0 B15R2.1154 Cc1ccc(c(c1)Br)C=C2CCCC2 271570a_100010378317_100009813563 [0,0,0,0,0,0|3,1,0]=4 1 B15R2.1154 Cc1ccc(c(c1)Br)NC2CCCC2 34a_100000210942_100000179811 [0,0,0,0,0,0|2,1,1]=4 2 B15R2.1154 Cc1ccc(c(c1)Br)Sc2ncc[nH]2 62a_100009813563_100025796157 [0,0,0,0,0,0|1,1,2]=4 3 B15R2.1154 Cc1ccc(c(c1)Br)Sc2ncc[nH]2 62a_100025796157_100009813563 [0,0,0,0,0,0|1,1,2]=4 4 B15R2.1154 Cc1ccc(c(c1)C)C=C2CCCC2 271570a_100010378317_100011217332 [0,0,0,0,0,0|4,0,0]=4 5 B15R2.1154 Cc1ccc(c(c1)C)NC2CCCC2 34a_100000736561_100000179811 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.1154 Cc1ccc(c(c1)C)NC2CCCC2 7a_100000736561_100000179811 [0,0,0,0,0,0|3,0,1]=4 7 B15R2.1154 Cc1ccc(c(c1)C)Nc2ncns2 27a_100000736561_100000693119 [0,0,0,0,0,0|3,0,1]=4 8 B15R2.1154 Cc1ccc(c(c1)C)Nc2nncs2 27a_100000736561_100000739804 [0,0,0,0,0,0|3,0,1]=4 9 B15R2.1154 Cc1ccc(c(c1)C)Sc2ncc[nH]2 62a_100011217332_100025796157 [0,0,0,0,0,0|2,0,2]=4 10 B15R2.1154 Cc1ccc(c(c1)C)Sc2ncc[nH]2 62a_100025796157_100011217332 [0,0,0,0,0,0|2,0,2]=4 11 B15R2.1154 Cc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100011263221 [0,0,0,0,0,0|3,0,0]=3 12 B15R2.1154 Cc1ccc(c(c1)Cl)CN2CCCC2 2230a_100000188435_100012349684 [0,0,0,0,0,0|4,0,0]=4 13 B15R2.1154 Cc1ccc(c(c1)Cl)CN2CCCC2 269982a_100000188435_100012349684 [0,0,0,0,0,0|4,0,0]=4 14 B15R2.1154 Cc1ccc(c(c1)Cl)CN2CCCC2 26a_100000188435_100000749699 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.1154 Cc1ccc(c(c1)Cl)CN2CCCC2 270004a_100000188435_100011935181 [0,0,0,0,0,0|4,0,0]=4 16 B15R2.1154 Cc1ccc(c(c1)Cl)NC2CCCC2 34a_100000210522_100000179811 [0,0,0,0,0,0|2,0,1]=3 17 B15R2.1154 Cc1ccc(c(c1)Cl)NC2CCOC2 34a_100000210522_100000690089 [0,0,0,0,0,0|3,0,1]=4 18 B15R2.1154 Cc1ccc(c(c1)Cl)OC2CCCC2 34a_100000749699_100000179811 [0,0,0,0,0,0|3,0,1]=4 19 B15R2.1154 Cc1ccc(c(c1)Cl)OC2CCCC2 7a_100000749699_100000179811 [0,0,0,0,0,0|3,0,1]=4 20 B15R2.1154 Cc1ccc(c(c1)Cl)SC2CCCC2 62a_100011217020_100011263221 [0,0,0,0,0,0|3,0,1]=4 21 B15R2.1154 Cc1ccc(c(c1)Cl)SC2CCCC2 62a_100011263221_100000179811 [0,0,0,0,0,0|3,0,1]=4 22 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2c[nH]cn2 62a_100000756875_100011263221 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2c[nH]cn2 62a_100011263221_100000756875 [0,0,0,0,0,0|3,0,1]=4 24 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2c[nH]nn2 62a_100009819707_100011263221 [0,0,0,0,0,0|4,0,0]=4 25 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2c[nH]nn2 62a_100011263221_100009819707 [0,0,0,0,0,0|4,0,0]=4 26 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2cc[nH]n2 62a_100000062575_100011263221 [0,0,0,0,0,0|3,0,1]=4 27 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2cc[nH]n2 62a_100011263221_100000062575 [0,0,0,0,0,0|3,0,1]=4 28 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ccon2 62a_100009818083_100011263221 [0,0,0,0,0,0|3,0,1]=4 29 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ccon2 62a_100011263221_100009818083 [0,0,0,0,0,0|3,0,1]=4 30 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ccsn2 62a_100009818082_100011263221 [0,0,0,0,0,0|3,0,1]=4 31 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ccsn2 62a_100011263221_100009818082 [0,0,0,0,0,0|3,0,1]=4 32 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2cscn2 62a_100000751502_100011263221 [0,0,0,0,0,0|3,0,1]=4 33 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2cscn2 62a_100011263221_100000751502 [0,0,0,0,0,0|3,0,1]=4 34 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nc[nH]n2 62a_100000761765_100011263221 [0,0,0,0,0,0|2,0,2]=4 35 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nc[nH]n2 62a_100011263221_100000761765 [0,0,0,0,0,0|2,0,2]=4 36 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100011263221_100025796157 [0,0,0,0,0,0|1,0,2]=3 37 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100011263221 [0,0,0,0,0,0|1,0,2]=3 38 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncco2 62a_100011263221_100011787736 [0,0,0,0,0,0|2,0,2]=4 39 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncco2 62a_100011787736_100011263221 [0,0,0,0,0,0|2,0,2]=4 40 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nccs2 62a_100000211983_100011263221 [0,0,0,0,0,0|2,0,2]=4 41 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nccs2 62a_100011263221_100000211983 [0,0,0,0,0,0|2,0,2]=4 42 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncns2 62a_100000693119_100011263221 [0,0,0,0,0,0|3,0,1]=4 43 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2ncns2 62a_100011263221_100000693119 [0,0,0,0,0,0|3,0,1]=4 44 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nncs2 62a_100000739804_100011263221 [0,0,0,0,0,0|3,0,1]=4 45 B15R2.1154 Cc1ccc(c(c1)Cl)Sc2nncs2 62a_100011263221_100000739804 [0,0,0,0,0,0|3,0,1]=4 46 B15R2.1154 Cc1ccc(c(c1)F)C=C2CCCC2 271570a_100010378317_100011216119 [0,0,0,0,0,0|3,1,0]=4 47 B15R2.1154 Cc1ccc(c(c1)F)NC2CCCC2 34a_100000211023_100000179811 [0,0,0,0,0,0|2,1,1]=4 48 B15R2.1154 Cc1ccc(c(c1)F)Nc2ncns2 27a_100000211023_100000693119 [0,0,0,0,0,0|2,1,1]=4 49 B15R2.1154 Cc1ccc(c(c1)F)Nc2nncs2 27a_100000211023_100000739804 [0,0,0,0,0,0|2,1,1]=4 50 B15R2.1154 Cc1ccc(c(c1)F)Sc2ncc[nH]2 62a_100011216119_100025796157 [0,0,0,0,0,0|1,1,2]=4 51 B15R2.1154 Cc1ccc(c(c1)F)Sc2ncc[nH]2 62a_100025796157_100011216119 [0,0,0,0,0,0|1,1,2]=4 52 B15R2.1154 Cc1ccc(c(c1)I)NC2CCCC2 34a_100011356834_100000179811 [0,0,0,0,0,0|2,1,1]=4 53 B15R2.1154 Cc1ccc(c(c1)N)C=C2CCCC2 271570a_100010378317_100011216686 [0,0,0,0,0,0|4,0,0]=4 54 B15R2.1154 Cc1ccc(c(c1)N)Sc2ncc[nH]2 62a_100011216686_100025796157 [0,0,0,0,0,0|2,0,2]=4 55 B15R2.1154 Cc1ccc(c(c1)N)Sc2ncc[nH]2 62a_100025796157_100011216686 [0,0,0,0,0,0|2,0,2]=4 56 B15R2.1154 Cc1ccc(c(c1)O)C=C2CCCC2 271570a_100010378317_100012002257 [0,0,0,0,0,0|4,0,0]=4 57 B15R2.1154 Cc1ccc(c(c1)O)NC2CCCC2 34a_100000211527_100000179811 [0,0,0,0,0,0|3,0,1]=4 58 B15R2.1154 Cc1ccc(c(c1)O)Nc2ncns2 27a_100000211527_100000693119 [0,0,0,0,0,0|3,0,1]=4 59 B15R2.1154 Cc1ccc(c(c1)O)Nc2nncs2 27a_100000211527_100000739804 [0,0,0,0,0,0|3,0,1]=4 60 B15R2.1154 Cc1ccc(c(c1)O)Sc2ncc[nH]2 62a_100012002257_100025796157 [0,0,0,0,0,0|2,0,2]=4 61 B15R2.1154 Cc1ccc(c(c1)O)Sc2ncc[nH]2 62a_100025796157_100012002257 [0,0,0,0,0,0|2,0,2]=4 62 B15R2.1154 Clc1cc(ccc1C=C2CCCC2)Br 271570a_100010378317_100011216062 [0,0,0,0,0,0|4,0,0]=4 63 B15R2.1154 Clc1cc(ccc1NC2CCCC2)Br 34a_100000211467_100000179811 [0,0,0,0,0,0|3,0,1]=4 64 B15R2.1154 Clc1cc(ccc1NC2CCCC2)I 34a_100011218065_100000179811 [0,0,0,0,0,0|3,0,1]=4 65 B15R2.1154 Clc1cc(ccc1Sc2ncc[nH]2)Br 62a_100011216062_100025796157 [0,0,0,0,0,0|2,0,2]=4 66 B15R2.1154 Clc1cc(ccc1Sc2ncc[nH]2)Br 62a_100025796157_100011216062 [0,0,0,0,0,0|2,0,2]=4 67 B15R2.1154 Clc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100000699841 [0,0,0,0,0,0|4,0,0]=4 68 B15R2.1154 Clc1ccc(c(c1)Cl)NC2CCCC2 34a_100000185861_100000179811 [0,0,0,0,0,0|3,0,1]=4 69 B15R2.1154 Clc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100000699841_100025796157 [0,0,0,0,0,0|2,0,2]=4 70 B15R2.1154 Clc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100000699841 [0,0,0,0,0,0|2,0,2]=4 71 B15R2.1154 Fc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100000733362 [0,0,0,0,0,0|4,0,0]=4 72 B15R2.1154 Fc1ccc(c(c1)Cl)NC2CCCC2 34a_100000212003_100000179811 [0,0,0,0,0,0|3,0,1]=4 73 B15R2.1154 Fc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100000733362_100025796157 [0,0,0,0,0,0|2,0,2]=4 74 B15R2.1154 Fc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100000733362 [0,0,0,0,0,0|2,0,2]=4 75 B15R2.1154 Nc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100000761885 [0,0,0,0,0,0|4,0,0]=4 76 B15R2.1154 Nc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100000761885_100025796157 [0,0,0,0,0,0|2,0,2]=4 77 B15R2.1154 Nc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100000761885 [0,0,0,0,0,0|2,0,2]=4 78 B15R2.1154 Oc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100000047559 [0,0,0,0,0,0|4,0,0]=4 79 B15R2.1154 Oc1ccc(c(c1)Cl)NC2CCCC2 34a_100011215599_100000179811 [0,0,0,0,0,0|3,0,1]=4 80 B15R2.1154 Oc1ccc(c(c1)Cl)Nc2ncns2 27a_100011215599_100000693119 [0,0,0,0,0,0|3,0,1]=4 81 B15R2.1154 Oc1ccc(c(c1)Cl)Nc2nncs2 27a_100011215599_100000739804 [0,0,0,0,0,0|3,0,1]=4 82 B15R2.1154 Oc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100000047559_100025796157 [0,0,0,0,0,0|2,0,2]=4 83 B15R2.1154 Oc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100000047559 [0,0,0,0,0,0|2,0,2]=4 84 B14R2.50 Clc1ccccc1C=C2CCCC2 271570a_100010378317_100000764095 [1,0,0,0,0,0|3,0,0]=4 85 B14R2.50 Clc1ccccc1NC2CCCC2 34a_100000185783_100000179811 [1,0,0,0,0,0|2,0,1]=4 86 B14R2.50 Clc1ccccc1Nc2ncns2 27a_100000185783_100000693119 [1,0,0,0,0,0|2,0,1]=4 87 B14R2.50 Clc1ccccc1Nc2nncs2 27a_100000185783_100000739804 [1,0,0,0,0,0|2,0,1]=4 88 B14R2.50 Clc1ccccc1Sc2ncc[nH]2 62a_100000764095_100025796157 [1,0,0,0,0,0|1,0,2]=4 89 B14R2.50 Clc1ccccc1Sc2ncc[nH]2 62a_100025796157_100000764095 [1,0,0,0,0,0|1,0,2]=4 90 B14R2.72 Cc1ccc(cc1)C=C2CCCC2 271570a_100010378317_100000186775 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.72 Cc1ccc(cc1)NC2CCCC2 34a_100000124888_100000179811 [1,0,0,0,0,0|2,0,1]=4 92 B14R2.72 Cc1ccc(cc1)Nc2ncns2 27a_100000124888_100000693119 [1,0,0,0,0,0|2,0,1]=4 93 B14R2.72 Cc1ccc(cc1)Nc2nncs2 27a_100000124888_100000739804 [1,0,0,0,0,0|2,0,1]=4 94 B14R2.72 Cc1ccc(cc1)Sc2ncc[nH]2 62a_100000186775_100025796157 [1,0,0,0,0,0|1,0,2]=4 95 B14R2.72 Cc1ccc(cc1)Sc2ncc[nH]2 62a_100025796157_100000186775 [1,0,0,0,0,0|1,0,2]=4 96 B16R2.316 Cc1ccc(c(c1)Cl)Sc2nc(c[nH]2)C 62a_100011263221_100161115468 [0,1,0,0,0,0|1,0,2]=4 97 B16R2.316 Cc1ccc(c(c1)Cl)Sc2nc(c[nH]2)C 62a_100161115468_100011263221 [0,1,0,0,0,0|1,0,2]=4 98 B16R2.2060 COc1ccc(c(c1)Cl)NC2CCCC2 34a_100000747055_100000179811 [0,1,0,0,0,0|2,0,1]=4 99 B16R2.2060 COc1ccc(c(c1)Cl)Nc2ncns2 27a_100000747055_100000693119 [0,1,0,0,0,0|2,0,1]=4 100 B16R2.2060 COc1ccc(c(c1)Cl)Nc2nncs2 27a_100000747055_100000739804 [0,1,0,0,0,0|2,0,1]=4 101 B16R2.2060 OCc1ccc(c(c1)Cl)C=C2CCCC2 271570a_100010378317_100000718186 [0,1,0,0,0,0|3,0,0]=4 102 B16R2.2060 OCc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100000718186_100025796157 [0,1,0,0,0,0|1,0,2]=4 103 B16R2.2060 OCc1ccc(c(c1)Cl)Sc2ncc[nH]2 62a_100025796157_100000718186 [0,1,0,0,0,0|1,0,2]=4 104 B16R2.6175 Cc1cc(c(c(c1)Br)NC2CCCC2)Cl 34a_100012339639_100000179811 [0,1,0,0,0,0|2,0,1]=4 105 B16R2.6175 Cc1cc(c(c(c1)Cl)NC2CCCC2)C 34a_100000211461_100000179811 [0,1,0,0,0,0|2,0,1]=4 106 B16R2.6175 Cc1cc(c(c(c1)Cl)NC2CCCC2)C 7a_100000211461_100000179811 [0,1,0,0,0,0|2,0,1]=4 107 B16R2.6175 Cc1cc(c(c(c1)Cl)NC2CCCC2)Cl 34a_100011996032_100000179811 [0,1,0,0,0,0|2,0,1]=4 108 B16R2.6175 Cc1cc(c(c(c1)Cl)NC2CCCC2)O 34a_100015906060_100000179811 [0,1,0,0,0,0|2,0,1]=4 109 B16R2.12287 Cc1ccc(c(c1O)Cl)NC2CCCC2 34a_100000036876_100000179811 [0,1,0,0,0,0|2,0,1]=4 110 B16R2.12287 Cc1ccc(c(c1O)Cl)NC2CCCC2 7a_100000036876_100000179811 [0,1,0,0,0,0|2,0,1]=4 111 B16R2.12287 Cc1ccc(c(c1O)Cl)Nc2ncns2 27a_100000036876_100000693119 [0,1,0,0,0,0|2,0,1]=4 112 B16R2.12287 Cc1ccc(c(c1O)Cl)Nc2nncs2 27a_100000036876_100000739804 [0,1,0,0,0,0|2,0,1]=4 113 B16R2.12609 Cc1ccc(c(c1)C)Nc2ncnn2C 27a_100000736561_100000732653 [0,1,0,0,0,0|2,0,1]=4 114 B16R2.12609 Cc1ccc(c(c1)Cl)NC2CCCC2=O 34a_100000210522_100000709159 [0,1,0,0,0,0|2,0,1]=4 115 B16R2.12609 Cc1ccc(c(c1)Cl)Sc2nccn2C 62a_100000707724_100011263221 [0,1,0,0,0,0|1,0,2]=4 116 B16R2.12609 Cc1ccc(c(c1)Cl)Sc2nccn2C 62a_100011263221_100000707724 [0,1,0,0,0,0|1,0,2]=4 117 B16R2.12609 Cc1ccc(c(c1)Cl)Sc2ncnn2C 62a_100000732653_100011263221 [0,1,0,0,0,0|2,0,1]=4 118 B16R2.12609 Cc1ccc(c(c1)Cl)Sc2ncnn2C 62a_100011263221_100000732653 [0,1,0,0,0,0|2,0,1]=4 119 B16R2.12609 Cc1ccc(c(c1)F)Nc2ncnn2C 27a_100000211023_100000732653 [0,1,0,0,0,0|1,1,1]=4 120 B16R2.12609 Cc1ccc(c(c1)O)Nc2ncnn2C 27a_100000211527_100000732653 [0,1,0,0,0,0|2,0,1]=4 121 B16R2.12609 Cn1ncnc1Nc2ccc(cc2Cl)O 27a_100011215599_100000732653 [0,1,0,0,0,0|2,0,1]=4 122 B16R2.26095 Cc1cc(c(cc1C)NC2CCCC2)Cl 34a_100012183282_100000179811 [0,1,0,0,0,0|2,0,1]=4 123 B16R2.26095 Cc1cc(c(cc1C)NC2CCCC2)Cl 7a_100012183282_100000179811 [0,1,0,0,0,0|2,0,1]=4 124 B16R2.26095 Cc1cc(c(cc1O)NC2CCCC2)Cl 34a_100000092876_100000179811 [0,1,0,0,0,0|2,0,1]=4 125 B16R2.26095 Cc1cc(c(cc1O)NC2CCCC2)Cl 7a_100000092876_100000179811 [0,1,0,0,0,0|2,0,1]=4 126 B14R1.774 CCCC=NNc1ccc(cc1Cl)C 4a_100000006747_100000185831 [0,0,1,0,0,0|3,0,0]=4 127 B14R1.774 CCCCC=Cc1ccc(cc1Cl)C 271570a_100016275911_100011263221 [0,0,1,0,0,0|3,0,0]=4 128 B14R1.774 CCCCCNc1ccc(cc1Cl)C 34a_100000210522_100000718602 [0,0,1,0,0,0|2,0,1]=4 129 B14R1.774 CCCNN=Cc1ccc(cc1Cl)C 4a_100000740057_100011935181 [0,0,1,0,0,0|3,0,0]=4 130 B14R1.774 Cc1ccc(c(c1)Cl)C=NNCCO 4a_100000210001_100011935181 [0,0,1,0,0,0|3,0,0]=4 131 B14R1.774 Cc1ccc(c(c1)Cl)COCCCN 34a_100000182051_100012349684 [0,0,1,0,0,0|3,0,0]=4 132 B14R1.774 Cc1ccc(c(c1)Cl)NCCCCF 34a_100000210522_100000729493 [0,0,1,0,0,0|2,0,1]=4 133 B14R1.774 Cc1ccc(c(c1)Cl)NCCCCO 34a_100000210522_100011216708 [0,0,1,0,0,0|2,0,1]=4 134 B14R1.6823 CC#CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000763181 [0,0,1,0,0,0|2,0,1]=4 135 B14R1.6823 CC=CC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210699 [0,0,1,0,0,0|2,0,1]=4 136 B14R1.6823 CC=CC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210699 [0,0,1,0,0,0|2,0,1]=4 137 B14R1.6823 CC=CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210699 [0,0,1,0,0,0|2,0,1]=4 138 B14R1.6823 CCCC(=O)Cc1ccc(cc1Cl)C 1458a_100000211992_100012349684 [0,0,1,0,0,0|3,0,0]=4 139 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000211992 [0,0,1,0,0,0|2,1,0]=4 140 B14R1.6823 CCCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000211992 [0,0,1,0,0,0|2,1,0]=4 141 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000211992 [0,0,1,0,0,0|3,0,0]=4 142 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000211992 [0,0,1,0,0,0|3,0,0]=4 143 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000211992 [0,0,1,0,0,0|3,0,0]=4 144 B14R1.6823 CCCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000211992 [0,0,1,0,0,0|3,0,0]=4 145 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000211992 [0,0,1,0,0,0|3,0,0]=4 146 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000211992 [0,0,1,0,0,0|3,0,0]=4 147 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000211992 [0,0,1,0,0,0|2,0,0]=3 148 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000211992 [0,0,1,0,0,0|2,0,0]=3 149 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000211992 [0,0,1,0,0,0|2,0,0]=3 150 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000211992 [0,0,1,0,0,0|3,0,0]=4 151 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000211992 [0,0,1,0,0,0|3,0,0]=4 152 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000211992 [0,0,1,0,0,0|3,0,0]=4 153 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000211992 [0,0,1,0,0,0|3,0,0]=4 154 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000211992 [0,0,1,0,0,0|3,0,0]=4 155 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000211992 [0,0,1,0,0,0|3,0,0]=4 156 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000211992 [0,0,1,0,0,0|3,0,0]=4 157 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000211992 [0,0,1,0,0,0|3,0,0]=4 158 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000211992 [0,0,1,0,0,0|3,0,0]=4 159 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000211992 [0,0,1,0,0,0|3,0,0]=4 160 B14R1.6823 CCCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000211992 [0,0,1,0,0,0|3,0,0]=4 161 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000211992 [0,0,1,0,0,0|2,1,0]=4 162 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000211992 [0,0,1,0,0,0|2,1,0]=4 163 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000211992 [0,0,1,0,0,0|2,1,0]=4 164 B14R1.6823 CCCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000211992 [0,0,1,0,0,0|2,1,0]=4 165 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000211992 [0,0,1,0,0,0|2,1,0]=4 166 B14R1.6823 CCCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000211992 [0,0,1,0,0,0|2,1,0]=4 167 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000211992 [0,0,1,0,0,0|3,0,0]=4 168 B14R1.6823 CCCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000211992 [0,0,1,0,0,0|3,0,0]=4 169 B14R1.6823 CCCC(C)Nc1ccc(cc1Cl)C 34a_100000210522_100000766640 [0,0,1,0,0,0|2,0,1]=4 170 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 11a_100015525214_100011236500 [0,0,1,0,0,0|3,0,0]=4 171 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 240690a_100015525214_100011236500 [0,0,1,0,0,0|3,0,0]=4 172 B14R1.6823 CCNC(=O)Cc1ccc(cc1C)C 527a_100015525214_100011236500 [0,0,1,0,0,0|3,0,0]=4 173 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 11a_100015525214_100012361378 [0,0,1,0,0,0|3,0,0]=4 174 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 240690a_100015525214_100012361378 [0,0,1,0,0,0|3,0,0]=4 175 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Br 527a_100015525214_100012361378 [0,0,1,0,0,0|3,0,0]=4 176 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 11a_100015525214_100000210926 [0,0,1,0,0,0|3,0,0]=4 177 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 240690a_100015525214_100000210926 [0,0,1,0,0,0|3,0,0]=4 178 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)Cl 527a_100015525214_100000210926 [0,0,1,0,0,0|3,0,0]=4 179 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 11a_100015525214_100000690284 [0,0,1,0,0,0|3,0,0]=4 180 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 240690a_100015525214_100000690284 [0,0,1,0,0,0|3,0,0]=4 181 B14R1.6823 CCNC(=O)Cc1ccc(cc1Cl)F 527a_100015525214_100000690284 [0,0,1,0,0,0|3,0,0]=4 182 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 11a_100015525214_100000042674 [0,0,1,0,0,0|2,1,0]=4 183 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 240690a_100015525214_100000042674 [0,0,1,0,0,0|2,1,0]=4 184 B14R1.6823 CCNC(=O)Cc1ccc(cc1F)C 527a_100015525214_100000042674 [0,0,1,0,0,0|2,1,0]=4 185 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)Br 2430a_100000211012_100015525214 [0,0,1,0,0,0|2,1,0]=4 186 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100015525214 [0,0,1,0,0,0|1,1,0]=3 187 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)Cl 2430a_100000752454_100015525214 [0,0,1,0,0,0|2,1,0]=4 188 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)F 2430a_100000738039_100015525214 [0,0,1,0,0,0|2,1,0]=4 189 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)I 2430a_100000750455_100015525214 [0,0,1,0,0,0|2,1,0]=4 190 B14R1.6823 CCNC(=O)Nc1ccc(cc1Br)O 2430a_100012001276_100015525214 [0,0,1,0,0,0|2,1,0]=4 191 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)Br 2430a_100000211769_100015525214 [0,0,1,0,0,0|3,0,0]=4 192 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100015525214 [0,0,1,0,0,0|2,0,0]=3 193 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)Cl 2430a_100000210418_100015525214 [0,0,1,0,0,0|3,0,0]=4 194 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)F 2430a_100000211637_100015525214 [0,0,1,0,0,0|3,0,0]=4 195 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)I 2430a_100000184554_100015525214 [0,0,1,0,0,0|3,0,0]=4 196 B14R1.6823 CCNC(=O)Nc1ccc(cc1C)O 2430a_100000756630_100015525214 [0,0,1,0,0,0|3,0,0]=4 197 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100015525214 [0,0,1,0,0,0|2,0,0]=3 198 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100015525214 [0,0,1,0,0,0|1,0,0]=2 199 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100015525214 [0,0,1,0,0,0|2,0,0]=3 200 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100015525214 [0,0,1,0,0,0|2,0,0]=3 201 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100015525214 [0,0,1,0,0,0|2,0,0]=3 202 B14R1.6823 CCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100015525214 [0,0,1,0,0,0|2,0,0]=3 203 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)Br 2430a_100000210722_100015525214 [0,0,1,0,0,0|2,1,0]=4 204 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100015525214 [0,0,1,0,0,0|1,1,0]=3 205 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)Cl 2430a_100000211020_100015525214 [0,0,1,0,0,0|2,1,0]=4 206 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)F 2430a_100000210720_100015525214 [0,0,1,0,0,0|2,1,0]=4 207 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)I 2430a_100011215594_100015525214 [0,0,1,0,0,0|2,1,0]=4 208 B14R1.6823 CCNC(=O)Nc1ccc(cc1F)O 2430a_100000759473_100015525214 [0,0,1,0,0,0|2,1,0]=4 209 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100015525214 [0,0,1,0,0,0|1,1,0]=3 210 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)Cl 2430a_100000761889_100015525214 [0,0,1,0,0,0|2,1,0]=4 211 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)F 2430a_100000760547_100015525214 [0,0,1,0,0,0|2,1,0]=4 212 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)I 2430a_100010002754_100015525214 [0,0,1,0,0,0|2,1,0]=4 213 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)I 512a_100010002754_100015525214 [0,0,1,0,0,0|2,1,0]=4 214 B14R1.6823 CCNC(=O)Nc1ccc(cc1I)O 2430a_100010084370_100015525214 [0,0,1,0,0,0|2,1,0]=4 215 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100015525214 [0,0,1,0,0,0|2,0,0]=3 216 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)Cl 2430a_100000185728_100015525214 [0,0,1,0,0,0|3,0,0]=4 217 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)F 2430a_100000753323_100015525214 [0,0,1,0,0,0|3,0,0]=4 218 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)I 2430a_100000057187_100015525214 [0,0,1,0,0,0|3,0,0]=4 219 B14R1.6823 CCNC(=O)Nc1ccc(cc1O)O 2430a_100000106777_100015525214 [0,0,1,0,0,0|3,0,0]=4 220 B14R1.6823 CNCC(=O)Nc1ccc(cc1Cl)C 2230a_106832991635_100000183498 [0,0,1,0,0,0|3,0,0]=4 221 B14R1.6823 CNCC(=O)Nc1ccc(cc1Cl)C 34a_100102657272_100000183498 [0,0,1,0,0,0|3,0,0]=4 222 B14R1.6823 CNCC(=O)Nc1ccc(cc1Cl)C 7a_106832991635_100000183498 [0,0,1,0,0,0|3,0,0]=4 223 B14R1.6823 COCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210968 [0,0,1,0,0,0|3,0,0]=4 224 B14R1.6823 COCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210968 [0,0,1,0,0,0|3,0,0]=4 