0 B16R1.4679 C=CCCCNC(CC)c1ccccc1Cl 269862a_100000700776_100011400563 [0,0,1,0,0,0|3,0,0]=4 1 B16R1.4679 C=CCCCN[C@@H](CC)c1ccccc1Cl 2230a_200016987949_100011713584 [0,0,1,0,0,0|3,0,0]=4 2 B16R1.4679 C=CCCCN[C@@H](CC)c1ccccc1Cl 34a_200016987949_100000757094 [0,0,1,0,0,0|3,0,0]=4 3 B16R1.4679 CCC(OCCCC=O)c1ccccc1F 7a_200011689290_200011292268 [0,0,1,0,0,0|2,1,0]=4 4 B16R1.4679 CCN(CCCCC=O)c1ccccc1Br 2230a_114873767003_100000139335 [0,0,1,0,0,0|2,1,0]=4 5 B16R1.4679 CCN(CCCCC=O)c1ccccc1Br 269982a_114873767003_100000139335 [0,0,1,0,0,0|2,1,0]=4 6 B16R1.4679 CCN(CCCCC=O)c1ccccc1C 2230a_100000211084_100000139335 [0,0,1,0,0,0|3,0,0]=4 7 B16R1.4679 CCN(CCCCC=O)c1ccccc1C 269982a_100000211084_100000139335 [0,0,1,0,0,0|3,0,0]=4 8 B16R1.4679 CCN(CCCCC=O)c1ccccc1F 2230a_100000220365_100000139335 [0,0,1,0,0,0|2,1,0]=4 9 B16R1.4679 CCN(CCCCC=O)c1ccccc1F 269982a_100000220365_100000139335 [0,0,1,0,0,0|2,1,0]=4 10 B16R1.4679 CCN(CCCCC=O)c1ccccc1O 269982a_103624766699_100000139335 [0,0,1,0,0,0|3,0,0]=4 11 B16R1.4679 CC[C@H](NCCCC=O)c1ccccc1Cl 2230a_200016987949_200011292268 [0,0,1,0,0,0|2,0,0]=3 12 B16R1.4679 CC[C@H](NCCCC=O)c1ccccc1F 2230a_100015190424_200011292268 [0,0,1,0,0,0|2,1,0]=4 13 B16R1.4679 N#CC(OCCCC=O)c1ccccc1Cl 7a_200011294979_200011292268 [0,0,1,0,0,0|3,0,0]=4 14 B16R1.4679 O=CCCCNC(CO)c1ccccc1Cl 2230a_100138412506_200011292268 [0,0,1,0,0,0|3,0,0]=4 15 B16R1.20764 C#CCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000753159 [0,0,1,0,0,0|1,0,2]=4 16 B16R1.20764 C/C=C/CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100102629194 [0,0,1,0,0,0|1,0,2]=4 17 B16R1.20764 C=CCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000754431 [0,0,1,0,0,0|1,0,2]=4 18 B16R1.20764 CC#CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000748600 [0,0,1,0,0,0|1,0,2]=4 19 B16R1.20764 CC=CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000070051 [0,0,1,0,0,0|1,0,2]=4 20 B16R1.20764 CCC(C(=O)CCC#N)c1ccccc1Cl 1458a_100011667493_100011215226 [0,0,1,0,0,0|2,0,1]=4 21 B16R1.20764 CCC(C(=O)CCCF)c1ccccc1Cl 1458a_100011667493_100011934791 [0,0,1,0,0,0|2,0,0]=3 22 B16R1.20764 CCC(C(=O)CCCO)c1ccccc1Cl 1458a_100011667493_100011215043 [0,0,1,0,0,0|2,0,0]=3 23 B16R1.20764 CCC(C(=O)CCOC)c1ccccc1Cl 1458a_100011667493_100000233755 [0,0,1,0,0,0|2,0,0]=3 24 B16R1.20764 CCC(C(=O)CCSC)c1ccccc1Cl 1458a_100011667493_100000751147 [0,0,1,0,0,0|2,0,0]=3 25 B16R1.20764 CCC(C(=O)NCCF)c1ccccc1Cl 11a_100000724931_100011667493 [0,0,1,0,0,0|3,0,0]=4 26 B16R1.20764 CCC(C(=O)NCCF)c1ccccc1Cl 1626a_100000724931_100011667493 [0,0,1,0,0,0|3,0,0]=4 27 B16R1.20764 CCC(C(=O)NCCF)c1ccccc1Cl 240690a_100000724931_100011667493 [0,0,1,0,0,0|3,0,0]=4 28 B16R1.20764 CCC(C(=O)NCCF)c1ccccc1Cl 527a_100000724931_100011667493 [0,0,1,0,0,0|3,0,0]=4 29 B16R1.20764 CCC(C(=O)NCCO)c1ccccc1Cl 240690a_100000210304_100011667493 [0,0,1,0,0,0|3,0,0]=4 30 B16R1.20764 CCC(C(=O)NCCO)c1ccccc1Cl 527a_100000210304_100011667493 [0,0,1,0,0,0|3,0,0]=4 31 B16R1.20764 CCCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210211 [0,0,1,0,0,0|1,0,0]=2 32 B16R1.20764 CCCCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210211 [0,0,1,0,0,0|2,0,0]=3 33 B16R1.20764 CCCCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000210211 [0,0,1,0,0,0|1,1,0]=3 34 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1Br 11a_114873767003_100000210183 [0,0,1,0,0,0|2,1,0]=4 35 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1Br 1626a_114873767003_100000210183 [0,0,1,0,0,0|2,1,0]=4 36 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 11a_100000211084_100000210183 [0,0,1,0,0,0|3,0,0]=4 37 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 1626a_100000211084_100000210183 [0,0,1,0,0,0|3,0,0]=4 38 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1C 22a_100000211084_100000210183 [0,0,1,0,0,0|3,0,0]=4 39 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1F 11a_100000220365_100000210183 [0,0,1,0,0,0|2,1,0]=4 40 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1F 1626a_100000220365_100000210183 [0,0,1,0,0,0|2,1,0]=4 41 B16R1.20764 CCCCC(=O)N(CC)c1ccccc1O 22a_103624766699_100000210183 [0,0,1,0,0,0|3,0,0]=4 42 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 11a_100020643023_100011667493 [0,0,1,0,0,0|2,0,0]=3 43 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 1626a_100020643023_100011667493 [0,0,1,0,0,0|2,0,0]=3 44 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 240690a_100020643023_100011667493 [0,0,1,0,0,0|2,0,0]=3 45 B16R1.20764 CCCNC(=O)C(CC)c1ccccc1Cl 527a_100020643023_100011667493 [0,0,1,0,0,0|2,0,0]=3 46 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1C 11a_100020643023_100012277922 [0,0,1,0,0,0|3,0,0]=4 47 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1C 1626a_100020643023_100012277922 [0,0,1,0,0,0|3,0,0]=4 48 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1C 240690a_100020643023_100012277922 [0,0,1,0,0,0|3,0,0]=4 49 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1C 527a_100020643023_100012277922 [0,0,1,0,0,0|3,0,0]=4 