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.245 Cc1c(c(ccn1)Cl)OC PB19448 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.245 Cc1c(c(ccn1)F)CCl AB83019 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.245 Cc1c(c(ccn1)F)CN AB83020 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.245 Cc1cccc(c1CCl)C AB08451 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.245 Cc1cccc(c1CN)O MB25667 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.245 Cc1cccc(c1CO)C AB03562 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.245 Cc1cccc(c1OC)O MB33579 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.245 Cc1cccc(c1SC)O MB08534 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.245 Cc1ccnc(c1CCl)Cl AB71112 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.245 Cc1ccnc(c1CCl)F AB71236 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.245 Cc1ccnc(c1CN)C AB75357 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.245 Cc1ccnc(c1CN)Cl AB74563 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.245 Cc1ccnc(c1CN)F AB83056 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.245 Cc1cncc(c1CCl)Cl AB83249 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.245 Cc1cncc(c1CCl)F AB82911 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.245 Cc1cncc(c1CN)C AB65429 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.245 Cc1cncc(c1CN)Cl AB83251 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.245 Cc1cncc(c1CN)F AB82914 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.245 c1c(c(c(cn1)Cl)C=O)F AB70955 [1,0,0,0,0,0|2,0,1]=4 79 B10R1.245 c1c(c(c(cn1)Cl)CCl)F AB70995 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.245 c1c(c(c(cn1)Cl)CN)F AB75075 [1,0,0,0,0,0|1,0,0]=2 81 B10R1.245 c1cc(c(c(c1)Br)C#N)Cl MB03774 [1,0,0,0,0,0|0,1,2]=4 82 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [1,0,0,0,0,0|1,1,1]=4 83 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [1,0,0,0,0,0|1,1,1]=4 84 B10R1.245 c1cc(c(c(c1)Br)CN)O MB12052 [1,0,0,0,0,0|1,1,0]=3 85 B10R1.245 c1cc(c(c(c1)Br)CO)F AB50340 [1,0,0,0,0,0|1,1,0]=3 86 B10R1.245 c1cc(c(c(c1)Cl)C#N)O PB19932 [1,0,0,0,0,0|1,0,2]=4 87 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.245 c1cc(c(c(c1)Cl)CN)O MB15041 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [1,0,0,0,0,0|2,0,1]=4 91 B10R1.245 c1cc(c(c(c1)F)CN)O MB03739 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.245 c1cc(c(c(c1)I)C#N)F AB01183 [1,0,0,0,0,0|0,1,2]=4 93 B10R1.245 c1cc(c(c(c1)I)CN)O MB31821 [1,0,0,0,0,0|1,1,0]=3 94 B10R1.245 c1cc(c(c(c1)O)CN)N MB31845 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.245 c1cnc(c(c1Cl)C=O)F AB70637 [1,0,0,0,0,0|2,0,1]=4 96 B10R1.245 c1cnc(c(c1Cl)CCl)F AB83202 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.245 c1cnc(c(c1Cl)CN)F AB83203 [1,0,0,0,0,0|1,0,0]=2 98 B10R1.245 c1cnc(c(c1F)C=O)Cl AB68028 [1,0,0,0,0,0|2,0,1]=4 99 B12R1.497 c1cc(c(c(c1F)F)CC=O)Br AB31714 [0,1,0,0,0,0|1,1,1]=4 100 B12R1.497 c1cc(c(c(c1F)F)CC=O)Cl AB31718 [0,1,0,0,0,0|1,0,1]=3 101 B12R1.497 c1cc(c(c(c1F)F)CC=O)I AB31711 [0,1,0,0,0,0|1,1,1]=4 102 B12R1.497 c1cc(c(c(c1F)F)CCO)Br AB31685 [0,1,0,0,0,0|1,1,0]=3 103 B12R1.497 c1cc(c(c(c1F)F)CCO)Cl AB31691 [0,1,0,0,0,0|1,0,0]=2 104 B12R1.497 c1cc(c(c(c1F)F)CCO)I AB31688 [0,1,0,0,0,0|1,1,0]=3 105 B12R1.497 c1cc(c(c(c1N)CC=O)F)F AB31722 [0,1,0,0,0,0|2,0,1]=4 106 B12R1.497 c1cc(c(c(c1N)CCO)F)F AB31695 [0,1,0,0,0,0|2,0,0]=3 107 B12R1.1009 CC(C)Oc1c(cccc1Cl)O MB22820 [0,1,0,0,0,0|3,0,0]=4 108 B12R1.1009 CC(C)Oc1c(cccc1F)O MB22807 [0,1,0,0,0,0|3,0,0]=4 109 B12R1.1009 c1cc(c(c(c1)F)CC(=O)O)N AB31835 [0,1,0,0,0,0|2,0,1]=4 110 B12R1.1009 c1cc(c(c(c1)F)CC(=O)O)O AB31842 [0,1,0,0,0,0|2,0,1]=4 111 B12R1.1631 Cc1c(c(ccn1)Cl)CCCN AB83341 [0,1,0,0,0,0|2,0,0]=3 112 B12R1.1631 Cc1c(c(ccn1)F)CCCN AB83024 [0,1,0,0,0,0|2,0,0]=3 113 B12R1.1631 Cc1ccnc(c1CCCN)C AB82608 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.1631 Cc1ccnc(c1CCCN)Cl AB83346 [0,1,0,0,0,0|2,0,0]=3 115 B12R1.1631 Cc1ccnc(c1CCCN)F AB83060 [0,1,0,0,0,0|2,0,0]=3 116 B12R1.1631 Cc1cncc(c1CCCN)C AB82553 [0,1,0,0,0,0|3,0,0]=4 117 B12R1.1631 Cc1cncc(c1CCCN)Cl AB83257 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.1631 Cc1cncc(c1CCCN)F AB82919 [0,1,0,0,0,0|2,0,0]=3 119 B12R1.1631 c1c(c(c(cn1)Cl)CCCN)F AB83132 [0,1,0,0,0,0|1,0,0]=2 120 B12R1.1631 c1cc(c(c(c1)F)CCCN)F AB38728 [0,1,0,0,0,0|0,1,0]=2 121 B12R1.1631 c1cnc(c(c1Cl)CCCN)F AB83207 [0,1,0,0,0,0|1,0,0]=2 122 B12R2.202 c1cc2c(c(c1)Br)CC(C2)N AB69977 [0,0,0,1,0,0|1,1,0]=3 123 B12R2.202 c1cc2c(c(c1)Cl)CC(=O)N2 AB15885 [0,0,0,1,0,0|2,0,1]=4 124 B12R2.202 c1cc2c(c(c1)Cl)CC(C2)N AB69973 [0,0,0,1,0,0|1,0,0]=2 125 B12R2.202 c1cc2c(c(c1)Cl)oc(n2)N MB01974 [0,0,0,1,0,0|2,0,1]=4 126 B12R2.202 c1cc2c(c(c1)F)CC(=O)N2 AB17595 [0,0,0,1,0,0|2,0,1]=4 127 B12R2.202 c1cc2c(cn(n2)N)c(c1)Cl MB14918 [0,0,0,1,0,0|2,0,1]=4 128 B12R2.1081 Cc1c2c(ccn1)CNCC2 AB84983 [0,0,0,1,0,0|3,0,0]=4 129 B12R2.1081 c1c2c(c(cn1)Br)CCNC2 AB76671 [0,0,0,1,0,0|2,1,0]=4 130 B12R2.1081 c1c2c(c(cn1)Cl)CCNC2 AB84975 [0,0,0,1,0,0|2,0,0]=3 131 B12R2.1081 c1cc2c(c(c1)Br)CCCC2 MB06103 [0,0,0,1,0,0|2,1,0]=4 132 B12R2.1081 c1cc2c(c(c1)Br)CCCN2 PB31290 [0,0,0,1,0,0|2,1,0]=4 133 B12R2.1081 c1cc2c(c(c1)Br)CCNC2 PB22176 [0,0,0,1,0,0|1,1,0]=3 134 B12R2.1081 c1cc2c(c(c1)Cl)CCCN2 MB06321 [0,0,0,1,0,0|2,0,0]=3 135 B12R2.1081 c1cc2c(c(c1)Cl)CCNC2 AB45748 [0,0,0,1,0,0|1,0,0]=2 136 B12R2.1081 c1cc2c(c(c1)Cl)CCNC2 MB03608 [0,0,0,1,0,0|1,0,0]=2 137 B12R2.1081 c1cc2c(c(c1)Cl)CNCC2 AB45195 [0,0,0,1,0,0|3,0,0]=4 138 B12R2.1081 c1cc2c(c(c1)Cl)OCCN2 MB06343 [0,0,0,1,0,0|3,0,0]=4 139 B12R2.1081 c1cc2c(c(c1)F)NCCO2 MB11311 [0,0,0,1,0,0|3,0,0]=4 140 B12R2.1081 c1cc2c(c(c1)F)OCCN2 MB06345 [0,0,0,1,0,0|3,0,0]=4 141 B12R2.1081 c1cc2c(c(c1)N)CCNC2 AB12578 [0,0,0,1,0,0|2,0,0]=3 142 B12R2.1081 c1cnc(c2c1CNCC2)Cl AB56101 [0,0,0,1,0,0|2,0,0]=3 143 B12R2.1081 c1cnc(c2c1NCCC2)Cl AB64180 [0,0,0,1,0,0|3,0,0]=4 144 B12R2.1081 c1cnc2c(c1Br)CCNC2 AB73915 [0,0,0,1,0,0|2,1,0]=4 145 B12R2.1081 c1cnc2c(c1Cl)CCCN2 AB77458 [0,0,0,1,0,0|3,0,0]=4 146 B12R2.1081 c1cnc2c(c1Cl)CCNC2 AB73916 [0,0,0,1,0,0|2,0,0]=3 147 B12R2.1081 c1cnc2c(c1O)CCNC2 AB73921 [0,0,0,1,0,0|3,0,0]=4 148 B12R2.1081 c1nc2c(c(n1)Cl)CCNC2 AB64232 [0,0,0,1,0,0|3,0,0]=4 149 B9R1.8 c1c(cncn1)CCN AB45406 [2,0,0,0,0,0|2,0,0]=4 150 B9R1.8 c1cc(cnc1)CCN AB04606 [2,0,0,0,0,0|1,0,0]=3 151 B9R1.8 c1cc(cnc1)CNN PB16271 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.8 c1cc(nnc1)CCN AB61130 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.8 c1ccnc(c1)CCN AB00732 [2,0,0,0,0,0|1,0,0]=3 154 B9R1.8 c1ccnc(c1)CNN PB19014 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.8 c1cnc(cn1)CCN AB22666 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.8 c1cnc(nc1)CCN AB55156 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.8 c1cnccc1CCN AB01702 [2,0,0,0,0,0|1,0,0]=3 158 B9R1.8 c1cnccc1CNN PB10342 [2,0,0,0,0,0|2,0,0]=4 159 B9R1.8 c1cncnc1CCN PB14818 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.8 c1cnncc1CCN AB62610 [2,0,0,0,0,0|2,0,0]=4 161 B9R1.15 CCc1c(cccn1)Br AB68544 [2,0,0,0,0,0|1,1,0]=4 162 B9R1.15 CCc1c(cccn1)O MB01433 [2,0,0,0,0,0|2,0,0]=4 163 B9R1.15 CCc1c(cncn1)F PB21906 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.15 CCc1ccncc1O MB12325 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.15 CCc1cnccc1Br PB37149 [2,0,0,0,0,0|1,1,0]=4 166 B9R1.15 CCc1cnccc1O MB24095 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.15 CCc1cncnc1Cl AB62552 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.15 COc1c(cccn1)Cl AB13603 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.15 COc1c(cccn1)F AB13397 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.15 COc1cccnc1Cl AB14749 [2,0,0,0,0,0|2,0,0]=4 171 B9R1.15 COc1ccncc1Cl AB51203 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.15 COc1ccncc1F AB66775 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.15 COc1cnccc1Cl AB66368 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.15 COc1cnccc1F AB66590 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.15 Cc1c(cccn1)CN AB14093 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.15 Cc1cccnc1CN AB20671 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.15 Cc1ccncc1CN PB14440 [2,0,0,0,0,0|2,0,0]=4 178 B9R1.15 Cc1cnccc1CN AB17090 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.15 c1cc(c(nc1)Br)CN AB41824 [2,0,0,0,0,0|1,1,0]=4 180 B9R1.15 c1cc(c(nc1)CBr)F PB10918 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.15 c1cc(c(nc1)CCl)Cl AB60061 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.15 c1cc(c(nc1)CCl)F PB14946 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.15 c1cc(c(nc1)CN)Br AB67637 [2,0,0,0,0,0|1,1,0]=4 184 B9R1.15 c1cc(c(nc1)CN)Cl PB26156 [2,0,0,0,0,0|1,0,0]=3 185 B9R1.15 c1cc(c(nc1)CN)F AB55320 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.15 c1cc(c(nc1)CN)F PB13118 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.15 c1cc(c(nc1)CN)N AB48448 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.15 c1cc(c(nc1)CN)O MB01728 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.15 c1cc(c(nc1)CO)Cl AB63515 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.15 c1cc(c(nc1)CO)F PB22208 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.15 c1cc(c(nc1)Cl)CCl PB14751 [2,0,0,0,0,0|2,0,0]=4 192 B9R1.15 c1cc(c(nc1)Cl)CO PB27555 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.15 c1cc(c(nc1)F)CCl AB60073 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.15 c1cc(c(nc1)F)CN AB23466 [2,0,0,0,0,0|1,0,0]=3 195 B9R1.15 c1ccc(c(c1)CI)O MB07048 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.15 c1ccc(c(c1)CN)O MB01565 [2,0,0,0,0,0|1,0,0]=3 197 B9R1.15 c1cnc(c(n1)CN)Cl PB12787 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.15 c1cncc(c1Br)CN AB67954 [2,0,0,0,0,0|1,1,0]=4 199 B9R1.15 c1cncc(c1CCl)Cl AB67608 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.15 c1cncc(c1CCl)F AB67665 [2,0,0,0,0,0|2,0,0]=4 201 B9R1.15 c1cncc(c1CN)Br AB63141 [2,0,0,0,0,0|1,1,0]=4 202 B9R1.15 c1cncc(c1CN)Cl AB63139 [2,0,0,0,0,0|1,0,0]=3 203 B9R1.15 c1cncc(c1CN)F AB63136 [2,0,0,0,0,0|1,0,0]=3 204 B9R1.15 c1cncc(c1CN)N AB49287 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.15 c1cncc(c1CN)O MB09249 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.15 c1cncc(c1CO)F PB29849 [2,0,0,0,0,0|2,0,0]=4 207 B9R1.15 c1cncc(c1Cl)CCl AB60091 [2,0,0,0,0,0|2,0,0]=4 208 B9R1.15 c1cncc(c1Cl)CN AB49675 [2,0,0,0,0,0|1,0,0]=3 209 B9R1.15 c1cncc(c1F)CCl AB68054 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.15 c1cncc(c1F)CN AB68023 [2,0,0,0,0,0|1,0,0]=3 211 B9R1.15 