0 B15R2.555 CN1CCCCC1c2ccccc2Br 2230a_100010004825_200000210301 [1,0,0,0,0,0|2,1,0]=4 1 B15R2.555 CN1CCCCC1c2ccccc2Br 269982a_100010004825_200000210301 [1,0,0,0,0,0|2,1,0]=4 2 B15R2.555 CN1CCCCC1c2ccccc2Br 34a_100010004825_200000210301 [1,0,0,0,0,0|2,1,0]=4 3 B15R2.555 CN1CCCCC1c2ccccc2Cl 2230a_100011804123_200000210301 [1,0,0,0,0,0|2,0,0]=3 4 B15R2.555 CN1CCCCC1c2ccccc2Cl 269982a_100011804123_200000210301 [1,0,0,0,0,0|2,0,0]=3 5 B15R2.555 CN1CCCCC1c2ccccc2Cl 34a_100011804123_200000210301 [1,0,0,0,0,0|2,0,0]=3 6 B15R2.555 CN1CCCCC1c2ccccc2F 2230a_100011223933_200000210301 [1,0,0,0,0,0|2,1,0]=4 7 B15R2.555 CN1CCCCC1c2ccccc2F 269982a_100011223933_200000210301 [1,0,0,0,0,0|2,1,0]=4 8 B15R2.555 CN1CCCCC1c2ccccc2F 34a_100011223933_200000210301 [1,0,0,0,0,0|2,1,0]=4 9 B15R2.555 O=C1CCCCN1c2ccccc2O 271570a_203496583355_200000217094 [1,0,0,0,0,0|2,0,0]=3 10 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Br 2230a_100010004825_200025704644 [1,0,0,0,0,0|2,1,0]=4 11 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Br 269982a_100010004825_200025704644 [1,0,0,0,0,0|2,1,0]=4 12 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Br 34a_100010004825_200025704644 [1,0,0,0,0,0|2,1,0]=4 13 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 2230a_100011804123_200025704644 [1,0,0,0,0,0|2,0,0]=3 14 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 269982a_100011804123_200025704644 [1,0,0,0,0,0|2,0,0]=3 15 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 34a_100011804123_200025704644 [1,0,0,0,0,0|2,0,0]=3 16 B15R2.555 [13CH3]N1CCCCC1c2ccccc2F 2230a_100011223933_200025704644 [1,0,0,0,0,0|2,1,0]=4 17 B15R2.555 [13CH3]N1CCCCC1c2ccccc2F 269982a_100011223933_200025704644 [1,0,0,0,0,0|2,1,0]=4 18 B15R2.555 [13CH3]N1CCCCC1c2ccccc2F 34a_100011223933_200025704644 [1,0,0,0,0,0|2,1,0]=4 19 B15R1.3965 C#CCCOCC(N)c1ccccc1Cl 34a_100138412506_100000688953 [0,0,1,0,0,0|2,0,1]=4 20 B15R1.3965 C#CCOCCC(N)c1ccccc1Cl 34a_100011661560_100000184674 [0,0,1,0,0,0|2,0,1]=4 21 B15R1.3965 C/C=C/COCC(N)c1ccccc1Cl 34a_100138412506_100102629194 [0,0,1,0,0,0|2,0,1]=4 22 B15R1.3965 C=CCCCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215482 [0,0,1,0,0,0|2,0,1]=4 23 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 2230a_100000219374_100011215482 [0,0,1,0,0,0|3,0,0]=4 24 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 269982a_100000219374_100011215482 [0,0,1,0,0,0|3,0,0]=4 25 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 34a_100000219374_100011215482 [0,0,1,0,0,0|3,0,0]=4 26 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 2230a_100000174978_100011713584 [0,0,1,0,0,0|3,0,0]=4 27 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 2230a_100000700776_100000181259 [0,0,1,0,0,0|3,0,0]=4 28 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 269862a_100000700776_100000210134 [0,0,1,0,0,0|3,0,0]=4 29 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 34a_100000174978_100000757094 [0,0,1,0,0,0|3,0,0]=4 30 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 34a_100000740796_100000757094 [0,0,1,0,0,0|3,0,0]=4 31 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 7a_100000740796_100000757094 [0,0,1,0,0,0|3,0,0]=4 32 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 7a_100000758997_100000181259 [0,0,1,0,0,0|3,0,0]=4 33 B15R1.3965 C=CCCNCC(O)c1ccccc1Cl 2230a_200000759403_100000754431 [0,0,1,0,0,0|3,0,0]=4 34 B15R1.3965 C=CCCNCC(O)c1ccccc1Cl 34a_200000759403_100000754431 [0,0,1,0,0,0|3,0,0]=4 35 B15R1.3965 C=CCCOCC(N)c1ccccc1Cl 34a_100138412506_100000754431 [0,0,1,0,0,0|2,0,0]=3 36 B15R1.3965 C=CCCOCC(N)c1ccncc1Cl 34a_200020642286_100000754431 [0,0,1,0,0,0|3,0,0]=4 37 B15R1.3965 C=CCCOC[C@@H](N)c1ccccc1Br 34a_100161155918_100000754431 [0,0,1,0,0,0|2,1,0]=4 38 B15R1.3965 C=CCCOC[C@H](N)c1ccccc1F 34a_100009818778_100000754431 [0,0,1,0,0,0|2,1,0]=4 39 B15R1.3965 C=CCOCCC(N)c1ccccc1Cl 34a_100011661560_100015514636 [0,0,1,0,0,0|2,0,0]=3 40 B15R1.3965 C=CCOCCC(N)c1ccccc1F 34a_100011661569_100015514636 [0,0,1,0,0,0|2,1,0]=4 41 B15R1.3965 CC(NCCCC=O)c1ccccc1Br 2230a_100000181357_200011292268 [0,0,1,0,0,0|2,1,0]=4 42 B15R1.3965 CC(NCCCC=O)c1ccccc1Cl 2230a_100000174978_200011292268 [0,0,1,0,0,0|2,0,0]=3 43 B15R1.3965 CC(NCCCC=O)c1ccccc1F 2230a_100000181408_200011292268 [0,0,1,0,0,0|2,1,0]=4 44 B15R1.3965 CC(OCCCC=O)c1ccccc1Br 7a_100000702211_200011292268 [0,0,1,0,0,0|2,1,0]=4 45 B15R1.3965 CC(OCCCC=O)c1ccccc1Cl 7a_100000740796_200011292268 [0,0,1,0,0,0|2,0,0]=3 46 B15R1.3965 CC(OCCCC=O)c1ccccc1F 7a_100000697922_200011292268 [0,0,1,0,0,0|2,1,0]=4 47 B15R1.3965 CC(OCCCC=O)c1ccccc1N 7a_100011405641_200011292268 [0,0,1,0,0,0|3,0,0]=4 48 B15R1.3965 CC(OCCCC=O)c1cccnc1Cl 7a_100009865335_200011292268 [0,0,1,0,0,0|3,0,0]=4 49 B15R1.3965 CC(SCCCC=O)c1ccccc1Cl 62a_100000181259_200011292268 [0,0,1,0,0,0|2,0,0]=3 50 B15R1.3965 CC(SCCCC=O)c1ccccc1Cl 62a_200011292268_100000181259 [0,0,1,0,0,0|2,0,0]=3 51 B15R1.3965 CC(SCCCC=O)c1ccccc1F 62a_200000741388_200011292268 [0,0,1,0,0,0|2,1,0]=4 52 B15R1.3965 CC(SCCCC=O)c1ccccc1F 62a_200011292268_200000741388 [0,0,1,0,0,0|2,1,0]=4 53 B15R1.3965 CC=CCOCC(N)c1ccccc1Cl 34a_100138412506_100000070051 [0,0,1,0,0,0|2,0,1]=4 54 B15R1.3965 CCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000210210 [0,0,1,0,0,0|2,0,1]=4 55 B15R1.3965 CCCOCCC(N)c1ccccc1Cl 34a_100011661560_100000210303 [0,0,1,0,0,0|2,0,1]=4 56 B15R1.3965 CN(CCCCC=O)c1ccccc1Br 2230a_100020606079_100000139335 [0,0,1,0,0,0|2,1,0]=4 57 B15R1.3965 CN(CCCCC=O)c1ccccc1Br 269982a_100020606079_100000139335 [0,0,1,0,0,0|2,1,0]=4 58 B15R1.3965 CN(CCCCC=O)c1ccccc1Cl 2230a_100000219374_100000139335 [0,0,1,0,0,0|2,0,0]=3 59 B15R1.3965 CN(CCCCC=O)c1ccccc1Cl 269982a_100000219374_100000139335 [0,0,1,0,0,0|2,0,0]=3 60 B15R1.3965 CN(CCCCC=O)c1ccccc1F 2230a_100000220357_100000139335 [0,0,1,0,0,0|2,1,0]=4 61 B15R1.3965 CN(CCCCC=O)c1ccccc1F 269982a_100000220357_100000139335 [0,0,1,0,0,0|2,1,0]=4 62 B15R1.3965 CN(CCCCC=O)c1ccccc1O 269982a_100000033821_100000139335 [0,0,1,0,0,0|3,0,0]=4 63 B15R1.3965 COCCOCC(N)c1ccccc1Cl 34a_100138412506_100011201679 [0,0,1,0,0,0|3,0,0]=4 64 B15R1.3965 CSCCOCC(N)c1ccccc1Cl 34a_100138412506_100000212216 [0,0,1,0,0,0|3,0,0]=4 65 B15R1.3965 CSCOCCC(N)c1ccccc1Cl 34a_100011661560_100011218213 [0,0,1,0,0,0|3,0,0]=4 66 B15R1.3965 C[C@@H](NCCCC=O)c1ccccc1O 2230a_100025703389_200011292268 [0,0,1,0,0,0|3,0,0]=4 67 B15R1.3965 Cc1ccccc1C(C)NCCCC=O 2230a_100000181355_200011292268 [0,0,1,0,0,0|3,0,0]=4 68 B15R1.3965 Cc1ccccc1C(C)OCCCC=O 7a_100000742021_200011292268 [0,0,1,0,0,0|3,0,0]=4 69 B15R1.3965 Cc1ccccc1N(C)CCCCC=O 2230a_100000219699_100000139335 [0,0,1,0,0,0|3,0,0]=4 70 B15R1.3965 Cc1ccccc1N(C)CCCCC=O 269982a_100000219699_100000139335 [0,0,1,0,0,0|3,0,0]=4 71 B15R1.3965 NC(CCOCC=O)c1ccccc1Cl 34a_100011661560_200009817547 [0,0,1,0,0,0|1,0,0]=2 72 B15R1.3965 NC(CCOCC=O)c1ccccc1F 34a_100011661569_200009817547 [0,0,1,0,0,0|1,1,0]=3 73 B15R1.3965 NC(CCOCCF)c1ccccc1Cl 34a_100011661560_100011217306 [0,0,1,0,0,0|2,0,1]=4 74 B15R1.3965 NC(CCOCCO)c1ccccc1Cl 34a_100011661560_100000211926 [0,0,1,0,0,0|1,0,2]=4 75 B15R1.3965 NC(COCCCF)c1ccccc1Cl 34a_100138412506_100011934791 [0,0,1,0,0,0|2,0,1]=4 76 B15R1.3965 NC(COCCCO)c1ccccc1Cl 34a_100138412506_100000230001 [0,0,1,0,0,0|1,0,2]=4 77 B15R1.5837 C#CCCC(=O)C(C)c1ccccc1Cl 1458a_100000692101_100000181259 [0,0,1,0,0,0|1,0,2]=4 78 B15R1.5837 C#CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000753159 [0,0,1,0,0,0|1,0,2]=4 79 B15R1.5837 C#CCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000753159 [0,0,1,0,0,0|1,0,2]=4 80 B15R1.5837 C/C=C/CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100102629194 [0,0,1,0,0,0|1,0,2]=4 81 B15R1.5837 C/C=C/CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100102629194 [0,0,1,0,0,0|1,0,2]=4 82 B15R1.5837 C=CCCC(=O)C(C)c1ccccc1Cl 1458a_100000749702_100000181259 [0,0,1,0,0,0|1,0,2]=4 83 B15R1.5837 C=CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000754431 [0,0,1,0,0,0|1,0,2]=4 84 B15R1.5837 C=CCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000754431 [0,0,1,0,0,0|1,0,2]=4 85 B15R1.5837 CC#CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000748600 [0,0,1,0,0,0|1,0,2]=4 86 B15R1.5837 CC#CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000748600 [0,0,1,0,0,0|1,0,2]=4 87 B15R1.5837 CC(C(=O)CCC#N)c1ccccc1Cl 1458a_100011667492_100011215226 [0,0,1,0,0,0|2,0,1]=4 88 B15R1.5837 CC(C(=O)CCC#N)c1ccccc1Cl 1458a_100011934036_100000181259 [0,0,1,0,0,0|2,0,1]=4 89 B15R1.5837 CC(C(=O)CCCF)c1ccccc1Br 1458a_100012359601_100011934791 [0,0,1,0,0,0|2,1,0]=4 90 B15R1.5837 CC(C(=O)CCCF)c1ccccc1Cl 1458a_100011667492_100011934791 [0,0,1,0,0,0|2,0,0]=3 91 B15R1.5837 CC(C(=O)CCCO)c1ccccc1Br 1458a_100012359601_100011215043 [0,0,1,0,0,0|2,1,0]=4 92 B15R1.5837 CC(C(=O)CCCO)c1ccccc1Cl 1458a_100011667492_100011215043 [0,0,1,0,0,0|2,0,0]=3 93 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 11a_100000724931_100011667492 [0,0,1,0,0,0|3,0,0]=4 94 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 1626a_100000724931_100011667492 [0,0,1,0,0,0|3,0,0]=4 95 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 240690a_100000724931_100011667492 [0,0,1,0,0,0|3,0,0]=4 96 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 527a_100000724931_100011667492 [0,0,1,0,0,0|3,0,0]=4 97 B15R1.5837 CC(C(=O)NCCO)c1ccccc1Cl 240690a_100000210304_100011667492 [0,0,1,0,0,0|3,0,0]=4 98 B15R1.5837 CC(C(=O)NCCO)c1ccccc1Cl 527a_100000210304_100011667492 [0,0,1,0,0,0|3,0,0]=4 99 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000070051 [0,0,1,0,0,0|1,0,2]=4 100 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100121576822_100000181259 [0,0,1,0,0,0|1,0,2]=4 101 B15R1.5837 CC=CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000070051 [0,0,1,0,0,0|1,0,2]=4 102 B15R1.5837 CCC#CC(=O)C(C)c1ccccc1Cl 1458a_100011827653_100000181259 [0,0,1,0,0,0|1,0,2]=4 103 B15R1.5837 CCC=CC(=O)C(C)c1ccccc1Cl 1458a_100000212282_100000181259 [0,0,1,0,0,0|1,0,2]=4 104 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210211 [0,0,1,0,0,0|1,1,0]=3 105 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Cl 1458a_100000210183_100000181259 [0,0,1,0,0,0|1,0,0]=2 106 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210211 [0,0,1,0,0,0|1,0,0]=2 107 B15R1.5837 CCCCC(=O)C(C)c1ccccc1F 1458a_100000210183_200000741388 [0,0,1,0,0,0|1,1,0]=3 108 B15R1.5837 CCCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210211 [0,0,1,0,0,0|1,1,0]=3 109 B15R1.5837 CCCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210211 [0,0,1,0,0,0|1,0,0]=2 110 B15R1.5837 CCCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210211 [0,0,1,0,0,0|1,1,0]=3 111 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210183 [0,0,1,0,0,0|2,1,0]=4 112 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210183 [0,0,1,0,0,0|2,1,0]=4 113 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210183 [0,0,1,0,0,0|3,0,0]=4 114 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210183 [0,0,1,0,0,0|3,0,0]=4 115 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210183 [0,0,1,0,0,0|3,0,0]=4 116 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210183 [0,0,1,0,0,0|2,0,0]=3 117 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210183 [0,0,1,0,0,0|2,0,0]=3 118 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210183 [0,0,1,0,0,0|2,1,0]=4 119 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210183 [0,0,1,0,0,0|2,1,0]=4 120 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210183 [0,0,1,0,0,0|2,1,0]=4 121 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210183 [0,0,1,0,0,0|3,0,0]=4 122 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210183 [0,0,1,0,0,0|3,0,0]=4 123 B15R1.5837 CCCCN(C)C(C)c1ccccc1Cl 2230a_100000207549_100000181259 [0,0,1,0,0,0|3,0,0]=4 124 B15R1.5837 CCCCN(C)C(C)c1ccccc1Cl 269982a_100000207549_100000181259 [0,0,1,0,0,0|3,0,0]=4 125 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 11a_100020643023_100012359601 [0,0,1,0,0,0|2,1,0]=4 126 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 1626a_100020643023_100012359601 [0,0,1,0,0,0|2,1,0]=4 127 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 240690a_100020643023_100012359601 [0,0,1,0,0,0|2,1,0]=4 128 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 527a_100020643023_100012359601 [0,0,1,0,0,0|2,1,0]=4 129 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 11a_100020643023_100011667492 [0,0,1,0,0,0|2,0,0]=3 130 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 1626a_100020643023_100011667492 [0,0,1,0,0,0|2,0,0]=3 131 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 240690a_100020643023_100011667492 [0,0,1,0,0,0|2,0,0]=3 132 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 527a_100020643023_100011667492 [0,0,1,0,0,0|2,0,0]=3 133 B15R1.5837 CCCNC(=O)C(O)c1ccccc1Br 240690a_100020643023_200011356456 [0,0,1,0,0,0|2,1,0]=4 134 B15R1.5837 CCCNC(=O)C(O)c1ccccc1Cl 240690a_100020643023_100011217820 [0,0,1,0,0,0|2,0,0]=3 135 B15R1.5837 CCCNC(=O)C(O)c1ccccc1F 240690a_100020643023_100011219519 [0,0,1,0,0,0|2,1,0]=4 136 B15R1.5837 CCCNC(=O)N(C)c1ccccc1Cl 512a_100020643023_100000219374 [0,0,1,0,0,0|3,0,0]=4 137 B15R1.5837 CCNNC(=O)C(C)c1ccccc1Cl 22a_100000756455_100011667492 [0,0,1,0,0,0|3,0,0]=4 138 B15R1.5837 CCNNC(=O)C(O)c1ccccc1Cl 22a_100000756455_100011217820 [0,0,1,0,0,0|3,0,0]=4 139 B15R1.5837 CCOCC(=O)C(C)c1ccccc1Cl 1458a_100000211967_100000181259 [0,0,1,0,0,0|2,0,0]=3 140 B15R1.5837 CCOCC(=O)C(C)c1ccccc1F 1458a_100000211967_200000741388 [0,0,1,0,0,0|2,1,0]=4 141 B15R1.5837 CCOCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000211967 [0,0,1,0,0,0|3,0,0]=4 142 B15R1.5837 CCOCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000211967 [0,0,1,0,0,0|3,0,0]=4 143 B15R1.5837 CCSCC(=O)C(C)c1ccccc1Cl 1458a_100000230394_100000181259 [0,0,1,0,0,0|2,0,0]=3 144 B15R1.5837 CCSCC(=O)C(C)c1ccccc1F 1458a_100000230394_200000741388 [0,0,1,0,0,0|2,1,0]=4 145 B15R1.5837 CCSCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000230394 [0,0,1,0,0,0|3,0,0]=4 146 B15R1.5837 CCSCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000230394 [0,0,1,0,0,0|3,0,0]=4 147 B15R1.5837 COCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000233755 [0,0,1,0,0,0|2,1,0]=4 148 B15R1.5837 COCCC(=O)C(C)c1ccccc1Cl 1458a_100000749529_100000181259 [0,0,1,0,0,0|2,0,0]=3 149 B15R1.5837 COCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000233755 [0,0,1,0,0,0|2,0,0]=3 150 B15R1.5837 COCCC(=O)C(C)c1ccccc1F 1458a_100000749529_200000741388 [0,0,1,0,0,0|2,1,0]=4 151 B15R1.5837 COCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000233755 [0,0,1,0,0,0|2,1,0]=4 152 B15R1.5837 COCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000233755 [0,0,1,0,0,0|2,0,0]=3 153 B15R1.5837 COCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000233755 [0,0,1,0,0,0|2,1,0]=4 154 B15R1.5837 COCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000749529 [0,0,1,0,0,0|3,0,0]=4 155 B15R1.5837 COCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000749529 [0,0,1,0,0,0|3,0,0]=4 156 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000751147 [0,0,1,0,0,0|2,1,0]=4 157 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Cl 1458a_100000174002_100000181259 [0,0,1,0,0,0|2,0,0]=3 158 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000751147 [0,0,1,0,0,0|2,0,0]=3 159 B15R1.5837 CSCCC(=O)C(C)c1ccccc1F 1458a_100000174002_200000741388 [0,0,1,0,0,0|2,1,0]=4 160 B15R1.5837 CSCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000751147 [0,0,1,0,0,0|2,1,0]=4 161 B15R1.5837 CSCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000751147 [0,0,1,0,0,0|2,0,0]=3 162 B15R1.5837 CSCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000751147 [0,0,1,0,0,0|2,1,0]=4 163 B15R1.5837 CSCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000174002 [0,0,1,0,0,0|3,0,0]=4 164 B15R1.5837 CSCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000174002 [0,0,1,0,0,0|3,0,0]=4 165 B15R1.5837 N#CCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100011215226 [0,0,1,0,0,0|2,0,1]=4 166 B15R1.5837 O=C(CCCF)C(O)c1ccccc1Br 1458a_200011356456_100011934791 [0,0,1,0,0,0|2,1,0]=4 167 B15R1.5837 O=C(CCCF)C(O)c1ccccc1Cl 1458a_100011217820_100011934791 [0,0,1,0,0,0|2,0,0]=3 168 B15R1.5837 O=C(CCCF)C(O)c1ccccc1F 1458a_100011219519_100011934791 [0,0,1,0,0,0|2,1,0]=4 169 B15R1.5837 O=C(CCCO)C(O)c1ccccc1Br 1458a_200011356456_100011215043 [0,0,1,0,0,0|2,1,0]=4 170 B15R1.5837 O=C(CCCO)C(O)c1ccccc1Cl 1458a_100011217820_100011215043 [0,0,1,0,0,0|2,0,0]=3 171 B15R1.5837 O=C(CCCO)C(O)c1ccccc1F 1458a_100011219519_100011215043 [0,0,1,0,0,0|2,1,0]=4 172 B15R1.5837 O=C(NCCF)C(O)c1ccccc1Cl 240690a_100000724931_100011217820 [0,0,1,0,0,0|3,0,0]=4 173 B15R1.5837 O=C(NCCO)C(O)c1ccccc1Cl 240690a_100000210304_100011217820 [0,0,1,0,0,0|3,0,0]=4 174 B15R1.9806 CC(C)(C(=O)CCF)c1ccccc1F 1458a_100000748980_100011217306 [0,0,1,0,0,0|2,1,0]=4 175 B15R1.9806 CC(C)(C(=O)CCF)c1cccnc1Cl 1458a_100011017506_100011217306 [0,0,1,0,0,0|3,0,0]=4 176 B15R1.9806 CC(C)(C(=O)CCO)c1ccccc1F 1458a_100000748980_100000211926 [0,0,1,0,0,0|2,1,0]=4 177 B15R1.9806 CC(C)(C(=O)CCO)c1cccnc1Cl 1458a_100011017506_100000211926 [0,0,1,0,0,0|3,0,0]=4 178 B15R1.9806 CCCC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000210303 [0,0,1,0,0,0|1,1,0]=3 179 B15R1.9806 CCCC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000210303 [0,0,1,0,0,0|2,0,0]=3 180 B15R1.9806 CCCC(=O)C(F)(F)c1ccccc1F 1458a_100000211992_100000070671 [0,0,1,0,0,0|2,1,0]=4 181 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 11a_100015525214_100000748980 [0,0,1,0,0,0|2,1,0]=4 182 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 240690a_100015525214_100000748980 [0,0,1,0,0,0|2,1,0]=4 183 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 527a_100015525214_100000748980 [0,0,1,0,0,0|2,1,0]=4 184 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 11a_100015525214_100011017506 [0,0,1,0,0,0|3,0,0]=4 185 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 240690a_100015525214_100011017506 [0,0,1,0,0,0|3,0,0]=4 186 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 527a_100015525214_100011017506 [0,0,1,0,0,0|3,0,0]=4 187 B15R1.9806 CCNC(=O)C(F)(F)c1ccccc1Cl 11a_100015525214_100011667290 [0,0,1,0,0,0|3,0,0]=4 188 B15R1.9806 CCNC(=O)C(F)(F)c1ccccc1Cl 240690a_100015525214_100011667290 [0,0,1,0,0,0|3,0,0]=4 189 B15R1.9806 CCNC(=O)C(F)(F)c1ccccc1Cl 527a_100015525214_100011667290 [0,0,1,0,0,0|3,0,0]=4 190 B14R1.38 C=CCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000754431 [1,0,1,0,0,0|2,0,0]=4 191 B14R1.38 C=CCOCC[C@H](N)c1ccccc1 34a_100025705951_100015514636 [1,0,1,0,0,0|2,0,0]=4 192 B14R1.38 CC(SCCCC=O)c1ccccc1 62a_100000230085_200011292268 [1,0,1,0,0,0|2,0,0]=4 193 B14R1.38 CC(SCCCC=O)c1ccccc1 62a_200011292268_100000230085 [1,0,1,0,0,0|2,0,0]=4 194 B14R1.38 CN(CCCCC=O)c1ccccc1 2230a_100000210012_100000139335 [1,0,1,0,0,0|2,0,0]=4 195 B14R1.38 CN(CCCCC=O)c1ccccc1 269982a_100000210012_100000139335 [1,0,1,0,0,0|2,0,0]=4 196 B14R1.38 C[C@@H](NCCCC=O)c1ccccc1 2230a_100000751104_200011292268 [1,0,1,0,0,0|2,0,0]=4 197 B14R1.38 C[C@@H](OCCCC=O)c1ccccc1 7a_100000761318_200011292268 [1,0,1,0,0,0|2,0,0]=4 198 B14R1.38 N[C@@H](CCOCC=O)c1ccccc1 34a_100025705951_200009817547 [1,0,1,0,0,0|1,0,0]=3 199 B14R1.38 O=CCNCCC(O)c1ccccc1 2230a_100000763605_200015260668 [1,0,1,0,0,0|2,0,0]=4 200 B14R1.38 O=CCSCC[C@@H](O)c1ccccc1 62a_100000729684_200015260668 [1,0,1,0,0,0|2,0,0]=4 201 B14R1.38 O=CCSCC[C@@H](O)c1ccccc1 62a_200015260668_100000729684 [1,0,1,0,0,0|2,0,0]=4 202 B14R1.882 C=CCCCCNc1ccccc1Cl 34a_100000185783_100011215482 [1,0,1,0,0,0|2,0,0]=4 203 B14R1.882 C=CCCCCOc1ccccc1Cl 34a_100000210172_100011215482 [1,0,1,0,0,0|2,0,0]=4 204 B14R1.882 C=CCCCCOc1ccccc1Cl 7a_100000210172_100011215482 [1,0,1,0,0,0|2,0,0]=4 205 B14R1.882 C=CCCCCSc1ccccc1Cl 62a_100000764095_100011215482 [1,0,1,0,0,0|2,0,0]=4 206 B14R1.882 C=CCCCCSc1ccccc1Cl 62a_100011215482_100000764095 [1,0,1,0,0,0|2,0,0]=4 207 B14R1.882 C=CCCCNCc1ccccc1Cl 2230a_100000174879_100011713584 [1,0,1,0,0,0|2,0,0]=4 208 B14R1.882 C=CCCCNCc1ccccc1Cl 2230a_100000700776_100000187162 [1,0,1,0,0,0|2,0,0]=4 209 B14R1.882 C=CCCCNCc1ccccc1Cl 270004a_100000700776_100000210073 [1,0,1,0,0,0|2,0,0]=4 210 B14R1.882 C=CCCCNCc1ccccc1Cl 34a_100000174879_100000757094 [1,0,1,0,0,0|2,0,0]=4 211 B14R1.882 C=CCCCNCc1ccccc1Cl 34a_100000700776_100000187162 [1,0,1,0,0,0|2,0,0]=4 212 B14R1.882 C=CCCCOCc1ccccc1Cl 34a_100000210847_100000757094 [1,0,1,0,0,0|2,0,0]=4 213 B14R1.882 C=CCCCOCc1ccccc1Cl 34a_100000758997_100000187162 [1,0,1,0,0,0|2,0,0]=4 214 B14R1.882 C=CCCCOCc1ccccc1Cl 7a_100000210847_100000757094 [1,0,1,0,0,0|2,0,0]=4 215 B14R1.882 C=CCCCOCc1ccccc1Cl 7a_100000758997_100000187162 [1,0,1,0,0,0|2,0,0]=4 216 B14R1.882 C=CCCCSCc1ccccc1Cl 62a_100000187162_100000757094 [1,0,1,0,0,0|2,0,0]=4 217 B14R1.882 C=CCCCSCc1ccccc1Cl 62a_100011713584_100000187162 [1,0,1,0,0,0|2,0,0]=4 218 B14R1.882 C=CCCNCCc1ccccc1Cl 2230a_100011207228_100000754431 [1,0,1,0,0,0|2,0,0]=4 219 B14R1.882 C=CCCNCCc1ccccc1Cl 2230a_100015191253_100011713703 [1,0,1,0,0,0|2,0,0]=4 220 B14R1.882 C=CCCNCCc1ccccc1Cl 270004a_100015191253_200011713468 [1,0,1,0,0,0|2,0,0]=4 221 B14R1.882 C=CCCNCCc1ccccc1Cl 34a_100011207228_100000754431 [1,0,1,0,0,0|2,0,0]=4 222 B14R1.882 C=CCCOCCc1ccccc1Cl 34a_100011205117_100011713703 [1,0,1,0,0,0|2,0,0]=4 223 B14R1.882 C=CCCOCCc1ccccc1Cl 34a_100011215284_100000754431 [1,0,1,0,0,0|2,0,0]=4 224 B14R1.882 C=CCCOCCc1ccccc1Cl 7a_100011215284_100000754431 [1,0,1,0,0,0|2,0,0]=4 225 B14R1.882 C=CCCSCCc1ccccc1Cl 62a_100000754431_100011713703 [1,0,1,0,0,0|2,0,0]=4 226 B14R1.882 C=CCCSCCc1ccccc1Cl 62a_100011713703_100000754431 [1,0,1,0,0,0|2,0,0]=4 227 B14R1.882 C=CCOCCCc1ccccc1Cl 34a_100011709251_100015514636 [1,0,1,0,0,0|2,0,0]=4 228 B14R1.882 C=CCOCCCc1ccccc1Cl 7a_100011709251_100015514636 [1,0,1,0,0,0|2,0,0]=4 229 B14R1.882 Cc1ccccc1COCCCC=O 7a_100000698903_200011292268 [1,0,1,0,0,0|2,0,0]=4 230 B14R1.882 Cc1ccccc1CSCCCC=O 62a_100000211839_200011292268 [1,0,1,0,0,0|2,0,0]=4 231 B14R1.882 Cc1ccccc1CSCCCC=O 62a_200011292268_100000211839 [1,0,1,0,0,0|2,0,0]=4 232 B14R1.882 Cc1ccccc1OCCCCC=O 7a_100000210338_100000139335 [1,0,1,0,0,0|2,0,0]=4 233 B14R1.882 Cc1ccccc1SCCCCC=O 62a_100000139335_100000210755 [1,0,1,0,0,0|2,0,0]=4 234 B14R1.882 Cc1ccccc1SCCCCC=O 62a_100000210755_100000139335 [1,0,1,0,0,0|2,0,0]=4 235 B14R1.882 Nc1ccccc1OCCCCC=O 7a_100000185747_100000139335 [1,0,1,0,0,0|2,0,0]=4 236 B14R1.882 Nc1ccccc1SCCCCC=O 62a_100000139335_100000210017 [1,0,1,0,0,0|2,0,0]=4 237 B14R1.882 Nc1ccccc1SCCCCC=O 62a_100000210017_100000139335 [1,0,1,0,0,0|2,0,0]=4 238 B14R1.882 O=CCCCCOc1ccccc1Br 7a_100000181306_100000139335 [1,0,1,0,0,0|1,1,0]=4 239 B14R1.882 O=CCCCCOc1ccccc1Cl 7a_100000210172_100000139335 [1,0,1,0,0,0|1,0,0]=3 240 B14R1.882 O=CCCCCOc1ccccc1F 7a_100000210171_100000139335 [1,0,1,0,0,0|1,1,0]=4 241 B14R1.882 O=CCCCCOc1ccccc1I 7a_100000739446_100000139335 [1,0,1,0,0,0|1,1,0]=4 242 B14R1.882 O=CCCCCOc1cccnc1Cl 7a_100000757616_100000139335 [1,0,1,0,0,0|2,0,0]=4 243 B14R1.882 O=CCCCCSc1ccccc1Br 62a_100000139335_100000695589 [1,0,1,0,0,0|1,1,0]=4 244 B14R1.882 O=CCCCCSc1ccccc1Br 62a_100000695589_100000139335 [1,0,1,0,0,0|1,1,0]=4 245 B14R1.882 O=CCCCCSc1ccccc1Cl 62a_100000139335_100000764095 [1,0,1,0,0,0|1,0,0]=3 246 B14R1.882 O=CCCCCSc1ccccc1Cl 62a_100000764095_100000139335 [1,0,1,0,0,0|1,0,0]=3 247 B14R1.882 O=CCCCCSc1ccccc1F 62a_100000139335_100011215700 [1,0,1,0,0,0|1,1,0]=4 248 B14R1.882 O=CCCCCSc1ccccc1F 62a_100011215700_100000139335 [1,0,1,0,0,0|1,1,0]=4 249 B14R1.882 O=CCCCCSc1ccccc1O 62a_100000139335_100000739446 [1,0,1,0,0,0|2,0,0]=4 250 B14R1.882 O=CCCCCSc1ccccc1O 62a_100000739446_100000139335 [1,0,1,0,0,0|2,0,0]=4 251 B14R1.882 O=CCCCCSc1cccnc1Cl 62a_100000036424_100000139335 [1,0,1,0,0,0|2,0,0]=4 252 B14R1.882 O=CCCCCSc1cccnc1Cl 62a_100000139335_100000036424 [1,0,1,0,0,0|2,0,0]=4 253 B14R1.882 O=CCCCCSc1ccncc1Cl 62a_100000139335_100000708259 [1,0,1,0,0,0|2,0,0]=4 254 B14R1.882 O=CCCCCSc1ccncc1Cl 62a_100000708259_100000139335 [1,0,1,0,0,0|2,0,0]=4 255 B14R1.882 O=CCCCCSc1cnccc1Cl 62a_100000139335_100009995489 [1,0,1,0,0,0|2,0,0]=4 256 B14R1.882 O=CCCCCSc1cnccc1Cl 62a_100009995489_100000139335 [1,0,1,0,0,0|2,0,0]=4 257 B14R1.882 O=CCCCCSc1ncccc1Cl 62a_100000139335_100011356963 [1,0,1,0,0,0|2,0,0]=4 258 B14R1.882 O=CCCCCSc1ncccc1Cl 62a_100011356963_100000139335 [1,0,1,0,0,0|2,0,0]=4 259 B14R1.882 O=CCCCNCc1ccccc1Br 2230a_100000689332_200011292268 [1,0,1,0,0,0|1,1,0]=4 260 B14R1.882 O=CCCCNCc1ccccc1Cl 2230a_100000174879_200011292268 [1,0,1,0,0,0|1,0,0]=3 261 B14R1.882 O=CCCCNCc1cccnc1Cl 2230a_100015189234_200011292268 [1,0,1,0,0,0|2,0,0]=4 262 B14R1.882 O=CCCCNCc1ncccc1Cl 2230a_100015189233_200011292268 [1,0,1,0,0,0|2,0,0]=4 263 B14R1.882 O=CCCCOCc1ccccc1Br 7a_100000756307_200011292268 [1,0,1,0,0,0|1,1,0]=4 264 B14R1.882 O=CCCCOCc1ccccc1Cl 7a_100000210847_200011292268 [1,0,1,0,0,0|1,0,0]=3 265 B14R1.882 O=CCCCOCc1ccccc1F 7a_100000211962_200011292268 [1,0,1,0,0,0|1,1,0]=4 266 B14R1.882 O=CCCCOCc1ccccc1I 7a_100000187465_200011292268 [1,0,1,0,0,0|1,1,0]=4 267 B14R1.882 O=CCCCOCc1cccnc1Cl 7a_100000748726_200011292268 [1,0,1,0,0,0|2,0,0]=4 268 B14R1.882 O=CCCCSCc1ccccc1Br 62a_100000184730_200011292268 [1,0,1,0,0,0|1,1,0]=4 269 B14R1.882 O=CCCCSCc1ccccc1Br 62a_200011292268_100000184730 [1,0,1,0,0,0|1,1,0]=4 270 B14R1.882 O=CCCCSCc1ccccc1Cl 62a_100000187162_200011292268 [1,0,1,0,0,0|1,0,0]=3 271 B14R1.882 O=CCCCSCc1ccccc1Cl 62a_200011292268_100000187162 [1,0,1,0,0,0|1,0,0]=3 272 B14R1.882 O=CCCCSCc1ccccc1F 62a_100000211605_200011292268 [1,0,1,0,0,0|1,1,0]=4 273 B14R1.882 O=CCCCSCc1ccccc1F 62a_200011292268_100000211605 [1,0,1,0,0,0|1,1,0]=4 274 B14R1.882 O=CCCCSCc1ccccc1I 62a_100011216222_200011292268 [1,0,1,0,0,0|1,1,0]=4 275 B14R1.882 O=CCCCSCc1ccccc1I 62a_200011292268_100011216222 [1,0,1,0,0,0|1,1,0]=4 276 B14R1.882 O=CCCCSCc1cccnc1Cl 62a_100000045678_200011292268 [1,0,1,0,0,0|2,0,0]=4 277 B14R1.882 O=CCCCSCc1cccnc1Cl 62a_200011292268_100000045678 [1,0,1,0,0,0|2,0,0]=4 278 B14R1.882 O=CCCCSCc1ccncc1Cl 62a_100000763264_200011292268 [1,0,1,0,0,0|2,0,0]=4 279 B14R1.882 O=CCCCSCc1ccncc1Cl 62a_200011292268_100000763264 [1,0,1,0,0,0|2,0,0]=4 280 B14R1.882 O=CCCCSCc1ncccc1Cl 62a_100000099807_200011292268 [1,0,1,0,0,0|2,0,0]=4 281 B14R1.882 O=CCCCSCc1ncccc1Cl 62a_200011292268_100000099807 [1,0,1,0,0,0|2,0,0]=4 282 B14R1.882 O=CCNCCCc1ccccc1F 2230a_100000724733_200015260668 [1,0,1,0,0,0|1,1,0]=4 283 B14R1.882 O=CCNCCCc1ccccc1F 34a_100000724733_200009817547 [1,0,1,0,0,0|1,1,0]=4 284 B14R1.882 O=CCNCCOc1ccccc1Cl 2230a_100000174932_200015260668 [1,0,1,0,0,0|2,0,0]=4 285 B14R1.882 O=CCNCCOc1ccccc1Cl 34a_100000174932_200009817547 [1,0,1,0,0,0|2,0,0]=4 286 B14R1.882 O=CCOCCCc1ccccc1Br 34a_100000699526_200009817547 [1,0,1,0,0,0|1,1,0]=4 287 B14R1.882 O=CCOCCCc1ccccc1Br 7a_100000699526_200015260668 [1,0,1,0,0,0|1,1,0]=4 288 B14R1.882 O=CCOCCCc1ccccc1Cl 34a_100011709251_200009817547 [1,0,1,0,0,0|1,0,0]=3 289 B14R1.882 O=CCOCCCc1ccccc1Cl 7a_100011709251_200015260668 [1,0,1,0,0,0|1,0,0]=3 290 B14R1.882 O=CCOCCCc1ccccc1F 34a_100011709249_200009817547 [1,0,1,0,0,0|1,1,0]=4 291 B14R1.882 O=CCOCCCc1ccccc1F 7a_100011709249_200015260668 [1,0,1,0,0,0|1,1,0]=4 292 B14R1.882 O=CCOCCOc1ccccc1Cl 34a_200000230518_200009817547 [1,0,1,0,0,0|2,0,0]=4 293 B14R1.882 O=CCOCCOc1ccccc1Cl 7a_200000230518_200015260668 [1,0,1,0,0,0|2,0,0]=4 294 B14R1.882 O=CCOCCSc1ccccc1Cl 34a_200000230572_200009817547 [1,0,1,0,0,0|2,0,0]=4 295 B14R1.882 O=CCOCCSc1ccccc1Cl 7a_200000230572_200015260668 [1,0,1,0,0,0|2,0,0]=4 296 B14R1.882 O=CCSCCCc1ccccc1Br 62a_200011713681_200015260668 [1,0,1,0,0,0|1,1,0]=4 297 B14R1.882 O=CCSCCCc1ccccc1Br 62a_200015260668_200011713681 [1,0,1,0,0,0|1,1,0]=4 298 B14R1.1035 C=CCOCC(N)c1ccccc1Cl 34a_100138412506_100015514636 [1,0,1,0,0,0|1,0,1]=4 299 B14R1.1035 CCCCNC(C)c1ccccc1Cl 2230a_100000102301_100000181259 [1,0,1,0,0,0|2,0,0]=4 300 B14R1.1035 CCCCNC(C)c1ccccc1Cl 2230a_100000174978_100000210211 [1,0,1,0,0,0|2,0,0]=4 301 B14R1.1035 CCCCNC(C)c1ccccc1Cl 269862a_100000102301_100000210134 [1,0,1,0,0,0|2,0,0]=4 302 B14R1.1035 CCCCNC(C)c1ccccc1Cl 34a_100000174978_100000210210 [1,0,1,0,0,0|2,0,0]=4 303 B14R1.1035 CCCCNC(C)c1ccccc1Cl 7a_106832991798_100000181259 [1,0,1,0,0,0|2,0,0]=4 304 B14R1.1035 CCCCOC(C)c1ccccc1Cl 34a_100000740796_100000210210 [1,0,1,0,0,0|2,0,0]=4 305 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000210227_100000181259 [1,0,1,0,0,0|2,0,0]=4 306 B14R1.1035 CCCCOC(C)c1ccccc1Cl 7a_100000740796_100000210211 [1,0,1,0,0,0|2,0,0]=4 307 B14R1.1035 CCCCSC(C)c1ccccc1Cl 62a_100000181259_100000210210 [1,0,1,0,0,0|2,0,0]=4 308 B14R1.1035 CCCCSC(C)c1ccccc1Cl 62a_100000210211_100000181259 [1,0,1,0,0,0|2,0,0]=4 309 B14R1.1035 CCCOCC(N)c1ccccc1Cl 34a_100138412506_100000210303 [1,0,1,0,0,0|1,0,1]=4 310 B14R1.1035 CCOCCC(N)c1ccccc1Cl 34a_100011661560_100000210202 [1,0,1,0,0,0|1,0,1]=4 311 B14R1.1035 CN(CCCC=O)c1ccccc1Cl 2230a_100000219374_200011292268 [1,0,1,0,0,0|2,0,0]=4 312 B14R1.1035 CN(CCCC=O)c1ccccc1Cl 269982a_100000219374_200011292268 [1,0,1,0,0,0|2,0,0]=4 313 B14R1.1035 NC(CCOCF)c1ccccc1Cl 34a_100011661560_100015361967 [1,0,1,0,0,0|2,0,0]=4 314 B14R1.1035 NC(COCC=O)c1ccccc1Cl 34a_100138412506_200009817547 [1,0,1,0,0,0|1,0,0]=3 315 B14R1.1035 NC(COCC=O)c1ccncc1Cl 34a_200020642286_200009817547 [1,0,1,0,0,0|2,0,0]=4 316 B14R1.1035 NC(COCCF)c1ccccc1Cl 34a_100138412506_100011217306 [1,0,1,0,0,0|2,0,0]=4 317 B14R1.1035 NC(COCCO)c1ccccc1Cl 34a_100138412506_100000211926 [1,0,1,0,0,0|1,0,1]=4 318 B14R1.1035 N[C@@H](COCC=O)c1ccccc1F 34a_100009818778_200009817547 [1,0,1,0,0,0|1,1,0]=4 319 B14R1.1035 N[C@H](COCC=O)c1ccccc1Br 34a_100161155918_200009817547 [1,0,1,0,0,0|1,1,0]=4 320 B14R1.1035 O=CCNCC(O)c1ccccc1Cl 2230a_200000759403_200015260668 [1,0,1,0,0,0|2,0,0]=4 321 B14R1.1035 O=CCNCC(O)c1ccccc1Cl 34a_200000759403_200009817547 [1,0,1,0,0,0|2,0,0]=4 322 B14R1.166 C=C(C(=O)CCCC)c1ccccc1 1458a_100000065200_100000210211 [1,0,1,0,0,0|1,0,1]=4 323 B14R1.166 CCCCC(=O)C(C)c1ccccc1 1458a_100000210183_100000230085 [1,0,1,0,0,0|1,0,0]=3 324 B14R1.166 CCCCC(=O)C(C)c1ccccn1 1458a_100000722050_100000210211 [1,0,1,0,0,0|2,0,0]=4 325 B14R1.166 CCCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000210211 [1,0,1,0,0,0|1,0,0]=3 326 B14R1.166 CCCCC(=O)N(C)c1ccccc1 11a_100000210012_100000210183 [1,0,1,0,0,0|2,0,0]=4 327 B14R1.166 CCCCC(=O)N(C)c1ccccc1 1626a_100000210012_100000210183 [1,0,1,0,0,0|2,0,0]=4 328 B14R1.166 CCCCC(=O)N(C)c1ccccc1 22a_100000210012_100000210183 [1,0,1,0,0,0|2,0,0]=4 329 B14R1.166 CCCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000210211 [1,0,1,0,0,0|1,0,0]=3 330 B14R1.166 CCCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210211 [1,0,1,0,0,0|1,0,0]=3 331 B14R1.166 CCCNC(=O)C(F)c1ccccc1 11a_100020643023_100000698975 [1,0,1,0,0,0|2,0,0]=4 332 B14R1.166 CCCNC(=O)C(F)c1ccccc1 1626a_100020643023_100000698975 [1,0,1,0,0,0|2,0,0]=4 333 B14R1.166 CCCNC(=O)C(F)c1ccccc1 240690a_100020643023_100000698975 [1,0,1,0,0,0|2,0,0]=4 334 B14R1.166 CCCNC(=O)C(F)c1ccccc1 527a_100020643023_100000698975 [1,0,1,0,0,0|2,0,0]=4 335 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 11a_100020643023_100000751047 [1,0,1,0,0,0|2,0,0]=4 336 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 1626a_100020643023_100000751047 [1,0,1,0,0,0|2,0,0]=4 337 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 