50 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1F 11a_100020643023_100012277919 [0,0,1,0,0,0|2,1,0]=4 51 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1F 1626a_100020643023_100012277919 [0,0,1,0,0,0|2,1,0]=4 52 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1F 240690a_100020643023_100012277919 [0,0,1,0,0,0|2,1,0]=4 53 B16R1.20764 CCCNC(=O)C(OC)c1ccccc1F 527a_100020643023_100012277919 [0,0,1,0,0,0|2,1,0]=4 54 B16R1.20764 CCNNC(=O)C(CC)c1ccccc1Cl 22a_100000756455_100011667493 [0,0,1,0,0,0|3,0,0]=4 55 B16R1.20764 COC(C(=O)CCCF)c1ccccc1C 1458a_100012277922_100011934791 [0,0,1,0,0,0|3,0,0]=4 56 B16R1.20764 COC(C(=O)CCCF)c1ccccc1F 1458a_100012277919_100011934791 [0,0,1,0,0,0|2,1,0]=4 57 B16R1.20764 COC(C(=O)CCCO)c1ccccc1C 1458a_100012277922_100011215043 [0,0,1,0,0,0|3,0,0]=4 58 B16R1.20764 COC(C(=O)CCCO)c1ccccc1F 1458a_100012277919_100011215043 [0,0,1,0,0,0|2,1,0]=4 59 B16R1.20764 COC(C(=O)CCSC)c1ccccc1C 1458a_100012277922_100000751147 [0,0,1,0,0,0|3,0,0]=4 60 B16R1.20764 COC(C(=O)CCSC)c1ccccc1F 1458a_100012277919_100000751147 [0,0,1,0,0,0|2,1,0]=4 61 B16R1.20764 COCCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000233755 [0,0,1,0,0,0|3,0,0]=4 62 B16R1.20764 COCCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000233755 [0,0,1,0,0,0|2,1,0]=4 63 B15R1.33 CCC(NCCCC=O)c1ccccc1 2230a_100000737752_200011292268 [1,0,1,0,0,0|2,0,0]=4 64 B15R1.33 CCC(OCCCC=O)c1ccccc1 7a_100000698172_200011292268 [1,0,1,0,0,0|2,0,0]=4 65 B15R1.33 CCCCCCC(NC)c1ccccc1 269862a_106832991636_100011192799 [1,0,1,0,0,0|1,0,1]=4 66 B15R1.33 CCN(CCCCC=O)c1ccccc1 2230a_100000210013_100000139335 [1,0,1,0,0,0|2,0,0]=4 67 B15R1.33 CCN(CCCCC=O)c1ccccc1 269982a_100000210013_100000139335 [1,0,1,0,0,0|2,0,0]=4 68 B15R1.3402 CCCCNC(CC)c1ccccc1Cl 269862a_100000102301_100011400563 [1,0,1,0,0,0|2,0,0]=4 69 B15R1.3402 CCCCN[C@@H](CC)c1ccccc1Cl 2230a_200016987949_100000210211 [1,0,1,0,0,0|2,0,0]=4 70 B15R1.3402 CCCCN[C@@H](CC)c1ccccc1Cl 34a_200016987949_100000210210 [1,0,1,0,0,0|2,0,0]=4 71 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 2230a_100000219374_100011215482 [1,0,1,0,0,0|2,0,0]=4 72 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 269982a_100000219374_100011215482 [1,0,1,0,0,0|2,0,0]=4 73 B15R1.3965 C=CCCCCN(C)c1ccccc1Cl 34a_100000219374_100011215482 [1,0,1,0,0,0|2,0,0]=4 74 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 2230a_100000174978_100011713584 [1,0,1,0,0,0|2,0,0]=4 75 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 2230a_100000700776_100000181259 [1,0,1,0,0,0|2,0,0]=4 76 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 269862a_100000700776_100000210134 [1,0,1,0,0,0|2,0,0]=4 77 B15R1.3965 C=CCCCNC(C)c1ccccc1Cl 34a_100000174978_100000757094 [1,0,1,0,0,0|2,0,0]=4 78 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 34a_100000740796_100000757094 [1,0,1,0,0,0|2,0,0]=4 79 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 7a_100000740796_100000757094 [1,0,1,0,0,0|2,0,0]=4 80 B15R1.3965 C=CCCCOC(C)c1ccccc1Cl 7a_100000758997_100000181259 [1,0,1,0,0,0|2,0,0]=4 81 B15R1.3965 C=CCCCSC(C)c1ccccc1Cl 62a_100000181259_100000757094 [1,0,1,0,0,0|2,0,0]=4 82 B15R1.3965 C=CCCCSC(C)c1ccccc1Cl 62a_100011713584_100000181259 [1,0,1,0,0,0|2,0,0]=4 83 B15R1.3965 C=CCCOCC(N)c1ccccc1Cl 34a_100138412506_100000754431 [1,0,1,0,0,0|2,0,0]=4 84 B15R1.3965 C=CCOCCC(N)c1ccccc1Cl 34a_100011661560_100015514636 [1,0,1,0,0,0|2,0,0]=4 85 B15R1.3965 CC(NCCCC=O)c1ccccc1Br 2230a_100000181357_200011292268 [1,0,1,0,0,0|1,1,0]=4 86 B15R1.3965 CC(NCCCC=O)c1ccccc1Cl 2230a_100000174978_200011292268 [1,0,1,0,0,0|1,0,0]=3 87 B15R1.3965 CC(NCCCC=O)c1ccccc1F 2230a_100000181408_200011292268 [1,0,1,0,0,0|1,1,0]=4 88 B15R1.3965 CC(OCCCC=O)c1ccccc1Br 7a_100000702211_200011292268 [1,0,1,0,0,0|1,1,0]=4 89 B15R1.3965 CC(OCCCC=O)c1ccccc1Cl 7a_100000740796_200011292268 [1,0,1,0,0,0|1,0,0]=3 90 B15R1.3965 CC(OCCCC=O)c1ccccc1F 7a_100000697922_200011292268 [1,0,1,0,0,0|1,1,0]=4 91 B15R1.3965 CC(OCCCC=O)c1ccccc1N 7a_100011405641_200011292268 [1,0,1,0,0,0|2,0,0]=4 92 B15R1.3965 CC(OCCCC=O)c1cccnc1Cl 7a_100009865335_200011292268 [1,0,1,0,0,0|2,0,0]=4 93 B15R1.3965 CC(SCCCC=O)c1ccccc1Cl 62a_100000181259_200011292268 [1,0,1,0,0,0|1,0,0]=3 94 B15R1.3965 CC(SCCCC=O)c1ccccc1Cl 62a_200011292268_100000181259 [1,0,1,0,0,0|1,0,0]=3 95 B15R1.3965 CC(SCCCC=O)c1ccccc1F 62a_200000741388_200011292268 [1,0,1,0,0,0|1,1,0]=4 96 B15R1.3965 CC(SCCCC=O)c1ccccc1F 62a_200011292268_200000741388 [1,0,1,0,0,0|1,1,0]=4 97 B15R1.3965 CN(CCCCC=O)c1ccccc1Br 2230a_100020606079_100000139335 [1,0,1,0,0,0|1,1,0]=4 98 B15R1.3965 CN(CCCCC=O)c1ccccc1Br 269982a_100020606079_100000139335 [1,0,1,0,0,0|1,1,0]=4 99 B15R1.3965 CN(CCCCC=O)c1ccccc1Cl 2230a_100000219374_100000139335 [1,0,1,0,0,0|1,0,0]=3 100 B15R1.3965 CN(CCCCC=O)c1ccccc1Cl 269982a_100000219374_100000139335 [1,0,1,0,0,0|1,0,0]=3 101 B15R1.3965 CN(CCCCC=O)c1ccccc1F 2230a_100000220357_100000139335 [1,0,1,0,0,0|1,1,0]=4 102 B15R1.3965 CN(CCCCC=O)c1ccccc1F 269982a_100000220357_100000139335 [1,0,1,0,0,0|1,1,0]=4 