c1cncc(c1O)CN MB35531 [2,0,0,0,0,0|2,0,0]=4 212 B9R1.3 Cc1c(c(ccn1)Cl)N AB70877 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.3 Cc1c(c(ccn1)F)N AB70905 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.3 Cc1c(cccc1Br)O MB09253 [2,0,0,0,0,0|1,1,0]=4 215 B9R1.3 Cc1c(cccc1I)O MB23347 [2,0,0,0,0,0|1,1,0]=4 216 B9R1.3 Cc1c(ccnc1Br)Cl AB71053 [2,0,0,0,0,0|1,1,0]=4 217 B9R1.3 Cc1c(ccnc1Br)F AB71081 [2,0,0,0,0,0|1,1,0]=4 218 B9R1.3 Cc1c(ccnc1Cl)Br AB53555 [2,0,0,0,0,0|1,1,0]=4 219 B9R1.3 Cc1c(ccnc1Cl)I AB13660 [2,0,0,0,0,0|1,1,0]=4 220 B9R1.3 Cc1c(ccnc1Cl)N AB75729 [2,0,0,0,0,0|2,0,0]=4 221 B9R1.3 Cc1c(ccnc1Cl)O AB71179 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.3 Cc1c(ccnc1F)Br AB53559 [2,0,0,0,0,0|1,1,0]=4 223 B9R1.3 Cc1c(ccnc1F)N AB82851 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.3 Cc1c(ccnc1F)O AB71301 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.3 Cc1c(ccnc1N)Cl AB70874 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.3 Cc1c(ccnc1N)F AB70896 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.3 Cc1c(ccnc1O)Cl AB71198 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.3 Cc1c(ccnc1O)F AB71318 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.3 Cc1c(cncc1Br)Cl AB75733 [2,0,0,0,0,0|1,1,0]=4 230 B9R1.3 Cc1c(cncc1Br)F AB74995 [2,0,0,0,0,0|1,1,0]=4 231 B9R1.3 Cc1c(cncc1Cl)N AB41999 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.3 Cc1c(cncc1Cl)O AB70586 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.3 Cc1c(nccc1Cl)C AB72126 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.3 Cc1cccc(c1N)Br MB03160 [2,0,0,0,0,0|1,1,0]=4 235 B9R1.3 Cc1cccc(c1N)F MB03934 [2,0,0,0,0,0|1,0,0]=3 236 B9R1.3 Cc1cccc(c1O)F MB11516 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.3 Cc1ccnc(c1N)Cl PB21708 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.3 Cc1ccnc(c1N)F AB17625 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.3 Cc1cncc(c1N)Cl AB44879 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.3 Cc1cncc(c1N)F AB75360 [2,0,0,0,0,0|2,0,0]=4 241 B9R1.3 c1c(c(c(cn1)Br)N)Cl AB56437 [2,0,0,0,0,0|1,1,0]=4 242 B9R1.3 c1c(c(c(cn1)Cl)Br)F AB70924 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.3 c1c(c(c(cn1)Cl)N)Cl AB03509 [2,0,0,0,0,0|1,1,0]=4 244 B9R1.3 c1c(c(c(cn1)Cl)N)F AB70854 [2,0,0,0,0,0|1,0,0]=3 245 B9R1.3 c1c(c(c(cn1)Cl)N)N AB50200 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.3 c1c(c(c(cn1)Cl)N)O AB83899 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.3 c1c(c(c(cn1)Cl)O)F AB66744 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.3 c1c(c(c(cn1)F)N)F AB10209 [2,0,0,0,0,0|1,1,0]=4 249 B9R1.3 c1cc(c(c(c1)Br)O)Cl MB08152 [2,0,0,0,0,0|1,1,0]=4 250 B9R1.3 c1cc(c(c(c1)Cl)Br)N MB08909 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.3 c1cc(c(c(c1)Cl)Br)O MB03079 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.3 c1cc(c(c(c1)Cl)I)N AB28280 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.3 c1cc(c(c(c1)Cl)I)O MB05351 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.3 c1cc(c(c(c1)Cl)N)N AB54530 [2,0,0,0,0,0|1,0,0]=3 255 B9R1.3 c1cc(c(c(c1)Cl)N)O MB10127 [2,0,0,0,0,0|1,0,0]=3 256 B9R1.3 c1cc(c(c(c1)F)Br)O MB03082 [2,0,0,0,0,0|2,0,0]=4 257 B9R1.3 c1cc(c(c(c1)F)Cl)N AB14054 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.3 c1cc(c(c(c1)F)Cl)O MB05350 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.3 c1cc(c(c(c1)F)I)O MB05358 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.3 c1cc(c(c(c1)F)N)N MB00506 [2,0,0,0,0,0|1,0,0]=3 261 B9R1.3 c1cc(c(c(c1)F)O)N