240690a_100020643023_100000751047 [1,0,1,0,0,0|2,0,0]=4 338 B14R1.166 CCCNC(=O)[C@@H](C)c1ccccc1 527a_100020643023_100000751047 [1,0,1,0,0,0|2,0,0]=4 339 B14R1.166 CCCNC(=O)[C@H](O)c1ccccc1 240690a_100020643023_100000684486 [1,0,1,0,0,0|2,0,0]=4 340 B14R1.166 CCOCC(=O)C(C)c1ccccc1 1458a_100000211967_100000230085 [1,0,1,0,0,0|2,0,0]=4 341 B14R1.166 CCSCC(=O)C(C)c1ccccc1 1458a_100000230394_100000230085 [1,0,1,0,0,0|2,0,0]=4 342 B14R1.166 COCCC(=O)C(C)c1ccccc1 1458a_100000749529_100000230085 [1,0,1,0,0,0|2,0,0]=4 343 B14R1.166 COCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000233755 [1,0,1,0,0,0|2,0,0]=4 344 B14R1.166 COCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000233755 [1,0,1,0,0,0|2,0,0]=4 345 B14R1.166 COCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000233755 [1,0,1,0,0,0|2,0,0]=4 346 B14R1.166 CSCCC(=O)C(C)c1ccccc1 1458a_100000174002_100000230085 [1,0,1,0,0,0|2,0,0]=4 347 B14R1.166 CSCCC(=O)C(F)c1ccccc1 1458a_100000698975_100000751147 [1,0,1,0,0,0|2,0,0]=4 348 B14R1.166 CSCCC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000751147 [1,0,1,0,0,0|2,0,0]=4 349 B14R1.166 CSCCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000751147 [1,0,1,0,0,0|2,0,0]=4 350 B14R1.166 C[C@H](C(=O)CCCF)c1ccccc1 1458a_100000751047_100011934791 [1,0,1,0,0,0|2,0,0]=4 351 B14R1.166 C[C@H](C(=O)CCCO)c1ccccc1 1458a_100000751047_100011215043 [1,0,1,0,0,0|2,0,0]=4 352 B14R1.166 O=C(CCCF)C(F)c1ccccc1 1458a_100000698975_100011934791 [1,0,1,0,0,0|2,0,0]=4 353 B14R1.166 O=C(CCCF)[C@H](O)c1ccccc1 1458a_100000684486_100011934791 [1,0,1,0,0,0|2,0,0]=4 354 B14R1.166 O=C(CCCO)C(F)c1ccccc1 1458a_100000698975_100011215043 [1,0,1,0,0,0|2,0,0]=4 355 B14R1.166 O=C(CCCO)[C@H](O)c1ccccc1 1458a_100000684486_100011215043 [1,0,1,0,0,0|2,0,0]=4 356 B14R1.946 C#CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000753159 [1,0,1,0,0,0|0,0,2]=4 357 B14R1.946 C#CCCC(=O)Cc1ccccc1Cl 1458a_100000692101_100000187162 [1,0,1,0,0,0|0,0,2]=4 358 B14R1.946 C/C=C/CC(=O)Cc1ccccc1Cl 1458a_100000183793_100102629194 [1,0,1,0,0,0|0,0,2]=4 359 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000754431 [1,0,1,0,0,0|0,0,2]=4 360 B14R1.946 C=CCCC(=O)Cc1ccccc1Cl 1458a_100000749702_100000187162 [1,0,1,0,0,0|0,0,2]=4 361 B14R1.946 CC#CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000748600 [1,0,1,0,0,0|0,0,2]=4 362 B14R1.946 CC=CCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000070051 [1,0,1,0,0,0|0,0,2]=4 363 B14R1.946 CC=CCC(=O)Cc1ccccc1Cl 1458a_100121576822_100000187162 [1,0,1,0,0,0|0,0,2]=4 364 B14R1.946 CCC#CC(=O)Cc1ccccc1Cl 1458a_100011827653_100000187162 [1,0,1,0,0,0|0,0,2]=4 365 B14R1.946 CCC=CC(=O)Cc1ccccc1Cl 1458a_100000212282_100000187162 [1,0,1,0,0,0|0,0,2]=4 366 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000210183_100000184730 [1,0,1,0,0,0|0,1,0]=3 367 B14R1.946 CCCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000210211 [1,0,1,0,0,0|0,1,0]=3 368 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000210183_100000211839 [1,0,1,0,0,0|1,0,0]=3 369 B14R1.946 CCCCC(=O)Cc1ccccc1C 1458a_100000212180_100000210211 [1,0,1,0,0,0|1,0,0]=3 370 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000210211 [1,0,1,0,0,0|0,0,0]=2 371 B14R1.946 CCCCC(=O)Cc1ccccc1Cl 1458a_100000210183_100000187162 [1,0,1,0,0,0|0,0,0]=2 372 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000210183_100000187165 [1,0,1,0,0,0|0,1,0]=3 373 B14R1.946 CCCCC(=O)Cc1ccccc1F 1458a_100000212012_100000210211 [1,0,1,0,0,0|0,1,0]=3 374 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000036491_100000210211 [1,0,1,0,0,0|0,1,0]=3 375 B14R1.946 CCCCC(=O)Cc1ccccc1I 1458a_100000210183_100011216222 [1,0,1,0,0,0|0,1,0]=3 376 B14R1.946 CCCCC(=O)Cc1ccccc1O 1458a_100000743006_100000210211 [1,0,1,0,0,0|1,0,0]=3 377 B14R1.946 CCCCC(=O)Cc1cccnc1Br 1458a_100000210183_100010140945 [1,0,1,0,0,0|1,1,0]=4 378 B14R1.946 CCCCC(=O)Cc1cccnc1C 1458a_100000210183_100000732876 [1,0,1,0,0,0|2,0,0]=4 379 B14R1.946 CCCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000210211 [1,0,1,0,0,0|1,0,0]=3 380 B14R1.946 CCCCC(=O)Cc1cccnc1Cl 1458a_100000210183_100000045678 [1,0,1,0,0,0|1,0,0]=3 381 B14R1.946 CCCCC(=O)Cc1cccnc1F 1458a_100000210183_100000099810 [1,0,1,0,0,0|1,1,0]=4 382 B14R1.946 CCCCC(=O)Cc1ccncc1C 1458a_100000210183_100020672808 [1,0,1,0,0,0|2,0,0]=4 383 B14R1.946 CCCCC(=O)Cc1ccncc1Cl 1458a_100000210183_100000763264 [1,0,1,0,0,0|1,0,0]=3 384 B14R1.946 CCCCC(=O)Cc1cnccc1C 1458a_100000210183_100000690890 [1,0,1,0,0,0|2,0,0]=4 385 B14R1.946 CCCCC(=O)Cc1ncccc1Br 1458a_100000210183_100025702911 [1,0,1,0,0,0|1,1,0]=4 386 B14R1.946 CCCCC(=O)Cc1ncccc1Br 1458a_200012357574_100000210211 [1,0,1,0,0,0|1,1,0]=4 387 B14R1.946 CCCCC(=O)Cc1ncccc1C 1458a_100000210183_100000696600 [1,0,1,0,0,0|2,0,0]=4 388 B14R1.946 CCCCC(=O)Cc1ncccc1C 1458a_200000722269_100000210211 [1,0,1,0,0,0|2,0,0]=4 389 B14R1.946 CCCCC(=O)Cc1ncccc1Cl 1458a_100000210183_100000099807 [1,0,1,0,0,0|1,0,0]=3 390 B14R1.946 CCCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000210211 [1,0,1,0,0,0|1,0,0]=3 391 B14R1.946 CCCCC(=O)Cc1ncccc1F 1458a_100000210183_100000104219 [1,0,1,0,0,0|1,1,0]=4 392 B14R1.946 CCCCC(=O)Cc1ncccc1O 1458a_100000210183_200020655725 [1,0,1,0,0,0|2,0,0]=4 393 B14R1.946 CCCCC(=O)Cn1ccccc1=O 1458a_100000189665_100000210211 [1,0,1,0,0,0|2,0,0]=4 394 B14R1.946 CCCCC(=O)Nc1ccccc1Br 11a_100000210017_100000210183 [1,0,1,0,0,0|1,1,0]=4 395 B14R1.946 CCCCC(=O)Nc1ccccc1Br 1626a_100000210017_100000210183 [1,0,1,0,0,0|1,1,0]=4 396 B14R1.946 CCCCC(=O)Nc1ccccc1C 11a_100015192222_100000210183 [1,0,1,0,0,0|2,0,0]=4 397 B14R1.946 CCCCC(=O)Nc1ccccc1C 1626a_100015192222_100000210183 [1,0,1,0,0,0|2,0,0]=4 398 B14R1.946 CCCCC(=O)Nc1ccccc1C 22a_100015192222_100000210183 [1,0,1,0,0,0|2,0,0]=4 399 B14R1.946 CCCCC(=O)Nc1ccccc1C 527a_100015192222_100000210183 [1,0,1,0,0,0|2,0,0]=4 400 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000210183 [1,0,1,0,0,0|1,0,0]=3 401 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000210183 [1,0,1,0,0,0|1,0,0]=3 402 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000210183 [1,0,1,0,0,0|1,0,0]=3 403 B14R1.946 CCCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000210183 [1,0,1,0,0,0|1,0,0]=3 404 B14R1.946 CCCCC(=O)Nc1ccccc1F 11a_100000210422_100000210183 [1,0,1,0,0,0|1,1,0]=4 405 B14R1.946 CCCCC(=O)Nc1ccccc1F 1626a_100000210422_100000210183 [1,0,1,0,0,0|1,1,0]=4 406 B14R1.946 CCCCC(=O)Nc1ccccc1F 22a_100000210422_100000210183 [1,0,1,0,0,0|1,1,0]=4 407 B14R1.946 CCCCC(=O)Nc1ccccc1F 527a_100000210422_100000210183 [1,0,1,0,0,0|1,1,0]=4 408 B14R1.946 CCCCC(=O)Nc1ccccc1I 11a_100000210053_100000210183 [1,0,1,0,0,0|1,1,0]=4 409 B14R1.946 CCCCC(=O)Nc1ccccc1I 1626a_100000210053_100000210183 [1,0,1,0,0,0|1,1,0]=4 410 B14R1.946 CCCCC(=O)Nc1ccccc1O 22a_100000185747_100000210183 [1,0,1,0,0,0|2,0,0]=4 411 B14R1.946 CCCCC(=O)Nc1ccccc1O 527a_100000185747_100000210183 [1,0,1,0,0,0|2,0,0]=4 412 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000184507_100000210211 [1,0,1,0,0,0|2,0,0]=4 413 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000196027_200000210301 [1,0,1,0,0,0|2,0,0]=4 414 B14R1.946 CCCCN(C)Cc1ccccc1Cl 2230a_100000207549_100000187162 [1,0,1,0,0,0|2,0,0]=4 415 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000184507_100000210211 [1,0,1,0,0,0|2,0,0]=4 416 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000196027_200000210301 [1,0,1,0,0,0|2,0,0]=4 417 B14R1.946 CCCCN(C)Cc1ccccc1Cl 269982a_100000207549_100000187162 [1,0,1,0,0,0|2,0,0]=4 418 B14R1.946 CCCCN(C)Cc1ccccc1Cl 26a_100000207549_100000210172 [1,0,1,0,0,0|2,0,0]=4 419 B14R1.946 CCCCN(C)Cc1ccccc1Cl 270004a_100000207549_100000210073 [1,0,1,0,0,0|2,0,0]=4 420 B14R1.946 CCCCN([13CH3])Cc1ccccc1Cl 2230a_100000196027_200025704644 [1,0,1,0,0,0|2,0,0]=4 421 B14R1.946 CCCCN([13CH3])Cc1ccccc1Cl 269982a_100000196027_200025704644 [1,0,1,0,0,0|2,0,0]=4 422 B14R1.946 CCCNC(=O)Cc1ccccc1Br 11a_100020643023_100000751119 [1,0,1,0,0,0|1,1,0]=4 423 B14R1.946 CCCNC(=O)Cc1ccccc1Br 240690a_100020643023_100000751119 [1,0,1,0,0,0|1,1,0]=4 424 B14R1.946 CCCNC(=O)Cc1ccccc1Br 527a_100020643023_100000751119 [1,0,1,0,0,0|1,1,0]=4 425 B14R1.946 CCCNC(=O)Cc1ccccc1C 11a_100020643023_100000212180 [1,0,1,0,0,0|2,0,0]=4 426 B14R1.946 CCCNC(=O)Cc1ccccc1C 1626a_100020643023_100000212180 [1,0,1,0,0,0|2,0,0]=4 427 B14R1.946 CCCNC(=O)Cc1ccccc1C 240690a_100020643023_100000212180 [1,0,1,0,0,0|2,0,0]=4 428 B14R1.946 CCCNC(=O)Cc1ccccc1C 527a_100020643023_100000212180 [1,0,1,0,0,0|2,0,0]=4 429 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 11a_100020643023_100000183793 [1,0,1,0,0,0|1,0,0]=3 430 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 1626a_100020643023_100000183793 [1,0,1,0,0,0|1,0,0]=3 431 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 240690a_100020643023_100000183793 [1,0,1,0,0,0|1,0,0]=3 432 B14R1.946 CCCNC(=O)Cc1ccccc1Cl 527a_100020643023_100000183793 [1,0,1,0,0,0|1,0,0]=3 433 B14R1.946 CCCNC(=O)Cc1ccccc1F 11a_100020643023_100000212012 [1,0,1,0,0,0|1,1,0]=4 434 B14R1.946 CCCNC(=O)Cc1ccccc1F 1626a_100020643023_100000212012 [1,0,1,0,0,0|1,1,0]=4 435 B14R1.946 CCCNC(=O)Cc1ccccc1F 240690a_100020643023_100000212012 [1,0,1,0,0,0|1,1,0]=4 436 B14R1.946 CCCNC(=O)Cc1ccccc1F 527a_100020643023_100000212012 [1,0,1,0,0,0|1,1,0]=4 437 B14R1.946 CCCNC(=O)Cc1ccccc1I 11a_100020643023_100000036491 [1,0,1,0,0,0|1,1,0]=4 438 B14R1.946 CCCNC(=O)Cc1ccccc1I 1626a_100020643023_100000036491 [1,0,1,0,0,0|1,1,0]=4 439 B14R1.946 CCCNC(=O)Cc1ccccc1I 240690a_100020643023_100000036491 [1,0,1,0,0,0|1,1,0]=4 440 B14R1.946 CCCNC(=O)Cc1ccccc1I 527a_100020643023_100000036491 [1,0,1,0,0,0|1,1,0]=4 441 B14R1.946 CCCNC(=O)Cc1ccccc1O 240690a_100020643023_100000743006 [1,0,1,0,0,0|2,0,0]=4 442 B14R1.946 CCCNC(=O)Cc1ccccc1O 527a_100020643023_100000743006 [1,0,1,0,0,0|2,0,0]=4 443 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 11a_100020643023_100000093521 [1,0,1,0,0,0|2,0,0]=4 444 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 1626a_100020643023_100000093521 [1,0,1,0,0,0|2,0,0]=4 445 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 240690a_100020643023_100000093521 [1,0,1,0,0,0|2,0,0]=4 446 B14R1.946 CCCNC(=O)Cc1cccnc1Cl 527a_100020643023_100000093521 [1,0,1,0,0,0|2,0,0]=4 447 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 11a_100020643023_100011998755 [1,0,1,0,0,0|2,0,0]=4 448 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 240690a_100020643023_100011998755 [1,0,1,0,0,0|2,0,0]=4 449 B14R1.946 CCCNC(=O)Cc1ncccc1Cl 527a_100020643023_100011998755 [1,0,1,0,0,0|2,0,0]=4 450 B14R1.946 CCCNC(=O)Nc1ccccc1Cl 2430a_100000185783_100020643023 [1,0,1,0,0,0|2,0,0]=4 451 B14R1.946 CCNCC(=O)Cc1ccccc1Br 2230a_100015525214_100000700504 [1,0,1,0,0,0|1,1,0]=4 452 B14R1.946 CCNCC(=O)Cc1ccccc1C 2230a_100015525214_100011223134 [1,0,1,0,0,0|2,0,0]=4 453 B14R1.946 CCNCC(=O)Nc1ccccc1Cl 2230a_100015525214_100000182448 [1,0,1,0,0,0|2,0,0]=4 454 B14R1.946 CCNNC(=O)Cc1ccccc1Cl 22a_100000756455_100000183793 [1,0,1,0,0,0|2,0,0]=4 455 B14R1.946 CCOCC(=O)Cc1ccccc1Br 1458a_100000211967_100000184730 [1,0,1,0,0,0|1,1,0]=4 456 B14R1.946 CCOCC(=O)Cc1ccccc1Br 34a_100121572206_100000700504 [1,0,1,0,0,0|1,1,0]=4 457 B14R1.946 CCOCC(=O)Cc1ccccc1C 1458a_100000211967_100000211839 [1,0,1,0,0,0|2,0,0]=4 458 B14R1.946 CCOCC(=O)Cc1ccccc1Cl 1458a_100000211967_100000187162 [1,0,1,0,0,0|1,0,0]=3 459 B14R1.946 CCOCC(=O)Cc1ccccc1F 1458a_100000211967_100000187165 [1,0,1,0,0,0|1,1,0]=4 460 B14R1.946 CCOCC(=O)Cc1ccccc1I 1458a_100000211967_100011216222 [1,0,1,0,0,0|1,1,0]=4 461 B14R1.946 CCOCC(=O)Cc1cccnc1Cl 1458a_100000211967_100000045678 [1,0,1,0,0,0|2,0,0]=4 462 B14R1.946 CCOCC(=O)Cc1ccncc1Cl 1458a_100000211967_100000763264 [1,0,1,0,0,0|2,0,0]=4 463 B14R1.946 CCOCC(=O)Cc1ncccc1Cl 1458a_100000211967_100000099807 [1,0,1,0,0,0|2,0,0]=4 464 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 11a_100000185783_100000211967 [1,0,1,0,0,0|2,0,0]=4 465 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000211967 [1,0,1,0,0,0|2,0,0]=4 466 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 22a_100000185783_100000211967 [1,0,1,0,0,0|2,0,0]=4 467 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 34a_100121572206_100000182448 [1,0,1,0,0,0|2,0,0]=4 468 B14R1.946 CCOCC(=O)Nc1ccccc1Cl 527a_100000185783_100000211967 [1,0,1,0,0,0|2,0,0]=4 469 B14R1.946 CCSCC(=O)Cc1ccccc1Br 1458a_100000230394_100000184730 [1,0,1,0,0,0|1,1,0]=4 470 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000210202_100000700504 [1,0,1,0,0,0|1,1,0]=4 471 B14R1.946 CCSCC(=O)Cc1ccccc1Br 62a_100000700504_100000210202 [1,0,1,0,0,0|1,1,0]=4 472 B14R1.946 CCSCC(=O)Cc1ccccc1C 1458a_100000230394_100000211839 [1,0,1,0,0,0|2,0,0]=4 473 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100000210202_100011223134 [1,0,1,0,0,0|2,0,0]=4 474 B14R1.946 CCSCC(=O)Cc1ccccc1C 62a_100011223134_100000210202 [1,0,1,0,0,0|2,0,0]=4 475 B14R1.946 CCSCC(=O)Cc1ccccc1Cl 1458a_100000230394_100000187162 [1,0,1,0,0,0|1,0,0]=3 476 B14R1.946 CCSCC(=O)Cc1ccccc1F 1458a_100000230394_100000187165 [1,0,1,0,0,0|1,1,0]=4 477 B14R1.946 CCSCC(=O)Cc1ccccc1I 1458a_100000230394_100011216222 [1,0,1,0,0,0|1,1,0]=4 478 B14R1.946 CCSCC(=O)Cc1cccnc1Cl 1458a_100000230394_100000045678 [1,0,1,0,0,0|2,0,0]=4 479 B14R1.946 CCSCC(=O)Cc1ccncc1Cl 1458a_100000230394_100000763264 [1,0,1,0,0,0|2,0,0]=4 480 B14R1.946 CCSCC(=O)Cc1ncccc1Cl 1458a_100000230394_100000099807 [1,0,1,0,0,0|2,0,0]=4 481 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 11a_100000185783_100000230394 [1,0,1,0,0,0|2,0,0]=4 482 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000230394 [1,0,1,0,0,0|2,0,0]=4 483 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 22a_100000185783_100000230394 [1,0,1,0,0,0|2,0,0]=4 484 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 527a_100000185783_100000230394 [1,0,1,0,0,0|2,0,0]=4 485 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_100000210202_100000182448 [1,0,1,0,0,0|2,0,0]=4 486 B14R1.946 CCSCC(=O)Nc1ccccc1Cl 62a_200011202291_100000210202 [1,0,1,0,0,0|2,0,0]=4 487 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 2230a_106832991635_100000242055 [1,0,1,0,0,0|2,0,0]=4 488 B14R1.946 CNCCC(=O)Nc1ccccc1Cl 7a_106832991635_100000242055 [1,0,1,0,0,0|2,0,0]=4 489 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000749529_100000184730 [1,0,1,0,0,0|1,1,0]=4 490 B14R1.946 COCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000233755 [1,0,1,0,0,0|1,1,0]=4 491 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000212180_100000233755 [1,0,1,0,0,0|2,0,0]=4 492 B14R1.946 COCCC(=O)Cc1ccccc1C 1458a_100000749529_100000211839 [1,0,1,0,0,0|2,0,0]=4 493 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000233755 [1,0,1,0,0,0|1,0,0]=3 494 B14R1.946 COCCC(=O)Cc1ccccc1Cl 1458a_100000749529_100000187162 [1,0,1,0,0,0|1,0,0]=3 495 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000212012_100000233755 [1,0,1,0,0,0|1,1,0]=4 496 B14R1.946 COCCC(=O)Cc1ccccc1F 1458a_100000749529_100000187165 [1,0,1,0,0,0|1,1,0]=4 497 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000036491_100000233755 [1,0,1,0,0,0|1,1,0]=4 498 B14R1.946 COCCC(=O)Cc1ccccc1I 1458a_100000749529_100011216222 [1,0,1,0,0,0|1,1,0]=4 499 B14R1.946 COCCC(=O)Cc1ccccc1O 1458a_100000743006_100000233755 [1,0,1,0,0,0|2,0,0]=4 500 B14R1.946 COCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000233755 [1,0,1,0,0,0|2,0,0]=4 501 B14R1.946 COCCC(=O)Cc1cccnc1Cl 1458a_100000749529_100000045678 [1,0,1,0,0,0|2,0,0]=4 502 B14R1.946 COCCC(=O)Cc1ccncc1Cl 1458a_100000749529_100000763264 [1,0,1,0,0,0|2,0,0]=4 503 B14R1.946 COCCC(=O)Cc1ncccc1Cl 1458a_100000749529_100000099807 [1,0,1,0,0,0|2,0,0]=4 504 B14R1.946 COCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000233755 [1,0,1,0,0,0|2,0,0]=4 505 B14R1.946 COCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000749529 [1,0,1,0,0,0|2,0,0]=4 506 B14R1.946 COCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000749529 [1,0,1,0,0,0|2,0,0]=4 507 B14R1.946 COCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000749529 [1,0,1,0,0,0|2,0,0]=4 508 B14R1.946 COCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000749529 [1,0,1,0,0,0|2,0,0]=4 509 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000174002_100000184730 [1,0,1,0,0,0|1,1,0]=4 510 B14R1.946 CSCCC(=O)Cc1ccccc1Br 1458a_100000751119_100000751147 [1,0,1,0,0,0|1,1,0]=4 511 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000174002_100000211839 [1,0,1,0,0,0|2,0,0]=4 512 B14R1.946 CSCCC(=O)Cc1ccccc1C 1458a_100000212180_100000751147 [1,0,1,0,0,0|2,0,0]=4 513 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000174002_100000187162 [1,0,1,0,0,0|1,0,0]=3 514 B14R1.946 CSCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100000751147 [1,0,1,0,0,0|1,0,0]=3 515 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000174002_100000187165 [1,0,1,0,0,0|1,1,0]=4 516 B14R1.946 CSCCC(=O)Cc1ccccc1F 1458a_100000212012_100000751147 [1,0,1,0,0,0|1,1,0]=4 517 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000036491_100000751147 [1,0,1,0,0,0|1,1,0]=4 518 B14R1.946 CSCCC(=O)Cc1ccccc1I 1458a_100000174002_100011216222 [1,0,1,0,0,0|1,1,0]=4 519 B14R1.946 CSCCC(=O)Cc1ccccc1O 1458a_100000743006_100000751147 [1,0,1,0,0,0|2,0,0]=4 520 B14R1.946 CSCCC(=O)Cc1cccnc1Cl 1458a_100000093521_100000751147 [1,0,1,0,0,0|2,0,0]=4 521 B14R1.946 CSCCC(=O)Cc1cccnc1Cl 1458a_100000174002_100000045678 [1,0,1,0,0,0|2,0,0]=4 522 B14R1.946 CSCCC(=O)Cc1ccncc1Cl 1458a_100000174002_100000763264 [1,0,1,0,0,0|2,0,0]=4 523 B14R1.946 CSCCC(=O)Cc1ncccc1Cl 1458a_100000174002_100000099807 [1,0,1,0,0,0|2,0,0]=4 524 B14R1.946 CSCCC(=O)Cc1ncccc1Cl 1458a_100011998755_100000751147 [1,0,1,0,0,0|2,0,0]=4 525 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 11a_100000185783_100000174002 [1,0,1,0,0,0|2,0,0]=4 526 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 1626a_100000185783_100000174002 [1,0,1,0,0,0|2,0,0]=4 527 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 22a_100000185783_100000174002 [1,0,1,0,0,0|2,0,0]=4 528 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 527a_100000185783_100000174002 [1,0,1,0,0,0|2,0,0]=4 529 B14R1.946 CSCCC(=O)Nc1ccccc1Cl 62a_200000210301_100000242055 [1,0,1,0,0,0|2,0,0]=4 530 B14R1.946 Cc1ccccc1CC(=O)CCCF 1458a_100000212180_100011934791 [1,0,1,0,0,0|2,0,0]=4 531 B14R1.946 Cc1ccccc1CC(=O)CCCO 1458a_100000212180_100011215043 [1,0,1,0,0,0|2,0,0]=4 532 B14R1.946 N#CCCC(=O)Cc1ccccc1Cl 1458a_100000183793_100011215226 [1,0,1,0,0,0|1,0,1]=4 533 B14R1.946 N#CCCC(=O)Cc1ccccc1Cl 1458a_100011934036_100000187162 [1,0,1,0,0,0|1,0,1]=4 534 B14R1.946 O=C(CCCF)Cc1ccccc1Br 1458a_100000751119_100011934791 [1,0,1,0,0,0|1,1,0]=4 535 B14R1.946 O=C(CCCF)Cc1ccccc1Cl 1458a_100000183793_100011934791 [1,0,1,0,0,0|1,0,0]=3 536 B14R1.946 O=C(CCCF)Cc1ccccc1F 1458a_100000212012_100011934791 [1,0,1,0,0,0|1,1,0]=4 537 B14R1.946 O=C(CCCF)Cc1ccccc1I 1458a_100000036491_100011934791 [1,0,1,0,0,0|1,1,0]=4 538 B14R1.946 O=C(CCCF)Cc1ccccc1O 1458a_100000743006_100011934791 [1,0,1,0,0,0|2,0,0]=4 539 B14R1.946 O=C(CCCF)Cc1cccnc1Cl 1458a_100000093521_100011934791 [1,0,1,0,0,0|2,0,0]=4 540 B14R1.946 O=C(CCCF)Cc1ncccc1Cl 1458a_100011998755_100011934791 [1,0,1,0,0,0|2,0,0]=4 541 B14R1.946 O=C(CCCO)Cc1ccccc1Br 1458a_100000751119_100011215043 [1,0,1,0,0,0|1,1,0]=4 542 B14R1.946 O=C(CCCO)Cc1ccccc1Cl 1458a_100000183793_100011215043 [1,0,1,0,0,0|1,0,0]=3 543 B14R1.946 O=C(CCCO)Cc1ccccc1F 1458a_100000212012_100011215043 [1,0,1,0,0,0|1,1,0]=4 544 B14R1.946 O=C(CCCO)Cc1ccccc1I 1458a_100000036491_100011215043 [1,0,1,0,0,0|1,1,0]=4 545 B14R1.946 O=C(CCCO)Cc1ccccc1O 1458a_100000743006_100011215043 [1,0,1,0,0,0|2,0,0]=4 546 B14R1.946 O=C(CCCO)Cc1cccnc1Cl 1458a_100000093521_100011215043 [1,0,1,0,0,0|2,0,0]=4 547 B14R1.946 O=C(CCCO)Cc1ncccc1Cl 1458a_100011998755_100011215043 [1,0,1,0,0,0|2,0,0]=4 548 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 11a_100000724931_100000183793 [1,0,1,0,0,0|2,0,0]=4 549 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 1626a_100000724931_100000183793 [1,0,1,0,0,0|2,0,0]=4 550 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 240690a_100000724931_100000183793 [1,0,1,0,0,0|2,0,0]=4 551 B14R1.946 O=C(Cc1ccccc1Cl)NCCF 527a_100000724931_100000183793 [1,0,1,0,0,0|2,0,0]=4 552 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 240690a_100000210304_100000183793 [1,0,1,0,0,0|2,0,0]=4 553 B14R1.946 O=C(Cc1ccccc1Cl)NCCO 527a_100000210304_100000183793 [1,0,1,0,0,0|2,0,0]=4 554 B14R1.946 [13CH3]SCCC(=O)Nc1ccccc1Cl 62a_200025704644_100000242055 [1,0,1,0,0,0|2,0,0]=4 555 B14R1.3348 C#CCC(=O)C(C)c1ccccc1Cl 1458a_100011220946_100000181259 [1,0,1,0,0,0|0,0,2]=4 556 B14R1.3348 C#CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000184674 [1,0,1,0,0,0|0,0,2]=4 557 B14R1.3348 C=CCC(=O)C(C)c1ccccc1Cl 1458a_100000210193_100000181259 [1,0,1,0,0,0|0,0,2]=4 558 B14R1.3348 C=CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210623 [1,0,1,0,0,0|0,0,2]=4 559 B14R1.3348 CC#CC(=O)C(C)c1ccccc1Cl 1458a_100000763181_100000181259 [1,0,1,0,0,0|0,0,2]=4 560 B14R1.3348 CC(C(=O)CC#N)c1ccccc1Cl 1458a_100011667492_100011214920 [1,0,1,0,0,0|1,0,1]=4 561 B14R1.3348 CC(C(=O)CC#N)c1ccccc1Cl 1458a_100051588842_100000181259 [1,0,1,0,0,0|1,0,1]=4 562 B14R1.3348 CC(C(=O)CCF)c1ccccc1Br 1458a_100012359601_100011217306 [1,0,1,0,0,0|1,1,0]=4 563 B14R1.3348 CC(C(=O)CCF)c1ccccc1Cl 1458a_100011667492_100011217306 [1,0,1,0,0,0|1,0,0]=3 564 B14R1.3348 CC(C(=O)CCO)c1ccccc1Br 1458a_100012359601_100000211926 [1,0,1,0,0,0|1,1,0]=4 565 B14R1.3348 CC(C(=O)CCO)c1ccccc1Cl 1458a_100011216618_100000181259 [1,0,1,0,0,0|1,0,0]=3 566 B14R1.3348 CC(C(=O)CCO)c1ccccc1Cl 1458a_100011667492_100000211926 [1,0,1,0,0,0|1,0,0]=3 567 B14R1.3348 CC(C(=O)CCO)c1ccccc1F 1458a_100011216618_200000741388 [1,0,1,0,0,0|1,1,0]=4 568 B14R1.3348 CC=CC(=O)C(C)c1ccccc1Cl 1458a_100000210699_100000181259 [1,0,1,0,0,0|0,0,2]=4 569 B14R1.3348 CCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210303 [1,0,1,0,0,0|0,1,0]=3 570 B14R1.3348 CCCC(=O)C(C)c1ccccc1Cl 1458a_100000211992_100000181259 [1,0,1,0,0,0|0,0,0]=2 571 B14R1.3348 CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210303 [1,0,1,0,0,0|0,0,0]=2 572 B14R1.3348 CCCC(=O)C(C)c1ccccc1F 1458a_100000211992_200000741388 [1,0,1,0,0,0|0,1,0]=3 573 B14R1.3348 CCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210303 [1,0,1,0,0,0|1,1,0]=4 574 B14R1.3348 CCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210303 [1,0,1,0,0,0|1,0,0]=3 575 B14R1.3348 CCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210303 [1,0,1,0,0,0|1,1,0]=4 576 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000211992 [1,0,1,0,0,0|1,1,0]=4 577 B14R1.3348 CCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000211992 [1,0,1,0,0,0|1,1,0]=4 578 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000211992 [1,0,1,0,0,0|2,0,0]=4 579 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000211992 [1,0,1,0,0,0|2,0,0]=4 580 B14R1.3348 CCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000211992 [1,0,1,0,0,0|2,0,0]=4 581 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000211992 [1,0,1,0,0,0|1,0,0]=3 582 B14R1.3348 CCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000211992 [1,0,1,0,0,0|1,0,0]=3 583 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000211992 [1,0,1,0,0,0|1,1,0]=4 584 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000211992 [1,0,1,0,0,0|1,1,0]=4 585 B14R1.3348 CCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000211992 [1,0,1,0,0,0|1,1,0]=4 586 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000211992 [1,0,1,0,0,0|2,0,0]=4 587 B14R1.3348 CCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000211992 [1,0,1,0,0,0|2,0,0]=4 588 B14R1.3348 CCCN(C)C(C)c1ccccc1Cl 2230a_100000747261_100000181259 [1,0,1,0,0,0|2,0,0]=4 589 B14R1.3348 CCCN(C)C(C)c1ccccc1Cl 269982a_100000747261_100000181259 [1,0,1,0,0,0|2,0,0]=4 590 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 11a_100015525214_100012359601 [1,0,1,0,0,0|1,1,0]=4 591 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 240690a_100015525214_100012359601 [1,0,1,0,0,0|1,1,0]=4 592 B14R1.3348 CCNC(=O)C(C)c1ccccc1Br 527a_100015525214_100012359601 [1,0,1,0,0,0|1,1,0]=4 593 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 11a_100015525214_100011667492 [1,0,1,0,0,0|1,0,0]=3 594 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 240690a_100015525214_100011667492 [1,0,1,0,0,0|1,0,0]=3 595 B14R1.3348 CCNC(=O)C(C)c1ccccc1Cl 527a_100015525214_100011667492 [1,0,1,0,0,0|1,0,0]=3 596 B14R1.3348 CCNC(=O)C(O)c1ccccc1Cl 240690a_100015525214_100011217820 [1,0,1,0,0,0|2,0,0]=4 597 B14R1.3348 CCNC(=O)N(C)c1ccccc1Cl 512a_100015525214_100000219374 [1,0,1,0,0,0|2,0,0]=4 598 B14R1.3348 CNNC(=O)C(C)c1ccccc1Cl 22a_100016993582_100011667492 [1,0,1,0,0,0|2,0,0]=4 599 B14R1.3348 COCC(=O)C(C)c1ccccc1Cl 1458a_100000210968_100000181259 [1,0,1,0,0,0|1,0,0]=3 600 B14R1.3348 COCC(=O)C(C)c1ccccc1F 1458a_100000210968_200000741388 [1,0,1,0,0,0|1,1,0]=4 601 B14R1.3348 COCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210968 [1,0,1,0,0,0|2,0,0]=4 602 B14R1.3348 COCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210968 [1,0,1,0,0,0|2,0,0]=4 603 B14R1.3348 CSCC(=O)C(C)c1ccccc1Cl 1458a_100000184570_100000181259 [1,0,1,0,0,0|1,0,0]=3 604 B14R1.3348 CSCC(=O)C(C)c1ccccc1F 1458a_100000184570_200000741388 [1,0,1,0,0,0|1,1,0]=4 605 B14R1.3348 CSCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000184570 [1,0,1,0,0,0|2,0,0]=4 606 B14R1.3348 CSCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000184570 [1,0,1,0,0,0|2,0,0]=4 607 B14R1.3348 O=C(CCF)C(O)c1ccccc1Cl 1458a_100011217820_100011217306 [1,0,1,0,0,0|2,0,0]=4 608 B14R1.3348 O=C(CCO)C(O)c1ccccc1Cl 1458a_100011217820_100000211926 [1,0,1,0,0,0|2,0,0]=4 609 B14R1.4230 CCCNC(C)(C)c1ccccc1Cl 2230a_100020606166_100000210303 [1,0,1,0,0,0|2,0,0]=4 610 B14R1.4230 CCCNC(C)(C)c1ccccc1Cl 34a_100020606166_100000210303 [1,0,1,0,0,0|2,0,0]=4 611 B14R1.4230 CCCOC(C)(C)c1ccccc1Cl 34a_100000690508_100000210303 [1,0,1,0,0,0|2,0,0]=4 612 B14R1.4230 CCCOC(C)(C)c1ccccc1Cl 7a_100000690508_100000210303 [1,0,1,0,0,0|2,0,0]=4 613 B14R1.523 CCCN(C(=O)C)c1ccccc1F 11a_100011231789_100015343762 [1,0,1,0,0,0|1,1,0]=4 614 B14R1.523 CCCN(C(=O)C)c1ccccc1F 1626a_100011231789_100015343762 [1,0,1,0,0,0|1,1,0]=4 615 B14R1.523 CCN[C@H](C(=O)O)c1ccccc1Cl 269956a_100009815989_100000210202 [1,0,1,0,0,0|2,0,0]=4 616 B14R1.510 CC(C)(C(=O)CCF)c1ccccc1 1458a_100000211857_100011217306 [1,0,1,0,0,0|2,0,0]=4 617 B14R1.510 CC(C)(C(=O)CCO)c1ccccc1 1458a_100000211857_100000211926 [1,0,1,0,0,0|2,0,0]=4 618 B14R1.510 CC(C)(C(=O)CCO)c1ccccc1 1458a_100011216618_100000034625 [1,0,1,0,0,0|2,0,0]=4 619 B14R1.510 CCCC(=O)C(C)(C)c1ccccc1 1458a_100000211857_100000210303 [1,0,1,0,0,0|1,0,0]=3 620 B14R1.510 CCCC(=O)C(C)(C)c1ccccc1 1458a_100000211992_100000034625 [1,0,1,0,0,0|1,0,0]=3 621 B14R1.510 CCCC(=O)C(F)(F)c1ccccc1 1458a_100000211992_100000036403 [1,0,1,0,0,0|2,0,0]=4 622 B14R1.510 CCCC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_100000210303 [1,0,1,0,0,0|1,0,0]=3 623 B14R1.510 CCNC(=O)C(C)(C)c1ccccc1 11a_100015525214_100000211857 [1,0,1,0,0,0|2,0,0]=4 624 B14R1.510 CCNC(=O)C(C)(C)c1ccccc1 240690a_100015525214_100000211857 [1,0,1,0,0,0|2,0,0]=4 625 B14R1.510 CCNC(=O)C(C)(C)c1ccccc1 527a_100015525214_100000211857 [1,0,1,0,0,0|2,0,0]=4 626 B14R1.510 CCNC(=O)[C@](C)(O)c1ccccc1 240690a_100015525214_100000753667 [1,0,1,0,0,0|2,0,0]=4 627 B14R1.510 COCC(=O)C(C)(C)c1ccccc1 1458a_100000210968_100000034625 [1,0,1,0,0,0|2,0,0]=4 628 B14R1.510 CSCC(=O)C(C)(C)c1ccccc1 1458a_100000184570_100000034625 [1,0,1,0,0,0|2,0,0]=4 629 B14R1.510 C[C@](O)(C(=O)CCF)c1ccccc1 1458a_100000753667_100011217306 [1,0,1,0,0,0|2,0,0]=4 630 B14R1.510 C[C@](O)(C(=O)CCO)c1ccccc1 1458a_100000753667_100000211926 [1,0,1,0,0,0|2,0,0]=4 631 B14R1.2908 CCC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000210202 [1,0,1,0,0,0|1,1,0]=4 632 B14R1.2908 CCC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000210202 [1,0,1,0,0,0|2,0,0]=4 633 B14R1.2982 CCC(=O)C(O)(CC)c1ccccc1 1458a_100011434905_100000210202 [1,0,1,0,0,0|1,0,0]=3 634 B14R1.2982 CCC(O)(C(=O)CF)c1ccccc1 1458a_100011434905_100015361967 [1,0,1,0,0,0|2,0,0]=4 635 B14R1.2982 CCC(O)(C(=O)NC)c1ccccc1 240690a_100102657272_100011434905 [1,0,1,0,0,0|2,0,0]=4 636 B14R1.7706 CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210202 [1,0,1,0,0,0|0,0,0]=2 637 B14R1.7706 CCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210202 [1,0,1,0,0,0|2,0,0]=4 638 B14R1.7706 CCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000210202 [1,0,1,0,0,0|1,1,0]=4 639 B14R1.7706 CCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210414 [1,0,1,0,0,0|1,1,0]=4 640 B14R1.7706 CCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210414 [1,0,1,0,0,0|1,1,0]=4 641 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210414 [1,0,1,0,0,0|2,0,0]=4 642 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210414 [1,0,1,0,0,0|2,0,0]=4 643 B14R1.7706 CCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210414 [1,0,1,0,0,0|2,0,0]=4 644 B14R1.7706 CCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210414 [1,0,1,0,0,0|1,1,0]=4 645 B14R1.7706 CCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210414 [1,0,1,0,0,0|1,1,0]=4 646 B14R1.7706 CCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210414 [1,0,1,0,0,0|2,0,0]=4 647 B14R1.7706 CCC(C(=O)CF)c1ccccc1Cl 1458a_100011667493_100015361967 [1,0,1,0,0,0|1,0,0]=3 648 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 11a_106832991635_100011667493 [1,0,1,0,0,0|1,0,0]=3 649 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 1626a_100102657272_100011667493 [1,0,1,0,0,0|1,0,0]=3 650 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 240690a_100102657272_100011667493 [1,0,1,0,0,0|1,0,0]=3 651 B14R1.7706 CCC(C(=O)NC)c1ccccc1Cl 527a_100102657272_100011667493 [1,0,1,0,0,0|1,0,0]=3 652 B14R1.7706 CNC(C(=O)OC)c1ccccc1Cl 2230a_106832991635_100000240054 [1,0,1,0,0,0|2,0,0]=4 653 B14R1.7706 CNC(C(=O)OC)c1ccccc1Cl 34a_100102657272_100000240054 [1,0,1,0,0,0|2,0,0]=4 654 B14R1.7706 CNC(C(=O)OC)c1ccccc1Cl 7a_106832991635_100000240054 [1,0,1,0,0,0|2,0,0]=4 655 B14R1.7706 COC(=O)C(OC)c1ccccc1Cl 34a_100138415774_100000240054 [1,0,1,0,0,0|2,0,0]=4 656 B14R1.7706 COC(=O)C(SC)c1ccccc1Cl 62a_100000240054_200000210301 [1,0,1,0,0,0|2,0,0]=4 657 B14R1.7706 COC(=O)C(SC)c1ccccc1Cl 62a_200000210301_100000240054 [1,0,1,0,0,0|2,0,0]=4 658 B14R1.7706 COC(=O)C(S[13CH3])c1ccccc1Cl 62a_100000240054_200025704644 [1,0,1,0,0,0|2,0,0]=4 659 B14R1.7706 COC(=O)C(S[13CH3])c1ccccc1Cl 62a_200025704644_100000240054 [1,0,1,0,0,0|2,0,0]=4 660 B14R1.7706 COC(=O)[C@@H](OC)c1ccccc1Cl 34a_100010004286_200000210301 [1,0,1,0,0,0|2,0,0]=4 661 B14R1.7706 COC(=O)[C@@H](O[13CH3])c1ccccc1Cl 34a_100010004286_200025704644 [1,0,1,0,0,0|2,0,0]=4 662 B14R2.24 Brc1ccccc1C2=CCCCC2 271570a_100000062251_100000695589 [2,0,0,0,0,0|0,1,1]=4 663 B14R2.24 CN1CCCCC1c2ccccc2 2230a_100000707174_200000210301 [2,0,0,0,0,0|2,0,0]=4 664 B14R2.24 CN1CCCCC1c2ccccc2 269982a_100000707174_200000210301 [2,0,0,0,0,0|2,0,0]=4 665 B14R2.24 CN1CCCCC1c2ccccc2 34a_100000707174_200000210301 [2,0,0,0,0,0|2,0,0]=4 666 B14R2.24 Cc1ccccc1C2=CCCCC2 271570a_100000062251_100000210755 [2,0,0,0,0,0|1,0,1]=4 667 B14R2.24 Clc1ccccc1C2=CCCCC2 271570a_100000062251_100000764095 [2,0,0,0,0,0|0,0,1]=3 668 B14R2.24 Clc1ccccc1C2=CCCCO2 271570a_100010177797_100000764095 [2,0,0,0,0,0|1,0,1]=4 669 B14R2.24 Clc1ccccc1C2=CCNCC2 271570a_100000731432_100000764095 [2,0,0,0,0,0|1,0,1]=4 670 B14R2.24 Clc1ccccc1C2=CCOCC2 271570a_100000070234_100000764095 [2,0,0,0,0,0|1,0,1]=4 671 B14R2.24 Clc1ccccc1C2=CCSCC2 271570a_100010232141_100000764095 [2,0,0,0,0,0|1,0,1]=4 672 B14R2.24 Clc1ccccc1C2=COCCC2 271570a_100010175576_100000764095 [2,0,0,0,0,0|1,0,1]=4 673 B14R2.24 Clc1cccnc1C2=CCCCC2 271570a_100000062251_100011356963 [2,0,0,0,0,0|1,0,1]=4 674 B14R2.24 Clc1ccncc1C2=CCCCC2 271570a_100000062251_100009995489 [2,0,0,0,0,0|1,0,1]=4 675 B14R2.24 Clc1cnccc1C2=CCCCC2 271570a_100000062251_100000708259 [2,0,0,0,0,0|1,0,1]=4 676 B14R2.24 Clc1ncccc1C2=CCCCC2 271570a_100000062251_100000036424 [2,0,0,0,0,0|1,0,1]=4 677 B14R2.24 Fc1ccccc1C2=CCCCC2 271570a_100000062251_100011215700 [2,0,0,0,0,0|0,1,1]=4 678 B14R2.24 Nc1ccccc1C2=CCCCC2 271570a_100000062251_100000210017 [2,0,0,0,0,0|1,0,1]=4 679 B14R2.24 Oc1ccccc1C2=CCCCC2 271570a_100000062251_100000739446 [2,0,0,0,0,0|1,0,1]=4 680 B14R2.24 Oc1ccccc1C2CCCCC2 271570a_203496583355_200009813743 [2,0,0,0,0,0|1,0,1]=4 681 B14R2.24 Oc1ccccc1C2CCCCN2 271570a_203496583355_100010004825 [2,0,0,0,0,0|2,0,0]=4 682 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 2230a_100000707174_200025704644 [2,0,0,0,0,0|2,0,0]=4 683 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 269982a_100000707174_200025704644 [2,0,0,0,0,0|2,0,0]=4 684 B14R2.24 [13CH3]N1CCCCC1c2ccccc2 34a_100000707174_200025704644 [2,0,0,0,0,0|2,0,0]=4 685 B16R1.20 CC(NCCCC=O)c1cccc(c1Cl)Cl 2230a_100015335525_200011292268 [0,1,1,0,0,0|2,0,0]=4 686 B16R1.20 CC(NCCCC=O)c1cccc(c1Cl)F 2230a_100103153465_200011292268 [0,1,1,0,0,0|2,0,0]=4 687 B16R1.20 CN(CCCCC=O)c1cccc(c1Cl)Cl 2230a_100000742713_100000139335 [0,1,1,0,0,0|2,0,0]=4 688 B16R1.20 CN(CCCCC=O)c1cccc(c1Cl)Cl 269982a_100000742713_100000139335 [0,1,1,0,0,0|2,0,0]=4 689 B16R1.4595 CC(NCCCC=O)c1cc(ccc1Cl)Cl 2230a_100000737532_200011292268 [0,1,1,0,0,0|2,0,0]=4 690 B16R1.4595 CC(OCCCC=O)c1cc(ccc1Cl)Cl 7a_100000742519_200011292268 [0,1,1,0,0,0|2,0,0]=4 691 B16R1.4595 CN(CCCCC=O)c1cc(ccc1Cl)Br 269982a_100011772073_100000139335 [0,1,1,0,0,0|2,0,0]=4 692 B16R1.4595 CN(CCCCC=O)c1cc(ccc1Cl)Cl 269982a_100000742562_100000139335 [0,1,1,0,0,0|2,0,0]=4 693 B16R1.4679 C=CCCCOC(CN)c1ccccc1Cl 34a_200000759403_100000757094 [0,1,1,0,0,0|2,0,0]=4 694 B16R1.4679 CC[C@H](NCCCC=O)c1ccccc1Cl 2230a_200016987949_200011292268 [0,1,1,0,0,0|2,0,0]=4 695 B16R1.4679 N#CC(OCCCC=O)c1ccccc1Cl 7a_200011294979_200011292268 [0,1,1,0,0,0|1,0,1]=4 696 B16R1.4679 O=CCCCNC(CO)c1ccccc1Cl 2230a_100138412506_200011292268 [0,1,1,0,0,0|2,0,0]=4 697 B16R1.7596 C#CCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000695029 [0,1,1,0,0,0|1,0,1]=4 698 B16R1.7596 C#CCCOCCC(N)c1ccccc1Cl 34a_100011661560_100000688953 [0,1,1,0,0,0|1,0,1]=4 699 B16R1.7596 C/C=C/COCCC(N)c1ccccc1Cl 34a_100011661560_100102629194 [0,1,1,0,0,0|1,0,1]=4 700 B16R1.7596 C=CCCCCNC(C)c1ccccc1Cl 2230a_100000174978_100011215482 [0,1,1,0,0,0|2,0,0]=4 701 B16R1.7596 C=CCCCCNC(C)c1ccccc1Cl 2230a_100000703577_100000181259 [0,1,1,0,0,0|2,0,0]=4 702 B16R1.7596 C=CCCCCNC(C)c1ccccc1Cl 269862a_100000703577_100000210134 [0,1,1,0,0,0|2,0,0]=4 703 B16R1.7596 C=CCCCCNC(C)c1ccccc1Cl 34a_100000174978_100011215482 [0,1,1,0,0,0|2,0,0]=4 704 B16R1.7596 C=CCCCCOC(C)c1ccccc1Cl 34a_100000740796_100011215482 [0,1,1,0,0,0|2,0,0]=4 705 B16R1.7596 C=CCCCCOC(C)c1ccccc1Cl 7a_100000740796_100011215482 [0,1,1,0,0,0|2,0,0]=4 706 B16R1.7596 C=CCCCCOC(C)c1ccccc1Cl 7a_100000766645_100000181259 [0,1,1,0,0,0|2,0,0]=4 707 B16R1.7596 C=CCCCNCC(O)c1ccccc1Cl 2230a_200000759403_100011713584 [0,1,1,0,0,0|2,0,0]=4 708 B16R1.7596 C=CCCCNCC(O)c1ccccc1Cl 34a_200000759403_100000757094 [0,1,1,0,0,0|2,0,0]=4 709 B16R1.7596 C=CCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000757094 [0,1,1,0,0,0|1,0,0]=3 710 B16R1.7596 C=CCCCOCC(N)c1ccncc1Cl 34a_200020642286_100000757094 [0,1,1,0,0,0|2,0,0]=4 711 B16R1.7596 C=CCCCOC[C@@H](N)c1ccccc1Br 34a_100161155918_100000757094 [0,1,1,0,0,0|1,1,0]=4 712 B16R1.7596 C=CCCCOC[C@H](N)c1ccccc1F 34a_100009818778_100000757094 [0,1,1,0,0,0|1,1,0]=4 713 B16R1.7596 C=CCCOCCC(N)c1ccccc1Cl 34a_100011661560_100000754431 [0,1,1,0,0,0|1,0,0]=3 714 B16R1.7596 C=CCCOCCC(N)c1ccccc1F 34a_100011661569_100000754431 [0,1,1,0,0,0|1,1,0]=4 715 B16R1.7596 C=COCCOCC(N)c1ccccc1Cl 34a_100138412506_100000039644 [0,1,1,0,0,0|2,0,0]=4 716 B16R1.7596 CC(NCCCCC=O)c1ccccc1Br 2230a_100000181357_100000139335 [0,1,1,0,0,0|1,1,0]=4 717 B16R1.7596 CC(NCCCCC=O)c1ccccc1Cl 2230a_100000174978_100000139335 [0,1,1,0,0,0|1,0,0]=3 718 B16R1.7596 CC(NCCCCC=O)c1ccccc1F 2230a_100000181408_100000139335 [0,1,1,0,0,0|1,1,0]=4 719 B16R1.7596 CC(OCCCCC=O)c1ccccc1Br 7a_100000702211_100000139335 [0,1,1,0,0,0|1,1,0]=4 720 B16R1.7596 CC(OCCCCC=O)c1ccccc1Cl 7a_100000740796_100000139335 [0,1,1,0,0,0|1,0,0]=3 721 B16R1.7596 CC(OCCCCC=O)c1ccccc1F 7a_100000697922_100000139335 [0,1,1,0,0,0|1,1,0]=4 722 B16R1.7596 CC(OCCCCC=O)c1ccccc1N 7a_100011405641_100000139335 [0,1,1,0,0,0|2,0,0]=4 723 B16R1.7596 CC(OCCCCC=O)c1cccnc1Cl 7a_100009865335_100000139335 [0,1,1,0,0,0|2,0,0]=4 724 B16R1.7596 CC(SCCCCC=O)c1ccccc1Cl 62a_100000139335_100000181259 [0,1,1,0,0,0|1,0,0]=3 725 B16R1.7596 CC(SCCCCC=O)c1ccccc1Cl 62a_100000181259_100000139335 [0,1,1,0,0,0|1,0,0]=3 726 B16R1.7596 CC(SCCCCC=O)c1ccccc1F 62a_100000139335_200000741388 [0,1,1,0,0,0|1,1,0]=4 727 B16R1.7596 CC(SCCCCC=O)c1ccccc1F 62a_200000741388_100000139335 [0,1,1,0,0,0|1,1,0]=4 728 B16R1.7596 CC=CCOCCC(N)c1ccccc1Cl 34a_100011661560_100000070051 [0,1,1,0,0,0|1,0,1]=4 729 B16R1.7596 CCCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000718602 [0,1,1,0,0,0|1,0,1]=4 730 B16R1.7596 CCCCOCCC(N)c1ccccc1Cl 34a_100011661560_100000210210 [0,1,1,0,0,0|1,0,1]=4 731 B16R1.7596 CN(CCCCCC=O)c1ccccc1Cl 2230a_100000219374_100000139337 [0,1,1,0,0,0|2,0,0]=4 732 B16R1.7596 CN(CCCCCC=O)c1ccccc1Cl 269982a_100000219374_100000139337 [0,1,1,0,0,0|2,0,0]=4 733 B16R1.7596 COCCCOCC(N)c1ccccc1Cl 34a_100138412506_100000740836 [0,1,1,0,0,0|2,0,0]=4 734 B16R1.7596 COCCOCCC(N)c1ccccc1Cl 34a_100011661560_100011201679 [0,1,1,0,0,0|2,0,0]=4 735 B16R1.7596 CSCCOCCC(N)c1ccccc1Cl 34a_100011661560_100000212216 [0,1,1,0,0,0|2,0,0]=4 736 B16R1.7596 C[C@@H](NCCCCC=O)c1ccccc1O 2230a_100025703389_100000139335 [0,1,1,0,0,0|2,0,0]=4 737 B16R1.7596 Cc1ccccc1C(C)NCCCCC=O 2230a_100000181355_100000139335 [0,1,1,0,0,0|2,0,0]=4 738 B16R1.7596 Cc1ccccc1C(C)OCCCCC=O 7a_100000742021_100000139335 [0,1,1,0,0,0|2,0,0]=4 739 B16R1.7596 NC(CCOCCCF)c1ccccc1Cl 34a_100011661560_100011934791 [0,1,1,0,0,0|1,0,1]=4 740 B16R1.7596 NC(CCOCCCO)c1ccccc1Cl 34a_100011661560_100000230001 [0,1,1,0,0,0|0,0,2]=4 741 B16R1.7596 NC(COCCCCF)c1ccccc1Cl 34a_100138412506_100000729493 [0,1,1,0,0,0|1,0,1]=4 742 B16R1.7596 NC(COCCCCO)c1ccccc1Cl 34a_100138412506_100011216708 [0,1,1,0,0,0|0,0,2]=4 743 B16R1.7596 O=CCCCNCC(O)c1ccccc1Br 2230a_100011236429_200011292268 [0,1,1,0,0,0|1,1,0]=4 744 B16R1.7596 O=CCCCNCC(O)c1ccccc1Cl 2230a_200000759403_200011292268 [0,1,1,0,0,0|1,0,0]=3 745 B16R1.7596 O=CCCCSCC(=O)c1ccccc1Cl 62a_100000211432_200011292268 [0,1,1,0,0,0|1,0,1]=4 746 B16R1.7596 O=CCCCSCC(=O)c1ccccc1Cl 62a_200011292268_100000211432 [0,1,1,0,0,0|1,0,1]=4 747 B16R1.10817 C=C(C)CCOCC(N)c1ccccc1Cl 34a_100138412506_100000730704 [0,1,1,0,0,0|2,0,0]=4 748 B16R1.10817 C=C(C)COCCC(N)c1ccccc1Cl 34a_100011661560_100000748629 [0,1,1,0,0,0|2,0,0]=4 749 B16R1.10817 C=C(F)COCCC(N)c1ccccc1Cl 34a_100011661560_100009893438 [0,1,1,0,0,0|2,0,0]=4 750 B16R1.10817 CC(=O)CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000735457 [0,1,1,0,0,0|1,0,1]=4 751 B16R1.10817 CC(=O)CCCCN(C)c1ccccc1Cl 269982a_100000219374_100000735457 [0,1,1,0,0,0|2,0,0]=4 752 B16R1.10817 CC(=O)CCCCN(C)c1ccccc1Cl 34a_100000219374_100009817362 [0,1,1,0,0,0|2,0,0]=4 753 B16R1.10817 CC(=O)CCCNC(C)c1ccccc1Cl 34a_100000174978_100000685027 [0,1,1,0,0,0|2,0,0]=4 754 B16R1.10817 CC(=O)CCCOC(C)c1ccccc1Cl 34a_100000740796_100000685027 [0,1,1,0,0,0|2,0,0]=4 755 B16R1.10817 CC(=O)CCCOC(C)c1ccccc1Cl 7a_100000740796_100011215641 [0,1,1,0,0,0|2,0,0]=4 756 B16R1.10817 CC(=O)CCCOC(C)c1ccccc1Cl 7a_100000759063_100000181259 [0,1,1,0,0,0|2,0,0]=4 757 B16R1.10817 CC(=O)CCCSC(C)c1ccccc1Cl 62a_100000181259_100011215641 [0,1,1,0,0,0|2,0,0]=4 758 B16R1.10817 CC(=O)CCCSC(C)c1ccccc1Cl 62a_100011215641_100000181259 [0,1,1,0,0,0|2,0,0]=4 759 B16R1.10817 CC(=O)OCOCC(N)c1ccccc1Cl 34a_100138412506_100009813279 [0,1,1,0,0,0|2,0,0]=4 760 B16R1.10817 CC(NCCCC(=O)N)c1ccccc1Cl 269862a_100000739312_100000210134 [0,1,1,0,0,0|2,0,0]=4 761 B16R1.10817 CC(NCCCC(=O)N)c1ccccc1Cl 34a_100000174978_100102525003 [0,1,1,0,0,0|2,0,0]=4 762 B16R1.10817 CC(OCCCC(=O)N)c1ccccc1Cl 34a_100000740796_100102525003 [0,1,1,0,0,0|2,0,0]=4 763 B16R1.10817 CC(OCCCC(=O)N)c1ccccc1Cl 7a_100000740796_100102525003 [0,1,1,0,0,0|2,0,0]=4 764 B16R1.10817 CC(SCCCC(=O)N)c1ccccc1Cl 62a_100000181259_100102525003 [0,1,1,0,0,0|2,0,0]=4 765 B16R1.10817 CC(SCCCC(=O)N)c1ccccc1Cl 62a_100102525003_100000181259 [0,1,1,0,0,0|2,0,0]=4 766 B16R1.10817 NC(=O)CCNCC(O)c1ccccc1Cl 2230a_200000759403_100000744528 [0,1,1,0,0,0|2,0,0]=4 767 B16R1.10817 NC(=O)CCNCC(O)c1ccccc1Cl 34a_200000759403_100000731001 [0,1,1,0,0,0|2,0,0]=4 768 B16R1.10817 NC(=O)CCOCC(N)c1ccccc1Cl 34a_100138412506_100000731001 [0,1,1,0,0,0|1,0,0]=3 769 B16R1.10817 NC(=O)CCOCC(N)c1ccncc1Cl 34a_200020642286_100000731001 [0,1,1,0,0,0|2,0,0]=4 770 B16R1.10817 NC(=O)CCOC[C@@H](N)c1ccccc1Br 34a_100161155918_100000731001 [0,1,1,0,0,0|1,1,0]=4 771 B16R1.10817 NC(=O)CCOC[C@H](N)c1ccccc1F 34a_100009818778_100000731001 [0,1,1,0,0,0|1,1,0]=4 772 B16R1.10817 NC(=O)COCCC(N)c1ccccc1Cl 34a_100011661560_100000187820 [0,1,1,0,0,0|1,0,0]=3 773 B16R1.10817 NC(=O)COCCC(N)c1ccccc1F 34a_100011661569_100000187820 [0,1,1,0,0,0|1,1,0]=4 774 B16R1.10817 NC(CCOCC(=O)[O-])c1ccccc1Cl 34a_100011661560_100020667443 [0,1,1,0,0,0|1,0,0]=3 775 B16R1.10817 NC(CCOCC(=O)[O-])c1ccccc1F 34a_100011661569_100020667443 [0,1,1,0,0,0|1,1,0]=4 776 B16R1.10817 NC(CCOC[N+](=O)[O-])c1ccccc1Cl 34a_100011661560_100000761209 [0,1,1,0,0,0|2,0,0]=4 777 B16R1.12779 CC(C)(NCCCC=O)c1ccccc1Cl 2230a_100020606166_200011292268 [0,1,1,0,0,0|2,0,0]=4 778 B16R1.12779 CC(C)(OCCCC=O)c1ccccc1Cl 7a_100000690508_200011292268 [0,1,1,0,0,0|2,0,0]=4 779 B16R1.16971 C=CC(O)COCC(N)c1ccccc1Cl 34a_100138412506_100000730141 [0,1,1,0,0,0|2,0,0]=4 780 B16R1.26593 C=CCCOC[C@@H](N)c1ccc(cc1Cl)F 34a_102531768864_100000754431 [0,1,1,0,0,0|2,0,0]=4 781 B16R1.26593 CC(NCCCC=O)c1ccc(cc1Cl)Cl 2230a_100000179772_200011292268 [0,1,1,0,0,0|2,0,0]=4 782 B16R1.26593 CC(OCCCC=O)c1ccc(cc1Cl)Cl 7a_100000743050_200011292268 [0,1,1,0,0,0|2,0,0]=4 783 B16R1.26593 CC(OCCCC=O)c1ccc(cc1Cl)F 7a_200011245020_200011292268 [0,1,1,0,0,0|2,0,0]=4 784 B16R1.26593 CN(CCCCC=O)c1ccc(cc1Cl)Br 269982a_100000221650_100000139335 [0,1,1,0,0,0|2,0,0]=4 785 B16R1.26593 CN(CCCCC=O)c1ccc(cc1Cl)Cl 269982a_114849113696_100000139335 [0,1,1,0,0,0|2,0,0]=4 786 B16R1.26593 C[C@@H](NCCCC=O)c1ccc(cc1Cl)F 2230a_100015196781_200011292268 [0,1,1,0,0,0|2,0,0]=4 787 B16R1.106955 CC(OCCCC=O)c1c(cccc1Cl)Cl 7a_100011215154_200011292268 [0,1,1,0,0,0|2,0,0]=4 788 B16R1.106955 CN(CCCCC=O)c1c(cccc1Cl)Cl 269982a_100000691019_100000139335 [0,1,1,0,0,0|2,0,0]=4 789 B16R1.106955 C[C@@H](NCCCC=O)c1c(cccc1Cl)Cl 2230a_100016989663_200011292268 [0,1,1,0,0,0|2,0,0]=4 790 B16R1.106955 C[C@@H](NCCCC=O)c1c(cccc1Cl)F 2230a_100011997870_200011292268 [0,1,1,0,0,0|2,0,0]=4 791 B16R1.106955 C[C@@H](OCCCC=O)c1c(cccc1Cl)F 7a_200012136785_200011292268 [0,1,1,0,0,0|2,0,0]=4 792 B16R1.90 CCCCC(=O)C(C)c1cccc(c1C)C 1458a_100000210183_100012183177 [0,1,1,0,0,0|2,0,0]=4 793 B16R1.90 CCCCC(=O)C(O)c1cccc(c1F)F 1458a_200011215923_100000210211 [0,1,1,0,0,0|1,1,0]=4 794 B16R1.90 CCCCC(=O)N(C)c1cccc(c1Cl)Cl 11a_100000742713_100000210183 [0,1,1,0,0,0|2,0,0]=4 795 B16R1.90 CCCCC(=O)N(C)c1cccc(c1Cl)Cl 1626a_100000742713_100000210183 [0,1,1,0,0,0|2,0,0]=4 796 B16R1.7497 CCCCC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_100000210211 [0,1,1,0,0,0|2,0,0]=4 797 B16R1.7497 CCCCC(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_100000210211 [0,1,1,0,0,0|1,1,0]=4 798 B16R1.7497 CCCCC(=O)N(C)c1cc(ccc1Cl)Br 11a_100011772073_100000210183 [0,1,1,0,0,0|2,0,0]=4 799 B16R1.7497 CCCCC(=O)N(C)c1cc(ccc1Cl)Br 1626a_100011772073_100000210183 [0,1,1,0,0,0|2,0,0]=4 800 B16R1.7497 CCCCC(=O)N(C)c1cc(ccc1Cl)Cl 11a_100000742562_100000210183 [0,1,1,0,0,0|2,0,0]=4 801 B16R1.7497 CCCCC(=O)N(C)c1cc(ccc1Cl)Cl 1626a_100000742562_100000210183 [0,1,1,0,0,0|2,0,0]=4 802 B16R1.7516 CCCCC(=O)C(C)c1ccccc1OC 1458a_100011435281_100000210211 [0,1,1,0,0,0|2,0,0]=4 803 B16R1.7740 CCCCC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000210211 [0,1,1,0,0,0|1,1,0]=4 804 B16R1.7740 CCCCC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000210211 [0,1,1,0,0,0|2,0,0]=4 805 B16R1.7740 CCCCC(=O)C(F)(F)c1ccccc1F 1458a_100000210183_100000070671 [0,1,1,0,0,0|1,1,0]=4 806 B16R1.7740 CCCNC(=O)C(F)(F)c1ccccc1Cl 11a_100020643023_100011667290 [0,1,1,0,0,0|2,0,0]=4 807 B16R1.7740 CCCNC(=O)C(F)(F)c1ccccc1Cl 1626a_100020643023_100011667290 [0,1,1,0,0,0|2,0,0]=4 808 B16R1.7740 CCCNC(=O)C(F)(F)c1ccccc1Cl 240690a_100020643023_100011667290 [0,1,1,0,0,0|2,0,0]=4 809 B16R1.7740 CCCNC(=O)C(F)(F)c1ccccc1Cl 527a_100020643023_100011667290 [0,1,1,0,0,0|2,0,0]=4 810 B16R1.10818 C=C(C)CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000730704 [0,1,1,0,0,0|1,0,1]=4 811 B16R1.10818 C=C(C)CCC(=O)C(C)c1ccccc1Cl 1458a_200000688413_100000181259 [0,1,1,0,0,0|1,0,1]=4 812 B16R1.10818 C=C(C)CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000730704 [0,1,1,0,0,0|1,0,1]=4 813 B16R1.10818 CC(C(=O)CC[S+](C)C)c1ccccc1Cl 1458a_100009452791_100000181259 [0,1,1,0,0,0|2,0,0]=4 814 B16R1.10818 CC(C)CCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210312 [0,1,1,0,0,0|1,1,0]=4 815 B16R1.10818 CC(C)CCC(=O)C(C)c1ccccc1Cl 1458a_100000181311_100000181259 [0,1,1,0,0,0|1,0,0]=3 816 B16R1.10818 CC(C)CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210312 [0,1,1,0,0,0|1,0,0]=3 817 B16R1.10818 CC(C)CCC(=O)C(C)c1ccccc1F 1458a_100000181311_200000741388 [0,1,1,0,0,0|1,1,0]=4 818 B16R1.10818 CC(C)CCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210312 [0,1,1,0,0,0|1,1,0]=4 819 B16R1.10818 CC(C)CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210312 [0,1,1,0,0,0|1,0,0]=3 820 B16R1.10818 CC(C)CCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210312 [0,1,1,0,0,0|1,1,0]=4 821 B16R1.10818 CC(C)CCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000181311 [0,1,1,0,0,0|2,0,0]=4 822 B16R1.10818 CC(C)CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000181311 [0,1,1,0,0,0|2,0,0]=4 823 B16R1.10818 CC(C)CNC(=O)C(C)c1ccccc1Cl 11a_100000210953_100011667492 [0,1,1,0,0,0|2,0,0]=4 824 B16R1.10818 CC(C)CNC(=O)C(C)c1ccccc1Cl 1626a_100000210953_100011667492 [0,1,1,0,0,0|2,0,0]=4 825 B16R1.10818 CC(C)CNC(=O)C(C)c1ccccc1Cl 240690a_100000210953_100011667492 [0,1,1,0,0,0|2,0,0]=4 826 B16R1.10818 CC(C)CNC(=O)C(C)c1ccccc1Cl 527a_100000210953_100011667492 [0,1,1,0,0,0|2,0,0]=4 827 B16R1.10818 CC(C)CNC(=O)C(O)c1ccccc1Cl 240690a_100000210953_100011217820 [0,1,1,0,0,0|2,0,0]=4 828 B16R1.10818 CC(C)OCC(=O)C(C)c1ccccc1Cl 1458a_100000745533_100000181259 [0,1,1,0,0,0|2,0,0]=4 829 B16R1.10818 CC(C)SCC(=O)C(C)c1ccccc1Cl 1458a_100000241585_100000181259 [0,1,1,0,0,0|2,0,0]=4 830 B16R1.10818 CC(O)CCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100012276601 [0,1,1,0,0,0|1,1,0]=4 831 B16R1.10818 CC(O)CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100012276601 [0,1,1,0,0,0|1,0,0]=3 832 B16R1.10818 