0 B15R1.5924 C#CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000753159 [0,0,0,0,0,0|2,0,2]=4 1 B15R1.5924 C#CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000753159 [0,0,0,0,0,0|2,0,2]=4 2 B15R1.5924 C#CCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000753159 [0,0,0,0,0,0|2,0,2]=4 3 B15R1.5924 C#CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000753159 [0,0,0,0,0,0|2,0,2]=4 4 B15R1.5924 C#CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000753159 [0,0,0,0,0,0|1,0,2]=3 5 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000212058_200009992764 [0,0,0,0,0,0|2,0,2]=4 6 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000212058_200000078382 [0,0,0,0,0,0|2,0,2]=4 7 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000212058_100009812877 [0,0,0,0,0,0|2,0,2]=4 8 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000212058_100000031928 [0,0,0,0,0,0|2,0,2]=4 9 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000212058_100000031928 [0,0,0,0,0,0|2,0,2]=4 10 B15R1.5924 C#CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000212058_100000074654 [0,0,0,0,0,0|2,0,2]=4 11 B15R1.5924 C/C=C/CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100102629194 [0,0,0,0,0,0|2,0,2]=4 12 B15R1.5924 C/C=C/CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100102629194 [0,0,0,0,0,0|2,0,2]=4 13 B15R1.5924 C/C=C/CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100102629194 [0,0,0,0,0,0|2,0,2]=4 14 B15R1.5924 C/C=C/CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100102629194 [0,0,0,0,0,0|2,0,2]=4 15 B15R1.5924 C/C=C/CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100102629194 [0,0,0,0,0,0|1,0,2]=3 16 B15R1.5924 C=CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000754431 [0,0,0,0,0,0|2,0,2]=4 17 B15R1.5924 C=CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000754431 [0,0,0,0,0,0|2,0,2]=4 18 B15R1.5924 C=CCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000754431 [0,0,0,0,0,0|2,0,2]=4 19 B15R1.5924 C=CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000754431 [0,0,0,0,0,0|2,0,2]=4 20 B15R1.5924 C=CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000754431 [0,0,0,0,0,0|1,0,2]=3 21 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020586998_200009992764 [0,0,0,0,0,0|2,0,2]=4 22 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020586998_200000078382 [0,0,0,0,0,0|2,0,2]=4 23 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020586998_100009812877 [0,0,0,0,0,0|2,0,2]=4 24 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020586998_100000031928 [0,0,0,0,0,0|2,0,2]=4 25 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)O)C)O 527a_100020586998_100000031928 [0,0,0,0,0,0|2,0,2]=4 26 B15R1.5924 C=CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020586998_100000074654 [0,0,0,0,0,0|2,0,2]=4 27 B15R1.5924 CC#CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000748600 [0,0,0,0,0,0|2,0,2]=4 28 B15R1.5924 CC#CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000748600 [0,0,0,0,0,0|2,0,2]=4 29 B15R1.5924 CC#CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000748600 [0,0,0,0,0,0|2,0,2]=4 30 B15R1.5924 CC#CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000748600 [0,0,0,0,0,0|2,0,2]=4 31 B15R1.5924 CC#CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000748600 [0,0,0,0,0,0|1,0,2]=3 32 B15R1.5924 CC=CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000070051 [0,0,0,0,0,0|2,0,2]=4 33 B15R1.5924 CC=CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000070051 [0,0,0,0,0,0|2,0,2]=4 34 B15R1.5924 CC=CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000070051 [0,0,0,0,0,0|2,0,2]=4 35 B15R1.5924 CC=CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000070051 [0,0,0,0,0,0|2,0,2]=4 36 B15R1.5924 CC=CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000070051 [0,0,0,0,0,0|1,0,2]=3 37 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_100000210211 [0,0,0,0,0,0|4,0,0]=4 38 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_100000210211 [0,0,0,0,0,0|4,0,0]=4 39 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100000210211 [0,0,0,0,0,0|4,0,0]=4 40 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210211 [0,0,0,0,0,0|4,0,0]=4 41 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_100000210211 [0,0,0,0,0,0|4,0,0]=4 42 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210211 [0,0,0,0,0,0|3,0,0]=3 43 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210211 [0,0,0,0,0,0|2,0,0]=2 44 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_100000210211 [0,0,0,0,0,0|4,0,0]=4 45 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_100000210211 [0,0,0,0,0,0|4,0,0]=4 46 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_100000210211 [0,0,0,0,0,0|4,0,0]=4 47 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_100000210211 [0,0,0,0,0,0|4,0,0]=4 48 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_100000210211 [0,0,0,0,0,0|4,0,0]=4 49 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210211 [0,0,0,0,0,0|3,0,0]=3 50 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100000210211 [0,0,0,0,0,0|4,0,0]=4 51 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_100000210211 [0,0,0,0,0,0|4,0,0]=4 52 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100000210211 [0,0,0,0,0,0|4,0,0]=4 53 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100000210211 [0,0,0,0,0,0|4,0,0]=4 54 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_100000210211 [0,0,0,0,0,0|4,0,0]=4 55 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_100000210211 [0,0,0,0,0,0|4,0,0]=4 56 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210211 [0,0,0,0,0,0|3,0,0]=3 57 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210211 [0,0,0,0,0,0|2,0,0]=2 58 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_100000210211 [0,0,0,0,0,0|4,0,0]=4 59 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_100000210211 [0,0,0,0,0,0|4,0,0]=4 60 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100000210211 [0,0,0,0,0,0|4,0,0]=4 61 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_100000210211 [0,0,0,0,0,0|4,0,0]=4 62 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_100000210211 [0,0,0,0,0,0|4,0,0]=4 63 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210211 [0,0,0,0,0,0|3,0,0]=3 64 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210211 [0,0,0,0,0,0|3,0,0]=3 65 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_100000210211 [0,0,0,0,0,0|4,0,0]=4 66 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_100000210211 [0,0,0,0,0,0|4,0,0]=4 67 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210211 [0,0,0,0,0,0|3,0,0]=3 68 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210211 [0,0,0,0,0,0|2,0,0]=2 69 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210211 [0,0,0,0,0,0|2,0,0]=2 70 B15R1.5924 CCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210211 [0,0,0,0,0,0|1,0,0]=1 71 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 11a_100020643023_100000187602 [0,0,0,0,0,0|4,0,0]=4 72 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 1626a_100020643023_100000187602 [0,0,0,0,0,0|4,0,0]=4 73 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 240690a_100020643023_100000187602 [0,0,0,0,0,0|4,0,0]=4 74 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)Br 527a_100020643023_100000187602 [0,0,0,0,0,0|4,0,0]=4 75 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 11a_100020643023_200012347618 [0,0,0,0,0,0|4,0,0]=4 76 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 1626a_100020643023_200012347618 [0,0,0,0,0,0|4,0,0]=4 77 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 240690a_100020643023_200012347618 [0,0,0,0,0,0|4,0,0]=4 78 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)C)F 527a_100020643023_200012347618 [0,0,0,0,0,0|4,0,0]=4 79 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 11a_100020643023_200012920480 [0,0,0,0,0,0|4,0,0]=4 80 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 1626a_100020643023_200012920480 [0,0,0,0,0,0|4,0,0]=4 81 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 240690a_100020643023_200012920480 [0,0,0,0,0,0|4,0,0]=4 82 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)Cl 527a_100020643023_200012920480 [0,0,0,0,0,0|4,0,0]=4 83 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 11a_100020643023_100010291025 [0,0,0,0,0,0|4,0,0]=4 84 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 1626a_100020643023_100010291025 [0,0,0,0,0,0|4,0,0]=4 85 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 240690a_100020643023_100010291025 [0,0,0,0,0,0|4,0,0]=4 86 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)Cl)F 527a_100020643023_100010291025 [0,0,0,0,0,0|4,0,0]=4 87 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 11a_100020643023_100010259547 [0,0,0,0,0,0|4,0,0]=4 88 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 1626a_100020643023_100010259547 [0,0,0,0,0,0|4,0,0]=4 89 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 240690a_100020643023_100010259547 [0,0,0,0,0,0|4,0,0]=4 90 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)F)F 527a_100020643023_100010259547 [0,0,0,0,0,0|4,0,0]=4 91 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100020643023_100000692688 [0,0,0,0,0,0|3,0,0]=3 92 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100020643023_100000692688 [0,0,0,0,0,0|3,0,0]=3 93 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020643023_200009992764 [0,0,0,0,0,0|2,0,0]=2 94 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 11a_100020643023_100000700660 [0,0,0,0,0,0|4,0,0]=4 95 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 1626a_100020643023_100000700660 [0,0,0,0,0,0|4,0,0]=4 96 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 240690a_100020643023_100000700660 [0,0,0,0,0,0|4,0,0]=4 97 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Br)C 527a_100020643023_100000700660 [0,0,0,0,0,0|4,0,0]=4 98 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 11a_100020643023_100000075298 [0,0,0,0,0,0|4,0,0]=4 99 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 1626a_100020643023_100000075298 [0,0,0,0,0,0|4,0,0]=4 100 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 240690a_100020643023_100000075298 [0,0,0,0,0,0|4,0,0]=4 101 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)C)C 527a_100020643023_100000075298 [0,0,0,0,0,0|4,0,0]=4 102 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 11a_100020643023_100000102532 [0,0,0,0,0,0|4,0,0]=4 103 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 1626a_100020643023_100000102532 [0,0,0,0,0,0|4,0,0]=4 104 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 240690a_100020643023_100000102532 [0,0,0,0,0,0|4,0,0]=4 105 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)Cl)C 527a_100020643023_100000102532 [0,0,0,0,0,0|4,0,0]=4 106 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 11a_100020643023_100000741972 [0,0,0,0,0,0|4,0,0]=4 107 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 1626a_100020643023_100000741972 [0,0,0,0,0,0|4,0,0]=4 108 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 240690a_100020643023_100000741972 [0,0,0,0,0,0|4,0,0]=4 109 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)F)C 527a_100020643023_100000741972 [0,0,0,0,0,0|4,0,0]=4 110 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 11a_100020643023_100010769667 [0,0,0,0,0,0|4,0,0]=4 111 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 1626a_100020643023_100010769667 [0,0,0,0,0,0|4,0,0]=4 112 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 240690a_100020643023_100010769667 [0,0,0,0,0,0|4,0,0]=4 113 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)I)C 527a_100020643023_100010769667 [0,0,0,0,0,0|4,0,0]=4 114 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100020643023_100011219978 [0,0,0,0,0,0|3,0,0]=3 115 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)C)O)C 527a_100020643023_100011219978 [0,0,0,0,0,0|3,0,0]=3 116 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 11a_100020643023_100012354307 [0,0,0,0,0,0|4,0,0]=4 117 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 1626a_100020643023_100012354307 [0,0,0,0,0,0|4,0,0]=4 118 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Br)Cl 240690a_100020643023_100012354307 [0,0,0,0,0,0|4,0,0]=4 119 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 11a_100020643023_100012356007 [0,0,0,0,0,0|4,0,0]=4 120 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 1626a_100020643023_100012356007 [0,0,0,0,0,0|4,0,0]=4 121 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 240690a_100020643023_100012356007 [0,0,0,0,0,0|4,0,0]=4 122 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)C)Cl 527a_100020643023_100012356007 [0,0,0,0,0,0|4,0,0]=4 123 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 11a_100020643023_100012339221 [0,0,0,0,0,0|4,0,0]=4 124 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1626a_100020643023_100012339221 [0,0,0,0,0,0|4,0,0]=4 125 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 240690a_100020643023_100012339221 [0,0,0,0,0,0|4,0,0]=4 126 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)Cl 527a_100020643023_100012339221 [0,0,0,0,0,0|4,0,0]=4 127 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 11a_100020643023_200010244527 [0,0,0,0,0,0|4,0,0]=4 128 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 1626a_100020643023_200010244527 [0,0,0,0,0,0|4,0,0]=4 129 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 240690a_100020643023_200010244527 [0,0,0,0,0,0|4,0,0]=4 130 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)Cl)F 527a_100020643023_200010244527 [0,0,0,0,0,0|4,0,0]=4 131 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 11a_100020643023_100011934374 [0,0,0,0,0,0|4,0,0]=4 132 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 1626a_100020643023_100011934374 [0,0,0,0,0,0|4,0,0]=4 133 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)Cl 240690a_100020643023_100011934374 [0,0,0,0,0,0|4,0,0]=4 134 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 11a_100020643023_100000068011 [0,0,0,0,0,0|4,0,0]=4 135 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 1626a_100020643023_100000068011 [0,0,0,0,0,0|4,0,0]=4 136 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 240690a_100020643023_100000068011 [0,0,0,0,0,0|4,0,0]=4 137 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)F)F 527a_100020643023_100000068011 [0,0,0,0,0,0|4,0,0]=4 138 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100020643023_100000184433 [0,0,0,0,0,0|3,0,0]=3 139 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100020643023_100000184433 [0,0,0,0,0,0|3,0,0]=3 140 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020643023_200000078382 [0,0,0,0,0,0|2,0,0]=2 141 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 11a_100020643023_100010078405 [0,0,0,0,0,0|4,0,0]=4 142 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 1626a_100020643023_100010078405 [0,0,0,0,0,0|4,0,0]=4 143 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 240690a_100020643023_100010078405 [0,0,0,0,0,0|4,0,0]=4 144 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Br)F 527a_100020643023_100010078405 [0,0,0,0,0,0|4,0,0]=4 145 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 11a_100020643023_100000055762 [0,0,0,0,0,0|4,0,0]=4 146 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 1626a_100020643023_100000055762 [0,0,0,0,0,0|4,0,0]=4 147 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 240690a_100020643023_100000055762 [0,0,0,0,0,0|4,0,0]=4 148 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)C)F 527a_100020643023_100000055762 [0,0,0,0,0,0|4,0,0]=4 149 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 11a_100020643023_100000104779 [0,0,0,0,0,0|4,0,0]=4 150 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 1626a_100020643023_100000104779 [0,0,0,0,0,0|4,0,0]=4 151 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 240690a_100020643023_100000104779 [0,0,0,0,0,0|4,0,0]=4 152 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)Cl)F 527a_100020643023_100000104779 [0,0,0,0,0,0|4,0,0]=4 153 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 11a_100020643023_100000061453 [0,0,0,0,0,0|4,0,0]=4 154 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 1626a_100020643023_100000061453 [0,0,0,0,0,0|4,0,0]=4 155 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 240690a_100020643023_100000061453 [0,0,0,0,0,0|4,0,0]=4 156 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)C 527a_100020643023_100000061453 [0,0,0,0,0,0|4,0,0]=4 157 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 11a_100020643023_100000751656 [0,0,0,0,0,0|4,0,0]=4 158 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 1626a_100020643023_100000751656 [0,0,0,0,0,0|4,0,0]=4 159 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 240690a_100020643023_100000751656 [0,0,0,0,0,0|4,0,0]=4 160 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)F 527a_100020643023_100000751656 [0,0,0,0,0,0|4,0,0]=4 161 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100020643023_200000081825 [0,0,0,0,0,0|3,0,0]=3 162 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100020643023_100000766045 [0,0,0,0,0,0|3,0,0]=3 163 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)F)O)F 527a_100020643023_100000766045 [0,0,0,0,0,0|3,0,0]=3 164 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 11a_100020643023_100012344050 [0,0,0,0,0,0|4,0,0]=4 165 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 1626a_100020643023_100012344050 [0,0,0,0,0,0|4,0,0]=4 166 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 240690a_100020643023_100012344050 [0,0,0,0,0,0|4,0,0]=4 167 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)C)F 527a_100020643023_100012344050 [0,0,0,0,0,0|4,0,0]=4 168 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)I)I 11a_100020643023_100000033816 [0,0,0,0,0,0|4,0,0]=4 169 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)I)I 1626a_100020643023_100000033816 [0,0,0,0,0,0|4,0,0]=4 170 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)I)I 527a_100020643023_100000033816 [0,0,0,0,0,0|4,0,0]=4 171 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 1626a_100020643023_100000034356 [0,0,0,0,0,0|3,0,0]=3 172 