0 B10R1.4 CCNc1ccccc1Cl CSC000219383 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.4 CCOc1ccccc1Cl CSC000169953 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.4 CCOc1ccccc1F CSC000172994 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.4 CCSc1ccccc1C CSC000053911 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.4 CCSc1ccccc1Cl CSC000006683 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.4 CSCc1ccccc1Br CSC000148299 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.4 CSCc1ccccc1Cl CSC000051354 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.15 CNc1ccccc1Cl CSC000219374 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.15 COc1ccccc1Br CSC000174000 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.15 COc1ccccc1Cl CSC000169952 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.15 COc1ccccc1I CSC000210334 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.15 CSc1ccccc1Br CSC000230855 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.15 CSc1ccccc1Cl CSC000000335 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.15 CSc1ccccc1F CSC000000233 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.15 CSc1ccccc1O CSC011216402 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.13 CNCc1cccc(c1Cl)Cl CSC000184510 [0,1,0,0,0,0|2,0,1]=4 16 B11R1.17 Brc1ccccc1OCC=C CSC000173964 [0,1,0,0,0,0|1,0,0]=2 17 B11R1.17 CCCOc1ccccc1Br CSC000174042 [0,1,0,0,0,0|1,0,2]=4 18 B11R1.17 CCCOc1ccccc1C CSC000169983 [0,1,0,0,0,0|1,0,2]=4 19 B11R1.17 CCCOc1ccccc1F CSC000173322 [0,1,0,0,0,0|1,0,2]=4 20 B11R1.17 CCCSc1ccccc1Br CSC000230854 [0,1,0,0,0,0|1,0,2]=4 21 B11R1.17 CCCSc1ccccc1Cl CSC000006739 [0,1,0,0,0,0|1,0,2]=4 22 B11R1.17 CCNCc1ccccc1F CSC000201217 [0,1,0,0,0,0|1,0,2]=4 23 B11R1.17 CCSCc1ccccc1Cl CSC000044547 [0,1,0,0,0,0|1,0,2]=4 24 B11R1.17 Cc1ccccc1NCC=C CSC011613358 [0,1,0,0,0,0|1,0,0]=2 25 B11R1.17 Cc1ccccc1NCCO CSC011233185 [0,1,0,0,0,0|2,0,1]=4 26 B11R1.17 Cc1ccccc1OCC=C CSC000172067 [0,1,0,0,0,0|1,0,0]=2 27 B11R1.17 Cc1ccccc1OCCO CSC011305843 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.17 Clc1ccccc1OCC#N CSC000169426 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.17 Clc1ccccc1OCC=C CSC000172057 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.17 Clc1ccccc1SCC#N CSC000149087 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.17 FCCSc1ccccc1Br CSC010198681 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.17 Fc1ccccc1OCC#N CSC000173231 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.17 Fc1ccccc1OCC=C CSC000173442 [0,1,0,0,0,0|1,0,0]=2 34 B11R1.17 OCCNc1ccccc1Br CSC011233104 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.17 OCCOc1ccccc1Cl CSC000230518 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.17 OCCOc1ccccc1F CSC000756447 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.17 OCCSc1ccccc1Br CSC000230852 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.17 OCCSc1ccccc1Cl CSC000230572 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.17 OCCSc1ccccc1F CSC000230732 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.41 CCNc1ccccc1OC CSC000219754 [0,1,0,0,0,0|1,0,2]=4 41 B11R1.41 CCOc1ccccc1CO CSC000708577 [0,1,0,0,0,0|1,0,2]=4 42 B11R1.41 CCOc1ccccc1OC CSC000005897 [0,1,0,0,0,0|1,0,2]=4 43 B11R1.41 CCSc1ccccc1OC CSC000055740 [0,1,0,0,0,0|1,0,2]=4 44 B11R1.41 COc1ccccc1CCO CSC011218620 [0,1,0,0,0,0|1,0,1]=3 45 B11R1.41 COc1ccccc1CSC CSC000053060 [0,1,0,0,0,0|1,0,1]=3 46 B11R1.81 