0 B10R1.17 CNCCc1ccccn1 BC218953 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.17 c1ccc(cc1)C#CCN BC211901 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.17 c1ccc(cc1)C#CCO BC222107 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.17 c1ccc(cc1)NCC#N BC219610 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 c1ccc(cc1)OCCBr BC209483 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 c1ccc(cc1)OCCO BC208517 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 c1ccc(cc1)\C=C\C#N BC225038 [0,0,0,0,0,0|2,0,2]=4 7 B10R1.17 c1cnccc1CCCO BC222234 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.8 c1cc(cnc1)CCN BC226643 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.8 c1ccc(cc1)CC=O BC250050 [1,0,0,0,0,0|0,0,2]=3 10 B9R1.8 c1ccc(cc1)CCBr BC203736 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.8 c1ccc(cc1)CCO BC213746 [1,0,0,0,0,0|0,0,0]=1 12 B9R1.8 c1ccc(cc1)CNN BC652179 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.8 c1ccc(cc1)CNN BC676720 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.8 c1ccnc(c1)CCBr BC216605 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.8 c1cnccc1CCBr BC683652 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.8 c1cnccc1CCO BC201212 [1,0,0,0,0,0|1,0,0]=2 17 B11R1.1 c1cc(ccc1CCCBr)Cl BC681641 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.1 c1cc(ccc1CCCO)Br BC653959 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.16 COCC(=O)c1ccccc1 BC644213 [0,1,0,0,0,0|0,0,1]=2 20 B11R1.16 c1ccc(cc1)C(=O)CCBr BC675527 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O BC681135 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.16 c1ccc(cc1)[C@H](CCCl)O BC201664 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.16 c1ccc(cc1)[C@H](CCO)N BC202108 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.17 CCCOc1c(cccn1)I BC643510 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.17 CCCOc1c(cccn1)N BC256310 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.28 c1ccc(cc1)CNCCO BC201328 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.28 c1ccc(cc1)COCC=O BC269066 [0,1,0,0,0,0|2,0,0]=3 28 B11R1.28 c1cnccc1CCCCCl BC261689 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.28 c1cnccc1CCCCO BC644122 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.91 CC(CCc1ccccc1)N BC653661 [0,1,0,0,0,0|1,0,0]=2 31 B11R1.91 c1ccc(cc1)COC(=O)N BC219591 [0,1,0,0,0,0|3,0,0]=4 32 B11R2.1 CC1=CCc2c1cccc2 BC600789 [0,0,0,1,0,0|1,0,1]=3 33 B11R2.1 CC1C=Cc2c1cccc2 BC600788 [0,0,0,1,0,0|1,0,2]=4 34 B11R2.1 c1ccc2c(c1)CCC2=O BC210634 [0,0,0,1,0,0|2,0,0]=3 35 B11R2.1 c1ccc2c(c1)CCC2N BC228055 [0,0,0,1,0,0|2,0,0]=3 36 B11R2.1 c1ccc2c(c1)CCC2N BC653269 [0,0,0,1,0,0|2,0,0]=3 37 B11R2.1 c1ccc2c(c1)CC[C@@H]2N BC679090 [0,0,0,1,0,0|2,0,0]=3 38 B11R2.20 c1c2c(ncn1)CCNC2 BC682213 [0,0,0,1,0,0|3,0,0]=4 39 B11R2.20 c1c2c(ncn1)CNCC2 BC682259 [0,0,0,1,0,0|3,0,0]=4 40 B11R2.20 c1cc2c(nc1)CCCC2 BC207983 [0,0,0,1,0,0|2,0,0]=3 41 B11R2.20 c1cnc2c(n1)CCCC2 BC218761 [0,0,0,1,0,0|3,0,0]=4 42 B11R2.20 c1cncc2c1CCCC2 BC682234 [0,0,0,1,0,0|2,0,0]=3 43 B9R1.12 CCCCc1[nH]ccn1 BC222416 [0,0,0,0,1,0|3,0,0]=4 44 B9R1.12 c1ccn(c1)CCCBr BC653419 [0,0,0,0,1,0|3,0,0]=4 45 B8R0.4 CCC\C=C\C=C\C=O BC218795 [1,0,1,0,0,0|1,0,0]=3 46 B8R1.2 CCc1cccnc1 BC223674 [2,0,0,0,0,0|1,0,0]=3 47 B8R1.2 COc1cccnc1 BC653137 [2,0,0,0,0,0|1,0,0]=3 48 B8R1.2 [C-]#[N+]c1ccccc1 BC297263 [2,0,0,0,0,0|1,0,1]=4 49 B8R1.2 c1c(cncn1)CO BC228080 [2,0,0,0,0,0|2,0,0]=4 50 B8R1.2 c1cc(cnc1)CBr BC258182 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.2 c1cc(cnc1)CBr BC281217 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.2 c1cc(cnc1)CCl BC204269 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.2 c1cc(cnc1)CN BC205833 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.2 c1cc(cnc1)CO BC209311 [2,0,0,0,0,0|1,0,0]=3 55 B8R1.2 c1ccc(cc1)CBr BC220250 [2,0,0,0,0,0|1,0,0]=3 56 B8R1.2 c1ccc(cc1)CCl BC210975 [2,0,0,0,0,0|1,0,0]=3 57 B8R1.2 c1ccc(cc1)CO BC222892 [2,0,0,0,0,0|0,0,0]=2 58 B8R1.2 c1ccc(cc1)N=O BC684726 [2,0,0,0,0,0|1,0,1]=4 59 B8R1.2 c1ccc(cc1)[Mg]Br BC653680 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.2 c1ccnc(c1)CCl BC213218 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.2 c1ccnc(c1)CCl BC227992 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.2 c1cncnc1CO BC228082 [2,0,0,0,0,0|2,0,0]=4 63 B10R1.1 CCOc1ccc(cn1)N BC215883 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.1 CCOc1ccc(nc1)Cl BC228804 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.1 COCc1ccc(cc1)O BC674868 [1,1,0,0,0,0|0,0,0]=2 66 B10R1.1 Cc1ccc(cc1)CC#N BC205621 [1,1,0,0,0,0|1,0,1]=4 67 B10R1.1 c1cc(ccc1CC#N)Br BC227508 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.1 c1cc(ccc1CC#N)N BC676372 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.1 