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100020643023_100000034356 [0,0,0,0,0,0|3,0,0]=3 173 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)I)O)I 527a_100020643023_100000034356 [0,0,0,0,0,0|3,0,0]=3 174 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020643023_100009812877 [0,0,0,0,0,0|2,0,0]=2 175 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020643023_100000031928 [0,0,0,0,0,0|2,0,0]=2 176 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100020643023_100000031928 [0,0,0,0,0,0|2,0,0]=2 177 B15R1.5924 CCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020643023_100000074654 [0,0,0,0,0,0|2,0,0]=2 178 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Br)O)Br 22a_100000756455_100000692688 [0,0,0,0,0,0|4,0,0]=4 179 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000756455_200009992764 [0,0,0,0,0,0|3,0,0]=3 180 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)C)O)C 22a_100000756455_100011219978 [0,0,0,0,0,0|4,0,0]=4 181 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Cl)O)Cl 22a_100000756455_100000184433 [0,0,0,0,0,0|4,0,0]=4 182 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000756455_200000078382 [0,0,0,0,0,0|3,0,0]=3 183 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)F)F)O 22a_100000756455_200000081825 [0,0,0,0,0,0|4,0,0]=4 184 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)F)O)F 22a_100000756455_100000766045 [0,0,0,0,0,0|4,0,0]=4 185 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)I)O)I 22a_100000756455_100000034356 [0,0,0,0,0,0|4,0,0]=4 186 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000756455_100009812877 [0,0,0,0,0,0|3,0,0]=3 187 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)O)C)O 22a_100000756455_100000031928 [0,0,0,0,0,0|3,0,0]=3 188 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000756455_100000074654 [0,0,0,0,0,0|3,0,0]=3 189 B15R1.5924 CCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000756455_100000212154 [0,0,0,0,0,0|2,0,0]=2 190 B15R1.5924 COCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000233755 [0,0,0,0,0,0|4,0,0]=4 191 B15R1.5924 COCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000233755 [0,0,0,0,0,0|3,0,0]=3 192 B15R1.5924 COCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000233755 [0,0,0,0,0,0|4,0,0]=4 193 B15R1.5924 COCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000233755 [0,0,0,0,0,0|4,0,0]=4 194 B15R1.5924 COCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000233755 [0,0,0,0,0,0|3,0,0]=3 195 B15R1.5924 COCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000233755 [0,0,0,0,0,0|4,0,0]=4 196 B15R1.5924 COCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000233755 [0,0,0,0,0,0|4,0,0]=4 197 B15R1.5924 COCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000233755 [0,0,0,0,0,0|4,0,0]=4 198 B15R1.5924 COCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000233755 [0,0,0,0,0,0|3,0,0]=3 199 B15R1.5924 COCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000233755 [0,0,0,0,0,0|3,0,0]=3 200 B15R1.5924 COCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000233755 [0,0,0,0,0,0|2,0,0]=2 201 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000751147 [0,0,0,0,0,0|4,0,0]=4 202 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000751147 [0,0,0,0,0,0|3,0,0]=3 203 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000751147 [0,0,0,0,0,0|4,0,0]=4 204 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000751147 [0,0,0,0,0,0|4,0,0]=4 205 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000751147 [0,0,0,0,0,0|3,0,0]=3 206 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000751147 [0,0,0,0,0,0|4,0,0]=4 207 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000751147 [0,0,0,0,0,0|4,0,0]=4 208 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000751147 [0,0,0,0,0,0|4,0,0]=4 209 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000751147 [0,0,0,0,0,0|3,0,0]=3 210 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000751147 [0,0,0,0,0,0|3,0,0]=3 211 B15R1.5924 CSCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000751147 [0,0,0,0,0,0|2,0,0]=2 212 B15R1.5924 Cc1c(cc(cc1O)C(=O)CCC#N)O 1458a_100000031928_100011215226 [0,0,0,0,0,0|3,0,1]=4 213 B15R1.5924 Cc1c(cc(cc1O)C(=O)CCCF)O 1458a_100000031928_100011934791 [0,0,0,0,0,0|3,0,0]=3 214 B15R1.5924 Cc1c(cc(cc1O)C(=O)CCCO)O 1458a_100000031928_100011215043 [0,0,0,0,0,0|3,0,0]=3 215 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCC#N)O 527a_100000734998_100000031928 [0,0,0,0,0,0|3,0,1]=4 216 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCF)O 240690a_100000724931_100000031928 [0,0,0,0,0,0|3,0,0]=3 217 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCF)O 527a_100000724931_100000031928 [0,0,0,0,0,0|3,0,0]=3 218 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCO)O 240690a_100000210304_100000031928 [0,0,0,0,0,0|3,0,0]=3 219 B15R1.5924 Cc1c(cc(cc1O)C(=O)NCCO)O 527a_100000210304_100000031928 [0,0,0,0,0,0|3,0,0]=3 220 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)CCCF 1458a_100011219978_100011934791 [0,0,0,0,0,0|4,0,0]=4 221 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)CCCO 1458a_100011219978_100011215043 [0,0,0,0,0,0|4,0,0]=4 222 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCF 240690a_100000724931_100011219978 [0,0,0,0,0,0|4,0,0]=4 223 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCF 527a_100000724931_100011219978 [0,0,0,0,0,0|4,0,0]=4 224 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCO 240690a_100000210304_100011219978 [0,0,0,0,0,0|4,0,0]=4 225 B15R1.5924 Cc1cc(cc(c1O)C)C(=O)NCCO 527a_100000210304_100011219978 [0,0,0,0,0,0|4,0,0]=4 226 B15R1.5924 N#CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215226 [0,0,0,0,0,0|3,0,1]=4 227 B15R1.5924 N#CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215226 [0,0,0,0,0,0|3,0,1]=4 228 B15R1.5924 N#CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215226 [0,0,0,0,0,0|3,0,1]=4 229 B15R1.5924 N#CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215226 [0,0,0,0,0,0|2,0,1]=3 230 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011934791 [0,0,0,0,0,0|4,0,0]=4 231 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011934791 [0,0,0,0,0,0|3,0,0]=3 232 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011934791 [0,0,0,0,0,0|4,0,0]=4 233 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011934791 [0,0,0,0,0,0|3,0,0]=3 234 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011934791 [0,0,0,0,0,0|4,0,0]=4 235 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011934791 [0,0,0,0,0,0|4,0,0]=4 236 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011934791 [0,0,0,0,0,0|4,0,0]=4 237 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011934791 [0,0,0,0,0,0|3,0,0]=3 238 B15R1.5924 O=C(CCCF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011934791 [0,0,0,0,0,0|2,0,0]=2 239 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011215043 [0,0,0,0,0,0|4,0,0]=4 240 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215043 [0,0,0,0,0,0|3,0,0]=3 241 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011215043 [0,0,0,0,0,0|4,0,0]=4 242 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215043 [0,0,0,0,0,0|3,0,0]=3 243 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011215043 [0,0,0,0,0,0|4,0,0]=4 244 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011215043 [0,0,0,0,0,0|4,0,0]=4 245 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011215043 [0,0,0,0,0,0|4,0,0]=4 246 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215043 [0,0,0,0,0,0|3,0,0]=3 247 B15R1.5924 O=C(CCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215043 [0,0,0,0,0,0|2,0,0]=2 248 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)Br 240690a_100000724931_100000692688 [0,0,0,0,0,0|4,0,0]=4 249 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)Br 527a_100000724931_100000692688 [0,0,0,0,0,0|4,0,0]=4 250 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Br)O)O 240690a_100000724931_200009992764 [0,0,0,0,0,0|3,0,0]=3 251 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)Cl 240690a_100000724931_100000184433 [0,0,0,0,0,0|4,0,0]=4 252 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)Cl 527a_100000724931_100000184433 [0,0,0,0,0,0|4,0,0]=4 253 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)Cl)O)O 240690a_100000724931_200000078382 [0,0,0,0,0,0|3,0,0]=3 254 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)F)O 240690a_100000724931_200000081825 [0,0,0,0,0,0|4,0,0]=4 255 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)O)F 240690a_100000724931_100000766045 [0,0,0,0,0,0|4,0,0]=4 256 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)F)O)F 527a_100000724931_100000766045 [0,0,0,0,0,0|4,0,0]=4 257 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 1626a_100000724931_100000034356 [0,0,0,0,0,0|4,0,0]=4 258 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 240690a_100000724931_100000034356 [0,0,0,0,0,0|4,0,0]=4 259 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)I)O)I 527a_100000724931_100000034356 [0,0,0,0,0,0|4,0,0]=4 260 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)O)Br)O 240690a_100000724931_100009812877 [0,0,0,0,0,0|3,0,0]=3 261 B15R1.5924 O=C(NCCF)c1cc(c(c(c1)O)Cl)O 240690a_100000724931_100000074654 [0,0,0,0,0,0|3,0,0]=3 262 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)Br 240690a_100000210304_100000692688 [0,0,0,0,0,0|4,0,0]=4 263 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)Br 527a_100000210304_100000692688 [0,0,0,0,0,0|4,0,0]=4 264 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Br)O)O 240690a_100000210304_200009992764 [0,0,0,0,0,0|3,0,0]=3 265 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)Cl 240690a_100000210304_100000184433 [0,0,0,0,0,0|4,0,0]=4 266 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)Cl 527a_100000210304_100000184433 [0,0,0,0,0,0|4,0,0]=4 267 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000210304_200000078382 [0,0,0,0,0,0|3,0,0]=3 268 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)F)O 240690a_100000210304_200000081825 [0,0,0,0,0,0|4,0,0]=4 269 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)O)F 240690a_100000210304_100000766045 [0,0,0,0,0,0|4,0,0]=4 270 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)F)O)F 527a_100000210304_100000766045 [0,0,0,0,0,0|4,0,0]=4 271 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)I)O)I 240690a_100000210304_100000034356 [0,0,0,0,0,0|4,0,0]=4 272 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)I)O)I 527a_100000210304_100000034356 [0,0,0,0,0,0|4,0,0]=4 273 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)O)Br)O 240690a_100000210304_100009812877 [0,0,0,0,0,0|3,0,0]=3 274 B15R1.5924 O=C(NCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000210304_100000074654 [0,0,0,0,0,0|3,0,0]=3 275 B14R1.61 CCCC=Cc1cc(c(c(c1)Br)O)C 271570a_100016258520_100010982682 [1,0,0,0,0,0|3,0,0]=4 276 B14R1.61 CCCC=Cc1cc(c(c(c1)C)O)C 271570a_100016258520_100000187306 [1,0,0,0,0,0|3,0,0]=4 277 B14R1.61 CCCC=Cc1cc(c(c(c1)Cl)O)C 271570a_100016258520_200015900153 [1,0,0,0,0,0|3,0,0]=4 278 B14R1.61 CCCC=Cc1cc(c(c(c1)Cl)O)Cl 271570a_100016258520_100012339652 [1,0,0,0,0,0|3,0,0]=4 279 B14R1.61 CCCC=Cc1cc(c(c(c1)F)F)O 271570a_100016258520_100000709865 [1,0,0,0,0,0|3,0,0]=4 280 B14R1.61 CCCC=Cc1cc(c(c(c1)F)N)O 271570a_100016258520_100015475841 [1,0,0,0,0,0|3,0,0]=4 281 B14R1.61 CCCC=Cc1cc(c(c(c1)F)O)F 271570a_100016258520_100011216917 [1,0,0,0,0,0|3,0,0]=4 282 B14R1.61 CCCC=Cc1cc(c(c(c1)F)O)N 271570a_100016258520_100011217383 [1,0,0,0,0,0|3,0,0]=4 283 B14R1.61 CCCC=Cc1cc(c(c(c1)N)O)C 271570a_100016258520_100011825904 [1,0,0,0,0,0|3,0,0]=4 284 B14R1.61 CCCC=Cc1cc(c(c(c1)O)N)C 271570a_100016258520_100010371313 [1,0,0,0,0,0|3,0,0]=4 285 B14R1.61 CCCCSc1cc(c(c(c1)F)O)O 62a_100000210211_100010114375 [1,0,0,0,0,0|3,0,0]=4 286 B14R1.61 CCCCSc1cc(c(c(c1)O)O)O 62a_100000210211_100010658518 [1,0,0,0,0,0|2,0,0]=3 287 B14R1.61 CCNN=Cc1cc(c(c(c1)Br)O)O 4a_100000756455_100000687232 [1,0,0,0,0,0|3,0,0]=4 288 B14R1.61 CCNN=Cc1cc(c(c(c1)O)O)O 4a_100000756455_100000042491 [1,0,0,0,0,0|2,0,0]=3 289 B14R1.61 CCOCSc1cc(c(c(c1)O)O)O 62a_100000739092_100010658518 [1,0,0,0,0,0|3,0,0]=4 290 B14R1.61 COCCSc1cc(c(c(c1)O)O)O 62a_100000233755_100010658518 [1,0,0,0,0,0|3,0,0]=4 291 B14R1.61 CSCCSc1cc(c(c(c1)O)O)O 62a_100000212216_100010658518 [1,0,0,0,0,0|3,0,0]=4 292 B14R1.61 OCCCSc1cc(c(c(c1)O)O)O 62a_100011215043_100010658518 [1,0,0,0,0,0|3,0,0]=4 293 B14R1.61 Oc1cc(cc(c1O)O)SCCCF 62a_100011934791_100010658518 [1,0,0,0,0,0|3,0,0]=4 294 B14R1.923 C#CCNC(=O)c1cc(cc(c1)O)O 240690a_100000212058_100000690292 [1,0,0,0,0,0|1,0,2]=4 295 B14R1.923 C#CCNC(=O)c1cc(cc(c1)O)O 527a_100000212058_100000690292 [1,0,0,0,0,0|1,0,2]=4 296 B14R1.923 C=CCNC(=O)c1cc(cc(c1)O)O 240690a_100020586998_100000690292 [1,0,0,0,0,0|1,0,2]=4 297 B14R1.923 C=CCNC(=O)c1cc(cc(c1)O)O 527a_100020586998_100000690292 [1,0,0,0,0,0|1,0,2]=4 298 B14R1.923 CCCCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210211 [1,0,0,0,0,0|3,0,0]=4 299 B14R1.923 CCCCC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_100000210211 [1,0,0,0,0,0|3,0,0]=4 300 B14R1.923 CCCCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210211 [1,0,0,0,0,0|3,0,0]=4 301 B14R1.923 CCCCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210211 [1,0,0,0,0,0|3,0,0]=4 302 B14R1.923 CCCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210211 [1,0,0,0,0,0|2,0,0]=3 303 B14R1.923 CCCCC(=O)c1cc(cc(c1)C)C 1458a_100000210874_100000210211 [1,0,0,0,0,0|3,0,0]=4 304 B14R1.923 CCCCC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_100000210211 [1,0,0,0,0,0|3,0,0]=4 305 B14R1.923 CCCCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210211 [1,0,0,0,0,0|3,0,0]=4 306 B14R1.923 CCCCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210211 [1,0,0,0,0,0|3,0,0]=4 307 B14R1.923 CCCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210211 [1,0,0,0,0,0|2,0,0]=3 308 B14R1.923 CCCCC(=O)c1cc(cc(c1)F)C 1458a_100000763163_100000210211 [1,0,0,0,0,0|3,0,0]=4 309 B14R1.923 CCCCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210211 [1,0,0,0,0,0|3,0,0]=4 310 B14R1.923 CCCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210211 [1,0,0,0,0,0|2,0,0]=3 311 B14R1.923 CCCCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210211 [1,0,0,0,0,0|3,0,0]=4 312 B14R1.923 CCCCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210211 [1,0,0,0,0,0|3,0,0]=4 313 B14R1.923 CCCCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210211 [1,0,0,0,0,0|3,0,0]=4 314 B14R1.923 CCCCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210211 [1,0,0,0,0,0|3,0,0]=4 315 B14R1.923 CCCCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210211 [1,0,0,0,0,0|3,0,0]=4 316 B14R1.923 CCCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210211 [1,0,0,0,0,0|2,0,0]=3 317 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Br 11a_100020643023_100000687083 [1,0,0,0,0,0|3,0,0]=4 318 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Br 1626a_100020643023_100000687083 [1,0,0,0,0,0|3,0,0]=4 319 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Br 240690a_100020643023_100000687083 [1,0,0,0,0,0|3,0,0]=4 320 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Br 527a_100020643023_100000687083 [1,0,0,0,0,0|3,0,0]=4 321 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)C 11a_100020643023_100000760426 [1,0,0,0,0,0|3,0,0]=4 322 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)C 1626a_100020643023_100000760426 [1,0,0,0,0,0|3,0,0]=4 323 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)C 240690a_100020643023_100000760426 [1,0,0,0,0,0|3,0,0]=4 324 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)C 527a_100020643023_100000760426 [1,0,0,0,0,0|3,0,0]=4 325 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Cl 11a_100020643023_100000687899 [1,0,0,0,0,0|3,0,0]=4 326 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Cl 1626a_100020643023_100000687899 [1,0,0,0,0,0|3,0,0]=4 327 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Cl 240690a_100020643023_100000687899 [1,0,0,0,0,0|3,0,0]=4 328 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)Cl 527a_100020643023_100000687899 [1,0,0,0,0,0|3,0,0]=4 329 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)F 11a_100020643023_100000739618 [1,0,0,0,0,0|3,0,0]=4 330 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)F 1626a_100020643023_100000739618 [1,0,0,0,0,0|3,0,0]=4 331 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)F 240690a_100020643023_100000739618 [1,0,0,0,0,0|3,0,0]=4 332 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)F 527a_100020643023_100000739618 [1,0,0,0,0,0|3,0,0]=4 333 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)O 240690a_100020643023_100011934545 [1,0,0,0,0,0|2,0,0]=3 334 B14R1.923 CCCNC(=O)c1cc(cc(c1)Br)O 527a_100020643023_100011934545 [1,0,0,0,0,0|2,0,0]=3 335 B14R1.923 CCCNC(=O)c1cc(cc(c1)C)C 11a_100020643023_100000210874 [1,0,0,0,0,0|3,0,0]=4 336 B14R1.923 CCCNC(=O)c1cc(cc(c1)C)C 1626a_100020643023_100000210874 [1,0,0,0,0,0|3,0,0]=4 337 B14R1.923 CCCNC(=O)c1cc(cc(c1)C)C 240690a_100020643023_100000210874 [1,0,0,0,0,0|3,0,0]=4 338 B14R1.923 CCCNC(=O)c1cc(cc(c1)C)C 527a_100020643023_100000210874 [1,0,0,0,0,0|3,0,0]=4 339 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)C 11a_100020643023_100000684526 [1,0,0,0,0,0|3,0,0]=4 340 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)C 1626a_100020643023_100000684526 [1,0,0,0,0,0|3,0,0]=4 341 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)C 240690a_100020643023_100000684526 [1,0,0,0,0,0|3,0,0]=4 342 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)C 527a_100020643023_100000684526 [1,0,0,0,0,0|3,0,0]=4 343 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)Cl 11a_100020643023_100000210701 [1,0,0,0,0,0|3,0,0]=4 344 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)Cl 1626a_100020643023_100000210701 [1,0,0,0,0,0|3,0,0]=4 345 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)Cl 240690a_100020643023_100000210701 [1,0,0,0,0,0|3,0,0]=4 346 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)Cl 527a_100020643023_100000210701 [1,0,0,0,0,0|3,0,0]=4 347 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)F 11a_100020643023_100000685768 [1,0,0,0,0,0|3,0,0]=4 348 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)F 