225 B14R1.6823 COCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210968 [0,0,1,0,0,0|3,0,0]=4 226 B14R1.6823 COCC(=O)Nc1ccc(cc1Cl)C 34a_100138415774_100000183498 [0,0,1,0,0,0|3,0,0]=4 227 B14R1.6823 CSCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000184570 [0,0,1,0,0,0|3,0,0]=4 228 B14R1.6823 CSCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000184570 [0,0,1,0,0,0|3,0,0]=4 229 B14R1.6823 CSCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000184570 [0,0,1,0,0,0|3,0,0]=4 230 B14R1.6823 CSCC(=O)Nc1ccc(cc1Cl)C 62a_200000210301_100000183498 [0,0,1,0,0,0|3,0,0]=4 231 B14R1.6823 Cc1ccc(c(c1)Cl)NC(=O)CCO 22a_100000210522_100011216618 [0,0,1,0,0,0|3,0,0]=4 232 B14R1.6823 Cc1ccc(c(c1)Cl)NC(=O)CS[13CH3] 62a_200025704644_100000183498 [0,0,1,0,0,0|3,0,0]=4 233 B14R2.739 Cc1ccc(c(c1)Br)C2=CCCC2 271570a_100000089523_100009813563 [0,0,0,0,1,0|2,1,0]=4 234 B14R2.739 Cc1ccc(c(c1)Br)c2ncc[nH]2 271570a_100016988920_100009813563 [0,0,0,0,1,0|0,1,2]=4 235 B14R2.739 Cc1ccc(c(c1)C)C2=CCCC2 271570a_100000089523_100011217332 [0,0,0,0,1,0|3,0,0]=4 236 B14R2.739 Cc1ccc(c(c1)C)c2ncc[nH]2 271570a_100011216325_100025796157 [0,0,0,0,1,0|1,0,2]=4 237 B14R2.739 Cc1ccc(c(c1)C)c2ncc[nH]2 271570a_100016988920_100011217332 [0,0,0,0,1,0|1,0,2]=4 238 B14R2.739 Cc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100011263221 [0,0,0,0,1,0|2,0,0]=3 239 B14R2.739 Cc1ccc(c(c1)Cl)C2=CCOC2 271570a_100009872500_100011263221 [0,0,0,0,1,0|3,0,0]=4 240 B14R2.739 Cc1ccc(c(c1)Cl)C2=COCC2 271570a_100000118173_100011263221 [0,0,0,0,1,0|3,0,0]=4 241 B14R2.739 Cc1ccc(c(c1)Cl)c2c[nH]cn2 271570a_100011218894_100000756875 [0,0,0,0,1,0|2,0,1]=4 242 B14R2.739 Cc1ccc(c(c1)Cl)c2cc[nH]n2 271570a_100000062414_100011263221 [0,0,0,0,1,0|2,0,1]=4 243 B14R2.739 Cc1ccc(c(c1)Cl)c2cc[nH]n2 271570a_100011218894_100000062575 [0,0,0,0,1,0|2,0,1]=4 244 B14R2.739 Cc1ccc(c(c1)Cl)c2ccsn2 271570a_100011218894_100009818082 [0,0,0,0,1,0|2,0,1]=4 245 B14R2.739 Cc1ccc(c(c1)Cl)c2cscn2 271570a_100011218894_100000751502 [0,0,0,0,1,0|2,0,1]=4 246 B14R2.739 Cc1ccc(c(c1)Cl)c2nc[nH]n2 271570a_100011218894_100000761765 [0,0,0,0,1,0|1,0,2]=4 247 B14R2.739 Cc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100011218894_100025796157 [0,0,0,0,1,0|0,0,2]=3 248 B14R2.739 Cc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100011263221 [0,0,0,0,1,0|0,0,2]=3 249 B14R2.739 Cc1ccc(c(c1)Cl)c2ncco2 271570a_100011218894_100011787736 [0,0,0,0,1,0|1,0,2]=4 250 B14R2.739 Cc1ccc(c(c1)Cl)c2nccs2 271570a_100011218894_100000211983 [0,0,0,0,1,0|1,0,2]=4 251 B14R2.739 Cc1ccc(c(c1)Cl)c2ncns2 271570a_100011218894_100000693119 [0,0,0,0,1,0|2,0,1]=4 252 B14R2.739 Cc1ccc(c(c1)Cl)c2nncs2 271570a_100011218894_100000739804 [0,0,0,0,1,0|2,0,1]=4 253 B14R2.739 Cc1ccc(c(c1)F)C2=CCCC2 271570a_100000089523_100011216119 [0,0,0,0,1,0|2,1,0]=4 254 B14R2.739 Cc1ccc(c(c1)F)c2ncc[nH]2 271570a_100011219514_100025796157 [0,0,0,0,1,0|0,1,2]=4 255 B14R2.739 Cc1ccc(c(c1)F)c2ncc[nH]2 271570a_100016988920_100011216119 [0,0,0,0,1,0|0,1,2]=4 256 B14R2.739 Cc1ccc(c(c1)N)C2=CCCC2 271570a_100000089523_100011216686 [0,0,0,0,1,0|3,0,0]=4 257 B14R2.739 Cc1ccc(c(c1)N)c2ncc[nH]2 271570a_100000068089_100025796157 [0,0,0,0,1,0|1,0,2]=4 258 B14R2.739 Cc1ccc(c(c1)N)c2ncc[nH]2 271570a_100016988920_100011216686 [0,0,0,0,1,0|1,0,2]=4 259 B14R2.739 Cc1ccc(c(c1)O)C2=CCCC2 271570a_100000089523_100012002257 [0,0,0,0,1,0|3,0,0]=4 260 B14R2.739 Cc1ccc(c(c1)O)c2ncc[nH]2 271570a_100016988920_100012002257 [0,0,0,0,1,0|1,0,2]=4 261 B14R2.739 Cc1ccc(c(n1)Cl)c2ncc[nH]2 271570a_100000080196_100025796157 [0,0,0,0,1,0|1,0,2]=4 262 B14R2.739 Clc1cc(ccc1C2=CCCC2)Br 271570a_100000089523_100011216062 [0,0,0,0,1,0|3,0,0]=4 263 B14R2.739 Clc1cc(ccc1c2ncc[nH]2)Br 271570a_100016988920_100011216062 [0,0,0,0,1,0|1,0,2]=4 264 B14R2.739 Clc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100000699841 [0,0,0,0,1,0|3,0,0]=4 265 B14R2.739 Clc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100012352019_100025796157 [0,0,0,0,1,0|1,0,2]=4 266 B14R2.739 Clc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100000699841 [0,0,0,0,1,0|1,0,2]=4 267 B14R2.739 Fc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100000733362 [0,0,0,0,1,0|3,0,0]=4 268 B14R2.739 Fc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100000693062_100025796157 [0,0,0,0,1,0|1,0,2]=4 269 B14R2.739 Fc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100000733362 [0,0,0,0,1,0|1,0,2]=4 270 B14R2.739 Nc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100000761885 [0,0,0,0,1,0|3,0,0]=4 271 B14R2.739 Nc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100010211349_100025796157 [0,0,0,0,1,0|1,0,2]=4 272 B14R2.739 Nc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100000761885 [0,0,0,0,1,0|1,0,2]=4 273 B14R2.739 Oc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100000047559 [0,0,0,0,1,0|3,0,0]=4 274 B14R2.739 Oc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100000079644_100025796157 [0,0,0,0,1,0|1,0,2]=4 275 B14R2.739 Oc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100000047559 [0,0,0,0,1,0|1,0,2]=4 276 B14R2.30090 Cc1ccc(c(c1)Br)NC2CCC2 34a_100000210942_100000749161 [0,0,0,0,1,0|1,1,1]=4 277 B14R2.30090 Cc1ccc(c(c1)C)NC2CCC2 34a_100000736561_100000749161 [0,0,0,0,1,0|2,0,1]=4 278 B14R2.30090 Cc1ccc(c(c1)Cl)CN2CCC2 269982a_100000754969_100012349684 [0,0,0,0,1,0|3,0,0]=4 279 B14R2.30090 Cc1ccc(c(c1)Cl)CN2CCC2 26a_100000754969_100000749699 [0,0,0,0,1,0|3,0,0]=4 280 B14R2.30090 Cc1ccc(c(c1)Cl)NC2CCC2 34a_100000210522_100000749161 [0,0,0,0,1,0|1,0,1]=3 281 B14R2.30090 Cc1ccc(c(c1)Cl)NC2COC2 34a_100000210522_100009818527 [0,0,0,0,1,0|2,0,1]=4 282 B14R2.30090 Cc1ccc(c(c1)Cl)OC2CCC2 34a_100000749699_100000749161 [0,0,0,0,1,0|2,0,1]=4 283 B14R2.30090 Cc1ccc(c(c1)Cl)SC2CCC2 62a_100011263221_100000749161 [0,0,0,0,1,0|2,0,1]=4 284 B14R2.30090 Cc1ccc(c(c1)F)NC2CCC2 34a_100000211023_100000749161 [0,0,0,0,1,0|1,1,1]=4 285 B14R2.30090 Cc1ccc(c(c1)I)NC2CCC2 34a_100011356834_100000749161 [0,0,0,0,1,0|1,1,1]=4 286 B14R2.30090 Cc1ccc(c(c1)O)NC2CCC2 34a_100000211527_100000749161 [0,0,0,0,1,0|2,0,1]=4 287 B14R2.30090 Clc1cc(ccc1NC2CCC2)Br 34a_100000211467_100000749161 [0,0,0,0,1,0|2,0,1]=4 288 B14R2.30090 Clc1cc(ccc1NC2CCC2)I 34a_100011218065_100000749161 [0,0,0,0,1,0|2,0,1]=4 289 B14R2.30090 Clc1ccc(c(c1)Cl)NC2CCC2 34a_100000185861_100000749161 [0,0,0,0,1,0|2,0,1]=4 290 B14R2.30090 Fc1ccc(c(c1)Cl)NC2CCC2 34a_100000212003_100000749161 [0,0,0,0,1,0|2,0,1]=4 291 B14R2.30090 Oc1ccc(c(c1)Cl)NC2CCC2 34a_100011215599_100000749161 [0,0,0,0,1,0|2,0,1]=4 292 B16R2.312 Cc1ccc(c(c1)Cl)NC2CCCCC2 34a_100000210522_100000210327 [0,0,0,0,0,1|2,0,1]=4 293 B16R2.312 Cc1ccc(c(c1)Cl)NC2CCCOC2 34a_100000210522_100000693364 [0,0,0,0,0,1|2,0,1]=4 294 B16R2.312 Cc1ccc(c(c1)Cl)NC2CCSCC2 34a_100000210522_100000069128 [0,0,0,0,0,1|2,0,1]=4 295 B16R2.3000 Brc1cc(ccc1OCC2=NCCN2)I 34a_100012361655_100000737910 [0,0,0,0,0,1|2,1,0]=4 296 B16R2.3000 Brc1cc(ccc1OCC2=NCCN2)I 7a_100012361655_100000737910 [0,0,0,0,0,1|2,1,0]=4 297 B16R2.3000 Brc1ccc(c(c1)Br)NCC2=NCCN2 34a_100000211012_100000737910 [0,0,0,0,0,1|1,1,0]=3 298 B16R2.3000 Brc1ccc(c(c1)Br)OCC2=NCCN2 34a_100000188717_100000737910 [0,0,0,0,0,1|2,1,0]=4 299 B16R2.3000 Brc1ccc(c(c1)Br)OCC2=NCCN2 7a_100000188717_100000737910 [0,0,0,0,0,1|2,1,0]=4 300 B16R2.3000 Brc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100011484698 [0,0,0,0,0,1|2,1,0]=4 301 B16R2.3000 Brc1ccc(c(c1)Br)SCC2=NCCN2 62a_100011484698_100000737910 [0,0,0,0,0,1|2,1,0]=4 302 B16R2.3000 Brc1ccc(c(c1)I)NCC2=NCCN2 34a_100000187925_100000737910 [0,0,0,0,0,1|1,1,0]=3 303 B16R2.3000 Brc1ccc(c(c1)I)OCC2=NCCN2 34a_100012355227_100000737910 [0,0,0,0,0,1|2,1,0]=4 304 B16R2.3000 Brc1ccc(c(c1)I)OCC2=NCCN2 7a_100012355227_100000737910 [0,0,0,0,0,1|2,1,0]=4 305 B16R2.3000 Cc1cc(=O)c(co1)OCC2=NCCN2 34a_100000081520_100000737910 [0,0,0,0,0,1|3,0,0]=4 306 B16R2.3000 Cc1cc(c(cn1)OCC2=NCCN2)Br 34a_100009843476_100000737910 [0,0,0,0,0,1|2,1,0]=4 307 B16R2.3000 Cc1cc(c(cn1)OCC2=NCCN2)Br 7a_100009843476_100000737910 [0,0,0,0,0,1|2,1,0]=4 308 B16R2.3000 Cc1cc(c(cn1)OCC2=NCCN2)C 34a_200000068632_100000737910 [0,0,0,0,0,1|3,0,0]=4 309 B16R2.3000 Cc1cc(c(cn1)OCC2=NCCN2)C 7a_200000068632_100000737910 [0,0,0,0,0,1|3,0,0]=4 310 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)C 62a_100000737910_100009819613 [0,0,0,0,0,1|3,0,0]=4 311 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)C 62a_100009819613_100000737910 [0,0,0,0,0,1|3,0,0]=4 312 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)N 62a_100000737910_100009817891 [0,0,0,0,0,1|3,0,0]=4 313 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)N 62a_100009817891_100000737910 [0,0,0,0,0,1|3,0,0]=4 314 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)O 62a_100000737910_100011016184 [0,0,0,0,0,1|3,0,0]=4 315 B16R2.3000 Cc1cc(c(cn1)SCC2=NCCN2)O 62a_100011016184_100000737910 [0,0,0,0,0,1|3,0,0]=4 316 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)Br 34a_100000211769_100000737910 [0,0,0,0,0,1|2,0,0]=3 317 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)Br 7a_100000211769_100000737910 [0,0,0,0,0,1|2,0,0]=3 318 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)Cl 34a_100000210418_100000737910 [0,0,0,0,0,1|2,0,0]=3 319 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)Cl 7a_100000210418_100000737910 [0,0,0,0,0,1|2,0,0]=3 320 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)F 34a_100000211637_100000737910 [0,0,0,0,0,1|2,0,0]=3 321 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)F 7a_100000211637_100000737910 [0,0,0,0,0,1|2,0,0]=3 322 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)I 34a_100000184554_100000737910 [0,0,0,0,0,1|2,0,0]=3 323 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)I 7a_100000184554_100000737910 [0,0,0,0,0,1|2,0,0]=3 324 B16R2.3000 Cc1cc(ccc1NCC2=NCCN2)O 34a_100000756630_100000737910 [0,0,0,0,0,1|2,0,0]=3 325 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)Br 34a_100000186361_100000737910 [0,0,0,0,0,1|3,0,0]=4 326 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)Br 7a_100000186361_100000737910 [0,0,0,0,0,1|3,0,0]=4 327 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)Cl 34a_100000211091_100000737910 [0,0,0,0,0,1|3,0,0]=4 328 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)Cl 7a_100000211091_100000737910 [0,0,0,0,0,1|3,0,0]=4 329 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)F 34a_100000764316_100000737910 [0,0,0,0,0,1|3,0,0]=4 330 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)F 7a_100000764316_100000737910 [0,0,0,0,0,1|3,0,0]=4 331 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)I 34a_100011218673_100000737910 [0,0,0,0,0,1|3,0,0]=4 332 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)I 7a_100011218673_100000737910 [0,0,0,0,0,1|3,0,0]=4 333 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)N 34a_100011218179_100000737910 [0,0,0,0,0,1|3,0,0]=4 334 B16R2.3000 Cc1cc(ccc1OCC2=NCCN2)N 7a_100011218179_100000737910 [0,0,0,0,0,1|3,0,0]=4 335 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)Br 62a_100000701812_100000737910 [0,0,0,0,0,1|3,0,0]=4 336 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)Br 62a_100000737910_100000701812 [0,0,0,0,0,1|3,0,0]=4 337 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)Cl 62a_100000737910_100011219607 [0,0,0,0,0,1|3,0,0]=4 338 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)Cl 62a_100011219607_100000737910 [0,0,0,0,0,1|3,0,0]=4 339 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)F 62a_100000737910_100011205405 [0,0,0,0,0,1|3,0,0]=4 340 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)F 62a_100011205405_100000737910 [0,0,0,0,0,1|3,0,0]=4 341 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)N 62a_100000210723_100000737910 [0,0,0,0,0,1|3,0,0]=4 342 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)N 62a_100000737910_100000210723 [0,0,0,0,0,1|3,0,0]=4 343 B16R2.3000 Cc1cc(ccc1SCC2=NCCN2)O 62a_100000737910_100000690111 [0,0,0,0,0,1|3,0,0]=4 344 B16R2.3000 Cc1ccc([n+](c1)[O-])SCC2=NCCN2 62a_100000737910_100009819918 [0,0,0,0,0,1|3,0,0]=4 345 B16R2.3000 Cc1ccc(c(c1)Br)NCC2=NCCN2 34a_100000210942_100000737910 [0,0,0,0,0,1|0,1,0]=2 346 B16R2.3000 Cc1ccc(c(c1)Br)NCc2ncc[nH]2 34a_100000210942_100016991755 [0,0,0,0,0,1|0,1,2]=4 347 B16R2.3000 Cc1ccc(c(c1)Br)NCc2nnn[nH]2 34a_100000210942_100000765167 [0,0,0,0,0,1|2,1,0]=4 348 B16R2.3000 Cc1ccc(c(c1)Br)NN=C2CCCC2 4a_100016996181_100000210133 [0,0,0,0,0,1|2,1,0]=4 349 B16R2.3000 Cc1ccc(c(c1)Br)OCC2=NCCN2 34a_100000210800_100000737910 [0,0,0,0,0,1|1,1,0]=3 350 B16R2.3000 Cc1ccc(c(c1)Br)OCC2=NCCN2 7a_100000210800_100000737910 [0,0,0,0,0,1|1,1,0]=3 351 B16R2.3000 Cc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100009813563 [0,0,0,0,0,1|1,1,0]=3 352 B16R2.3000 Cc1ccc(c(c1)Br)SCC2=NCCN2 62a_100009813563_100000737910 [0,0,0,0,0,1|1,1,0]=3 353 B16R2.3000 Cc1ccc(c(c1)C)NCC2=NCCN2 34a_100000736561_100000737910 [0,0,0,0,0,1|1,0,0]=2 354 B16R2.3000 Cc1ccc(c(c1)C)NCC2=NCCN2 7a_100000736561_100000737910 [0,0,0,0,0,1|1,0,0]=2 355 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 207a_100000736561_100000743867 [0,0,0,0,0,1|1,0,2]=4 356 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 34a_100000736561_100016991755 [0,0,0,0,0,1|1,0,2]=4 357 B16R2.3000 Cc1ccc(c(c1)C)NCc2ncc[nH]2 7a_100000736561_100000753453 [0,0,0,0,0,1|1,0,2]=4 358 B16R2.3000 Cc1ccc(c(c1)C)NCc2nnn[nH]2 34a_100000736561_100000765167 [0,0,0,0,0,1|3,0,0]=4 359 B16R2.3000 Cc1ccc(c(c1)C)NCc2nnn[nH]2 7a_100000736561_100000765167 [0,0,0,0,0,1|3,0,0]=4 360 B16R2.3000 Cc1ccc(c(c1)C)OCC2=NCCN2 34a_100000211776_100000737910 [0,0,0,0,0,1|2,0,0]=3 361 B16R2.3000 Cc1ccc(c(c1)C)OCC2=NCCN2 7a_100000211776_100000737910 [0,0,0,0,0,1|2,0,0]=3 362 B16R2.3000 Cc1ccc(c(c1)C)SCC2=NCCN2 62a_100000737910_100011217332 [0,0,0,0,0,1|2,0,0]=3 363 B16R2.3000 Cc1ccc(c(c1)C)SCC2=NCCN2 62a_100011217332_100000737910 [0,0,0,0,0,1|2,0,0]=3 364 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 207a_100000211070_100011935181 [0,0,0,0,0,1|2,0,1]=4 365 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 2230a_100000211070_100012349684 [0,0,0,0,0,1|2,0,1]=4 366 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 270004a_100000211070_100011935181 [0,0,0,0,0,1|2,0,1]=4 367 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 270004a_100011997539_100000210133 [0,0,0,0,0,1|2,0,1]=4 368 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 34a_100000211070_100012349684 [0,0,0,0,0,1|2,0,1]=4 369 B16R2.3000 Cc1ccc(c(c1)Cl)CNC2CCCC2 34a_100011997539_100000179811 [0,0,0,0,0,1|2,0,1]=4 370 B16R2.3000 Cc1ccc(c(c1)Cl)CNc2ncns2 27a_100011997539_100000693119 [0,0,0,0,0,1|2,0,1]=4 371 B16R2.3000 Cc1ccc(c(c1)Cl)CNc2nncs2 27a_100011997539_100000739804 [0,0,0,0,0,1|2,0,1]=4 372 B16R2.3000 Cc1ccc(c(c1)Cl)CSc2ncc[nH]2 62a_100012349684_100025796157 [0,0,0,0,0,1|1,0,2]=4 373 B16R2.3000 Cc1ccc(c(c1)Cl)CSc2ncc[nH]2 62a_100025796157_100012349684 [0,0,0,0,0,1|1,0,2]=4 374 B16R2.3000 Cc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100000210522_100000737910 [0,0,0,0,0,1|0,0,0]=1 375 B16R2.3000 Cc1ccc(c(c1)Cl)NCC2CCCC2 34a_100000210522_100000740388 [0,0,0,0,0,1|2,0,1]=4 376 B16R2.3000 Cc1ccc(c(c1)Cl)NCC2OCCO2 34a_100000210522_100000755774 [0,0,0,0,0,1|2,0,1]=4 377 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2c[nH]cn2 34a_100000210522_100000707719 [0,0,0,0,0,1|2,0,1]=4 378 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccn[nH]2 34a_100000210522_100000728653 [0,0,0,0,0,1|2,0,1]=4 379 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ccon2 34a_100000210522_100000234950 [0,0,0,0,0,1|2,0,1]=4 380 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cscn2 270302a_100000210522_100000743575 [0,0,0,0,0,1|2,0,1]=4 381 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2cscn2 34a_100000210522_100000205941 [0,0,0,0,0,1|2,0,1]=4 382 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000210522_100016991755 [0,0,0,0,0,1|0,0,2]=3 383 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncco2 34a_100000210522_103436540062 [0,0,0,0,0,1|1,0,2]=4 384 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2nccs2 270302a_100000210522_100000750902 [0,0,0,0,0,1|1,0,2]=4 385 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2nccs2 34a_100000210522_100015184050 [0,0,0,0,0,1|1,0,2]=4 386 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2ncon2 34a_100000210522_100000233494 [0,0,0,0,0,1|1,0,2]=4 387 B16R2.3000 Cc1ccc(c(c1)Cl)NCc2nnn[nH]2 34a_100000210522_100000765167 [0,0,0,0,0,1|2,0,0]=3 388 B16R2.3000 Cc1ccc(c(c1)Cl)NN=C2C=CCC2 4a_100000006747_100000239507 [0,0,0,0,0,1|2,0,1]=4 389 B16R2.3000 Cc1ccc(c(c1)Cl)NN=C2CCCC2 4a_100000006747_100000210133 [0,0,0,0,0,1|2,0,0]=3 390 B16R2.3000 Cc1ccc(c(c1)Cl)NN=C2CCOC2 4a_100000006747_100000752484 [0,0,0,0,0,1|3,0,0]=4 391 B16R2.3000 Cc1ccc(c(c1)Cl)NN=C2CCSC2 4a_100000006747_100000212027 [0,0,0,0,0,1|3,0,0]=4 392 B16R2.3000 Cc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100000749699_100000737910 [0,0,0,0,0,1|1,0,0]=2 393 B16R2.3000 Cc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100000749699_100000737910 [0,0,0,0,0,1|1,0,0]=2 394 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2ncc[nH]2 34a_100000749699_100016991755 [0,0,0,0,0,1|1,0,2]=4 395 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2ncc[nH]2 7a_100000749699_100000753453 [0,0,0,0,0,1|1,0,2]=4 396 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2nnn[nH]2 34a_100000749699_100000765167 [0,0,0,0,0,1|3,0,0]=4 397 B16R2.3000 Cc1ccc(c(c1)Cl)OCc2nnn[nH]2 7a_100000749699_100000765167 [0,0,0,0,0,1|3,0,0]=4 398 B16R2.3000 Cc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100011263221 [0,0,0,0,0,1|1,0,0]=2 399 B16R2.3000 Cc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100011263221_100000737910 [0,0,0,0,0,1|1,0,0]=2 400 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2ncc[nH]2 62a_100011263221_100016991755 [0,0,0,0,0,1|1,0,2]=4 401 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2ncc[nH]2 62a_100016991755_100011263221 [0,0,0,0,0,1|1,0,2]=4 402 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2nnn[nH]2 62a_100000765167_100011263221 [0,0,0,0,0,1|3,0,0]=4 403 B16R2.3000 Cc1ccc(c(c1)Cl)SCc2nnn[nH]2 62a_100011263221_100000765167 [0,0,0,0,0,1|3,0,0]=4 404 B16R2.3000 Cc1ccc(c(c1)F)NCC2=NCCN2 34a_100000211023_100000737910 [0,0,0,0,0,1|0,1,0]=2 405 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncc[nH]2 207a_100000211023_100000743867 [0,0,0,0,0,1|0,1,2]=4 406 B16R2.3000 Cc1ccc(c(c1)F)NCc2ncc[nH]2 34a_100000211023_100016991755 [0,0,0,0,0,1|0,1,2]=4 407 B16R2.3000 Cc1ccc(c(c1)F)NCc2nnn[nH]2 34a_100000211023_100000765167 [0,0,0,0,0,1|2,1,0]=4 408 B16R2.3000 Cc1ccc(c(c1)F)NN=C2CCCC2 4a_100000689694_100000210133 [0,0,0,0,0,1|2,1,0]=4 409 B16R2.3000 Cc1ccc(c(c1)F)OCC2=NCCN2 34a_100011216688_100000737910 [0,0,0,0,0,1|1,1,0]=3 410 B16R2.3000 Cc1ccc(c(c1)F)OCC2=NCCN2 7a_100011216688_100000737910 [0,0,0,0,0,1|1,1,0]=3 411 B16R2.3000 Cc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100011216119 [0,0,0,0,0,1|1,1,0]=3 412 B16R2.3000 Cc1ccc(c(c1)F)SCC2=NCCN2 62a_100011216119_100000737910 [0,0,0,0,0,1|1,1,0]=3 413 B16R2.3000 Cc1ccc(c(c1)I)NCC2=NCCN2 34a_100011356834_100000737910 [0,0,0,0,0,1|0,1,0]=2 414 B16R2.3000 Cc1ccc(c(c1)I)NCc2ncc[nH]2 34a_100011356834_100016991755 [0,0,0,0,0,1|0,1,2]=4 415 B16R2.3000 Cc1ccc(c(c1)I)NCc2nnn[nH]2 34a_100011356834_100000765167 [0,0,0,0,0,1|2,1,0]=4 416 B16R2.3000 Cc1ccc(c(c1)I)OCC2=NCCN2 34a_100000765521_100000737910 [0,0,0,0,0,1|1,1,0]=3 417 B16R2.3000 Cc1ccc(c(c1)I)OCC2=NCCN2 7a_100000765521_100000737910 [0,0,0,0,0,1|1,1,0]=3 418 B16R2.3000 Cc1ccc(c(c1)N)OCC2=NCCN2 34a_100011215204_100000737910 [0,0,0,0,0,1|2,0,0]=3 419 B16R2.3000 Cc1ccc(c(c1)N)OCC2=NCCN2 7a_100011215204_100000737910 [0,0,0,0,0,1|2,0,0]=3 420 B16R2.3000 Cc1ccc(c(c1)N)SCC2=NCCN2 62a_100000737910_100011216686 [0,0,0,0,0,1|2,0,0]=3 421 B16R2.3000 Cc1ccc(c(c1)N)SCC2=NCCN2 62a_100011216686_100000737910 [0,0,0,0,0,1|2,0,0]=3 422 B16R2.3000 Cc1ccc(c(c1)O)NCC2=NCCN2 34a_100000211527_100000737910 [0,0,0,0,0,1|1,0,0]=2 423 B16R2.3000 Cc1ccc(c(c1)O)NCc2ncc[nH]2 34a_100000211527_100016991755 [0,0,0,0,0,1|1,0,2]=4 424 B16R2.3000 Cc1ccc(c(c1)O)NCc2nnn[nH]2 34a_100000211527_100000765167 [0,0,0,0,0,1|3,0,0]=4 425 B16R2.3000 Cc1ccc(c(c1)O)SCC2=NCCN2 62a_100000737910_100012002257 [0,0,0,0,0,1|2,0,0]=3 426 B16R2.3000 Cc1ccc(c(c1)O)SCC2=NCCN2 62a_100012002257_100000737910 [0,0,0,0,0,1|2,0,0]=3 427 B16R2.3000 Cc1ccc(c(n1)Br)OCC2=NCCN2 34a_100000702858_100000737910 [0,0,0,0,0,1|2,1,0]=4 428 B16R2.3000 Cc1ccc(c(n1)Br)OCC2=NCCN2 7a_100000702858_100000737910 [0,0,0,0,0,1|2,1,0]=4 429 B16R2.3000 Cc1ccc(c(n1)C)OCC2=NCCN2 34a_100011218912_100000737910 [0,0,0,0,0,1|3,0,0]=4 430 B16R2.3000 Cc1ccc(c(n1)C)OCC2=NCCN2 7a_100011218912_100000737910 [0,0,0,0,0,1|3,0,0]=4 431 B16R2.3000 Cc1ccc(c(n1)C)SCC2=NCCN2 62a_100000737910_100009813853 [0,0,0,0,0,1|3,0,0]=4 432 B16R2.3000 Cc1ccc(c(n1)C)SCC2=NCCN2 62a_100009813853_100000737910 [0,0,0,0,0,1|3,0,0]=4 433 B16R2.3000 Cc1ccc(c(n1)Cl)OCC2=NCCN2 34a_100000086286_100000737910 [0,0,0,0,0,1|2,0,0]=3 434 B16R2.3000 Cc1ccc(c(n1)Cl)OCC2=NCCN2 7a_100000086286_100000737910 [0,0,0,0,0,1|2,0,0]=3 435 B16R2.3000 Cc1ccc(c(n1)F)OCC2=NCCN2 34a_100000079963_100000737910 [0,0,0,0,0,1|2,1,0]=4 436 B16R2.3000 Cc1ccc(c(n1)F)OCC2=NCCN2 7a_100000079963_100000737910 [0,0,0,0,0,1|2,1,0]=4 437 B16R2.3000 Cc1ccc(c(n1)F)SCC2=NCCN2 62a_100000737910_100010006597 [0,0,0,0,0,1|2,1,0]=4 438 B16R2.3000 Cc1ccc(c(n1)F)SCC2=NCCN2 62a_100010006597_100000737910 [0,0,0,0,0,1|2,1,0]=4 439 B16R2.3000 Cc1ccc(c(n1)I)OCC2=NCCN2 34a_100000023897_100000737910 [0,0,0,0,0,1|2,1,0]=4 440 B16R2.3000 Cc1ccc(c(n1)I)OCC2=NCCN2 7a_100000023897_100000737910 [0,0,0,0,0,1|2,1,0]=4 441 B16R2.3000 Cc1ccc(c(n1)N)OCC2=NCCN2 34a_100000694039_100000737910 [0,0,0,0,0,1|3,0,0]=4 442 B16R2.3000 Cc1ccc(c(n1)N)OCC2=NCCN2 7a_100000694039_100000737910 [0,0,0,0,0,1|3,0,0]=4 443 B16R2.3000 Cc1ccc(c(n1)N)SCC2=NCCN2 62a_100000737910_100009816662 [0,0,0,0,0,1|3,0,0]=4 444 B16R2.3000 Cc1ccc(c(n1)N)SCC2=NCCN2 62a_100009816662_100000737910 [0,0,0,0,0,1|3,0,0]=4 445 B16R2.3000 Cc1ccc(c(n1)O)SCC2=NCCN2 62a_100000737910_100009817604 [0,0,0,0,0,1|3,0,0]=4 446 B16R2.3000 Cc1ccc(c(n1)O)SCC2=NCCN2 