AB45742 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.3 c1cc(c(c(c1)I)Br)F MB07001 [2,0,0,0,0,0|1,1,0]=4 263 B9R1.3 c1cc(c(c(c1)I)N)O MB03004 [2,0,0,0,0,0|1,1,0]=4 264 B9R1.3 c1cc(c(c(c1)I)O)Cl MB14795 [2,0,0,0,0,0|1,1,0]=4 265 B9R1.3 c1cc(c(c(c1)I)O)F MB05032 [2,0,0,0,0,0|1,1,0]=4 266 B9R1.3 c1cnc(c(c1Br)N)Cl AB76588 [2,0,0,0,0,0|1,1,0]=4 267 B9R1.3 c1cnc(c(c1Cl)Br)F AB74960 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.3 c1cnc(c(c1Cl)N)Br AB70423 [2,0,0,0,0,0|1,1,0]=4 269 B9R1.3 c1cnc(c(c1Cl)N)Cl AB51385 [2,0,0,0,0,0|1,1,0]=4 270 B9R1.3 c1cnc(c(c1Cl)N)F AB83198 [2,0,0,0,0,0|1,0,0]=3 271 B9R1.3 c1cnc(c(c1Cl)N)N PB28504 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.3 c1cnc(c(c1Cl)N)O AB75026 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.3 c1cnc(c(c1Cl)O)F AB71148 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.3 c1cnc(c(c1N)N)Cl PB12434 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.3 c1cnc(c(c1N)N)F AB70620 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.3 c1cnc(c(c1O)N)Cl AB76250 [2,0,0,0,0,0|2,0,0]=4 277 B11R1.13 Cc1c(c(ccn1)CCN)Cl AB83309 [1,1,0,0,0,0|1,0,0]=3 278 B11R1.13 Cc1c(ccnc1CCN)Cl AB83260 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.13 Cc1c(ccnc1CCN)F AB82931 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.13 Cc1c(ccnc1Cl)CCN AB83367 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.13 Cc1c(ccnc1F)CCN AB82857 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.13 Cc1c(cncc1Cl)CCN AB83292 [1,1,0,0,0,0|2,0,0]=4 283 B11R1.13 Cc1c(nccc1CCN)C AB82525 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.13 Cc1ccnc(c1C)CCN AB82520 [1,1,0,0,0,0|2,0,0]=4 285 B11R1.13 Cc1ccnc(c1Cl)CCN AB83303 [1,1,0,0,0,0|1,0,0]=3 286 B11R1.13 Cc1cncc(c1C)CCN AB82560 [1,1,0,0,0,0|2,0,0]=4 287 B11R1.13 Cc1cncc(c1Cl)CCN AB83272 [1,1,0,0,0,0|1,0,0]=3 288 B11R1.13 Cc1cncc(c1F)CCN AB82944 [1,1,0,0,0,0|1,0,0]=3 289 B11R1.13 c1c(c(c(cn1)Cl)F)CCN AB82977 [1,1,0,0,0,0|1,0,0]=3 290 B11R1.13 c1c(c(c(cn1)Cl)O)CCN AB84034 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.13 c1c(c(c(cn1)F)Cl)CCN AB83150 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.13 c1c(c(c(cn1)O)Cl)CCN AB84001 [1,1,0,0,0,0|1,0,0]=3 293 B11R1.13 c1cnc(c(c1CCN)Cl)F AB83163 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.13 c1cnc(c(c1CCN)Cl)N AB83940 [1,1,0,0,0,0|1,0,0]=3 295 B11R1.13 c1cnc(c(c1CCN)F)Cl AB83223 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.13 c1cnc(c(c1CCN)N)Cl AB83978 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.13 c1cnc(c(c1CCN)O)Cl AB84113 [1,1,0,0,0,0|2,0,0]=4 298 B11R1.13 c1cnc(c(c1Cl)F)CCN AB83139 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.13 c1cnc(c(c1Cl)N)CCN AB83872 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.13 c1cnc(c(c1Cl)O)CCN AB83986 [1,1,0,0,0,0|2,0,0]=4 301 B11R1.13 c1cnc(c(c1F)Cl)CCN AB83008 [1,1,0,0,0,0|1,0,0]=3 302 B11R1.13 c1cnc(c(c1N)Cl)CCN AB83929 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.13 c1cnc(c(c1O)Cl)CCN AB84057 [1,1,0,0,0,0|1,0,0]=3 304 B11R1.17 Cc1c(cccn1)CCCN AB66944 [1,1,0,0,0,0|2,0,0]=4 305 B11R1.17 Cc1ccccc1CCC=O AB42260 [1,1,0,0,0,0|2,0,0]=4 306 B11R1.17 Cc1ccccc1CCCN AB38679 [1,1,0,0,0,0|1,0,0]=3 307 B11R1.17 Cc1ccncc1CCCN AB67853 [1,1,0,0,0,0|2,0,0]=4 308 B11R1.17 c1cc(c(nc1)Br)CCCN AB55123 [1,1,0,0,0,0|1,1,0]=4 309 B11R1.17 c1cc(c(nc1)Cl)CCCN AB55105 [1,1,0,0,0,0|1,0,0]=3 310 B11R1.17 c1ccc(c(c1)CCC=O)Br AB49228 [1,1,0,0,0,0|1,1,0]=4 311 B11R1.17 c1ccc(c(c1)CCC=O)Cl AB42271 [1,1,0,0,0,0|1,0,0]=3 312 B11R1.17 