CC(O)CCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100012276601 [0,1,1,0,0,0|1,1,0]=4 833 B16R1.10818 CC(O)CCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100012276601 [0,1,1,0,0,0|1,0,0]=3 834 B16R1.10818 CC(O)CCC(=O)C(O)c1ccccc1F 1458a_100011219519_100012276601 [0,1,1,0,0,0|1,1,0]=4 835 B16R1.10818 CC(O)CCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000718519 [0,1,1,0,0,0|2,0,0]=4 836 B16R1.10818 CC(O)CNC(=O)C(C)c1ccccc1Cl 11a_100000210904_100011667492 [0,1,1,0,0,0|2,0,0]=4 837 B16R1.10818 CC(O)CNC(=O)C(C)c1ccccc1Cl 240690a_100000210904_100011667492 [0,1,1,0,0,0|2,0,0]=4 838 B16R1.10818 CC(O)CNC(=O)C(C)c1ccccc1Cl 527a_100000210904_100011667492 [0,1,1,0,0,0|2,0,0]=4 839 B16R1.10818 CC(O)CNC(=O)C(O)c1ccccc1Cl 240690a_100000210904_100011217820 [0,1,1,0,0,0|2,0,0]=4 840 B16R1.13247 CC(CCO)C(=O)C(C)c1ccccc1Cl 1458a_100011667492_100009893172 [0,1,1,0,0,0|2,0,0]=4 841 B16R1.13247 CC(CCO)C(=O)C(O)c1ccccc1Cl 1458a_100011217820_100009893172 [0,1,1,0,0,0|2,0,0]=4 842 B16R1.13247 CCCC(C)C(=O)C(C)c1ccccc1Br 1458a_100012359601_100000766640 [0,1,1,0,0,0|1,1,0]=4 843 B16R1.13247 CCCC(C)C(=O)C(C)c1ccccc1Cl 1458a_100000210906_100000181259 [0,1,1,0,0,0|1,0,0]=3 844 B16R1.13247 CCCC(C)C(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000766640 [0,1,1,0,0,0|1,0,0]=3 845 B16R1.13247 CCCC(C)C(=O)C(C)c1ccccc1F 1458a_100000210906_200000741388 [0,1,1,0,0,0|1,1,0]=4 846 B16R1.13247 CCCC(C)C(=O)C(O)c1ccccc1Br 1458a_200011356456_100000766640 [0,1,1,0,0,0|1,1,0]=4 847 B16R1.13247 CCCC(C)C(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000766640 [0,1,1,0,0,0|1,0,0]=3 848 B16R1.13247 CCCC(C)C(=O)C(O)c1ccccc1F 1458a_100011219519_100000766640 [0,1,1,0,0,0|1,1,0]=4 849 B16R1.13247 CCCC(C)C(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210906 [0,1,1,0,0,0|2,0,0]=4 850 B16R1.13247 CCCC(C)C(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210906 [0,1,1,0,0,0|2,0,0]=4 851 B16R1.13247 CCCN(C)C(=O)C(C)c1ccccc1Cl 11a_100000747261_100011667492 [0,1,1,0,0,0|2,0,0]=4 852 B16R1.13247 CCCN(C)C(=O)C(C)c1ccccc1Cl 1626a_100000747261_100011667492 [0,1,1,0,0,0|2,0,0]=4 853 B16R1.13247 CCCN(C)C(=O)C(C)c1ccccc1Cl 240690a_100000747261_100011667492 [0,1,1,0,0,0|2,0,0]=4 854 B16R1.13247 CCCN(C)C(=O)C(C)c1ccccc1Cl 527a_100000747261_100011667492 [0,1,1,0,0,0|2,0,0]=4 855 B16R1.13247 CCCN(C)C(=O)C(O)c1ccccc1Cl 240690a_100000747261_100011217820 [0,1,1,0,0,0|2,0,0]=4 856 B16R1.13247 CCC[C@H](O)C(=O)C(C)c1ccccc1Cl 1458a_100009822183_100000181259 [0,1,1,0,0,0|1,0,0]=3 857 B16R1.13247 CCC[C@H](O)C(=O)C(C)c1ccccc1F 1458a_100009822183_200000741388 [0,1,1,0,0,0|1,1,0]=4 858 B16R1.13247 CCOC(C)C(=O)C(C)c1ccccc1Cl 1458a_100000739345_100000181259 [0,1,1,0,0,0|2,0,0]=4 859 B16R1.13247 CCSC(C)C(=O)C(C)c1ccccc1Cl 1458a_100000230601_100000181259 [0,1,1,0,0,0|2,0,0]=4 860 B16R1.13247 COCC(C)C(=O)C(C)c1ccccc1Cl 1458a_100000751857_100000181259 [0,1,1,0,0,0|2,0,0]=4 861 B16R1.13247 COCC(C)C(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000765312 [0,1,1,0,0,0|2,0,0]=4 862 B16R1.13247 COCC(C)C(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000765312 [0,1,1,0,0,0|2,0,0]=4 863 B16R1.13247 CSCC(C)C(=O)C(C)c1ccccc1Cl 1458a_100000753918_100000181259 [0,1,1,0,0,0|2,0,0]=4 864 B16R1.16913 CC(C(=O)C[C@@H](C)CO)c1ccccc1Cl 1458a_100011667492_100000059175 [0,1,1,0,0,0|2,0,0]=4 865 B16R1.16913 CCC(=O)CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000747405 [0,1,1,0,0,0|1,0,1]=4 866 B16R1.16913 CCC(=O)CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000747405 [0,1,1,0,0,0|1,0,1]=4 867 B16R1.16913 CCC(C)CC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000748023 [0,1,1,0,0,0|1,1,0]=4 868 B16R1.16913 CCC(C)CC(=O)C(C)c1ccccc1Cl 1458a_100000708755_100000181259 [0,1,1,0,0,0|1,0,0]=3 869 B16R1.16913 CCC(C)CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000748023 [0,1,1,0,0,0|1,0,0]=3 870 B16R1.16913 CCC(C)CC(=O)C(C)c1ccccc1F 1458a_100000708755_200000741388 [0,1,1,0,0,0|1,1,0]=4 871 B16R1.16913 CCC(C)CC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000748023 [0,1,1,0,0,0|1,1,0]=4 872 B16R1.16913 CCC(C)CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000748023 [0,1,1,0,0,0|1,0,0]=3 873 B16R1.16913 CCC(C)CC(=O)C(O)c1ccccc1F 1458a_100011219519_100000748023 [0,1,1,0,0,0|1,1,0]=4 874 B16R1.16913 CCC(C)CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000708755 [0,1,1,0,0,0|2,0,0]=4 875 B16R1.16913 CCC(C)CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000708755 [0,1,1,0,0,0|2,0,0]=4 876 B16R1.16913 CCC(C)NC(=O)C(C)c1ccccc1Cl 11a_100000209981_100011667492 [0,1,1,0,0,0|2,0,0]=4 877 B16R1.16913 CCC(C)NC(=O)C(C)c1ccccc1Cl 1626a_100000209981_100011667492 [0,1,1,0,0,0|2,0,0]=4 878 B16R1.16913 CCC(C)NC(=O)C(C)c1ccccc1Cl 240690a_100000209981_100011667492 [0,1,1,0,0,0|2,0,0]=4 879 B16R1.16913 CCC(C)NC(=O)C(C)c1ccccc1Cl 527a_100000209981_100011667492 [0,1,1,0,0,0|2,0,0]=4 880 B16R1.16913 CCC(C)NC(=O)C(O)c1ccccc1Cl 240690a_100000209981_100011217820 [0,1,1,0,0,0|2,0,0]=4 881 B16R1.16913 CCC(O)CC(=O)C(C)c1ccccc1Br 1458a_100012359601_100011218378 [0,1,1,0,0,0|1,1,0]=4 882 B16R1.16913 CCC(O)CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100011218378 [0,1,1,0,0,0|1,0,0]=3 883 B16R1.16913 CCC(O)CC(=O)C(C)c1ccccc1Cl 1458a_100011667805_100000181259 [0,1,1,0,0,0|1,0,0]=3 884 B16R1.16913 CCC(O)CC(=O)C(C)c1ccccc1F 1458a_100011667805_200000741388 [0,1,1,0,0,0|1,1,0]=4 885 B16R1.16913 CCC(O)CC(=O)C(O)c1ccccc1Br 1458a_200011356456_100011218378 [0,1,1,0,0,0|1,1,0]=4 886 B16R1.16913 CCC(O)CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100011218378 [0,1,1,0,0,0|1,0,0]=3 887 B16R1.16913 CCC(O)CC(=O)C(O)c1ccccc1F 1458a_100011219519_100011218378 [0,1,1,0,0,0|1,1,0]=4 888 B16R1.16913 CCC(O)CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100011667805 [0,1,1,0,0,0|2,0,0]=4 889 B16R1.16913 CCN(C)CC(=O)C(C)c1ccccc1Cl 1458a_100116209913_100000181259 [0,1,1,0,0,0|2,0,0]=4 890 B16R1.16913 CC[C@H](C)CC(=O)C(C)c1ccccc1Br 1458a_100012359601_100009816398 [0,1,1,0,0,0|1,1,0]=4 891 B16R1.16913 CC[C@H](C)CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100009816398 [0,1,1,0,0,0|1,0,0]=3 892 B16R1.16913 CC[C@H](C)CC(=O)C(O)c1ccccc1Br 1458a_200011356456_100009816398 [0,1,1,0,0,0|1,1,0]=4 893 B16R1.16913 CC[C@H](C)CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100009816398 [0,1,1,0,0,0|1,0,0]=3 894 B16R1.16913 CC[C@H](C)CC(=O)C(O)c1ccccc1F 1458a_100011219519_100009816398 [0,1,1,0,0,0|1,1,0]=4 895 B16R1.16913 C[C@@H](CO)CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000059175 [0,1,1,0,0,0|2,0,0]=4 896 B16R1.20764 CCC(C(=O)CCCF)c1ccccc1Cl 1458a_100011667493_100011934791 [0,1,1,0,0,0|2,0,0]=4 897 B16R1.20764 CCC(C(=O)CCCO)c1ccccc1Cl 1458a_100011667493_100011215043 [0,1,1,0,0,0|2,0,0]=4 898 B16R1.20764 CCC(C(=O)CCOC)c1ccccc1Cl 1458a_100011667493_100000233755 [0,1,1,0,0,0|2,0,0]=4 899 B16R1.20764 CCC(C(=O)CCSC)c1ccccc1Cl 1458a_100011667493_100000751147 [0,1,1,0,0,0|2,0,0]=4 900 B16R1.20764 CCCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210211 [0,1,1,0,0,0|1,0,0]=3 901 B16R1.20764 CCCCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210211 [0,1,1,0,0,0|2,0,0]=4 902 B16R1.20764 CCCCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000210211 [0,1,1,0,0,0|1,1,0]=4 903 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 11a_100020643023_100011667493 [0,1,1,0,0,0|2,0,0]=4 904 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 1626a_100020643023_100011667493 [0,1,1,0,0,0|2,0,0]=4 905 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 240690a_100020643023_100011667493 [0,1,1,0,0,0|2,0,0]=4 906 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 527a_100020643023_100011667493 [0,1,1,0,0,0|2,0,0]=4 907 B16R1.40312 CC(C(=O)CCCF)c1ccc(cc1Cl)F 1458a_200012359452_100011934791 [0,1,1,0,0,0|2,0,0]=4 908 B16R1.40312 CC(C(=O)CCCO)c1ccc(cc1Cl)F 1458a_200012359452_100011215043 [0,1,1,0,0,0|2,0,0]=4 909 B16R1.40312 CCCCC(=O)C(C)c1ccc(cc1Cl)F 1458a_200012359452_100000210211 [0,1,1,0,0,0|1,0,0]=3 910 B16R1.40312 CCCCC(=O)C(O)c1ccc(cc1F)Br 1458a_100011356516_100000210211 [0,1,1,0,0,0|1,1,0]=4 911 B16R1.40312 CCCCC(=O)C(O)c1ccc(cc1F)F 1458a_100011216397_100000210211 [0,1,1,0,0,0|1,1,0]=4 912 B16R1.40312 CCCCC(=O)N(C)c1ccc(cc1Cl)Br 11a_100000221650_100000210183 [0,1,1,0,0,0|2,0,0]=4 913 B16R1.40312 CCCCC(=O)N(C)c1ccc(cc1Cl)Br 1626a_100000221650_100000210183 [0,1,1,0,0,0|2,0,0]=4 914 B16R1.40312 CCCCC(=O)N(C)c1ccc(cc1Cl)Cl 11a_114849113696_100000210183 [0,1,1,0,0,0|2,0,0]=4 915 B16R1.40312 CCCCC(=O)N(C)c1ccc(cc1Cl)Cl 1626a_114849113696_100000210183 [0,1,1,0,0,0|2,0,0]=4 916 B16R1.40312 CCCNC(=O)C(C)c1ccc(cc1Cl)F 11a_100020643023_200012359452 [0,1,1,0,0,0|2,0,0]=4 917 B16R1.40312 CCCNC(=O)C(C)c1ccc(cc1Cl)F 1626a_100020643023_200012359452 [0,1,1,0,0,0|2,0,0]=4 918 B16R1.40312 CCCNC(=O)C(C)c1ccc(cc1Cl)F 240690a_100020643023_200012359452 [0,1,1,0,0,0|2,0,0]=4 919 B16R1.40312 CCCNC(=O)C(C)c1ccc(cc1Cl)F 527a_100020643023_200012359452 [0,1,1,0,0,0|2,0,0]=4 920 B16R1.40312 COCCC(=O)C(C)c1ccc(cc1Cl)F 1458a_200012359452_100000233755 [0,1,1,0,0,0|2,0,0]=4 921 B16R1.40312 CSCCC(=O)C(C)c1ccc(cc1Cl)F 1458a_200012359452_100000751147 [0,1,1,0,0,0|2,0,0]=4 922 B16R1.131163 CCCCC(=O)C(O)c1c(cccc1F)F 1458a_200011216624_100000210211 [0,1,1,0,0,0|1,1,0]=4 923 B16R1.131163 CCCCC(=O)N(C)c1c(cccc1Cl)Cl 11a_100000691019_100000210183 [0,1,1,0,0,0|2,0,0]=4 924 B16R1.131163 CCCCC(=O)N(C)c1c(cccc1Cl)Cl 1626a_100000691019_100000210183 [0,1,1,0,0,0|2,0,0]=4 925 B16R1.2620 CCC(C)C(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000758301 [0,1,1,0,0,0|1,1,0]=4 926 B16R1.2620 CCC(C)C(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000758301 [0,1,1,0,0,0|2,0,0]=4 927 B16R1.7434 CC(C)CC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000210624 [0,1,1,0,0,0|1,1,0]=4 928 B16R1.7434 CC(C)CC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000210624 [0,1,1,0,0,0|2,0,0]=4 929 B16R1.7434 CC(O)CC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100011218427 [0,1,1,0,0,0|1,1,0]=4 930 B16R1.7434 CC(O)CC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100011218427 [0,1,1,0,0,0|2,0,0]=4 931 B16R1.13842 CCCC(=O)C(C)(C)c1ccccc1OC 1458a_100000747510_100000210303 [0,1,1,0,0,0|2,0,0]=4 932 B16R1.65311 CC(C)(C(=O)CCF)c1ccc(cc1Cl)Cl 1458a_100011389698_100011217306 [0,1,1,0,0,0|2,0,0]=4 933 B16R1.65311 CC(C)(C(=O)CCO)c1ccc(cc1Cl)Cl 1458a_100011389698_100000211926 [0,1,1,0,0,0|2,0,0]=4 934 B16R1.65311 CCCC(=O)C(C)(C)c1ccc(cc1Cl)Cl 1458a_100011389698_100000210303 [0,1,1,0,0,0|1,0,0]=3 935 B16R1.65311 CCNC(=O)C(C)(C)c1ccc(cc1Cl)Cl 11a_100015525214_100011389698 [0,1,1,0,0,0|2,0,0]=4 936 B16R1.65311 CCNC(=O)C(C)(C)c1ccc(cc1Cl)Cl 240690a_100015525214_100011389698 [0,1,1,0,0,0|2,0,0]=4 937 B16R1.65311 CCNC(=O)C(C)(C)c1ccc(cc1Cl)Cl 527a_100015525214_100011389698 [0,1,1,0,0,0|2,0,0]=4 938 B16R1.162467 CCCC(=O)C(C)(C)c1c(cccc1F)F 1458a_100011975622_100000210303 [0,1,1,0,0,0|1,1,0]=4 939 B16R2.2474 C=Cc1ccccc1N2CCCCC2=O 271570a_100011290941_200000217094 [1,1,0,0,0,0|2,0,0]=4 940 B16R2.2474 CCN1CCCCC1c2ccccc2Cl 2230a_100011804123_100000210202 [1,1,0,0,0,0|2,0,0]=4 941 B16R2.2474 CCN1CCCCC1c2ccccc2Cl 269982a_100011804123_100000204670 [1,1,0,0,0,0|2,0,0]=4 942 B16R2.2474 CCN1CCCCC1c2ccccc2Cl 34a_100011804123_100000210202 [1,1,0,0,0,0|2,0,0]=4 943 B16R2.2474 CSc1ccccc1N2CCCCC2=O 62a_200000210301_200000217094 [1,1,0,0,0,0|2,0,0]=4 944 B16R2.2474 CSc1ccccc1N2CCCCC2=O 62a_200000217094_200000210301 [1,1,0,0,0,0|2,0,0]=4 945 B16R2.2474 FCN1CCCCC1c2ccccc2Cl 269982a_100011804123_100015361967 [1,1,0,0,0,0|2,0,0]=4 946 B16R2.2474 FCN1CCCCC1c2ccccc2Cl 34a_100011804123_100015361967 [1,1,0,0,0,0|2,0,0]=4 947 B16R2.2474 [13CH3]Sc1ccccc1N2CCCCC2=O 62a_200000217094_200025704644 [1,1,0,0,0,0|2,0,0]=4 948 B16R2.2474 [13CH3]Sc1ccccc1N2CCCCC2=O 62a_200025704644_200000217094 [1,1,0,0,0,0|2,0,0]=4 949 B16R2.2996 Cc1ccc(cc1N2CCCCC2=O)O 271570a_203496583355_200011344815 [1,1,0,0,0,0|2,0,0]=4 950 B16R2.2996 O=C1CCCCN1c2cc(ccc2F)O 271570a_203496583355_200010126270 [1,1,0,0,0,0|1,1,0]=4 951 B16R2.546 O=CCN1CCC(C1)c2ccccc2Cl 2230a_100015183920_200015260668 [0,0,1,1,0,0|2,0,0]=4 952 B16R2.546 O=CCN1CCC(C1)c2ccccc2Cl 269982a_100015183920_200015260668 [0,0,1,1,0,0|2,0,0]=4 953 B16R2.546 O=CCN1CCC(C1)c2ccccc2Cl 34a_100015183920_200009817547 [0,0,1,1,0,0|2,0,0]=4 954 B16R2.12486 CC(NC1CCC1=O)c2ccccc2Cl 34a_100000174978_100009892977 [0,0,1,1,0,0|2,0,0]=4 955 B16R2.12486 CC(OC1CCC1=O)c2ccccc2Cl 34a_100000740796_100009892977 [0,0,1,1,0,0|2,0,0]=4 956 B16R2.12486 CC(OC1CCC1=O)c2ccccc2Cl 7a_100000740796_100009892977 [0,0,1,1,0,0|2,0,0]=4 957 B16R2.12486 CC(SC1CCC1=O)c2ccccc2Cl 62a_100000181259_100009892977 [0,0,1,1,0,0|2,0,0]=4 958 B16R2.12486 CC(SC1CCC1=O)c2ccccc2Cl 62a_100009892977_100000181259 [0,0,1,1,0,0|2,0,0]=4 959 B16R2.22598 CN(c1ccccc1Cl)C2CCCC2=O 2230a_100000219374_100000211823 [0,0,1,1,0,0|2,0,0]=4 960 B16R2.22598 CN(c1ccccc1Cl)C2CCCC2=O 269982a_100000219374_100000211823 [0,0,1,1,0,0|2,0,0]=4 961 B16R2.22598 CN(c1ccccc1Cl)C2CCCC2=O 34a_100000219374_100000709159 [0,0,1,1,0,0|2,0,0]=4 962 B16R2.22598 O=C1CCCC1C(=O)c2ccccc2Cl 1458a_100000185844_100000211823 [0,0,1,1,0,0|1,0,1]=4 963 B16R2.37 CCCCC(=O)C1C=Cc2c1cccc2 1458a_200009832160_100000210211 [0,0,1,1,0,0|2,0,0]=4 964 B16R2.37 CCCCC(=O)C1CCc2c1cccc2 1458a_100000750891_100000210211 [0,0,1,1,0,0|2,0,0]=4 965 B16R2.12439 CC(C(=O)CC1CC1)c2ccccc2Br 1458a_100012359601_100000742324 [0,0,1,1,0,0|1,1,0]=4 966 B16R2.12439 CC(C(=O)CC1CC1)c2ccccc2Cl 1458a_100000738066_100000181259 [0,0,1,1,0,0|1,0,0]=3 967 B16R2.12439 CC(C(=O)CC1CC1)c2ccccc2Cl 1458a_100011667492_100000742324 [0,0,1,1,0,0|1,0,0]=3 968 B16R2.12439 CC(C(=O)CC1CC1)c2ccccc2F 1458a_100000738066_200000741388 [0,0,1,1,0,0|1,1,0]=4 969 B16R2.12439 CC(C(=O)CC1CO1)c2ccccc2Cl 1458a_100011667492_100011216344 [0,0,1,1,0,0|2,0,0]=4 970 B16R2.12439 CC(C(=O)CC1CS1)c2ccccc2Cl 1458a_100011667492_100000031435 [0,0,1,1,0,0|2,0,0]=4 971 B16R2.12439 CC(C(=O)C[C@@H]1CO1)c2ccccc2Cl 1458a_100011667492_100000745022 [0,0,1,1,0,0|2,0,0]=4 972 B16R2.12439 CC(C(=O)NC1CC1)c2ccccc2Cl 1626a_100000212008_100011667492 [0,0,1,1,0,0|2,0,0]=4 973 B16R2.12439 CC(C(=O)NC1CC1)c2ccccc2Cl 240690a_100000212008_100011667492 [0,0,1,1,0,0|2,0,0]=4 974 B16R2.12439 CC(C(=O)NC1CC1)c2ccccc2Cl 527a_100000212008_100011667492 [0,0,1,1,0,0|2,0,0]=4 975 B16R2.12439 CN(C(=O)CC1CC1)c2ccccc2Cl 11a_100000219374_100000738066 [0,0,1,1,0,0|2,0,0]=4 976 B16R2.12439 CN(C(=O)CC1CC1)c2ccccc2Cl 1626a_100000219374_100000738066 [0,0,1,1,0,0|2,0,0]=4 977 B16R2.12439 O=C(CC1CC1)C(O)c2ccccc2Br 1458a_200011356456_100000742324 [0,0,1,1,0,0|1,1,0]=4 978 B16R2.12439 O=C(CC1CC1)C(O)c2ccccc2Cl 1458a_100011217820_100000742324 [0,0,1,1,0,0|1,0,0]=3 979 B16R2.12439 O=C(CC1CC1)C(O)c2ccccc2F 1458a_100011219519_100000742324 [0,0,1,1,0,0|1,1,0]=4 980 B16R2.12439 O=C(CC1CO1)C(O)c2ccccc2Cl 1458a_100011217820_100011216344 [0,0,1,1,0,0|2,0,0]=4 981 B16R2.12439 O=C(CC1CS1)C(O)c2ccccc2Cl 1458a_100011217820_100000031435 [0,0,1,1,0,0|2,0,0]=4 982 B16R2.12439 O=C(C[C@@H]1CO1)C(O)c2ccccc2Cl 1458a_100011217820_100000745022 [0,0,1,1,0,0|2,0,0]=4 983 B16R2.12439 O=C(NC1CC1)C(O)c2ccccc2Cl 240690a_100000212008_100011217820 [0,0,1,1,0,0|2,0,0]=4 984 B16R2.12440 CC(C(=O)C1CC1C)c2ccccc2Cl 1458a_100000211227_100000181259 [0,0,1,1,0,0|1,0,0]=3 985 B16R2.12440 CC(C(=O)C1CC1C)c2ccccc2F 1458a_100000211227_200000741388 [0,0,1,1,0,0|1,1,0]=4 986 B16R2.12440 CC(C(=O)[C@@H]1C[C@@H]1F)c2ccccc2Cl 1458a_100015396687_100000181259 [0,0,1,1,0,0|2,0,0]=4 987 B16R2.12440 CC1CC1C(=O)N(C)c2ccccc2Cl 11a_100000219374_100000211227 [0,0,1,1,0,0|2,0,0]=4 988 B16R2.12440 CC1CC1C(=O)N(C)c2ccccc2Cl 1626a_100000219374_100000211227 [0,0,1,1,0,0|2,0,0]=4 989 B16R2.83999 