CSCc1ccc(cc1Cl)F CSC000051359 [0,1,0,0,0,0|2,0,1]=4 47 B11R1.81 CSCc1ccc(cc1F)F CSC010285496 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.86 CC(=O)Nc1ccccc1Br CSC000153524 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.86 CC(=O)Nc1ccccc1C CSC000153662 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.86 CC(=O)Nc1ccccc1Cl CSC000153741 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.86 CC(=O)Nc1ccccc1F CSC000154224 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.86 CC(=O)Nc1ccccc1I CSC000154044 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.86 CC(=O)Nc1ncccc1O CSC000022013 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.86 CC(=O)Oc1ccccc1C CSC000001913 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.86 CC(=O)Oc1ccccc1F CSC000001835 [0,1,0,0,0,0|2,0,1]=4 56 B11R1.86 Cc1ccccc1NC(=O)N CSC000181700 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.86 NC(=O)Cc1ccccc1Cl CSC000162363 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.86 NC(=O)Cc1ccccc1F CSC000162305 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.86 NC(=O)Nc1ccccc1Br CSC000742221 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.86 NC(=O)Nc1ccccc1Cl CSC000181701 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.182 CSCc1cc(ccc1F)F CSC000052045 [0,1,0,0,0,0|2,0,1]=4 62 B11R1.222 CNC(=O)c1ccccc1O CSC000185920 [0,1,0,0,0,0|1,0,2]=4 63 B11R1.222 NNC(=O)c1ccccc1O CSC000186518 [0,1,0,0,0,0|2,0,1]=4 64 B11R1.605 CSCc1c(cccc1Cl)F CSC000051357 [0,1,0,0,0,0|2,0,1]=4 65 B10R1.1 CSCc1ccc(cc1)C CSC000051358 [1,1,0,0,0,0|1,0,1]=4 66 B10R1.1 CSCc1ccc(cc1)Cl CSC000000312 [1,1,0,0,0,0|1,0,1]=4 67 B10R1.1 CSCc1ccc(cc1)F CSC000051356 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.10 CSCc1cccc(c1)Cl CSC000051353 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.10 CSCc1cccc(c1)F CSC000053058 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.17 C#CCSc1ccccc1 CSC000172648 [1,1,0,0,0,0|0,0,2]=4 71 B10R1.17 C=CCSc1ccccc1 CSC000006400 [1,1,0,0,0,0|0,0,0]=2 72 B10R1.17 CCCSc1ccccc1 CSC000005822 [1,1,0,0,0,0|0,0,2]=4 73 B10R1.17 CCSCc1ccccc1 CSC000006444 [1,1,0,0,0,0|0,0,2]=4 74 B10R1.17 COCSc1ccccc1 CSC000000817 [1,1,0,0,0,0|1,0,1]=4 75 B10R1.17 OCCSc1ccccc1 CSC000230494 [1,1,0,0,0,0|1,0,1]=4 76 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.20 COc1ccccc1SC CSC000037525 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.224 CC(=O)Nc1cccc(c1O)Cl CSC000117800 [0,2,0,0,0,0|1,0,1]=4 82 B12R1.69 Cc1cc(ccc1OCC=C)Br CSC011308933 [0,2,0,0,0,0|1,0,0]=3 83 B12R1.69 Cc1ccc(c(c1)Br)OCC=C CSC000241584 [0,2,0,0,0,0|1,0,0]=3 84 B12R1.69 Clc1cc(ccc1OCC=C)Br CSC009811538 [0,2,0,0,0,0|1,0,0]=3 85 B12R1.69 Clc1ccc(c(c1)Br)OCC=C CSC000172271 [0,2,0,0,0,0|1,0,0]=3 86 B12R1.69 Clc1ccc(c(c1)Cl)OCC=C CSC000006397 [0,2,0,0,0,0|1,0,0]=3 87 B12R1.69 Fc1cc(ccc1OCC=C)Br CSC000172283 [0,2,0,0,0,0|1,0,0]=3 88 B12R1.69 Fc1ccc(c(c1)Br)OCC=C CSC000172273 [0,2,0,0,0,0|1,0,0]=3 89 B12R1.121 C=CCOc1ccccc1C#N CSC000172157 [0,2,0,0,0,0|1,0,0]=3 90 B12R1.121 CCCOc1ccccc1CO CSC011232767 [0,2,0,0,0,0|0,0,2]=4 91 B12R1.121 CCCSc1ccccc1OC CSC000055745 [0,2,0,0,0,0|0,0,2]=4 92 B12R1.121 CCNCc1ccccc1OC CSC000186928 [0,2,0,0,0,0|0,0,2]=4 93 B12R1.121 CCSCc1ccccc1OC CSC000044553 [0,2,0,0,0,0|0,0,2]=4 94 B12R1.121 COc1ccccc1OCC=C CSC000006401 [0,2,0,0,0,0|0,0,0]=2 95 B12R1.121 COc1ccccc1OCCO CSC011305853 [0,2,0,0,0,0|1,0,1]=4 96 B12R1.121 COc1ccccc1SCC#N CSC011448407 [0,2,0,0,0,0|1,0,1]=4 97 B12R1.121 