c1ccc(c(c1)CCC=O)F AB49232 [1,1,0,0,0,0|1,0,0]=3 313 B11R1.17 c1ccc(c(c1)CCCN)Br AB38695 [1,1,0,0,0,0|0,1,0]=3 314 B11R1.17 c1ccc(c(c1)CCCN)Cl AB23306 [1,1,0,0,0,0|0,0,0]=2 315 B11R1.17 c1ccc(c(c1)CCCN)F AB38684 [1,1,0,0,0,0|0,0,0]=2 316 B11R1.17 c1cncc(c1Cl)CCCN AB68003 [1,1,0,0,0,0|1,0,0]=3 317 B11R1.17 c1cncc(c1F)CCCN AB68073 [1,1,0,0,0,0|1,0,0]=3 318 B11R1.41 CCCc1ccccc1NN AB27885 [1,1,0,0,0,0|2,0,0]=4 319 B11R1.41 COc1c(cccn1)CCN AB45444 [1,1,0,0,0,0|2,0,0]=4 320 B11R1.41 COc1ccccc1CNN PB34218 [1,1,0,0,0,0|2,0,0]=4 321 B11R1.41 COc1ccncc1CCN AB45493 [1,1,0,0,0,0|2,0,0]=4 322 B11R1.41 COc1cnccc1CCN AB67567 [1,1,0,0,0,0|2,0,0]=4 323 B11R1.41 c1cncc(c1C#N)CCN AB68138 [1,1,0,0,0,0|2,0,0]=4 324 B11R1.81 CNCc1ccc(cc1Cl)Cl PB15788 [1,1,0,0,0,0|2,0,0]=4 325 B11R1.81 Cc1c(ccc(n1)Cl)CCN AB85389 [1,1,0,0,0,0|2,0,0]=4 326 B11R1.81 Cc1cc(c(cn1)CCN)Cl AB83329 [1,1,0,0,0,0|1,0,0]=3 327 B11R1.81 Cc1cc(c(cn1)CCN)F AB83049 [1,1,0,0,0,0|1,0,0]=3 328 B11R1.81 Cc1cc(c(nc1)CCN)C AB65484 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.81 Cc1cc(c(nc1)CCN)Cl AB83243 [1,1,0,0,0,0|1,0,0]=3 330 B11R1.81 Cc1cc(c(nc1)CCN)F AB76359 [1,1,0,0,0,0|1,0,0]=3 331 B11R1.81 Cc1cc(cnc1CCN)Cl AB83241 [1,1,0,0,0,0|2,0,0]=4 332 B11R1.81 Cc1cc(cnc1CCN)F AB82903 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.81 Cc1cc(ncc1CCN)C AB82577 [1,1,0,0,0,0|2,0,0]=4 334 B11R1.81 Cc1cc(ncc1CCN)Cl AB83351 [1,1,0,0,0,0|2,0,0]=4 335 B11R1.81 Cc1cc(ncc1CCN)F AB83069 [1,1,0,0,0,0|2,0,0]=4 336 B11R1.81 c1c(c(cnc1F)CCN)Cl AB83191 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.81 c1c(cnc(c1Cl)CCN)F AB83122 [1,1,0,0,0,0|1,0,0]=3 338 B11R1.81 c1c(cnc(c1F)CCN)Cl AB83116 [1,1,0,0,0,0|1,0,0]=3 339 B11R1.81 c1cc(c(cc1Cl)Cl)CNN PB13051 [1,1,0,0,0,0|1,0,0]=3 340 B11R1.81 c1cc(c(cc1F)Cl)CNN PB17475 [1,1,0,0,0,0|1,0,0]=3 341 B11R1.81 c1cc(c(cc1N)Cl)CC#N AB44259 [1,1,0,0,0,0|0,0,2]=4 342 B11R1.86 CC(Cc1ccccc1Br)N MB08211 [1,1,0,0,0,0|0,1,0]=3 343 B11R1.86 CC(Cc1ccccc1Cl)N MB06204 [1,1,0,0,0,0|0,0,0]=2 344 B11R1.86 Cc1ccccc1CC(C)N MB01550 [1,1,0,0,0,0|1,0,0]=3 345 B11R1.86 c1ccc(c(c1)CC(=N)N)Cl AB60879 [1,1,0,0,0,0|0,0,1]=3 346 B11R1.86 c1ccc(c(c1)CC(=O)Cl)F AB16515 [1,1,0,0,0,0|1,0,1]=4 347 B11R1.86 c1ccc(c(c1)CC(=O)N)N AB26281 [1,1,0,0,0,0|1,0,1]=4 348 B11R1.182 Cc1cc(c(cn1)C)CCN AB82532 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.182 Cc1cc(c(nc1)C)CCN AB82544 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.182 Cc1cc(c(nc1)Cl)CCN AB83239 [1,1,0,0,0,0|1,0,0]=3 351 B11R1.182 Cc1cc(c(nc1)F)CCN AB55183 [1,1,0,0,0,0|1,0,0]=3 352 B11R1.182 Cc1ccc(nc1CCN)C AB65479 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.182 Cc1ccc(nc1CCN)Cl AB83233 [1,1,0,0,0,0|2,0,0]=4 354 B11R1.182 Cc1ccc(nc1CCN)F AB82893 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.182 Cc1cnc(cc1CCN)Cl AB83226 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.182 Cc1cnc(cc1CCN)F AB82871 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.182 c1c(c(cnc1Cl)F)CCN AB83094 [1,1,0,0,0,0|1,0,0]=3 358 B11R1.182 c1c(c(nnc1Cl)Cl)CCN AB72248 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.182 c1c(cnc(c1CCN)Cl)F AB83111 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.182 c1cc(nc(c1F)CCN)Cl AB83105 [1,1,0,0,0,0|1,0,0]=3 361 B11R1.222 CCC(=O)c1ccccc1F MB00205 [1,1,0,0,0,0|1,0,1]=4 362 B11R1.72 c1cc(c(c(c1F)CN)F)F MB01069 [1,1,0,0,0,0|0,1,0]=3 363 B11R1.72 c1cc(c(c(c1F)F)C=O)Cl AB31731 [1,1,0,0,0,0|1,0,1]=4 364 B11R1.72 c1cc(c(c(c1F)F)CO)Br AB31706 [1,1,0,0,0,0|1,1,0]=4 365 B11R1.72 c1cc(c(c(c1F)F)CO)Cl