103 B15R1.3965 CN(CCCCC=O)c1ccccc1O 269982a_100000033821_100000139335 [1,0,1,0,0,0|2,0,0]=4 104 B15R1.3965 C[C@@H](NCCCC=O)c1ccccc1O 2230a_100025703389_200011292268 [1,0,1,0,0,0|2,0,0]=4 105 B15R1.3965 Cc1ccccc1C(C)NCCCC=O 2230a_100000181355_200011292268 [1,0,1,0,0,0|2,0,0]=4 106 B15R1.3965 Cc1ccccc1C(C)OCCCC=O 7a_100000742021_200011292268 [1,0,1,0,0,0|2,0,0]=4 107 B15R1.3965 Cc1ccccc1N(C)CCCCC=O 2230a_100000219699_100000139335 [1,0,1,0,0,0|2,0,0]=4 108 B15R1.3965 Cc1ccccc1N(C)CCCCC=O 269982a_100000219699_100000139335 [1,0,1,0,0,0|2,0,0]=4 109 B15R1.3965 NC(CCOCC=O)c1ccccc1Cl 34a_100011661560_200009817547 [1,0,1,0,0,0|1,0,0]=3 110 B15R1.3965 NC(CCOCC=O)c1ccccc1F 34a_100011661569_200009817547 [1,0,1,0,0,0|1,1,0]=4 111 B15R1.1215 CCC(C(=O)CCCF)c1ccccc1 1458a_100000211302_100011934791 [1,0,1,0,0,0|2,0,0]=4 112 B15R1.1215 CCC(C(=O)CCCO)c1ccccc1 1458a_100000211302_100011215043 [1,0,1,0,0,0|2,0,0]=4 113 B15R1.1215 CCC(C(=O)CCOC)c1ccccc1 1458a_100000211302_100000233755 [1,0,1,0,0,0|2,0,0]=4 114 B15R1.1215 CCC(C(=O)CCSC)c1ccccc1 1458a_100000211302_100000751147 [1,0,1,0,0,0|2,0,0]=4 115 B15R1.1215 CCCCC(=O)C(CC)c1ccccc1 1458a_100000211302_100000210211 [1,0,1,0,0,0|1,0,0]=3 116 B15R1.1215 CCCCC(=O)C(CO)c1ccccc1 1458a_100011218805_100000210211 [1,0,1,0,0,0|2,0,0]=4 117 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 11a_100000210013_100000210183 [1,0,1,0,0,0|2,0,0]=4 118 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 1626a_100000210013_100000210183 [1,0,1,0,0,0|2,0,0]=4 119 B15R1.1215 CCCCC(=O)N(CC)c1ccccc1 22a_100000210013_100000210183 [1,0,1,0,0,0|2,0,0]=4 120 B15R1.1215 CCCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000210211 [1,0,1,0,0,0|1,0,0]=3 121 B15R1.1215 CCCNC(=O)C(CC)c1ccccc1 11a_100020643023_100000211302 [1,0,1,0,0,0|2,0,0]=4 122 B15R1.1215 CCCNC(=O)C(CC)c1ccccc1 1626a_100020643023_100000211302 [1,0,1,0,0,0|2,0,0]=4 123 B15R1.1215 CCCNC(=O)C(CC)c1ccccc1 240690a_100020643023_100000211302 [1,0,1,0,0,0|2,0,0]=4 124 B15R1.1215 CCCNC(=O)C(CC)c1ccccc1 527a_100020643023_100000211302 [1,0,1,0,0,0|2,0,0]=4 125 B15R1.1215 CCCNC(=O)[C@H](OC)c1ccccc1 11a_100020643023_100000698336 [1,0,1,0,0,0|2,0,0]=4 126 B15R1.1215 CCCNC(=O)[C@H](OC)c1ccccc1 1626a_100020643023_100000698336 [1,0,1,0,0,0|2,0,0]=4 127 B15R1.1215 CCCNC(=O)[C@H](OC)c1ccccc1 240690a_100020643023_100000698336 [1,0,1,0,0,0|2,0,0]=4 128 B15R1.1215 CCCNC(=O)[C@H](OC)c1ccccc1 527a_100020643023_100000698336 [1,0,1,0,0,0|2,0,0]=4 129 B15R1.1215 COCCC(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000233755 [1,0,1,0,0,0|2,0,0]=4 130 B15R1.1215 CO[C@@H](C(=O)CCCF)c1ccccc1 1458a_100000698336_100011934791 [1,0,1,0,0,0|2,0,0]=4 131 B15R1.1215 CO[C@@H](C(=O)CCCO)c1ccccc1 1458a_100000698336_100011215043 [1,0,1,0,0,0|2,0,0]=4 132 B15R1.1215 CO[C@@H](C(=O)CCSC)c1ccccc1 1458a_100000698336_100000751147 [1,0,1,0,0,0|2,0,0]=4 133 B15R1.5837 C#CCCC(=O)C(C)c1ccccc1Cl 1458a_100000692101_100000181259 [1,0,1,0,0,0|0,0,2]=4 134 B15R1.5837 C#CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000753159 [1,0,1,0,0,0|0,0,2]=4 135 B15R1.5837 C/C=C/CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100102629194 [1,0,1,0,0,0|0,0,2]=4 136 B15R1.5837 C=CCCC(=O)C(C)c1ccccc1Cl 1458a_100000749702_100000181259 [1,0,1,0,0,0|0,0,2]=4 137 B15R1.5837 C=CCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000754431 [1,0,1,0,0,0|0,0,2]=4 138 B15R1.5837 CC#CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000748600 [1,0,1,0,0,0|0,0,2]=4 139 B15R1.5837 CC(C(=O)CCC#N)c1ccccc1Cl 1458a_100011667492_100011215226 [1,0,1,0,0,0|1,0,1]=4 140 B15R1.5837 CC(C(=O)CCC#N)c1ccccc1Cl 1458a_100011934036_100000181259 [1,0,1,0,0,0|1,0,1]=4 141 B15R1.5837 CC(C(=O)CCCF)c1ccccc1Br 1458a_100012359601_100011934791 [1,0,1,0,0,0|1,1,0]=4 142 B15R1.5837 CC(C(=O)CCCF)c1ccccc1Cl 1458a_100011667492_100011934791 [1,0,1,0,0,0|1,0,0]=3 143 B15R1.5837 CC(C(=O)CCCO)c1ccccc1Br 1458a_100012359601_100011215043 [1,0,1,0,0,0|1,1,0]=4 144 B15R1.5837 CC(C(=O)CCCO)c1ccccc1Cl 1458a_100011667492_100011215043 [1,0,1,0,0,0|1,0,0]=3 145 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 11a_100000724931_100011667492 [1,0,1,0,0,0|2,0,0]=4 146 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 1626a_100000724931_100011667492 [1,0,1,0,0,0|2,0,0]=4 147 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 240690a_100000724931_100011667492 [1,0,1,0,0,0|2,0,0]=4 148 B15R1.5837 CC(C(=O)NCCF)c1ccccc1Cl 527a_100000724931_100011667492 [1,0,1,0,0,0|2,0,0]=4 149 B15R1.5837 CC(C(=O)NCCO)c1ccccc1Cl 240690a_100000210304_100011667492 [1,0,1,0,0,0|2,0,0]=4 150 B15R1.5837 CC(C(=O)NCCO)c1ccccc1Cl 527a_100000210304_100011667492 [1,0,1,0,0,0|2,0,0]=4 151 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000070051 [1,0,1,0,0,0|0,0,2]=4 152 B15R1.5837 CC=CCC(=O)C(C)c1ccccc1Cl 1458a_100121576822_100000181259 [1,0,1,0,0,0|0,0,2]=4 153 B15R1.5837 CCC#CC(=O)C(C)c1ccccc1Cl 1458a_100011827653_100000181259 [1,0,1,0,0,0|0,0,2]=4 154 B15R1.5837 CCC=CC(=O)C(C)c1ccccc1Cl 1458a_100000212282_100000181259 [1,0,1,0,0,0|0,0,2]=4 155 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000210211 [1,0,1,0,0,0|0,1,0]=3 156 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Cl 1458a_100000210183_100000181259 [1,0,1,0,0,0|0,0,0]=2 157 B15R1.5837 CCCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000210211 [1,0,1,0,0,0|0,0,0]=2 158 B15R1.5837 CCCCC(=O)C(C)c1ccccc1F 1458a_100000210183_200000741388 [1,0,1,0,0,0|0,1,0]=3 159 B15R1.5837 CCCCC(=O)C(O)c1ccccc1Br 1458a_200011356456_100000210211 [1,0,1,0,0,0|1,1,0]=4 160 B15R1.5837 CCCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000210211 [1,0,1,0,0,0|1,0,0]=3 161 B15R1.5837 CCCCC(=O)C(O)c1ccccc1F 1458a_100011219519_100000210211 [1,0,1,0,0,0|1,1,0]=4 162 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Br 11a_100020606079_100000210183 [1,0,1,0,0,0|1,1,0]=4 163 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Br 1626a_100020606079_100000210183 [1,0,1,0,0,0|1,1,0]=4 164 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 11a_100000219699_100000210183 [1,0,1,0,0,0|2,0,0]=4 165 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 1626a_100000219699_100000210183 [1,0,1,0,0,0|2,0,0]=4 166 B15R1.5837 CCCCC(=O)N(C)c1ccccc1C 22a_100000219699_100000210183 [1,0,1,0,0,0|2,0,0]=4 167 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000210183 [1,0,1,0,0,0|1,0,0]=3 168 B15R1.5837 CCCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000210183 [1,0,1,0,0,0|1,0,0]=3 169 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 11a_100000220357_100000210183 [1,0,1,0,0,0|1,1,0]=4 170 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 1626a_100000220357_100000210183 [1,0,1,0,0,0|1,1,0]=4 171 B15R1.5837 CCCCC(=O)N(C)c1ccccc1F 22a_100000220357_100000210183 [1,0,1,0,0,0|1,1,0]=4 172 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 22a_100000033821_100000210183 [1,0,1,0,0,0|2,0,0]=4 173 B15R1.5837 CCCCC(=O)N(C)c1ccccc1O 527a_100000033821_100000210183 [1,0,1,0,0,0|2,0,0]=4 174 B15R1.5837 CCCCN(C)C(C)c1ccccc1Cl 2230a_100000207549_100000181259 [1,0,1,0,0,0|2,0,0]=4 175 B15R1.5837 CCCCN(C)C(C)c1ccccc1Cl 269982a_100000207549_100000181259 [1,0,1,0,0,0|2,0,0]=4 176 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 11a_100020643023_100012359601 [1,0,1,0,0,0|1,1,0]=4 177 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 1626a_100020643023_100012359601 [1,0,1,0,0,0|1,1,0]=4 178 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 240690a_100020643023_100012359601 [1,0,1,0,0,0|1,1,0]=4 179 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Br 527a_100020643023_100012359601 [1,0,1,0,0,0|1,1,0]=4 180 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 11a_100020643023_100011667492 [1,0,1,0,0,0|1,0,0]=3 181 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 1626a_100020643023_100011667492 [1,0,1,0,0,0|1,0,0]=3 182 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 240690a_100020643023_100011667492 [1,0,1,0,0,0|1,0,0]=3 183 B15R1.5837 CCCNC(=O)C(C)c1ccccc1Cl 527a_100020643023_100011667492 [1,0,1,0,0,0|1,0,0]=3 184 B15R1.5837 CCCNC(=O)C(O)c1ccccc1Cl 240690a_100020643023_100011217820 [1,0,1,0,0,0|2,0,0]=4 185 B15R1.5837 CCCNC(=O)N(C)c1ccccc1Cl 512a_100020643023_100000219374 [1,0,1,0,0,0|2,0,0]=4 186 B15R1.5837 CCNNC(=O)C(C)c1ccccc1Cl 22a_100000756455_100011667492 [1,0,1,0,0,0|2,0,0]=4 187 B15R1.5837 CCOCC(=O)C(C)c1ccccc1Cl 1458a_100000211967_100000181259 [1,0,1,0,0,0|1,0,0]=3 188 B15R1.5837 CCOCC(=O)C(C)c1ccccc1F 1458a_100000211967_200000741388 [1,0,1,0,0,0|1,1,0]=4 189 B15R1.5837 CCOCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000211967 [1,0,1,0,0,0|2,0,0]=4 190 B15R1.5837 CCOCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000211967 [1,0,1,0,0,0|2,0,0]=4 191 B15R1.5837 CCSCC(=O)C(C)c1ccccc1Cl 1458a_100000230394_100000181259 [1,0,1,0,0,0|1,0,0]=3 192 B15R1.5837 CCSCC(=O)C(C)c1ccccc1F 1458a_100000230394_200000741388 [1,0,1,0,0,0|1,1,0]=4 193 B15R1.5837 CCSCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000230394 [1,0,1,0,0,0|2,0,0]=4 194 B15R1.5837 CCSCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000230394 [1,0,1,0,0,0|2,0,0]=4 195 B15R1.5837 COCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000233755 [1,0,1,0,0,0|1,1,0]=4 196 B15R1.5837 COCCC(=O)C(C)c1ccccc1Cl 1458a_100000749529_100000181259 [1,0,1,0,0,0|1,0,0]=3 197 B15R1.5837 COCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000233755 [1,0,1,0,0,0|1,0,0]=3 198 B15R1.5837 COCCC(=O)C(C)c1ccccc1F 1458a_100000749529_200000741388 [1,0,1,0,0,0|1,1,0]=4 199 B15R1.5837 COCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000233755 [1,0,1,0,0,0|2,0,0]=4 200 B15R1.5837 COCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000749529 [1,0,1,0,0,0|2,0,0]=4 201 B15R1.5837 COCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000749529 [1,0,1,0,0,0|2,0,0]=4 202 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Br 1458a_100012359601_100000751147 [1,0,1,0,0,0|1,1,0]=4 203 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Cl 1458a_100000174002_100000181259 [1,0,1,0,0,0|1,0,0]=3 204 B15R1.5837 CSCCC(=O)C(C)c1ccccc1Cl 1458a_100011667492_100000751147 [1,0,1,0,0,0|1,0,0]=3 205 B15R1.5837 CSCCC(=O)C(C)c1ccccc1F 1458a_100000174002_200000741388 [1,0,1,0,0,0|1,1,0]=4 206 B15R1.5837 CSCCC(=O)C(O)c1ccccc1Cl 1458a_100011217820_100000751147 [1,0,1,0,0,0|2,0,0]=4 207 B15R1.5837 CSCCC(=O)N(C)c1ccccc1Cl 11a_100000219374_100000174002 [1,0,1,0,0,0|2,0,0]=4 208 B15R1.5837 CSCCC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100000174002 [1,0,1,0,0,0|2,0,0]=4 209 B15R1.5837 O=C(CCCF)C(O)c1ccccc1Cl 1458a_100011217820_100011934791 [1,0,1,0,0,0|2,0,0]=4 210 B15R1.5837 O=C(CCCO)C(O)c1ccccc1Cl 1458a_100011217820_100011215043 [1,0,1,0,0,0|2,0,0]=4 211 B15R1.10394 CCC(C(=O)CCF)c1ccccc1Cl 1458a_100011667493_100011217306 [1,0,1,0,0,0|2,0,0]=4 212 B15R1.10394 CCC(C(=O)CCO)c1ccccc1Cl 1458a_100011667493_100000211926 [1,0,1,0,0,0|2,0,0]=4 213 B15R1.10394 CCCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000210303 [1,0,1,0,0,0|1,0,0]=3 214 B15R1.10394 CCCC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000210303 [1,0,1,0,0,0|2,0,0]=4 215 B15R1.10394 CCCC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000210303 [1,0,1,0,0,0|1,1,0]=4 216 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 11a_100015525214_100011667493 [1,0,1,0,0,0|2,0,0]=4 217 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 240690a_100015525214_100011667493 [1,0,1,0,0,0|2,0,0]=4 218 B15R1.10394 CCNC(=O)C(CC)c1ccccc1Cl 527a_100015525214_100011667493 [1,0,1,0,0,0|2,0,0]=4 219 B15R1.10394 CCOC(=O)C(NC)c1ccccc1Cl 2230a_106832991635_200011626503 [1,0,1,0,0,0|1,0,0]=3 220 B15R1.10394 CCOC(=O)C(NC)c1ccccc1Cl 34a_100102657272_200011626503 [1,0,1,0,0,0|1,0,0]=3 221 B15R1.10394 CCOC(=O)C(NC)c1ccccc1Cl 7a_106832991635_200011626503 [1,0,1,0,0,0|1,0,0]=3 222 B15R1.10394 CCOC(=O)C(OC)c1ccccc1Cl 34a_100138415774_200011626503 [1,0,1,0,0,0|2,0,0]=4 223 B15R1.10394 CCOC(=O)C(SC)c1ccccc1Cl 62a_200000210301_200011626503 [1,0,1,0,0,0|2,0,0]=4 224 B15R1.10394 CCOC(=O)C(SC)c1ccccc1Cl 62a_200011626503_200000210301 [1,0,1,0,0,0|2,0,0]=4 225 B15R1.10394 CCOC(=O)C(S[13CH3])c1ccccc1Cl 62a_200011626503_200025704644 [1,0,1,0,0,0|2,0,0]=4 226 B15R1.10394 CCOC(=O)C(S[13CH3])c1ccccc1Cl 62a_200025704644_200011626503 [1,0,1,0,0,0|2,0,0]=4 227 B15R1.4682 CCC(=O)C(CC)(CC)c1ccccc1 1458a_100000765338_100000210202 [1,0,1,0,0,0|1,0,0]=3 228 B15R1.4682 CCC(CC)(C(=O)CF)c1ccccc1 1458a_100000765338_100015361967 [1,0,1,0,0,0|2,0,0]=4 229 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 11a_106832991635_100000765338 [1,0,1,0,0,0|2,0,0]=4 230 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 240690a_100102657272_100000765338 [1,0,1,0,0,0|2,0,0]=4 231 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 527a_100102657272_100000765338 [1,0,1,0,0,0|2,0,0]=4 232 B15R1.9806 CC(C)(C(=O)CCF)c1ccccc1F 1458a_100000748980_100011217306 [1,0,1,0,0,0|1,1,0]=4 233 B15R1.9806 CC(C)(C(=O)CCF)c1cccnc1Cl 1458a_100011017506_100011217306 [1,0,1,0,0,0|2,0,0]=4 234 B15R1.9806 CC(C)(C(=O)CCO)c1ccccc1F 1458a_100000748980_100000211926 [1,0,1,0,0,0|1,1,0]=4 235 B15R1.9806 CC(C)(C(=O)CCO)c1cccnc1Cl 1458a_100011017506_100000211926 [1,0,1,0,0,0|2,0,0]=4 236 B15R1.9806 CCCC(=O)C(C)(C)c1ccccc1F 1458a_100000748980_100000210303 [1,0,1,0,0,0|0,1,0]=3 237 B15R1.9806 CCCC(=O)C(C)(C)c1cccnc1Cl 1458a_100011017506_100000210303 [1,0,1,0,0,0|1,0,0]=3 238 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 11a_100015525214_100000748980 [1,0,1,0,0,0|1,1,0]=4 239 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 240690a_100015525214_100000748980 [1,0,1,0,0,0|1,1,0]=4 240 B15R1.9806 CCNC(=O)C(C)(C)c1ccccc1F 527a_100015525214_100000748980 [1,0,1,0,0,0|1,1,0]=4 241 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 11a_100015525214_100011017506 [1,0,1,0,0,0|2,0,0]=4 242 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 240690a_100015525214_100011017506 [1,0,1,0,0,0|2,0,0]=4 243 B15R1.9806 CCNC(=O)C(C)(C)c1cccnc1Cl 527a_100015525214_100011017506 [1,0,1,0,0,0|2,0,0]=4 244 B15R1.9919 CCCC(=O)C(O)(CC)c1ccccc1 1458a_100011434905_100000210303 [1,0,1,0,0,0|2,0,0]=4 245 B15R2.4980 CNC1(CCOCC1)c2ccccc2 2230a_100000754981_200000210301 [2,0,0,0,0,0|1,0,1]=4 246 B15R2.4980 CNC1(CCOCC1)c2ccccc2 34a_100000754981_200000210301 [2,0,0,0,0,0|1,0,1]=4 247 B15R2.4980 COC1(CCCCC1)c2ccccc2 34a_100011219906_200000210301 [2,0,0,0,0,0|1,0,1]=4 248 B15R2.4980 COC1(CCCCC1)c2ccccc2 7a_100011219906_200000210301 [2,0,0,0,0,0|1,0,1]=4 249 B15R2.4980 [13CH3]NC1(CCOCC1)c2ccccc2 2230a_100000754981_200025704644 [2,0,0,0,0,0|1,0,1]=4 250 B15R2.4980 [13CH3]NC1(CCOCC1)c2ccccc2 34a_100000754981_200025704644 [2,0,0,0,0,0|1,0,1]=4 251 B15R2.4980 [13CH3]OC1(CCCCC1)c2ccccc2 34a_100011219906_200025704644 [2,0,0,0,0,0|1,0,1]=4 252 B15R2.4980 [13CH3]OC1(CCCCC1)c2ccccc2 7a_100011219906_200025704644 [2,0,0,0,0,0|1,0,1]=4 253 B15R2.555 CN1CCCCC1c2ccccc2Cl 2230a_100011804123_200000210301 [2,0,0,0,0,0|2,0,0]=4 254 B15R2.555 CN1CCCCC1c2ccccc2Cl 269982a_100011804123_200000210301 [2,0,0,0,0,0|2,0,0]=4 255 B15R2.555 