COc1ccccc1SCC=C CSC000055742 [0,2,0,0,0,0|0,0,0]=2 98 B12R1.121 COc1ccccc1SCCO CSC011448452 [0,2,0,0,0,0|1,0,1]=4 99 B12R1.121 OCc1ccccc1OCC=C CSC000246290 [0,2,0,0,0,0|0,0,0]=2 100 B12R1.125 CC(=C)COc1ccccc1C CSC000171510 [0,2,0,0,0,0|1,0,0]=3 101 B12R1.125 CC(=C)CSc1ccccc1C CSC000053913 [0,2,0,0,0,0|1,0,0]=3 102 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [0,2,0,0,0,0|1,0,1]=4 103 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [0,2,0,0,0,0|1,0,1]=4 104 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [0,2,0,0,0,0|1,0,1]=4 105 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [0,2,0,0,0,0|1,0,1]=4 106 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [0,2,0,0,0,0|1,0,1]=4 108 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [0,2,0,0,0,0|1,0,1]=4 109 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [0,2,0,0,0,0|2,0,0]=4 110 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [0,2,0,0,0,0|1,0,0]=3 112 B12R1.125 OC(=O)COc1ccccc1F CSC000182486 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.371 CNC(=O)Cc1ccccc1Br CSC009816160 [0,2,0,0,0,0|1,0,1]=4 114 B12R1.371 CNC(=O)Cc1ccccc1C CSC000175625 [0,2,0,0,0,0|1,0,1]=4 115 B12R1.371 CNC(=O)Cc1ccccc1Cl CSC000159959 [0,2,0,0,0,0|1,0,1]=4 116 B12R1.371 CNC(=O)Cc1ccccc1F CSC000159918 [0,2,0,0,0,0|1,0,1]=4 117 B12R1.371 CNC(=O)Cc1ccccc1N CSC000738506 [0,2,0,0,0,0|1,0,1]=4 118 B12R1.371 COC(=O)Cc1ccccc1Br CSC000699816 [0,2,0,0,0,0|1,0,1]=4 119 B12R1.371 COC(=O)Cc1ccccc1C CSC000175439 [0,2,0,0,0,0|1,0,1]=4 120 B12R1.371 COC(=O)Cc1ccccc1F CSC000149365 [0,2,0,0,0,0|1,0,1]=4 121 B12R1.371 COC(=O)Cc1ccccc1O CSC000758901 [0,2,0,0,0,0|0,0,1]=3 122 B12R1.371 Cc1ccccc1CC(=O)NN CSC000190038 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.371 Cc1ccccc1CC(=O)NO CSC000190267 [0,2,0,0,0,0|2,0,0]=4 124 B12R1.371 NNC(=O)Cc1ccccc1Cl CSC000189918 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.371 NNC(=O)Cc1ccccc1F CSC000190036 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.374 Cc1ccc(c(c1)SCC=C)C CSC000006498 [0,2,0,0,0,0|1,0,0]=3 127 B12R1.374 Cc1ccc(cc1OCC=C)Br CSC013996621 [0,2,0,0,0,0|1,0,0]=3 128 B12R1.374 Fc1ccc(cc1OCC=C)Br CSC013224552 [0,2,0,0,0,0|1,0,0]=3 129 B12R1.1631 Fc1cccc(c1OCC=C)F CSC000047891 [0,2,0,0,0,0|1,0,0]=3 130 B12R1.75 COc1ccccc1CC(=O)N CSC000162009 [0,2,0,0,0,0|1,0,0]=3 131 B12R1.75 COc1ccccc1OC(=O)C CSC000002000 [0,2,0,0,0,0|1,0,1]=4 132 B12R1.169 CCOc1ccccc1CC=C CSC011198606 [0,2,0,0,0,0|0,0,0]=2 133 B12R1.169 CCOc1ccccc1CCO CSC011754905 [0,2,0,0,0,0|1,0,1]=4 134 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl CSC010293595 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.233 NC(=O)Cc1ccc(cc1Br)F CSC010883721 [0,2,0,0,0,0|2,0,0]=4 136 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl CSC000162283 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.233 NC(=O)Cc1ccc(cc1Cl)F CSC000034102 [0,2,0,0,0,0|2,0,0]=4 138 B12R1.127 CC(=O)Nc1cc(ccc1O)Br CSC010005742 [0,2,0,0,0,0|1,0,1]=4 139 B12R1.127 CC(=O)Nc1cc(ccc1O)C CSC000035807 [0,2,0,0,0,0|1,0,1]=4 140 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl CSC000012038 [0,2,0,0,0,0|1,0,1]=4 141 B12R1.127 Cc1ccc(c(c1)CC(=O)N)C CSC011694954 [0,2,0,0,0,0|2,0,0]=4 142 B12R1.1009 CC(=O)Nc1c(cccc1O)C CSC000103797 [0,2,0,0,0,0|1,0,1]=4 143 B12R1.1009 NC(=O)Cc1c(cccc1Cl)F CSC000162243 [0,2,0,0,0,0|2,0,0]=4 144 B12R2.32 CSc1nc2ccccc2o1 CSC000000691 [0,1,0,1,0,0|1,0,1]=4 145 B12R2.18 Cn1c2ccccc2oc1=O CSC000171226 [0,1,0,1,0,0|2,0,0]=4