CC(C(=O)C1CCC1)c2ccccc2Br 1458a_100012359601_100000749161 [0,0,1,1,0,0|1,1,0]=4 990 B16R2.83999 CC(C(=O)C1CCC1)c2ccccc2Cl 1458a_100000209988_100000181259 [0,0,1,1,0,0|1,0,0]=3 991 B16R2.83999 CC(C(=O)C1CCC1)c2ccccc2Cl 1458a_100011667492_100000749161 [0,0,1,1,0,0|1,0,0]=3 992 B16R2.83999 CC(C(=O)C1CCC1)c2ccccc2F 1458a_100000209988_200000741388 [0,0,1,1,0,0|1,1,0]=4 993 B16R2.83999 CC(C(=O)C1CCO1)c2ccccc2Cl 1458a_100000089072_100000181259 [0,0,1,1,0,0|2,0,0]=4 994 B16R2.83999 CC(C(=O)C1COC1)c2ccccc2Cl 1458a_100000758290_100000181259 [0,0,1,1,0,0|2,0,0]=4 995 B16R2.83999 CC(C(=O)C1COC1)c2ccccc2Cl 1458a_100011667492_100000687716 [0,0,1,1,0,0|2,0,0]=4 996 B16R2.83999 CC(C(=O)N1CCC1)c2ccccc2Cl 11a_100000754969_100011667492 [0,0,1,1,0,0|2,0,0]=4 997 B16R2.83999 CC(C(=O)N1CCC1)c2ccccc2Cl 240690a_100000754969_100011667492 [0,0,1,1,0,0|2,0,0]=4 998 B16R2.83999 CC(C(=O)N1CCC1)c2ccccc2Cl 527a_100000754969_100011667492 [0,0,1,1,0,0|2,0,0]=4 999 B16R2.83999 CN(C(=O)C1CCC1)c2ccccc2Cl 11a_100000219374_100000209988 [0,0,1,1,0,0|2,0,0]=4 1000 B16R2.83999 CN(C(=O)C1CCC1)c2ccccc2Cl 1626a_100000219374_100000209988 [0,0,1,1,0,0|2,0,0]=4 1001 B16R2.83999 O=C(C(O)c1ccccc1Cl)N2CCC2 240690a_100000754969_100011217820 [0,0,1,1,0,0|2,0,0]=4 1002 B16R2.83999 O=C(C1CCC1)C(O)c2ccccc2Br 1458a_200011356456_100000749161 [0,0,1,1,0,0|1,1,0]=4 1003 B16R2.83999 O=C(C1CCC1)C(O)c2ccccc2Cl 1458a_100011217820_100000749161 [0,0,1,1,0,0|1,0,0]=3 1004 B16R2.83999 O=C(C1CCC1)C(O)c2ccccc2F 1458a_100011219519_100000749161 [0,0,1,1,0,0|1,1,0]=4 1005 B16R2.83999 O=C(C1COC1)C(O)c2ccccc2Cl 1458a_100011217820_100000687716 [0,0,1,1,0,0|2,0,0]=4 1006 B16R2.84013 CC(=O)C1(CCCC1)c2ccccc2F 1458a_100000212013_200000210301 [0,0,1,1,0,0|1,1,0]=4 1007 B16R2.84013 [13CH3]C(=O)C1(CCCC1)c2ccccc2F 1458a_100000212013_200025704644 [0,0,1,1,0,0|1,1,0]=4 1008 B16R2.29874 CCCC(=O)C1(CC1)c2ccccc2Br 1458a_100000707476_100000210303 [0,0,1,1,0,0|1,1,0]=4 1009 B16R2.29874 CCCC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000210303 [0,0,1,1,0,0|1,0,0]=3 1010 B16R2.29874 CCCC(=O)C1(CC1)c2ccccc2F 1458a_100000757711_100000210303 [0,0,1,1,0,0|1,1,0]=4 1011 B16R2.29874 CCNC(=O)C1(CC1)c2ccccc2Cl 11a_100015525214_100011549969 [0,0,1,1,0,0|2,0,0]=4 1012 B16R2.29874 CCNC(=O)C1(CC1)c2ccccc2Cl 240690a_100015525214_100011549969 [0,0,1,1,0,0|2,0,0]=4 1013 B16R2.29874 CCNC(=O)C1(CC1)c2ccccc2Cl 527a_100015525214_100011549969 [0,0,1,1,0,0|2,0,0]=4 1014 B16R2.29874 O=C(CCF)C1(CC1)c2ccccc2Cl 1458a_100011549969_100011217306 [0,0,1,1,0,0|2,0,0]=4 1015 B16R2.29874 O=C(CCO)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000211926 [0,0,1,1,0,0|2,0,0]=4 1016 B16R2.169004 CCC(=O)C1(CCC1)c2ccccc2Br 1458a_100011756641_100000210202 [0,0,1,1,0,0|1,1,0]=4 1017 B16R2.169004 CCC(=O)C1(CCC1)c2ccccc2Cl 1458a_100011549970_100000210202 [0,0,1,1,0,0|1,0,0]=3 1018 B16R2.169004 CCC(=O)C1(CCC1)c2ccccc2F 1458a_100011497512_100000210202 [0,0,1,1,0,0|1,1,0]=4 1019 B16R2.169004 CNC(=O)C1(CCC1)c2ccccc2Cl 11a_106832991635_100011549970 [0,0,1,1,0,0|2,0,0]=4 1020 B16R2.169004 CNC(=O)C1(CCC1)c2ccccc2Cl 240690a_100102657272_100011549970 [0,0,1,1,0,0|2,0,0]=4 1021 B16R2.169004 CNC(=O)C1(CCC1)c2ccccc2Cl 527a_100102657272_100011549970 [0,0,1,1,0,0|2,0,0]=4 1022 B16R2.169004 O=C(CF)C1(CCC1)c2ccccc2Cl 1458a_100011549970_100015361967 [0,0,1,1,0,0|2,0,0]=4 1023 B14R2.296 CN1CCCC1c2ccccc2Cl 2230a_100000742539_200000210301 [1,0,0,0,1,0|2,0,0]=4 1024 B14R2.296 CN1CCCC1c2ccccc2Cl 269982a_100000742539_200000210301 [1,0,0,0,1,0|2,0,0]=4 1025 B14R2.296 CN1CCCC1c2ccccc2Cl 34a_100000742539_200000210301 [1,0,0,0,1,0|2,0,0]=4 1026 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 2230a_100000742539_200025704644 [1,0,0,0,1,0|2,0,0]=4 1027 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 269982a_100000742539_200025704644 [1,0,0,0,1,0|2,0,0]=4 1028 B14R2.296 [13CH3]N1CCCC1c2ccccc2Cl 34a_100000742539_200025704644 [1,0,0,0,1,0|2,0,0]=4 1029 B16R1.4621 C=CCCOCC(N)Cc1ccccc1Cl 34a_100012001541_100000754431 [0,0,1,0,0,1|2,0,0]=4 1030 B16R1.4621 CN(CCCCC=O)Cc1ccccc1Cl 2230a_100000184507_100000139335 [0,0,1,0,0,1|2,0,0]=4 1031 B16R1.4621 CN(CCCCC=O)Cc1ccccc1Cl 269982a_100000184507_100000139335 [0,0,1,0,0,1|2,0,0]=4 1032 B16R1.7523 CC(Oc1ccccc1Cl)C(=O)CCCF 1458a_100000191201_100011934791 [0,0,1,0,0,1|2,0,0]=4 1033 B16R1.7523 CC(Oc1ccccc1Cl)C(=O)CCCO 1458a_100000191201_100011215043 [0,0,1,0,0,1|2,0,0]=4 1034 B16R1.7523 CC(Sc1ccccc1Cl)C(=O)CCCF 1458a_100000181065_100011934791 [0,0,1,0,0,1|2,0,0]=4 1035 B16R1.7523 CC(Sc1ccccc1Cl)C(=O)CCCO 1458a_100000181065_100011215043 [0,0,1,0,0,1|2,0,0]=4 1036 B16R1.7523 CCCCC(=O)C(=Cc1ccccc1Cl)C 1458a_100000693296_100000210211 [0,0,1,0,0,1|1,0,1]=4 1037 B16R1.7523 CCCCC(=O)C(C)Oc1ccccc1Br 1458a_100000246065_100000210211 [0,0,1,0,0,1|1,1,0]=4 1038 B16R1.7523 CCCCC(=O)C(C)Oc1ccccc1C 1458a_100000189243_100000210211 [0,0,1,0,0,1|2,0,0]=4 1039 B16R1.7523 CCCCC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_100000210211 [0,0,1,0,0,1|1,0,0]=3 1040 B16R1.7523 CCCCC(=O)C(C)Oc1ccccc1F 1458a_100000191191_100000210211 [0,0,1,0,0,1|1,1,0]=4 1041 B16R1.7523 CCCCC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_100000210211 [0,0,1,0,0,1|1,0,0]=3 1042 B16R1.7523 CCCCC(=O)C(O)Cc1ccccc1Br 1458a_100012382637_100000210211 [0,0,1,0,0,1|1,1,0]=4 1043 B16R1.7523 CCCCC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_100000210211 [0,0,1,0,0,1|1,0,0]=3 1044 B16R1.7523 CCCCC(=O)N(C)Cc1ccccc1Cl 11a_100000184507_100000210183 [0,0,1,0,0,1|2,0,0]=4 1045 B16R1.7523 CCCCC(=O)N(C)Cc1ccccc1Cl 1626a_100000184507_100000210183 [0,0,1,0,0,1|2,0,0]=4 1046 B16R1.7523 CCCCC(=O)N(C)Cc1ccccc1Cl 240690a_100000184507_100000210183 [0,0,1,0,0,1|2,0,0]=4 1047 B16R1.7523 CCCCC(=O)N(C)Cc1ccccc1Cl 527a_100000184507_100000210183 [0,0,1,0,0,1|2,0,0]=4 1048 B16R1.7523 CCCNC(=O)C(C)Nc1ccccc1Cl 34a_100000185783_100000230305 [0,0,1,0,0,1|2,0,0]=4 1049 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 11a_100020643023_100000191201 [0,0,1,0,0,1|2,0,0]=4 1050 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 1626a_100020643023_100000191201 [0,0,1,0,0,1|2,0,0]=4 1051 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 240690a_100020643023_100000191201 [0,0,1,0,0,1|2,0,0]=4 1052 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 34a_100000210172_100000230305 [0,0,1,0,0,1|2,0,0]=4 1053 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 527a_100020643023_100000191201 [0,0,1,0,0,1|2,0,0]=4 1054 B16R1.7523 CCCNC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000230305 [0,0,1,0,0,1|2,0,0]=4 1055 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 11a_100020643023_100000181065 [0,0,1,0,0,1|2,0,0]=4 1056 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 1626a_100020643023_100000181065 [0,0,1,0,0,1|2,0,0]=4 1057 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 240690a_100020643023_100000181065 [0,0,1,0,0,1|2,0,0]=4 1058 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 527a_100020643023_100000181065 [0,0,1,0,0,1|2,0,0]=4 1059 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 62a_100000230305_100000764095 [0,0,1,0,0,1|2,0,0]=4 1060 B16R1.7523 CCCNC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000230305 [0,0,1,0,0,1|2,0,0]=4 1061 B16R1.7523 CCCNC(=O)C(O)Cc1ccccc1Cl 240690a_100020643023_100000703902 [0,0,1,0,0,1|2,0,0]=4 1062 B16R1.7523 CCCNC(=O)C(O)Cc1ccccc1Cl 527a_100020643023_100000703902 [0,0,1,0,0,1|2,0,0]=4 1063 B16R1.7523 CCCOC(=O)C(C)Nc1ccccc1Cl 34a_100000185783_100000760410 [0,0,1,0,0,1|2,0,0]=4 1064 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Cl 34a_100000210172_100000760410 [0,0,1,0,0,1|2,0,0]=4 1065 B16R1.7523 CCCOC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000760410 [0,0,1,0,0,1|2,0,0]=4 1066 B16R1.7523 CCCOC(=O)C(C)Sc1ccccc1Cl 62a_100000760410_100000764095 [0,0,1,0,0,1|2,0,0]=4 1067 B16R1.7523 CCCOC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000760410 [0,0,1,0,0,1|2,0,0]=4 1068 B16R1.7523 COCCC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_100000233755 [0,0,1,0,0,1|2,0,0]=4 1069 B16R1.7523 COCCC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_100000233755 [0,0,1,0,0,1|2,0,0]=4 1070 B16R1.7523 COCCC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_100000233755 [0,0,1,0,0,1|2,0,0]=4 1071 B16R1.7523 CSCCC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_100000751147 [0,0,1,0,0,1|2,0,0]=4 1072 B16R1.7523 CSCCC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_100000751147 [0,0,1,0,0,1|2,0,0]=4 1073 B16R1.7523 CSCCC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_100000751147 [0,0,1,0,0,1|2,0,0]=4 1074 B16R1.7523 O=C(CCCF)C(O)Cc1ccccc1Cl 1458a_100000703902_100011934791 [0,0,1,0,0,1|2,0,0]=4 1075 B16R1.7523 O=C(CCCO)C(O)Cc1ccccc1Cl 1458a_100000703902_100011215043 [0,0,1,0,0,1|2,0,0]=4 1076 B16R1.13848 CC(C)(Oc1ccccc1Cl)C(=O)CCF 1458a_100015197561_100011217306 [0,0,1,0,0,1|2,0,0]=4 1077 B16R1.13848 CC(C)(Oc1ccccc1Cl)C(=O)CCO 1458a_100015197561_100000211926 [0,0,1,0,0,1|2,0,0]=4 1078 B16R1.13848 CCCC(=O)C(C)(C)Cc1ccccc1F 1458a_200011736048_100000210303 [0,0,1,0,0,1|1,1,0]=4 1079 B16R1.13848 CCCC(=O)C(C)(C)Oc1ccccc1C 1458a_200015182929_100000210303 [0,0,1,0,0,1|2,0,0]=4 1080 B16R1.13848 CCCC(=O)C(C)(C)Oc1ccccc1Cl 1458a_100015197561_100000210303 [0,0,1,0,0,1|1,0,0]=3 1081 B16R1.13848 CCNC(=O)C(C)(C)Oc1ccccc1Cl 11a_100015525214_100015197561 [0,0,1,0,0,1|2,0,0]=4 1082 B16R1.13848 CCNC(=O)C(C)(C)Oc1ccccc1Cl 240690a_100015525214_100015197561 [0,0,1,0,0,1|2,0,0]=4 1083 B16R1.13848 CCNC(=O)C(C)(C)Oc1ccccc1Cl 527a_100015525214_100015197561 [0,0,1,0,0,1|2,0,0]=4 1084 B16R1.13848 CCOC(=O)C(C)(C)Oc1ccccc1Cl 7a_100000210172_100011216345 [0,0,1,0,0,1|2,0,0]=4 1085 B16R1.13848 CCOC(=O)C(C)(C)Sc1ccccc1Cl 62a_100000764095_100011216345 [0,0,1,0,0,1|2,0,0]=4 1086 B16R1.13848 CCOC(=O)C(C)(C)Sc1ccccc1Cl 62a_100011216345_100000764095 [0,0,1,0,0,1|2,0,0]=4 1087 B16R1.15350 CC(C)(NC(=O)CCO)c1ccccc1Cl 240690a_100020606166_100011216618 [0,0,1,0,0,1|2,0,0]=4 1088 B16R1.15350 CCCC(=O)CC(C)(C)c1ccccc1F 1458a_200012180094_100000210303 [0,0,1,0,0,1|1,1,0]=4 1089 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Br 11a_100020606264_100000211992 [0,0,1,0,0,1|1,1,0]=4 1090 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Br 1626a_100020606264_100000211992 [0,0,1,0,0,1|1,1,0]=4 1091 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Br 240690a_100020606264_100000211992 [0,0,1,0,0,1|1,1,0]=4 1092 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Br 527a_100020606264_100000211992 [0,0,1,0,0,1|1,1,0]=4 1093 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Cl 11a_100020606166_100000211992 [0,0,1,0,0,1|1,0,0]=3 1094 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Cl 1626a_100020606166_100000211992 [0,0,1,0,0,1|1,0,0]=3 1095 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Cl 240690a_100020606166_100000211992 [0,0,1,0,0,1|1,0,0]=3 1096 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1Cl 527a_100020606166_100000211992 [0,0,1,0,0,1|1,0,0]=3 1097 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1F 11a_100000734538_100000211992 [0,0,1,0,0,1|1,1,0]=4 1098 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1F 1626a_100000734538_100000211992 [0,0,1,0,0,1|1,1,0]=4 1099 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1F 240690a_100000734538_100000211992 [0,0,1,0,0,1|1,1,0]=4 1100 B16R1.15350 CCCC(=O)NC(C)(C)c1ccccc1F 527a_100000734538_100000211992 [0,0,1,0,0,1|1,1,0]=4 1101 B16R1.15350 CCNC(=O)NC(C)(C)c1ccccc1Cl 2708a_100015525214_100020606166 [0,0,1,0,0,1|2,0,0]=4 1102 B16R1.15350 CCNC(=O)NC(C)(C)c1ccccc1Cl 273464a_100015525214_100020606166 [0,0,1,0,0,1|2,0,0]=4 1103 B16R1.15350 CCNC(=O)NC(C)(C)c1ccccc1Cl 273464a_100020606166_100015525214 [0,0,1,0,0,1|2,0,0]=4 1104 B16R1.15350 CCNC(=O)NC(C)(C)c1ccccc1Cl 512a_100020606166_100015525214 [0,0,1,0,0,1|2,0,0]=4 1105 B16R1.15350 COCC(=O)NC(C)(C)c1ccccc1Cl 11a_100020606166_100000210968 [0,0,1,0,0,1|2,0,0]=4 1106 B16R1.15350 COCC(=O)NC(C)(C)c1ccccc1Cl 1626a_100020606166_100000210968 [0,0,1,0,0,1|2,0,0]=4 1107 B16R1.15350 COCC(=O)NC(C)(C)c1ccccc1Cl 240690a_100020606166_100000210968 [0,0,1,0,0,1|2,0,0]=4 1108 B16R1.15350 COCC(=O)NC(C)(C)c1ccccc1Cl 527a_100020606166_100000210968 [0,0,1,0,0,1|2,0,0]=4 1109 B16R1.15350 CSCC(=O)NC(C)(C)c1ccccc1Cl 11a_100020606166_100000184570 [0,0,1,0,0,1|2,0,0]=4 1110 B16R1.15350 CSCC(=O)NC(C)(C)c1ccccc1Cl 1626a_100020606166_100000184570 [0,0,1,0,0,1|2,0,0]=4 1111 B16R1.15350 CSCC(=O)NC(C)(C)c1ccccc1Cl 240690a_100020606166_100000184570 [0,0,1,0,0,1|2,0,0]=4 1112 B16R1.15350 CSCC(=O)NC(C)(C)c1ccccc1Cl 527a_100020606166_100000184570 [0,0,1,0,0,1|2,0,0]=4 1113 B16R2.4062 C[n+]1ccccc1SC2CCCCC2=O 62a_100000204591_100000212160 [1,0,0,0,0,1|2,0,0]=4 1114 B16R2.4062 Cc1ccccc1NC2CCCCC2=O 34a_100015192222_100000754470 [1,0,0,0,0,1|1,0,0]=3 1115 B16R2.4062 Cc1ccccc1NC2CCCNC2=O 34a_100015192222_100000687798 [1,0,0,0,0,1|2,0,0]=4 1116 B16R2.4062 Cc1ccccc1NC2COCCC2=O 34a_100015192222_100012180262 [1,0,0,0,0,1|2,0,0]=4 1117 B16R2.4062 Cc1ccccc1OC2CCCCC2=O 34a_100000210338_100000754470 [1,0,0,0,0,1|1,0,0]=3 1118 B16R2.4062 Cc1ccccc1OC2CCCCC2=O 7a_100000210338_100000204591 [1,0,0,0,0,1|1,0,0]=3 1119 B16R2.4062 Cc1ccccc1OC2CCCNC2=O 34a_100000210338_100000687798 [1,0,0,0,0,1|2,0,0]=4 1120 B16R2.4062 Cc1ccccc1OC2CCCNC2=O 7a_100000210338_100000687798 [1,0,0,0,0,1|2,0,0]=4 1121 B16R2.4062 Cc1ccccc1OC2COCCC2=O 34a_100000210338_100012180262 [1,0,0,0,0,1|2,0,0]=4 1122 B16R2.4062 Cc1ccccc1OC2COCCC2=O 7a_100000210338_100012180262 [1,0,0,0,0,1|2,0,0]=4 1123 B16R2.4062 Cc1ccccc1SC2CCCCC2=O 62a_100000204591_100000210755 [1,0,0,0,0,1|1,0,0]=3 1124 B16R2.4062 Cc1ccccc1SC2CCCCC2=O 62a_100000210755_100000204591 [1,0,0,0,0,1|1,0,0]=3 1125 B16R2.4062 Cc1ccccc1SC2CCCNC2=O 62a_100000210755_100000687798 [1,0,0,0,0,1|2,0,0]=4 1126 B16R2.4062 Cc1ccccc1SC2CCCNC2=O 62a_100000687798_100000210755 [1,0,0,0,0,1|2,0,0]=4 1127 B16R2.4062 Cc1ccccc1SC2COCCC2=O 62a_100000210755_100012180262 [1,0,0,0,0,1|2,0,0]=4 1128 B16R2.4062 Cc1ccccc1SC2COCCC2=O 62a_100012180262_100000210755 [1,0,0,0,0,1|2,0,0]=4 1129 B16R2.4062 Cc1cccnc1SC2CCCCC2=O 62a_100000204591_100000751373 [1,0,0,0,0,1|2,0,0]=4 1130 B16R2.4062 Cc1cccnc1SC2CCCCC2=O 62a_100000751373_100000204591 [1,0,0,0,0,1|2,0,0]=4 1131 B16R2.4062 Cc1ccncc1OC2CCCCC2=O 34a_100011997053_100000754470 [1,0,0,0,0,1|2,0,0]=4 1132 B16R2.4062 Cc1ccncc1OC2CCCCC2=O 7a_100011997053_100000204591 [1,0,0,0,0,1|2,0,0]=4 1133 B16R2.4062 Cc1ccncc1SC2CCCCC2=O 62a_100000204591_100000761580 [1,0,0,0,0,1|2,0,0]=4 1134 B16R2.4062 Cc1ccncc1SC2CCCCC2=O 62a_100000761580_100000204591 [1,0,0,0,0,1|2,0,0]=4 1135 B16R2.4062 Cc1cnccc1OC2CCCCC2=O 34a_100000694293_100000754470 [1,0,0,0,0,1|2,0,0]=4 1136 B16R2.4062 Cc1cnccc1SC2CCCCC2=O 62a_100000204591_100000765111 [1,0,0,0,0,1|2,0,0]=4 1137 B16R2.4062 Cc1cnccc1SC2CCCCC2=O 62a_100000765111_100000204591 [1,0,0,0,0,1|2,0,0]=4 1138 B16R2.4062 Cc1ncccc1OC2CCCCC2=O 34a_100000745507_100000754470 [1,0,0,0,0,1|2,0,0]=4 1139 B16R2.4062 Cc1ncccc1OC2CCCCC2=O 7a_100000745507_100000204591 [1,0,0,0,0,1|2,0,0]=4 1140 B16R2.4062 Cc1ncccc1SC2CCCCC2=O 62a_100000204591_100000751574 [1,0,0,0,0,1|2,0,0]=4 1141 B16R2.4062 Cc1ncccc1SC2CCCCC2=O 62a_100000751574_100000204591 [1,0,0,0,0,1|2,0,0]=4 1142 B16R2.4062 FC1CCCCC1Nc2ccccc2Cl 34a_100000185783_100015423560 [1,0,0,0,0,1|1,0,1]=4 1143 B16R2.4062 FC1CCCCC1Oc2ccccc2Cl 34a_100000210172_100015423560 [1,0,0,0,0,1|1,0,1]=4 1144 B16R2.4062 FC1CCCCC1Sc2ccccc2Cl 62a_100000764095_100015423560 [1,0,0,0,0,1|1,0,1]=4 1145 B16R2.4062 FC1CCCCC1Sc2ccccc2Cl 62a_100015423560_100000764095 [1,0,0,0,0,1|1,0,1]=4 1146 B16R2.4062 Nc1ccccc1OC2CCCCC2=O 34a_100000185747_100000754470 [1,0,0,0,0,1|1,0,0]=3 1147 B16R2.4062 