CN1CCCCC1c2ccccc2Cl 34a_100011804123_200000210301 [2,0,0,0,0,0|2,0,0]=4 256 B15R2.555 O=C1CCCCN1c2ccccc2O 271570a_203496583355_200000217094 [2,0,0,0,0,0|2,0,0]=4 257 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 2230a_100011804123_200025704644 [2,0,0,0,0,0|2,0,0]=4 258 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 269982a_100011804123_200025704644 [2,0,0,0,0,0|2,0,0]=4 259 B15R2.555 [13CH3]N1CCCCC1c2ccccc2Cl 34a_100011804123_200025704644 [2,0,0,0,0,0|2,0,0]=4 260 B17R1.7826 C=CCCNCC(c1ccccc1Cl)N(C)C 2230a_100000185106_100000754431 [0,1,1,0,0,0|2,0,0]=4 261 B17R1.7826 CC(C)N(CCCCC=O)c1ccccc1Cl 269982a_100000219376_100000139335 [0,1,1,0,0,0|2,0,0]=4 262 B17R1.7826 CC(C)N(CCCCC=O)c1ccccc1Cl 7a_100000219376_100000139335 [0,1,1,0,0,0|2,0,0]=4 263 B17R1.16908 C=CCCCCNC(CC)c1ccccc1Cl 269862a_100000703577_100011400563 [0,1,1,0,0,0|2,0,0]=4 264 B17R1.16908 C=CCCCCN[C@@H](CC)c1ccccc1Cl 2230a_200016987949_100011215482 [0,1,1,0,0,0|2,0,0]=4 265 B17R1.16908 C=CCCCCN[C@@H](CC)c1ccccc1Cl 34a_200016987949_100011215482 [0,1,1,0,0,0|2,0,0]=4 266 B17R1.16908 CCC(OCCCCC=O)c1ccccc1F 7a_200011689290_100000139335 [0,1,1,0,0,0|1,1,0]=4 267 B17R1.16908 CC[C@H](NCCCCC=O)c1ccccc1Cl 2230a_200016987949_100000139335 [0,1,1,0,0,0|1,0,0]=3 268 B17R1.16908 CC[C@H](NCCCCC=O)c1ccccc1F 2230a_100015190424_100000139335 [0,1,1,0,0,0|1,1,0]=4 269 B17R1.16908 N#CC(OCCCCC=O)c1ccccc1Cl 7a_200011294979_100000139335 [0,1,1,0,0,0|2,0,0]=4 270 B17R1.16908 O=CCCCCNC(CO)c1ccccc1Cl 2230a_100138412506_100000139335 [0,1,1,0,0,0|2,0,0]=4 271 B17R1.41441 CCN(CCCCC=O)c1ccc(cc1Cl)Cl 269982a_100160557746_100000139335 [0,1,1,0,0,0|2,0,0]=4 272 B17R1.165447 O=CCCCNC(CCO)c1ccccc1Cl 2230a_100011661560_200011292268 [0,1,1,0,0,0|2,0,0]=4 273 B17R1.182322 CCC(NCCCC(=O)N)c1ccccc1Cl 269862a_100000739312_100011400563 [0,1,1,0,0,0|2,0,0]=4 274 B17R1.182322 CC[C@H](NCCCC(=O)C)c1ccccc1Cl 34a_200016987949_100000685027 [0,1,1,0,0,0|2,0,0]=4 275 B17R1.182322 CC[C@H](NCCCC(=O)N)c1ccccc1Cl 34a_200016987949_100102525003 [0,1,1,0,0,0|2,0,0]=4 276 B17R1.3109 C=C(C)CCC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000730704 [0,1,1,0,0,0|1,0,1]=4 277 B17R1.3109 CCC(C(=O)CCC(C)C)c1ccccc1Cl 1458a_100011667493_100000210312 [0,1,1,0,0,0|1,0,0]=3 278 B17R1.3109 CCC(C(=O)CCC(C)O)c1ccccc1Cl 1458a_100011667493_100012276601 [0,1,1,0,0,0|1,0,0]=3 279 B17R1.3109 CCC(C(=O)NCC(C)C)c1ccccc1Cl 11a_100000210953_100011667493 [0,1,1,0,0,0|2,0,0]=4 280 B17R1.3109 CCC(C(=O)NCC(C)C)c1ccccc1Cl 1626a_100000210953_100011667493 [0,1,1,0,0,0|2,0,0]=4 281 B17R1.3109 CCC(C(=O)NCC(C)C)c1ccccc1Cl 240690a_100000210953_100011667493 [0,1,1,0,0,0|2,0,0]=4 282 B17R1.3109 CCC(C(=O)NCC(C)C)c1ccccc1Cl 527a_100000210953_100011667493 [0,1,1,0,0,0|2,0,0]=4 283 B17R1.3109 CCC(C(=O)NCC(C)O)c1ccccc1Cl 11a_100000210904_100011667493 [0,1,1,0,0,0|2,0,0]=4 284 B17R1.3109 CCC(C(=O)NCC(C)O)c1ccccc1Cl 240690a_100000210904_100011667493 [0,1,1,0,0,0|2,0,0]=4 285 B17R1.3109 CCC(C(=O)NCC(C)O)c1ccccc1Cl 527a_100000210904_100011667493 [0,1,1,0,0,0|2,0,0]=4 286 B17R1.3109 COC(C(=O)CCC(C)C)c1ccccc1C 1458a_100012277922_100000210312 [0,1,1,0,0,0|2,0,0]=4 287 B17R1.3109 COC(C(=O)CCC(C)C)c1ccccc1F 1458a_100012277919_100000210312 [0,1,1,0,0,0|1,1,0]=4 288 B17R1.3109 COC(C(=O)CCC(C)O)c1ccccc1C 1458a_100012277922_100012276601 [0,1,1,0,0,0|2,0,0]=4 289 B17R1.3109 COC(C(=O)CCC(C)O)c1ccccc1F 1458a_100012277919_100012276601 [0,1,1,0,0,0|1,1,0]=4 290 B17R1.9784 C#CCCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000753159 [0,1,1,0,0,0|0,0,2]=4 291 B17R1.9784 C/C=C/CC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100102629194 [0,1,1,0,0,0|0,0,2]=4 292 B17R1.9784 C=CCCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000754431 [0,1,1,0,0,0|0,0,2]=4 293 B17R1.9784 CC#CCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000748600 [0,1,1,0,0,0|0,0,2]=4 294 B17R1.9784 CC=CCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000070051 [0,1,1,0,0,0|0,0,2]=4 295 B17R1.9784 CCCCC(=O)C(c1ccccc1C)C(C)C 1458a_200011667393_100000210211 [0,1,1,0,0,0|2,0,0]=4 296 B17R1.9784 CCCCC(=O)C(c1ccccc1C)N(C)C 1458a_200015186453_100000210211 [0,1,1,0,0,0|1,0,0]=3 297 B17R1.9784 CCCCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000210211 [0,1,1,0,0,0|0,0,0]=2 298 B17R1.9784 CCCCC(=O)C(c1ccccc1F)N(C)C 1458a_100011344403_100000210211 [0,1,1,0,0,0|0,1,0]=3 299 B17R1.9784 CCCCC(=O)N(c1ccccc1Cl)C(C)C 1626a_100000219376_100000210183 [0,1,1,0,0,0|2,0,0]=4 300 B17R1.9784 CCCNC(=O)C(c1ccccc1C)N(C)C 240690a_100020643023_200015186453 [0,1,1,0,0,0|2,0,0]=4 301 B17R1.9784 CCCNC(=O)C(c1ccccc1C)N(C)C 527a_100020643023_200015186453 [0,1,1,0,0,0|2,0,0]=4 302 B17R1.9784 CCCNC(=O)C(c1ccccc1Cl)N(C)C 240690a_100020643023_100000689846 [0,1,1,0,0,0|1,0,0]=3 303 B17R1.9784 CCCNC(=O)C(c1ccccc1Cl)N(C)C 527a_100020643023_100000689846 [0,1,1,0,0,0|1,0,0]=3 304 B17R1.9784 CCCNC(=O)C(c1ccccc1F)N(C)C 240690a_100020643023_100011344403 [0,1,1,0,0,0|1,1,0]=4 305 B17R1.9784 CCCNC(=O)C(c1ccccc1F)N(C)C 527a_100020643023_100011344403 [0,1,1,0,0,0|1,1,0]=4 