62a_100009817604_100000737910 [0,0,0,0,0,1|3,0,0]=4 447 B16R2.3000 Cc1cnc(c(c1)Br)OCC2=NCCN2 34a_100000719714_100000737910 [0,0,0,0,0,1|2,1,0]=4 448 B16R2.3000 Cc1cnc(c(c1)C)SCC2=NCCN2 62a_100000737910_100009864548 [0,0,0,0,0,1|3,0,0]=4 449 B16R2.3000 Cc1cnc(c(c1)C)SCC2=NCCN2 62a_100009864548_100000737910 [0,0,0,0,0,1|3,0,0]=4 450 B16R2.3000 Cc1cnc(c(c1)F)SCC2=NCCN2 62a_100000737910_100009819633 [0,0,0,0,0,1|2,1,0]=4 451 B16R2.3000 Cc1cnc(c(c1)F)SCC2=NCCN2 62a_100009819633_100000737910 [0,0,0,0,0,1|2,1,0]=4 452 B16R2.3000 Cc1cnc(c(c1)N)OCC2=NCCN2 34a_100012000488_100000737910 [0,0,0,0,0,1|3,0,0]=4 453 B16R2.3000 Cc1cnc(c(c1)N)SCC2=NCCN2 62a_100000733613_100000737910 [0,0,0,0,0,1|3,0,0]=4 454 B16R2.3000 Cc1cnc(c(c1)N)SCC2=NCCN2 62a_100000737910_100000733613 [0,0,0,0,0,1|3,0,0]=4 455 B16R2.3000 Cc1cnc(c(c1)O)SCC2=NCCN2 62a_100000737910_100012000487 [0,0,0,0,0,1|3,0,0]=4 456 B16R2.3000 Clc1cc(c(cn1)OCC2=NCCN2)Cl 34a_100009868576_100000737910 [0,0,0,0,0,1|3,0,0]=4 457 B16R2.3000 Clc1cc(c(cn1)OCC2=NCCN2)Cl 7a_100009868576_100000737910 [0,0,0,0,0,1|3,0,0]=4 458 B16R2.3000 Clc1cc(c(cn1)SCC2=NCCN2)Cl 62a_100000737910_100010200927 [0,0,0,0,0,1|3,0,0]=4 459 B16R2.3000 Clc1cc(c(cn1)SCC2=NCCN2)Cl 62a_100010200927_100000737910 [0,0,0,0,0,1|3,0,0]=4 460 B16R2.3000 Clc1cc(ccc1NCC2=NCCN2)Br 34a_100000211467_100000737910 [0,0,0,0,0,1|1,0,0]=2 461 B16R2.3000 Clc1cc(ccc1NCC2=NCCN2)I 34a_100011218065_100000737910 [0,0,0,0,0,1|1,0,0]=2 462 B16R2.3000 Clc1cc(ccc1NCc2ncc[nH]2)Br 34a_100000211467_100016991755 [0,0,0,0,0,1|1,0,2]=4 463 B16R2.3000 Clc1cc(ccc1NCc2ncc[nH]2)I 34a_100011218065_100016991755 [0,0,0,0,0,1|1,0,2]=4 464 B16R2.3000 Clc1cc(ccc1NCc2nnn[nH]2)Br 34a_100000211467_100000765167 [0,0,0,0,0,1|3,0,0]=4 465 B16R2.3000 Clc1cc(ccc1NCc2nnn[nH]2)I 34a_100011218065_100000765167 [0,0,0,0,0,1|3,0,0]=4 466 B16R2.3000 Clc1cc(ccc1NN=C2CCCC2)Br 4a_100000751498_100000210133 [0,0,0,0,0,1|3,0,0]=4 467 B16R2.3000 Clc1cc(ccc1OCC2=NCCN2)Br 34a_100000186472_100000737910 [0,0,0,0,0,1|2,0,0]=3 468 B16R2.3000 Clc1cc(ccc1OCC2=NCCN2)Br 7a_100000186472_100000737910 [0,0,0,0,0,1|2,0,0]=3 469 B16R2.3000 Clc1cc(ccc1OCC2=NCCN2)I 34a_100012360047_100000737910 [0,0,0,0,0,1|2,0,0]=3 470 B16R2.3000 Clc1cc(ccc1OCC2=NCCN2)I 7a_100012360047_100000737910 [0,0,0,0,0,1|2,0,0]=3 471 B16R2.3000 Clc1cc(ccc1SCC2=NCCN2)Br 62a_100000737910_100011216062 [0,0,0,0,0,1|2,0,0]=3 472 B16R2.3000 Clc1cc(ccc1SCC2=NCCN2)Br 62a_100011216062_100000737910 [0,0,0,0,0,1|2,0,0]=3 473 B16R2.3000 Clc1cc(cnc1OCC2=NCCN2)Br 34a_100012339560_100000737910 [0,0,0,0,0,1|3,0,0]=4 474 B16R2.3000 Clc1cc(ncc1SCC2=NCCN2)Br 62a_100000737910_100010381092 [0,0,0,0,0,1|3,0,0]=4 475 B16R2.3000 Clc1cc(ncc1SCC2=NCCN2)Br 62a_100010381092_100000737910 [0,0,0,0,0,1|3,0,0]=4 476 B16R2.3000 Clc1ccc(c(c1)Br)NCC2=NCCN2 34a_100000752454_100000737910 [0,0,0,0,0,1|1,1,0]=3 477 B16R2.3000 Clc1ccc(c(c1)Br)OCC2=NCCN2 34a_100000211998_100000737910 [0,0,0,0,0,1|2,1,0]=4 478 B16R2.3000 Clc1ccc(c(c1)Br)OCC2=NCCN2 7a_100000211998_100000737910 [0,0,0,0,0,1|2,1,0]=4 479 B16R2.3000 Clc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100011219703 [0,0,0,0,0,1|2,1,0]=4 480 B16R2.3000 Clc1ccc(c(c1)Br)SCC2=NCCN2 62a_100011219703_100000737910 [0,0,0,0,0,1|2,1,0]=4 481 B16R2.3000 Clc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100000185861_100000737910 [0,0,0,0,0,1|1,0,0]=2 482 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000185861_100016991755 [0,0,0,0,0,1|1,0,2]=4 483 B16R2.3000 Clc1ccc(c(c1)Cl)NCc2nnn[nH]2 34a_100000185861_100000765167 [0,0,0,0,0,1|3,0,0]=4 484 B16R2.3000 Clc1ccc(c(c1)Cl)NN=C2CCCC2 4a_100000717958_100000210133 [0,0,0,0,0,1|3,0,0]=4 485 B16R2.3000 Clc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100015191787_100000737910 [0,0,0,0,0,1|2,0,0]=3 486 B16R2.3000 Clc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100015191787_100000737910 [0,0,0,0,0,1|2,0,0]=3 487 B16R2.3000 Clc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000699841_100000737910 [0,0,0,0,0,1|2,0,0]=3 488 B16R2.3000 Clc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100000699841 [0,0,0,0,0,1|2,0,0]=3 489 B16R2.3000 Clc1ccc(c(c1)I)NCC2=NCCN2 34a_100000761889_100000737910 [0,0,0,0,0,1|1,1,0]=3 490 B16R2.3000 Clc1ccc(c(c1)I)OCC2=NCCN2 34a_100011356953_100000737910 [0,0,0,0,0,1|2,1,0]=4 491 B16R2.3000 Clc1ccc(c(c1)I)OCC2=NCCN2 7a_100011356953_100000737910 [0,0,0,0,0,1|2,1,0]=4 492 B16R2.3000 Clc1ccc(c(n1)Cl)OCC2=NCCN2 34a_100000101165_100000737910 [0,0,0,0,0,1|3,0,0]=4 493 B16R2.3000 Clc1ccc(c(n1)Cl)OCC2=NCCN2 7a_100000101165_100000737910 [0,0,0,0,0,1|3,0,0]=4 494 B16R2.3000 Clc1ccc(c(n1)Cl)SCC2=NCCN2 62a_100000737910_100000043682 [0,0,0,0,0,1|3,0,0]=4 495 B16R2.3000 Clc1nc(ccc1OCC2=NCCN2)Br 34a_100010246206_100000737910 [0,0,0,0,0,1|3,0,0]=4 496 B16R2.3000 Clc1nc(ccc1OCC2=NCCN2)Br 7a_100010246206_100000737910 [0,0,0,0,0,1|3,0,0]=4 497 B16R2.3000 Clc1nc(ccc1OCC2=NCCN2)I 34a_100000721234_100000737910 [0,0,0,0,0,1|3,0,0]=4 498 B16R2.3000 Clc1nc(ccc1OCC2=NCCN2)I 7a_100000721234_100000737910 [0,0,0,0,0,1|3,0,0]=4 499 B16R2.3000 Clc1nc(ccc1SCC2=NCCN2)Br 62a_100000737910_100010246183 [0,0,0,0,0,1|3,0,0]=4 500 B16R2.3000 Clc1nc(ccc1SCC2=NCCN2)Br 62a_100010246183_100000737910 [0,0,0,0,0,1|3,0,0]=4 501 B16R2.3000 Fc1cc(ccc1NCC2=NCCN2)Br 34a_100000210722_100000737910 [0,0,0,0,0,1|1,1,0]=3 502 B16R2.3000 Fc1cc(ccc1NCC2=NCCN2)Cl 34a_100000211020_100000737910 [0,0,0,0,0,1|1,1,0]=3 503 B16R2.3000 Fc1cc(ccc1NCC2=NCCN2)I 34a_100011215594_100000737910 [0,0,0,0,0,1|1,1,0]=3 504 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)Br 34a_100000185481_100000737910 [0,0,0,0,0,1|2,1,0]=4 505 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)Br 7a_100000185481_100000737910 [0,0,0,0,0,1|2,1,0]=4 506 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)Cl 34a_100000230166_100000737910 [0,0,0,0,0,1|2,1,0]=4 507 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)Cl 7a_100000230166_100000737910 [0,0,0,0,0,1|2,1,0]=4 508 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)I 34a_100011356965_100000737910 [0,0,0,0,0,1|2,1,0]=4 509 B16R2.3000 Fc1cc(ccc1OCC2=NCCN2)I 7a_100011356965_100000737910 [0,0,0,0,0,1|2,1,0]=4 510 B16R2.3000 Fc1cc(ccc1SCC2=NCCN2)Br 62a_100000737910_100009814013 [0,0,0,0,0,1|2,1,0]=4 511 B16R2.3000 Fc1cc(ccc1SCC2=NCCN2)Br 62a_100009814013_100000737910 [0,0,0,0,0,1|2,1,0]=4 512 B16R2.3000 Fc1cc(ccc1SCC2=NCCN2)Cl 62a_100000737910_100011216042 [0,0,0,0,0,1|2,1,0]=4 513 B16R2.3000 Fc1cc(ccc1SCC2=NCCN2)Cl 62a_100011216042_100000737910 [0,0,0,0,0,1|2,1,0]=4 514 B16R2.3000 Fc1ccc(c(c1)Br)NCC2=NCCN2 34a_100000738039_100000737910 [0,0,0,0,0,1|1,1,0]=3 515 B16R2.3000 Fc1ccc(c(c1)Br)OCC2=NCCN2 34a_100000211999_100000737910 [0,0,0,0,0,1|2,1,0]=4 516 B16R2.3000 Fc1ccc(c(c1)Br)OCC2=NCCN2 7a_100000211999_100000737910 [0,0,0,0,0,1|2,1,0]=4 517 B16R2.3000 Fc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100011217111 [0,0,0,0,0,1|2,1,0]=4 518 B16R2.3000 Fc1ccc(c(c1)Br)SCC2=NCCN2 62a_100011217111_100000737910 [0,0,0,0,0,1|2,1,0]=4 519 B16R2.3000 Fc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100000212003_100000737910 [0,0,0,0,0,1|1,0,0]=2 520 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000212003_100016991755 [0,0,0,0,0,1|1,0,2]=4 521 B16R2.3000 Fc1ccc(c(c1)Cl)NCc2nnn[nH]2 34a_100000212003_100000765167 [0,0,0,0,0,1|3,0,0]=4 522 B16R2.3000 Fc1ccc(c(c1)Cl)NN=C2CCCC2 4a_100016987656_100000210133 [0,0,0,0,0,1|3,0,0]=4 523 B16R2.3000 Fc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100000212004_100000737910 [0,0,0,0,0,1|2,0,0]=3 524 B16R2.3000 Fc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100000212004_100000737910 [0,0,0,0,0,1|2,0,0]=3 525 B16R2.3000 Fc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000733362_100000737910 [0,0,0,0,0,1|2,0,0]=3 526 B16R2.3000 Fc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100000733362 [0,0,0,0,0,1|2,0,0]=3 527 B16R2.3000 Fc1ccc(c(c1)F)NCC2=NCCN2 34a_100000210720_100000737910 [0,0,0,0,0,1|1,1,0]=3 528 B16R2.3000 Fc1ccc(c(c1)F)OCC2=NCCN2 34a_100000230127_100000737910 [0,0,0,0,0,1|2,1,0]=4 529 B16R2.3000 Fc1ccc(c(c1)F)OCC2=NCCN2 7a_100000230127_100000737910 [0,0,0,0,0,1|2,1,0]=4 530 B16R2.3000 Fc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100000750030 [0,0,0,0,0,1|2,1,0]=4 531 B16R2.3000 Fc1ccc(c(c1)F)SCC2=NCCN2 62a_100000750030_100000737910 [0,0,0,0,0,1|2,1,0]=4 532 B16R2.3000 Fc1ccc(c(c1)I)NCC2=NCCN2 34a_100000760547_100000737910 [0,0,0,0,0,1|1,1,0]=3 533 B16R2.3000 Fc1ccc(c(c1)I)OCC2=NCCN2 34a_100012355409_100000737910 [0,0,0,0,0,1|2,1,0]=4 534 B16R2.3000 Fc1ccc(c(c1)I)OCC2=NCCN2 7a_100012355409_100000737910 [0,0,0,0,0,1|2,1,0]=4 535 B16R2.3000 Fc1cnc(c(c1)Cl)OCC2=NCCN2 34a_100009847679_100000737910 [0,0,0,0,0,1|3,0,0]=4 536 B16R2.3000 Ic1ccc(c(c1)I)OCC2=NCCN2 7a_100010001573_100000737910 [0,0,0,0,0,1|2,1,0]=4 537 B16R2.3000 Nc1cc(c(cn1)SCC2=NCCN2)Cl 62a_100000694920_100000737910 [0,0,0,0,0,1|3,0,0]=4 538 B16R2.3000 Nc1cc(c(cn1)SCC2=NCCN2)Cl 62a_100000737910_100000694920 [0,0,0,0,0,1|3,0,0]=4 539 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)Br 34a_100000752626_100000737910 [0,0,0,0,0,1|3,0,0]=4 540 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)Br 7a_100000752626_100000737910 [0,0,0,0,0,1|3,0,0]=4 541 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)Cl 34a_100000210500_100000737910 [0,0,0,0,0,1|3,0,0]=4 542 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)Cl 7a_100000210500_100000737910 [0,0,0,0,0,1|3,0,0]=4 543 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)F 34a_100000759472_100000737910 [0,0,0,0,0,1|3,0,0]=4 544 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)F 7a_100000759472_100000737910 [0,0,0,0,0,1|3,0,0]=4 545 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)I 34a_100000753495_100000737910 [0,0,0,0,0,1|3,0,0]=4 546 B16R2.3000 Nc1cc(ccc1OCC2=NCCN2)I 7a_100000753495_100000737910 [0,0,0,0,0,1|3,0,0]=4 547 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)Br 62a_100000737910_100000743836 [0,0,0,0,0,1|3,0,0]=4 548 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)Br 62a_100000743836_100000737910 [0,0,0,0,0,1|3,0,0]=4 549 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)Cl 62a_100000737910_100000761886 [0,0,0,0,0,1|3,0,0]=4 550 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)Cl 62a_100000761886_100000737910 [0,0,0,0,0,1|3,0,0]=4 551 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)F 62a_100000687223_100000737910 [0,0,0,0,0,1|3,0,0]=4 552 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)F 62a_100000737910_100000687223 [0,0,0,0,0,1|3,0,0]=4 553 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)O 62a_100000737910_100011999798 [0,0,0,0,0,1|3,0,0]=4 554 B16R2.3000 Nc1cc(ccc1SCC2=NCCN2)O 62a_100011999798_100000737910 [0,0,0,0,0,1|3,0,0]=4 555 B16R2.3000 Nc1ccc(c(c1)Br)OCC2=NCCN2 34a_100011534360_100000737910 [0,0,0,0,0,1|2,1,0]=4 556 B16R2.3000 Nc1ccc(c(c1)Br)OCC2=NCCN2 7a_100011534360_100000737910 [0,0,0,0,0,1|2,1,0]=4 557 B16R2.3000 Nc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100000750458 [0,0,0,0,0,1|2,1,0]=4 558 B16R2.3000 Nc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000750458_100000737910 [0,0,0,0,0,1|2,1,0]=4 559 B16R2.3000 Nc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100000744943_100000737910 [0,0,0,0,0,1|2,0,0]=3 560 B16R2.3000 Nc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100000744943_100000737910 [0,0,0,0,0,1|2,0,0]=3 561 B16R2.3000 Nc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100000761885 [0,0,0,0,0,1|2,0,0]=3 562 B16R2.3000 Nc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000761885_100000737910 [0,0,0,0,0,1|2,0,0]=3 563 B16R2.3000 Nc1ccc(c(c1)F)OCC2=NCCN2 34a_100011220035_100000737910 [0,0,0,0,0,1|2,1,0]=4 564 B16R2.3000 Nc1ccc(c(c1)F)OCC2=NCCN2 7a_100011220035_100000737910 [0,0,0,0,0,1|2,1,0]=4 565 B16R2.3000 Nc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100011356925 [0,0,0,0,0,1|2,1,0]=4 566 B16R2.3000 Nc1ccc(c(c1)F)SCC2=NCCN2 62a_100011356925_100000737910 [0,0,0,0,0,1|2,1,0]=4 567 B16R2.3000 Nc1ccc(c(c1)N)OCC2=NCCN2 34a_100000725306_100000737910 [0,0,0,0,0,1|3,0,0]=4 568 B16R2.3000 Nc1ccc(c(c1)N)SCC2=NCCN2 62a_100000737910_200012175722 [0,0,0,0,0,1|3,0,0]=4 569 B16R2.3000 Nc1ccc(c(c1)N)SCC2=NCCN2 62a_200012175722_100000737910 [0,0,0,0,0,1|3,0,0]=4 570 B16R2.3000 Nc1ccc(c(n1)Cl)SCC2=NCCN2 62a_100000737910_100010270343 [0,0,0,0,0,1|3,0,0]=4 571 B16R2.3000 Nc1ccc(c(n1)Cl)SCC2=NCCN2 62a_100010270343_100000737910 [0,0,0,0,0,1|3,0,0]=4 572 B16R2.3000 Oc1cc(ccc1NCC2=NCCN2)Br 34a_100000739049_100000737910 [0,0,0,0,0,1|2,0,0]=3 573 B16R2.3000 Oc1cc(ccc1NCC2=NCCN2)Cl 34a_100000185728_100000737910 [0,0,0,0,0,1|2,0,0]=3 574 B16R2.3000 Oc1cc(ccc1NCC2=NCCN2)F 34a_100000753323_100000737910 [0,0,0,0,0,1|2,0,0]=3 575 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)Br 62a_100000737910_100012344904 [0,0,0,0,0,1|3,0,0]=4 576 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)Br 62a_100012344904_100000737910 [0,0,0,0,0,1|3,0,0]=4 577 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)Cl 62a_100000050036_100000737910 [0,0,0,0,0,1|3,0,0]=4 578 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)Cl 62a_100000737910_100000050036 [0,0,0,0,0,1|3,0,0]=4 579 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)F 62a_100000690578_100000737910 [0,0,0,0,0,1|3,0,0]=4 580 B16R2.3000 Oc1cc(ccc1SCC2=NCCN2)F 62a_100000737910_100000690578 [0,0,0,0,0,1|3,0,0]=4 581 B16R2.3000 Oc1ccc(c(c1)Br)NCC2=NCCN2 34a_100012001276_100000737910 [0,0,0,0,0,1|1,1,0]=3 582 B16R2.3000 Oc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000701344_100000737910 [0,0,0,0,0,1|2,1,0]=4 583 B16R2.3000 Oc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100000701344 [0,0,0,0,0,1|2,1,0]=4 584 B16R2.3000 Oc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100011215599_100000737910 [0,0,0,0,0,1|1,0,0]=2 585 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100011215599_100016991755 [0,0,0,0,0,1|1,0,2]=4 586 B16R2.3000 Oc1ccc(c(c1)Cl)NCc2nnn[nH]2 34a_100011215599_100000765167 [0,0,0,0,0,1|3,0,0]=4 587 B16R2.3000 Oc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000047559_100000737910 [0,0,0,0,0,1|2,0,0]=3 588 B16R2.3000 Oc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100000047559 [0,0,0,0,0,1|2,0,0]=3 589 B16R2.3000 Oc1ccc(c(c1)F)NCC2=NCCN2 34a_100000759473_100000737910 [0,0,0,0,0,1|1,1,0]=3 590 B16R2.3000 Oc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100000755031 [0,0,0,0,0,1|2,1,0]=4 591 B16R2.3000 Oc1ccc(c(c1)F)SCC2=NCCN2 62a_100000755031_100000737910 [0,0,0,0,0,1|2,1,0]=4 592 B16R2.3000 Oc1ccc(c(c1)I)NCC2=NCCN2 34a_100010084370_100000737910 [0,0,0,0,0,1|1,1,0]=3 593 B16R2.3000 Oc1ccc(c(c1)O)NCC2=NCCN2 34a_100000106777_100000737910 [0,0,0,0,0,1|2,0,0]=3 594 B16R2.3000 Oc1ccc(c(c1)O)SCC2=NCCN2 62a_100000737910_100009813921 [0,0,0,0,0,1|3,0,0]=4 595 B13R1.369 CCC=NNc1ccc(cc1Cl)C 4a_100000006747_100000210100 [1,0,1,0,0,0|1,0,1]=4 596 B13R1.369 CCCC=Cc1ccc(cc1Cl)C 271570a_100016258520_100011263221 [1,0,1,0,0,0|2,0,0]=4 597 B13R1.369 CCCCNc1ccc(cc1Cl)C 34a_100000210522_100000210210 [1,0,1,0,0,0|1,0,1]=4 598 B13R1.369 CCCNCc1ccc(cc1Cl)C 207a_100020643023_100011935181 [1,0,1,0,0,0|1,0,1]=4 599 B13R1.369 CCCNCc1ccc(cc1Cl)C 270004a_100020643023_100011935181 [1,0,1,0,0,0|1,0,1]=4 600 B13R1.369 CCCNCc1ccc(cc1Cl)C 34a_100011997539_100000210303 [1,0,1,0,0,0|1,0,1]=4 601 B13R1.369 CCNN=Cc1ccc(cc1Cl)C 4a_100000756455_100011935181 [1,0,1,0,0,0|2,0,0]=4 602 B13R1.369 CCOC=Cc1ccc(cc1Cl)C 271570a_100016256518_100011263221 [1,0,1,0,0,0|2,0,0]=4 603 B13R1.369 Cc1ccc(c(c1)Cl)CNCCF 34a_100000724931_100012349684 [1,0,1,0,0,0|1,0,1]=4 604 B13R1.369 Cc1ccc(c(c1)Cl)CNCCF 34a_100011997539_100011217306 [1,0,1,0,0,0|1,0,1]=4 605 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 207a_100000210304_100011935181 [1,0,1,0,0,0|1,0,1]=4 606 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 2230a_100016997473_100012349684 [1,0,1,0,0,0|1,0,1]=4 607 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 270004a_100000210304_100011935181 [1,0,1,0,0,0|1,0,1]=4 608 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 34a_100011997539_100000211926 [1,0,1,0,0,0|1,0,1]=4 609 B13R1.369 Cc1ccc(c(c1)Cl)CNCCO 34a_100016990907_100012349684 [1,0,1,0,0,0|1,0,1]=4 610 B13R1.369 Cc1ccc(c(c1)Cl)COCCN 34a_100000210304_100012349684 [1,0,1,0,0,0|1,0,1]=4 611 B13R1.369 Cc1ccc(c(c1)Cl)NCCCF 34a_100000210522_100011934791 [1,0,1,0,0,0|1,0,1]=4 612 B13R1.369 Cc1ccc(c(c1)Cl)NCCCO 34a_100000210522_100000230001 [1,0,1,0,0,0|1,0,1]=4 613 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000211992 [1,0,1,0,0,0|2,0,0]=4 614 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000211992 [1,0,1,0,0,0|2,0,0]=4 615 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000211992 [1,0,1,0,0,0|2,0,0]=4 616 B13R1.19 CCCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000211992 [1,0,1,0,0,0|2,0,0]=4 617 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 11a_100015525214_100000212244 [1,0,1,0,0,0|2,0,0]=4 618 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 240690a_100015525214_100000212244 [1,0,1,0,0,0|2,0,0]=4 619 B13R1.19 CCNC(=O)Cc1ccc(cc1)C 527a_100015525214_100000212244 [1,0,1,0,0,0|2,0,0]=4 620 B13R1.19 CCNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100015525214 [1,0,1,0,0,0|2,0,0]=4 621 B13R1.19 CCNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100015525214 [1,0,1,0,0,0|1,0,0]=3 622 B13R1.19 CCNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100015525214 [1,0,1,0,0,0|2,0,0]=4 623 B13R1.19 CCNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100015525214 [1,0,1,0,0,0|2,0,0]=4 624 B13R1.19 CCNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100015525214 [1,0,1,0,0,0|2,0,0]=4 625 B13R1.19 CCNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100015525214 [1,0,1,0,0,0|2,0,0]=4 626 B13R1.470 CCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211992 [1,0,1,0,0,0|2,0,0]=4 627 B13R1.470 CCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211992 [1,0,1,0,0,0|2,0,0]=4 628 B13R1.470 CCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211992 [1,0,1,0,0,0|2,0,0]=4 629 B13R1.470 CCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211992 [1,0,1,0,0,0|2,0,0]=4 630 B13R1.470 CCNC(=O)Cc1ccccc1Cl 11a_100015525214_100000183793 [1,0,1,0,0,0|2,0,0]=4 631 B13R1.470 CCNC(=O)Cc1ccccc1Cl 240690a_100015525214_100000183793 [1,0,1,0,0,0|2,0,0]=4 632 B13R1.470 CCNC(=O)Cc1ccccc1Cl 527a_100015525214_100000183793 [1,0,1,0,0,0|2,0,0]=4 633 B13R1.470 CCNC(=O)Nc1ccccc1Br 2430a_100000210017_100015525214 [1,0,1,0,0,0|1,1,0]=4 634 B13R1.470 CCNC(=O)Nc1ccccc1C 2430a_100015192222_100015525214 [1,0,1,0,0,0|2,0,0]=4 635 B13R1.470 CCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100015525214 [1,0,1,0,0,0|1,0,0]=3 636 B13R1.470 CCNC(=O)Nc1ccccc1F 2430a_100000210422_100015525214 [1,0,1,0,0,0|1,1,0]=4 637 B13R1.470 CCNC(=O)Nc1ccccc1I 2430a_100000210053_100015525214 [1,0,1,0,0,0|1,1,0]=4 638 B13R1.470 CCNC(=O)Nc1ccccc1O 2430a_100000185747_100015525214 [1,0,1,0,0,0|2,0,0]=4 639 B13R1.2679 CCC(=O)Cc1ccc(cc1Cl)C 1458a_100000210414_100012349684 [1,0,1,0,0,0|2,0,0]=4 640 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100000210414 [1,0,1,0,0,0|1,1,0]=4 641 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100000210414 [1,0,1,0,0,0|1,1,0]=4 642 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 11a_100000736561_100000210414 [1,0,1,0,0,0|2,0,0]=4 643 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100000210414 [1,0,1,0,0,0|2,0,0]=4 644 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000210414 [1,0,1,0,0,0|2,0,0]=4 645 B13R1.2679 CCC(=O)Nc1ccc(cc1C)C 527a_100000736561_100000210414 [1,0,1,0,0,0|2,0,0]=4 646 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100000210414 [1,0,1,0,0,0|2,0,0]=4 647 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100000210414 [1,0,1,0,0,0|2,0,0]=4 648 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210414 [1,0,1,0,0,0|1,0,0]=3 649 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210414 [1,0,1,0,0,0|1,0,0]=3 650 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210414 [1,0,1,0,0,0|1,0,0]=3 651 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100000210414 [1,0,1,0,0,0|2,0,0]=4 652 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100000210414 [1,0,1,0,0,0|2,0,0]=4 653 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000210414 [1,0,1,0,0,0|2,0,0]=4 654 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100000210414 [1,0,1,0,0,0|2,0,0]=4 655 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100000210414 [1,0,1,0,0,0|2,0,0]=4 656 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000210414 [1,0,1,0,0,0|2,0,0]=4 657 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100000210414 [1,0,1,0,0,0|2,0,0]=4 658 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100000210414 [1,0,1,0,0,0|2,0,0]=4 659 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000210414 [1,0,1,0,0,0|2,0,0]=4 660 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000210414 [1,0,1,0,0,0|2,0,0]=4 661 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100000210414 [1,0,1,0,0,0|2,0,0]=4 662 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 11a_100000211023_100000210414 [1,0,1,0,0,0|1,1,0]=4 663 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100000210414 [1,0,1,0,0,0|1,1,0]=4 664 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000210414 [1,0,1,0,0,0|1,1,0]=4 665 B13R1.2679 CCC(=O)Nc1ccc(cc1F)C 527a_100000211023_100000210414 [1,0,1,0,0,0|1,1,0]=4 666 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 11a_100011356834_100000210414 [1,0,1,0,0,0|1,1,0]=4 667 B13R1.2679 CCC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100000210414 [1,0,1,0,0,0|1,1,0]=4 668 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000210414 [1,0,1,0,0,0|2,0,0]=4 669 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152038 [1,0,1,0,0,0|2,0,0]=4 670 B13R1.2679 CCC(=O)Nc1ccc(cc1O)C 527a_100000211527_100000210414 [1,0,1,0,0,0|2,0,0]=4 671 B13R1.2679 CCC(C)Nc1ccc(cc1Cl)C 34a_100000210522_100011215416 [1,0,1,0,0,0|1,0,1]=4 672 B13R1.2679 CNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100102657272 [1,0,1,0,0,0|1,1,0]=4 673 B13R1.2679 CNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100102657272 [1,0,1,0,0,0|2,0,0]=4 674 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100102657272 [1,0,1,0,0,0|2,0,0]=4 675 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100102657272 [1,0,1,0,0,0|1,0,0]=3 676 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100102657272 [1,0,1,0,0,0|2,0,0]=4 677 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100102657272 [1,0,1,0,0,0|2,0,0]=4 678 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100102657272 [1,0,1,0,0,0|2,0,0]=4 679 B13R1.2679 CNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100102657272 [1,0,1,0,0,0|2,0,0]=4 680 B13R1.2679 CNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100102657272 [1,0,1,0,0,0|1,1,0]=4 681 B13R1.2679 CNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100102657272 [1,0,1,0,0,0|1,1,0]=4 682 B13R1.2679 CNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100102657272 [1,0,1,0,0,0|2,0,0]=4 683 B13R1.2679 Cc1ccc(c(c1)Cl)NC(=O)CO 22a_100000210522_100000210174 [1,0,1,0,0,0|2,0,0]=4 684 B15R1.1176 CCCCC=NNc1ccc(cc1Cl)C 4a_100000006747_100000210104 [0,1,1,0,0,0|2,0,0]=4 685 B15R1.5927 C#CCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100000212058 [0,1,1,0,0,0|1,0,1]=4 686 B15R1.5927 C=CCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100020586998 [0,1,1,0,0,0|1,0,1]=4 687 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100000210183 [0,1,1,0,0,0|2,0,0]=4 688 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100000210183 [0,1,1,0,0,0|2,0,0]=4 689 B15R1.5927 CCCCC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000210183 [0,1,1,0,0,0|2,0,0]=4 690 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100020643023 [0,1,1,0,0,0|1,1,0]=4 691 B15R1.5927 CCCNC(=O)Nc1ccc(cc1C)C 2430a_100000736561_100020643023 [0,1,1,0,0,0|2,0,0]=4 692 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100020643023 [0,1,1,0,0,0|2,0,0]=4 693 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100020643023 [0,1,1,0,0,0|1,0,0]=3 694 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100020643023 [0,1,1,0,0,0|2,0,0]=4 695 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100020643023 [0,1,1,0,0,0|2,0,0]=4 696 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100020643023 [0,1,1,0,0,0|2,0,0]=4 697 B15R1.5927 CCCNC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100020643023 [0,1,1,0,0,0|2,0,0]=4 698 B15R1.5927 CCCNC(=O)Nc1ccc(cc1F)C 2430a_100000211023_100020643023 [0,1,1,0,0,0|1,1,0]=4 699 B15R1.5927 CCCNC(=O)Nc1ccc(cc1I)C 2430a_100011356834_100020643023 [0,1,1,0,0,0|1,1,0]=4 700 B15R1.5927 CCCNC(=O)Nc1ccc(cc1O)C 2430a_100000211527_100020643023 [0,1,1,0,0,0|2,0,0]=4 701 B15R1.5927 Cc1ccc(c(c1)Br)NC(=O)NCCF 2430a_100000210942_100000724931 [0,1,1,0,0,0|1,1,0]=4 702 B15R1.5927 Cc1ccc(c(c1)Br)NC(=O)NCCO 2430a_100000210942_100000210304 [0,1,1,0,0,0|1,1,0]=4 703 B15R1.5927 Cc1ccc(c(c1)C)NC(=O)NCCF 2430a_100000736561_100000724931 [0,1,1,0,0,0|2,0,0]=4 704 B15R1.5927 Cc1ccc(c(c1)C)NC(=O)NCCO 2430a_100000736561_100000210304 [0,1,1,0,0,0|2,0,0]=4 705 B15R1.5927 Cc1ccc(c(c1)Cl)NC(=O)NCC#N 2430a_100000210522_100000734998 [0,1,1,0,0,0|0,0,2]=4 706 B15R1.5927 Cc1ccc(c(c1)Cl)NC(=O)NCCF 2430a_100000210522_100000724931 [0,1,1,0,0,0|1,0,0]=3 707 B15R1.5927 Cc1ccc(c(c1)Cl)NC(=O)NCCO 2430a_100000210522_100000210304 [0,1,1,0,0,0|1,0,0]=3 708 B15R1.5927 Cc1ccc(c(c1)F)NC(=O)NCCF 2430a_100000211023_100000724931 [0,1,1,0,0,0|1,1,0]=4 709 B15R1.5927 Cc1ccc(c(c1)F)NC(=O)NCCO 2430a_100000211023_100000210304 [0,1,1,0,0,0|1,1,0]=4 710 B15R1.5927 Cc1ccc(c(c1)I)NC(=O)NCCF 2430a_100011356834_100000724931 [0,1,1,0,0,0|1,1,0]=4 711 B15R1.5927 Cc1ccc(c(c1)I)NC(=O)NCCO 2430a_100011356834_100000210304 [0,1,1,0,0,0|1,1,0]=4 712 B15R1.5927 Cc1ccc(c(c1)O)NC(=O)NCCF 2430a_100000211527_100000724931 [0,1,1,0,0,0|2,0,0]=4 713 B15R1.5927 Cc1ccc(c(c1)O)NC(=O)NCCO 2430a_100000211527_100000210304 [0,1,1,0,0,0|2,0,0]=4 714 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000724931 [0,1,1,0,0,0|2,0,0]=4 715 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000724931 [0,1,1,0,0,0|2,0,0]=4 716 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)F 2430a_100000212003_100000724931 [0,1,1,0,0,0|2,0,0]=4 717 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)I 2430a_100011218065_100000724931 [0,1,1,0,0,0|2,0,0]=4 718 B15R1.5927 O=C(NCCF)Nc1ccc(cc1Cl)O 2430a_100011215599_100000724931 [0,1,1,0,0,0|2,0,0]=4 719 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000210304 [0,1,1,0,0,0|2,0,0]=4 720 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000210304 [0,1,1,0,0,0|2,0,0]=4 721 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)F 2430a_100000212003_100000210304 [0,1,1,0,0,0|2,0,0]=4 722 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)I 2430a_100011218065_100000210304 [0,1,1,0,0,0|2,0,0]=4 723 B15R1.5927 O=C(NCCO)Nc1ccc(cc1Cl)O 2430a_100011215599_100000210304 [0,1,1,0,0,0|2,0,0]=4 724 B15R1.2548 CCCC(=O)Nc1cc(c(cc1Cl)C)C 11a_100012183282_100000211992 [0,1,1,0,0,0|2,0,0]=4 725 B15R1.2548 CCCC(=O)Nc1cc(c(cc1Cl)C)C 1626a_100012183282_100000211992 [0,1,1,0,0,0|2,0,0]=4 726 B15R1.2548 CCCC(=O)Nc1cc(c(cc1Cl)C)C 22a_100012183282_100000211992 [0,1,1,0,0,0|2,0,0]=4 727 B15R1.2548 CCCC(=O)Nc1cc(c(cc1Cl)C)O 22a_100000092876_100000211992 [0,1,1,0,0,0|2,0,0]=4 728 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Br)C)Br 2430a_100012348304_100015525214 [0,1,1,0,0,0|1,1,0]=4 729 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Br)C)C 2430a_100012337760_100015525214 [0,1,1,0,0,0|1,1,0]=4 730 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Br)C)Cl 2430a_100000702286_100015525214 [0,1,1,0,0,0|1,1,0]=4 731 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Br)C)F 2430a_100011218008_100015525214 [0,1,1,0,0,0|1,1,0]=4 732 B15R1.2548 CCNC(=O)Nc1cc(c(cc1C)C)Br 2430a_100000703630_100015525214 [0,1,1,0,0,0|2,0,0]=4 733 B15R1.2548 CCNC(=O)Nc1cc(c(cc1C)C)C 2430a_100011217141_100015525214 [0,1,1,0,0,0|2,0,0]=4 734 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Br)F 2430a_100000688864_100015525214 [0,1,1,0,0,0|2,0,0]=4 735 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)C)C 2430a_100012183282_100015525214 [0,1,1,0,0,0|1,0,0]=3 736 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)C)O 2430a_100000092876_100015525214 [0,1,1,0,0,0|1,0,0]=3 737 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)Br 2430a_200012360370_100015525214 [0,1,1,0,0,0|2,0,0]=4 738 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)C 2430a_100012000392_100015525214 [0,1,1,0,0,0|2,0,0]=4 739 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)Cl 2430a_100000211015_100015525214 [0,1,1,0,0,0|2,0,0]=4 740 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)F 2430a_100012017157_100015525214 [0,1,1,0,0,0|2,0,0]=4 741 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)I 2430a_100016224655_100015525214 [0,1,1,0,0,0|2,0,0]=4 742 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)Cl)O 2430a_100000037174_100015525214 [0,1,1,0,0,0|2,0,0]=4 743 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)F)Br 2430a_100000685351_100015525214 [0,1,1,0,0,0|2,0,0]=4 744 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)F)C 2430a_100000729549_100015525214 [0,1,1,0,0,0|2,0,0]=4 745 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)F)Cl 2430a_100000085081_100015525214 [0,1,1,0,0,0|2,0,0]=4 746 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)F)F 2430a_100000766337_100015525214 [0,1,1,0,0,0|2,0,0]=4 747 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)O)Cl 2430a_100012000071_100015525214 [0,1,1,0,0,0|2,0,0]=4 748 B15R1.2548 CCNC(=O)Nc1cc(c(cc1Cl)O)F 2430a_100009886023_100015525214 [0,1,1,0,0,0|2,0,0]=4 749 B15R1.2548 CCNC(=O)Nc1cc(c(cc1F)C)Br 2430a_100010239588_100015525214 [0,1,1,0,0,0|1,1,0]=4 750 B15R1.2548 CCNC(=O)Nc1cc(c(cc1F)C)F 2430a_100012002673_100015525214 [0,1,1,0,0,0|1,1,0]=4 751 B15R1.2548 CCNC(=O)Nc1cc(c(cc1F)C)I 2430a_100011014115_100015525214 [0,1,1,0,0,0|1,1,0]=4 752 B15R1.2548 CCNC(=O)Nc1cc(c(cc1F)C)O 2430a_100000117193_100015525214 [0,1,1,0,0,0|1,1,0]=4 753 B15R1.2548 CCNC(=O)Nc1cc(c(cc1I)C)Br 2430a_200015600912_100015525214 [0,1,1,0,0,0|1,1,0]=4 754 B15R1.2548 CCNC(=O)Nc1cc(c(cc1I)C)C 2430a_100012353678_100015525214 [0,1,1,0,0,0|1,1,0]=4 755 B15R1.2548 CCNC(=O)Nc1cc(c(cc1O)C)Br 2430a_200010235796_100015525214 [0,1,1,0,0,0|2,0,0]=4 756 B15R1.2548 CCNC(=O)Nc1cc(c(cc1O)C)C 2430a_100133014134_100015525214 [0,1,1,0,0,0|2,0,0]=4 757 B15R1.2548 CCNC(=O)Nc1cc(c(cc1O)C)Cl 2430a_100000091707_100015525214 [0,1,1,0,0,0|2,0,0]=4 758 B15R1.2549 CCCC(=O)Nc1ccc(c(c1Cl)O)C 11a_100000036876_100000211992 [0,1,1,0,0,0|2,0,0]=4 759 B15R1.2549 CCCC(=O)Nc1ccc(c(c1Cl)O)C 22a_100000036876_100000211992 [0,1,1,0,0,0|2,0,0]=4 760 B15R1.2549 CCNC(=O)Nc1ccc(c(c1C)Br)C 2430a_106354213274_100015525214 [0,1,1,0,0,0|2,0,0]=4 761 B15R1.2549 CCNC(=O)Nc1ccc(c(c1C)C)C 2430a_100000116900_100015525214 [0,1,1,0,0,0|2,0,0]=4 762 B15R1.2549 CCNC(=O)Nc1ccc(c(c1C)Cl)C 2430a_100009954856_100015525214 [0,1,1,0,0,0|2,0,0]=4 763 B15R1.2549 CCNC(=O)Nc1ccc(c(c1C)I)C 2430a_100011170560_100015525214 [0,1,1,0,0,0|2,0,0]=4 764 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)C)Cl 2430a_100011935240_100015525214 [0,1,1,0,0,0|2,0,0]=4 765 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)C)F 2430a_100009863382_100015525214 [0,1,1,0,0,0|2,0,0]=4 766 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)Cl)Br 2430a_100000701039_100015525214 [0,1,1,0,0,0|2,0,0]=4 767 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)Cl)F 2430a_100000068956_100015525214 [0,1,1,0,0,0|2,0,0]=4 768 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)Cl)O 2430a_100012017499_100015525214 [0,1,1,0,0,0|2,0,0]=4 769 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)F)F 2430a_100000101296_100015525214 [0,1,1,0,0,0|2,0,0]=4 770 B15R1.2549 CCNC(=O)Nc1ccc(c(c1Cl)O)C 2430a_100000036876_100015525214 [0,1,1,0,0,0|1,0,0]=3 771 B15R1.2549 CCNC(=O)Nc1ccc(c(c1F)F)C 2430a_100000062217_100015525214 [0,1,1,0,0,0|1,1,0]=4 772 B15R1.2549 CCNC(=O)Nc1ccc(c(c1F)F)C 512a_100000062217_100015525214 [0,1,1,0,0,0|1,1,0]=4 773 B15R1.8426 CC(C)NC(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100138425928 [0,1,1,0,0,0|2,0,0]=4 774 B15R1.8426 CC(C)NC(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100138425928 [0,1,1,0,0,0|2,0,0]=4 775 B15R1.8426 CC(C)NC(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100138425928 [0,1,1,0,0,0|2,0,0]=4 776 B15R1.8426 CC(C)NC(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100138425928 [0,1,1,0,0,0|2,0,0]=4 777 B15R1.8426 CC(C)NC(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100138425928 [0,1,1,0,0,0|2,0,0]=4 778 B15R1.8426 Cc1ccc(c(c1)Br)NC(=O)NC(C)C 2430a_100000210942_100138425928 [0,1,1,0,0,0|1,1,0]=4 779 B15R1.8426 Cc1ccc(c(c1)C)NC(=O)NC(C)C 2430a_100000736561_100138425928 [0,1,1,0,0,0|2,0,0]=4 780 B15R1.8426 Cc1ccc(c(c1)Cl)NC(=O)CC(C)C 11a_100000210522_100000210554 [0,1,1,0,0,0|2,0,0]=4 781 B15R1.8426 Cc1ccc(c(c1)Cl)NC(=O)CC(C)C 1626a_100000210522_100000210554 [0,1,1,0,0,0|2,0,0]=4 782 B15R1.8426 Cc1ccc(c(c1)Cl)NC(=O)CC(C)C 22a_100000210522_100000210554 [0,1,1,0,0,0|2,0,0]=4 783 B15R1.8426 Cc1ccc(c(c1)Cl)NC(=O)C[C@@H](C)O 22a_100000210522_100011933948 [0,1,1,0,0,0|2,0,0]=4 784 B15R1.8426 Cc1ccc(c(c1)Cl)NC(=O)NC(C)C 2430a_100000210522_100138425928 [0,1,1,0,0,0|1,0,0]=3 785 B15R1.8426 Cc1ccc(c(c1)F)NC(=O)NC(C)C 2430a_100000211023_100138425928 [0,1,1,0,0,0|1,1,0]=4 786 B15R1.8426 Cc1ccc(c(c1)I)NC(=O)NC(C)C 2430a_100011356834_100138425928 [0,1,1,0,0,0|1,1,0]=4 787 B15R1.8426 Cc1ccc(c(c1)O)NC(=O)NC(C)C 2430a_100000211527_100138425928 [0,1,1,0,0,0|2,0,0]=4 788 B15R1.9725 C#Cc1cc(ccc1NC(=O)NCC)C 2430a_200012001881_100015525214 [0,1,1,0,0,0|2,0,0]=4 789 B15R1.9725 C#Cc1cc(ccc1NC(=O)NCC)C 512a_200012001881_100015525214 [0,1,1,0,0,0|2,0,0]=4 790 B15R1.9725 CCNC(=O)Nc1ccc(cc1C#N)C 2430a_100011934023_100015525214 [0,1,1,0,0,0|2,0,0]=4 791 B15R1.9725 CCNC(=O)Nc1ccc(cc1OC)C 2430a_100000746441_100015525214 [0,1,1,0,0,0|2,0,0]=4 792 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)NC 34a_200000187346_200000210301 [0,1,1,0,0,0|2,0,0]=4 793 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)NC 7a_200000187346_200000210301 [0,1,1,0,0,0|2,0,0]=4 794 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)N[13CH3] 34a_200000187346_200025704644 [0,1,1,0,0,0|2,0,0]=4 795 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)N[13CH3] 7a_200000187346_200025704644 [0,1,1,0,0,0|2,0,0]=4 796 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)OC 11a_100000747055_100000211992 [0,1,1,0,0,0|2,0,0]=4 797 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)OC 1626a_100000747055_100000211992 [0,1,1,0,0,0|2,0,0]=4 798 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)OC 22a_100000747055_100000211992 [0,1,1,0,0,0|2,0,0]=4 799 B15R1.9726 CCCC(=O)Nc1ccc(cc1Cl)OC 527a_100000747055_100000211992 [0,1,1,0,0,0|2,0,0]=4 800 B15R1.9726 CCNC(=O)Cc1ccc(cc1Cl)OC 11a_100015525214_100000688043 [0,1,1,0,0,0|2,0,0]=4 801 B15R1.9726 CCNC(=O)Cc1ccc(cc1Cl)OC 240690a_100015525214_100000688043 [0,1,1,0,0,0|2,0,0]=4 802 B15R1.9726 CCNC(=O)Cc1ccc(cc1Cl)OC 527a_100015525214_100000688043 [0,1,1,0,0,0|2,0,0]=4 803 B15R1.9726 CCNC(=O)Nc1ccc(cc1Br)CC 2430a_100012339725_100015525214 [0,1,1,0,0,0|1,1,0]=4 804 B15R1.9726 CCNC(=O)Nc1ccc(cc1Br)OC 2430a_100015195136_100015525214 [0,1,1,0,0,0|1,1,0]=4 805 B15R1.9726 CCNC(=O)Nc1ccc(cc1C)CC 2430a_100011226020_100015525214 [0,1,1,0,0,0|2,0,0]=4 806 B15R1.9726 CCNC(=O)Nc1ccc(cc1C)CC 512a_100015525214_100011226020 [0,1,1,0,0,0|2,0,0]=4 807 B15R1.9726 CCNC(=O)Nc1ccc(cc1C)CO 2430a_200011997030_100015525214 [0,1,1,0,0,0|2,0,0]=4 808 B15R1.9726 CCNC(=O)Nc1ccc(cc1C)OC 2430a_100000750285_100015525214 [0,1,1,0,0,0|2,0,0]=4 809 B15R1.9726 CCNC(=O)Nc1ccc(cc1Cl)OC 2430a_100000747055_100015525214 [0,1,1,0,0,0|1,0,0]=3 810 B15R1.9726 CCNC(=O)Nc1ccc(cc1F)CC 2430a_100016177294_100015525214 [0,1,1,0,0,0|1,1,0]=4 811 B15R1.9726 CCNC(=O)Nc1ccc(cc1F)OC 2430a_100011299463_100015525214 [0,1,1,0,0,0|1,1,0]=4 812 B15R1.9726 CCNC(=O)Nc1ccc(cc1F)SC 2430a_100012056844_100015525214 [0,1,1,0,0,0|1,1,0]=4 813 B15R1.9726 CCNC(=O)Nc1ccc(cc1I)OC 2430a_100000049804_100015525214 [0,1,1,0,0,0|1,1,0]=4 814 B15R1.9726 CCNC(=O)Nc1ccc(cc1O)CC 2430a_100000124328_100015525214 [0,1,1,0,0,0|2,0,0]=4 815 B15R1.9726 CCNC(=O)Nc1ccc(cc1O)OC 2430a_100016989039_100015525214 [0,1,1,0,0,0|2,0,0]=4 816 B15R1.14339 CCC(C)C(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100011192722 [0,1,1,0,0,0|2,0,0]=4 817 B15R1.14339 CCC(C)C(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100011192722 [0,1,1,0,0,0|2,0,0]=4 818 B15R1.14339 CCC(C)C(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100011192722 [0,1,1,0,0,0|2,0,0]=4 819 B15R1.14339 CCC(O)C(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100011196387 [0,1,1,0,0,0|2,0,0]=4 820 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Br)C 2430a_100000210942_100000225621 [0,1,1,0,0,0|1,1,0]=4 821 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1C)C 2430a_100000736561_100000225621 [0,1,1,0,0,0|2,0,0]=4 822 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)Br 2430a_100000211467_100000225621 [0,1,1,0,0,0|2,0,0]=4 823 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)C 2430a_100000210522_100000225621 [0,1,1,0,0,0|1,0,0]=3 824 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)Cl 2430a_100000185861_100000225621 [0,1,1,0,0,0|2,0,0]=4 825 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)F 2430a_100000212003_100000225621 [0,1,1,0,0,0|2,0,0]=4 826 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)I 2430a_100011218065_100000225621 [0,1,1,0,0,0|2,0,0]=4 827 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1Cl)O 2430a_100011215599_100000225621 [0,1,1,0,0,0|2,0,0]=4 828 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1F)C 2430a_100000211023_100000225621 [0,1,1,0,0,0|1,1,0]=4 829 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1I)C 2430a_100011356834_100000225621 [0,1,1,0,0,0|1,1,0]=4 830 B15R1.14339 CCN(C)C(=O)Nc1ccc(cc1O)C 2430a_100000211527_100000225621 [0,1,1,0,0,0|2,0,0]=4 831 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1Br)C 512a_100015525214_100000221369 [0,1,1,0,0,0|1,1,0]=4 832 B15R1.16836 CCNC(=O)N(C)c1ccc(cc1Cl)Br 512a_100015525214_100000221650 [0,1,1,0,0,0|2,0,0]=4 833 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Br)C)Cl 1626a_100012339639_100000211992 [0,1,1,0,0,0|2,0,0]=4 834 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Cl)C)C 11a_100000211461_100000211992 [0,1,1,0,0,0|2,0,0]=4 835 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Cl)C)C 1626a_100000211461_100000211992 [0,1,1,0,0,0|2,0,0]=4 836 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Cl)C)Cl 1626a_100011996032_100000211992 [0,1,1,0,0,0|2,0,0]=4 837 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Cl)C)O 22a_100015906060_100000211992 [0,1,1,0,0,0|2,0,0]=4 838 B15R1.37637 CCCC(=O)Nc1c(cc(cc1Cl)C)O 527a_100015906060_100000211992 [0,1,1,0,0,0|2,0,0]=4 839 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Br)C)C 2430a_100000688863_100015525214 [0,1,1,0,0,0|1,1,0]=4 840 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Br)C)C 512a_100015525214_100000688863 [0,1,1,0,0,0|1,1,0]=4 841 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Br)C)F 2430a_100012353694_100015525214 [0,1,1,0,0,0|1,1,0]=4 842 B15R1.37637 CCNC(=O)Nc1c(cc(cc1C)C)C 2430a_100000210045_100015525214 [0,1,1,0,0,0|2,0,0]=4 843 B15R1.37637 CCNC(=O)Nc1c(cc(cc1C)C)C 512a_100015525214_100000210045 [0,1,1,0,0,0|2,0,0]=4 844 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)Br)C 512a_100015525214_100000741131 [0,1,1,0,0,0|2,0,0]=4 845 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)C)C 2430a_100000211461_100015525214 [0,1,1,0,0,0|1,0,0]=3 846 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)C)C 512a_100015525214_100000211461 [0,1,1,0,0,0|1,0,0]=3 847 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)C)Cl 2430a_100011996032_100015525214 [0,1,1,0,0,0|1,0,0]=3 848 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)C)O 2430a_100015906060_100015525214 [0,1,1,0,0,0|1,0,0]=3 849 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)Cl)C 2430a_100011215104_100015525214 [0,1,1,0,0,0|2,0,0]=4 850 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)Cl)F 2430a_100000688862_100015525214 [0,1,1,0,0,0|2,0,0]=4 851 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)F)C 2430a_100000725997_100015525214 [0,1,1,0,0,0|2,0,0]=4 852 B15R1.37637 CCNC(=O)Nc1c(cc(cc1Cl)F)F 2430a_100000688773_100015525214 [0,1,1,0,0,0|2,0,0]=4 853 B15R1.37637 CCNC(=O)Nc1c(cc(cc1I)C)I 2430a_200015987959_100015525214 [0,1,1,0,0,0|1,1,0]=4 854 B15R1.37637 CCNC(=O)Nc1c(cc(cc1I)C)I 512a_200015987959_100015525214 [0,1,1,0,0,0|1,1,0]=4 855 B15R1.37637 CNNC(=O)Nc1c(cc(cc1Cl)C)C 512a_100016993582_100000211461 [0,1,1,0,0,0|2,0,0]=4 856 B15R2.359 Cn1ncnc1Nc2ccccc2Cl 27a_100000185783_100000732653 [1,1,0,0,0,0|1,0,1]=4 857 B15R2.1510 Cc1ccc(cc1)Nc2ncnn2C 27a_100000124888_100000732653 [1,1,0,0,0,0|1,0,1]=4 858 B15R2.1153 Cc1ccc(c(c1)Cl)c2nc(c[nH]2)C 271570a_100011218894_100161115468 [0,1,0,0,1,0|0,0,2]=4 859 B15R2.2111 COc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100010391030_100025796157 [0,1,0,0,1,0|0,0,2]=4 860 B15R2.2111 OCc1ccc(c(c1)Cl)C2=CCCC2 271570a_100000089523_100000718186 [0,1,0,0,1,0|2,0,0]=4 861 B15R2.2111 OCc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100016988920_100000718186 [0,1,0,0,1,0|0,0,2]=4 862 B15R2.2111 OCc1ccc(c(c1)Cl)c2ncc[nH]2 271570a_100135389012_100025796157 [0,1,0,0,1,0|0,0,2]=4 863 B15R2.4201 Cc1cc(c(c(c1)Cl)c2ncc[nH]2)Cl 271570a_100010233845_100025796157 [0,1,0,0,1,0|0,0,2]=4 864 B15R2.7536 Cc1ccc(c(c1)Cl)c2nccn2C 271570a_100011218894_100000707724 [0,1,0,0,1,0|0,0,2]=4 865 B15R2.7536 Cc1ccc(c(c1)Cl)c2ncnn2C 271570a_100011218894_100000732653 [0,1,0,0,1,0|1,0,1]=4 866 B15R2.15599 Cc1cc(c(cc1F)c2ncc[nH]2)Cl 271570a_100010264401_100025796157 [0,1,0,0,1,0|0,0,2]=4 867 B15R2.4203 Cc1cc(c(c(c1)Br)NC2CCC2)Cl 34a_100012339639_100000749161 [0,1,0,0,1,0|1,0,1]=4 868 B15R2.4203 Cc1cc(c(c(c1)Cl)NC2CCC2)C 34a_100000211461_100000749161 [0,1,0,0,1,0|1,0,1]=4 869 B15R2.4203 Cc1cc(c(c(c1)Cl)NC2CCC2)Cl 34a_100011996032_100000749161 [0,1,0,0,1,0|1,0,1]=4 870 B15R2.4203 Cc1cc(c(c(c1)Cl)NC2CCC2)O 34a_100015906060_100000749161 [0,1,0,0,1,0|1,0,1]=4 871 B15R2.15603 Cc1cc(c(cc1C)NC2CCC2)Cl 34a_100012183282_100000749161 [0,1,0,0,1,0|1,0,1]=4 872 B15R2.15603 Cc1cc(c(cc1O)NC2CCC2)Cl 34a_100000092876_100000749161 [0,1,0,0,1,0|1,0,1]=4 873 B15R2.15650 Cc1ccc(c(c1)Cl)NC2CCC2=O 34a_100000210522_100009892977 [0,1,0,0,1,0|1,0,1]=4 874 B15R2.65819 Cc1ccc(c(c1O)Cl)NC2CCC2 34a_100000036876_100000749161 [0,1,0,0,1,0|1,0,1]=4 875 B15R2.91950 COc1ccc(c(c1)Cl)NC2CCC2 34a_100000747055_100000749161 [0,1,0,0,1,0|1,0,1]=4 876 B17R2.42570 Cc1ccc(c(c1)Cl)NC2CCCNC2=O 34a_100000210522_100000687798 [0,1,0,0,0,1|1,0,1]=4 877 B17R2.2815 CCc1ccc(c(c1)Br)NCC2=NCCN2 34a_100012339725_100000737910 [0,1,0,0,0,1|0,1,0]=3 878 B17R2.2815 CCc1ccc(c(c1)Br)OCC2=NCCN2 34a_100012339963_100000737910 [0,1,0,0,0,1|1,1,0]=4 879 B17R2.2815 CCc1ccc(c(c1)Br)OCC2=NCCN2 7a_100012339963_100000737910 [0,1,0,0,0,1|1,1,0]=4 880 B17R2.2815 CCc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_200009997437 [0,1,0,0,0,1|1,1,0]=4 881 B17R2.2815 CCc1ccc(c(c1)Br)SCC2=NCCN2 62a_200009997437_100000737910 [0,1,0,0,0,1|1,1,0]=4 882 B17R2.2815 CCc1ccc(c(c1)C)NCC2=NCCN2 34a_100011226020_100000737910 [0,1,0,0,0,1|1,0,0]=3 883 B17R2.2815 CCc1ccc(c(c1)C)NCC2=NCCN2 7a_100011226020_100000737910 [0,1,0,0,0,1|1,0,0]=3 884 B17R2.2815 CCc1ccc(c(c1)F)NCC2=NCCN2 34a_100016177294_100000737910 [0,1,0,0,0,1|0,1,0]=3 885 B17R2.2815 CCc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_200010339503 [0,1,0,0,0,1|1,1,0]=4 886 B17R2.2815 CCc1ccc(c(c1)F)SCC2=NCCN2 62a_200010339503_100000737910 [0,1,0,0,0,1|1,1,0]=4 887 B17R2.2815 CCc1ccc(c(c1)N)OCC2=NCCN2 34a_100000765835_100000737910 [0,1,0,0,0,1|2,0,0]=4 888 B17R2.2815 CCc1ccc(c(c1)N)OCC2=NCCN2 7a_100000765835_100000737910 [0,1,0,0,0,1|2,0,0]=4 889 B17R2.2815 CCc1ccc(c(c1)O)NCC2=NCCN2 34a_100000124328_100000737910 [0,1,0,0,0,1|1,0,0]=3 890 B17R2.2815 CNc1ccc(c(c1)C)SCC2=NCCN2 