c1cc(ccc1CCBr)Cl BC658954 [1,1,0,0,0,0|1,0,0]=3 70 B10R1.1 c1cc(ccc1CCN)Br BC205235 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.1 c1cc(ccc1CCO)Br BC646236 [1,1,0,0,0,0|0,0,0]=2 72 B10R1.1 c1cc(ccc1CCO)O BC676907 [1,1,0,0,0,0|0,0,0]=2 73 B10R1.1 c1cc(ccc1\C=N\O)F BC684728 [1,1,0,0,0,0|1,0,1]=4 74 B10R1.4 CCOc1cccnc1Br BC228753 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.4 CCOc1cccnc1N BC228705 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.4 c1ccc(c(c1)CC#N)Br BC227507 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.4 c1ccc(c(c1)CCN)Br BC202041 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.4 c1ccc(c(c1)CCO)N BC202238 [1,1,0,0,0,0|0,0,0]=2 79 B10R1.10 CCCc1cccc(c1)N BC679945 [1,1,0,0,0,0|0,0,0]=2 80 B10R1.10 CCOc1cc(cnc1)Br BC652457 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.10 CCOc1cc(cnc1)N BC680839 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.10 CCOc1ccnc(c1)N BC202201 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.10 CNCc1cccc(c1)Br BC653644 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.10 c1cc(cc(c1)Br)CC#N BC203406 [1,1,0,0,0,0|1,0,1]=4 85 B10R1.10 c1cc(cc(c1)Br)CCO BC645716 [1,1,0,0,0,0|0,0,0]=2 86 B10R1.10 c1cc(cc(c1)O)CCN BC600077 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.15 C#CC(c1ccccc1)O BC218343 [1,1,0,0,0,0|0,0,2]=4 88 B10R1.15 CC[C@H](c1ccccc1)N BC201033 [1,1,0,0,0,0|0,0,0]=2 89 B10R1.15 COC(=O)c1ccncc1 BC205546 [1,1,0,0,0,0|1,0,1]=4 90 B10R1.15 c1ccc(cc1)C(=O)CN BC222358 [1,1,0,0,0,0|1,0,1]=4 91 B10R1.15 c1ccc(cc1)C(C#N)Br BC620262 [1,1,0,0,0,0|1,0,1]=4 92 B10R1.15 c1ccc(cc1)C(CCl)O BC651818 [1,1,0,0,0,0|1,0,0]=3 93 B10R1.15 c1ccc(cc1)[C@H](CO)N BC204938 [1,1,0,0,0,0|0,0,0]=2 94 B10R1.18 CC(=O)Cc1ccccc1 BC250367 [1,1,0,0,0,0|0,0,1]=3 95 B10R1.18 CC(C)Nc1ccccc1 BC208321 [1,1,0,0,0,0|1,0,0]=3 96 B10R1.18 c1cc(cnc1)CC(=O)O BC228147 [1,1,0,0,0,0|1,0,1]=4 97 B10R1.18 c1ccnc(c1)CC(=O)O BC210696 [1,1,0,0,0,0|1,0,1]=4 98 B10R1.18 c1ccnc(c1)CC(=O)O BC653678 [1,1,0,0,0,0|1,0,1]=4 99 B10R1.18 c1cnccc1CC(=O)O BC220630 [1,1,0,0,0,0|1,0,1]=4 100 B12R1.1 c1cc(ccc1CNCCO)F BC220844 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.16 CNCC(c1ccc(cc1)O)O BC678112 [0,2,0,0,0,0|1,0,0]=3 102 B12R1.16 c1cc(ccc1[C@H](CCO)N)Cl BC676871 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.21 c1cc(ccc1CCC(=O)O)O BC678073 [0,2,0,0,0,0|2,0,0]=4 104 B12R1.49 COC(=O)Cc1ccc(cc1)Br