306 B17R1.9784 CCNNC(=O)C(c1ccccc1Cl)N(C)C 22a_100000756455_100000689846 [0,1,1,0,0,0|2,0,0]=4 307 B17R1.9784 CN(C)C(C(=O)CCC#N)c1ccccc1Cl 1458a_100000689846_100011215226 [0,1,1,0,0,0|1,0,1]=4 308 B17R1.9784 CN(C)C(C(=O)CCCF)c1ccccc1Cl 1458a_100000689846_100011934791 [0,1,1,0,0,0|1,0,0]=3 309 B17R1.9784 CN(C)C(C(=O)CCCF)c1ccccc1F 1458a_100011344403_100011934791 [0,1,1,0,0,0|1,1,0]=4 310 B17R1.9784 CN(C)C(C(=O)CCCO)c1ccccc1Cl 1458a_100000689846_100011215043 [0,1,1,0,0,0|1,0,0]=3 311 B17R1.9784 CN(C)C(C(=O)CCCO)c1ccccc1F 1458a_100011344403_100011215043 [0,1,1,0,0,0|1,1,0]=4 312 B17R1.9784 CN(C)C(C(=O)NCCF)c1ccccc1Cl 240690a_100000724931_100000689846 [0,1,1,0,0,0|2,0,0]=4 313 B17R1.9784 CN(C)C(C(=O)NCCF)c1ccccc1Cl 527a_100000724931_100000689846 [0,1,1,0,0,0|2,0,0]=4 314 B17R1.9784 CN(C)C(C(=O)NCCO)c1ccccc1Cl 240690a_100000210304_100000689846 [0,1,1,0,0,0|2,0,0]=4 315 B17R1.9784 CN(C)C(C(=O)NCCO)c1ccccc1Cl 527a_100000210304_100000689846 [0,1,1,0,0,0|2,0,0]=4 316 B17R1.9784 COCCC(=O)C(c1ccccc1C)N(C)C 1458a_200015186453_100000233755 [0,1,1,0,0,0|2,0,0]=4 317 B17R1.9784 COCCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000233755 [0,1,1,0,0,0|1,0,0]=3 318 B17R1.9784 COCCC(=O)C(c1ccccc1F)N(C)C 1458a_100011344403_100000233755 [0,1,1,0,0,0|1,1,0]=4 319 B17R1.9784 CSCCC(=O)C(c1ccccc1C)N(C)C 1458a_200015186453_100000751147 [0,1,1,0,0,0|2,0,0]=4 320 B17R1.9784 CSCCC(=O)C(c1ccccc1Cl)N(C)C 1458a_100000689846_100000751147 [0,1,1,0,0,0|1,0,0]=3 321 B17R1.9784 CSCCC(=O)C(c1ccccc1F)N(C)C 1458a_100011344403_100000751147 [0,1,1,0,0,0|1,1,0]=4 322 B17R1.9784 Cc1ccccc1C(C(=O)CCCF)N(C)C 1458a_200015186453_100011934791 [0,1,1,0,0,0|2,0,0]=4 323 B17R1.9784 Cc1ccccc1C(C(=O)CCCO)N(C)C 1458a_200015186453_100011215043 [0,1,1,0,0,0|2,0,0]=4 324 B17R1.20773 CCC(=O)CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000747405 [0,1,1,0,0,0|1,0,1]=4 325 B17R1.20773 CCC(C(=O)C[C@@H](C)CC)c1ccccc1Cl 1458a_100011667493_100009816398 [0,1,1,0,0,0|1,0,0]=3 326 B17R1.20773 CCC(C(=O)C[C@@H](C)CO)c1ccccc1Cl 1458a_100011667493_100000059175 [0,1,1,0,0,0|2,0,0]=4 327 B17R1.20773 CCC(C)CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000748023 [0,1,1,0,0,0|1,0,0]=3 328 B17R1.20773 CCC(C)CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100000748023 [0,1,1,0,0,0|2,0,0]=4 329 B17R1.20773 CCC(C)CC(=O)C(OC)c1ccccc1F 1458a_100012277919_100000748023 [0,1,1,0,0,0|1,1,0]=4 330 B17R1.20773 CCC(C)NC(=O)C(CC)c1ccccc1Cl 11a_100000209981_100011667493 [0,1,1,0,0,0|2,0,0]=4 331 B17R1.20773 CCC(C)NC(=O)C(CC)c1ccccc1Cl 1626a_100000209981_100011667493 [0,1,1,0,0,0|2,0,0]=4 332 B17R1.20773 CCC(C)NC(=O)C(CC)c1ccccc1Cl 240690a_100000209981_100011667493 [0,1,1,0,0,0|2,0,0]=4 333 B17R1.20773 CCC(C)NC(=O)C(CC)c1ccccc1Cl 527a_100000209981_100011667493 [0,1,1,0,0,0|2,0,0]=4 334 B17R1.20773 CCC(O)CC(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100011218378 [0,1,1,0,0,0|1,0,0]=3 335 B17R1.20773 CCC(O)CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100011218378 [0,1,1,0,0,0|2,0,0]=4 336 B17R1.20773 CCC(O)CC(=O)C(OC)c1ccccc1F 1458a_100012277919_100011218378 [0,1,1,0,0,0|1,1,0]=4 337 B17R1.20773 CC[C@H](C)CC(=O)C(OC)c1ccccc1C 1458a_100012277922_100009816398 [0,1,1,0,0,0|2,0,0]=4 338 B17R1.20773 CC[C@H](C)CC(=O)C(OC)c1ccccc1F 1458a_100012277919_100009816398 [0,1,1,0,0,0|1,1,0]=4 339 B17R1.130906 CCC(C(=O)C(C)CCO)c1ccccc1Cl 1458a_100011667493_100009893172 [0,1,1,0,0,0|2,0,0]=4 340 B17R1.130906 CCC(C(=O)C(C)COC)c1ccccc1Cl 1458a_100011667493_100000765312 [0,1,1,0,0,0|2,0,0]=4 341 B17R1.130906 CCCC(C)C(=O)C(CC)c1ccccc1Cl 1458a_100011667493_100000766640 [0,1,1,0,0,0|1,0,0]=3 342 B17R1.130906 CCCC(C)C(=O)C(OC)c1ccccc1C 1458a_100012277922_100000766640 [0,1,1,0,0,0|2,0,0]=4 343 B17R1.130906 CCCC(C)C(=O)C(OC)c1ccccc1F 1458a_100012277919_100000766640 [0,1,1,0,0,0|1,1,0]=4 344 B17R1.130906 CCCN(C)C(=O)C(CC)c1ccccc1Cl 11a_100000747261_100011667493 [0,1,1,0,0,0|2,0,0]=4 345 B17R1.130906 CCCN(C)C(=O)C(CC)c1ccccc1Cl 1626a_100000747261_100011667493 [0,1,1,0,0,0|2,0,0]=4 346 B17R1.130906 CCCN(C)C(=O)C(CC)c1ccccc1Cl 240690a_100000747261_100011667493 [0,1,1,0,0,0|2,0,0]=4 347 B17R1.130906 CCCN(C)C(=O)C(CC)c1ccccc1Cl 527a_100000747261_100011667493 [0,1,1,0,0,0|2,0,0]=4 348 B17R1.169661 CCCCC(=O)N(CC)c1ccc(cc1Cl)Cl 11a_100160557746_100000210183 [0,1,1,0,0,0|2,0,0]=4 349 B17R1.169661 CCCCC(=O)N(CC)c1ccc(cc1Cl)Cl 1626a_100160557746_100000210183 [0,1,1,0,0,0|2,0,0]=4 350 B17R2.22380 O=CCCCNC1(CC1)c2ccccc2Cl 2230a_100015187805_200011292268 [0,0,1,1,0,0|2,0,0]=4 351 B17R2.452208 CC[C@H](NC1CCC1=O)c2ccccc2Cl 34a_200016987949_100009892977 [0,0,1,1,0,0|2,0,0]=4 352 B17R2.74780 CCCCC(=O)C1(CC1)c2ccccc2Br 1458a_100000707476_100000210211 [0,0,1,1,0,0|1,1,0]=4 353 B17R2.74780 CCCCC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000210211 [0,0,1,1,0,0|1,0,0]=3 354 B17R2.74780 CCCCC(=O)C1(CC1)c2ccccc2F 1458a_100000757711_100000210211 [0,0,1,1,0,0|1,1,0]=4 355 B17R2.74780 CCCNC(=O)C1(CC1)c2ccccc2Cl 11a_100020643023_100011549969 [0,0,1,1,0,0|2,0,0]=4 356 B17R2.74780 