62a_100000737910_100102888905 [0,1,0,0,0,1|2,0,0]=4 891 B17R2.2815 CNc1ccc(c(c1)C)SCC2=NCCN2 62a_100102888905_100000737910 [0,1,0,0,0,1|2,0,0]=4 892 B17R2.2815 CNc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100012285320 [0,1,0,0,0,1|1,1,0]=4 893 B17R2.2815 CNc1ccc(c(c1)F)SCC2=NCCN2 62a_100012285320_100000737910 [0,1,0,0,0,1|1,1,0]=4 894 B17R2.2815 COc1ccc(c(c1)Br)NCC2=NCCN2 34a_100015195136_100000737910 [0,1,0,0,0,1|0,1,0]=3 895 B17R2.2815 COc1ccc(c(c1)Br)OCC2=NCCN2 34a_100000685887_100000737910 [0,1,0,0,0,1|1,1,0]=4 896 B17R2.2815 COc1ccc(c(c1)Br)OCC2=NCCN2 7a_100000685887_100000737910 [0,1,0,0,0,1|1,1,0]=4 897 B17R2.2815 COc1ccc(c(c1)Br)SCC2=NCCN2 62a_100000737910_100012349170 [0,1,0,0,0,1|1,1,0]=4 898 B17R2.2815 COc1ccc(c(c1)Br)SCC2=NCCN2 62a_100012349170_100000737910 [0,1,0,0,0,1|1,1,0]=4 899 B17R2.2815 COc1ccc(c(c1)C)NCC2=NCCN2 34a_100000750285_100000737910 [0,1,0,0,0,1|1,0,0]=3 900 B17R2.2815 COc1ccc(c(c1)C)OCC2=NCCN2 34a_100012002223_100000737910 [0,1,0,0,0,1|2,0,0]=4 901 B17R2.2815 COc1ccc(c(c1)C)OCC2=NCCN2 7a_100012002223_100000737910 [0,1,0,0,0,1|2,0,0]=4 902 B17R2.2815 COc1ccc(c(c1)C)SCC2=NCCN2 62a_100000737910_100000759875 [0,1,0,0,0,1|2,0,0]=4 903 B17R2.2815 COc1ccc(c(c1)C)SCC2=NCCN2 62a_100000759875_100000737910 [0,1,0,0,0,1|2,0,0]=4 904 B17R2.2815 COc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100000747055_100000737910 [0,1,0,0,0,1|0,0,0]=2 905 B17R2.2815 COc1ccc(c(c1)Cl)NCc2ncc[nH]2 207a_100000747055_100000743867 [0,1,0,0,0,1|0,0,2]=4 906 B17R2.2815 COc1ccc(c(c1)Cl)NCc2ncc[nH]2 34a_100000747055_100016991755 [0,1,0,0,0,1|0,0,2]=4 907 B17R2.2815 COc1ccc(c(c1)Cl)NCc2nnn[nH]2 34a_100000747055_100000765167 [0,1,0,0,0,1|2,0,0]=4 908 B17R2.2815 COc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100000038596_100000737910 [0,1,0,0,0,1|1,0,0]=3 909 B17R2.2815 COc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100000038596_100000737910 [0,1,0,0,0,1|1,0,0]=3 910 B17R2.2815 COc1ccc(c(c1)F)NCC2=NCCN2 34a_100011299463_100000737910 [0,1,0,0,0,1|0,1,0]=3 911 B17R2.2815 COc1ccc(c(c1)F)OCC2=NCCN2 34a_100000036999_100000737910 [0,1,0,0,0,1|1,1,0]=4 912 B17R2.2815 COc1ccc(c(c1)F)OCC2=NCCN2 7a_100000036999_100000737910 [0,1,0,0,0,1|1,1,0]=4 913 B17R2.2815 COc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100000753793 [0,1,0,0,0,1|1,1,0]=4 914 B17R2.2815 COc1ccc(c(c1)F)SCC2=NCCN2 62a_100000753793_100000737910 [0,1,0,0,0,1|1,1,0]=4 915 B17R2.2815 COc1ccc(c(c1)I)NCC2=NCCN2 34a_100000049804_100000737910 [0,1,0,0,0,1|0,1,0]=3 916 B17R2.2815 COc1ccc(c(c1)N)OCC2=NCCN2 34a_100000188146_100000737910 [0,1,0,0,0,1|2,0,0]=4 917 B17R2.2815 COc1ccc(c(c1)N)SCC2=NCCN2 62a_100000737910_100000748021 [0,1,0,0,0,1|2,0,0]=4 918 B17R2.2815 COc1ccc(c(c1)N)SCC2=NCCN2 62a_100000748021_100000737910 [0,1,0,0,0,1|2,0,0]=4 919 B17R2.2815 COc1ccc(c(c1)O)NCC2=NCCN2 34a_100016989039_100000737910 [0,1,0,0,0,1|1,0,0]=3 920 B17R2.2815 COc1ccc(c(c1)O)SCC2=NCCN2 62a_100000737910_100000719091 [0,1,0,0,0,1|2,0,0]=4 921 B17R2.2815 CSc1ccc(c(c1)F)NCC2=NCCN2 34a_100012056844_100000737910 [0,1,0,0,0,1|0,1,0]=3 922 B17R2.2815 CSc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100009816902 [0,1,0,0,0,1|1,1,0]=4 923 B17R2.2815 CSc1ccc(c(c1)F)SCC2=NCCN2 62a_100009816902_100000737910 [0,1,0,0,0,1|1,1,0]=4 924 B17R2.2815 Cc1cc(ccc1NCC2=NCCN2)C#N 34a_100011216260_100000737910 [0,1,0,0,0,1|1,0,1]=4 925 B17R2.2815 Cc1cc(ccc1NCC2=NCCN2)C#N 7a_100011216260_100000737910 [0,1,0,0,0,1|1,0,1]=4 926 B17R2.2815 Cc1cc(ccc1NCC2=NCCN2)CO 34a_200011997030_100000737910 [0,1,0,0,0,1|1,0,0]=3 927 B17R2.2815 Cc1cc(ccc1OCC2=NCCN2)CO 34a_100000075815_100000737910 [0,1,0,0,0,1|2,0,0]=4 928 B17R2.2815 Cc1cc(ccc1OCC2=NCCN2)CO 7a_100000075815_100000737910 [0,1,0,0,0,1|2,0,0]=4 929 B17R2.2815 Cc1cc(ccc1SCC2=NCCN2)CN 62a_100000737910_100015205234 [0,1,0,0,0,1|2,0,0]=4 930 B17R2.2815 Cc1cc(ccc1SCC2=NCCN2)CN 62a_100015205234_100000737910 [0,1,0,0,0,1|2,0,0]=4 931 B17R2.2815 Cc1cc(ccc1SCC2=NCCN2)CO 62a_100000718852_100000737910 [0,1,0,0,0,1|2,0,0]=4 932 B17R2.2815 Cc1cc(ccc1SCC2=NCCN2)CO 62a_100000737910_100000718852 [0,1,0,0,0,1|2,0,0]=4 933 B17R2.2815 N#Cc1ccc(c(c1)Br)NCC2=NCCN2 34a_100000736769_100000737910 [0,1,0,0,0,1|0,1,1]=4 934 B17R2.2815 N#Cc1ccc(c(c1)Br)NCC2=NCCN2 7a_100000736769_100000737910 [0,1,0,0,0,1|0,1,1]=4 935 B17R2.2815 N#Cc1ccc(c(c1)Cl)NCC2=NCCN2 34a_100000690208_100000737910 [0,1,0,0,0,1|0,0,1]=3 936 B17R2.2815 N#Cc1ccc(c(c1)Cl)NCC2=NCCN2 7a_100000690208_100000737910 [0,1,0,0,0,1|0,0,1]=3 937 B17R2.2815 N#Cc1ccc(c(c1)Cl)OCC2=NCCN2 34a_100000205955_100000737910 [0,1,0,0,0,1|1,0,1]=4 938 B17R2.2815 N#Cc1ccc(c(c1)Cl)OCC2=NCCN2 7a_100000205955_100000737910 [0,1,0,0,0,1|1,0,1]=4 939 B17R2.2815 N#Cc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100012349663 [0,1,0,0,0,1|1,0,1]=4 940 B17R2.2815 N#Cc1ccc(c(c1)F)NCC2=NCCN2 34a_100000760432_100000737910 [0,1,0,0,0,1|0,1,1]=4 941 B17R2.2815 N#Cc1ccc(c(c1)F)NCC2=NCCN2 7a_100000760432_100000737910 [0,1,0,0,0,1|0,1,1]=4 942 B17R2.2815 N#Cc1ccc(c(c1)I)NCC2=NCCN2 7a_100000067503_100000737910 [0,1,0,0,0,1|0,1,1]=4 943 B17R2.2815 N#Cc1ccc(c(c1)O)NCC2=NCCN2 34a_100011997735_100000737910 [0,1,0,0,0,1|1,0,1]=4 944 B17R2.2815 NCc1ccc(c(c1)F)OCC2=NCCN2 34a_100000758358_100000737910 [0,1,0,0,0,1|1,1,0]=4 945 B17R2.2815 NCc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100000755036 [0,1,0,0,0,1|1,1,0]=4 946 B17R2.2815 NCc1ccc(c(c1)F)SCC2=NCCN2 62a_100000755036_100000737910 [0,1,0,0,0,1|1,1,0]=4 947 B17R2.2815 Nc1cc(ccc1OCC2=NCCN2)CO 34a_100000123545_100000737910 [0,1,0,0,0,1|2,0,0]=4 948 B17R2.2815 Nc1cc(ccc1SCC2=NCCN2)CO 62a_100000737910_100012347568 [0,1,0,0,0,1|2,0,0]=4 949 B17R2.2815 Nc1cc(ccc1SCC2=NCCN2)CO 62a_100012347568_100000737910 [0,1,0,0,0,1|2,0,0]=4 950 B17R2.2815 OCc1ccc(c(c1)Br)OCC2=NCCN2 34a_100011191544_100000737910 [0,1,0,0,0,1|1,1,0]=4 951 B17R2.2815 OCc1ccc(c(c1)Br)OCC2=NCCN2 7a_100011191544_100000737910 [0,1,0,0,0,1|1,1,0]=4 952 B17R2.2815 OCc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000718186_100000737910 [0,1,0,0,0,1|1,0,0]=3 953 B17R2.2815 OCc1ccc(c(c1)Cl)SCC2=NCCN2 62a_100000737910_100000718186 [0,1,0,0,0,1|1,0,0]=3 954 B17R2.2815 OCc1ccc(c(c1)F)NCC2=NCCN2 34a_100011217239_100000737910 [0,1,0,0,0,1|0,1,0]=3 955 B17R2.2815 OCc1ccc(c(c1)F)SCC2=NCCN2 62a_100000737910_100011533735 [0,1,0,0,0,1|1,1,0]=4 956 B17R2.2815 OCc1ccc(c(c1)F)SCC2=NCCN2 62a_100011533735_100000737910 [0,1,0,0,0,1|1,1,0]=4 957 B17R2.2815 OCc1ccc(c(c1)O)SCC2=NCCN2 62a_100000049605_100000737910 [0,1,0,0,0,1|2,0,0]=4 958 B17R2.2815 OCc1ccc(c(c1)O)SCC2=NCCN2 62a_100000737910_100000049605 [0,1,0,0,0,1|2,0,0]=4 959 B17R2.2815 OCc1ccc(c(n1)Cl)OCC2=NCCN2 34a_200000118097_100000737910 [0,1,0,0,0,1|2,0,0]=4 960 B17R2.2815 OCc1ccc(c(n1)Cl)OCC2=NCCN2 7a_200000118097_100000737910 [0,1,0,0,0,1|2,0,0]=4 961 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)Br 269982a_200000221195_100000737910 [0,1,0,0,0,1|1,1,0]=4 962 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)Br 34a_200000221195_100000737910 [0,1,0,0,0,1|1,1,0]=4 963 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)Cl 269982a_100020633009_100000737910 [0,1,0,0,0,1|1,1,0]=4 964 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)Cl 34a_100020633009_100000737910 [0,1,0,0,0,1|1,1,0]=4 965 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)F 269982a_100011246292_100000737910 [0,1,0,0,0,1|1,1,0]=4 966 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Br)F 34a_100011246292_100000737910 [0,1,0,0,0,1|1,1,0]=4 967 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Cl)Br 269982a_100000221650_100000737910 [0,1,0,0,0,1|1,0,0]=3 968 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Cl)Br 34a_100000221650_100000737910 [0,1,0,0,0,1|1,0,0]=3 969 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Cl)Cl 269982a_114849113696_100000737910 [0,1,0,0,0,1|1,0,0]=3 970 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2Cl)Cl 34a_114849113696_100000737910 [0,1,0,0,0,1|1,0,0]=3 971 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)Br 269982a_100000743884_100000737910 [0,1,0,0,0,1|1,1,0]=4 972 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)Br 34a_100000743884_100000737910 [0,1,0,0,0,1|1,1,0]=4 973 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)F 269982a_100020633734_100000737910 [0,1,0,0,0,1|1,1,0]=4 974 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)F 34a_100020633734_100000737910 [0,1,0,0,0,1|1,1,0]=4 975 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)F 38a_100020633734_100000737910 [0,1,0,0,0,1|1,1,0]=4 976 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)I 269982a_114948340911_100000737910 [0,1,0,0,0,1|1,1,0]=4 977 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)I 34a_114948340911_100000737910 [0,1,0,0,0,1|1,1,0]=4 978 B17R2.3478 CN(CC1=NCCN1)c2ccc(cc2F)I 38a_114948340911_100000737910 [0,1,0,0,0,1|1,1,0]=4 979 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)Br 269982a_100000221803_100000737910 [0,1,0,0,0,1|2,0,0]=4 980 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)Br 34a_100000221803_100000737910 [0,1,0,0,0,1|2,0,0]=4 981 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)Cl 269982a_114849113698_100000737910 [0,1,0,0,0,1|2,0,0]=4 982 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)Cl 34a_114849113698_100000737910 [0,1,0,0,0,1|2,0,0]=4 983 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)Cl 38a_114849113698_100000737910 [0,1,0,0,0,1|2,0,0]=4 984 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)O 269982a_100161107805_100000737910 [0,1,0,0,0,1|2,0,0]=4 985 B17R2.3478 Cc1cc(ccc1N(C)CC2=NCCN2)O 34a_100161107805_100000737910 [0,1,0,0,0,1|2,0,0]=4 986 B17R2.3478 Cc1ccc(c(c1)Br)N(C)CC2=NCCN2 269982a_100000221369_100000737910 [0,1,0,0,0,1|0,1,0]=3 987 B17R2.3478 Cc1ccc(c(c1)Br)N(C)CC2=NCCN2 34a_100000221369_100000737910 [0,1,0,0,0,1|0,1,0]=3 988 B17R2.3489 Cc1ccc(c(c1)Cl)NN=C2CCC(C2)C 4a_100000006747_100011215218 [0,1,0,0,0,1|2,0,0]=4 989 B17R2.3489 Cc1ccc(c(c1)Cl)NN=C2CCC(C2)O 4a_100000006747_100012614533 [0,1,0,0,0,1|2,0,0]=4 990 B17R2.5361 Cc1ccc(c(c1)Cl)NC(=O)C2=CCCC2 11a_100000210522_100000038896 [0,1,0,0,0,1|2,0,0]=4 991 B17R2.5361 Cc1ccc(c(c1)Cl)NC(=O)C2=CCCC2 1626a_100000210522_100000038896 [0,1,0,0,0,1|2,0,0]=4 992 B17R2.5361 Cc1ccc(c(c1)Cl)NC(=O)C2=CCCC2 22a_100000210522_100000038896 [0,1,0,0,0,1|2,0,0]=4 993 B17R2.10450 C#Cc1cc(ccc1NCC2=NCCN2)C 34a_200012001881_100000737910 [0,1,0,0,0,1|1,0,0]=3 994 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)Br 34a_100000686106_100000737910 [0,1,0,0,0,1|2,0,0]=4 995 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)Br 7a_100000686106_100000737910 [0,1,0,0,0,1|2,0,0]=4 996 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)Cl 34a_100012017146_100000737910 [0,1,0,0,0,1|2,0,0]=4 997 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)Cl 7a_100012017146_100000737910 [0,1,0,0,0,1|2,0,0]=4 998 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)I 34a_100000014069_100000737910 [0,1,0,0,0,1|2,0,0]=4 999 B17R2.10450 CCc1cc(ccc1NCC2=NCCN2)I 7a_100000014069_100000737910 [0,1,0,0,0,1|2,0,0]=4 1000 B17R2.10450 CCc1cc(ccc1OCC2=NCCN2)C 34a_100009844793_100000737910 [0,1,0,0,0,1|2,0,0]=4 1001 B17R2.10450 CCc1cc(ccc1OCC2=NCCN2)C 7a_100009844793_100000737910 [0,1,0,0,0,1|2,0,0]=4 1002 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)Br 34a_100011279103_100000737910 [0,1,0,0,0,1|2,0,0]=4 1003 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)C 34a_100000746441_100000737910 [0,1,0,0,0,1|1,0,0]=3 1004 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)Cl 34a_100000707585_100000737910 [0,1,0,0,0,1|2,0,0]=4 1005 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)F 34a_100000737216_100000737910 [0,1,0,0,0,1|2,0,0]=4 1006 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)I 34a_100015196925_100000737910 [0,1,0,0,0,1|2,0,0]=4 1007 B17R2.10450 COc1cc(ccc1NCC2=NCCN2)O 34a_100015326901_100000737910 [0,1,0,0,0,1|2,0,0]=4 1008 B17R2.10450 COc1cc(ccc1OCC2=NCCN2)C 34a_100000186466_100000737910 [0,1,0,0,0,1|2,0,0]=4 1009 B17R2.10450 COc1cc(ccc1SCC2=NCCN2)C 62a_100000737910_100010200004 [0,1,0,0,0,1|2,0,0]=4 1010 B17R2.10450 COc1cc(ccc1SCC2=NCCN2)C 62a_100010200004_100000737910 [0,1,0,0,0,1|2,0,0]=4 1011 B17R2.10450 CSc1cc(ccc1SCC2=NCCN2)C 62a_100000737910_200010709736 [0,1,0,0,0,1|2,0,0]=4 1012 B17R2.10450 CSc1cc(ccc1SCC2=NCCN2)C 62a_200010709736_100000737910 [0,1,0,0,0,1|2,0,0]=4 1013 B17R2.10450 Cc1ccc(c(c1)C#N)NCC2=NCCN2 7a_100011934023_100000737910 [0,1,0,0,0,1|1,0,0]=3 1014 B17R2.10450 Cc1ccc(c(c1)C#N)OCC2=NCCN2 34a_200012180384_100000737910 [0,1,0,0,0,1|2,0,0]=4 1015 B17R2.10450 Cc1ccc(c(c1)C#N)OCC2=NCCN2 7a_200012180384_100000737910 [0,1,0,0,0,1|2,0,0]=4 1016 B17R2.10450 Cc1ccc(c(c1)C#N)SCC2=NCCN2 62a_100000737910_100011935190 [0,1,0,0,0,1|2,0,0]=4 1017 B17R2.10450 Cc1ccc(c(c1)C=O)SCC2=NCCN2 62a_100000737910_100011551863 [0,1,0,0,0,1|2,0,0]=4 1018 B17R2.10450 Cc1ccc(c(c1)C=O)SCC2=NCCN2 62a_100011551863_100000737910 [0,1,0,0,0,1|2,0,0]=4 1019 B17R2.10450 Cc1ccc(c(c1)CO)NCC2=NCCN2 34a_100011215565_100000737910 [0,1,0,0,0,1|1,0,0]=3 1020 B17R2.10450 Cc1ccc(c(c1)CO)OCC2=NCCN2 34a_200011846009_100000737910 [0,1,0,0,0,1|2,0,0]=4 1021 B17R2.10450 Cc1ccc(c(c1)CO)OCC2=NCCN2 7a_200011846009_100000737910 [0,1,0,0,0,1|2,0,0]=4 1022 B17R2.10450 Cc1ccc(c(c1)CO)SCC2=NCCN2 62a_100000737910_100012361352 [0,1,0,0,0,1|2,0,0]=4 1023 B17R2.10450 Cc1ccc(c(c1)CO)SCC2=NCCN2 62a_100012361352_100000737910 [0,1,0,0,0,1|2,0,0]=4 1024 B17R2.10450 Cc1ccc(c(n1)CCl)OCC2=NCCN2 34a_100020630696_100000737910 [0,1,0,0,0,1|2,0,0]=4 1025 B17R2.10450 Cc1ccc(c(n1)CCl)OCC2=NCCN2 7a_100020630696_100000737910 [0,1,0,0,0,1|2,0,0]=4 1026 B17R2.10450 N#Cc1cc(ccc1NCC2=NCCN2)Br 7a_100000688460_100000737910 [0,1,0,0,0,1|2,0,0]=4 1027 B17R2.10450 N#Cc1cc(ccc1NCC2=NCCN2)Cl 7a_100011219925_100000737910 [0,1,0,0,0,1|2,0,0]=4 1028 B17R2.10450 N#Cc1cc(ccc1NCC2=NCCN2)F 34a_100000685569_100000737910 [0,1,0,0,0,1|2,0,0]=4 1029 B17R2.10450 N#Cc1cc(ccc1NCC2=NCCN2)F 7a_100000685569_100000737910 [0,1,0,0,0,1|2,0,0]=4 1030 B17R2.10450 N#Cc1cc(ccc1NCC2=NCCN2)I 7a_100000049818_100000737910 [0,1,0,0,0,1|2,0,0]=4 1031 B17R2.10450 OCc1cc(ccc1NCC2=NCCN2)Br 34a_100012353972_100000737910 [0,1,0,0,0,1|2,0,0]=4 1032 B17R2.10450 OCc1cc(ccc1NCC2=NCCN2)Cl 34a_100011214999_100000737910 [0,1,0,0,0,1|2,0,0]=4 1033 B17R2.10450 OCc1cc(ccc1NCC2=NCCN2)F 34a_100011296978_100000737910 [0,1,0,0,0,1|2,0,0]=4 1034 B17R2.20834 Cc1ccc(c(c1)Cl)CNc2ncnn2C 27a_100011997539_100000732653 [0,1,0,0,0,1|1,0,1]=4 1035 B17R2.20834 Cc1ccc(c(c1)Cl)NCc2nccn2C 34a_100000210522_100000700302 [0,1,0,0,0,1|0,0,2]=4 1036 B17R2.20834 Cc1ccc(c(c1)Cl)NN=C2CCCC2C 4a_100000006747_100000752053 [0,1,0,0,0,1|2,0,0]=4 1037 B17R2.20834 Cc1ccc(c(c1)Cl)NN=C2CCCC2O 4a_100000006747_200000719330 [0,1,0,0,0,1|2,0,0]=4 1038 B17R2.42397 Brc1cc(c(cc1Br)NCC2=NCCN2)Br 34a_100009998182_100000737910 [0,1,0,0,0,1|1,1,0]=4 1039 B17R2.42397 Brc1cc(c(cc1Br)NCC2=NCCN2)Br 7a_100009998182_100000737910 [0,1,0,0,0,1|1,1,0]=4 1040 B17R2.42397 Cc1cc(c(cc1Br)Br)NCC2=NCCN2 34a_100009995518_100000737910 [0,1,0,0,0,1|1,1,0]=4 1041 B17R2.42397 Cc1cc(c(cc1Br)Br)NCC2=NCCN2 7a_100009995518_100000737910 [0,1,0,0,0,1|1,1,0]=4 1042 B17R2.42397 Cc1cc(c(cc1Br)C)NCC2=NCCN2 34a_100011934712_100000737910 [0,1,0,0,0,1|2,0,0]=4 1043 B17R2.42397 Cc1cc(c(cc1Br)C)NCC2=NCCN2 7a_100011934712_100000737910 [0,1,0,0,0,1|2,0,0]=4 1044 B17R2.42397 Cc1cc(c(cc1Br)Cl)OCC2=NCCN2 34a_200012350488_100000737910 [0,1,0,0,0,1|2,0,0]=4 1045 B17R2.42397 Cc1cc(c(cc1Br)Cl)OCC2=NCCN2 7a_200012350488_100000737910 [0,1,0,0,0,1|2,0,0]=4 1046 B17R2.42397 Cc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_100000737910_100010259621 [0,1,0,0,0,1|2,0,0]=4 1047 B17R2.42397 Cc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_100010259621_100000737910 [0,1,0,0,0,1|2,0,0]=4 1048 B17R2.42397 Cc1cc(c(cc1Br)F)NCC2=NCCN2 34a_100000691575_100000737910 [0,1,0,0,0,1|1,1,0]=4 1049 B17R2.42397 Cc1cc(c(cc1Br)F)NCC2=NCCN2 7a_100000691575_100000737910 [0,1,0,0,0,1|1,1,0]=4 1050 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)Br 34a_100012348304_100000737910 [0,1,0,0,0,1|0,1,0]=3 1051 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)Br 7a_100012348304_100000737910 [0,1,0,0,0,1|0,1,0]=3 1052 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)C 34a_100000703630_100000737910 [0,1,0,0,0,1|1,0,0]=3 1053 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)C 7a_100000703630_100000737910 [0,1,0,0,0,1|1,0,0]=3 1054 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)F 34a_100010239588_100000737910 [0,1,0,0,0,1|0,1,0]=3 1055 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)F 7a_100010239588_100000737910 [0,1,0,0,0,1|0,1,0]=3 1056 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)I 34a_200015600912_100000737910 [0,1,0,0,0,1|0,1,0]=3 1057 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)I 7a_200015600912_100000737910 [0,1,0,0,0,1|0,1,0]=3 1058 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)O 34a_200010235796_100000737910 [0,1,0,0,0,1|1,0,0]=3 1059 B17R2.42397 Cc1cc(c(cc1Br)NCC2=NCCN2)O 7a_200010235796_100000737910 [0,1,0,0,0,1|1,0,0]=3 1060 B17R2.42397 Cc1cc(c(cc1Br)O)NCC2=NCCN2 34a_200010107346_100000737910 [0,1,0,0,0,1|2,0,0]=4 1061 B17R2.42397 Cc1cc(c(cc1Br)OCC2=NCCN2)F 34a_100010068922_100000737910 [0,1,0,0,0,1|1,1,0]=4 1062 B17R2.42397 Cc1cc(c(cc1Br)OCC2=NCCN2)F 7a_100010068922_100000737910 [0,1,0,0,0,1|1,1,0]=4 1063 B17R2.42397 Cc1cc(c(cc1Br)OCC2=NCCN2)N 34a_200010107346_100000737910 [0,1,0,0,0,1|2,0,0]=4 1064 B17R2.42397 Cc1cc(c(cc1Br)OCC2=NCCN2)N 7a_200010107346_100000737910 [0,1,0,0,0,1|2,0,0]=4 1065 B17R2.42397 Cc1cc(c(cc1Br)SCC2=NCCN2)Br 62a_100000737910_100012929169 [0,1,0,0,0,1|1,1,0]=4 1066 B17R2.42397 Cc1cc(c(cc1Br)SCC2=NCCN2)Br 62a_100012929169_100000737910 [0,1,0,0,0,1|1,1,0]=4 1067 B17R2.42397 Cc1cc(c(cc1Br)SCC2=NCCN2)F 62a_100000737910_100011068846 [0,1,0,0,0,1|1,1,0]=4 1068 B17R2.42397 Cc1cc(c(cc1Br)SCC2=NCCN2)F 62a_100011068846_100000737910 [0,1,0,0,0,1|1,1,0]=4 1069 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)Br 34a_100012337760_100000737910 [0,1,0,0,0,1|0,1,0]=3 1070 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)Br 7a_100012337760_100000737910 [0,1,0,0,0,1|0,1,0]=3 1071 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)C 34a_100011217141_100000737910 [0,1,0,0,0,1|1,0,0]=3 1072 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)C 7a_100011217141_100000737910 [0,1,0,0,0,1|1,0,0]=3 1073 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)Cl 34a_100012183282_100000737910 [0,1,0,0,0,1|0,0,0]=2 1074 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)Cl 7a_100012183282_100000737910 [0,1,0,0,0,1|0,0,0]=2 1075 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)I 34a_100012353678_100000737910 [0,1,0,0,0,1|0,1,0]=3 1076 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)I 7a_100012353678_100000737910 [0,1,0,0,0,1|0,1,0]=3 1077 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)O 34a_100133014134_100000737910 [0,1,0,0,0,1|1,0,0]=3 1078 B17R2.42397 Cc1cc(c(cc1C)NCC2=NCCN2)O 7a_100133014134_100000737910 [0,1,0,0,0,1|1,0,0]=3 1079 B17R2.42397 Cc1cc(c(cc1C)NCc2ncc[nH]2)Cl 207a_100012183282_100000743867 [0,1,0,0,0,1|0,0,2]=4 1080 B17R2.42397 Cc1cc(c(cc1C)NCc2ncc[nH]2)Cl 34a_100012183282_100016991755 [0,1,0,0,0,1|0,0,2]=4 1081 B17R2.42397 Cc1cc(c(cc1C)NCc2ncc[nH]2)Cl 7a_100012183282_100000753453 [0,1,0,0,0,1|0,0,2]=4 1082 B17R2.42397 Cc1cc(c(cc1C)NCc2nnn[nH]2)Cl 34a_100012183282_100000765167 [0,1,0,0,0,1|2,0,0]=4 1083 B17R2.42397 Cc1cc(c(cc1C)NCc2nnn[nH]2)Cl 7a_100012183282_100000765167 [0,1,0,0,0,1|2,0,0]=4 1084 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)Br 34a_100009814663_100000737910 [0,1,0,0,0,1|1,1,0]=4 1085 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)Br 7a_100009814663_100000737910 [0,1,0,0,0,1|1,1,0]=4 1086 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)C 34a_200000047129_100000737910 [0,1,0,0,0,1|2,0,0]=4 1087 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)C 7a_200000047129_100000737910 [0,1,0,0,0,1|2,0,0]=4 1088 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)Cl 34a_100000031796_100000737910 [0,1,0,0,0,1|1,0,0]=3 1089 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)Cl 7a_100000031796_100000737910 [0,1,0,0,0,1|1,0,0]=3 1090 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)N 34a_100133014134_100000737910 [0,1,0,0,0,1|2,0,0]=4 1091 B17R2.42397 Cc1cc(c(cc1C)OCC2=NCCN2)N 7a_100133014134_100000737910 [0,1,0,0,0,1|2,0,0]=4 1092 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)C 62a_100000737910_100000759388 [0,1,0,0,0,1|2,0,0]=4 1093 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)C 62a_100000759388_100000737910 [0,1,0,0,0,1|2,0,0]=4 1094 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)F 62a_100000737910_100010197417 [0,1,0,0,0,1|1,1,0]=4 1095 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)F 62a_100010197417_100000737910 [0,1,0,0,0,1|1,1,0]=4 1096 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)N 62a_100000737910_100012337760 [0,1,0,0,0,1|2,0,0]=4 1097 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)N 62a_100012337760_100000737910 [0,1,0,0,0,1|2,0,0]=4 1098 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)O 62a_100000737910_100009814663 [0,1,0,0,0,1|2,0,0]=4 1099 B17R2.42397 Cc1cc(c(cc1C)SCC2=NCCN2)O 62a_100009814663_100000737910 [0,1,0,0,0,1|2,0,0]=4 1100 B17R2.42397 Cc1cc(c(cc1Cl)C)NCC2=NCCN2 34a_100011830454_100000737910 [0,1,0,0,0,1|2,0,0]=4 1101 B17R2.42397 Cc1cc(c(cc1Cl)C)NCC2=NCCN2 7a_100011830454_100000737910 [0,1,0,0,0,1|2,0,0]=4 1102 B17R2.42397 Cc1cc(c(cc1Cl)Cl)NCC2=NCCN2 34a_100012000392_100000737910 [0,1,0,0,0,1|1,0,0]=3 1103 B17R2.42397 Cc1cc(c(cc1Cl)Cl)NCC2=NCCN2 7a_100012000392_100000737910 [0,1,0,0,0,1|1,0,0]=3 1104 B17R2.42397 Cc1cc(c(cc1Cl)Cl)OCC2=NCCN2 34a_100012002691_100000737910 [0,1,0,0,0,1|2,0,0]=4 1105 B17R2.42397 Cc1cc(c(cc1Cl)Cl)OCC2=NCCN2 7a_100012002691_100000737910 [0,1,0,0,0,1|2,0,0]=4 1106 B17R2.42397 Cc1cc(c(cc1Cl)F)NCC2=NCCN2 34a_100000091823_100000737910 [0,1,0,0,0,1|1,1,0]=4 1107 B17R2.42397 Cc1cc(c(cc1Cl)F)NCC2=NCCN2 7a_100000091823_100000737910 [0,1,0,0,0,1|1,1,0]=4 1108 B17R2.42397 Cc1cc(c(cc1Cl)NCC2=NCCN2)Br 34a_100000702286_100000737910 [0,1,0,0,0,1|0,1,0]=3 1109 B17R2.42397 Cc1cc(c(cc1Cl)NCC2=NCCN2)Br 7a_100000702286_100000737910 [0,1,0,0,0,1|0,1,0]=3 1110 B17R2.42397 Cc1cc(c(cc1Cl)NCC2=NCCN2)O 34a_100000091707_100000737910 [0,1,0,0,0,1|1,0,0]=3 1111 B17R2.42397 Cc1cc(c(cc1F)Br)NCC2=NCCN2 34a_100010233353_100000737910 [0,1,0,0,0,1|1,1,0]=4 1112 B17R2.42397 Cc1cc(c(cc1F)Br)NCC2=NCCN2 7a_100010233353_100000737910 [0,1,0,0,0,1|1,1,0]=4 1113 B17R2.42397 Cc1cc(c(cc1F)Cl)NCC2=NCCN2 34a_100000729549_100000737910 [0,1,0,0,0,1|1,0,0]=3 1114 B17R2.42397 Cc1cc(c(cc1F)Cl)NCC2=NCCN2 7a_100000729549_100000737910 [0,1,0,0,0,1|1,0,0]=3 1115 B17R2.42397 Cc1cc(c(cc1F)I)NCC2=NCCN2 34a_100010238302_100000737910 [0,1,0,0,0,1|1,1,0]=4 1116 B17R2.42397 Cc1cc(c(cc1F)I)NCC2=NCCN2 7a_100010238302_100000737910 [0,1,0,0,0,1|1,1,0]=4 1117 B17R2.42397 Cc1cc(c(cc1F)NCC2=NCCN2)Br 34a_100011218008_100000737910 [0,1,0,0,0,1|0,1,0]=3 1118 B17R2.42397 Cc1cc(c(cc1F)NCC2=NCCN2)Br 7a_100011218008_100000737910 [0,1,0,0,0,1|0,1,0]=3 1119 B17R2.42397 Cc1cc(c(cc1F)NCC2=NCCN2)F 34a_100012002673_100000737910 [0,1,0,0,0,1|0,1,0]=3 1120 B17R2.42397 Cc1cc(c(cc1F)NCC2=NCCN2)F 7a_100012002673_100000737910 [0,1,0,0,0,1|0,1,0]=3 1121 B17R2.42397 Cc1cc(c(cc1F)O)NCC2=NCCN2 34a_100012022779_100000737910 [0,1,0,0,0,1|2,0,0]=4 1122 B17R2.42397 Cc1cc(c(cc1F)O)NCC2=NCCN2 7a_100012022779_100000737910 [0,1,0,0,0,1|2,0,0]=4 1123 B17R2.42397 Cc1cc(c(cc1F)OCC2=NCCN2)N 34a_100012022779_100000737910 [0,1,0,0,0,1|2,0,0]=4 1124 B17R2.42397 Cc1cc(c(cc1F)OCC2=NCCN2)N 7a_100012022779_100000737910 [0,1,0,0,0,1|2,0,0]=4 1125 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)Br 62a_100000737910_200009814774 [0,1,0,0,0,1|1,1,0]=4 1126 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)Br 62a_200009814774_100000737910 [0,1,0,0,0,1|1,1,0]=4 1127 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)F 62a_100000737910_100011219510 [0,1,0,0,0,1|1,1,0]=4 1128 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)F 62a_100011219510_100000737910 [0,1,0,0,0,1|1,1,0]=4 1129 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)N 62a_100000737910_100010233353 [0,1,0,0,0,1|2,0,0]=4 1130 B17R2.42397 Cc1cc(c(cc1F)SCC2=NCCN2)N 62a_100010233353_100000737910 [0,1,0,0,0,1|2,0,0]=4 1131 B17R2.42397 Cc1cc(c(cc1I)NCC2=NCCN2)F 34a_100011014115_100000737910 [0,1,0,0,0,1|0,1,0]=3 1132 B17R2.42397 Cc1cc(c(cc1I)NCC2=NCCN2)F 7a_100011014115_100000737910 [0,1,0,0,0,1|0,1,0]=3 1133 B17R2.42397 Cc1cc(c(cc1N)OCC2=NCCN2)Cl 34a_100009961766_100000737910 [0,1,0,0,0,1|1,0,0]=3 1134 B17R2.42397 Cc1cc(c(cc1N)OCC2=NCCN2)Cl 7a_100009961766_100000737910 [0,1,0,0,0,1|1,0,0]=3 1135 B17R2.42397 Cc1cc(c(cc1N)SCC2=NCCN2)C 62a_100000703630_100000737910 [0,1,0,0,0,1|2,0,0]=4 1136 B17R2.42397 Cc1cc(c(cc1N)SCC2=NCCN2)C 62a_100000737910_100000703630 [0,1,0,0,0,1|2,0,0]=4 1137 B17R2.42397 Cc1cc(c(cc1N)SCC2=NCCN2)F 62a_100000717900_100000737910 [0,1,0,0,0,1|1,1,0]=4 1138 B17R2.42397 Cc1cc(c(cc1N)SCC2=NCCN2)F 62a_100000737910_100000717900 [0,1,0,0,0,1|1,1,0]=4 1139 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Br)Cl 34a_100010244688_100000737910 [0,1,0,0,0,1|2,0,0]=4 1140 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Br)Cl 7a_100010244688_100000737910 [0,1,0,0,0,1|2,0,0]=4 1141 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Br)F 34a_100000717900_100000737910 [0,1,0,0,0,1|2,0,0]=4 1142 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Br)F 7a_100000717900_100000737910 [0,1,0,0,0,1|2,0,0]=4 1143 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)Br 34a_100012353740_100000737910 [0,1,0,0,0,1|2,0,0]=4 1144 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)Br 7a_100012353740_100000737910 [0,1,0,0,0,1|2,0,0]=4 1145 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)Cl 34a_100012017293_100000737910 [0,1,0,0,0,1|2,0,0]=4 1146 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)Cl 7a_100012017293_100000737910 [0,1,0,0,0,1|2,0,0]=4 1147 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)F 34a_100012017673_100000737910 [0,1,0,0,0,1|2,0,0]=4 1148 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)Cl)F 7a_100012017673_100000737910 [0,1,0,0,0,1|2,0,0]=4 1149 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)Br 34a_100000695870_100000737910 [0,1,0,0,0,1|2,0,0]=4 1150 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)Br 7a_100000695870_100000737910 [0,1,0,0,0,1|2,0,0]=4 1151 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)F 34a_100011830416_100000737910 [0,1,0,0,0,1|2,0,0]=4 1152 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)F 7a_100011830416_100000737910 [0,1,0,0,0,1|2,0,0]=4 1153 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)I 34a_100010291052_100000737910 [0,1,0,0,0,1|2,0,0]=4 1154 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)F)I 7a_100010291052_100000737910 [0,1,0,0,0,1|2,0,0]=4 1155 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)O)Cl 34a_100009961766_100000737910 [0,1,0,0,0,1|2,0,0]=4 1156 B17R2.42397 Cc1cc(c(cc1NCC2=NCCN2)O)Cl 7a_100009961766_100000737910 [0,1,0,0,0,1|2,0,0]=4 1157 B17R2.42397 Cc1cc(c(cc1O)C)NCC2=NCCN2 34a_100000720036_100000737910 [0,1,0,0,0,1|2,0,0]=4 1158 B17R2.42397 Cc1cc(c(cc1O)C)NCC2=NCCN2 7a_100000720036_100000737910 [0,1,0,0,0,1|2,0,0]=4 1159 B17R2.42397 Cc1cc(c(cc1O)NCC2=NCCN2)Cl 34a_100000092876_100000737910 [0,1,0,0,0,1|0,0,0]=2 1160 B17R2.42397 Cc1cc(c(cc1O)NCC2=NCCN2)Cl 7a_100000092876_100000737910 [0,1,0,0,0,1|0,0,0]=2 1161 B17R2.42397 Cc1cc(c(cc1O)NCC2=NCCN2)F 34a_100000117193_100000737910 [0,1,0,0,0,1|0,1,0]=3 1162 B17R2.42397 Cc1cc(c(cc1O)NCC2=NCCN2)F 7a_100000117193_100000737910 [0,1,0,0,0,1|0,1,0]=3 1163 B17R2.42397 Cc1cc(c(cc1O)NCc2ncc[nH]2)Cl 34a_100000092876_100016991755 [0,1,0,0,0,1|0,0,2]=4 1164 B17R2.42397 Cc1cc(c(cc1O)NCc2ncc[nH]2)Cl 7a_100000092876_100000753453 [0,1,0,0,0,1|0,0,2]=4 1165 B17R2.42397 Cc1cc(c(cc1O)NCc2nnn[nH]2)Cl 34a_100000092876_100000765167 [0,1,0,0,0,1|2,0,0]=4 1166 B17R2.42397 Cc1cc(c(cc1O)NCc2nnn[nH]2)Cl 7a_100000092876_100000765167 [0,1,0,0,0,1|2,0,0]=4 1167 B17R2.42397 Cc1cc(c(cc1O)SCC2=NCCN2)F 62a_100000737910_100014242602 [0,1,0,0,0,1|1,1,0]=4 1168 B17R2.42397 Cc1cc(c(cc1O)SCC2=NCCN2)F 62a_100014242602_100000737910 [0,1,0,0,0,1|1,1,0]=4 1169 B17R2.42397 Clc1cc(c(cc1Br)Cl)NCC2=NCCN2 34a_100000246133_100000737910 [0,1,0,0,0,1|1,0,0]=3 1170 B17R2.42397 Clc1cc(c(cc1Br)Cl)NCC2=NCCN2 7a_100000246133_100000737910 [0,1,0,0,0,1|1,0,0]=3 1171 B17R2.42397 Clc1cc(c(cc1Br)Cl)OCC2=NCCN2 34a_100000719705_100000737910 [0,1,0,0,0,1|2,0,0]=4 1172 B17R2.42397 Clc1cc(c(cc1Br)Cl)OCC2=NCCN2 7a_100000719705_100000737910 [0,1,0,0,0,1|2,0,0]=4 1173 B17R2.42397 Clc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_100000737910_200010244590 [0,1,0,0,0,1|2,0,0]=4 1174 B17R2.42397 Clc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_200010244590_100000737910 [0,1,0,0,0,1|2,0,0]=4 1175 B17R2.42397 Clc1cc(c(cc1Br)NCC2=NCCN2)Cl 34a_200012360370_100000737910 [0,1,0,0,0,1|1,0,0]=3 1176 B17R2.42397 Clc1cc(c(cc1Br)NCC2=NCCN2)Cl 7a_200012360370_100000737910 [0,1,0,0,0,1|1,0,0]=3 1177 B17R2.42397 Clc1cc(c(cc1Br)OCC2=NCCN2)Cl 34a_100010203734_100000737910 [0,1,0,0,0,1|2,0,0]=4 1178 B17R2.42397 Clc1cc(c(cc1Br)OCC2=NCCN2)Cl 7a_100010203734_100000737910 [0,1,0,0,0,1|2,0,0]=4 1179 B17R2.42397 Clc1cc(c(cc1Cl)NCC2=NCCN2)Cl 34a_100000211015_100000737910 [0,1,0,0,0,1|1,0,0]=3 1180 B17R2.42397 Clc1cc(c(cc1Cl)NCC2=NCCN2)Cl 7a_100000211015_100000737910 [0,1,0,0,0,1|1,0,0]=3 1181 B17R2.42397 Clc1cc(c(cc1Cl)NCC2=NCCN2)I 7a_200011093942_100000737910 [0,1,0,0,0,1|1,1,0]=4 1182 B17R2.42397 Clc1cc(c(cc1Cl)OCC2=NCCN2)Cl 34a_100000211312_100000737910 [0,1,0,0,0,1|2,0,0]=4 1183 B17R2.42397 Clc1cc(c(cc1Cl)OCC2=NCCN2)Cl 7a_100000211312_100000737910 [0,1,0,0,0,1|2,0,0]=4 1184 B17R2.42397 Clc1cc(c(cc1Cl)SCC2=NCCN2)Cl 62a_100000737910_200011216203 [0,1,0,0,0,1|2,0,0]=4 1185 B17R2.42397 Clc1cc(c(cc1Cl)SCC2=NCCN2)Cl 62a_200011216203_100000737910 [0,1,0,0,0,1|2,0,0]=4 1186 B17R2.42397 Clc1cc(c(cc1I)NCC2=NCCN2)Cl 7a_100016224655_100000737910 [0,1,0,0,0,1|1,0,0]=3 1187 B17R2.42397 Clc1cc(c(cc1OCC2=NCCN2)I)Br 34a_100021297947_100000737910 [0,1,0,0,0,1|2,0,0]=4 1188 B17R2.42397 Clc1cc(c(cc1OCC2=NCCN2)I)Br 7a_100021297947_100000737910 [0,1,0,0,0,1|2,0,0]=4 1189 B17R2.42397 Fc1cc(c(cc1Br)Br)NCC2=NCCN2 34a_100010212202_100000737910 [0,1,0,0,0,1|1,1,0]=4 1190 B17R2.42397 Fc1cc(c(cc1Br)Br)NCC2=NCCN2 7a_100010212202_100000737910 [0,1,0,0,0,1|1,1,0]=4 1191 B17R2.42397 Fc1cc(c(cc1Br)Cl)NCC2=NCCN2 34a_100000688864_100000737910 [0,1,0,0,0,1|1,0,0]=3 1192 B17R2.42397 Fc1cc(c(cc1Br)Cl)NCC2=NCCN2 7a_100000688864_100000737910 [0,1,0,0,0,1|1,0,0]=3 1193 B17R2.42397 Fc1cc(c(cc1Br)Cl)OCC2=NCCN2 34a_100000726166_100000737910 [0,1,0,0,0,1|2,0,0]=4 1194 B17R2.42397 Fc1cc(c(cc1Br)Cl)OCC2=NCCN2 7a_100000726166_100000737910 [0,1,0,0,0,1|2,0,0]=4 1195 B17R2.42397 Fc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_100000737910_100010212230 [0,1,0,0,0,1|2,0,0]=4 1196 B17R2.42397 Fc1cc(c(cc1Br)Cl)SCC2=NCCN2 62a_100010212230_100000737910 [0,1,0,0,0,1|2,0,0]=4 1197 B17R2.42397 Fc1cc(c(cc1Br)F)NCC2=NCCN2 34a_100000690247_100000737910 [0,1,0,0,0,1|1,1,0]=4 1198 B17R2.42397 Fc1cc(c(cc1Br)F)NCC2=NCCN2 7a_100000690247_100000737910 [0,1,0,0,0,1|1,1,0]=4 1199 B17R2.42397 Fc1cc(c(cc1Br)I)NCC2=NCCN2 34a_100010888672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1200 B17R2.42397 Fc1cc(c(cc1Br)I)NCC2=NCCN2 7a_100010888672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1201 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)Br 34a_100010131408_100000737910 [0,1,0,0,0,1|1,1,0]=4 1202 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)Br 7a_100010131408_100000737910 [0,1,0,0,0,1|1,1,0]=4 1203 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)Cl 34a_100000685351_100000737910 [0,1,0,0,0,1|1,0,0]=3 1204 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)Cl 7a_100000685351_100000737910 [0,1,0,0,0,1|1,0,0]=3 1205 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)F 34a_100000700208_100000737910 [0,1,0,0,0,1|1,1,0]=4 1206 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)F 7a_100000700208_100000737910 [0,1,0,0,0,1|1,1,0]=4 1207 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)I 34a_200021016574_100000737910 [0,1,0,0,0,1|1,1,0]=4 1208 B17R2.42397 Fc1cc(c(cc1Br)NCC2=NCCN2)I 7a_200021016574_100000737910 [0,1,0,0,0,1|1,1,0]=4 1209 B17R2.42397 Fc1cc(c(cc1Br)OCC2=NCCN2)Cl 34a_100010189047_100000737910 [0,1,0,0,0,1|2,0,0]=4 1210 B17R2.42397 Fc1cc(c(cc1Br)OCC2=NCCN2)Cl 7a_100010189047_100000737910 [0,1,0,0,0,1|2,0,0]=4 1211 B17R2.42397 Fc1cc(c(cc1Cl)Br)NCC2=NCCN2 34a_100010254744_100000737910 [0,1,0,0,0,1|1,1,0]=4 1212 B17R2.42397 Fc1cc(c(cc1Cl)Br)NCC2=NCCN2 7a_100010254744_100000737910 [0,1,0,0,0,1|1,1,0]=4 1213 B17R2.42397 Fc1cc(c(cc1Cl)Cl)NCC2=NCCN2 34a_100012017157_100000737910 [0,1,0,0,0,1|1,0,0]=3 1214 B17R2.42397 Fc1cc(c(cc1Cl)Cl)NCC2=NCCN2 7a_100012017157_100000737910 [0,1,0,0,0,1|1,0,0]=3 1215 B17R2.42397 Fc1cc(c(cc1Cl)F)NCC2=NCCN2 34a_100011998097_100000737910 [0,1,0,0,0,1|1,1,0]=4 1216 B17R2.42397 Fc1cc(c(cc1Cl)F)NCC2=NCCN2 7a_100011998097_100000737910 [0,1,0,0,0,1|1,1,0]=4 1217 B17R2.42397 Fc1cc(c(cc1Cl)I)NCC2=NCCN2 34a_100010892166_100000737910 [0,1,0,0,0,1|1,1,0]=4 1218 B17R2.42397 Fc1cc(c(cc1Cl)I)NCC2=NCCN2 7a_100010892166_100000737910 [0,1,0,0,0,1|1,1,0]=4 1219 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)Br 34a_100009817155_100000737910 [0,1,0,0,0,1|1,1,0]=4 1220 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)Br 7a_100009817155_100000737910 [0,1,0,0,0,1|1,1,0]=4 1221 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)Cl 34a_100000085081_100000737910 [0,1,0,0,0,1|1,0,0]=3 1222 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)Cl 7a_100000085081_100000737910 [0,1,0,0,0,1|1,0,0]=3 1223 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)F 34a_100011998096_100000737910 [0,1,0,0,0,1|1,1,0]=4 1224 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)F 7a_100011998096_100000737910 [0,1,0,0,0,1|1,1,0]=4 1225 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)I 34a_200010992381_100000737910 [0,1,0,0,0,1|1,1,0]=4 1226 B17R2.42397 Fc1cc(c(cc1Cl)NCC2=NCCN2)I 7a_200010992381_100000737910 [0,1,0,0,0,1|1,1,0]=4 1227 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)Br 34a_100000690790_100000737910 [0,1,0,0,0,1|1,1,0]=4 1228 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)Br 7a_100000690790_100000737910 [0,1,0,0,0,1|1,1,0]=4 1229 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)Cl 34a_100000766337_100000737910 [0,1,0,0,0,1|1,0,0]=3 1230 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)Cl 7a_100000766337_100000737910 [0,1,0,0,0,1|1,0,0]=3 1231 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)F 34a_100000750162_100000737910 [0,1,0,0,0,1|1,1,0]=4 1232 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)F 7a_100000750162_100000737910 [0,1,0,0,0,1|1,1,0]=4 1233 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)I 34a_100000765032_100000737910 [0,1,0,0,0,1|1,1,0]=4 1234 B17R2.42397 Fc1cc(c(cc1F)NCC2=NCCN2)I 7a_100000765032_100000737910 [0,1,0,0,0,1|1,1,0]=4 1235 B17R2.42397 Fc1cc(c(cc1F)OCC2=NCCN2)Cl 34a_100009848785_100000737910 [0,1,0,0,0,1|2,0,0]=4 1236 B17R2.42397 Fc1cc(c(cc1F)OCC2=NCCN2)Cl 7a_100009848785_100000737910 [0,1,0,0,0,1|2,0,0]=4 1237 B17R2.42397 Fc1cc(c(cc1F)SCC2=NCCN2)Cl 62a_100000737910_100012349977 [0,1,0,0,0,1|2,0,0]=4 1238 B17R2.42397 Fc1cc(c(cc1F)SCC2=NCCN2)Cl 62a_100012349977_100000737910 [0,1,0,0,0,1|2,0,0]=4 1239 B17R2.42397 Fc1cc(c(cc1I)F)NCC2=NCCN2 34a_100010185194_100000737910 [0,1,0,0,0,1|1,1,0]=4 1240 B17R2.42397 Fc1cc(c(cc1I)F)NCC2=NCCN2 7a_100010185194_100000737910 [0,1,0,0,0,1|1,1,0]=4 1241 B17R2.42397 Fc1cc(c(cc1I)OCC2=NCCN2)Cl 34a_100010735246_100000737910 [0,1,0,0,0,1|2,0,0]=4 1242 B17R2.42397 Fc1cc(c(cc1I)OCC2=NCCN2)Cl 7a_100010735246_100000737910 [0,1,0,0,0,1|2,0,0]=4 1243 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Br)Br 34a_200010212207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1244 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Br)Br 7a_200010212207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1245 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Br)Cl 34a_100013023876_100000737910 [0,1,0,0,0,1|1,1,0]=4 1246 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Br)Cl 7a_100013023876_100000737910 [0,1,0,0,0,1|1,1,0]=4 1247 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Cl)Br 34a_100012356688_100000737910 [0,1,0,0,0,1|1,1,0]=4 1248 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Cl)Br 7a_100012356688_100000737910 [0,1,0,0,0,1|1,1,0]=4 1249 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Cl)Cl 34a_100000724578_100000737910 [0,1,0,0,0,1|1,1,0]=4 1250 B17R2.42397 Fc1cc(c(cc1NCC2=NCCN2)Cl)Cl 7a_100000724578_100000737910 [0,1,0,0,0,1|1,1,0]=4 1251 B17R2.42397 Nc1cc(c(cc1Cl)Cl)OCC2=NCCN2 34a_100000037174_100000737910 [0,1,0,0,0,1|2,0,0]=4 1252 B17R2.42397 Nc1cc(c(cc1Cl)Cl)OCC2=NCCN2 7a_100000037174_100000737910 [0,1,0,0,0,1|2,0,0]=4 1253 B17R2.42397 Nc1cc(c(cc1Cl)Cl)SCC2=NCCN2 62a_100000737910_100016224655 [0,1,0,0,0,1|2,0,0]=4 1254 B17R2.42397 Nc1cc(c(cc1Cl)Cl)SCC2=NCCN2 62a_100016224655_100000737910 [0,1,0,0,0,1|2,0,0]=4 1255 B17R2.42397 Nc1cc(c(cc1Cl)OCC2=NCCN2)Cl 34a_100012000071_100000737910 [0,1,0,0,0,1|2,0,0]=4 1256 B17R2.42397 Nc1cc(c(cc1Cl)OCC2=NCCN2)Cl 7a_100012000071_100000737910 [0,1,0,0,0,1|2,0,0]=4 1257 B17R2.42397 Nc1cc(c(cc1F)Cl)OCC2=NCCN2 34a_100000042052_100000737910 [0,1,0,0,0,1|2,0,0]=4 1258 B17R2.42397 Nc1cc(c(cc1F)Cl)OCC2=NCCN2 7a_100000042052_100000737910 [0,1,0,0,0,1|2,0,0]=4 1259 B17R2.42397 Nc1cc(c(cc1O)Cl)SCC2=NCCN2 62a_100000737910_100011011175 [0,1,0,0,0,1|2,0,0]=4 1260 B17R2.42397 Nc1cc(c(cc1O)Cl)SCC2=NCCN2 62a_100011011175_100000737910 [0,1,0,0,0,1|2,0,0]=4 1261 B17R2.42397 Oc1cc(c(cc1Br)NCC2=NCCN2)Br 34a_100011080774_100000737910 [0,1,0,0,0,1|1,1,0]=4 1262 B17R2.42397 Oc1cc(c(cc1Br)NCC2=NCCN2)Br 7a_100011080774_100000737910 [0,1,0,0,0,1|1,1,0]=4 1263 B17R2.42397 Oc1cc(c(cc1Cl)Cl)NCC2=NCCN2 34a_100000037174_100000737910 [0,1,0,0,0,1|1,0,0]=3 1264 B17R2.42397 Oc1cc(c(cc1Cl)Cl)NCC2=NCCN2 7a_100000037174_100000737910 [0,1,0,0,0,1|1,0,0]=3 1265 B17R2.42397 Oc1cc(c(cc1Cl)F)NCC2=NCCN2 34a_100000042052_100000737910 [0,1,0,0,0,1|1,1,0]=4 1266 B17R2.42397 Oc1cc(c(cc1Cl)F)NCC2=NCCN2 7a_100000042052_100000737910 [0,1,0,0,0,1|1,1,0]=4 1267 B17R2.42397 Oc1cc(c(cc1Cl)NCC2=NCCN2)Cl 34a_100012000071_100000737910 [0,1,0,0,0,1|1,0,0]=3 1268 B17R2.42397 Oc1cc(c(cc1Cl)NCC2=NCCN2)Cl 7a_100012000071_100000737910 [0,1,0,0,0,1|1,0,0]=3 1269 B17R2.42397 Oc1cc(c(cc1F)F)NCC2=NCCN2 34a_100011219470_100000737910 [0,1,0,0,0,1|1,1,0]=4 1270 B17R2.42397 Oc1cc(c(cc1F)F)NCC2=NCCN2 7a_100011219470_100000737910 [0,1,0,0,0,1|1,1,0]=4 1271 B17R2.42397 Oc1cc(c(cc1F)NCC2=NCCN2)Cl 34a_100009886023_100000737910 [0,1,0,0,0,1|1,0,0]=3 1272 B17R2.42397 Oc1cc(c(cc1F)NCC2=NCCN2)Cl 7a_100009886023_100000737910 [0,1,0,0,0,1|1,0,0]=3 1273 B17R2.42397 Oc1cc(c(cc1F)NCC2=NCCN2)F 34a_100020635945_100000737910 [0,1,0,0,0,1|1,1,0]=4 1274 B17R2.42397 Oc1cc(c(cc1F)NCC2=NCCN2)F 7a_100020635945_100000737910 [0,1,0,0,0,1|1,1,0]=4 1275 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Br)Br 7a_200010781931_100000737910 [0,1,0,0,0,1|2,0,0]=4 1276 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Br)Cl 34a_100013488937_100000737910 [0,1,0,0,0,1|2,0,0]=4 1277 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Br)Cl 7a_100013488937_100000737910 [0,1,0,0,0,1|2,0,0]=4 1278 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Br)F 34a_100012359894_100000737910 [0,1,0,0,0,1|2,0,0]=4 1279 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Br)F 7a_100012359894_100000737910 [0,1,0,0,0,1|2,0,0]=4 1280 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Cl)Cl 34a_100000696747_100000737910 [0,1,0,0,0,1|2,0,0]=4 1281 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)Cl)Cl 7a_100000696747_100000737910 [0,1,0,0,0,1|2,0,0]=4 1282 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)F)Br 34a_100013038943_100000737910 [0,1,0,0,0,1|2,0,0]=4 1283 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)F)Br 7a_100013038943_100000737910 [0,1,0,0,0,1|2,0,0]=4 1284 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)F)F 34a_106722365970_100000737910 [0,1,0,0,0,1|2,0,0]=4 1285 B17R2.42397 Oc1cc(c(cc1NCC2=NCCN2)F)F 7a_106722365970_100000737910 [0,1,0,0,0,1|2,0,0]=4 1286 B17R2.42550 Brc1ccc(c(c1Br)Br)NCC2=NCCN2 34a_100010151465_100000737910 [0,1,0,0,0,1|1,1,0]=4 1287 B17R2.42550 Cc1c(ccc(c1Br)Br)NCC2=NCCN2 34a_100010244494_100000737910 [0,1,0,0,0,1|2,0,0]=4 1288 B17R2.42550 Cc1c(ccc(c1Br)Br)NCC2=NCCN2 7a_100010244494_100000737910 [0,1,0,0,0,1|2,0,0]=4 1289 B17R2.42550 Cc1c(ccc(c1Br)Cl)NCC2=NCCN2 34a_100016073598_100000737910 [0,1,0,0,0,1|2,0,0]=4 1290 B17R2.42550 Cc1c(ccc(c1Br)Cl)NCC2=NCCN2 7a_100016073598_100000737910 [0,1,0,0,0,1|2,0,0]=4 1291 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)Br 34a_100009816967_100000737910 [0,1,0,0,0,1|2,0,0]=4 1292 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)Br 7a_100009816967_100000737910 [0,1,0,0,0,1|2,0,0]=4 1293 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)F 34a_100000062172_100000737910 [0,1,0,0,0,1|2,0,0]=4 1294 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)F 7a_100000062172_100000737910 [0,1,0,0,0,1|2,0,0]=4 1295 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)O 34a_200011216674_100000737910 [0,1,0,0,0,1|2,0,0]=4 1296 B17R2.42550 Cc1c(ccc(c1C)NCC2=NCCN2)O 7a_200011216674_100000737910 [0,1,0,0,0,1|2,0,0]=4 1297 B17R2.42550 Cc1c(ccc(c1Cl)Br)NCC2=NCCN2 34a_100009816872_100000737910 [0,1,0,0,0,1|2,0,0]=4 1298 B17R2.42550 Cc1c(ccc(c1Cl)Br)NCC2=NCCN2 7a_100009816872_100000737910 [0,1,0,0,0,1|2,0,0]=4 1299 B17R2.42550 Cc1c(ccc(c1Cl)Cl)NCC2=NCCN2 34a_114948340058_100000737910 [0,1,0,0,0,1|2,0,0]=4 1300 B17R2.42550 Cc1c(ccc(c1Cl)Cl)NCC2=NCCN2 7a_114948340058_100000737910 [0,1,0,0,0,1|2,0,0]=4 1301 B17R2.42550 Cc1c(ccc(c1Cl)NCC2=NCCN2)Cl 34a_100011935240_100000737910 [0,1,0,0,0,1|1,0,0]=3 1302 B17R2.42550 Cc1c(ccc(c1Cl)NCC2=NCCN2)Cl 7a_100011935240_100000737910 [0,1,0,0,0,1|1,0,0]=3 1303 B17R2.42550 Cc1c(ccc(c1Cl)NCC2=NCCN2)F 34a_100009863382_100000737910 [0,1,0,0,0,1|1,0,0]=3 1304 B17R2.42550 Cc1c(ccc(c1Cl)NCC2=NCCN2)F 7a_100009863382_100000737910 [0,1,0,0,0,1|1,0,0]=3 1305 B17R2.42550 Cc1c(ccc(c1Cl)OCC2=NCCN2)Br 34a_100021574527_100000737910 [0,1,0,0,0,1|2,0,0]=4 1306 B17R2.42550 Cc1c(ccc(c1Cl)OCC2=NCCN2)Br 7a_100021574527_100000737910 [0,1,0,0,0,1|2,0,0]=4 1307 B17R2.42550 Cc1c(ccc(c1Cl)SCC2=NCCN2)Br 62a_100000737910_100055076181 [0,1,0,0,0,1|2,0,0]=4 1308 B17R2.42550 Cc1c(ccc(c1Cl)SCC2=NCCN2)Br 62a_100055076181_100000737910 [0,1,0,0,0,1|2,0,0]=4 1309 B17R2.42550 Cc1c(ccc(c1Cl)SCC2=NCCN2)Cl 62a_100000737910_100010730154 [0,1,0,0,0,1|2,0,0]=4 1310 B17R2.42550 Cc1c(ccc(c1Cl)SCC2=NCCN2)Cl 62a_100010730154_100000737910 [0,1,0,0,0,1|2,0,0]=4 1311 B17R2.42550 Cc1c(ccc(c1F)Br)NCC2=NCCN2 34a_100010208198_100000737910 [0,1,0,0,0,1|2,0,0]=4 1312 B17R2.42550 Cc1c(ccc(c1F)Br)NCC2=NCCN2 7a_100010208198_100000737910 [0,1,0,0,0,1|2,0,0]=4 1313 B17R2.42550 Cc1c(ccc(c1F)I)NCC2=NCCN2 34a_100010291050_100000737910 [0,1,0,0,0,1|2,0,0]=4 1314 B17R2.42550 Cc1c(ccc(c1F)I)NCC2=NCCN2 7a_100010291050_100000737910 [0,1,0,0,0,1|2,0,0]=4 1315 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)Br 34a_100000722916_100000737910 [0,1,0,0,0,1|1,1,0]=4 1316 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)Br 7a_100000722916_100000737910 [0,1,0,0,0,1|1,1,0]=4 1317 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)F 34a_102495366501_100000737910 [0,1,0,0,0,1|1,1,0]=4 1318 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)F 7a_102495366501_100000737910 [0,1,0,0,0,1|1,1,0]=4 1319 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)O 34a_200000126710_100000737910 [0,1,0,0,0,1|1,1,0]=4 1320 B17R2.42550 Cc1c(ccc(c1F)NCC2=NCCN2)O 7a_200000126710_100000737910 [0,1,0,0,0,1|1,1,0]=4 1321 B17R2.42550 Cc1ccc(c(c1Br)C)NCC2=NCCN2 34a_106354213274_100000737910 [0,1,0,0,0,1|1,0,0]=3 1322 B17R2.42550 Cc1ccc(c(c1Br)C)NCC2=NCCN2 7a_106354213274_100000737910 [0,1,0,0,0,1|1,0,0]=3 1323 B17R2.42550 Cc1ccc(c(c1Br)C)OCC2=NCCN2 34a_100010659238_100000737910 [0,1,0,0,0,1|2,0,0]=4 1324 B17R2.42550 