BC207826 [0,2,0,0,0,0|0,0,1]=3 105 B12R1.49 COC(=O)Cc1ccc(cc1)O BC207602 [0,2,0,0,0,0|0,0,1]=3 106 B12R1.69 CCCCc1ccc(cc1O)O BC219862 [0,2,0,0,0,0|1,0,0]=3 107 B12R1.71 COCCc1ccc(cc1)OC BC600844 [0,2,0,0,0,0|0,0,0]=2 108 B12R1.17 CNCC(=O)c1cccc(c1)O BC679056 [0,2,0,0,0,0|1,0,1]=4 109 B12R1.30 CNCCC(c1ccccc1)O BC679596 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.34 CC([C@@H](c1ccccc1)O)NC BC216227 [0,2,0,0,0,0|1,0,0]=3 111 B12R1.34 CN(C(=O)c1ccccc1)OC BC210651 [0,2,0,0,0,0|1,0,1]=4 112 B12R1.34 c1ccc(cc1)[C@@H]([C@H](CO)N)O BC200170 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.34 c1ccc(cc1)[C@H]([C@@H](CO)N)O BC652581 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.107 c1ccc(cc1)C(CC(=O)O)O BC224119 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.121 CCCOc1ccccc1C=O BC675920 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.125 Cc1ccccc1CCC(=O)O BC684657 [0,2,0,0,0,0|2,0,0]=4 117 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br BC687835 [0,2,0,0,0,0|2,0,0]=4 118 B12R1.125 c1ccc(c(c1)CCC(=O)O)Cl BC684352 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.267 CCCCCc1ccccc1C BC686296 [0,2,0,0,0,0|1,0,0]=3 120 B12R1.226 c1cc(cc(c1)Cl)CCC(=O)O BC687795 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.226 c1cc(cc(c1)N)CCC(=O)O BC204347 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.226 c1cc(cc(c1)O)CCC(=O)O BC687786 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.8 c1ccc(cc1)COCCCO BC221424 [0,2,0,0,0,0|1,0,0]=3 124 B12R1.27 c1ccc(cc1)CNC(=O)CCl BC202236 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.27 c1ccc(cc1)COC(=O)CN BC218219 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.32 CCOC(=O)Cc1ccccn1 BC225240 [0,2,0,0,0,0|1,0,1]=4 127 B12R1.32 CN(CC#C)Cc1ccccc1 BC214776 [0,2,0,0,0,0|1,0,1]=4 128 B12R1.32 CN(CCN)Cc1ccccc1 BC635280 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.252 c1ccc(cc1)CCCC(=O)O BC678065 [0,2,0,0,0,0|1,0,1]=4 130 B12R1.252 c1ccc(cc1)COCC(=O)O BC216347 [0,2,0,0,0,0|2,0,0]=4 131 B12R1.43 c1ccc(cc1)CC(C(=O)O)O BC224313 [0,2,0,0,0,0|2,0,0]=4 132 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)Cl BC636160 [0,2,0,0,0,0|2,0,0]=4 133 B10R2.7 c1cc2c(nc1)CNC2 BC202976 [1,0,0,1,0,0|2,0,0]=4 134 B10R2.7 c1cc2c(nc1)CNC2 BC657106 [1,0,0,1,0,0|2,0,0]=4 135 B10R2.7 c1cc2c(nc1)CNC2 BC682032 [1,0,0,1,0,0|2,0,0]=4 136 B10R2.7 c1cc2c(nc1)CNC2 BC683702 [1,0,0,1,0,0|2,0,0]=4 137 B10R2.7 c1ccc2c(c1)CC=C2 BC218987 [1,0,0,1,0,0|0,0,2]=4 138 B10R2.7 c1ccc2c(c1)CCN2 BC219733 [1,0,0,1,0,0|1,0,0]=3 139 B10R2.7 c1ccc2c(c1)CCO2 BC207982 [1,0,0,1,0,0|0,0,0]=2 140 B10R2.7 c1ccc2c(c1)CNC2 BC217544 [1,0,0,1,0,0|1,0,0]=3 141 B10R2.7 c1ccc2c(c1)CNC2 BC682033 [1,0,0,1,0,0|1,0,0]=3 142 B10R2.7 c1ccc2c(c1)nco2 BC200554 [1,0,0,1,0,0|1,0,1]=4 143 B10R2.7 c1cncc2c1CNC2 BC202975 [1,0,0,1,0,0|2,0,0]=4 144 B10R2.320 c1ccc2c(c1)CC2=O BC225121 [1,0,0,1,0,0|0,0,2]=4 145 B12R2.24 c1cc2c(cc1Br)C=CCC2 BC653628 [0,1,0,1,0,0|1,0,1]=4 146 B12R2.24 c1cc2c(cc1Br)CCNC2 BC654139 [0,1,0,1,0,0|1,0,0]=3 147 B12R2.24 c1cc2c(cc1Br)CNCC2 BC668372 [0,1,0,1,0,0|1,0,0]=3 148 B12R2.24 c1cc2c(cc1Br)CNCC2 BC682211 [0,1,0,1,0,0|1,0,0]=3 149 B12R2.24 c1cc2c(cc1Cl)CNCC2 BC236706 [0,1,0,1,0,0|1,0,0]=3 150 B12R2.24 c1cc2c(cc1N)CCNC2 BC677941 [0,1,0,1,0,0|1,0,0]=3 151 B12R2.24 c1cc2c(cc1N)NCCC2 BC210066 [0,1,0,1,0,0|2,0,0]=4 152 B12R2.24 c1cc2c(cc1O)CCCN2 BC223196 [0,1,0,1,0,0|2,0,0]=4 153 B12R2.24 c1cc2c(cc1O)NCCC2 BC210096 [0,1,0,1,0,0|2,0,0]=4 154 B12R2.24 c1cc2c(nc1)CC(=O)CC2 BC682257 [0,1,0,1,0,0|2,0,0]=4 155 B12R2.24 c1cc2c(nc1)CCC(=O)C2 BC228640 [0,1,0,1,0,0|2,0,0]=4 156 B12R2.24 c1ccc2c(c1)CCC(C2)N BC280642 [0,1,0,1,0,0|1,0,0]=3 157 B12R2.24 c1ccc2c(c1)CCC(C2)N BC677882 [0,1,0,1,0,0|1,0,0]=3 158 B12R2.24 c1ccc2c(c1)CC[C@H](C2)N BC201483 [0,1,0,1,0,0|1,0,0]=3 159 B12R2.24 c1cncc2c1CCC(=O)C2 BC679511 [0,1,0,1,0,0|2,0,0]=4 160 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 BC219907 [0,1,0,1,0,0|2,0,0]=4 161 B12R2.132 c1cc2c(cc1F)C(=O)CC2 BC218979 [0,1,0,1,0,0|2,0,0]=4 162 B12R2.132 c1cc2c(cc1O)C(=O)CC2 BC218980 [0,1,0,1,0,0|2,0,0]=4 163 B12R2.2 c1ccc(cc1)C2CCCN2 BC220765 [0,1,0,1,0,0|1,0,0]=3 164 B12R2.2 c1ccc(cc1)C2CCNC2 BC206377 [0,1,0,1,0,0|1,0,0]=3 165 B12R2.2 c1ccc(cc1)C2CCNC2 BC681902 [0,1,0,1,0,0|1,0,0]=3 166 B12R2.2 c1ccc(cc1)[C@@H]2CCCN2 BC227897 [0,1,0,1,0,0|1,0,0]=3 167 B12R2.2 c1ccc(cc1)[C@@H]2CCNC2 BC630674 [0,1,0,1,0,0|1,0,0]=3 168 B12R2.2 c1ccc(cc1)[C@H]2CCCN2 BC227898 [0,1,0,1,0,0|1,0,0]=3 169 B12R2.2 c1ccnc(c1)C2CCNC2 BC685416 [0,1,0,1,0,0|2,0,0]=4 170 B12R2.2 c1cnccc1C2CCCN2 BC201198 [0,1,0,1,0,0|2,0,0]=4 171 B12R2.2 c1cnccc1N2CCCC2 BC214914 [0,1,0,1,0,0|2,0,0]=4 172 B12R2.1081 CC1c2ccccc2CCN1 BC226194 [0,1,0,1,0,0|1,0,0]=3 173 B12R2.1081 c1cc2c(c(c1)N)CCNC2 BC654967 [0,1,0,1,0,0|1,0,0]=3 174 B12R2.1081 c1cc2c(c(c1)O)CC=CC2 