1626a_100020643023_100000685768 [1,0,0,0,0,0|3,0,0]=4 349 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)F 240690a_100020643023_100000685768 [1,0,0,0,0,0|3,0,0]=4 350 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)F 527a_100020643023_100000685768 [1,0,0,0,0,0|3,0,0]=4 351 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)O 240690a_100020643023_100011997059 [1,0,0,0,0,0|2,0,0]=3 352 B14R1.923 CCCNC(=O)c1cc(cc(c1)Cl)O 527a_100020643023_100011997059 [1,0,0,0,0,0|2,0,0]=3 353 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)C 11a_100020643023_100000763163 [1,0,0,0,0,0|3,0,0]=4 354 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)C 1626a_100020643023_100000763163 [1,0,0,0,0,0|3,0,0]=4 355 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)C 240690a_100020643023_100000763163 [1,0,0,0,0,0|3,0,0]=4 356 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)C 527a_100020643023_100000763163 [1,0,0,0,0,0|3,0,0]=4 357 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)F 11a_100020643023_100000211655 [1,0,0,0,0,0|3,0,0]=4 358 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)F 1626a_100020643023_100000211655 [1,0,0,0,0,0|3,0,0]=4 359 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)F 240690a_100020643023_100000211655 [1,0,0,0,0,0|3,0,0]=4 360 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)F 527a_100020643023_100000211655 [1,0,0,0,0,0|3,0,0]=4 361 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)O 11a_100020643023_100012017291 [1,0,0,0,0,0|2,0,0]=3 362 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)O 240690a_100020643023_100012017291 [1,0,0,0,0,0|2,0,0]=3 363 B14R1.923 CCCNC(=O)c1cc(cc(c1)F)O 527a_100020643023_100012017291 [1,0,0,0,0,0|2,0,0]=3 364 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Br 11a_100020643023_100000689235 [1,0,0,0,0,0|3,0,0]=4 365 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Br 1626a_100020643023_100000689235 [1,0,0,0,0,0|3,0,0]=4 366 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Br 240690a_100020643023_100000689235 [1,0,0,0,0,0|3,0,0]=4 367 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Br 527a_100020643023_100000689235 [1,0,0,0,0,0|3,0,0]=4 368 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)C 11a_100020643023_100000729426 [1,0,0,0,0,0|3,0,0]=4 369 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)C 1626a_100020643023_100000729426 [1,0,0,0,0,0|3,0,0]=4 370 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)C 240690a_100020643023_100000729426 [1,0,0,0,0,0|3,0,0]=4 371 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)C 527a_100020643023_100000729426 [1,0,0,0,0,0|3,0,0]=4 372 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Cl 11a_100020643023_100012047205 [1,0,0,0,0,0|3,0,0]=4 373 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Cl 1626a_100020643023_100012047205 [1,0,0,0,0,0|3,0,0]=4 374 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Cl 240690a_100020643023_100012047205 [1,0,0,0,0,0|3,0,0]=4 375 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)Cl 527a_100020643023_100012047205 [1,0,0,0,0,0|3,0,0]=4 376 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)F 11a_100020643023_100012047268 [1,0,0,0,0,0|3,0,0]=4 377 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)F 1626a_100020643023_100012047268 [1,0,0,0,0,0|3,0,0]=4 378 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)F 240690a_100020643023_100012047268 [1,0,0,0,0,0|3,0,0]=4 379 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)F 527a_100020643023_100012047268 [1,0,0,0,0,0|3,0,0]=4 380 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)I 11a_100020643023_100011204819 [1,0,0,0,0,0|3,0,0]=4 381 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)I 1626a_100020643023_100011204819 [1,0,0,0,0,0|3,0,0]=4 382 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)I 240690a_100020643023_100011204819 [1,0,0,0,0,0|3,0,0]=4 383 B14R1.923 CCCNC(=O)c1cc(cc(c1)I)I 527a_100020643023_100011204819 [1,0,0,0,0,0|3,0,0]=4 384 B14R1.923 CCCNC(=O)c1cc(cc(c1)O)C 240690a_100020643023_100000094094 [1,0,0,0,0,0|2,0,0]=3 385 B14R1.923 CCCNC(=O)c1cc(cc(c1)O)C 527a_100020643023_100000094094 [1,0,0,0,0,0|2,0,0]=3 386 B14R1.923 CCCNC(=O)c1cc(cc(c1)O)O 240690a_100020643023_100000690292 [1,0,0,0,0,0|1,0,0]=2 387 B14R1.923 CCCNC(=O)c1cc(cc(c1)O)O 527a_100020643023_100000690292 [1,0,0,0,0,0|1,0,0]=2 388 B14R1.923 CCNCC(=O)c1cc(cc(c1)O)O 2230a_100015525214_100010006762 [1,0,0,0,0,0|2,0,0]=3 389 B14R1.923 CCNN=C(C)c1cc(cc(c1)O)O 4a_100000756455_100000032396 [1,0,0,0,0,0|3,0,0]=4 390 B14R1.923 CCNNC(=O)c1cc(cc(c1)Br)O 22a_100000756455_100011934545 [1,0,0,0,0,0|3,0,0]=4 391 B14R1.923 CCNNC(=O)c1cc(cc(c1)Cl)O 22a_100000756455_100011997059 [1,0,0,0,0,0|3,0,0]=4 392 B14R1.923 CCNNC(=O)c1cc(cc(c1)F)O 22a_100000756455_100012017291 [1,0,0,0,0,0|3,0,0]=4 393 B14R1.923 CCNNC(=O)c1cc(cc(c1)O)C 22a_100000756455_100000094094 [1,0,0,0,0,0|3,0,0]=4 394 B14R1.923 CCNNC(=O)c1cc(cc(c1)O)O 22a_100000756455_100000690292 [1,0,0,0,0,0|2,0,0]=3 395 B14R1.923 CCOCC(=O)c1cc(cc(c1)O)O 34a_100121572206_100010006762 [1,0,0,0,0,0|2,0,0]=3 396 B14R1.923 CCSCC(=O)c1cc(cc(c1)O)O 62a_100000210202_100010006762 [1,0,0,0,0,0|2,0,0]=3 397 B14R1.923 CCSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100000210202 [1,0,0,0,0,0|2,0,0]=3 398 B14R1.923 COCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000233755 [1,0,0,0,0,0|3,0,0]=4 399 B14R1.923 COCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000233755 [1,0,0,0,0,0|3,0,0]=4 400 B14R1.923 COCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000233755 [1,0,0,0,0,0|3,0,0]=4 401 B14R1.923 COCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000233755 [1,0,0,0,0,0|3,0,0]=4 402 B14R1.923 CSCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000751147 [1,0,0,0,0,0|3,0,0]=4 403 B14R1.923 CSCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000751147 [1,0,0,0,0,0|3,0,0]=4 404 B14R1.923 CSCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000751147 [1,0,0,0,0,0|3,0,0]=4 405 B14R1.923 CSCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000751147 [1,0,0,0,0,0|3,0,0]=4 406 B14R1.923 Cc1cc(cc(c1)C(=O)CCCF)O 1458a_100000094094_100011934791 [1,0,0,0,0,0|3,0,0]=4 407 B14R1.923 Cc1cc(cc(c1)C(=O)CCCO)O 1458a_100000094094_100011215043 [1,0,0,0,0,0|3,0,0]=4 408 B14R1.923 Cc1cc(cc(c1)C(=O)NCCF)O 240690a_100000724931_100000094094 [1,0,0,0,0,0|3,0,0]=4 409 B14R1.923 Cc1cc(cc(c1)C(=O)NCCF)O 527a_100000724931_100000094094 [1,0,0,0,0,0|3,0,0]=4 410 B14R1.923 Cc1cc(cc(c1)C(=O)NCCO)O 240690a_100000210304_100000094094 [1,0,0,0,0,0|3,0,0]=4 411 B14R1.923 Cc1cc(cc(c1)C(=O)NCCO)O 527a_100000210304_100000094094 [1,0,0,0,0,0|3,0,0]=4 412 B14R1.923 N#CCNC(=O)c1cc(cc(c1)O)O 527a_100000734998_100000690292 [1,0,0,0,0,0|2,0,1]=4 413 B14R1.923 O=C(CCCF)c1cc(cc(c1)Br)O 1458a_100011934545_100011934791 [1,0,0,0,0,0|3,0,0]=4 414 B14R1.923 O=C(CCCF)c1cc(cc(c1)Cl)O 1458a_100011997059_100011934791 [1,0,0,0,0,0|3,0,0]=4 415 B14R1.923 O=C(CCCF)c1cc(cc(c1)F)O 1458a_100012017291_100011934791 [1,0,0,0,0,0|3,0,0]=4 416 B14R1.923 O=C(CCCO)c1cc(cc(c1)Br)O 1458a_100011934545_100011215043 [1,0,0,0,0,0|3,0,0]=4 417 B14R1.923 O=C(CCCO)c1cc(cc(c1)Cl)O 1458a_100011997059_100011215043 [1,0,0,0,0,0|3,0,0]=4 418 B14R1.923 O=C(CCCO)c1cc(cc(c1)F)O 1458a_100012017291_100011215043 [1,0,0,0,0,0|3,0,0]=4 419 B14R1.923 O=C(CSCF)c1cc(cc(c1)O)O 62a_100010006762_100015361967 [1,0,0,0,0,0|3,0,0]=4 420 B14R1.923 O=C(CSCF)c1cc(cc(c1)O)O 62a_100015361967_100010006762 [1,0,0,0,0,0|3,0,0]=4 421 B14R1.923 O=C(NCCF)c1cc(cc(c1)Br)O 240690a_100000724931_100011934545 [1,0,0,0,0,0|3,0,0]=4 422 B14R1.923 O=C(NCCF)c1cc(cc(c1)Br)O 527a_100000724931_100011934545 [1,0,0,0,0,0|3,0,0]=4 423 B14R1.923 O=C(NCCF)c1cc(cc(c1)Cl)O 240690a_100000724931_100011997059 [1,0,0,0,0,0|3,0,0]=4 424 B14R1.923 O=C(NCCF)c1cc(cc(c1)Cl)O 527a_100000724931_100011997059 [1,0,0,0,0,0|3,0,0]=4 425 B14R1.923 O=C(NCCF)c1cc(cc(c1)F)O 11a_100000724931_100012017291 [1,0,0,0,0,0|3,0,0]=4 426 B14R1.923 O=C(NCCF)c1cc(cc(c1)F)O 240690a_100000724931_100012017291 [1,0,0,0,0,0|3,0,0]=4 427 B14R1.923 O=C(NCCF)c1cc(cc(c1)F)O 527a_100000724931_100012017291 [1,0,0,0,0,0|3,0,0]=4 428 B14R1.923 O=C(NCCF)c1cc(cc(c1)O)O 240690a_100000724931_100000690292 [1,0,0,0,0,0|2,0,0]=3 429 B14R1.923 O=C(NCCF)c1cc(cc(c1)O)O 527a_100000724931_100000690292 [1,0,0,0,0,0|2,0,0]=3 430 B14R1.923 O=C(NCCO)c1cc(cc(c1)Br)O 240690a_100000210304_100011934545 [1,0,0,0,0,0|3,0,0]=4 431 B14R1.923 O=C(NCCO)c1cc(cc(c1)Br)O 527a_100000210304_100011934545 [1,0,0,0,0,0|3,0,0]=4 432 B14R1.923 O=C(NCCO)c1cc(cc(c1)Cl)O 240690a_100000210304_100011997059 [1,0,0,0,0,0|3,0,0]=4 433 B14R1.923 O=C(NCCO)c1cc(cc(c1)Cl)O 527a_100000210304_100011997059 [1,0,0,0,0,0|3,0,0]=4 434 B14R1.923 O=C(NCCO)c1cc(cc(c1)F)O 240690a_100000210304_100012017291 [1,0,0,0,0,0|3,0,0]=4 435 B14R1.923 O=C(NCCO)c1cc(cc(c1)F)O 527a_100000210304_100012017291 [1,0,0,0,0,0|3,0,0]=4 436 B14R1.923 O=C(NCCO)c1cc(cc(c1)O)O 240690a_100000210304_100000690292 [1,0,0,0,0,0|2,0,0]=3 437 B14R1.923 O=C(NCCO)c1cc(cc(c1)O)O 527a_100000210304_100000690292 [1,0,0,0,0,0|2,0,0]=3 438 B14R1.941 C#CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000753159 [1,0,0,0,0,0|1,0,2]=4 439 B14R1.941 C/C=C/CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100102629194 [1,0,0,0,0,0|1,0,2]=4 440 B14R1.941 C=CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000754431 [1,0,0,0,0,0|1,0,2]=4 441 B14R1.941 CC#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748600 [1,0,0,0,0,0|1,0,2]=4 442 B14R1.941 CC=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000070051 [1,0,0,0,0,0|1,0,2]=4 443 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210211 [1,0,0,0,0,0|3,0,0]=4 444 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210211 [1,0,0,0,0,0|3,0,0]=4 445 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210211 [1,0,0,0,0,0|3,0,0]=4 446 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210211 [1,0,0,0,0,0|3,0,0]=4 447 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210211 [1,0,0,0,0,0|3,0,0]=4 448 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210211 [1,0,0,0,0,0|2,0,0]=3 449 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210211 [1,0,0,0,0,0|3,0,0]=4 450 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210211 [1,0,0,0,0,0|3,0,0]=4 451 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210211 [1,0,0,0,0,0|3,0,0]=4 452 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210211 [1,0,0,0,0,0|3,0,0]=4 453 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210211 [1,0,0,0,0,0|3,0,0]=4 454 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210211 [1,0,0,0,0,0|2,0,0]=3 455 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210211 [1,0,0,0,0,0|3,0,0]=4 456 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210211 [1,0,0,0,0,0|3,0,0]=4 457 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210211 [1,0,0,0,0,0|3,0,0]=4 458 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210211 [1,0,0,0,0,0|3,0,0]=4 459 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210211 [1,0,0,0,0,0|3,0,0]=4 460 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210211 [1,0,0,0,0,0|2,0,0]=3 461 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210211 [1,0,0,0,0,0|3,0,0]=4 462 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210211 [1,0,0,0,0,0|3,0,0]=4 463 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210211 [1,0,0,0,0,0|3,0,0]=4 464 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210211 [1,0,0,0,0,0|3,0,0]=4 465 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210211 [1,0,0,0,0,0|3,0,0]=4 466 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210211 [1,0,0,0,0,0|2,0,0]=3 467 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210211 [1,0,0,0,0,0|3,0,0]=4 468 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210211 [1,0,0,0,0,0|3,0,0]=4 469 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210211 [1,0,0,0,0,0|3,0,0]=4 470 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210211 [1,0,0,0,0,0|3,0,0]=4 471 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210211 [1,0,0,0,0,0|3,0,0]=4 472 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210211 [1,0,0,0,0,0|2,0,0]=3 473 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210211 [1,0,0,0,0,0|2,0,0]=3 474 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210211 [1,0,0,0,0,0|2,0,0]=3 475 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210211 [1,0,0,0,0,0|2,0,0]=3 476 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210211 [1,0,0,0,0,0|2,0,0]=3 477 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210211 [1,0,0,0,0,0|2,0,0]=3 478 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210211 [1,0,0,0,0,0|1,0,0]=2 479 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 11a_100020643023_100012339404 [1,0,0,0,0,0|3,0,0]=4 480 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 1626a_100020643023_100012339404 [1,0,0,0,0,0|3,0,0]=4 481 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 240690a_100020643023_100012339404 [1,0,0,0,0,0|3,0,0]=4 482 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Br 527a_100020643023_100012339404 [1,0,0,0,0,0|3,0,0]=4 483 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 11a_100020643023_100000186397 [1,0,0,0,0,0|3,0,0]=4 484 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 1626a_100020643023_100000186397 [1,0,0,0,0,0|3,0,0]=4 485 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 240690a_100020643023_100000186397 [1,0,0,0,0,0|3,0,0]=4 486 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)C 527a_100020643023_100000186397 [1,0,0,0,0,0|3,0,0]=4 487 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 11a_100020643023_100000691181 [1,0,0,0,0,0|3,0,0]=4 488 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 1626a_100020643023_100000691181 [1,0,0,0,0,0|3,0,0]=4 489 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 240690a_100020643023_100000691181 [1,0,0,0,0,0|3,0,0]=4 490 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)Cl 527a_100020643023_100000691181 [1,0,0,0,0,0|3,0,0]=4 491 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 11a_100020643023_100000760357 [1,0,0,0,0,0|3,0,0]=4 492 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 1626a_100020643023_100000760357 [1,0,0,0,0,0|3,0,0]=4 493 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 240690a_100020643023_100000760357 [1,0,0,0,0,0|3,0,0]=4 494 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)F 527a_100020643023_100000760357 [1,0,0,0,0,0|3,0,0]=4 495 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 11a_100020643023_100000739115 [1,0,0,0,0,0|3,0,0]=4 496 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 1626a_100020643023_100000739115 [1,0,0,0,0,0|3,0,0]=4 497 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 240690a_100020643023_100000739115 [1,0,0,0,0,0|3,0,0]=4 498 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)I 527a_100020643023_100000739115 [1,0,0,0,0,0|3,0,0]=4 499 B14R1.941 CCCNC(=O)c1ccc(c(c1)Br)O 240690a_100020643023_100000189672 [1,0,0,0,0,0|2,0,0]=3 500 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 11a_100020643023_100000692631 [1,0,0,0,0,0|3,0,0]=4 501 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 1626a_100020643023_100000692631 [1,0,0,0,0,0|3,0,0]=4 502 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 240690a_100020643023_100000692631 [1,0,0,0,0,0|3,0,0]=4 503 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Br 527a_100020643023_100000692631 [1,0,0,0,0,0|3,0,0]=4 504 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 11a_100020643023_100000210898 [1,0,0,0,0,0|3,0,0]=4 505 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 1626a_100020643023_100000210898 [1,0,0,0,0,0|3,0,0]=4 506 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 240690a_100020643023_100000210898 [1,0,0,0,0,0|3,0,0]=4 507 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)C 527a_100020643023_100000210898 [1,0,0,0,0,0|3,0,0]=4 508 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 11a_100020643023_100000686306 [1,0,0,0,0,0|3,0,0]=4 509 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 1626a_100020643023_100000686306 [1,0,0,0,0,0|3,0,0]=4 510 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 240690a_100020643023_100000686306 [1,0,0,0,0,0|3,0,0]=4 511 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)Cl 527a_100020643023_100000686306 [1,0,0,0,0,0|3,0,0]=4 512 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 11a_100020643023_100000751819 [1,0,0,0,0,0|3,0,0]=4 513 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 1626a_100020643023_100000751819 [1,0,0,0,0,0|3,0,0]=4 514 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 240690a_100020643023_100000751819 [1,0,0,0,0,0|3,0,0]=4 515 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)F 527a_100020643023_100000751819 [1,0,0,0,0,0|3,0,0]=4 516 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 11a_100020643023_100000751300 [1,0,0,0,0,0|3,0,0]=4 517 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 1626a_100020643023_100000751300 [1,0,0,0,0,0|3,0,0]=4 518 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 240690a_100020643023_100000751300 [1,0,0,0,0,0|3,0,0]=4 519 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)I 527a_100020643023_100000751300 [1,0,0,0,0,0|3,0,0]=4 520 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)O 240690a_100020643023_100000685612 [1,0,0,0,0,0|2,0,0]=3 521 B14R1.941 CCCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357430 [1,0,0,0,0,0|2,0,0]=3 522 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 11a_100020643023_100000687082 [1,0,0,0,0,0|3,0,0]=4 523 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 1626a_100020643023_100000687082 [1,0,0,0,0,0|3,0,0]=4 524 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 240690a_100020643023_100000687082 [1,0,0,0,0,0|3,0,0]=4 525 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Br 527a_100020643023_100000687082 [1,0,0,0,0,0|3,0,0]=4 526 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 11a_100020643023_100000751740 [1,0,0,0,0,0|3,0,0]=4 527 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 1626a_100020643023_100000751740 [1,0,0,0,0,0|3,0,0]=4 528 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 