AB31704 [1,1,0,0,0,0|1,0,0]=3 366 B11R1.72 c1cc(c(c(c1F)F)CO)I AB31708 [1,1,0,0,0,0|1,1,0]=4 367 B11R1.72 c1cc(c(c(c1N)CO)F)F AB31701 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.72 c1cc(c(c(c1N)F)CN)F AB50264 [1,1,0,0,0,0|0,1,0]=3 369 B11R1.156 B(c1c(cccc1Cl)F)(O)O AB17456 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.156 CC(=O)c1c(ccnc1F)Cl AB83199 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.156 CC(=O)c1c(cncc1Cl)F AB75073 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.156 CC(C)c1c(cccc1Br)O MB22335 [1,1,0,0,0,0|1,1,0]=4 373 B11R1.156 CC(C)c1c(cccc1Cl)O MB22338 [1,1,0,0,0,0|1,0,0]=3 374 B11R1.156 CC(C)c1c(cccc1F)O MB22319 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.156 CC(C)c1c(cccc1I)O MB22320 [1,1,0,0,0,0|1,1,0]=4 376 B11R1.156 CC(C)c1c(cccc1O)N MB22301 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.156 CN(C)c1c(cccc1Cl)O MB24669 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.156 CN(C)c1c(cccc1F)O MB24657 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.156 Cc1cccc(c1C(C)C)O MB22300 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.156 c1cc(c(c(c1)Cl)C(=N)N)F AB18302 [1,1,0,0,0,0|0,0,1]=3 381 B11R1.156 c1cc(c(c(c1)Cl)C(=O)N)O MB31636 [1,1,0,0,0,0|1,0,1]=4 382 B11R1.156 c1cc(c(c(c1)F)C(=N)N)F AB18297 [1,1,0,0,0,0|0,1,1]=4 383 B11R1.156 c1cc(c(c(c1)F)C(=O)N)O MB25665 [1,1,0,0,0,0|1,0,1]=4 384 B11R1.265 CCc1c(cccc1O)C#N MB23560 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.265 CCc1c(cccc1O)C=O MB23582 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.265 CCc1c(cccc1O)CN MB23584 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.265 CCc1c(cccc1O)NC MB23593 [1,1,0,0,0,0|2,0,0]=4 388 B11R1.265 CCc1c(cccc1OC)O MB23601 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.265 CCc1c(cccc1SC)O MB23611 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.265 CCc1cccc(c1CC)O MB24051 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.265 CCc1cccc(c1CN)O MB24052 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.265 CNc1cccc(c1CN)O MB33011 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.265 CSc1cccc(c1CN)O MB30038 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.265 c1cc(c(c(c1)O)CN)C#N MB38764 [1,1,0,0,0,0|2,0,0]=4 395 B11R1.265 c1cc(c(c(c1)O)CN)C=O MB28913 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.265 c1cc(c(c(c1)O)CN)CN MB32658 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.464 Cc1cc(cc(c1CN)C)Br MB09872 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.464 c1c(cc(c(c1F)C=O)Cl)Cl CB11634 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.464 c1c(cc(c(c1F)CN)F)Br AB21101 [1,1,0,0,0,0|0,1,0]=3 400 B13R1.885 c1cc(c(c(c1F)F)CC(=O)O)Cl AB31679 [0,2,0,0,0,0|1,0,1]=4 401 B13R1.4453 CCOC(=O)c1c(cccc1Cl)F MB03694 [0,2,0,0,0,0|1,0,1]=4 402 B13R1.8919 CNCCCc1c(cccc1F)F AB38827 [0,2,0,0,0,0|0,1,0]=3 403 B11R1.24 c1cc(cc(c1)Cl)CCCN AB38690 [0,0,1,1,0,0|1,0,1]=4 404 B11R1.24 c1cc(cc(c1)F)CCCN AB38688 [0,0,1,1,0,0|1,0,1]=4 405 B11R1.24 c1cc(nc(c1)Cl)CCCN AB67357 [0,0,1,1,0,0|1,0,1]=4 406 B11R2.10 c1ccc2c(c1)CC(C2)Br MB05045 [1,0,0,1,0,0|2,0,0]=4 407 B11R2.10 c1ccc2c(c1)CC(C2)N AB03106 [1,0,0,1,0,0|1,0,0]=3 408 B11R2.10 c1ccc2c(c1)CN(C2)N MB09229 [1,0,0,1,0,0|2,0,0]=4 409 B11R2.20 c1cc2c(nc1)CCNC2 AB27765 [1,0,0,1,0,0|2,0,0]=4 410 B11R2.20 c1cc2c(nc1)CNCC2 PB14621 [1,0,0,1,0,0|2,0,0]=4 411 B11R2.20 c1ccc2c(c1)CCN=C2 AB01545 [1,0,0,1,0,0|1,0,1]=4 412 B11R2.20 c1cncc2c1CCNC2 PB10616 [1,0,0,1,0,0|2,0,0]=4 413 B11R2.20 c1cncc2c1CNCC2 AB48928 [1,0,0,1,0,0|2,0,0]=4 414 B11R2.55 c1ccc(c(c1)C2CO2)Cl MB07493 [1,0,0,1,0,0|1,0,0]=3 415 B11R2.106 Cc1cccc2c1CCN2 MB06155 [1,0,0,1,0,0|1,0,0]=3 416 B11R2.106 c1cc(c2c(c1)NCC2)N MB05532 [1,0,0,1,0,0|1,0,0]=3 417 B11R2.106 c1cc(c2c(c1)OCC2)N PB21917 [1,0,0,1,0,0|2,0,0]=4 418 B11R2.106 c1cc2c(c(c1)Br)CCC2 PB24478 [1,0,0,1,0,0|1,1,0]=4 419 B11R2.106 c1cc2c(c(c1)Cl)CCN2 MB04569 [1,0,0,1,0,0|0,0,0]=2 420 B11R2.106 c1cc2c(c(c1)Cl)CNC2 MB05816 [1,0,0,1,0,0|2,0,0]=4 421 B11R2.106 c1cc2c(c(c1)F)CNC2 MB08984 [1,0,0,1,0,0|2,0,0]=4 422 B11R2.106 c1cc2c(c(c1)O)CCN2 MB07004 [1,0,0,1,0,0|1,0,0]=3 423 B11R2.106 c1cc2n(c(=O)c1)CCN2 MB08872 [1,0,0,1,0,0|2,0,0]=4 424 B11R2.106 c1cnc(c2c1NCC2)Br AB73026 [1,0,0,1,0,0|1,1,0]=4 425 B11R2.106 c1cnc(c2c1NCC2)Cl PB31568 [1,0,0,1,0,0|1,0,0]=3 426 B11R2.106 c1cnc2c(c1Br)CCN2 AB76365 [1,0,0,1,0,0|1,1,0]=4 427 B11R2.106 c1cnc2c(c1I)CCN2 AB85220 [1,0,0,1,0,0|1,1,0]=4 428 B13R2.162 c1cc2c(c(c1)Br)CC(CO2)N AB70336 [0,1,0,1,0,0|1,1,0]=4 429 B13R2.402 Cc1cccc(c1OC2CC2)Cl MB37972 [0,1,0,1,0,0|2,0,0]=4 430 B13R2.402 Cc1cccc(c1OC2CC2)F MB47400 [0,1,0,1,0,0|2,0,0]=4 431 B13R2.402 c1c(c(c(cn1)Cl)OC2CC2)F MB63214 [0,1,0,1,0,0|2,0,0]=4 432 B13R2.402 c1cc(c(c(c1)Br)OC2CC2)Cl MB68849 [0,1,0,1,0,0|1,1,0]=4 433 B13R2.402 c1cc(c(c(c1)Br)OC2CC2)F MB63181 [0,1,0,1,0,0|1,1,0]=4 434 B13R2.402 c1cc(c(c(c1)Cl)OC2CC2)Cl MB68852 [0,1,0,1,0,0|1,1,0]=4 435 B13R2.402 c1cc(c(c(c1)Cl)OC2CC2)F MB63183 [0,1,0,1,0,0|1,0,0]=3 436 B13R2.402 c1cc(c(c(c1)Cl)OC2CC2)N MB66075 [0,1,0,1,0,0|2,0,0]=4 437 B13R2.402 c1cc(c(c(c1)F)CC2CC2)O MB29129 [0,1,0,1,0,0|2,0,0]=4 438 B13R2.402 c1cc(c(c(c1)F)OC2CC2)N MB66066 [0,1,0,1,0,0|2,0,0]=4 439 B13R2.402 c1cc(c(c(c1)I)OC2CC2)Cl MB68847 [0,1,0,1,0,0|1,1,0]=4 440 B13R2.402 c1cc(c(c(c1)I)OC2CC2)F MB63179 [0,1,0,1,0,0|1,1,0]=4 441 B13R2.402 c1cnc(c(c1Cl)OC2CC2)F MB63239 [0,1,0,1,0,0|2,0,0]=4 442 B13R2.402 c1cnc(c(c1F)OC2CC2)Cl MB63188 [0,1,0,1,0,0|2,0,0]=4 443 B13R2.328 c1c2c(c(nc1Cl)Cl)CCNC2 AB84984 [0,1,0,1,0,0|2,0,0]=4 444 B13R2.342 c1c2c(c(cn1)Cl)CCNC2=O AB73841 [0,1,0,1,0,0|2,0,0]=4 445 B13R2.342 c1cc2c(c(c1)Br)CCNC2=O AB64743 [0,1,0,1,0,0|1,1,0]=4 446 B13R2.342 c1cc2c(c(c1)Cl)CCCC2=O AB45800 [0,1,0,1,0,0|2,0,0]=4 447 B13R2.342 c1cc2c(c(c1)Cl)CCCC2N AB38490 [0,1,0,1,0,0|2,0,0]=4 448 B13R2.342 c1cc2c(c(c1)Cl)CCC[C@@H]2N AB38494 [0,1,0,1,0,0|2,0,0]=4 449 B13R2.342 c1cc2c(c(c1)Cl)CCC[C@H]2N AB38493 [0,1,0,1,0,0|2,0,0]=4 450 B13R2.342 c1cc2c(c(c1)Cl)CCNC2=O AB19152 [0,1,0,1,0,0|1,0,0]=3 451 B13R2.342 c1cc2c(c(c1)F)CCCC2=O AB43579 [0,1,0,1,0,0|2,0,0]=4 452 B13R2.342 c1cc2c(c(c1)F)CCCC2N AB38437 [0,1,0,1,0,0|2,0,0]=4 453 B13R2.342 c1cc2c(c(c1)F)CCC[C@@H]2N AB38445 [0,1,0,1,0,0|2,0,0]=4 454 B13R2.342 c1cc2c(c(c1)F)CCC[C@H]2N AB38441 [0,1,0,1,0,0|2,0,0]=4 455 B13R2.342 c1cc2c(c(c1)F)CCNC2=O AB19155 [0,1,0,1,0,0|1,0,0]=3 456 B13R2.342 c1cc2c(c(c1)N)CCNC2=O AB53700 [0,1,0,1,0,0|2,0,0]=4 457 B13R2.342 c1cc2c(c(c1)N)CCNC2=O MB05527 [0,1,0,1,0,0|2,0,0]=4 458 B13R2.342 c1cnc(c2c1C(=O)NCC2)Cl AB77225 [0,1,0,1,0,0|2,0,0]=4 459 B13R2.581 COc1cccc2c1CC(C2)N AB69970 [0,1,0,1,0,0|2,0,0]=4 460 B13R2.1613 c1cc2c(c(c1)C#N)CCNC2 AB32479 [0,1,0,1,0,0|2,0,0]=4 461 B13R2.4820 c1cnc(c2c1CNCCC2)Cl AB77488 [0,1,0,1,0,0|2,0,0]=4 462 B13R2.54 c1cc2c(c(c1)F)nc(o2)CN AB49533 [0,1,0,1,0,0|1,0,1]=4 463 B13R2.54 c1cc2c(c(c1)F)oc(n2)CN AB57749 [0,1,0,1,0,0|1,0,1]=4 464 B13R2.5179 c1cc2c(c(c1)Cl)CCC(=O)C2 AB17118 [0,1,0,1,0,0|2,0,0]=4 465 B13R2.5179 c1cc2c(c(c1)F)CCC(=O)C2 AB17125 [0,1,0,1,0,0|2,0,0]=4 466 B13R2.4818 c1cc2c(c(c1)F)C(CCO2)N MB69096 [0,1,0,1,0,0|2,0,0]=4