0 B12R2.612 Cc1c2ccc(cc2[nH]n1)Br WX637351 [0,0,0,0,0,0|2,1,0]=3 1 B12R2.612 Cc1c2ccc(cc2[nH]n1)O WX645011 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.612 Cc1ccc2c(c1)CCC2O WX642032 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.612 Cc1ccc2c(c1)[nH]nc2I WX638053 [0,0,0,0,0,0|3,0,0]=3 4 B12R2.612 Cc1ccn2c(c1)nnc2O WX649088 [0,0,0,0,0,0|3,0,0]=3 5 B12R2.612 Cn1c2ccc(cc2cn1)Br WX637303 [0,0,0,0,0,0|3,1,0]=4 6 B12R2.612 Cn1c2ccc(cc2cn1)N WX609373 [0,0,0,0,0,0|4,0,0]=4 7 B12R2.612 c1c2c(cnc1Br)c(n[nH]2)I WXC04649 [0,0,0,0,0,0|3,1,0]=4 8 B12R2.612 c1cc2c(cc1Br)CCC2O WX633165 [0,0,0,0,0,0|2,1,1]=4 9 B12R2.612 c1cc2c(cc1Br)CC[C@H]2O WX633147 [0,0,0,0,0,0|2,1,1]=4 10 B12R2.612 c1cc2c(cc1Br)CNC2=O WX633084 [0,0,0,0,0,0|1,1,2]=4 11 B12R2.612 c1cc2c(cc1Br)onc2N WX609288 [0,0,0,0,0,0|1,1,0]=2 12 B12R2.612 c1cc2c(cc1Cl)[nH]nc2I WXC02215 [0,0,0,0,0,0|2,0,0]=2 13 B11R2.1 Cn1c2ccccc2cn1 WX690064 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 c1cc2c(c(n[nH]2)N)nc1 WX606101 [1,0,0,0,0,0|3,0,0]=4 15 B11R2.1 c1cc2c(c(no2)N)nc1 WX609206 [1,0,0,0,0,0|2,0,0]=3 16 B11R2.1 c1ccc2c(c1)CCC2O WX649087 [1,0,0,0,0,0|2,0,1]=4 17 B11R2.1 c1ccc2c(c1)CNC2=O WX619030 [1,0,0,0,0,0|1,0,2]=4 18 B11R2.1 c1ccc2c(c1)c(co2)Br WX637107 [1,0,0,0,0,0|2,0,0]=3 19 B11R2.1 c1ccn2c(c1)nnc2O WX645024 [1,0,0,0,0,0|2,0,0]=3 20 B11R2.1 c1cncc2c1c(n[nH]2)Cl WX636003 [1,0,0,0,0,0|3,0,0]=4 21 B11R2.1 c1cncc2c1c(n[nH]2)N WX606100 [1,0,0,0,0,0|3,0,0]=4 22 B11R2.36 Cc1ccc2c(c1)cn[nH]2 WX690069 [1,0,0,0,0,0|3,0,0]=4 23 B11R2.36 Cc1ccc2cc[nH]c2c1 WX690210 [1,0,0,0,0,0|3,0,0]=4 24 B11R2.36 c1c(cnc2c1[nH]nc2)Br WX637340 [1,0,0,0,0,0|2,1,0]=4 25 B11R2.36 c1c2c(cnc1Cl)cn[nH]2 WXC01805 [1,0,0,0,0,0|2,0,0]=3 26 B11R2.36 c1c[nH]c2c1ncc(c2)Cl WX636104 [1,0,0,0,0,0|3,0,0]=4 27 B11R2.36 c1cc(cc2c1cc[nH]2)Cl WX636210 [1,0,0,0,0,0|2,0,0]=3 28 B11R2.36 c1cc(cn2c1cnc2)Br WX637328 [1,0,0,0,0,0|2,1,0]=4 29 B11R2.36 c1cc2c(cc1Br)cn[nH]2 WX637324 [1,0,0,0,0,0|2,1,0]=4 30 B11R2.36 c1cc2c(cc1Cl)[nH]cn2 WX632043 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.36 c1cc2c(cc1I)cn[nH]2 WX638023 [1,0,0,0,0,0|2,1,0]=4 32 B11R2.36 c1cc2c(cc1N)cn[nH]2 WX609435 [1,0,0,0,0,0|3,0,0]=4 33 B11R2.36 c1cc2c(cc1N)ocn2 WX609294 [1,0,0,0,0,0|3,0,0]=4 34 B11R2.36 c1cc2c(cc[nH]2)cc1Cl WX636209 [1,0,0,0,0,0|3,0,0]=4 35 B11R2.36 c1cc2cn[nH]c2cc1Br WX633020 [1,0,0,0,0,0|1,1,0]=3 36 B11R2.36 c1cn2ccnc2cc1Cl WXC01436 [1,0,0,0,0,0|3,0,0]=4 37 B13R2.662 CCc1c2ccc(cc2[nH]n1)Br WX637248 [0,1,0,0,0,0|2,1,0]=4 38 B13R2.662 Cc1ccc2c(c1)[nH]cc2CO WX640012 [0,1,0,0,0,0|3,0,0]=4 39 B13R2.2130 Cc1c2ccc(cc2[nH]n1)OC WX690025 [0,1,0,0,0,0|3,0,0]=4 40 B13R2.5187 Cn1c2cc(ccc2c(n1)N)Br WX609332 [0,1,0,0,0,0|2,1,0]=4 41 B11R1.22 Cc1ccc(cc1)\C(=N/O)\N WX690131 [0,0,1,0,0,0|2,0,0]=3 42 B11R1.22 c1cc(ccc1C(=S)NN)Cl WXC00711 [0,0,1,0,0,0|1,1,1]=4 43 B11R1.22 c1cc(ccc1\C(=N\O)\N)O WX690142 [0,0,1,0,0,0|2,0,0]=3 44 B11R1.37 COc1c(ccc(n1)Cl)C=O WXC01981 [0,0,1,0,0,0|2,0,1]=4 45 B11R1.37 c1cc(c(cc1Cl)CO)CO WX640146 [0,0,1,0,0,0|2,0,1]=4 46 B11R1.166 CC(=O)c1ccc(cc1O)Br WX626004 [0,0,1,0,0,0|1,1,1]=4 47 B11R1.166 Cc1c(ccc(n1)Cl)C(=O)O WX614340 [0,0,1,0,0,0|3,0,0]=4 48 B11R1.166 Cc1ccc(c(c1)F)C(=O)O WX612018 [0,0,1,0,0,0|3,0,0]=4 49 B11R1.166 c1c(c(cnc1Cl)C(=O)O)Cl WX614282 [0,0,1,0,0,0|3,0,0]=4 50 B11R1.166 c1cc(c(cc1Cl)O)C(=O)N WX632029 [0,0,1,0,0,0|0,0,2]=3 51 B13R2.3683 Cc1ccc2c(c1)ccc(n2)O WX649065 [0,0,0,0,0,1|3,0,0]=4 52 B13R2.3683 c1cc(cc2c1cc(nc2)N)Br WX633032 [0,0,0,0,0,1|2,1,0]=4 53 B13R2.3683 c1cc(nc2c1cc(cc2)O)Cl WX636122 [0,0,0,0,0,1|3,0,0]=4 54 B13R2.3683 c1cc(nc2c1cc(cc2)O)O WX649037 [0,0,0,0,0,1|3,0,0]=4 55 B13R2.5179 c1cc2c(=O)ccoc2cc1Br WX637240 [0,0,0,0,0,1|1,1,1]=4 56 B13R2.5179 c1cc2c(cc1Br)COCC2=O WX633128 [0,0,0,0,0,1|1,1,1]=4 57 B13R2.5179 c1cc2c(cc1Br)OCCC2=O WX633086 [0,0,0,0,0,1|1,1,1]=4 58 B13R2.5179 c1cc2c(cc1Cl)ncnc2O WX636185 [0,0,0,0,0,1|1,0,0]=2 59 B13R2.5179 c1cc2c(cc1O)OCCC2=O WX645088 [0,0,0,0,0,1|2,0,1]=4 60 B13R2.5179 c1cc2c(ccnc2Cl)cc1Br WX637094 [0,0,0,0,0,1|2,1,0]=4 61 B13R2.5179 c1cc2c(ccnc2N)cc1Br WX609228 [0,0,0,0,0,1|2,1,0]=4 62 B10R1.1 c1cc(ccc1\C=N\O)Cl WX632026 [1,0,1,0,0,0|0,0,0]=2 63 B10R1.13 B(c1ccc(cc1)N)(O)O WX650024 [1,0,1,0,0,0|2,0,0]=4 64 B10R1.13 c1cc(ccc1C(=N)N)Br WX684427 [1,0,1,0,0,0|1,1,0]=4 65 B10R1.13 c1cc(ccc1C(=N)N)Br WX690071 [1,0,1,0,0,0|1,1,0]=4 66 B10R1.15 c1ccc(cc1)\C(=N\O)\N WX690132 [1,0,1,0,0,0|1,0,0]=3 67 B10R1.25 c1cc(c(cc1Br)O)C=O WX622075 [1,0,1,0,0,0|0,1,1]=4 68 B10R1.25 c1cc(c(cc1Br)O)CO WXC01145 [1,0,1,0,0,0|0,1,1]=4 69 B10R1.25 c1cc(c(cc1F)O)C=O WX622072 [1,0,1,0,0,0|0,1,1]=4 70 B10R1.61 B(c1ccccc1O)(O)O WX650052 [1,0,1,0,0,0|2,0,0]=4 71 B10R1.61 c1ccc(c(c1)C(=N)N)Cl WX619951 [1,0,1,0,0,0|2,0,0]=4 72 B10R1.61 c1ccc(c(c1)C(=N)N)F WX619904 [1,0,1,0,0,0|2,0,0]=4 73 B10R2.7 c1cncc2c1cn[nH]2 WX606053 [2,0,0,0,0,0|2,0,0]=4 74 B10R2.7 c1cncc2c1cn[nH]2 WX606115 [2,0,0,0,0,0|2,0,0]=4 75 B12R1.20 c1cc(ccc1C(=O)C(=O)O)Cl WXC01366 [0,1,1,0,0,0|1,0,1]=4 76 B12R1.367 Cc1ccc(cc1C)\C(=N\O)\N WX690170 [0,1,1,0,0,0|2,0,0]=4 77 B12R1.367 Cc1ccc(cc1Cl)\C(=N\O)\N WX690196 [0,1,1,0,0,0|2,0,0]=4 78 B12R1.1703 Cc1cc(ccc1\C(=N\O)\N)Cl WX619921 [0,1,1,0,0,0|1,0,0]=3 79 B12R1.57 COc1cc(ncc1C(=O)O)Cl WX614012 [0,1,1,0,0,0|2,0,0]=4 80 B12R1.232 c1c(c(cc(c1Cl)O)O)C(=O)O WX612073 [0,1,1,0,0,0|2,0,0]=4 81 B12R2.1 c1ccc/2c(c1)CC\C2=N/O WX690241 [1,1,0,0,0,0|2,0,0]=4 82 B12R2.1 c1ccc2c(c1)c(c[nH]2)CO WX640278 [1,1,0,0,0,0|2,0,0]=4 83 B12R2.1 c1ccc2c(c1)c(n[nH]2)C=O WX624131 [1,1,0,0,0,0|1,0,1]=4 84 B12R2.1 c1ccc2c(c1)c(no2)CBr WX630337 [1,1,0,0,0,0|1,0,0]=3 85 B12R2.132 Cc1ccc2c(c1)c(n[nH]2)Br WX637069 [1,1,0,0,0,0|2,0,0]=4 86 B12R2.132 Cc1ccc2c(c1)c(n[nH]2)I WX638052 [1,1,0,0,0,0|2,0,0]=4 87 B12R2.132 Cc1ccc2nnc(n2c1)O WX645025 [1,1,0,0,0,0|2,0,0]=4 88 B12R2.132 c1cc2c(cc1Br)c(n[nH]2)I WX633003 [1,1,0,0,0,0|2,0,0]=4 89 B12R2.132 c1cc2c(cc1Br)c(n[nH]2)N WX609402 [1,1,0,0,0,0|2,0,0]=4 90 B12R2.132 c1cc2c(cc1N)c(n[nH]2)Cl WX609439 [1,1,0,0,0,0|2,0,0]=4 91 B12R2.196 Cc1c2cccc(c2[nH]n1)Br WX637104 [1,1,0,0,0,0|2,0,0]=4 92 B12R2.196 Cc1cccc2c1[nH]nc2I WX638054 [1,1,0,0,0,0|2,0,0]=4 93 B12R2.203 Cc1c2c(cccc2Br)[nH]n1 WX637132 [1,1,0,0,0,0|2,0,0]=4 94 B12R2.203 Cc1cccc2c1c(n[nH]2)I WX638051 [1,1,0,0,0,0|2,0,0]=4 95 B12R2.2028 Cn1c2ccccc2c(n1)Br WX637115 [1,1,0,0,0,0|2,0,0]=4 96 B12R2.100 Cc1cc2c(cc1N)cn[nH]2 WX606004 [1,1,0,0,0,0|2,0,0]=4 97 B12R2.100 Cc1cc2c(cc1N)cn[nH]2 WX609437 [1,1,0,0,0,0|2,0,0]=4 98 B12R2.100 c1c2cn[nH]c2cc(c1Br)F WX633239 [1,1,0,0,0,0|1,1,0]=4 99 B12R2.246 c1c(cc(c2c1[nH]nc2)F)Br WXC03412 [1,1,0,0,0,0|1,1,0]=4 100 B12R2.606 c1cc2c(cc1Cl)oc(n2)Cl WX636227 [1,1,0,0,0,0|2,0,0]=4 101 B12R2.606 c1cc2c(cc1Cl)oc(n2)S WX632006 [1,1,0,0,0,0|2,0,0]=4 102 B14R2.8235 c1cc2c(cc1Cl)c(nc(n2)Cl)Cl WX636317 [0,1,0,0,0,1|2,0,0]=4 103 B14R2.1073 COc1c2ccc(cc2ccn1)Br WX637095 [0,1,0,0,0,1|1,1,0]=4 104 B14R2.28472 c1c2c(cc(c1Br)Cl)ncnc2O WX637300 [0,1,0,0,0,1|1,0,0]=3 105 B12R1.49 c1cc(ccc1C\C(=N/O)\N)O WX690137 [0,0,1,0,0,1|2,0,0]=4 106 B12R1.49 c1cc(ccc1C\C(=N\O)\N)F WX690158 [0,0,1,0,0,1|1,1,0]=4