CCCNC(=O)C1(CC1)c2ccccc2Cl 240690a_100020643023_100011549969 [0,0,1,1,0,0|2,0,0]=4 357 B17R2.74780 CCCNC(=O)C1(CC1)c2ccccc2Cl 527a_100020643023_100011549969 [0,0,1,1,0,0|2,0,0]=4 358 B17R2.74780 COCCC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000233755 [0,0,1,1,0,0|2,0,0]=4 359 B17R2.74780 CSCCC(=O)C1(CC1)c2ccccc2Cl 1458a_100011549969_100000751147 [0,0,1,1,0,0|2,0,0]=4 360 B17R2.74780 O=C(CCCF)C1(CC1)c2ccccc2Cl 1458a_100011549969_100011934791 [0,0,1,1,0,0|2,0,0]=4 361 B17R2.74780 O=C(CCCO)C1(CC1)c2ccccc2Cl 1458a_100011549969_100011215043 [0,0,1,1,0,0|2,0,0]=4 362 B17R2.91528 CCC(C(=O)CC1CC1)c2ccccc2Cl 1458a_100011667493_100000742324 [0,0,1,1,0,0|1,0,0]=3 363 B17R2.91528 CCC(C(=O)CC1CO1)c2ccccc2Cl 1458a_100011667493_100011216344 [0,0,1,1,0,0|2,0,0]=4 364 B17R2.91528 CCC(C(=O)CC1CS1)c2ccccc2Cl 1458a_100011667493_100000031435 [0,0,1,1,0,0|2,0,0]=4 365 B17R2.91528 CCC(C(=O)C[C@@H]1CO1)c2ccccc2Cl 1458a_100011667493_100000745022 [0,0,1,1,0,0|2,0,0]=4 366 B17R2.91528 CCC(C(=O)NC1CC1)c2ccccc2Cl 1626a_100000212008_100011667493 [0,0,1,1,0,0|2,0,0]=4 367 B17R2.91528 CCC(C(=O)NC1CC1)c2ccccc2Cl 240690a_100000212008_100011667493 [0,0,1,1,0,0|2,0,0]=4 368 B17R2.91528 CCC(C(=O)NC1CC1)c2ccccc2Cl 527a_100000212008_100011667493 [0,0,1,1,0,0|2,0,0]=4 369 B17R2.91528 COC(C(=O)CC1CC1)c2ccccc2C 1458a_100012277922_100000742324 [0,0,1,1,0,0|2,0,0]=4 370 B17R2.91528 COC(C(=O)CC1CC1)c2ccccc2F 1458a_100012277919_100000742324 [0,0,1,1,0,0|1,1,0]=4 371 B17R2.440810 CCCCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000210211 [0,0,1,1,0,0|2,0,0]=4 372 B17R2.440810 CCCCC(=O)C1OCCc2c1cccc2 1458a_100000026751_100000210211 [0,0,1,1,0,0|2,0,0]=4 373 B17R2.455535 CCC(C(=O)C1CCC1)c2ccccc2Cl 1458a_100011667493_100000749161 [0,0,1,1,0,0|1,0,0]=3 374 B17R2.455535 CCC(C(=O)C1COC1)c2ccccc2Cl 1458a_100011667493_100000687716 [0,0,1,1,0,0|2,0,0]=4 375 B17R2.455535 CCC(C(=O)N1CCC1)c2ccccc2Cl 11a_100000754969_100011667493 [0,0,1,1,0,0|2,0,0]=4 376 B17R2.455535 CCC(C(=O)N1CCC1)c2ccccc2Cl 240690a_100000754969_100011667493 [0,0,1,1,0,0|2,0,0]=4 377 B17R2.455535 CCC(C(=O)N1CCC1)c2ccccc2Cl 527a_100000754969_100011667493 [0,0,1,1,0,0|2,0,0]=4 378 B17R2.455535 COC(C(=O)C1CCC1)c2ccccc2C 1458a_100012277922_100000749161 [0,0,1,1,0,0|2,0,0]=4 379 B17R2.455535 COC(C(=O)C1CCC1)c2ccccc2F 1458a_100012277919_100000749161 [0,0,1,1,0,0|1,1,0]=4 380 B17R2.349324 CCC(=O)C1(CCCC1)c2ccccc2F 1458a_100000212013_100000210202 [0,0,1,1,0,0|1,1,0]=4 381 B17R2.320472 CCCC(=O)C1(CCC1)c2ccccc2Br 1458a_100011756641_100000210303 [0,0,1,1,0,0|1,1,0]=4 382 B17R2.320472 CCCC(=O)C1(CCC1)c2ccccc2Cl 1458a_100011549970_100000210303 [0,0,1,1,0,0|1,0,0]=3 383 B17R2.320472 CCCC(=O)C1(CCC1)c2ccccc2F 1458a_100011497512_100000210303 [0,0,1,1,0,0|1,1,0]=4 384 B17R2.320472 CCNC(=O)C1(CCC1)c2ccccc2Cl 11a_100015525214_100011549970 [0,0,1,1,0,0|2,0,0]=4 385 B17R2.320472 CCNC(=O)C1(CCC1)c2ccccc2Cl 240690a_100015525214_100011549970 [0,0,1,1,0,0|2,0,0]=4 386 B17R2.320472 CCNC(=O)C1(CCC1)c2ccccc2Cl 527a_100015525214_100011549970 [0,0,1,1,0,0|2,0,0]=4 387 B17R2.320472 O=C(CCF)C1(CCC1)c2ccccc2Cl 1458a_100011549970_100011217306 [0,0,1,1,0,0|2,0,0]=4 388 B17R2.320472 O=C(CCO)C1(CCC1)c2ccccc2Cl 1458a_100011549970_100000211926 [0,0,1,1,0,0|2,0,0]=4 389 B17R1.5235 CCN(CCCCC=O)Cc1ccccc1Cl 2230a_100000201176_100000139335 [0,0,1,0,0,1|2,0,0]=4 390 B17R1.5235 CCN(CCCCC=O)Cc1ccccc1Cl 269982a_100000201176_100000139335 [0,0,1,0,0,1|2,0,0]=4 391 B17R1.29980 CCC(Oc1ccccc1Cl)C(=O)CCCF 1458a_100000205292_100011934791 [0,0,1,0,0,1|2,0,0]=4 392 B17R1.29980 CCC(Oc1ccccc1Cl)C(=O)CCCO 1458a_100000205292_100011215043 [0,0,1,0,0,1|2,0,0]=4 393 B17R1.29980 CCC(Oc1ccccc1Cl)C(=O)CCOC 1458a_100000205292_100000233755 [0,0,1,0,0,1|2,0,0]=4 394 B17R1.29980 CCC(Oc1ccccc1Cl)C(=O)CCSC 1458a_100000205292_100000751147 [0,0,1,0,0,1|2,0,0]=4 395 B17R1.29980 CCCCC(=O)C(CC)Oc1ccccc1Cl 1458a_100000205292_100000210211 [0,0,1,0,0,1|1,0,0]=3 396 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1Cl 11a_100000201176_100000210183 [0,0,1,0,0,1|2,0,0]=4 397 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1Cl 1626a_100000201176_100000210183 [0,0,1,0,0,1|2,0,0]=4 398 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1Cl 240690a_100000201176_100000210183 [0,0,1,0,0,1|2,0,0]=4 399 B17R1.29980 CCCCC(=O)N(CC)Cc1ccccc1Cl 527a_100000201176_100000210183 [0,0,1,0,0,1|2,0,0]=4 400 B17R1.29980 CCCNC(=O)C(CC)Oc1ccccc1Cl 11a_100020643023_100000205292 [0,0,1,0,0,1|2,0,0]=4 401 B17R1.29980 CCCNC(=O)C(CC)Oc1ccccc1Cl 1626a_100020643023_100000205292 [0,0,1,0,0,1|2,0,0]=4 402 B17R1.29980 CCCNC(=O)C(CC)Oc1ccccc1Cl 240690a_100020643023_100000205292 [0,0,1,0,0,1|2,0,0]=4 403 B17R1.29980 CCCNC(=O)C(CC)Oc1ccccc1Cl 527a_100020643023_100000205292 [0,0,1,0,0,1|2,0,0]=4 404 B17R1.29980 CCCNC(=O)C(CC)Oc1ccccc1Cl 7a_100000210172_200011763335 [0,0,1,0,0,1|2,0,0]=4 405 B17R1.29980 CCCNC(=O)C(CC)Sc1ccccc1Cl 62a_100000764095_200011763335 [0,0,1,0,0,1|2,0,0]=4 406 B17R1.29980 CCCNC(=O)C(CC)Sc1ccccc1Cl 62a_200011763335_100000764095 [0,0,1,0,0,1|2,0,0]=4