BC208599 [0,1,0,1,0,0|1,0,1]=4 175 B12R2.1081 c1cc2c(nc1)C(CCC2)O BC228167 [0,1,0,1,0,0|2,0,0]=4 176 B12R2.1081 c1cc2c(nc1)CCCC2O BC202819 [0,1,0,1,0,0|2,0,0]=4 177 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 BC208640 [0,1,0,1,0,0|2,0,0]=4 178 B12R2.1081 c1ccc2c(c1)C(CCN2)N BC222937 [0,1,0,1,0,0|2,0,0]=4 179 B12R2.1081 c1ccc2c(c1)C(CCN2)O BC600011 [0,1,0,1,0,0|2,0,0]=4 180 B12R2.1081 c1ccc2c(c1)CCC[C@@H]2N BC200269 [0,1,0,1,0,0|1,0,0]=3 181 B12R2.1081 c1ccc2c(c1)CCC[C@H]2N BC683708 [0,1,0,1,0,0|1,0,0]=3 182 B12R2.1081 c1ccc2c(c1)CCNC2=O BC213850 [0,1,0,1,0,0|1,0,1]=4 183 B12R2.196 c1cc2c(c(c1)Br)CCC2=O BC677084 [0,1,0,1,0,0|2,0,0]=4 184 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O BC676446 [0,1,0,1,0,0|2,0,0]=4 185 B12R2.196 c1cc2c(c(c1)F)CCC2N BC625954 [0,1,0,1,0,0|2,0,0]=4 186 B12R2.196 c1cc2c(c(c1)F)CC[C@@H]2N BC687902 [0,1,0,1,0,0|2,0,0]=4 187 B12R2.196 c1cc2c(c(c1)O)CCC2=O BC687631 [0,1,0,1,0,0|2,0,0]=4 188 B12R2.80 c1cc(cc(c1)Cl)C2CC2N BC213824 [0,1,0,1,0,0|2,0,0]=4 189 B12R2.203 Cc1cccc2c1C(=O)CC2 BC688379 [0,1,0,1,0,0|2,0,0]=4 190 B12R2.203 c1cc2c(c(c1)Br)C(=O)CC2 BC652362 [0,1,0,1,0,0|2,0,0]=4 191 B12R2.203 c1cc2c(c(c1)Cl)C(=O)CC2 BC677426 [0,1,0,1,0,0|2,0,0]=4 192 B12R2.203 c1cc2c(c(c1)O)C(=O)CC2 BC687634 [0,1,0,1,0,0|2,0,0]=4 193 B12R2.612 Cc1ccc2c(c1)CCC2=O BC218986 [0,1,0,1,0,0|2,0,0]=4 194 B12R2.612 c1cc2c(cc1Br)CCC2=O BC210245 [0,1,0,1,0,0|2,0,0]=4 195 B12R2.612 c1cc2c(cc1Cl)CCC2=O BC200429 [0,1,0,1,0,0|2,0,0]=4 196 B12R2.612 c1cc2c(cc1F)CCC2=O BC202173 [0,1,0,1,0,0|2,0,0]=4 197 B12R2.612 c1cc2c(cc1F)CC[C@@H]2N BC687899 [0,1,0,1,0,0|2,0,0]=4 198 B12R2.612 c1cc2c(cc1F)CC[C@H]2N BC687900 [0,1,0,1,0,0|2,0,0]=4 199 B12R2.612 c1cc2c(cc1N)CCC2=O BC219807 [0,1,0,1,0,0|2,0,0]=4 200 B12R2.612 c1cc2c(cc1O)CCC2=O BC200684 [0,1,0,1,0,0|2,0,0]=4 201 B12R2.18 CC1Cc2ccccc2N1C BC220721 [0,1,0,1,0,0|1,0,0]=3 202 B12R2.18 CN1c2ccccc2CC1=O BC207649 [0,1,0,1,0,0|1,0,1]=4 203 B12R2.18 c1ccc2c(c1)CC(C2=O)Br BC218981 [0,1,0,1,0,0|2,0,0]=4 204 B12R2.18 c1ccc2c(c1)CC(C2O)Br BC676562 [0,1,0,1,0,0|2,0,0]=4 205 B12R2.18 c1ccc2c(c1)C[C@@H]([C@@H]2N)O BC207012 [0,1,0,1,0,0|2,0,0]=4 206 B12R2.18 c1ccc2c(c1)C[C@H]([C@H]2N)O BC679640 [0,1,0,1,0,0|2,0,0]=4 207 B12R2.3190 c1ccc2c(c1)CC2C(=O)O BC225119 [0,1,0,1,0,0|2,0,0]=4 208 B12R3.12 c1ccc2c(c1)CC3C2O3 BC200720 [0,0,0,2,0,0|0,0,0]=2 209 B8R1.8 c1c(nc[nH]1)CCO BC678874 [1,0,0,0,1,0|2,0,0]=4