Cc1ccc(c(c1Br)C)OCC2=NCCN2 7a_100010659238_100000737910 [0,1,0,0,0,1|2,0,0]=4 1325 B17R2.42550 Cc1ccc(c(c1C)C)NCC2=NCCN2 34a_100000116900_100000737910 [0,1,0,0,0,1|1,0,0]=3 1326 B17R2.42550 Cc1ccc(c(c1C)C)NCC2=NCCN2 7a_100000116900_100000737910 [0,1,0,0,0,1|1,0,0]=3 1327 B17R2.42550 Cc1ccc(c(c1C)F)SCC2=NCCN2 62a_100000737910_200015555822 [0,1,0,0,0,1|1,1,0]=4 1328 B17R2.42550 Cc1ccc(c(c1C)F)SCC2=NCCN2 62a_200015555822_100000737910 [0,1,0,0,0,1|1,1,0]=4 1329 B17R2.42550 Cc1ccc(c(c1Cl)C)NCC2=NCCN2 34a_100009954856_100000737910 [0,1,0,0,0,1|1,0,0]=3 1330 B17R2.42550 Cc1ccc(c(c1Cl)C)NCC2=NCCN2 7a_100009954856_100000737910 [0,1,0,0,0,1|1,0,0]=3 1331 B17R2.42550 Cc1ccc(c(c1F)F)NCC2=NCCN2 34a_100000062217_100000737910 [0,1,0,0,0,1|0,1,0]=3 1332 B17R2.42550 Cc1ccc(c(c1F)F)NCC2=NCCN2 7a_100000062217_100000737910 [0,1,0,0,0,1|0,1,0]=3 1333 B17R2.42550 Cc1ccc(c(c1F)F)OCC2=NCCN2 34a_100000036877_100000737910 [0,1,0,0,0,1|1,1,0]=4 1334 B17R2.42550 Cc1ccc(c(c1F)F)OCC2=NCCN2 7a_100000036877_100000737910 [0,1,0,0,0,1|1,1,0]=4 1335 B17R2.42550 Cc1ccc(c(c1F)F)SCC2=NCCN2 62a_100000737910_100012766498 [0,1,0,0,0,1|1,1,0]=4 1336 B17R2.42550 Cc1ccc(c(c1F)F)SCC2=NCCN2 62a_100012766498_100000737910 [0,1,0,0,0,1|1,1,0]=4 1337 B17R2.42550 Cc1ccc(c(c1F)O)SCC2=NCCN2 62a_100000722096_100000737910 [0,1,0,0,0,1|2,0,0]=4 1338 B17R2.42550 Cc1ccc(c(c1F)O)SCC2=NCCN2 62a_100000737910_100000722096 [0,1,0,0,0,1|2,0,0]=4 1339 B17R2.42550 Cc1ccc(c(c1I)C)NCC2=NCCN2 34a_100011170560_100000737910 [0,1,0,0,0,1|1,0,0]=3 1340 B17R2.42550 Cc1ccc(c(c1I)C)NCC2=NCCN2 7a_100011170560_100000737910 [0,1,0,0,0,1|1,0,0]=3 1341 B17R2.42550 Cc1ccc(c(c1N)C)SCC2=NCCN2 62a_100000737910_200010074581 [0,1,0,0,0,1|2,0,0]=4 1342 B17R2.42550 Cc1ccc(c(c1N)C)SCC2=NCCN2 62a_200010074581_100000737910 [0,1,0,0,0,1|2,0,0]=4 1343 B17R2.42550 Cc1ccc(c(c1O)Cl)NCC2=NCCN2 34a_100000036876_100000737910 [0,1,0,0,0,1|0,0,0]=2 1344 B17R2.42550 Cc1ccc(c(c1O)Cl)NCC2=NCCN2 7a_100000036876_100000737910 [0,1,0,0,0,1|0,0,0]=2 1345 B17R2.42550 Cc1ccc(c(c1O)Cl)NCc2ncc[nH]2 34a_100000036876_100016991755 [0,1,0,0,0,1|0,0,2]=4 1346 B17R2.42550 Cc1ccc(c(c1O)Cl)NCc2ncc[nH]2 7a_100000036876_100000753453 [0,1,0,0,0,1|0,0,2]=4 1347 B17R2.42550 Cc1ccc(c(c1O)Cl)NCc2nnn[nH]2 34a_100000036876_100000765167 [0,1,0,0,0,1|2,0,0]=4 1348 B17R2.42550 Cc1ccc(c(c1O)Cl)NCc2nnn[nH]2 7a_100000036876_100000765167 [0,1,0,0,0,1|2,0,0]=4 1349 B17R2.42550 Clc1c(ccc(c1Cl)NCC2=NCCN2)Br 34a_100000701039_100000737910 [0,1,0,0,0,1|1,0,0]=3 1350 B17R2.42550 Clc1c(ccc(c1Cl)OCC2=NCCN2)Br 34a_100011988769_100000737910 [0,1,0,0,0,1|2,0,0]=4 1351 B17R2.42550 Clc1c(ccc(c1Cl)OCC2=NCCN2)Br 7a_100011988769_100000737910 [0,1,0,0,0,1|2,0,0]=4 1352 B17R2.42550 Clc1c(ccc(c1Cl)SCC2=NCCN2)Br 62a_100000737910_200012356690 [0,1,0,0,0,1|2,0,0]=4 1353 B17R2.42550 Clc1c(ccc(c1Cl)SCC2=NCCN2)Br 62a_200012356690_100000737910 [0,1,0,0,0,1|2,0,0]=4 1354 B17R2.42550 Clc1c(ccc(c1I)NCC2=NCCN2)Br 34a_200010779962_100000737910 [0,1,0,0,0,1|1,1,0]=4 1355 B17R2.42550 Clc1ccc(c(c1Cl)Br)NCC2=NCCN2 34a_100021501213_100000737910 [0,1,0,0,0,1|1,1,0]=4 1356 B17R2.42550 Clc1ccc(c(c1Cl)Cl)NCC2=NCCN2 34a_200000033989_100000737910 [0,1,0,0,0,1|1,0,0]=3 1357 B17R2.42550 Clc1ccc(c(c1Cl)Cl)OCC2=NCCN2 34a_200011215298_100000737910 [0,1,0,0,0,1|2,0,0]=4 1358 B17R2.42550 Clc1ccc(c(c1Cl)Cl)OCC2=NCCN2 7a_200011215298_100000737910 [0,1,0,0,0,1|2,0,0]=4 1359 B17R2.42550 Clc1ccc(c(c1Cl)I)NCC2=NCCN2 34a_200011093878_100000737910 [0,1,0,0,0,1|1,1,0]=4 1360 B17R2.42550 Fc1c(ccc(c1Br)NCC2=NCCN2)I 34a_100015781493_100000737910 [0,1,0,0,0,1|1,1,0]=4 1361 B17R2.42550 Fc1c(ccc(c1Cl)Br)NCC2=NCCN2 34a_100009813730_100000737910 [0,1,0,0,0,1|1,1,0]=4 1362 B17R2.42550 Fc1c(ccc(c1Cl)Cl)NCC2=NCCN2 34a_100000036759_100000737910 [0,1,0,0,0,1|1,1,0]=4 1363 B17R2.42550 Fc1c(ccc(c1Cl)NCC2=NCCN2)Br 34a_100010109752_100000737910 [0,1,0,0,0,1|1,0,0]=3 1364 B17R2.42550 Fc1c(ccc(c1Cl)NCC2=NCCN2)Cl 34a_100000069711_100000737910 [0,1,0,0,0,1|1,0,0]=3 1365 B17R2.42550 Fc1c(ccc(c1Cl)NCC2=NCCN2)Cl 7a_100000069711_100000737910 [0,1,0,0,0,1|1,0,0]=3 1366 B17R2.42550 Fc1c(ccc(c1Cl)OCC2=NCCN2)Br 34a_100010245746_100000737910 [0,1,0,0,0,1|2,0,0]=4 1367 B17R2.42550 Fc1c(ccc(c1Cl)OCC2=NCCN2)Br 7a_100010245746_100000737910 [0,1,0,0,0,1|2,0,0]=4 1368 B17R2.42550 Fc1c(ccc(c1F)NCC2=NCCN2)Br 34a_100010200256_100000737910 [0,1,0,0,0,1|1,1,0]=4 1369 B17R2.42550 Fc1c(ccc(c1F)NCC2=NCCN2)Cl 34a_100000088996_100000737910 [0,1,0,0,0,1|1,1,0]=4 1370 B17R2.42550 Fc1c(ccc(c1F)NCC2=NCCN2)Cl 7a_100000088996_100000737910 [0,1,0,0,0,1|1,1,0]=4 1371 B17R2.42550 Fc1c(ccc(c1F)NCC2=NCCN2)I 34a_100010291506_100000737910 [0,1,0,0,0,1|1,1,0]=4 1372 B17R2.42550 Fc1c(ccc(c1F)NCC2=NCCN2)I 7a_100010291506_100000737910 [0,1,0,0,0,1|1,1,0]=4 1373 B17R2.42550 Fc1c(ccc(c1I)NCC2=NCCN2)Cl 34a_100010134325_100000737910 [0,1,0,0,0,1|1,1,0]=4 1374 B17R2.42550 Fc1ccc(c(c1Br)F)NCC2=NCCN2 34a_100010070858_100000737910 [0,1,0,0,0,1|1,1,0]=4 1375 B17R2.42550 Fc1ccc(c(c1Br)F)NCC2=NCCN2 7a_100010070858_100000737910 [0,1,0,0,0,1|1,1,0]=4 1376 B17R2.42550 Fc1ccc(c(c1Br)I)NCC2=NCCN2 34a_100020765651_100000737910 [0,1,0,0,0,1|1,1,0]=4 1377 B17R2.42550 Fc1ccc(c(c1Cl)Cl)NCC2=NCCN2 34a_100000068956_100000737910 [0,1,0,0,0,1|1,0,0]=3 1378 B17R2.42550 Fc1ccc(c(c1Cl)Cl)NCC2=NCCN2 7a_100000068956_100000737910 [0,1,0,0,0,1|1,0,0]=3 1379 B17R2.42550 Fc1ccc(c(c1Cl)F)NCC2=NCCN2 34a_100000038966_100000737910 [0,1,0,0,0,1|1,1,0]=4 1380 B17R2.42550 Fc1ccc(c(c1Cl)F)NCC2=NCCN2 7a_100000038966_100000737910 [0,1,0,0,0,1|1,1,0]=4 1381 B17R2.42550 Fc1ccc(c(c1F)Br)NCC2=NCCN2 34a_100010232473_100000737910 [0,1,0,0,0,1|1,1,0]=4 1382 B17R2.42550 Fc1ccc(c(c1F)Br)NCC2=NCCN2 7a_100010232473_100000737910 [0,1,0,0,0,1|1,1,0]=4 1383 B17R2.42550 Fc1ccc(c(c1F)Cl)NCC2=NCCN2 34a_100000101296_100000737910 [0,1,0,0,0,1|1,0,0]=3 1384 B17R2.42550 Fc1ccc(c(c1F)Cl)NCC2=NCCN2 7a_100000101296_100000737910 [0,1,0,0,0,1|1,0,0]=3 1385 B17R2.42550 Fc1ccc(c(c1F)F)NCC2=NCCN2 34a_100000210235_100000737910 [0,1,0,0,0,1|1,1,0]=4 1386 B17R2.42550 Fc1ccc(c(c1F)F)NCC2=NCCN2 7a_100000210235_100000737910 [0,1,0,0,0,1|1,1,0]=4 1387 B17R2.42550 Fc1ccc(c(c1I)F)NCC2=NCCN2 34a_100015510717_100000737910 [0,1,0,0,0,1|1,1,0]=4 1388 B17R2.42550 Nc1c(ccc(c1Cl)OCC2=NCCN2)Cl 34a_100016988457_100000737910 [0,1,0,0,0,1|2,0,0]=4 1389 B17R2.42550 Nc1c(ccc(c1Cl)OCC2=NCCN2)Cl 7a_100016988457_100000737910 [0,1,0,0,0,1|2,0,0]=4 1390 B17R2.42550 Nc1ccc(c(c1Cl)Cl)OCC2=NCCN2 34a_100012017499_100000737910 [0,1,0,0,0,1|2,0,0]=4 1391 B17R2.42550 Nc1ccc(c(c1Cl)Cl)OCC2=NCCN2 7a_100012017499_100000737910 [0,1,0,0,0,1|2,0,0]=4 1392 B17R2.42550 Nc1ccc(c(c1F)Cl)OCC2=NCCN2 34a_200000098347_100000737910 [0,1,0,0,0,1|2,0,0]=4 1393 B17R2.42550 Nc1ccc(c(c1F)Cl)OCC2=NCCN2 7a_200000098347_100000737910 [0,1,0,0,0,1|2,0,0]=4 1394 B17R2.42550 Oc1c(ccc(c1Br)F)NCC2=NCCN2 34a_100010128263_100000737910 [0,1,0,0,0,1|2,0,0]=4 1395 B17R2.42550 Oc1c(ccc(c1F)F)NCC2=NCCN2 34a_100015205010_100000737910 [0,1,0,0,0,1|2,0,0]=4 1396 B17R2.42550 Oc1ccc(c(c1Cl)Cl)NCC2=NCCN2 34a_100012017499_100000737910 [0,1,0,0,0,1|1,0,0]=3 1397 B17R2.42550 Oc1ccc(c(c1Cl)Cl)NCC2=NCCN2 7a_100012017499_100000737910 [0,1,0,0,0,1|1,0,0]=3 1398 B17R2.42550 Oc1ccc(c(c1Cl)F)NCC2=NCCN2 34a_200000098347_100000737910 [0,1,0,0,0,1|1,1,0]=4 1399 B17R2.42550 Oc1ccc(c(c1Cl)F)NCC2=NCCN2 7a_200000098347_100000737910 [0,1,0,0,0,1|1,1,0]=4 1400 B17R2.42550 Oc1ccc(c(c1F)F)NCC2=NCCN2 34a_100015204651_100000737910 [0,1,0,0,0,1|1,1,0]=4 1401 B17R2.42550 Oc1ccc(c(c1F)F)NCC2=NCCN2 7a_100015204651_100000737910 [0,1,0,0,0,1|1,1,0]=4 1402 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000184052_100000737910 [0,1,0,0,0,1|0,1,0]=3 1403 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)C 34a_100000688863_100000737910 [0,1,0,0,0,1|0,1,0]=3 1404 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100012339639_100000737910 [0,1,0,0,0,1|0,0,0]=2 1405 B17R2.83661 Cc1cc(c(c(c1)Br)NCC2=NCCN2)F 34a_100012353694_100000737910 [0,1,0,0,0,1|0,1,0]=3 1406 B17R2.83661 Cc1cc(c(c(c1)Br)NCc2ncc[nH]2)Cl 34a_100012339639_100016991755 [0,1,0,0,0,1|0,0,2]=4 1407 B17R2.83661 Cc1cc(c(c(c1)Br)NCc2nnn[nH]2)Cl 34a_100012339639_100000765167 [0,1,0,0,0,1|2,0,0]=4 1408 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)Br 34a_100000203795_100000737910 [0,1,0,0,0,1|1,1,0]=4 1409 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)Br 7a_100000203795_100000737910 [0,1,0,0,0,1|1,1,0]=4 1410 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)C 34a_100011934984_100000737910 [0,1,0,0,0,1|1,1,0]=4 1411 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)C 7a_100011934984_100000737910 [0,1,0,0,0,1|1,1,0]=4 1412 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)F 34a_200010713133_100000737910 [0,1,0,0,0,1|1,1,0]=4 1413 B17R2.83661 Cc1cc(c(c(c1)Br)OCC2=NCCN2)F 7a_200010713133_100000737910 [0,1,0,0,0,1|1,1,0]=4 1414 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_100000737910_200011219743 [0,1,0,0,0,1|1,1,0]=4 1415 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)Br 62a_200011219743_100000737910 [0,1,0,0,0,1|1,1,0]=4 1416 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)C 62a_100000737910_200012353697 [0,1,0,0,0,1|1,1,0]=4 1417 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)C 62a_200012353697_100000737910 [0,1,0,0,0,1|1,1,0]=4 1418 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100000737910_100010208195 [0,1,0,0,0,1|1,1,0]=4 1419 B17R2.83661 Cc1cc(c(c(c1)Br)SCC2=NCCN2)F 62a_100010208195_100000737910 [0,1,0,0,0,1|1,1,0]=4 1420 B17R2.83661 Cc1cc(c(c(c1)C)NCC2=NCCN2)C 34a_100000210045_100000737910 [0,1,0,0,0,1|1,0,0]=3 1421 B17R2.83661 Cc1cc(c(c(c1)C)NCC2=NCCN2)C 7a_100000210045_100000737910 [0,1,0,0,0,1|1,0,0]=3 1422 B17R2.83661 Cc1cc(c(c(c1)C)OCC2=NCCN2)C 34a_100000212074_100000737910 [0,1,0,0,0,1|2,0,0]=4 1423 B17R2.83661 Cc1cc(c(c(c1)C)OCC2=NCCN2)C 7a_100000212074_100000737910 [0,1,0,0,0,1|2,0,0]=4 1424 B17R2.83661 Cc1cc(c(c(c1)C)SCC2=NCCN2)C 62a_100000737910_100011204320 [0,1,0,0,0,1|2,0,0]=4 1425 B17R2.83661 Cc1cc(c(c(c1)C)SCC2=NCCN2)C 62a_100011204320_100000737910 [0,1,0,0,0,1|2,0,0]=4 1426 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)C 34a_100000211461_100000737910 [0,1,0,0,0,1|0,0,0]=2 1427 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)C 7a_100000211461_100000737910 [0,1,0,0,0,1|0,0,0]=2 1428 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100011996032_100000737910 [0,1,0,0,0,1|0,0,0]=2 1429 B17R2.83661 Cc1cc(c(c(c1)Cl)NCC2=NCCN2)O 34a_100015906060_100000737910 [0,1,0,0,0,1|0,0,0]=2 1430 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2ncc[nH]2)C 34a_100000211461_100016991755 [0,1,0,0,0,1|0,0,2]=4 1431 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2ncc[nH]2)C 7a_100000211461_100000753453 [0,1,0,0,0,1|0,0,2]=4 1432 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2ncc[nH]2)Cl 34a_100011996032_100016991755 [0,1,0,0,0,1|0,0,2]=4 1433 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2ncc[nH]2)O 34a_100015906060_100016991755 [0,1,0,0,0,1|0,0,2]=4 1434 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2nnn[nH]2)C 34a_100000211461_100000765167 [0,1,0,0,0,1|2,0,0]=4 1435 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2nnn[nH]2)C 7a_100000211461_100000765167 [0,1,0,0,0,1|2,0,0]=4 1436 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2nnn[nH]2)Cl 34a_100011996032_100000765167 [0,1,0,0,0,1|2,0,0]=4 1437 B17R2.83661 Cc1cc(c(c(c1)Cl)NCc2nnn[nH]2)O 34a_100015906060_100000765167 [0,1,0,0,0,1|2,0,0]=4 1438 B17R2.83661 Cc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000034925_100000737910 [0,1,0,0,0,1|1,0,0]=3 1439 B17R2.83661 Cc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000034925_100000737910 [0,1,0,0,0,1|1,0,0]=3 1440 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100000737910_100015306127 [0,1,0,0,0,1|1,1,0]=4 1441 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)F 62a_100015306127_100000737910 [0,1,0,0,0,1|1,1,0]=4 1442 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)N 62a_100000737910_100021129147 [0,1,0,0,0,1|1,1,0]=4 1443 B17R2.83661 Cc1cc(c(c(c1)F)SCC2=NCCN2)N 62a_100021129147_100000737910 [0,1,0,0,0,1|1,1,0]=4 1444 B17R2.83661 Cc1cc(c(c(c1)I)OCC2=NCCN2)F 34a_200135191068_100000737910 [0,1,0,0,0,1|1,1,0]=4 1445 B17R2.83661 Cc1cc(c(c(c1)I)OCC2=NCCN2)F 7a_200135191068_100000737910 [0,1,0,0,0,1|1,1,0]=4 1446 B17R2.83661 Cc1cc(c(c(c1)N)OCC2=NCCN2)C 34a_100011216242_100000737910 [0,1,0,0,0,1|2,0,0]=4 1447 B17R2.83661 Cc1cc(c(c(c1)N)OCC2=NCCN2)C 7a_100011216242_100000737910 [0,1,0,0,0,1|2,0,0]=4 1448 B17R2.83661 Cc1cc(c(c(c1)O)SCC2=NCCN2)C 62a_100000737910_100010342985 [0,1,0,0,0,1|2,0,0]=4 1449 B17R2.83661 Cc1cc(c(c(c1)O)SCC2=NCCN2)C 62a_100010342985_100000737910 [0,1,0,0,0,1|2,0,0]=4 1450 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100012047207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1451 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Br 7a_100012047207_100000737910 [0,1,0,0,0,1|1,1,0]=4 1452 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Cl 34a_100012353696_100000737910 [0,1,0,0,0,1|1,1,0]=4 1453 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)Cl 7a_100012353696_100000737910 [0,1,0,0,0,1|1,1,0]=4 1454 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)F 34a_100011216670_100000737910 [0,1,0,0,0,1|1,1,0]=4 1455 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Br)F 7a_100011216670_100000737910 [0,1,0,0,0,1|1,1,0]=4 1456 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Br 34a_100000737279_100000737910 [0,1,0,0,0,1|2,0,0]=4 1457 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Br 7a_100000737279_100000737910 [0,1,0,0,0,1|2,0,0]=4 1458 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Cl 34a_100000692879_100000737910 [0,1,0,0,0,1|2,0,0]=4 1459 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)Cl 7a_100000692879_100000737910 [0,1,0,0,0,1|2,0,0]=4 1460 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)F 34a_100011290887_100000737910 [0,1,0,0,0,1|2,0,0]=4 1461 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)F 7a_100011290887_100000737910 [0,1,0,0,0,1|2,0,0]=4 1462 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)I 7a_100011356821_100000737910 [0,1,0,0,0,1|2,0,0]=4 1463 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)C)O 34a_100011934200_100000737910 [0,1,0,0,0,1|2,0,0]=4 1464 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000741131_100000737910 [0,1,0,0,0,1|1,0,0]=3 1465 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Br 7a_100000741131_100000737910 [0,1,0,0,0,1|1,0,0]=3 1466 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Cl 34a_100011215104_100000737910 [0,1,0,0,0,1|1,0,0]=3 1467 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)Cl 7a_100011215104_100000737910 [0,1,0,0,0,1|1,0,0]=3 1468 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)F 34a_100000725997_100000737910 [0,1,0,0,0,1|1,0,0]=3 1469 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)Cl)F 7a_100000725997_100000737910 [0,1,0,0,0,1|1,0,0]=3 1470 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100000709789_100000737910 [0,1,0,0,0,1|1,1,0]=4 1471 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Br 7a_100000709789_100000737910 [0,1,0,0,0,1|1,1,0]=4 1472 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100012017672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1473 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100012017672_100000737910 [0,1,0,0,0,1|1,1,0]=4 1474 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)I)Br 7a_200000690823_100000737910 [0,1,0,0,0,1|1,1,0]=4 1475 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)I)Cl 7a_100012344046_100000737910 [0,1,0,0,0,1|1,1,0]=4 1476 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)O)Br 34a_100010371313_100000737910 [0,1,0,0,0,1|2,0,0]=4 1477 B17R2.83661 Cc1cc(cc(c1NCC2=NCCN2)O)Br 7a_100010371313_100000737910 [0,1,0,0,0,1|2,0,0]=4 1478 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000211485_100000737910 [0,1,0,0,0,1|2,0,0]=4 1479 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000211485_100000737910 [0,1,0,0,0,1|2,0,0]=4 1480 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Cl 34a_100011218458_100000737910 [0,1,0,0,0,1|2,0,0]=4 1481 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)Cl 7a_100011218458_100000737910 [0,1,0,0,0,1|2,0,0]=4 1482 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)I 34a_200015900153_100000737910 [0,1,0,0,0,1|2,0,0]=4 1483 B17R2.83661 Cc1cc(cc(c1OCC2=NCCN2)Cl)I 7a_200015900153_100000737910 [0,1,0,0,0,1|2,0,0]=4 1484 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)Cl 62a_100000737910_200000035511 [0,1,0,0,0,1|2,0,0]=4 1485 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)Cl 62a_200000035511_100000737910 [0,1,0,0,0,1|2,0,0]=4 1486 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)F 62a_100000737910_100010079234 [0,1,0,0,0,1|2,0,0]=4 1487 B17R2.83661 Cc1cc(cc(c1SCC2=NCCN2)Cl)F 62a_100010079234_100000737910 [0,1,0,0,0,1|2,0,0]=4 1488 B17R2.83661 Clc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000724118_100000737910 [0,1,0,0,0,1|1,1,0]=4 1489 B17R2.83661 Clc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100011218119_100000737910 [0,1,0,0,0,1|1,0,0]=3 1490 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 34a_200000243811_100000737910 [0,1,0,0,0,1|2,0,0]=4 1491 B17R2.83661 Clc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 7a_200000243811_100000737910 [0,1,0,0,0,1|2,0,0]=4 1492 B17R2.83661 Clc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100000737910_200009992027 [0,1,0,0,0,1|2,0,0]=4 1493 B17R2.83661 Clc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_200009992027_100000737910 [0,1,0,0,0,1|2,0,0]=4 1494 B17R2.83661 Clc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100000210601_100000737910 [0,1,0,0,0,1|1,0,0]=3 1495 B17R2.83661 Clc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000210218_100000737910 [0,1,0,0,0,1|2,0,0]=4 1496 B17R2.83661 Clc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000210218_100000737910 [0,1,0,0,0,1|2,0,0]=4 1497 B17R2.83661 Clc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100000737910_200011216440 [0,1,0,0,0,1|2,0,0]=4 1498 B17R2.83661 Clc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_200011216440_100000737910 [0,1,0,0,0,1|2,0,0]=4 1499 B17R2.83661 Clc1cc(c(c(c1)I)OCC2=NCCN2)Cl 34a_200012339341_100000737910 [0,1,0,0,0,1|2,0,0]=4 1500 B17R2.83661 Clc1cc(c(c(c1)I)OCC2=NCCN2)Cl 7a_200012339341_100000737910 [0,1,0,0,0,1|2,0,0]=4 1501 B17R2.83661 Clc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100011216035_100000737910 [0,1,0,0,0,1|1,0,0]=3 1502 B17R2.83661 Clc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000211608_100000737910 [0,1,0,0,0,1|1,0,0]=3 1503 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Br)Br 34a_100012337755_100000737910 [0,1,0,0,0,1|2,0,0]=4 1504 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Br)Br 7a_100012337755_100000737910 [0,1,0,0,0,1|2,0,0]=4 1505 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000753780_100000737910 [0,1,0,0,0,1|2,0,0]=4 1506 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000753780_100000737910 [0,1,0,0,0,1|2,0,0]=4 1507 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)Cl)I 7a_100012339652_100000737910 [0,1,0,0,0,1|2,0,0]=4 1508 B17R2.83661 Clc1cc(cc(c1OCC2=NCCN2)I)I 7a_100009997439_100000737910 [0,1,0,0,0,1|2,0,0]=4 1509 B17R2.83661 Clc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100000737910_200011263224 [0,1,0,0,0,1|2,0,0]=4 1510 B17R2.83661 Clc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_200011263224_100000737910 [0,1,0,0,0,1|2,0,0]=4 1511 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)Br 34a_100000211720_100000737910 [0,1,0,0,0,1|1,1,0]=4 1512 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)Cl 34a_100000694656_100000737910 [0,1,0,0,0,1|1,0,0]=3 1513 B17R2.83661 Fc1cc(c(c(c1)Br)NCC2=NCCN2)F 34a_100000211602_100000737910 [0,1,0,0,0,1|1,1,0]=4 1514 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 34a_100011830411_100000737910 [0,1,0,0,0,1|2,0,0]=4 1515 B17R2.83661 Fc1cc(c(c(c1)Br)OCC2=NCCN2)Cl 7a_100011830411_100000737910 [0,1,0,0,0,1|2,0,0]=4 1516 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100000737910_100012356682 [0,1,0,0,0,1|2,0,0]=4 1517 B17R2.83661 Fc1cc(c(c(c1)Br)SCC2=NCCN2)Cl 62a_100012356682_100000737910 [0,1,0,0,0,1|2,0,0]=4 1518 B17R2.83661 Fc1cc(c(c(c1)Cl)NCC2=NCCN2)Cl 34a_100000688861_100000737910 [0,1,0,0,0,1|1,0,0]=3 1519 B17R2.83661 Fc1cc(c(c(c1)Cl)NCC2=NCCN2)F 34a_100000688773_100000737910 [0,1,0,0,0,1|1,0,0]=3 1520 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100011217724_100000737910 [0,1,0,0,0,1|2,0,0]=4 1521 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100011217724_100000737910 [0,1,0,0,0,1|2,0,0]=4 1522 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)F 34a_100011935252_100000737910 [0,1,0,0,0,1|2,0,0]=4 1523 B17R2.83661 Fc1cc(c(c(c1)Cl)OCC2=NCCN2)F 7a_100011935252_100000737910 [0,1,0,0,0,1|2,0,0]=4 1524 B17R2.83661 Fc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100000737910_100010175091 [0,1,0,0,0,1|2,0,0]=4 1525 B17R2.83661 Fc1cc(c(c(c1)Cl)SCC2=NCCN2)Cl 62a_100010175091_100000737910 [0,1,0,0,0,1|2,0,0]=4 1526 B17R2.83661 Fc1cc(c(c(c1)F)NCC2=NCCN2)F 34a_100000760425_100000737910 [0,1,0,0,0,1|1,1,0]=4 1527 B17R2.83661 Fc1cc(c(c(c1)I)NCC2=NCCN2)F 34a_100102885649_100000737910 [0,1,0,0,0,1|1,1,0]=4 1528 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Br)Br 34a_100011215609_100000737910 [0,1,0,0,0,1|1,1,0]=4 1529 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Br)Cl 34a_100011217455_100000737910 [0,1,0,0,0,1|1,1,0]=4 1530 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Br 34a_100000725741_100000737910 [0,1,0,0,0,1|1,0,0]=3 1531 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Br 7a_100000725741_100000737910 [0,1,0,0,0,1|1,0,0]=3 1532 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Cl 34a_100000688862_100000737910 [0,1,0,0,0,1|1,0,0]=3 1533 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)Cl)Cl 7a_100000688862_100000737910 [0,1,0,0,0,1|1,0,0]=3 1534 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100000758902_100000737910 [0,1,0,0,0,1|1,1,0]=4 1535 