Nc1ccccc1OC2CCCCC2=O 7a_100000185747_100000204591 [1,0,0,0,0,1|1,0,0]=3 1148 B16R2.4062 Nc1ccccc1OC2CCCNC2=O 34a_100000185747_100000687798 [1,0,0,0,0,1|2,0,0]=4 1149 B16R2.4062 Nc1ccccc1OC2CCCNC2=O 7a_100000185747_100000687798 [1,0,0,0,0,1|2,0,0]=4 1150 B16R2.4062 Nc1ccccc1OC2COCCC2=O 34a_100000185747_100012180262 [1,0,0,0,0,1|2,0,0]=4 1151 B16R2.4062 Nc1ccccc1OC2COCCC2=O 7a_100000185747_100012180262 [1,0,0,0,0,1|2,0,0]=4 1152 B16R2.4062 Nc1ccccc1SC2CCCCC2=O 62a_100000204591_100000210017 [1,0,0,0,0,1|1,0,0]=3 1153 B16R2.4062 Nc1ccccc1SC2CCCCC2=O 62a_100000210017_100000204591 [1,0,0,0,0,1|1,0,0]=3 1154 B16R2.4062 Nc1ccccc1SC2CCCNC2=O 62a_100000210017_100000687798 [1,0,0,0,0,1|2,0,0]=4 1155 B16R2.4062 Nc1ccccc1SC2CCCNC2=O 62a_100000687798_100000210017 [1,0,0,0,0,1|2,0,0]=4 1156 B16R2.4062 Nc1ccccc1SC2COCCC2=O 62a_100000210017_100012180262 [1,0,0,0,0,1|2,0,0]=4 1157 B16R2.4062 Nc1ccccc1SC2COCCC2=O 62a_100012180262_100000210017 [1,0,0,0,0,1|2,0,0]=4 1158 B16R2.4062 Nc1cccnc1OC2CCCCC2=O 34a_100000746358_100000754470 [1,0,0,0,0,1|2,0,0]=4 1159 B16R2.4062 Nc1cccnc1SC2CCCCC2=O 62a_100000204591_100000688686 [1,0,0,0,0,1|2,0,0]=4 1160 B16R2.4062 Nc1cccnc1SC2CCCCC2=O 62a_100000688686_100000204591 [1,0,0,0,0,1|2,0,0]=4 1161 B16R2.4062 Nc1ccncc1OC2CCCCC2=O 34a_100000753702_100000754470 [1,0,0,0,0,1|2,0,0]=4 1162 B16R2.4062 Nc1ccncc1SC2CCCCC2=O 62a_100000047001_100000204591 [1,0,0,0,0,1|2,0,0]=4 1163 B16R2.4062 Nc1ccncc1SC2CCCCC2=O 62a_100000204591_100000047001 [1,0,0,0,0,1|2,0,0]=4 1164 B16R2.4062 Nc1cnccc1SC2CCCCC2=O 62a_100000204591_100000756074 [1,0,0,0,0,1|2,0,0]=4 1165 B16R2.4062 Nc1cnccc1SC2CCCCC2=O 62a_100000756074_100000204591 [1,0,0,0,0,1|2,0,0]=4 1166 B16R2.4062 Nc1ncccc1OC2CCCCC2=O 34a_100000211975_100000754470 [1,0,0,0,0,1|2,0,0]=4 1167 B16R2.4062 Nc1ncccc1OC2CCCCC2=O 7a_100000211975_100000204591 [1,0,0,0,0,1|2,0,0]=4 1168 B16R2.4062 Nc1ncccc1SC2CCCCC2=O 62a_100000045569_100000204591 [1,0,0,0,0,1|2,0,0]=4 1169 B16R2.4062 Nc1ncccc1SC2CCCCC2=O 62a_100000204591_100000045569 [1,0,0,0,0,1|2,0,0]=4 1170 B16R2.4062 O=C1CCCCC1Nc2ccccc2Br 34a_100000210017_100000754470 [1,0,0,0,0,1|0,1,0]=3 1171 B16R2.4062 O=C1CCCCC1Nc2ccccc2Cl 34a_100000185783_100000754470 [1,0,0,0,0,1|0,0,0]=2 1172 B16R2.4062 O=C1CCCCC1Nc2ccccc2F 34a_100000210422_100000754470 [1,0,0,0,0,1|0,1,0]=3 1173 B16R2.4062 O=C1CCCCC1Nc2ccccc2I 34a_100000210053_100000754470 [1,0,0,0,0,1|0,1,0]=3 1174 B16R2.4062 O=C1CCCCC1Nc2ccccc2O 34a_100000185747_100000754470 [1,0,0,0,0,1|1,0,0]=3 1175 B16R2.4062 O=C1CCCCC1Oc2cccc[n+]2[O-] 7a_100000211761_100000204591 [1,0,0,0,0,1|2,0,0]=4 1176 B16R2.4062 O=C1CCCCC1Oc2ccccc2Br 34a_100000181306_100000754470 [1,0,0,0,0,1|0,1,0]=3 1177 B16R2.4062 O=C1CCCCC1Oc2ccccc2Br 7a_100000181306_100000204591 [1,0,0,0,0,1|0,1,0]=3 1178 B16R2.4062 O=C1CCCCC1Oc2ccccc2Cl 34a_100000210172_100000754470 [1,0,0,0,0,1|0,0,0]=2 1179 B16R2.4062 O=C1CCCCC1Oc2ccccc2Cl 7a_100000210172_100000204591 [1,0,0,0,0,1|0,0,0]=2 1180 B16R2.4062 O=C1CCCCC1Oc2ccccc2F 34a_100000210171_100000754470 [1,0,0,0,0,1|0,1,0]=3 1181 B16R2.4062 O=C1CCCCC1Oc2ccccc2F 7a_100000210171_100000204591 [1,0,0,0,0,1|0,1,0]=3 1182 B16R2.4062 O=C1CCCCC1Oc2ccccc2I 34a_100000739446_100000754470 [1,0,0,0,0,1|0,1,0]=3 1183 B16R2.4062 O=C1CCCCC1Oc2ccccc2I 7a_100000739446_100000204591 [1,0,0,0,0,1|0,1,0]=3 1184 B16R2.4062 O=C1CCCCC1Oc2cccnc2Br 34a_100000744436_100000754470 [1,0,0,0,0,1|1,1,0]=4 1185 B16R2.4062 O=C1CCCCC1Oc2cccnc2Br 7a_100000744436_100000204591 [1,0,0,0,0,1|1,1,0]=4 1186 B16R2.4062 O=C1CCCCC1Oc2cccnc2Cl 34a_100000757616_100000754470 [1,0,0,0,0,1|1,0,0]=3 1187 B16R2.4062 O=C1CCCCC1Oc2cccnc2Cl 7a_100000757616_100000204591 [1,0,0,0,0,1|1,0,0]=3 1188 B16R2.4062 O=C1CCCCC1Oc2cccnc2F 34a_100000061740_100000754470 [1,0,0,0,0,1|1,1,0]=4 1189 B16R2.4062 O=C1CCCCC1Oc2cccnc2F 7a_100000061740_100000204591 [1,0,0,0,0,1|1,1,0]=4 1190 B16R2.4062 O=C1CCCCC1Oc2cccnc2I 34a_100000034122_100000754470 [1,0,0,0,0,1|1,1,0]=4 1191 B16R2.4062 O=C1CCCCC1Oc2cccnc2I 7a_100000034122_100000204591 [1,0,0,0,0,1|1,1,0]=4 1192 B16R2.4062 O=C1CCCCC1Oc2cccoc2=O 34a_100000077404_100000754470 [1,0,0,0,0,1|2,0,0]=4 1193 B16R2.4062 O=C1CCCCC1Oc2cccoc2=O 7a_100000077404_100000204591 [1,0,0,0,0,1|2,0,0]=4 1194 B16R2.4062 O=C1CCCCC1Oc2ccncc2Br 34a_100011996408_100000754470 [1,0,0,0,0,1|1,1,0]=4 1195 B16R2.4062 O=C1CCCCC1Oc2ccncc2Cl 34a_100011997054_100000754470 [1,0,0,0,0,1|1,0,0]=3 1196 B16R2.4062 O=C1CCCCC1Oc2ccncc2F 34a_200000081243_100000754470 [1,0,0,0,0,1|1,1,0]=4 1197 B16R2.4062 O=C1CCCCC1Oc2cnccc2Cl 34a_100011996695_100000754470 [1,0,0,0,0,1|1,0,0]=3 1198 B16R2.4062 O=C1CCCCC1Oc2cnccc2I 34a_100000050107_100000754470 [1,0,0,0,0,1|1,1,0]=4 1199 B16R2.4062 O=C1CCCCC1Oc2coccc2=O 34a_100000060831_100000754470 [1,0,0,0,0,1|2,0,0]=4 1200 B16R2.4062 O=C1CCCCC1Oc2ncccc2Cl 34a_100011290957_100000754470 [1,0,0,0,0,1|1,0,0]=3 1201 B16R2.4062 O=C1CCCCC1Oc2ncccc2F 34a_100011219419_100000754470 [1,0,0,0,0,1|1,1,0]=4 1202 B16R2.4062 O=C1CCCCC1Sc2c[nH]ccc2=O 62a_100000204591_100009998708 [1,0,0,0,0,1|2,0,0]=4 1203 B16R2.4062 O=C1CCCCC1Sc2c[nH]ccc2=O 62a_100009998708_100000204591 [1,0,0,0,0,1|2,0,0]=4 1204 B16R2.4062 O=C1CCCCC1Sc2c[nH]ccc2=S 62a_100000204591_200012280681 [1,0,0,0,0,1|2,0,0]=4 1205 B16R2.4062 O=C1CCCCC1Sc2c[nH]ccc2=S 62a_200012280681_100000204591 [1,0,0,0,0,1|2,0,0]=4 1206 B16R2.4062 O=C1CCCCC1Sc2cccc[n+]2[O-] 62a_100000204591_200000042595 [1,0,0,0,0,1|2,0,0]=4 1207 B16R2.4062 O=C1CCCCC1Sc2ccccc2Br 62a_100000204591_100000695589 [1,0,0,0,0,1|0,1,0]=3 1208 B16R2.4062 O=C1CCCCC1Sc2ccccc2Br 62a_100000695589_100000204591 [1,0,0,0,0,1|0,1,0]=3 1209 B16R2.4062 O=C1CCCCC1Sc2ccccc2Cl 62a_100000204591_100000764095 [1,0,0,0,0,1|0,0,0]=2 1210 B16R2.4062 O=C1CCCCC1Sc2ccccc2Cl 62a_100000764095_100000204591 [1,0,0,0,0,1|0,0,0]=2 1211 B16R2.4062 O=C1CCCCC1Sc2ccccc2F 62a_100000204591_100011215700 [1,0,0,0,0,1|0,1,0]=3 1212 B16R2.4062 O=C1CCCCC1Sc2ccccc2F 62a_100011215700_100000204591 [1,0,0,0,0,1|0,1,0]=3 1213 B16R2.4062 O=C1CCCCC1Sc2ccccc2O 62a_100000204591_100000739446 [1,0,0,0,0,1|1,0,0]=3 1214 B16R2.4062 O=C1CCCCC1Sc2ccccc2O 62a_100000739446_100000204591 [1,0,0,0,0,1|1,0,0]=3 1215 B16R2.4062 O=C1CCCCC1Sc2cccnc2Br 62a_100000204591_100010202626 [1,0,0,0,0,1|1,1,0]=4 1216 B16R2.4062 O=C1CCCCC1Sc2cccnc2Br 62a_100010202626_100000204591 [1,0,0,0,0,1|1,1,0]=4 1217 B16R2.4062 O=C1CCCCC1Sc2cccnc2Cl 62a_100000036424_100000204591 [1,0,0,0,0,1|1,0,0]=3 1218 B16R2.4062 O=C1CCCCC1Sc2cccnc2Cl 62a_100000204591_100000036424 [1,0,0,0,0,1|1,0,0]=3 1219 B16R2.4062 O=C1CCCCC1Sc2cccnc2F 62a_100000204591_100009816115 [1,0,0,0,0,1|1,1,0]=4 1220 B16R2.4062 O=C1CCCCC1Sc2cccnc2F 62a_100009816115_100000204591 [1,0,0,0,0,1|1,1,0]=4 1221 B16R2.4062 O=C1CCCCC1Sc2cccnc2O 62a_100000204591_100000760158 [1,0,0,0,0,1|2,0,0]=4 1222 B16R2.4062 O=C1CCCCC1Sc2cccnc2O 62a_100000760158_100000204591 [1,0,0,0,0,1|2,0,0]=4 1223 B16R2.4062 O=C1CCCCC1Sc2ccncc2Br 62a_100000204591_100000726257 [1,0,0,0,0,1|1,1,0]=4 1224 B16R2.4062 O=C1CCCCC1Sc2ccncc2Br 62a_100000726257_100000204591 [1,0,0,0,0,1|1,1,0]=4 1225 B16R2.4062 O=C1CCCCC1Sc2ccncc2Cl 62a_100000204591_100000708259 [1,0,0,0,0,1|1,0,0]=3 1226 B16R2.4062 O=C1CCCCC1Sc2ccncc2Cl 62a_100000708259_100000204591 [1,0,0,0,0,1|1,0,0]=3 1227 B16R2.4062 O=C1CCCCC1Sc2ccncc2F 62a_100000047030_100000204591 [1,0,0,0,0,1|1,1,0]=4 1228 B16R2.4062 O=C1CCCCC1Sc2ccncc2F 62a_100000204591_100000047030 [1,0,0,0,0,1|1,1,0]=4 1229 B16R2.4062 O=C1CCCCC1Sc2ccncc2O 62a_100000204591_100009817591 [1,0,0,0,0,1|2,0,0]=4 1230 B16R2.4062 O=C1CCCCC1Sc2ccncc2O 62a_100009817591_100000204591 [1,0,0,0,0,1|2,0,0]=4 1231 B16R2.4062 O=C1CCCCC1Sc2cnccc2Br 62a_100000204591_100010138639 [1,0,0,0,0,1|1,1,0]=4 1232 B16R2.4062 O=C1CCCCC1Sc2cnccc2Br 62a_100010138639_100000204591 [1,0,0,0,0,1|1,1,0]=4 1233 B16R2.4062 O=C1CCCCC1Sc2cnccc2Cl 62a_100000204591_100009995489 [1,0,0,0,0,1|1,0,0]=3 1234 B16R2.4062 O=C1CCCCC1Sc2cnccc2Cl 62a_100009995489_100000204591 [1,0,0,0,0,1|1,0,0]=3 1235 B16R2.4062 O=C1CCCCC1Sc2cnccc2F 62a_100000204591_100009820683 [1,0,0,0,0,1|1,1,0]=4 1236 B16R2.4062 O=C1CCCCC1Sc2cnccc2F 62a_100009820683_100000204591 [1,0,0,0,0,1|1,1,0]=4 1237 B16R2.4062 O=C1CCCCC1Sc2cncnc2Cl 62a_100000204591_100000758962 [1,0,0,0,0,1|2,0,0]=4 1238 B16R2.4062 O=C1CCCCC1Sc2cncnc2Cl 62a_100000758962_100000204591 [1,0,0,0,0,1|2,0,0]=4 1239 B16R2.4062 O=C1CCCCC1Sc2ncccc2Br 62a_100000204591_100000696092 [1,0,0,0,0,1|1,1,0]=4 1240 B16R2.4062 O=C1CCCCC1Sc2ncccc2Br 62a_100000696092_100000204591 [1,0,0,0,0,1|1,1,0]=4 1241 B16R2.4062 O=C1CCCCC1Sc2ncccc2Cl 62a_100000204591_100011356963 [1,0,0,0,0,1|1,0,0]=3 1242 B16R2.4062 O=C1CCCCC1Sc2ncccc2Cl 62a_100011356963_100000204591 [1,0,0,0,0,1|1,0,0]=3 1243 B16R2.4062 O=C1CCCCC1Sc2ncccc2F 62a_100000204591_100000685392 [1,0,0,0,0,1|1,1,0]=4 1244 B16R2.4062 O=C1CCCCC1Sc2ncccc2F 62a_100000685392_100000204591 [1,0,0,0,0,1|1,1,0]=4 1245 B16R2.4062 O=C1CCCCC1Sc2ncccc2O 62a_100000034122_100000204591 [1,0,0,0,0,1|2,0,0]=4 1246 B16R2.4062 O=C1CCCCC1Sc2ncccc2O 62a_100000204591_100000034122 [1,0,0,0,0,1|2,0,0]=4 1247 B16R2.4062 O=C1CCCCC1Sc2nccnc2Cl 62a_100000204591_100010886584 [1,0,0,0,0,1|2,0,0]=4 1248 B16R2.4062 O=C1CCCCC1Sc2nccnc2Cl 62a_100010886584_100000204591 [1,0,0,0,0,1|2,0,0]=4 1249 B16R2.4062 O=C1CCOCC1Nc2ccccc2Br 34a_100000210017_100012180262 [1,0,0,0,0,1|1,1,0]=4 1250 B16R2.4062 O=C1CCOCC1Nc2ccccc2Cl 34a_100000185783_100012180262 [1,0,0,0,0,1|1,0,0]=3 1251 B16R2.4062 O=C1CCOCC1Nc2ccccc2F 34a_100000210422_100012180262 [1,0,0,0,0,1|1,1,0]=4 1252 B16R2.4062 O=C1CCOCC1Nc2ccccc2I 34a_100000210053_100012180262 [1,0,0,0,0,1|1,1,0]=4 1253 B16R2.4062 O=C1CCOCC1Nc2ccccc2O 34a_100000185747_100012180262 [1,0,0,0,0,1|2,0,0]=4 1254 B16R2.4062 O=C1CCOCC1Oc2ccccc2Br 34a_100000181306_100012180262 [1,0,0,0,0,1|1,1,0]=4 1255 B16R2.4062 O=C1CCOCC1Oc2ccccc2Br 7a_100000181306_100012180262 [1,0,0,0,0,1|1,1,0]=4 1256 B16R2.4062 O=C1CCOCC1Oc2ccccc2Cl 34a_100000210172_100012180262 [1,0,0,0,0,1|1,0,0]=3 1257 B16R2.4062 O=C1CCOCC1Oc2ccccc2Cl 7a_100000210172_100012180262 [1,0,0,0,0,1|1,0,0]=3 1258 B16R2.4062 O=C1CCOCC1Oc2ccccc2F 34a_100000210171_100012180262 [1,0,0,0,0,1|1,1,0]=4 1259 B16R2.4062 O=C1CCOCC1Oc2ccccc2F 7a_100000210171_100012180262 [1,0,0,0,0,1|1,1,0]=4 1260 B16R2.4062 O=C1CCOCC1Oc2ccccc2I 34a_100000739446_100012180262 [1,0,0,0,0,1|1,1,0]=4 1261 B16R2.4062 O=C1CCOCC1Oc2ccccc2I 7a_100000739446_100012180262 [1,0,0,0,0,1|1,1,0]=4 1262 B16R2.4062 O=C1CCOCC1Oc2cccnc2Cl 34a_100000757616_100012180262 [1,0,0,0,0,1|2,0,0]=4 1263 B16R2.4062 O=C1CCOCC1Oc2cccnc2Cl 7a_100000757616_100012180262 [1,0,0,0,0,1|2,0,0]=4 1264 B16R2.4062 O=C1CCOCC1Oc2ccncc2Cl 34a_100011997054_100012180262 [1,0,0,0,0,1|2,0,0]=4 1265 B16R2.4062 O=C1CCOCC1Oc2cnccc2Cl 34a_100011996695_100012180262 [1,0,0,0,0,1|2,0,0]=4 1266 B16R2.4062 O=C1CCOCC1Oc2ncccc2Cl 34a_100011290957_100012180262 [1,0,0,0,0,1|2,0,0]=4 1267 B16R2.4062 O=C1CCOCC1Sc2ccccc2Br 62a_100000695589_100012180262 [1,0,0,0,0,1|1,1,0]=4 1268 B16R2.4062 O=C1CCOCC1Sc2ccccc2Br 62a_100012180262_100000695589 [1,0,0,0,0,1|1,1,0]=4 1269 B16R2.4062 O=C1CCOCC1Sc2ccccc2Cl 62a_100000764095_100012180262 [1,0,0,0,0,1|1,0,0]=3 1270 B16R2.4062 O=C1CCOCC1Sc2ccccc2Cl 62a_100012180262_100000764095 [1,0,0,0,0,1|1,0,0]=3 1271 B16R2.4062 O=C1CCOCC1Sc2ccccc2F 62a_100011215700_100012180262 [1,0,0,0,0,1|1,1,0]=4 1272 B16R2.4062 O=C1CCOCC1Sc2ccccc2F 62a_100012180262_100011215700 [1,0,0,0,0,1|1,1,0]=4 1273 B16R2.4062 O=C1CCOCC1Sc2ccccc2O 62a_100000739446_100012180262 [1,0,0,0,0,1|2,0,0]=4 1274 B16R2.4062 O=C1CCOCC1Sc2ccccc2O 62a_100012180262_100000739446 [1,0,0,0,0,1|2,0,0]=4 1275 B16R2.4062 O=C1CCOCC1Sc2cccnc2Cl 62a_100000036424_100012180262 [1,0,0,0,0,1|2,0,0]=4 1276 B16R2.4062 O=C1CCOCC1Sc2cccnc2Cl 62a_100012180262_100000036424 [1,0,0,0,0,1|2,0,0]=4 1277 B16R2.4062 O=C1CCOCC1Sc2ccncc2Cl 62a_100000708259_100012180262 [1,0,0,0,0,1|2,0,0]=4 1278 B16R2.4062 O=C1CCOCC1Sc2ccncc2Cl 62a_100012180262_100000708259 [1,0,0,0,0,1|2,0,0]=4 1279 B16R2.4062 O=C1CCOCC1Sc2cnccc2Cl 62a_100009995489_100012180262 [1,0,0,0,0,1|2,0,0]=4 1280 B16R2.4062 O=C1CCOCC1Sc2cnccc2Cl 62a_100012180262_100009995489 [1,0,0,0,0,1|2,0,0]=4 1281 B16R2.4062 O=C1CCOCC1Sc2ncccc2Cl 62a_100011356963_100012180262 [1,0,0,0,0,1|2,0,0]=4 1282 B16R2.4062 O=C1CCOCC1Sc2ncccc2Cl 62a_100012180262_100011356963 [1,0,0,0,0,1|2,0,0]=4 1283 B16R2.4062 O=C1NCCCC1Nc2ccccc2Br 34a_100000210017_100000687798 [1,0,0,0,0,1|1,1,0]=4 1284 B16R2.4062 O=C1NCCCC1Nc2ccccc2Cl 34a_100000185783_100000687798 [1,0,0,0,0,1|1,0,0]=3 1285 B16R2.4062 O=C1NCCCC1Nc2ccccc2F 34a_100000210422_100000687798 [1,0,0,0,0,1|1,1,0]=4 1286 B16R2.4062 O=C1NCCCC1Nc2ccccc2I 34a_100000210053_100000687798 [1,0,0,0,0,1|1,1,0]=4 1287 B16R2.4062 O=C1NCCCC1Nc2ccccc2O 34a_100000185747_100000687798 [1,0,0,0,0,1|2,0,0]=4 1288 B16R2.4062 O=C1NCCCC1Oc2ccccc2Br 34a_100000181306_100000687798 [1,0,0,0,0,1|1,1,0]=4 1289 B16R2.4062 O=C1NCCCC1Oc2ccccc2Br 7a_100000181306_100000687798 [1,0,0,0,0,1|1,1,0]=4 1290 B16R2.4062 O=C1NCCCC1Oc2ccccc2Cl 34a_100000210172_100000687798 [1,0,0,0,0,1|1,0,0]=3 1291 B16R2.4062 O=C1NCCCC1Oc2ccccc2Cl 7a_100000210172_100000687798 [1,0,0,0,0,1|1,0,0]=3 1292 B16R2.4062 O=C1NCCCC1Oc2ccccc2F 34a_100000210171_100000687798 [1,0,0,0,0,1|1,1,0]=4 1293 B16R2.4062 O=C1NCCCC1Oc2ccccc2F 7a_100000210171_100000687798 [1,0,0,0,0,1|1,1,0]=4 1294 B16R2.4062 O=C1NCCCC1Oc2ccccc2I 34a_100000739446_100000687798 [1,0,0,0,0,1|1,1,0]=4 1295 B16R2.4062 O=C1NCCCC1Oc2ccccc2I 7a_100000739446_100000687798 [1,0,0,0,0,1|1,1,0]=4 1296 B16R2.4062 O=C1NCCCC1Oc2cccnc2Cl 34a_100000757616_100000687798 [1,0,0,0,0,1|2,0,0]=4 1297 B16R2.4062 O=C1NCCCC1Oc2cccnc2Cl 7a_100000757616_100000687798 [1,0,0,0,0,1|2,0,0]=4 1298 B16R2.4062 O=C1NCCCC1Oc2ccncc2Cl 34a_100011997054_100000687798 [1,0,0,0,0,1|2,0,0]=4 1299 B16R2.4062 O=C1NCCCC1Oc2cnccc2Cl 34a_100011996695_100000687798 [1,0,0,0,0,1|2,0,0]=4 1300 B16R2.4062 O=C1NCCCC1Oc2ncccc2Cl 34a_100011290957_100000687798 [1,0,0,0,0,1|2,0,0]=4 1301 B16R2.4062 O=C1NCCCC1Sc2ccccc2Br 62a_100000687798_100000695589 [1,0,0,0,0,1|1,1,0]=4 1302 B16R2.4062 O=C1NCCCC1Sc2ccccc2Br 62a_100000695589_100000687798 [1,0,0,0,0,1|1,1,0]=4 1303 B16R2.4062 O=C1NCCCC1Sc2ccccc2Cl 62a_100000687798_100000764095 [1,0,0,0,0,1|1,0,0]=3 1304 B16R2.4062 O=C1NCCCC1Sc2ccccc2Cl 62a_100000764095_100000687798 [1,0,0,0,0,1|1,0,0]=3 1305 B16R2.4062 O=C1NCCCC1Sc2ccccc2F 62a_100000687798_100011215700 [1,0,0,0,0,1|1,1,0]=4 1306 B16R2.4062 O=C1NCCCC1Sc2ccccc2F 62a_100011215700_100000687798 [1,0,0,0,0,1|1,1,0]=4 1307 B16R2.4062 O=C1NCCCC1Sc2ccccc2O 62a_100000687798_100000739446 [1,0,0,0,0,1|2,0,0]=4 1308 B16R2.4062 O=C1NCCCC1Sc2ccccc2O 62a_100000739446_100000687798 [1,0,0,0,0,1|2,0,0]=4 1309 B16R2.4062 O=C1NCCCC1Sc2cccnc2Cl 62a_100000036424_100000687798 [1,0,0,0,0,1|2,0,0]=4 1310 B16R2.4062 O=C1NCCCC1Sc2cccnc2Cl 62a_100000687798_100000036424 [1,0,0,0,0,1|2,0,0]=4 1311 B16R2.4062 O=C1NCCCC1Sc2ccncc2Cl 62a_100000687798_100000708259 [1,0,0,0,0,1|2,0,0]=4 1312 B16R2.4062 O=C1NCCCC1Sc2ccncc2Cl 62a_100000708259_100000687798 [1,0,0,0,0,1|2,0,0]=4 1313 B16R2.4062 O=C1NCCCC1Sc2cnccc2Cl 62a_100000687798_100009995489 [1,0,0,0,0,1|2,0,0]=4 1314 B16R2.4062 O=C1NCCCC1Sc2cnccc2Cl 62a_100009995489_100000687798 [1,0,0,0,0,1|2,0,0]=4 1315 B16R2.4062 O=C1NCCCC1Sc2ncccc2Cl 62a_100000687798_100011356963 [1,0,0,0,0,1|2,0,0]=4 1316 B16R2.4062 O=C1NCCCC1Sc2ncccc2Cl 62a_100011356963_100000687798 [1,0,0,0,0,1|2,0,0]=4 1317 B16R2.4062 OC1CCCCC1Nc2ccccc2Cl 34a_100000185783_100000038908 [1,0,0,0,0,1|0,0,2]=4 1318 B16R2.4062 OC1CCCCC1Oc2ccccc2Cl 34a_100000210172_100000038908 [1,0,0,0,0,1|0,0,2]=4 1319 B16R2.4062 OC1CCCCC1Sc2ccccc2Cl 62a_100000038908_100000764095 [1,0,0,0,0,1|0,0,2]=4 1320 B16R2.4062 OC1CCCCC1Sc2ccccc2Cl 62a_100000764095_100000038908 [1,0,0,0,0,1|0,0,2]=4