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Br 7a_100000758902_100000737910 [0,1,0,0,0,1|1,1,0]=4 1536 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100000695146_100000737910 [0,1,0,0,0,1|1,1,0]=4 1537 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100000695146_100000737910 [0,1,0,0,0,1|1,1,0]=4 1538 B17R2.83661 Fc1cc(cc(c1NCC2=NCCN2)F)I 34a_100012353610_100000737910 [0,1,0,0,0,1|1,1,0]=4 1539 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100011216646_100000737910 [0,1,0,0,0,1|2,0,0]=4 1540 B17R2.83661 Fc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100011216646_100000737910 [0,1,0,0,0,1|2,0,0]=4 1541 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100000737910_100010212234 [0,1,0,0,0,1|2,0,0]=4 1542 B17R2.83661 Fc1cc(cc(c1SCC2=NCCN2)Cl)Br 62a_100010212234_100000737910 [0,1,0,0,0,1|2,0,0]=4 1543 B17R2.83661 Nc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 34a_100000695418_100000737910 [0,1,0,0,0,1|2,0,0]=4 1544 B17R2.83661 Nc1cc(c(c(c1)Cl)OCC2=NCCN2)Cl 7a_100000695418_100000737910 [0,1,0,0,0,1|2,0,0]=4 1545 B17R2.83661 Nc1cc(c(c(c1)Cl)SCC2=NCCN2)F 62a_100000737910_100014833993 [0,1,0,0,0,1|2,0,0]=4 1546 B17R2.83661 Nc1cc(c(c(c1)Cl)SCC2=NCCN2)F 62a_100014833993_100000737910 [0,1,0,0,0,1|2,0,0]=4 1547 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Br 34a_100000694353_100000737910 [0,1,0,0,0,1|2,0,0]=4 1548 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Br 7a_100000694353_100000737910 [0,1,0,0,0,1|2,0,0]=4 1549 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Cl 34a_100000695819_100000737910 [0,1,0,0,0,1|2,0,0]=4 1550 B17R2.83661 Nc1cc(cc(c1OCC2=NCCN2)Cl)Cl 7a_100000695819_100000737910 [0,1,0,0,0,1|2,0,0]=4 1551 B17R2.83661 Oc1cc(c(c(c1)F)NCC2=NCCN2)F 34a_100000036573_100000737910 [0,1,0,0,0,1|1,1,0]=4 1552 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Br 34a_100015475841_100000737910 [0,1,0,0,0,1|1,1,0]=4 1553 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Cl 34a_100010883250_100000737910 [0,1,0,0,0,1|1,1,0]=4 1554 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)Cl 7a_100010883250_100000737910 [0,1,0,0,0,1|1,1,0]=4 1555 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)F 34a_100011217947_100000737910 [0,1,0,0,0,1|1,1,0]=4 1556 B17R2.83661 Oc1cc(cc(c1NCC2=NCCN2)F)F 7a_100011217947_100000737910 [0,1,0,0,0,1|1,1,0]=4 1557 B17R2.13228 COc1ccc(c(c1)Cl)Nc2ncnn2C 27a_100000747055_100000732653 [0,2,0,0,0,0|1,0,1]=4 1558 B17R2.5036 Cc1ccc(c(c1O)Cl)Nc2ncnn2C 27a_100000036876_100000732653 [0,2,0,0,0,0|1,0,1]=4 1559 B15R2.15656 Cc1ccc(c(c1)Cl)NC(=O)C2CC2 11a_100000210522_100000210395 [0,0,1,1,0,0|2,0,0]=4 1560 B15R2.15656 Cc1ccc(c(c1)Cl)NC(=O)C2CC2 1626a_100000210522_100000210395 [0,0,1,1,0,0|2,0,0]=4 1561 B15R2.15656 Cc1ccc(c(c1)Cl)NC(=O)C2CC2 22a_100000210522_100000210395 [0,0,1,1,0,0|2,0,0]=4 1562 B13R1.1511 CCCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210303 [0,0,1,0,1,0|2,0,0]=4 1563 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 11a_100015525214_100000685072 [0,0,1,0,1,0|1,1,0]=4 1564 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 240690a_100015525214_100000685072 [0,0,1,0,1,0|1,1,0]=4 1565 B13R1.1511 CCNC(=O)c1ccc(cc1Br)C 527a_100015525214_100000685072 [0,0,1,0,1,0|1,1,0]=4 1566 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 11a_100015525214_100000211164 [0,0,1,0,1,0|2,0,0]=4 1567 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 240690a_100015525214_100000211164 [0,0,1,0,1,0|2,0,0]=4 1568 B13R1.1511 CCNC(=O)c1ccc(cc1C)C 527a_100015525214_100000211164 [0,0,1,0,1,0|2,0,0]=4 1569 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 11a_100015525214_100000741628 [0,0,1,0,1,0|2,0,0]=4 1570 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 240690a_100015525214_100000741628 [0,0,1,0,1,0|2,0,0]=4 1571 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Br 527a_100015525214_100000741628 [0,0,1,0,1,0|2,0,0]=4 1572 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 11a_100015525214_100000766932 [0,0,1,0,1,0|1,0,0]=3 1573 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 240690a_100015525214_100000766932 [0,0,1,0,1,0|1,0,0]=3 1574 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)C 527a_100015525214_100000766932 [0,0,1,0,1,0|1,0,0]=3 1575 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 11a_100015525214_100000185840 [0,0,1,0,1,0|2,0,0]=4 1576 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 240690a_100015525214_100000185840 [0,0,1,0,1,0|2,0,0]=4 1577 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)Cl 527a_100015525214_100000185840 [0,0,1,0,1,0|2,0,0]=4 1578 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 11a_100015525214_100000211397 [0,0,1,0,1,0|2,0,0]=4 1579 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 240690a_100015525214_100000211397 [0,0,1,0,1,0|2,0,0]=4 1580 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)F 527a_100015525214_100000211397 [0,0,1,0,1,0|2,0,0]=4 1581 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 11a_100015525214_100000751301 [0,0,1,0,1,0|2,0,0]=4 1582 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 240690a_100015525214_100000751301 [0,0,1,0,1,0|2,0,0]=4 1583 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)I 527a_100015525214_100000751301 [0,0,1,0,1,0|2,0,0]=4 1584 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 240690a_100015525214_100000702456 [0,0,1,0,1,0|2,0,0]=4 1585 B13R1.1511 CCNC(=O)c1ccc(cc1Cl)O 527a_100015525214_100000702456 [0,0,1,0,1,0|2,0,0]=4 1586 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 11a_100015525214_100000766033 [0,0,1,0,1,0|1,1,0]=4 1587 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 240690a_100015525214_100000766033 [0,0,1,0,1,0|1,1,0]=4 1588 B13R1.1511 CCNC(=O)c1ccc(cc1F)C 527a_100015525214_100000766033 [0,0,1,0,1,0|1,1,0]=4 1589 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 11a_100015525214_100009999607 [0,0,1,0,1,0|1,1,0]=4 1590 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 240690a_100015525214_100009999607 [0,0,1,0,1,0|1,1,0]=4 1591 B13R1.1511 CCNC(=O)c1ccc(cc1I)C 527a_100015525214_100009999607 [0,0,1,0,1,0|1,1,0]=4 1592 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 240690a_100015525214_100000212137 [0,0,1,0,1,0|2,0,0]=4 1593 B13R1.1511 CCNC(=O)c1ccc(cc1O)C 527a_100015525214_100000212137 [0,0,1,0,1,0|2,0,0]=4 1594 B13R1.1511 CNNC(=O)c1ccc(cc1Cl)C 22a_100016993582_100000766932 [0,0,1,0,1,0|2,0,0]=4 1595 B13R2.18 Clc1ccccc1C2=CCCC2 271570a_100000089523_100000764095 [1,0,0,0,1,0|2,0,0]=4 1596 B13R2.18 Clc1ccccc1c2ncc[nH]2 271570a_100011934419_100025796157 [1,0,0,0,1,0|0,0,2]=4 1597 B13R2.18 Clc1ccccc1c2ncc[nH]2 271570a_100016988920_100000764095 [1,0,0,0,1,0|0,0,2]=4 1598 B13R2.5225 Clc1ccccc1NC2CCC2 34a_100000185783_100000749161 [1,0,0,0,1,0|1,0,1]=4 1599 B13R2.12 Cc1ccc(cc1)C2=CCCC2 271570a_100000089523_100000186775 [1,0,0,0,1,0|2,0,0]=4 1600 B13R2.12 Cc1ccc(cc1)c2ncc[nH]2 271570a_100000708704_100025796157 [1,0,0,0,1,0|0,0,2]=4 1601 B13R2.12 Cc1ccc(cc1)c2ncc[nH]2 271570a_100016988920_100000186775 [1,0,0,0,1,0|0,0,2]=4 1602 B13R2.12 Oc1ccc(cc1)C2=NCCO2 271570a_203496583355_100009812740 [1,0,0,0,1,0|2,0,0]=4 1603 B13R2.1069 Cc1ccc(cc1)NC2CCC2 34a_100000124888_100000749161 [1,0,0,0,1,0|1,0,1]=4 1604 B13R2.5400 Cc1ccc(c(c1)Br)NC2CC2 34a_100000210942_100000211595 [0,0,0,0,2,0|0,1,1]=4 1605 B13R2.5400 Cc1ccc(c(c1)C)NC2CC2 34a_100000736561_100000211595 [0,0,0,0,2,0|1,0,1]=4 1606 B13R2.5400 Cc1ccc(c(c1)Cl)NC2CC2 34a_100000210522_100000211595 [0,0,0,0,2,0|0,0,1]=3 1607 B13R2.5400 Cc1ccc(c(c1)Cl)OC2CC2 34a_100000749699_100000211595 [0,0,0,0,2,0|1,0,1]=4 1608 B13R2.5400 Cc1ccc(c(c1)Cl)SC2CC2 62a_100011263221_100000211595 [0,0,0,0,2,0|1,0,1]=4 1609 B13R2.5400 Cc1ccc(c(c1)F)NC2CC2 34a_100000211023_100000211595 [0,0,0,0,2,0|0,1,1]=4 1610 B13R2.5400 Cc1ccc(c(c1)I)NC2CC2 34a_100011356834_100000211595 [0,0,0,0,2,0|0,1,1]=4 1611 B13R2.5400 Cc1ccc(c(c1)O)NC2CC2 34a_100000211527_100000211595 [0,0,0,0,2,0|1,0,1]=4 1612 B13R2.5400 Clc1cc(ccc1NC2CC2)Br 34a_100000211467_100000211595 [0,0,0,0,2,0|1,0,1]=4 1613 B13R2.5400 Clc1cc(ccc1NC2CC2)I 34a_100011218065_100000211595 [0,0,0,0,2,0|1,0,1]=4 1614 B13R2.5400 Clc1ccc(c(c1)Cl)NC2CC2 34a_100000185861_100000211595 [0,0,0,0,2,0|1,0,1]=4 1615 B13R2.5400 Fc1ccc(c(c1)Cl)NC2CC2 34a_100000212003_100000211595 [0,0,0,0,2,0|1,0,1]=4 1616 B13R2.5400 Oc1ccc(c(c1)Cl)NC2CC2 34a_100011215599_100000211595 [0,0,0,0,2,0|1,0,1]=4 1617 B15R1.462 CCC(=NNc1ccc(cc1Cl)C)CC 4a_100000006747_100000210860 [0,0,1,0,0,1|2,0,0]=4 1618 B15R2.562 Brc1ccccc1NCC2=NCCN2 34a_100000210017_100000737910 [1,0,0,0,0,1|0,1,0]=3 1619 B15R2.562 Brc1ccccc1OCC2=NCCN2 34a_100000181306_100000737910 [1,0,0,0,0,1|1,1,0]=4 1620 B15R2.562 Brc1ccccc1OCC2=NCCN2 7a_100000181306_100000737910 [1,0,0,0,0,1|1,1,0]=4 1621 B15R2.562 Brc1ccccc1SCC2=NCCN2 62a_100000695589_100000737910 [1,0,0,0,0,1|1,1,0]=4 1622 B15R2.562 Brc1ccccc1SCC2=NCCN2 62a_100000737910_100000695589 [1,0,0,0,0,1|1,1,0]=4 1623 B15R2.562 Cc1ccccc1NCC2=NCCN2 34a_100015192222_100000737910 [1,0,0,0,0,1|1,0,0]=3 1624 B15R2.562 Cc1ccccc1OCC2=NCCN2 34a_100000210338_100000737910 [1,0,0,0,0,1|2,0,0]=4 1625 B15R2.562 Cc1ccccc1OCC2=NCCN2 7a_100000210338_100000737910 [1,0,0,0,0,1|2,0,0]=4 1626 B15R2.562 Cc1ccccc1SCC2=NCCN2 62a_100000210755_100000737910 [1,0,0,0,0,1|2,0,0]=4 1627 B15R2.562 Cc1ccccc1SCC2=NCCN2 62a_100000737910_100000210755 [1,0,0,0,0,1|2,0,0]=4 1628 B15R2.562 Clc1ccccc1NCC2=NCCN2 34a_100000185783_100000737910 [1,0,0,0,0,1|0,0,0]=2 1629 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 207a_100000185783_100000743867 [1,0,0,0,0,1|0,0,2]=4 1630 B15R2.562 Clc1ccccc1NCc2ncc[nH]2 34a_100000185783_100016991755 [1,0,0,0,0,1|0,0,2]=4 1631 B15R2.562 Clc1ccccc1NCc2nnn[nH]2 34a_100000185783_100000765167 [1,0,0,0,0,1|2,0,0]=4 1632 B15R2.562 Clc1ccccc1NN=C2CCCC2 4a_100000683529_100000210133 [1,0,0,0,0,1|2,0,0]=4 1633 B15R2.562 Clc1ccccc1OCC2=NCCN2 34a_100000210172_100000737910 [1,0,0,0,0,1|1,0,0]=3 1634 B15R2.562 Clc1ccccc1OCC2=NCCN2 7a_100000210172_100000737910 [1,0,0,0,0,1|1,0,0]=3 1635 B15R2.562 Clc1ccccc1SCC2=NCCN2 62a_100000737910_100000764095 [1,0,0,0,0,1|1,0,0]=3 1636 B15R2.562 Clc1ccccc1SCC2=NCCN2 62a_100000764095_100000737910 [1,0,0,0,0,1|1,0,0]=3 1637 B15R2.562 Clc1cccnc1OCC2=NCCN2 34a_100011290957_100000737910 [1,0,0,0,0,1|2,0,0]=4 1638 B15R2.562 Clc1cccnc1SCC2=NCCN2 62a_100000737910_100011356963 [1,0,0,0,0,1|2,0,0]=4 1639 B15R2.562 Clc1cccnc1SCC2=NCCN2 62a_100011356963_100000737910 [1,0,0,0,0,1|2,0,0]=4 1640 B15R2.562 Clc1ccncc1OCC2=NCCN2 34a_100011996695_100000737910 [1,0,0,0,0,1|2,0,0]=4 1641 B15R2.562 Clc1ccncc1SCC2=NCCN2 62a_100000737910_100009995489 [1,0,0,0,0,1|2,0,0]=4 1642 B15R2.562 Clc1ccncc1SCC2=NCCN2 62a_100009995489_100000737910 [1,0,0,0,0,1|2,0,0]=4 1643 B15R2.562 Clc1cnccc1OCC2=NCCN2 34a_100011997054_100000737910 [1,0,0,0,0,1|2,0,0]=4 1644 B15R2.562 Clc1cnccc1SCC2=NCCN2 62a_100000708259_100000737910 [1,0,0,0,0,1|2,0,0]=4 1645 B15R2.562 Clc1cnccc1SCC2=NCCN2 62a_100000737910_100000708259 [1,0,0,0,0,1|2,0,0]=4 1646 B15R2.562 Clc1ncccc1OCC2=NCCN2 34a_100000757616_100000737910 [1,0,0,0,0,1|2,0,0]=4 1647 B15R2.562 Clc1ncccc1OCC2=NCCN2 7a_100000757616_100000737910 [1,0,0,0,0,1|2,0,0]=4 1648 B15R2.562 Clc1ncccc1SCC2=NCCN2 62a_100000036424_100000737910 [1,0,0,0,0,1|2,0,0]=4 1649 B15R2.562 Clc1ncccc1SCC2=NCCN2 62a_100000737910_100000036424 [1,0,0,0,0,1|2,0,0]=4 1650 B15R2.562 Fc1ccccc1NCC2=NCCN2 34a_100000210422_100000737910 [1,0,0,0,0,1|0,1,0]=3 1651 B15R2.562 Fc1ccccc1OCC2=NCCN2 34a_100000210171_100000737910 [1,0,0,0,0,1|1,1,0]=4 1652 B15R2.562 Fc1ccccc1OCC2=NCCN2 7a_100000210171_100000737910 [1,0,0,0,0,1|1,1,0]=4 1653 B15R2.562 Fc1ccccc1SCC2=NCCN2 62a_100000737910_100011215700 [1,0,0,0,0,1|1,1,0]=4 1654 B15R2.562 Fc1ccccc1SCC2=NCCN2 62a_100011215700_100000737910 [1,0,0,0,0,1|1,1,0]=4 1655 B15R2.562 Ic1ccccc1NCC2=NCCN2 34a_100000210053_100000737910 [1,0,0,0,0,1|0,1,0]=3 1656 B15R2.562 Ic1ccccc1OCC2=NCCN2 34a_100000739446_100000737910 [1,0,0,0,0,1|1,1,0]=4 1657 B15R2.562 Ic1ccccc1OCC2=NCCN2 7a_100000739446_100000737910 [1,0,0,0,0,1|1,1,0]=4 1658 B15R2.562 Nc1ccccc1OCC2=NCCN2 34a_100000185747_100000737910 [1,0,0,0,0,1|2,0,0]=4 1659 B15R2.562 Nc1ccccc1OCC2=NCCN2 7a_100000185747_100000737910 [1,0,0,0,0,1|2,0,0]=4 1660 B15R2.562 Nc1ccccc1SCC2=NCCN2 62a_100000210017_100000737910 [1,0,0,0,0,1|2,0,0]=4 1661 B15R2.562 Nc1ccccc1SCC2=NCCN2 62a_100000737910_100000210017 [1,0,0,0,0,1|2,0,0]=4 1662 B15R2.562 Oc1ccccc1NCC2=NCCN2 34a_100000185747_100000737910 [1,0,0,0,0,1|1,0,0]=3 1663 B15R2.562 Oc1ccccc1SCC2=NCCN2 62a_100000737910_100000739446 [1,0,0,0,0,1|2,0,0]=4 1664 B15R2.562 Oc1ccccc1SCC2=NCCN2 62a_100000739446_100000737910 [1,0,0,0,0,1|2,0,0]=4 1665 B15R2.100 Brc1ccc(cc1)NCC2=NCCN2 34a_100000210018_100000737910 [1,0,0,0,0,1|1,0,0]=3 1666 B15R2.100 Brc1ccc(cc1)OCC2=NCCN2 34a_100000185759_100000737910 [1,0,0,0,0,1|2,0,0]=4 1667 B15R2.100 Brc1ccc(cc1)OCC2=NCCN2 7a_100000185759_100000737910 [1,0,0,0,0,1|2,0,0]=4 1668 B15R2.100 Brc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000752885 [1,0,0,0,0,1|2,0,0]=4 1669 B15R2.100 Brc1ccc(cc1)SCC2=NCCN2 62a_100000752885_100000737910 [1,0,0,0,0,1|2,0,0]=4 1670 B15R2.100 Cc1ccc(cc1)NCC2=NCCN2 34a_100000124888_100000737910 [1,0,0,0,0,1|0,0,0]=2 1671 B15R2.100 Cc1ccc(cc1)NCc2ncc[nH]2 207a_100000124888_100000743867 [1,0,0,0,0,1|0,0,2]=4 1672 B15R2.100 Cc1ccc(cc1)NCc2ncc[nH]2 34a_100000124888_100016991755 [1,0,0,0,0,1|0,0,2]=4 1673 B15R2.100 Cc1ccc(cc1)NCc2nnn[nH]2 34a_100000124888_100000765167 [1,0,0,0,0,1|2,0,0]=4 1674 B15R2.100 Cc1ccc(cc1)NN=C2CCCC2 4a_100000683527_100000210133 [1,0,0,0,0,1|2,0,0]=4 1675 B15R2.100 Cc1ccc(cc1)OCC2=NCCN2 34a_100000210336_100000737910 [1,0,0,0,0,1|1,0,0]=3 1676 B15R2.100 Cc1ccc(cc1)OCC2=NCCN2 7a_100000210336_100000737910 [1,0,0,0,0,1|1,0,0]=3 1677 B15R2.100 Cc1ccc(cc1)SCC2=NCCN2 62a_100000186775_100000737910 [1,0,0,0,0,1|1,0,0]=3 1678 B15R2.100 Cc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000186775 [1,0,0,0,0,1|1,0,0]=3 1679 B15R2.100 Cc1ccc(cn1)OCC2=NCCN2 34a_100000745506_100000737910 [1,0,0,0,0,1|2,0,0]=4 1680 B15R2.100 Cc1ccc(cn1)OCC2=NCCN2 7a_100000745506_100000737910 [1,0,0,0,0,1|2,0,0]=4 1681 B15R2.100 Cc1ccc(cn1)SCC2=NCCN2 62a_100000737910_100000751577 [1,0,0,0,0,1|2,0,0]=4 1682 B15R2.100 Cc1ccc(cn1)SCC2=NCCN2 62a_100000751577_100000737910 [1,0,0,0,0,1|2,0,0]=4 1683 B15R2.100 Cc1ccc(nc1)OCC2=NCCN2 34a_100000759353_100000737910 [1,0,0,0,0,1|2,0,0]=4 1684 B15R2.100 Cc1ccc(nc1)SCC2=NCCN2 62a_100000737910_100000754016 [1,0,0,0,0,1|2,0,0]=4 1685 B15R2.100 Cc1ccc(nc1)SCC2=NCCN2 62a_100011192072_100000737910 [1,0,0,0,0,1|2,0,0]=4 1686 B15R2.100 Clc1ccc(cc1)NCC2=NCCN2 34a_100000210052_100000737910 [1,0,0,0,0,1|1,0,0]=3 1687 B15R2.100 Clc1ccc(cc1)OCC2=NCCN2 34a_100000210216_100000737910 [1,0,0,0,0,1|2,0,0]=4 1688 B15R2.100 Clc1ccc(cc1)OCC2=NCCN2 7a_100000210216_100000737910 [1,0,0,0,0,1|2,0,0]=4 1689 B15R2.100 Clc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000755918 [1,0,0,0,0,1|2,0,0]=4 1690 B15R2.100 Clc1ccc(cc1)SCC2=NCCN2 62a_100000755918_100000737910 [1,0,0,0,0,1|2,0,0]=4 1691 B15R2.100 Fc1ccc(cc1)NCC2=NCCN2 34a_100000185862_100000737910 [1,0,0,0,0,1|1,0,0]=3 1692 B15R2.100 Fc1ccc(cc1)OCC2=NCCN2 34a_100000210339_100000737910 [1,0,0,0,0,1|2,0,0]=4 1693 B15R2.100 Fc1ccc(cc1)SCC2=NCCN2 62a_100000211213_100000737910 [1,0,0,0,0,1|2,0,0]=4 1694 B15R2.100 Fc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000211213 [1,0,0,0,0,1|2,0,0]=4 1695 B15R2.100 Ic1ccc(cc1)NCC2=NCCN2 34a_100000185761_100000737910 [1,0,0,0,0,1|1,0,0]=3 1696 B15R2.100 Ic1ccc(cc1)OCC2=NCCN2 34a_100000212066_100000737910 [1,0,0,0,0,1|2,0,0]=4 1697 B15R2.100 Ic1ccc(cc1)OCC2=NCCN2 7a_100000212066_100000737910 [1,0,0,0,0,1|2,0,0]=4 1698 B15R2.100 Nc1ccc(cc1)OCC2=NCCN2 34a_100000185829_100000737910 [1,0,0,0,0,1|2,0,0]=4 1699 B15R2.100 Nc1ccc(cc1)SCC2=NCCN2 62a_100000185761_100000737910 [1,0,0,0,0,1|2,0,0]=4 1700 B15R2.100 Nc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000185761 [1,0,0,0,0,1|2,0,0]=4 1701 B15R2.100 Oc1ccc(cc1)NCC2=NCCN2 34a_100000185829_100000737910 [1,0,0,0,0,1|1,0,0]=3 1702 B15R2.100 Oc1ccc(cc1)SCC2=NCCN2 62a_100000737910_100000185759 [1,0,0,0,0,1|2,0,0]=4 1703 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2C=CCCC2 4a_100000006747_100011213375 [0,0,0,0,0,2|2,0,0]=4 1704 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2CCCCC2 4a_100000006747_100000210434 [0,0,0,0,0,2|2,0,0]=4 1705 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2CCCOC2 4a_100000006747_100000753404 [0,0,0,0,0,2|2,0,0]=4 1706 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2CCCSC2 4a_100000006747_100000057913 [0,0,0,0,0,2|2,0,0]=4 1707 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2CCOCC2 4a_100000006747_100011217826 [0,0,0,0,0,2|2,0,0]=4 1708 B17R2.5360 Cc1ccc(c(c1)Cl)NN=C2CCSCC2 4a_100000006747_100000203788 [0,0,0,0,0,2|2,0,0]=4 1709 B17R2.3487 Cc1cc(ccc1CNCC2=NCCN2)Br 34a_100000753881_100000737910 [0,0,0,0,0,2|2,0,0]=4 1710 B17R2.3487 Cc1cc(ccc1CNCC2=NCCN2)Cl 34a_103436540063_100000737910 [0,0,0,0,0,2|2,0,0]=4 1711 B17R2.3487 Cc1cc(ccc1CNCC2=NCCN2)F 34a_100137329023_100000737910 [0,0,0,0,0,2|2,0,0]=4 1712 B17R2.3487 Cc1ccc(c(c1)C)CNCC2=NCCN2 34a_100000737523_100000737910 [0,0,0,0,0,2|1,0,0]=3 1713 B17R2.3487 Cc1ccc(c(c1)C)COCC2=NCCN2 34a_100011215341_100000737910 [0,0,0,0,0,2|2,0,0]=4 1714 B17R2.3487 Cc1ccc(c(c1)C)COCC2=NCCN2 7a_100011215341_100000737910 [0,0,0,0,0,2|2,0,0]=4 1715 B17R2.3487 Cc1ccc(c(c1)C)CSCC2=NCCN2 62a_100000737910_100011219618 [0,0,0,0,0,2|2,0,0]=4 1716 B17R2.3487 Cc1ccc(c(c1)C)CSCC2=NCCN2 62a_100011219618_100000737910 [0,0,0,0,0,2|2,0,0]=4 1717 B17R2.3487 Cc1ccc(c(c1)Cl)CNCC2=NCCN2 34a_100011997539_100000737910 [0,0,0,0,0,2|0,0,0]=2 1718 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2ncc[nH]2 207a_100000754540_100011935181 [0,0,0,0,0,2|0,0,2]=4 1719 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2ncc[nH]2 207a_100011997539_100000743867 [0,0,0,0,0,2|0,0,2]=4 1720 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2ncc[nH]2 270004a_100000754540_100011935181 [0,0,0,0,0,2|0,0,2]=4 1721 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2ncc[nH]2 34a_100011997539_100016991755 [0,0,0,0,0,2|0,0,2]=4 1722 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2nnc[nH]2 2230a_200015183720_100012349684 [0,0,0,0,0,2|1,0,1]=4 1723 B17R2.3487 Cc1ccc(c(c1)Cl)CNCc2nnn[nH]2 34a_100011997539_100000765167 [0,0,0,0,0,2|2,0,0]=4 1724 B17R2.3487 Cc1ccc(c(c1)Cl)COCC2=NCCN2 34a_100000720314_100000737910 [0,0,0,0,0,2|1,0,0]=3 1725 B17R2.3487 Cc1ccc(c(c1)Cl)COCC2=NCCN2 7a_100000720314_100000737910 [0,0,0,0,0,2|1,0,0]=3 1726 B17R2.3487 Cc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100000737910_100012349684 [0,0,0,0,0,2|1,0,0]=3 1727 B17R2.3487 Cc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100012349684_100000737910 [0,0,0,0,0,2|1,0,0]=3 1728 B17R2.3487 Cc1ccc(c(c1)Cl)NN=CC2=CCCC2 4a_100000006747_100000702379 [0,0,0,0,0,2|2,0,0]=4 1729 B17R2.3487 Cc1ccc(c(c1)Cl)NN=Cc2ncc[nH]2 4a_100000006747_100000743867 [0,0,0,0,0,2|0,0,2]=4 1730 B17R2.3487 Cc1ccc(c(c1)F)CNCC2=NCCN2 34a_100102887089_100000737910 [0,0,0,0,0,2|0,1,0]=3 1731 B17R2.3487 Cc1ccc(c(c1)F)COCC2=NCCN2 34a_100011216587_100000737910 [0,0,0,0,0,2|1,1,0]=4 1732 B17R2.3487 Cc1ccc(c(c1)F)COCC2=NCCN2 7a_100011216587_100000737910 [0,0,0,0,0,2|1,1,0]=4 1733 B17R2.3487 Cc1ccc(c(c1)F)CSCC2=NCCN2 62a_100000737910_100011217900 [0,0,0,0,0,2|1,1,0]=4 1734 B17R2.3487 Cc1ccc(c(c1)F)CSCC2=NCCN2 62a_100011217900_100000737910 [0,0,0,0,0,2|1,1,0]=4 1735 B17R2.3487 Cc1ccc(c(c1)N)COCC2=NCCN2 34a_100000087799_100000737910 [0,0,0,0,0,2|2,0,0]=4 1736 B17R2.3487 Cc1ccc(c(c1)N)COCC2=NCCN2 7a_100000087799_100000737910 [0,0,0,0,0,2|2,0,0]=4 1737 B17R2.3487 Cc1ccc(c(n1)Cl)COCC2=NCCN2 34a_102495338573_100000737910 [0,0,0,0,0,2|2,0,0]=4 1738 B17R2.3487 Cc1ccc(c(n1)Cl)COCC2=NCCN2 7a_102495338573_100000737910 [0,0,0,0,0,2|2,0,0]=4 1739 B17R2.3487 Clc1cc(ccc1CNCC2=NCCN2)Br 34a_100020628970_100000737910 [0,0,0,0,0,2|1,0,0]=3 1740 B17R2.3487 Clc1cc(ccc1COCC2=NCCN2)Br 34a_100000756401_100000737910 [0,0,0,0,0,2|2,0,0]=4 1741 B17R2.3487 Clc1cc(ccc1COCC2=NCCN2)Br 7a_100000756401_100000737910 [0,0,0,0,0,2|2,0,0]=4 1742 B17R2.3487 Clc1cc(ccc1CSCC2=NCCN2)Br 62a_100000737910_100011740631 [0,0,0,0,0,2|2,0,0]=4 1743 B17R2.3487 Clc1cc(ccc1CSCC2=NCCN2)Br 62a_100011740631_100000737910 [0,0,0,0,0,2|2,0,0]=4 1744 B17R2.3487 Clc1cc(cnc1CNCC2=NCCN2)Br 34a_100025703182_100000737910 [0,0,0,0,0,2|2,0,0]=4 1745 B17R2.3487 Clc1ccc(c(c1)Br)CNCC2=NCCN2 34a_100102692131_100000737910 [0,0,0,0,0,2|1,1,0]=4 1746 B17R2.3487 Clc1ccc(c(c1)Cl)CNCC2=NCCN2 34a_100000174880_100000737910 [0,0,0,0,0,2|1,0,0]=3 1747 B17R2.3487 Clc1ccc(c(c1)Cl)COCC2=NCCN2 34a_100000215721_100000737910 [0,0,0,0,0,2|2,0,0]=4 1748 B17R2.3487 Clc1ccc(c(c1)Cl)COCC2=NCCN2 7a_100000215721_100000737910 [0,0,0,0,0,2|2,0,0]=4 1749 B17R2.3487 Clc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100000188473_100000737910 [0,0,0,0,0,2|2,0,0]=4 1750 B17R2.3487 Clc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100000737910_100000188473 [0,0,0,0,0,2|2,0,0]=4 1751 B17R2.3487 Fc1cc(ccc1CNCC2=NCCN2)Br 34a_100000754580_100000737910 [0,0,0,0,0,2|1,1,0]=4 1752 B17R2.3487 Fc1cc(ccc1CNCC2=NCCN2)Cl 34a_100000708496_100000737910 [0,0,0,0,0,2|1,1,0]=4 1753 B17R2.3487 Fc1ccc(c(c1)Br)CNCC2=NCCN2 34a_100000708791_100000737910 [0,0,0,0,0,2|1,1,0]=4 1754 B17R2.3487 Fc1ccc(c(c1)Cl)CNCC2=NCCN2 34a_100000174946_100000737910 [0,0,0,0,0,2|1,0,0]=3 1755 B17R2.3487 Fc1ccc(c(c1)Cl)COCC2=NCCN2 34a_100011219954_100000737910 [0,0,0,0,0,2|2,0,0]=4 1756 B17R2.3487 Fc1ccc(c(c1)Cl)COCC2=NCCN2 7a_100011219954_100000737910 [0,0,0,0,0,2|2,0,0]=4 1757 B17R2.3487 Fc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100000187853_100000737910 [0,0,0,0,0,2|2,0,0]=4 1758 B17R2.3487 Fc1ccc(c(c1)Cl)CSCC2=NCCN2 62a_100000737910_100000187853 [0,0,0,0,0,2|2,0,0]=4 1759 B17R2.3487 Fc1ccc(c(c1)F)CNCC2=NCCN2 34a_100000737868_100000737910 [0,0,0,0,0,2|1,1,0]=4 1760 B17R2.3487 Fc1cnc(c(c1)Cl)CNCC2=NCCN2 34a_100020639648_100000737910 [0,0,0,0,0,2|2,0,0]=4 1761 B17R2.3487 Nc1ccc(c(c1)Cl)COCC2=NCCN2 34a_100000689119_100000737910 [0,0,0,0,0,2|2,0,0]=4 1762 B17R2.3487 Oc1ccc(c(c1)Cl)CNCC2=NCCN2 34a_200161156549_100000737910 [0,0,0,0,0,2|1,0,0]=3