240690a_100020643023_100000751740 [1,0,0,0,0,0|3,0,0]=4 529 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)C 527a_100020643023_100000751740 [1,0,0,0,0,0|3,0,0]=4 530 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 11a_100020643023_100000210401 [1,0,0,0,0,0|3,0,0]=4 531 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100020643023_100000210401 [1,0,0,0,0,0|3,0,0]=4 532 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100020643023_100000210401 [1,0,0,0,0,0|3,0,0]=4 533 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)Cl 527a_100020643023_100000210401 [1,0,0,0,0,0|3,0,0]=4 534 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 11a_100020643023_100000686462 [1,0,0,0,0,0|3,0,0]=4 535 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 1626a_100020643023_100000686462 [1,0,0,0,0,0|3,0,0]=4 536 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 240690a_100020643023_100000686462 [1,0,0,0,0,0|3,0,0]=4 537 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)F 527a_100020643023_100000686462 [1,0,0,0,0,0|3,0,0]=4 538 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 11a_100020643023_100000684831 [1,0,0,0,0,0|3,0,0]=4 539 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 1626a_100020643023_100000684831 [1,0,0,0,0,0|3,0,0]=4 540 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 240690a_100020643023_100000684831 [1,0,0,0,0,0|3,0,0]=4 541 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)I 527a_100020643023_100000684831 [1,0,0,0,0,0|3,0,0]=4 542 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100020643023_100000212196 [1,0,0,0,0,0|2,0,0]=3 543 B14R1.941 CCCNC(=O)c1ccc(c(c1)Cl)O 527a_100020643023_100000212196 [1,0,0,0,0,0|2,0,0]=3 544 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 11a_100020643023_100000743946 [1,0,0,0,0,0|3,0,0]=4 545 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 1626a_100020643023_100000743946 [1,0,0,0,0,0|3,0,0]=4 546 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 240690a_100020643023_100000743946 [1,0,0,0,0,0|3,0,0]=4 547 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Br 527a_100020643023_100000743946 [1,0,0,0,0,0|3,0,0]=4 548 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 11a_100020643023_100000212313 [1,0,0,0,0,0|3,0,0]=4 549 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 1626a_100020643023_100000212313 [1,0,0,0,0,0|3,0,0]=4 550 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 240690a_100020643023_100000212313 [1,0,0,0,0,0|3,0,0]=4 551 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)C 527a_100020643023_100000212313 [1,0,0,0,0,0|3,0,0]=4 552 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 11a_100020643023_100000743183 [1,0,0,0,0,0|3,0,0]=4 553 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 1626a_100020643023_100000743183 [1,0,0,0,0,0|3,0,0]=4 554 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 240690a_100020643023_100000743183 [1,0,0,0,0,0|3,0,0]=4 555 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)Cl 527a_100020643023_100000743183 [1,0,0,0,0,0|3,0,0]=4 556 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 11a_100020643023_100000209822 [1,0,0,0,0,0|3,0,0]=4 557 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 1626a_100020643023_100000209822 [1,0,0,0,0,0|3,0,0]=4 558 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 240690a_100020643023_100000209822 [1,0,0,0,0,0|3,0,0]=4 559 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)F 527a_100020643023_100000209822 [1,0,0,0,0,0|3,0,0]=4 560 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 11a_100020643023_100000062624 [1,0,0,0,0,0|3,0,0]=4 561 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 1626a_100020643023_100000062624 [1,0,0,0,0,0|3,0,0]=4 562 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 240690a_100020643023_100000062624 [1,0,0,0,0,0|3,0,0]=4 563 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)I 527a_100020643023_100000062624 [1,0,0,0,0,0|3,0,0]=4 564 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)O 240690a_100020643023_100000185466 [1,0,0,0,0,0|2,0,0]=3 565 B14R1.941 CCCNC(=O)c1ccc(c(c1)F)O 527a_100020643023_100000185466 [1,0,0,0,0,0|2,0,0]=3 566 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 11a_100020643023_100012343876 [1,0,0,0,0,0|3,0,0]=4 567 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 1626a_100020643023_100012343876 [1,0,0,0,0,0|3,0,0]=4 568 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 240690a_100020643023_100012343876 [1,0,0,0,0,0|3,0,0]=4 569 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Br 527a_100020643023_100012343876 [1,0,0,0,0,0|3,0,0]=4 570 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 11a_100020643023_100000751299 [1,0,0,0,0,0|3,0,0]=4 571 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 1626a_100020643023_100000751299 [1,0,0,0,0,0|3,0,0]=4 572 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 240690a_100020643023_100000751299 [1,0,0,0,0,0|3,0,0]=4 573 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)C 527a_100020643023_100000751299 [1,0,0,0,0,0|3,0,0]=4 574 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 11a_100020643023_100000739381 [1,0,0,0,0,0|3,0,0]=4 575 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 1626a_100020643023_100000739381 [1,0,0,0,0,0|3,0,0]=4 576 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 240690a_100020643023_100000739381 [1,0,0,0,0,0|3,0,0]=4 577 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)Cl 527a_100020643023_100000739381 [1,0,0,0,0,0|3,0,0]=4 578 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 11a_100020643023_100000688015 [1,0,0,0,0,0|3,0,0]=4 579 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 1626a_100020643023_100000688015 [1,0,0,0,0,0|3,0,0]=4 580 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 240690a_100020643023_100000688015 [1,0,0,0,0,0|3,0,0]=4 581 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)F 527a_100020643023_100000688015 [1,0,0,0,0,0|3,0,0]=4 582 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 11a_100020643023_100000725830 [1,0,0,0,0,0|3,0,0]=4 583 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 1626a_100020643023_100000725830 [1,0,0,0,0,0|3,0,0]=4 584 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 240690a_100020643023_100000725830 [1,0,0,0,0,0|3,0,0]=4 585 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)I 527a_100020643023_100000725830 [1,0,0,0,0,0|3,0,0]=4 586 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)O 1626a_100020643023_100000037485 [1,0,0,0,0,0|2,0,0]=3 587 B14R1.941 CCCNC(=O)c1ccc(c(c1)I)O 240690a_100020643023_100000037485 [1,0,0,0,0,0|2,0,0]=3 588 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Br 240690a_100020643023_100000689001 [1,0,0,0,0,0|2,0,0]=3 589 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Br 527a_100020643023_100000689001 [1,0,0,0,0,0|2,0,0]=3 590 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)C 240690a_100020643023_100000233767 [1,0,0,0,0,0|2,0,0]=3 591 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100020643023_100011933997 [1,0,0,0,0,0|2,0,0]=3 592 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)Cl 527a_100020643023_100011933997 [1,0,0,0,0,0|2,0,0]=3 593 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 240690a_100020643023_100000035894 [1,0,0,0,0,0|2,0,0]=3 594 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359901 [1,0,0,0,0,0|2,0,0]=3 595 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)F 527a_100020643023_100000035894 [1,0,0,0,0,0|2,0,0]=3 596 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 1626a_100020643023_100000239334 [1,0,0,0,0,0|2,0,0]=3 597 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 240690a_100020643023_100000239334 [1,0,0,0,0,0|2,0,0]=3 598 B14R1.941 CCCNC(=O)c1ccc(c(c1)O)I 527a_100020643023_100000239334 [1,0,0,0,0,0|2,0,0]=3 599 B14R1.941 CCCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013322381 [1,0,0,0,0,0|1,0,0]=2 600 B14R1.941 CCNN=C(C)c1ccc(c(c1)O)O 4a_100000756455_100000025746 [1,0,0,0,0,0|3,0,0]=4 601 B14R1.941 CCNNC(=O)c1ccc(c(c1)Br)O 22a_100000756455_100000189672 [1,0,0,0,0,0|3,0,0]=4 602 B14R1.941 CCNNC(=O)c1ccc(c(c1)C)O 22a_100000756455_100000685612 [1,0,0,0,0,0|3,0,0]=4 603 B14R1.941 CCNNC(=O)c1ccc(c(c1)Cl)O 22a_100000756455_100000212196 [1,0,0,0,0,0|3,0,0]=4 604 B14R1.941 CCNNC(=O)c1ccc(c(c1)F)O 22a_100000756455_100000185466 [1,0,0,0,0,0|3,0,0]=4 605 B14R1.941 CCNNC(=O)c1ccc(c(c1)I)O 22a_100000756455_100000037485 [1,0,0,0,0,0|3,0,0]=4 606 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)Br 22a_100000756455_100000689001 [1,0,0,0,0,0|3,0,0]=4 607 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)C 22a_100000756455_100000233767 [1,0,0,0,0,0|3,0,0]=4 608 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)Cl 22a_100000756455_100011933997 [1,0,0,0,0,0|3,0,0]=4 609 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)F 22a_100000756455_100000035894 [1,0,0,0,0,0|3,0,0]=4 610 B14R1.941 CCNNC(=O)c1ccc(c(c1)O)I 22a_100000756455_100000239334 [1,0,0,0,0,0|3,0,0]=4 611 B14R1.941 CCSCC(=O)c1ccc(c(c1)Cl)O 62a_100000210202_200010170092 [1,0,0,0,0,0|3,0,0]=4 612 B14R1.941 CCSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_100000210202 [1,0,0,0,0,0|3,0,0]=4 613 B14R1.941 CCSCC(=O)c1ccc(c(c1)O)O 62a_100000210202_100000183813 [1,0,0,0,0,0|2,0,0]=3 614 B14R1.941 COCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000233755 [1,0,0,0,0,0|3,0,0]=4 615 B14R1.941 COCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000233755 [1,0,0,0,0,0|3,0,0]=4 616 B14R1.941 COCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000233755 [1,0,0,0,0,0|3,0,0]=4 617 B14R1.941 COCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000233755 [1,0,0,0,0,0|3,0,0]=4 618 B14R1.941 COCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000233755 [1,0,0,0,0,0|3,0,0]=4 619 B14R1.941 COCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000233755 [1,0,0,0,0,0|3,0,0]=4 620 B14R1.941 COCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000233755 [1,0,0,0,0,0|3,0,0]=4 621 B14R1.941 COCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000233755 [1,0,0,0,0,0|3,0,0]=4 622 B14R1.941 COCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000233755 [1,0,0,0,0,0|3,0,0]=4 623 B14R1.941 COCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000233755 [1,0,0,0,0,0|3,0,0]=4 624 B14R1.941 COCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000233755 [1,0,0,0,0,0|2,0,0]=3 625 B14R1.941 CSCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000751147 [1,0,0,0,0,0|3,0,0]=4 626 B14R1.941 CSCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000751147 [1,0,0,0,0,0|3,0,0]=4 627 B14R1.941 CSCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000751147 [1,0,0,0,0,0|3,0,0]=4 628 B14R1.941 CSCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000751147 [1,0,0,0,0,0|3,0,0]=4 629 B14R1.941 CSCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000751147 [1,0,0,0,0,0|3,0,0]=4 630 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000751147 [1,0,0,0,0,0|3,0,0]=4 631 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000751147 [1,0,0,0,0,0|3,0,0]=4 632 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000751147 [1,0,0,0,0,0|3,0,0]=4 633 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000751147 [1,0,0,0,0,0|3,0,0]=4 634 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000751147 [1,0,0,0,0,0|3,0,0]=4 635 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000751147 [1,0,0,0,0,0|2,0,0]=3 636 B14R1.941 Cc1cc(ccc1O)C(=O)CCCF 1458a_100000685612_100011934791 [1,0,0,0,0,0|3,0,0]=4 637 B14R1.941 Cc1cc(ccc1O)C(=O)CCCO 1458a_100000685612_100011215043 [1,0,0,0,0,0|3,0,0]=4 638 B14R1.941 Cc1cc(ccc1O)C(=O)NCCF 240690a_100000724931_100000685612 [1,0,0,0,0,0|3,0,0]=4 639 B14R1.941 Cc1cc(ccc1O)C(=O)NCCO 240690a_100000210304_100000685612 [1,0,0,0,0,0|3,0,0]=4 640 B14R1.941 Cc1ccc(cc1O)C(=O)CCCF 1458a_100000233767_100011934791 [1,0,0,0,0,0|3,0,0]=4 641 B14R1.941 Cc1ccc(cc1O)C(=O)CCCO 1458a_100000233767_100011215043 [1,0,0,0,0,0|3,0,0]=4 642 B14R1.941 Cc1ccc(cc1O)C(=O)NCCF 240690a_100000724931_100000233767 [1,0,0,0,0,0|3,0,0]=4 643 B14R1.941 Cc1ccc(cc1O)C(=O)NCCO 240690a_100000210304_100000233767 [1,0,0,0,0,0|3,0,0]=4 644 B14R1.941 N#CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011215226 [1,0,0,0,0,0|2,0,1]=4 645 B14R1.941 O=C(CCCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011934791 [1,0,0,0,0,0|3,0,0]=4 646 B14R1.941 O=C(CCCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011934791 [1,0,0,0,0,0|3,0,0]=4 647 B14R1.941 O=C(CCCF)c1ccc(c(c1)F)O 1458a_100000185466_100011934791 [1,0,0,0,0,0|3,0,0]=4 648 B14R1.941 O=C(CCCF)c1ccc(c(c1)I)O 1458a_100000037485_100011934791 [1,0,0,0,0,0|3,0,0]=4 649 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011934791 [1,0,0,0,0,0|3,0,0]=4 650 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011934791 [1,0,0,0,0,0|3,0,0]=4 651 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)F 1458a_100000035894_100011934791 [1,0,0,0,0,0|3,0,0]=4 652 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)I 1458a_100000239334_100011934791 [1,0,0,0,0,0|3,0,0]=4 653 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)O 1458a_100000212155_100011934791 [1,0,0,0,0,0|2,0,0]=3 654 B14R1.941 O=C(CCCO)c1ccc(c(c1)Br)O 1458a_100000189672_100011215043 [1,0,0,0,0,0|3,0,0]=4 655 B14R1.941 O=C(CCCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100011215043 [1,0,0,0,0,0|3,0,0]=4 656 B14R1.941 O=C(CCCO)c1ccc(c(c1)F)O 1458a_100000185466_100011215043 [1,0,0,0,0,0|3,0,0]=4 657 B14R1.941 O=C(CCCO)c1ccc(c(c1)I)O 1458a_100000037485_100011215043 [1,0,0,0,0,0|3,0,0]=4 658 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)Br 1458a_100000689001_100011215043 [1,0,0,0,0,0|3,0,0]=4 659 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100011215043 [1,0,0,0,0,0|3,0,0]=4 660 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)F 1458a_100000035894_100011215043 [1,0,0,0,0,0|3,0,0]=4 661 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)I 1458a_100000239334_100011215043 [1,0,0,0,0,0|3,0,0]=4 662 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)O 1458a_100000212155_100011215043 [1,0,0,0,0,0|2,0,0]=3 663 B14R1.941 O=C(CSCF)c1ccc(c(c1)O)O 62a_100015361967_100000183813 [1,0,0,0,0,0|3,0,0]=4 664 B14R1.941 O=C(NCCF)c1ccc(c(c1)Br)O 240690a_100000724931_100000189672 [1,0,0,0,0,0|3,0,0]=4 665 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)O 240690a_100000724931_100000212196 [1,0,0,0,0,0|3,0,0]=4 666 B14R1.941 O=C(NCCF)c1ccc(c(c1)Cl)O 527a_100000724931_100000212196 [1,0,0,0,0,0|3,0,0]=4 667 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)O 240690a_100000724931_100000185466 [1,0,0,0,0,0|3,0,0]=4 668 B14R1.941 O=C(NCCF)c1ccc(c(c1)F)O 527a_100000724931_100000185466 [1,0,0,0,0,0|3,0,0]=4 669 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)O 1626a_100000724931_100000037485 [1,0,0,0,0,0|3,0,0]=4 670 B14R1.941 O=C(NCCF)c1ccc(c(c1)I)O 240690a_100000724931_100000037485 [1,0,0,0,0,0|3,0,0]=4 671 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Br 240690a_100000724931_100000689001 [1,0,0,0,0,0|3,0,0]=4 672 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Br 527a_100000724931_100000689001 [1,0,0,0,0,0|3,0,0]=4 673 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Cl 240690a_100000724931_100011933997 [1,0,0,0,0,0|3,0,0]=4 674 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)Cl 527a_100000724931_100011933997 [1,0,0,0,0,0|3,0,0]=4 675 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)F 240690a_100000724931_100000035894 [1,0,0,0,0,0|3,0,0]=4 676 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)F 527a_100000724931_100000035894 [1,0,0,0,0,0|3,0,0]=4 677 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 1626a_100000724931_100000239334 [1,0,0,0,0,0|3,0,0]=4 678 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 240690a_100000724931_100000239334 [1,0,0,0,0,0|3,0,0]=4 679 B14R1.941 O=C(NCCF)c1ccc(c(c1)O)I 527a_100000724931_100000239334 [1,0,0,0,0,0|3,0,0]=4 680 B14R1.941 O=C(NCCO)c1ccc(c(c1)Br)O 240690a_100000210304_100000189672 [1,0,0,0,0,0|3,0,0]=4 681 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)O 240690a_100000210304_100000212196 [1,0,0,0,0,0|3,0,0]=4 682 B14R1.941 O=C(NCCO)c1ccc(c(c1)Cl)O 527a_100000210304_100000212196 [1,0,0,0,0,0|3,0,0]=4 683 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)O 240690a_100000210304_100000185466 [1,0,0,0,0,0|3,0,0]=4 684 B14R1.941 O=C(NCCO)c1ccc(c(c1)F)O 527a_100000210304_100000185466 [1,0,0,0,0,0|3,0,0]=4 685 B14R1.941 O=C(NCCO)c1ccc(c(c1)I)O 240690a_100000210304_100000037485 [1,0,0,0,0,0|3,0,0]=4 686 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Br 240690a_100000210304_100000689001 [1,0,0,0,0,0|3,0,0]=4 687 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Br 527a_100000210304_100000689001 [1,0,0,0,0,0|3,0,0]=4 688 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Cl 240690a_100000210304_100011933997 [1,0,0,0,0,0|3,0,0]=4 689 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)Cl 527a_100000210304_100011933997 [1,0,0,0,0,0|3,0,0]=4 690 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)F 240690a_100000210304_100000035894 [1,0,0,0,0,0|3,0,0]=4 691 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)F 527a_100000210304_100000035894 [1,0,0,0,0,0|3,0,0]=4 692 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)I 240690a_100000210304_100000239334 [1,0,0,0,0,0|3,0,0]=4 693 B14R1.941 O=C(NCCO)c1ccc(c(c1)O)I 527a_100000210304_100000239334 [1,0,0,0,0,0|3,0,0]=4 694 B14R1.6821 C#CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000184674 [1,0,0,0,0,0|1,0,2]=4 695 B14R1.6821 C#CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000184674 [1,0,0,0,0,0|1,0,2]=4 696 B14R1.6821 C#CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000184674 [1,0,0,0,0,0|1,0,2]=4 697 B14R1.6821 C#CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000184674 [1,0,0,0,0,0|1,0,2]=4 698 B14R1.6821 C#CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000184674 [1,0,0,0,0,0|0,0,2]=3 699 B14R1.6821 C=CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210623 [1,0,0,0,0,0|1,0,2]=4 700 B14R1.6821 C=CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210623 [1,0,0,0,0,0|1,0,2]=4 701 B14R1.6821 C=CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210623 [1,0,0,0,0,0|1,0,2]=4 702 B14R1.6821 C=CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210623 [1,0,0,0,0,0|1,0,2]=4 703 B14R1.6821 C=CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210623 [1,0,0,0,0,0|0,0,2]=3 704 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_100000210303 [1,0,0,0,0,0|3,0,0]=4 705 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_100000210303 [1,0,0,0,0,0|3,0,0]=4 706 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_100000210303 [1,0,0,0,0,0|3,0,0]=4 707 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_100000210303 [1,0,0,0,0,0|3,0,0]=4 708 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_100000210303 [1,0,0,0,0,0|3,0,0]=4 709 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210303 [1,0,0,0,0,0|2,0,0]=3 710 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210303 [1,0,0,0,0,0|1,0,0]=2 711 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_100000210303 [1,0,0,0,0,0|3,0,0]=4 712 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_100000210303 [1,0,0,0,0,0|3,0,0]=4 713 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_100000210303 [1,0,0,0,0,0|3,0,0]=4 714 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_100000210303 [1,0,0,0,0,0|3,0,0]=4 715 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_100000210303 [1,0,0,0,0,0|3,0,0]=4 716 B14R1.6821 CCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210303 [1,0,0,0,0,0|2,0,0]=3 717 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_100000210303 [1,0,0,0,0,0|3,0,0]=4 718 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_100000210303 [1,0,0,0,0,0|3,0,0]=4 719 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_100000210303 [1,0,0,0,0,0|3,0,0]=4 720 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_100000210303 [1,0,0,0,0,0|3,0,0]=4 721 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_100000210303 [1,0,0,0,0,0|3,0,0]=4 722 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_100000210303 [1,0,0,0,0,0|3,0,0]=4 723 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210303 [1,0,0,0,0,0|2,0,0]=3 724 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210303 [1,0,0,0,0,0|1,0,0]=2 725 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_100000210303 [1,0,0,0,0,0|3,0,0]=4 726 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_100000210303 [1,0,0,0,0,0|3,0,0]=4 727 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_100000210303 [1,0,0,0,0,0|3,0,0]=4 728 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_100000210303 [1,0,0,0,0,0|3,0,0]=4 729 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_100000210303 [1,0,0,0,0,0|3,0,0]=4 730 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210303 [1,0,0,0,0,0|2,0,0]=3 731 B14R1.6821 CCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210303 [1,0,0,0,0,0|2,0,0]=3 732 B14R1.6821 CCCC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_100000210303 [1,0,0,0,0,0|3,0,0]=4 733 B14R1.6821 CCCC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_100000210303 [1,0,0,0,0,0|3,0,0]=4 734 B14R1.6821 CCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210303 [1,0,0,0,0,0|2,0,0]=3 735 B14R1.6821 CCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210303 [1,0,0,0,0,0|1,0,0]=2 736 B14R1.6821 CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210303 [1,0,0,0,0,0|1,0,0]=2 737 B14R1.6821 CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210303 [1,0,0,0,0,0|0,0,0]=1 738 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100015525214_100000692688 [1,0,0,0,0,0|3,0,0]=4 739 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100015525214_100000692688 [1,0,0,0,0,0|3,0,0]=4 740 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100015525214_200009992764 [1,0,0,0,0,0|2,0,0]=3 741 B14R1.6821 CCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100015525214_100011219978 [1,0,0,0,0,0|3,0,0]=4 742 B14R1.6821 CCNC(=O)c1cc(c(c(c1)C)O)C 527a_100015525214_100011219978 [1,0,0,0,0,0|3,0,0]=4 743 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100015525214_100000184433 [1,0,0,0,0,0|3,0,0]=4 744 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100015525214_100000184433 [1,0,0,0,0,0|3,0,0]=4 745 B14R1.6821 CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100015525214_200000078382 [1,0,0,0,0,0|2,0,0]=3 746 B14R1.6821 CCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100015525214_200000081825 [1,0,0,0,0,0|3,0,0]=4 747 B14R1.6821 CCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100015525214_100000766045 [1,0,0,0,0,0|3,0,0]=4 748 B14R1.6821 CCNC(=O)c1cc(c(c(c1)F)O)F 527a_100015525214_100000766045 [1,0,0,0,0,0|3,0,0]=4 749 B14R1.6821 CCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100015525214_100000034356 [1,0,0,0,0,0|3,0,0]=4 750 B14R1.6821 CCNC(=O)c1cc(c(c(c1)I)O)I 527a_100015525214_100000034356 [1,0,0,0,0,0|3,0,0]=4 751 B14R1.6821 CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100015525214_100009812877 [1,0,0,0,0,0|2,0,0]=3 752 B14R1.6821 CCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100015525214_100000031928 [1,0,0,0,0,0|2,0,0]=3 753 B14R1.6821 CCNC(=O)c1cc(c(c(c1)O)C)O 527a_100015525214_100000031928 [1,0,0,0,0,0|2,0,0]=3 754 B14R1.6821 CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100015525214_100000074654 [1,0,0,0,0,0|2,0,0]=3 755 B14R1.6821 CCOC(=O)c1cc(c(c(c1)Br)N)O 271570a_203496583355_100009816177 [1,0,0,0,0,0|2,0,0]=3 756 B14R1.6821 CCOC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_200015718343 [1,0,0,0,0,0|2,0,0]=3 757 B14R1.6821 CCOC(=O)c1cc(c(c(c1)O)N)C 271570a_203496583355_100010073787 [1,0,0,0,0,0|2,0,0]=3 758 B14R1.6821 CNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100016993582_200009992764 [1,0,0,0,0,0|3,0,0]=4 759 B14R1.6821 CNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100016993582_200000078382 [1,0,0,0,0,0|3,0,0]=4 760 B14R1.6821 CNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100016993582_100009812877 [1,0,0,0,0,0|3,0,0]=4 761 B14R1.6821 CNNC(=O)c1cc(c(c(c1)O)C)O 22a_100016993582_100000031928 [1,0,0,0,0,0|3,0,0]=4 762 B14R1.6821 CNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100016993582_100000074654 [1,0,0,0,0,0|3,0,0]=4 763 B14R1.6821 CNNC(=O)c1cc(c(c(c1)O)O)O 22a_100016993582_100000212154 [1,0,0,0,0,0|2,0,0]=3 764 B14R1.6821 Cc1c(cc(cc1O)C(=O)CC#N)O 1458a_100000031928_100011214920 [1,0,0,0,0,0|2,0,1]=4 765 B14R1.6821 Cc1c(cc(cc1O)C(=O)CCF)O 1458a_100000031928_100011217306 [1,0,0,0,0,0|2,0,0]=3 766 B14R1.6821 Cc1c(cc(cc1O)C(=O)CCO)O 1458a_100000031928_100000211926 [1,0,0,0,0,0|2,0,0]=3 767 B14R1.6821 Cc1cc(cc(c1O)C)C(=O)CCF 1458a_100011219978_100011217306 [1,0,0,0,0,0|3,0,0]=4 768 B14R1.6821 Cc1cc(cc(c1O)C)C(=O)CCO 1458a_100011219978_100000211926 [1,0,0,0,0,0|3,0,0]=4 769 B14R1.6821 N#CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011214920 [1,0,0,0,0,0|2,0,1]=4 770 B14R1.6821 N#CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011214920 [1,0,0,0,0,0|2,0,1]=4 771 B14R1.6821 N#CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011214920 [1,0,0,0,0,0|2,0,1]=4 772 B14R1.6821 N#CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011214920 [1,0,0,0,0,0|1,0,1]=3 773 B14R1.6821 O=C(CCF)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011217306 [1,0,0,0,0,0|3,0,0]=4 774 B14R1.6821 O=C(CCF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011217306 [1,0,0,0,0,0|2,0,0]=3 775 B14R1.6821 O=C(CCF)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011217306 [1,0,0,0,0,0|3,0,0]=4 776 B14R1.6821 O=C(CCF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011217306 [1,0,0,0,0,0|2,0,0]=3 777 B14R1.6821 O=C(CCF)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011217306 [1,0,0,0,0,0|3,0,0]=4 778 B14R1.6821 O=C(CCF)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011217306 [1,0,0,0,0,0|3,0,0]=4 779 B14R1.6821 O=C(CCF)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011217306 [1,0,0,0,0,0|3,0,0]=4 780 B14R1.6821 O=C(CCF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011217306 [1,0,0,0,0,0|2,0,0]=3 781 B14R1.6821 O=C(CCF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011217306 [1,0,0,0,0,0|1,0,0]=2 782 B14R1.6821 O=C(CCO)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000211926 [1,0,0,0,0,0|3,0,0]=4 783 B14R1.6821 O=C(CCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000211926 [1,0,0,0,0,0|2,0,0]=3 784 B14R1.6821 O=C(CCO)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000211926 [1,0,0,0,0,0|3,0,0]=4 785 B14R1.6821 O=C(CCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000211926 [1,0,0,0,0,0|2,0,0]=3 786 B14R1.6821 O=C(CCO)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000211926 [1,0,0,0,0,0|3,0,0]=4 787 B14R1.6821 O=C(CCO)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000211926 [1,0,0,0,0,0|3,0,0]=4 788 B14R1.6821 O=C(CCO)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000211926 [1,0,0,0,0,0|3,0,0]=4 789 B14R1.6821 O=C(CCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000211926 [1,0,0,0,0,0|2,0,0]=3 790 B14R1.6821 O=C(CCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000211926 [1,0,0,0,0,0|1,0,0]=2 791 B16R1.3548 C#CCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000731252 [0,1,0,0,0,0|2,0,1]=4 792 B16R1.3548 C#CCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000731252 [0,1,0,0,0,0|2,0,1]=4 793 B16R1.3548 C#CCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000731252 [0,1,0,0,0,0|2,0,1]=4 794 B16R1.3548 C#CCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000731252 [0,1,0,0,0,0|2,0,1]=4 795 B16R1.3548 C#CCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000731252 [0,1,0,0,0,0|1,0,1]=3 796 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000755551_200009992764 [0,1,0,0,0,0|2,0,1]=4 797 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000755551_200000078382 [0,1,0,0,0,0|2,0,1]=4 798 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000755551_100009812877 [0,1,0,0,0,0|2,0,1]=4 799 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000755551_100000031928 [0,1,0,0,0,0|2,0,1]=4 800 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000755551_100000031928 [0,1,0,0,0,0|2,0,1]=4 801 B16R1.3548 C#CCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000755551_100000074654 [0,1,0,0,0,0|2,0,1]=4 802 B16R1.3548 C=CCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000757094 [0,1,0,0,0,0|2,0,1]=4 803 B16R1.3548 C=CCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000757094 [0,1,0,0,0,0|2,0,1]=4 804 B16R1.3548 C=CCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000757094 [0,1,0,0,0,0|2,0,1]=4 805 B16R1.3548 C=CCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000757094 [0,1,0,0,0,0|2,0,1]=4 806 B16R1.3548 C=CCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000757094 [0,1,0,0,0,0|1,0,1]=3 807 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100015191253_200009992764 [0,1,0,0,0,0|2,0,1]=4 808 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100015191253_200000078382 [0,1,0,0,0,0|2,0,1]=4 809 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100015191253_100009812877 [0,1,0,0,0,0|2,0,1]=4 810 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100015191253_100000031928 [0,1,0,0,0,0|2,0,1]=4 811 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100015191253_100000031928 [0,1,0,0,0,0|2,0,1]=4 812 B16R1.3548 C=CCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100015191253_100000074654 [0,1,0,0,0,0|2,0,1]=4 813 B16R1.3548 C=CCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100020588587_100000212154 [0,1,0,0,0,0|1,0,2]=4 814 B16R1.3548 C=COCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000039644 [0,1,0,0,0,0|1,0,2]=4 815 B16R1.3548 CC#CCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000685387_100000031928 [0,1,0,0,0,0|2,0,1]=4 816 B16R1.3548 CC/C=C\CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100103147603 [0,1,0,0,0,0|2,0,1]=4 817 B16R1.3548 CC/C=C\CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100103147603 [0,1,0,0,0,0|2,0,1]=4 818 B16R1.3548 CC/C=C\CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100103147603 [0,1,0,0,0,0|2,0,1]=4 819 B16R1.3548 CC/C=C\CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100103147603 [0,1,0,0,0,0|2,0,1]=4 820 B16R1.3548 CC/C=C\CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100103147603 [0,1,0,0,0,0|1,0,1]=3 821 B16R1.3548 CCC#CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100009813939 [0,1,0,0,0,0|2,0,1]=4 822 B16R1.3548 CCC#CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100009813939 [0,1,0,0,0,0|2,0,1]=4 823 B16R1.3548 CCC#CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100009813939 [0,1,0,0,0,0|2,0,1]=4 824 B16R1.3548 CCC#CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100009813939 [0,1,0,0,0,0|2,0,1]=4 825 B16R1.3548 CCC#CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009813939 [0,1,0,0,0,0|1,0,1]=3 826 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210326 [0,1,0,0,0,0|3,0,0]=4 827 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210326 [0,1,0,0,0,0|2,0,0]=3 828 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210326 [0,1,0,0,0,0|3,0,0]=4 829 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210326 [0,1,0,0,0,0|3,0,0]=4 830 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210326 [0,1,0,0,0,0|2,0,0]=3 831 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210326 [0,1,0,0,0,0|3,0,0]=4 832 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210326 [0,1,0,0,0,0|3,0,0]=4 833 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210326 [0,1,0,0,0,0|3,0,0]=4 834 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210326 [0,1,0,0,0,0|2,0,0]=3 835 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210326 [0,1,0,0,0,0|2,0,0]=3 836 B16R1.3548 CCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210326 [0,1,0,0,0,0|1,0,0]=2 837 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000102301_100000692688 [0,1,0,0,0,0|3,0,0]=4 838 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100000102301_100000692688 [0,1,0,0,0,0|3,0,0]=4 839 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000102301_200009992764 [0,1,0,0,0,0|2,0,0]=3 840 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100000102301_100011219978 [0,1,0,0,0,0|3,0,0]=4 841 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)C)O)C 527a_100000102301_100011219978 [0,1,0,0,0,0|3,0,0]=4 842 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000102301_100000184433 [0,1,0,0,0,0|3,0,0]=4 843 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000102301_100000184433 [0,1,0,0,0,0|3,0,0]=4 844 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000102301_200000078382 [0,1,0,0,0,0|2,0,0]=3 845 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100000102301_200000081825 [0,1,0,0,0,0|3,0,0]=4 846 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100000102301_100000766045 [0,1,0,0,0,0|3,0,0]=4 847 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)F)O)F 527a_100000102301_100000766045 [0,1,0,0,0,0|3,0,0]=4 848 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)O)I 1626a_100000102301_100000034356 [0,1,0,0,0,0|3,0,0]=4 849 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100000102301_100000034356 [0,1,0,0,0,0|3,0,0]=4 850 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)I)O)I 527a_100000102301_100000034356 [0,1,0,0,0,0|3,0,0]=4 851 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000102301_100009812877 [0,1,0,0,0,0|2,0,0]=3 852 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000102301_100000031928 [0,1,0,0,0,0|2,0,0]=3 853 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000102301_100000031928 [0,1,0,0,0,0|2,0,0]=3 854 B16R1.3548 CCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000102301_100000074654 [0,1,0,0,0,0|2,0,0]=3 855 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)Br)O)Br 22a_100000740057_100000692688 [0,1,0,0,0,0|3,0,0]=4 856 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000740057_200009992764 [0,1,0,0,0,0|2,0,0]=3 857 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)C)O)C 22a_100000740057_100011219978 [0,1,0,0,0,0|3,0,0]=4 858 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)Cl)O)Cl 22a_100000740057_100000184433 [0,1,0,0,0,0|3,0,0]=4 859 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000740057_200000078382 [0,1,0,0,0,0|2,0,0]=3 860 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)F)F)O 22a_100000740057_200000081825 [0,1,0,0,0,0|3,0,0]=4 861 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)F)O)F 22a_100000740057_100000766045 [0,1,0,0,0,0|3,0,0]=4 862 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)I)O)I 22a_100000740057_100000034356 [0,1,0,0,0,0|3,0,0]=4 863 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000740057_100009812877 [0,1,0,0,0,0|2,0,0]=3 864 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)O)C)O 22a_100000740057_100000031928 [0,1,0,0,0,0|2,0,0]=3 865 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000740057_100000074654 [0,1,0,0,0,0|2,0,0]=3 866 B16R1.3548 CCCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000740057_100000212154 [0,1,0,0,0,0|1,0,0]=2 867 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011215890 [0,1,0,0,0,0|3,0,0]=4 868 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215890 [0,1,0,0,0,0|2,0,0]=3 869 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100011215890 [0,1,0,0,0,0|3,0,0]=4 870 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011215890 [0,1,0,0,0,0|3,0,0]=4 871 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215890 [0,1,0,0,0,0|2,0,0]=3 872 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011215890 [0,1,0,0,0,0|3,0,0]=4 873 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011215890 [0,1,0,0,0,0|3,0,0]=4 874 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011215890 [0,1,0,0,0,0|3,0,0]=4 875 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011215890 [0,1,0,0,0,0|2,0,0]=3 876 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215890 [0,1,0,0,0,0|2,0,0]=3 877 B16R1.3548 CCOCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215890 [0,1,0,0,0,0|1,0,0]=2 878 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000757381 [0,1,0,0,0,0|3,0,0]=4 879 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000757381 [0,1,0,0,0,0|2,0,0]=3 880 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000757381 [0,1,0,0,0,0|3,0,0]=4 881 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000757381 [0,1,0,0,0,0|3,0,0]=4 882 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000757381 [0,1,0,0,0,0|2,0,0]=3 883 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000757381 [0,1,0,0,0,0|3,0,0]=4 884 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000757381 [0,1,0,0,0,0|3,0,0]=4 885 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000757381 [0,1,0,0,0,0|3,0,0]=4 886 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000757381 [0,1,0,0,0,0|2,0,0]=3 887 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000757381 [0,1,0,0,0,0|2,0,0]=3 888 B16R1.3548 CCSCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000757381 [0,1,0,0,0,0|1,0,0]=2 889 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000740836 [0,1,0,0,0,0|3,0,0]=4 890 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000740836 [0,1,0,0,0,0|2,0,0]=3 891 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000740836 [0,1,0,0,0,0|3,0,0]=4 892 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000740836 [0,1,0,0,0,0|3,0,0]=4 893 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000740836 [0,1,0,0,0,0|2,0,0]=3 894 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000740836 [0,1,0,0,0,0|3,0,0]=4 895 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000740836 [0,1,0,0,0,0|3,0,0]=4 896 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000740836 [0,1,0,0,0,0|3,0,0]=4 897 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000740836 [0,1,0,0,0,0|2,0,0]=3 898 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000740836 [0,1,0,0,0,0|2,0,0]=3 899 B16R1.3548 COCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000740836 [0,1,0,0,0,0|1,0,0]=2 900 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000209980_100000692688 [0,1,0,0,0,0|3,0,0]=4 901 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100000209980_100000692688 [0,1,0,0,0,0|3,0,0]=4 902 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000209980_200009992764 [0,1,0,0,0,0|2,0,0]=3 903 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100000209980_100011219978 [0,1,0,0,0,0|3,0,0]=4 904 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)C)O)C 527a_100000209980_100011219978 [0,1,0,0,0,0|3,0,0]=4 905 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000209980_100000184433 [0,1,0,0,0,0|3,0,0]=4 906 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000209980_100000184433 [0,1,0,0,0,0|3,0,0]=4 907 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000209980_200000078382 [0,1,0,0,0,0|2,0,0]=3 908 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100000209980_200000081825 [0,1,0,0,0,0|3,0,0]=4 909 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100000209980_100000766045 [0,1,0,0,0,0|3,0,0]=4 910 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)F)O)F 527a_100000209980_100000766045 [0,1,0,0,0,0|3,0,0]=4 911 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)I)O)I 1626a_100000209980_100000034356 [0,1,0,0,0,0|3,0,0]=4 912 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100000209980_100000034356 [0,1,0,0,0,0|3,0,0]=4 913 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)I)O)I 527a_100000209980_100000034356 [0,1,0,0,0,0|3,0,0]=4 914 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000209980_100009812877 [0,1,0,0,0,0|2,0,0]=3 915 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000209980_100000031928 [0,1,0,0,0,0|2,0,0]=3 916 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000209980_100000031928 [0,1,0,0,0,0|2,0,0]=3 917 B16R1.3548 COCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000209980_100000074654 [0,1,0,0,0,0|2,0,0]=3 918 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100020590264_100000692688 [0,1,0,0,0,0|3,0,0]=4 919 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100020590264_100000692688 [0,1,0,0,0,0|3,0,0]=4 920 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020590264_200009992764 [0,1,0,0,0,0|2,0,0]=3 921 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)C)O)C 240690a_100020590264_100011219978 [0,1,0,0,0,0|3,0,0]=4 922 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)C)O)C 527a_100020590264_100011219978 [0,1,0,0,0,0|3,0,0]=4 923 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100020590264_100000184433 [0,1,0,0,0,0|3,0,0]=4 924 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100020590264_100000184433 [0,1,0,0,0,0|3,0,0]=4 925 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020590264_200000078382 [0,1,0,0,0,0|2,0,0]=3 926 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)F)F)O 240690a_100020590264_200000081825 [0,1,0,0,0,0|3,0,0]=4 927 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)F)O)F 240690a_100020590264_100000766045 [0,1,0,0,0,0|3,0,0]=4 928 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)F)O)F 527a_100020590264_100000766045 [0,1,0,0,0,0|3,0,0]=4 929 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)I)O)I 1626a_100020590264_100000034356 [0,1,0,0,0,0|3,0,0]=4 930 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)I)O)I 240690a_100020590264_100000034356 [0,1,0,0,0,0|3,0,0]=4 931 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)I)O)I 527a_100020590264_100000034356 [0,1,0,0,0,0|3,0,0]=4 932 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020590264_100009812877 [0,1,0,0,0,0|2,0,0]=3 933 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020590264_100000031928 [0,1,0,0,0,0|2,0,0]=3 934 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100020590264_100000031928 [0,1,0,0,0,0|2,0,0]=3 935 B16R1.3548 CSCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020590264_100000074654 [0,1,0,0,0,0|2,0,0]=3 936 B16R1.3548 Cc1c(cc(cc1O)C(=O)CCCC#N)O 1458a_100000031928_100000211468 [0,1,0,0,0,0|2,0,1]=4 937 B16R1.3548 Cc1c(cc(cc1O)C(=O)CCCCF)O 1458a_100000031928_100000729493 [0,1,0,0,0,0|2,0,0]=3 938 B16R1.3548 Cc1c(cc(cc1O)C(=O)CCCCO)O 1458a_100000031928_100000210776 [0,1,0,0,0,0|2,0,0]=3 939 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCC#N)O 240690a_100000720768_100000031928 [0,1,0,0,0,0|2,0,1]=4 940 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCC#N)O 527a_100000720768_100000031928 [0,1,0,0,0,0|2,0,1]=4 941 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCCF)O 240690a_100015189416_100000031928 [0,1,0,0,0,0|2,0,0]=3 942 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCCF)O 527a_100015189416_100000031928 [0,1,0,0,0,0|2,0,0]=3 943 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCCO)O 240690a_100000182051_100000031928 [0,1,0,0,0,0|2,0,0]=3 944 B16R1.3548 Cc1c(cc(cc1O)C(=O)NCCCO)O 527a_100000182051_100000031928 [0,1,0,0,0,0|2,0,0]=3 945 B16R1.3548 Cc1c(cc(cc1O)C(=O)NNCCO)O 22a_100000210001_100000031928 [0,1,0,0,0,0|3,0,0]=4 946 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)CCCCF 1458a_100011219978_100000729493 [0,1,0,0,0,0|3,0,0]=4 947 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)CCCCO 1458a_100011219978_100000210776 [0,1,0,0,0,0|3,0,0]=4 948 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)NCCCF 240690a_100015189416_100011219978 [0,1,0,0,0,0|3,0,0]=4 949 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)NCCCF 527a_100015189416_100011219978 [0,1,0,0,0,0|3,0,0]=4 950 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)NCCCO 240690a_100000182051_100011219978 [0,1,0,0,0,0|3,0,0]=4 951 B16R1.3548 Cc1cc(cc(c1O)C)C(=O)NCCCO 527a_100000182051_100011219978 [0,1,0,0,0,0|3,0,0]=4 952 B16R1.3548 N#CCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000211468 [0,1,0,0,0,0|2,0,1]=4 953 B16R1.3548 N#CCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000211468 [0,1,0,0,0,0|2,0,1]=4 954 B16R1.3548 N#CCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000211468 [0,1,0,0,0,0|2,0,1]=4 955 B16R1.3548 N#CCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000211468 [0,1,0,0,0,0|1,0,1]=3 956 B16R1.3548 N#CCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000720768_200009992764 [0,1,0,0,0,0|2,0,1]=4 957 B16R1.3548 N#CCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000720768_200000078382 [0,1,0,0,0,0|2,0,1]=4 958 B16R1.3548 N#CCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000720768_100009812877 [0,1,0,0,0,0|2,0,1]=4 959 B16R1.3548 N#CCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000720768_100000074654 [0,1,0,0,0,0|2,0,1]=4 960 B16R1.3548 O=C(CC#CCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000047223 [0,1,0,0,0,0|1,0,2]=4 961 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000729493 [0,1,0,0,0,0|3,0,0]=4 962 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000729493 [0,1,0,0,0,0|2,0,0]=3 963 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000729493 [0,1,0,0,0,0|3,0,0]=4 964 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000729493 [0,1,0,0,0,0|2,0,0]=3 965 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000729493 [0,1,0,0,0,0|3,0,0]=4 966 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000729493 [0,1,0,0,0,0|3,0,0]=4 967 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000729493 [0,1,0,0,0,0|3,0,0]=4 968 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000729493 [0,1,0,0,0,0|2,0,0]=3 969 B16R1.3548 O=C(CCCCF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000729493 [0,1,0,0,0,0|1,0,0]=2 970 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210776 [0,1,0,0,0,0|3,0,0]=4 971 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210776 [0,1,0,0,0,0|2,0,0]=3 972 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210776 [0,1,0,0,0,0|3,0,0]=4 973 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210776 [0,1,0,0,0,0|2,0,0]=3 974 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210776 [0,1,0,0,0,0|3,0,0]=4 975 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210776 [0,1,0,0,0,0|3,0,0]=4 976 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210776 [0,1,0,0,0,0|3,0,0]=4 977 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210776 [0,1,0,0,0,0|2,0,0]=3 978 B16R1.3548 O=C(CCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210776 [0,1,0,0,0,0|1,0,0]=2 979 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Br)O)Br 240690a_100015189416_100000692688 [0,1,0,0,0,0|3,0,0]=4 980 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Br)O)Br 527a_100015189416_100000692688 [0,1,0,0,0,0|3,0,0]=4 981 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Br)O)O 240690a_100015189416_200009992764 [0,1,0,0,0,0|2,0,0]=3 982 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Cl)O)Cl 240690a_100015189416_100000184433 [0,1,0,0,0,0|3,0,0]=4 983 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Cl)O)Cl 527a_100015189416_100000184433 [0,1,0,0,0,0|3,0,0]=4 984 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)Cl)O)O 240690a_100015189416_200000078382 [0,1,0,0,0,0|2,0,0]=3 985 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)F)F)O 240690a_100015189416_200000081825 [0,1,0,0,0,0|3,0,0]=4 986 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)F)O)F 240690a_100015189416_100000766045 [0,1,0,0,0,0|3,0,0]=4 987 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)F)O)F 527a_100015189416_100000766045 [0,1,0,0,0,0|3,0,0]=4 988 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)I)O)I 1626a_100015189416_100000034356 [0,1,0,0,0,0|3,0,0]=4 989 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)I)O)I 240690a_100015189416_100000034356 [0,1,0,0,0,0|3,0,0]=4 990 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)I)O)I 527a_100015189416_100000034356 [0,1,0,0,0,0|3,0,0]=4 991 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)O)Br)O 240690a_100015189416_100009812877 [0,1,0,0,0,0|2,0,0]=3 992 B16R1.3548 O=C(NCCCF)c1cc(c(c(c1)O)Cl)O 240690a_100015189416_100000074654 [0,1,0,0,0,0|2,0,0]=3 993 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Br)O)Br 240690a_100000182051_100000692688 [0,1,0,0,0,0|3,0,0]=4 994 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Br)O)Br 527a_100000182051_100000692688 [0,1,0,0,0,0|3,0,0]=4 995 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Br)O)O 240690a_100000182051_200009992764 [0,1,0,0,0,0|2,0,0]=3 996 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Cl)O)Cl 240690a_100000182051_100000184433 [0,1,0,0,0,0|3,0,0]=4 997 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Cl)O)Cl 527a_100000182051_100000184433 [0,1,0,0,0,0|3,0,0]=4 998 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000182051_200000078382 [0,1,0,0,0,0|2,0,0]=3 999 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)F)F)O 240690a_100000182051_200000081825 [0,1,0,0,0,0|3,0,0]=4 1000 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)F)O)F 240690a_100000182051_100000766045 [0,1,0,0,0,0|3,0,0]=4 1001 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)F)O)F 527a_100000182051_100000766045 [0,1,0,0,0,0|3,0,0]=4 1002 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)I)O)I 240690a_100000182051_100000034356 [0,1,0,0,0,0|3,0,0]=4 1003 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)I)O)I 527a_100000182051_100000034356 [0,1,0,0,0,0|3,0,0]=4 1004 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)O)Br)O 240690a_100000182051_100009812877 [0,1,0,0,0,0|2,0,0]=3 1005 B16R1.3548 O=C(NCCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000182051_100000074654 [0,1,0,0,0,0|2,0,0]=3 1006 B16R1.3548 O=C(NNCCO)c1cc(c(c(c1)Br)O)O 22a_100000210001_200009992764 [0,1,0,0,0,0|3,0,0]=4 1007 B16R1.3548 O=C(NNCCO)c1cc(c(c(c1)Cl)O)O 22a_100000210001_200000078382 [0,1,0,0,0,0|3,0,0]=4 1008 B16R1.3548 O=C(NNCCO)c1cc(c(c(c1)O)Br)O 22a_100000210001_100009812877 [0,1,0,0,0,0|3,0,0]=4 1009 B16R1.3548 O=C(NNCCO)c1cc(c(c(c1)O)Cl)O 22a_100000210001_100000074654 [0,1,0,0,0,0|3,0,0]=4 1010 B16R1.3548 O=C(NNCCO)c1cc(c(c(c1)O)O)O 22a_100000210001_100000212154 [0,1,0,0,0,0|2,0,0]=3 1011 B16R1.7626 CCCCC(=O)c1cc(c(c(c1F)F)O)F 1458a_100000088966_100000210211 [0,1,0,0,0,0|3,0,0]=4 1012 B16R1.7626 CCCCC(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_100000210211 [0,1,0,0,0,0|3,0,0]=4 1013 B16R1.7626 CCCNC(=O)c1cc(c(c(c1F)F)O)F 240690a_100020643023_100000088966 [0,1,0,0,0,0|3,0,0]=4 1014 B16R1.7626 CCCNC(=O)c1cc(c(c(c1F)O)F)F 240690a_100020643023_100000737090 [0,1,0,0,0,0|3,0,0]=4 1015 B16R1.14848 CCC(=O)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000747405 [0,1,0,0,0,0|2,0,1]=4 1016 B16R1.14848 CCC(=O)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000747405 [0,1,0,0,0,0|2,0,1]=4 1017 B16R1.14848 CCC(=O)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000747405 [0,1,0,0,0,0|2,0,1]=4 1018 B16R1.14848 CCC(=O)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000747405 [0,1,0,0,0,0|2,0,1]=4 1019 B16R1.14848 CCC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000747405 [0,1,0,0,0,0|1,0,1]=3 1020 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000748023 [0,1,0,0,0,0|3,0,0]=4 1021 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000748023 [0,1,0,0,0,0|2,0,0]=3 1022 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000748023 [0,1,0,0,0,0|3,0,0]=4 1023 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000748023 [0,1,0,0,0,0|3,0,0]=4 1024 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000748023 [0,1,0,0,0,0|2,0,0]=3 1025 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000748023 [0,1,0,0,0,0|3,0,0]=4 1026 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000748023 [0,1,0,0,0,0|3,0,0]=4 1027 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000748023 [0,1,0,0,0,0|3,0,0]=4 1028 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000748023 [0,1,0,0,0,0|2,0,0]=3 1029 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000748023 [0,1,0,0,0,0|2,0,0]=3 1030 B16R1.14848 CCC(C)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000748023 [0,1,0,0,0,0|1,0,0]=2 1031 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000209981_100000692688 [0,1,0,0,0,0|3,0,0]=4 1032 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Br)O)Br 527a_100000209981_100000692688 [0,1,0,0,0,0|3,0,0]=4 1033 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000209981_200009992764 [0,1,0,0,0,0|2,0,0]=3 1034 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)C)O)C 240690a_100000209981_100011219978 [0,1,0,0,0,0|3,0,0]=4 1035 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)C)O)C 527a_100000209981_100011219978 [0,1,0,0,0,0|3,0,0]=4 1036 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000209981_100000184433 [0,1,0,0,0,0|3,0,0]=4 1037 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000209981_100000184433 [0,1,0,0,0,0|3,0,0]=4 1038 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000209981_200000078382 [0,1,0,0,0,0|2,0,0]=3 1039 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)F)F)O 240690a_100000209981_200000081825 [0,1,0,0,0,0|3,0,0]=4 1040 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)F)O)F 240690a_100000209981_100000766045 [0,1,0,0,0,0|3,0,0]=4 1041 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)F)O)F 527a_100000209981_100000766045 [0,1,0,0,0,0|3,0,0]=4 1042 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)I)O)I 1626a_100000209981_100000034356 [0,1,0,0,0,0|3,0,0]=4 1043 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)I)O)I 240690a_100000209981_100000034356 [0,1,0,0,0,0|3,0,0]=4 1044 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)I)O)I 527a_100000209981_100000034356 [0,1,0,0,0,0|3,0,0]=4 1045 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000209981_100009812877 [0,1,0,0,0,0|2,0,0]=3 1046 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000209981_100000031928 [0,1,0,0,0,0|2,0,0]=3 1047 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000209981_100000031928 [0,1,0,0,0,0|2,0,0]=3 1048 B16R1.14848 CCC(C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000209981_100000074654 [0,1,0,0,0,0|2,0,0]=3 1049 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011218378 [0,1,0,0,0,0|3,0,0]=4 1050 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011218378 [0,1,0,0,0,0|2,0,0]=3 1051 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100011218378 [0,1,0,0,0,0|3,0,0]=4 1052 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011218378 [0,1,0,0,0,0|3,0,0]=4 1053 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011218378 [0,1,0,0,0,0|2,0,0]=3 1054 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011218378 [0,1,0,0,0,0|3,0,0]=4 1055 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011218378 [0,1,0,0,0,0|3,0,0]=4 1056 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011218378 [0,1,0,0,0,0|3,0,0]=4 1057 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011218378 [0,1,0,0,0,0|2,0,0]=3 1058 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011218378 [0,1,0,0,0,0|2,0,0]=3 1059 B16R1.14848 CCC(O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011218378 [0,1,0,0,0,0|1,0,0]=2 1060 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100009816398 [0,1,0,0,0,0|3,0,0]=4 1061 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100009816398 [0,1,0,0,0,0|2,0,0]=3 1062 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100009816398 [0,1,0,0,0,0|3,0,0]=4 1063 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100009816398 [0,1,0,0,0,0|3,0,0]=4 1064 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100009816398 [0,1,0,0,0,0|2,0,0]=3 1065 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100009816398 [0,1,0,0,0,0|3,0,0]=4 1066 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100009816398 [0,1,0,0,0,0|3,0,0]=4 1067 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100009816398 [0,1,0,0,0,0|3,0,0]=4 1068 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100009816398 [0,1,0,0,0,0|2,0,0]=3 1069 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100009816398 [0,1,0,0,0,0|2,0,0]=3 1070 B16R1.14848 CC[C@H](C)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009816398 [0,1,0,0,0,0|1,0,0]=2 1071 B16R1.14848 CNC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000183359 [0,1,0,0,0,0|2,0,1]=4 1072 B16R1.14848 COC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000747449 [0,1,0,0,0,0|2,0,1]=4 1073 B16R1.14848 C[C@@H](CO)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000059175 [0,1,0,0,0,0|3,0,0]=4 1074 B16R1.14848 C[C@@H](CO)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000059175 [0,1,0,0,0,0|3,0,0]=4 1075 B16R1.14848 C[C@@H](CO)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000059175 [0,1,0,0,0,0|3,0,0]=4 1076 B16R1.14848 C[C@@H](CO)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000059175 [0,1,0,0,0,0|2,0,0]=3 1077 B16R1.14848 C[C@H](CF)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100102880703_200009992764 [0,1,0,0,0,0|3,0,0]=4 1078 B16R1.14848 C[C@H](CF)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100102880703_200000078382 [0,1,0,0,0,0|3,0,0]=4 1079 B16R1.14848 C[C@H](CF)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100102880703_100009812877 [0,1,0,0,0,0|3,0,0]=4 1080 B16R1.14848 C[C@H](CF)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100102880703_100000074654 [0,1,0,0,0,0|3,0,0]=4 1081 B16R1.14848 C[C@H](CO)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000737577_200009992764 [0,1,0,0,0,0|3,0,0]=4 1082 B16R1.14848 C[C@H](CO)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000737577_200000078382 [0,1,0,0,0,0|3,0,0]=4 1083 B16R1.14848 C[C@H](CO)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000737577_100009812877 [0,1,0,0,0,0|3,0,0]=4 1084 B16R1.14848 C[C@H](CO)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000737577_100000074654 [0,1,0,0,0,0|3,0,0]=4 1085 B16R1.14848 Cc1c(cc(cc1O)C(=O)C[C@@H](C)CO)O 1458a_100000031928_100000059175 [0,1,0,0,0,0|3,0,0]=4 1086 B16R1.14848 Cc1c(cc(cc1O)C(=O)N[C@H](C)CF)O 240690a_100102880703_100000031928 [0,1,0,0,0,0|3,0,0]=4 1087 B16R1.14848 Cc1c(cc(cc1O)C(=O)N[C@H](C)CF)O 527a_100102880703_100000031928 [0,1,0,0,0,0|3,0,0]=4 1088 B16R1.14848 Cc1c(cc(cc1O)C(=O)N[C@H](C)CO)O 240690a_100000737577_100000031928 [0,1,0,0,0,0|3,0,0]=4 1089 B16R1.14848 Cc1c(cc(cc1O)C(=O)N[C@H](C)CO)O 527a_100000737577_100000031928 [0,1,0,0,0,0|3,0,0]=4 1090 B16R1.52957 C=C(C)CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000730704 [0,1,0,0,0,0|2,0,1]=4 1091 B16R1.52957 C=C(C)CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000730704 [0,1,0,0,0,0|2,0,1]=4 1092 B16R1.52957 C=C(C)CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000730704 [0,1,0,0,0,0|2,0,1]=4 1093 B16R1.52957 C=C(C)CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000730704 [0,1,0,0,0,0|2,0,1]=4 1094 B16R1.52957 C=C(C)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000730704 [0,1,0,0,0,0|1,0,1]=3 1095 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000765925_200009992764 [0,1,0,0,0,0|2,0,1]=4 1096 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000765925_200000078382 [0,1,0,0,0,0|2,0,1]=4 1097 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000765925_100009812877 [0,1,0,0,0,0|2,0,1]=4 1098 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000765925_100000031928 [0,1,0,0,0,0|2,0,1]=4 1099 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)O)C)O 527a_100000765925_100000031928 [0,1,0,0,0,0|2,0,1]=4 1100 B16R1.52957 C=C(C)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000765925_100000074654 [0,1,0,0,0,0|2,0,1]=4 1101 B16R1.52957 CC(=CCC(=O)c1cc(c(c(c1)O)O)O)C 1458a_100000212154_100000761012 [0,1,0,0,0,0|1,0,2]=4 1102 B16R1.52957 CC(=O)NNC(=O)c1cc(c(c(c1)O)O)O 22a_100000189765_100000212154 [0,1,0,0,0,0|2,0,1]=4 1103 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210312 [0,1,0,0,0,0|3,0,0]=4 1104 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210312 [0,1,0,0,0,0|2,0,0]=3 1105 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210312 [0,1,0,0,0,0|3,0,0]=4 1106 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210312 [0,1,0,0,0,0|2,0,0]=3 1107 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210312 [0,1,0,0,0,0|3,0,0]=4 1108 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210312 [0,1,0,0,0,0|3,0,0]=4 1109 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210312 [0,1,0,0,0,0|3,0,0]=4 1110 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210312 [0,1,0,0,0,0|2,0,0]=3 1111 B16R1.52957 CC(C)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210312 [0,1,0,0,0,0|1,0,0]=2 1112 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000210953_100000692688 [0,1,0,0,0,0|3,0,0]=4 1113 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100000210953_100000692688 [0,1,0,0,0,0|3,0,0]=4 1114 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000210953_200009992764 [0,1,0,0,0,0|2,0,0]=3 1115 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000210953_100000184433 [0,1,0,0,0,0|3,0,0]=4 1116 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000210953_100000184433 [0,1,0,0,0,0|3,0,0]=4 1117 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000210953_200000078382 [0,1,0,0,0,0|2,0,0]=3 1118 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)F)F)O 240690a_100000210953_200000081825 [0,1,0,0,0,0|3,0,0]=4 1119 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)F)O)F 240690a_100000210953_100000766045 [0,1,0,0,0,0|3,0,0]=4 1120 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)F)O)F 527a_100000210953_100000766045 [0,1,0,0,0,0|3,0,0]=4 1121 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)I)O)I 1626a_100000210953_100000034356 [0,1,0,0,0,0|3,0,0]=4 1122 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)I)O)I 240690a_100000210953_100000034356 [0,1,0,0,0,0|3,0,0]=4 1123 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)I)O)I 527a_100000210953_100000034356 [0,1,0,0,0,0|3,0,0]=4 1124 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000210953_100009812877 [0,1,0,0,0,0|2,0,0]=3 1125 B16R1.52957 CC(C)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000210953_100000074654 [0,1,0,0,0,0|2,0,0]=3 1126 B16R1.52957 CC(C)NNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000741168_200009992764 [0,1,0,0,0,0|3,0,0]=4 1127 B16R1.52957 CC(C)NNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000741168_200000078382 [0,1,0,0,0,0|3,0,0]=4 1128 B16R1.52957 CC(C)NNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000741168_100009812877 [0,1,0,0,0,0|3,0,0]=4 1129 B16R1.52957 CC(C)NNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000741168_100000074654 [0,1,0,0,0,0|3,0,0]=4 1130 B16R1.52957 CC(C)NNC(=O)c1cc(c(c(c1)O)O)O 22a_100000741168_100000212154 [0,1,0,0,0,0|2,0,0]=3 1131 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100012276601 [0,1,0,0,0,0|3,0,0]=4 1132 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100012276601 [0,1,0,0,0,0|2,0,0]=3 1133 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100012276601 [0,1,0,0,0,0|3,0,0]=4 1134 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100012276601 [0,1,0,0,0,0|2,0,0]=3 1135 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100012276601 [0,1,0,0,0,0|3,0,0]=4 1136 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100012276601 [0,1,0,0,0,0|3,0,0]=4 1137 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100012276601 [0,1,0,0,0,0|3,0,0]=4 1138 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100012276601 [0,1,0,0,0,0|2,0,0]=3 1139 B16R1.52957 CC(O)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100012276601 [0,1,0,0,0,0|1,0,0]=2 1140 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000210904_100000692688 [0,1,0,0,0,0|3,0,0]=4 1141 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Br)O)Br 527a_100000210904_100000692688 [0,1,0,0,0,0|3,0,0]=4 1142 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000210904_200009992764 [0,1,0,0,0,0|2,0,0]=3 1143 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000210904_100000184433 [0,1,0,0,0,0|3,0,0]=4 1144 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000210904_100000184433 [0,1,0,0,0,0|3,0,0]=4 1145 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000210904_200000078382 [0,1,0,0,0,0|2,0,0]=3 1146 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)F)F)O 240690a_100000210904_200000081825 [0,1,0,0,0,0|3,0,0]=4 1147 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)F)O)F 240690a_100000210904_100000766045 [0,1,0,0,0,0|3,0,0]=4 1148 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)F)O)F 527a_100000210904_100000766045 [0,1,0,0,0,0|3,0,0]=4 1149 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)I)O)I 240690a_100000210904_100000034356 [0,1,0,0,0,0|3,0,0]=4 1150 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)I)O)I 527a_100000210904_100000034356 [0,1,0,0,0,0|3,0,0]=4 1151 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000210904_100009812877 [0,1,0,0,0,0|2,0,0]=3 1152 B16R1.52957 CC(O)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000210904_100000074654 [0,1,0,0,0,0|2,0,0]=3 1153 B16R1.52957 Cc1c(cc(cc1O)C(=O)CCC(C)C)O 1458a_100000031928_100000210312 [0,1,0,0,0,0|2,0,0]=3 1154 B16R1.52957 Cc1c(cc(cc1O)C(=O)CCC(C)O)O 1458a_100000031928_100012276601 [0,1,0,0,0,0|2,0,0]=3 1155 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(C)C)O 240690a_100000210953_100000031928 [0,1,0,0,0,0|2,0,0]=3 1156 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(C)C)O 527a_100000210953_100000031928 [0,1,0,0,0,0|2,0,0]=3 1157 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(C)O)O 240690a_100000210904_100000031928 [0,1,0,0,0,0|2,0,0]=3 1158 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(C)O)O 527a_100000210904_100000031928 [0,1,0,0,0,0|2,0,0]=3 1159 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(F)F)O 240690a_100000765723_100000031928 [0,1,0,0,0,0|3,0,0]=4 1160 B16R1.52957 Cc1c(cc(cc1O)C(=O)NCC(F)F)O 527a_100000765723_100000031928 [0,1,0,0,0,0|3,0,0]=4 1161 B16R1.52957 Cc1c(cc(cc1O)C(=O)NNC(C)C)O 22a_100000741168_100000031928 [0,1,0,0,0,0|3,0,0]=4 1162 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)CCC(C)C 1458a_100011219978_100000210312 [0,1,0,0,0,0|3,0,0]=4 1163 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)CCC(C)O 1458a_100011219978_100012276601 [0,1,0,0,0,0|3,0,0]=4 1164 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)NCC(C)C 240690a_100000210953_100011219978 [0,1,0,0,0,0|3,0,0]=4 1165 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)NCC(C)C 527a_100000210953_100011219978 [0,1,0,0,0,0|3,0,0]=4 1166 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)NCC(C)O 240690a_100000210904_100011219978 [0,1,0,0,0,0|3,0,0]=4 1167 B16R1.52957 Cc1cc(cc(c1O)C)C(=O)NCC(C)O 527a_100000210904_100011219978 [0,1,0,0,0,0|3,0,0]=4 1168 B16R1.52957 O=C(NCC(F)F)c1cc(c(c(c1)Br)O)O 240690a_100000765723_200009992764 [0,1,0,0,0,0|3,0,0]=4 1169 B16R1.52957 O=C(NCC(F)F)c1cc(c(c(c1)Cl)O)O 240690a_100000765723_200000078382 [0,1,0,0,0,0|3,0,0]=4 1170 B16R1.52957 O=C(NCC(F)F)c1cc(c(c(c1)O)Br)O 240690a_100000765723_100009812877 [0,1,0,0,0,0|3,0,0]=4 1171 B16R1.52957 O=C(NCC(F)F)c1cc(c(c(c1)O)Cl)O 240690a_100000765723_100000074654 [0,1,0,0,0,0|3,0,0]=4 1172 B16R1.66350 CC(CC#N)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009813641 [0,1,0,0,0,0|2,0,1]=4 1173 B16R1.66350 CC(CCO)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100009893172 [0,1,0,0,0,0|3,0,0]=4 1174 B16R1.66350 CC(CCO)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100009893172 [0,1,0,0,0,0|3,0,0]=4 1175 B16R1.66350 CC(CCO)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100009893172 [0,1,0,0,0,0|3,0,0]=4 1176 B16R1.66350 CC(CCO)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009893172 [0,1,0,0,0,0|2,0,0]=3 1177 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000766640 [0,1,0,0,0,0|3,0,0]=4 1178 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000766640 [0,1,0,0,0,0|2,0,0]=3 1179 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000766640 [0,1,0,0,0,0|3,0,0]=4 1180 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000766640 [0,1,0,0,0,0|3,0,0]=4 1181 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000766640 [0,1,0,0,0,0|2,0,0]=3 1182 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000766640 [0,1,0,0,0,0|3,0,0]=4 1183 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000766640 [0,1,0,0,0,0|3,0,0]=4 1184 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000766640 [0,1,0,0,0,0|3,0,0]=4 1185 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000766640 [0,1,0,0,0,0|2,0,0]=3 1186 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000766640 [0,1,0,0,0,0|2,0,0]=3 1187 B16R1.66350 CCCC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000766640 [0,1,0,0,0,0|1,0,0]=2 1188 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Br)O)Br 240690a_100000747261_100000692688 [0,1,0,0,0,0|3,0,0]=4 1189 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Br)O)Br 527a_100000747261_100000692688 [0,1,0,0,0,0|3,0,0]=4 1190 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000747261_200009992764 [0,1,0,0,0,0|2,0,0]=3 1191 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)C)O)C 240690a_100000747261_100011219978 [0,1,0,0,0,0|3,0,0]=4 1192 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)C)O)C 527a_100000747261_100011219978 [0,1,0,0,0,0|3,0,0]=4 1193 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Cl)O)Cl 240690a_100000747261_100000184433 [0,1,0,0,0,0|3,0,0]=4 1194 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Cl)O)Cl 527a_100000747261_100000184433 [0,1,0,0,0,0|3,0,0]=4 1195 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000747261_200000078382 [0,1,0,0,0,0|2,0,0]=3 1196 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)F)F)O 240690a_100000747261_200000081825 [0,1,0,0,0,0|3,0,0]=4 1197 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)F)O)F 240690a_100000747261_100000766045 [0,1,0,0,0,0|3,0,0]=4 1198 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)F)O)F 527a_100000747261_100000766045 [0,1,0,0,0,0|3,0,0]=4 1199 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)I)O)I 1626a_100000747261_100000034356 [0,1,0,0,0,0|3,0,0]=4 1200 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)I)O)I 240690a_100000747261_100000034356 [0,1,0,0,0,0|3,0,0]=4 1201 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)I)O)I 527a_100000747261_100000034356 [0,1,0,0,0,0|3,0,0]=4 1202 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000747261_100009812877 [0,1,0,0,0,0|2,0,0]=3 1203 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)O)C)O 240690a_100000747261_100000031928 [0,1,0,0,0,0|2,0,0]=3 1204 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)O)C)O 527a_100000747261_100000031928 [0,1,0,0,0,0|2,0,0]=3 1205 B16R1.66350 CCCN(C)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000747261_100000074654 [0,1,0,0,0,0|2,0,0]=3 1206 B16R1.66350 CN(CCO)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000210263_200009992764 [0,1,0,0,0,0|3,0,0]=4 1207 B16R1.66350 CN(CCO)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000210263_200000078382 [0,1,0,0,0,0|3,0,0]=4 1208 B16R1.66350 CN(CCO)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000210263_100009812877 [0,1,0,0,0,0|3,0,0]=4 1209 B16R1.66350 CN(CCO)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000210263_100000074654 [0,1,0,0,0,0|3,0,0]=4 1210 B16R1.66350 COCC(C)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000765312 [0,1,0,0,0,0|3,0,0]=4 1211 B16R1.66350 COCC(C)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000765312 [0,1,0,0,0,0|3,0,0]=4 1212 B16R1.66350 COCC(C)C(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000765312 [0,1,0,0,0,0|3,0,0]=4 1213 B16R1.66350 COCC(C)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000765312 [0,1,0,0,0,0|3,0,0]=4 1214 B16R1.66350 COCC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000765312 [0,1,0,0,0,0|2,0,0]=3 1215 B16R1.66350 Cc1c(cc(cc1O)C(=O)C(C)CCO)O 1458a_100000031928_100009893172 [0,1,0,0,0,0|3,0,0]=4 1216 B16R1.66350 Cc1c(cc(cc1O)C(=O)N(C)CCO)O 240690a_100000210263_100000031928 [0,1,0,0,0,0|3,0,0]=4 1217 B16R1.66350 Cc1c(cc(cc1O)C(=O)N(C)CCO)O 527a_100000210263_100000031928 [0,1,0,0,0,0|3,0,0]=4 1218 B16R1.89785 C#CCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000753159 [0,1,0,0,0,0|1,0,2]=4 1219 B16R1.89785 C/C=C/CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100102629194 [0,1,0,0,0,0|1,0,2]=4 1220 B16R1.89785 C=CCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000754431 [0,1,0,0,0,0|1,0,2]=4 1221 B16R1.89785 CC#CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000748600 [0,1,0,0,0,0|1,0,2]=4 1222 B16R1.89785 CC=CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000070051 [0,1,0,0,0,0|1,0,2]=4 1223 B16R1.89785 CCCCC(=O)c1cc(c(c(c1)OC)Cl)Br 1458a_100020639751_100000210211 [0,1,0,0,0,0|3,0,0]=4 1224 B16R1.89785 CCCCC(=O)c1cc(c(c(c1)OC)F)F 1458a_100000081826_100000210211 [0,1,0,0,0,0|3,0,0]=4 1225 B16R1.89785 CCCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000210211 [0,1,0,0,0,0|2,0,0]=3 1226 B16R1.89785 CCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210211 [0,1,0,0,0,0|1,0,0]=2 1227 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)Cl)Br 11a_100020643023_100020639751 [0,1,0,0,0,0|3,0,0]=4 1228 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)Cl)Br 1626a_100020643023_100020639751 [0,1,0,0,0,0|3,0,0]=4 1229 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)Cl)Br 240690a_100020643023_100020639751 [0,1,0,0,0,0|3,0,0]=4 1230 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)Cl)Br 527a_100020643023_100020639751 [0,1,0,0,0,0|3,0,0]=4 1231 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)F)F 11a_100020643023_100000081826 [0,1,0,0,0,0|3,0,0]=4 1232 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)F)F 1626a_100020643023_100000081826 [0,1,0,0,0,0|3,0,0]=4 1233 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)F)F 240690a_100020643023_100000081826 [0,1,0,0,0,0|3,0,0]=4 1234 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)F)F 527a_100020643023_100000081826 [0,1,0,0,0,0|3,0,0]=4 1235 B16R1.89785 CCCNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100020643023_100000209947 [0,1,0,0,0,0|2,0,0]=3 1236 B16R1.89785 CCNNC(=O)c1cc(c(c(c1)OC)O)Cl 22a_100000756455_100000209947 [0,1,0,0,0,0|3,0,0]=4 1237 B16R1.89785 CCNNC(=O)c1cc(c(c(c1)OC)O)O 22a_100000756455_100000061230 [0,1,0,0,0,0|2,0,0]=3 1238 B16R1.89785 COCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000233755 [0,1,0,0,0,0|3,0,0]=4 1239 B16R1.89785 COCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000233755 [0,1,0,0,0,0|2,0,0]=3 1240 B16R1.89785 COc1cc(cc(c1O)Cl)C(=O)CCCF 1458a_100000209947_100011934791 [0,1,0,0,0,0|3,0,0]=4 1241 B16R1.89785 COc1cc(cc(c1O)Cl)C(=O)CCCO 1458a_100000209947_100011215043 [0,1,0,0,0,0|3,0,0]=4 1242 B16R1.89785 COc1cc(cc(c1O)Cl)C(=O)CCSC 1458a_100000209947_100000751147 [0,1,0,0,0,0|3,0,0]=4 1243 B16R1.89785 COc1cc(cc(c1O)Cl)C(=O)NCCF 240690a_100000724931_100000209947 [0,1,0,0,0,0|3,0,0]=4 1244 B16R1.89785 COc1cc(cc(c1O)Cl)C(=O)NCCO 240690a_100000210304_100000209947 [0,1,0,0,0,0|3,0,0]=4 1245 B16R1.89785 COc1cc(cc(c1O)O)C(=O)CCC#N 1458a_100000061230_100011215226 [0,1,0,0,0,0|2,0,1]=4 1246 B16R1.89785 COc1cc(cc(c1O)O)C(=O)CCCF 1458a_100000061230_100011934791 [0,1,0,0,0,0|2,0,0]=3 1247 B16R1.89785 COc1cc(cc(c1O)O)C(=O)CCCO 1458a_100000061230_100011215043 [0,1,0,0,0,0|2,0,0]=3 1248 B16R1.89785 COc1cc(cc(c1O)O)C(=O)CCSC 1458a_100000061230_100000751147 [0,1,0,0,0,0|2,0,0]=3 1249 B16R1.89786 C#CCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000753159 [0,1,0,0,0,0|1,0,2]=4 1250 B16R1.89786 C/C=C/CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100102629194 [0,1,0,0,0,0|1,0,2]=4 1251 B16R1.89786 C=CCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000754431 [0,1,0,0,0,0|1,0,2]=4 1252 B16R1.89786 CC#CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000748600 [0,1,0,0,0,0|1,0,2]=4 1253 B16R1.89786 CC=CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000070051 [0,1,0,0,0,0|1,0,2]=4 1254 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)Br)OC)Br 1458a_100012337705_100000210211 [0,1,0,0,0,0|3,0,0]=4 1255 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000210211 [0,1,0,0,0,0|2,0,0]=3 1256 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)C)OC)C 1458a_100000696790_100000210211 [0,1,0,0,0,0|3,0,0]=4 1257 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)Cl)OC)Cl 1458a_100000013545_100000210211 [0,1,0,0,0,0|3,0,0]=4 1258 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)Cl)OC)F 1458a_100011356498_100000210211 [0,1,0,0,0,0|3,0,0]=4 1259 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)F)CO)F 1458a_200009844098_100000210211 [0,1,0,0,0,0|3,0,0]=4 1260 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)F)OC)F 1458a_100011216840_100000210211 [0,1,0,0,0,0|3,0,0]=4 1261 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)I)OC)F 1458a_100012920440_100000210211 [0,1,0,0,0,0|3,0,0]=4 1262 B16R1.89786 CCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000210211 [0,1,0,0,0,0|1,0,0]=2 1263 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)Br 11a_100020643023_100012337705 [0,1,0,0,0,0|3,0,0]=4 1264 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)Br 1626a_100020643023_100012337705 [0,1,0,0,0,0|3,0,0]=4 1265 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)Br 240690a_100020643023_100012337705 [0,1,0,0,0,0|3,0,0]=4 1266 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)Br 527a_100020643023_100012337705 [0,1,0,0,0,0|3,0,0]=4 1267 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100020643023_100010760816 [0,1,0,0,0,0|2,0,0]=3 1268 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Br)OC)O 527a_100020643023_100010760816 [0,1,0,0,0,0|2,0,0]=3 1269 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)C)OC)C 11a_100020643023_100000696790 [0,1,0,0,0,0|3,0,0]=4 1270 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)C)OC)C 1626a_100020643023_100000696790 [0,1,0,0,0,0|3,0,0]=4 1271 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)C)OC)C 240690a_100020643023_100000696790 [0,1,0,0,0,0|3,0,0]=4 1272 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)C)OC)C 527a_100020643023_100000696790 [0,1,0,0,0,0|3,0,0]=4 1273 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)Cl 11a_100020643023_100000013545 [0,1,0,0,0,0|3,0,0]=4 1274 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)Cl 1626a_100020643023_100000013545 [0,1,0,0,0,0|3,0,0]=4 1275 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)Cl 240690a_100020643023_100000013545 [0,1,0,0,0,0|3,0,0]=4 1276 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)Cl 527a_100020643023_100000013545 [0,1,0,0,0,0|3,0,0]=4 1277 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)F 11a_100020643023_100011356498 [0,1,0,0,0,0|3,0,0]=4 1278 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)F 1626a_100020643023_100011356498 [0,1,0,0,0,0|3,0,0]=4 1279 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)F 240690a_100020643023_100011356498 [0,1,0,0,0,0|3,0,0]=4 1280 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)Cl)OC)F 527a_100020643023_100011356498 [0,1,0,0,0,0|3,0,0]=4 1281 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)CO)F 11a_100020643023_200009844098 [0,1,0,0,0,0|3,0,0]=4 1282 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)CO)F 1626a_100020643023_200009844098 [0,1,0,0,0,0|3,0,0]=4 1283 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)CO)F 240690a_100020643023_200009844098 [0,1,0,0,0,0|3,0,0]=4 1284 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)CO)F 527a_100020643023_200009844098 [0,1,0,0,0,0|3,0,0]=4 1285 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)OC)F 11a_100020643023_100011216840 [0,1,0,0,0,0|3,0,0]=4 1286 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)OC)F 1626a_100020643023_100011216840 [0,1,0,0,0,0|3,0,0]=4 1287 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)OC)F 240690a_100020643023_100011216840 [0,1,0,0,0,0|3,0,0]=4 1288 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)F)OC)F 527a_100020643023_100011216840 [0,1,0,0,0,0|3,0,0]=4 1289 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)I)OC)F 11a_100020643023_100012920440 [0,1,0,0,0,0|3,0,0]=4 1290 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)I)OC)F 1626a_100020643023_100012920440 [0,1,0,0,0,0|3,0,0]=4 1291 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)I)OC)F 240690a_100020643023_100012920440 [0,1,0,0,0,0|3,0,0]=4 1292 B16R1.89786 CCCNC(=O)c1cc(c(c(c1)I)OC)F 527a_100020643023_100012920440 [0,1,0,0,0,0|3,0,0]=4 1293 B16R1.89786 CCNNC(=O)c1cc(c(c(c1)Br)OC)O 22a_100000756455_100010760816 [0,1,0,0,0,0|3,0,0]=4 1294 B16R1.89786 CCNNC(=O)c1cc(c(c(c1)O)OC)O 22a_100000756455_100000073573 [0,1,0,0,0,0|2,0,0]=3 1295 B16R1.89786 COCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000233755 [0,1,0,0,0,0|3,0,0]=4 1296 B16R1.89786 COCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000233755 [0,1,0,0,0,0|2,0,0]=3 1297 B16R1.89786 COc1c(cc(cc1Br)C(=O)CCCF)O 1458a_100010760816_100011934791 [0,1,0,0,0,0|3,0,0]=4 1298 B16R1.89786 COc1c(cc(cc1Br)C(=O)CCCO)O 1458a_100010760816_100011215043 [0,1,0,0,0,0|3,0,0]=4 1299 B16R1.89786 COc1c(cc(cc1Br)C(=O)CCSC)O 1458a_100010760816_100000751147 [0,1,0,0,0,0|3,0,0]=4 1300 B16R1.89786 COc1c(cc(cc1Br)C(=O)NCCF)O 240690a_100000724931_100010760816 [0,1,0,0,0,0|3,0,0]=4 1301 B16R1.89786 COc1c(cc(cc1Br)C(=O)NCCF)O 527a_100000724931_100010760816 [0,1,0,0,0,0|3,0,0]=4 1302 B16R1.89786 COc1c(cc(cc1Br)C(=O)NCCO)O 240690a_100000210304_100010760816 [0,1,0,0,0,0|3,0,0]=4 1303 B16R1.89786 COc1c(cc(cc1Br)C(=O)NCCO)O 527a_100000210304_100010760816 [0,1,0,0,0,0|3,0,0]=4 1304 B16R1.89786 COc1c(cc(cc1O)C(=O)CCC#N)O 1458a_100000073573_100011215226 [0,1,0,0,0,0|2,0,1]=4 1305 B16R1.89786 COc1c(cc(cc1O)C(=O)CCCF)O 1458a_100000073573_100011934791 [0,1,0,0,0,0|2,0,0]=3 1306 B16R1.89786 COc1c(cc(cc1O)C(=O)CCCO)O 1458a_100000073573_100011215043 [0,1,0,0,0,0|2,0,0]=3 1307 B16R1.89786 COc1c(cc(cc1O)C(=O)CCSC)O 1458a_100000073573_100000751147 [0,1,0,0,0,0|2,0,0]=3 1308 B16R2.22304 Cc1cc(cc(c1N)O)C2=CCCCO2 271570a_100010177797_100010371313 [0,0,0,1,0,0|3,0,0]=4 1309 B16R2.22304 Cc1cc(cc(c1O)Br)C2=CCCCO2 271570a_100010177797_100010982682 [0,0,0,1,0,0|3,0,0]=4 1310 B16R2.22304 Cc1cc(cc(c1O)C)C2=CCCCO2 271570a_100010177797_100000187306 [0,0,0,1,0,0|3,0,0]=4 1311 B16R2.22304 Cc1cc(cc(c1O)Cl)C2=CCCCO2 271570a_100010177797_200015900153 [0,0,0,1,0,0|3,0,0]=4 1312 B16R2.22304 Cc1cc(cc(c1O)N)C2=CCCCO2 271570a_100010177797_100011825904 [0,0,0,1,0,0|3,0,0]=4 1313 B16R2.22304 Nc1c(cc(cc1F)C2=CCCCO2)O 271570a_100010177797_100015475841 [0,0,0,1,0,0|3,0,0]=4 1314 B16R2.22304 Nc1cc(cc(c1O)F)C2=CCCCO2 271570a_100010177797_100011217383 [0,0,0,1,0,0|3,0,0]=4 1315 B16R2.22304 Oc1c(cc(cc1Cl)C2=CCCCO2)Cl 271570a_100010177797_100012339652 [0,0,0,1,0,0|3,0,0]=4 1316 B16R2.22304 Oc1c(cc(cc1F)C2=CCCCO2)F 271570a_100010177797_100011216917 [0,0,0,1,0,0|3,0,0]=4 1317 B16R2.22304 Oc1cc(cc(c1F)F)C2=CCCCO2 271570a_100010177797_100000709865 [0,0,0,1,0,0|3,0,0]=4 1318 B16R2.79225 Cc1noc(n1)c2cc(c(c(c2)O)O)O 270196a_100000212224_100000212154 [0,0,0,1,0,0|2,0,1]=4 1319 B16R2.338810 Cc1c(cc(cc1O)C(=O)C2CCC2)O 1458a_100000031928_100000749161 [0,0,0,1,0,0|2,0,0]=3 1320 B16R2.338810 Cc1c(cc(cc1O)C(=O)C2COC2)O 1458a_100000031928_100000687716 [0,0,0,1,0,0|3,0,0]=4 1321 B16R2.338810 Cc1c(cc(cc1O)C(=O)N2CCC2)O 240690a_100000754969_100000031928 [0,0,0,1,0,0|2,0,0]=3 1322 B16R2.338810 Cc1c(cc(cc1O)C(=O)N2CCC2)O 527a_100000754969_100000031928 [0,0,0,1,0,0|2,0,0]=3 1323 B16R2.338810 Cc1cc(cc(c1O)C)C(=O)C2CCC2 1458a_100011219978_100000749161 [0,0,0,1,0,0|3,0,0]=4 1324 B16R2.338810 Cc1cc(cc(c1O)C)C(=O)N2CCC2 240690a_100000754969_100011219978 [0,0,0,1,0,0|3,0,0]=4 1325 B16R2.338810 Cc1cc(cc(c1O)C)C(=O)N2CCC2 527a_100000754969_100011219978 [0,0,0,1,0,0|3,0,0]=4 1326 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)Br)C2CCC2 1458a_100000692688_100000749161 [0,0,0,1,0,0|3,0,0]=4 1327 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)Br)N2CCC2 240690a_100000754969_100000692688 [0,0,0,1,0,0|3,0,0]=4 1328 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)Br)N2CCC2 527a_100000754969_100000692688 [0,0,0,1,0,0|3,0,0]=4 1329 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)O)C2CCC2 1458a_200009992764_100000749161 [0,0,0,1,0,0|2,0,0]=3 1330 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)O)C2COC2 1458a_200009992764_100000687716 [0,0,0,1,0,0|3,0,0]=4 1331 B16R2.338810 O=C(c1cc(c(c(c1)Br)O)O)N2CCC2 240690a_100000754969_200009992764 [0,0,0,1,0,0|2,0,0]=3 1332 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)Cl)C2CCC2 1458a_100000184433_100000749161 [0,0,0,1,0,0|3,0,0]=4 1333 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)Cl)N2CCC2 240690a_100000754969_100000184433 [0,0,0,1,0,0|3,0,0]=4 1334 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)Cl)N2CCC2 527a_100000754969_100000184433 [0,0,0,1,0,0|3,0,0]=4 1335 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)O)C2CCC2 1458a_200000078382_100000749161 [0,0,0,1,0,0|2,0,0]=3 1336 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)O)C2COC2 1458a_200000078382_100000687716 [0,0,0,1,0,0|3,0,0]=4 1337 B16R2.338810 O=C(c1cc(c(c(c1)Cl)O)O)N2CCC2 240690a_100000754969_200000078382 [0,0,0,1,0,0|2,0,0]=3 1338 B16R2.338810 O=C(c1cc(c(c(c1)F)F)O)C2CCC2 1458a_200000081825_100000749161 [0,0,0,1,0,0|3,0,0]=4 1339 B16R2.338810 O=C(c1cc(c(c(c1)F)F)O)N2CCC2 240690a_100000754969_200000081825 [0,0,0,1,0,0|3,0,0]=4 1340 B16R2.338810 O=C(c1cc(c(c(c1)F)O)F)C2CCC2 1458a_100000766045_100000749161 [0,0,0,1,0,0|3,0,0]=4 1341 B16R2.338810 O=C(c1cc(c(c(c1)F)O)F)N2CCC2 240690a_100000754969_100000766045 [0,0,0,1,0,0|3,0,0]=4 1342 B16R2.338810 O=C(c1cc(c(c(c1)F)O)F)N2CCC2 527a_100000754969_100000766045 [0,0,0,1,0,0|3,0,0]=4 1343 B16R2.338810 O=C(c1cc(c(c(c1)I)O)I)C2CCC2 1458a_100000034356_100000749161 [0,0,0,1,0,0|3,0,0]=4 1344 B16R2.338810 O=C(c1cc(c(c(c1)I)O)I)N2CCC2 240690a_100000754969_100000034356 [0,0,0,1,0,0|3,0,0]=4 1345 B16R2.338810 O=C(c1cc(c(c(c1)I)O)I)N2CCC2 527a_100000754969_100000034356 [0,0,0,1,0,0|3,0,0]=4 1346 B16R2.338810 O=C(c1cc(c(c(c1)O)Br)O)N2CCC2 240690a_100000754969_100009812877 [0,0,0,1,0,0|2,0,0]=3 1347 B16R2.338810 O=C(c1cc(c(c(c1)O)Cl)O)C2CCC2 1458a_100000074654_100000749161 [0,0,0,1,0,0|2,0,0]=3 1348 B16R2.338810 O=C(c1cc(c(c(c1)O)Cl)O)C2COC2 1458a_100000074654_100000687716 [0,0,0,1,0,0|3,0,0]=4 1349 B16R2.338810 O=C(c1cc(c(c(c1)O)Cl)O)N2CCC2 240690a_100000754969_100000074654 [0,0,0,1,0,0|2,0,0]=3 1350 B16R2.338810 O=C(c1cc(c(c(c1)O)O)O)C2CCC2 1458a_100000212154_100000749161 [0,0,0,1,0,0|1,0,0]=2 1351 B16R2.338810 O=C(c1cc(c(c(c1)O)O)O)C2COC2 1458a_100000212154_100000687716 [0,0,0,1,0,0|2,0,0]=3 1352 B16R2.375760 Cc1c(cc(cc1O)C(=O)CC2CC2)O 1458a_100000031928_100000742324 [0,0,0,1,0,0|2,0,0]=3 1353 B16R2.375760 Cc1c(cc(cc1O)C(=O)CC2CO2)O 1458a_100000031928_100011216344 [0,0,0,1,0,0|3,0,0]=4 1354 B16R2.375760 Cc1c(cc(cc1O)C(=O)CC2CS2)O 1458a_100000031928_100000031435 [0,0,0,1,0,0|3,0,0]=4 1355 B16R2.375760 Cc1c(cc(cc1O)C(=O)C[C@@H]2CO2)O 1458a_100000031928_100000745022 [0,0,0,1,0,0|3,0,0]=4 1356 B16R2.375760 Cc1c(cc(cc1O)C(=O)NC2CC2)O 240690a_100000212008_100000031928 [0,0,0,1,0,0|2,0,0]=3 1357 B16R2.375760 Cc1c(cc(cc1O)C(=O)NC2CC2)O 527a_100000212008_100000031928 [0,0,0,1,0,0|2,0,0]=3 1358 B16R2.375760 Cc1cc(cc(c1O)C)C(=O)CC2CC2 1458a_100011219978_100000742324 [0,0,0,1,0,0|3,0,0]=4 1359 B16R2.375760 Cc1cc(cc(c1O)C)C(=O)NC2CC2 240690a_100000212008_100011219978 [0,0,0,1,0,0|3,0,0]=4 1360 B16R2.375760 Cc1cc(cc(c1O)C)C(=O)NC2CC2 527a_100000212008_100011219978 [0,0,0,1,0,0|3,0,0]=4 1361 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)Br)O)Br 1458a_100000692688_100000742324 [0,0,0,1,0,0|3,0,0]=4 1362 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000742324 [0,0,0,1,0,0|2,0,0]=3 1363 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)Cl)O)Cl 1458a_100000184433_100000742324 [0,0,0,1,0,0|3,0,0]=4 1364 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000742324 [0,0,0,1,0,0|2,0,0]=3 1365 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)F)F)O 1458a_200000081825_100000742324 [0,0,0,1,0,0|3,0,0]=4 1366 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)F)O)F 1458a_100000766045_100000742324 [0,0,0,1,0,0|3,0,0]=4 1367 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)I)O)I 1458a_100000034356_100000742324 [0,0,0,1,0,0|3,0,0]=4 1368 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000742324 [0,0,0,1,0,0|2,0,0]=3 1369 B16R2.375760 O=C(CC1CC1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000742324 [0,0,0,1,0,0|1,0,0]=2 1370 B16R2.375760 O=C(CC1CO1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100011216344 [0,0,0,1,0,0|3,0,0]=4 1371 B16R2.375760 O=C(CC1CO1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100011216344 [0,0,0,1,0,0|3,0,0]=4 1372 B16R2.375760 O=C(CC1CO1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100011216344 [0,0,0,1,0,0|3,0,0]=4 1373 B16R2.375760 O=C(CC1CO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100011216344 [0,0,0,1,0,0|2,0,0]=3 1374 B16R2.375760 O=C(CC1CS1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000031435 [0,0,0,1,0,0|3,0,0]=4 1375 B16R2.375760 O=C(CC1CS1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000031435 [0,0,0,1,0,0|3,0,0]=4 1376 B16R2.375760 O=C(CC1CS1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000031435 [0,0,0,1,0,0|3,0,0]=4 1377 B16R2.375760 O=C(CC1CS1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000031435 [0,0,0,1,0,0|2,0,0]=3 1378 B16R2.375760 O=C(C[C@@H]1CO1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000745022 [0,0,0,1,0,0|3,0,0]=4 1379 B16R2.375760 O=C(C[C@@H]1CO1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000745022 [0,0,0,1,0,0|3,0,0]=4 1380 B16R2.375760 O=C(C[C@@H]1CO1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000745022 [0,0,0,1,0,0|3,0,0]=4 1381 B16R2.375760 O=C(C[C@@H]1CO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000745022 [0,0,0,1,0,0|2,0,0]=3 1382 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Br)O)Br 240690a_100000212008_100000692688 [0,0,0,1,0,0|3,0,0]=4 1383 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Br)O)Br 527a_100000212008_100000692688 [0,0,0,1,0,0|3,0,0]=4 1384 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Br)O)O 240690a_100000212008_200009992764 [0,0,0,1,0,0|2,0,0]=3 1385 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Cl)O)Cl 240690a_100000212008_100000184433 [0,0,0,1,0,0|3,0,0]=4 1386 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Cl)O)Cl 527a_100000212008_100000184433 [0,0,0,1,0,0|3,0,0]=4 1387 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)Cl)O)O 240690a_100000212008_200000078382 [0,0,0,1,0,0|2,0,0]=3 1388 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)F)F)O 240690a_100000212008_200000081825 [0,0,0,1,0,0|3,0,0]=4 1389 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)F)O)F 240690a_100000212008_100000766045 [0,0,0,1,0,0|3,0,0]=4 1390 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)F)O)F 527a_100000212008_100000766045 [0,0,0,1,0,0|3,0,0]=4 1391 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)I)O)I 1626a_100000212008_100000034356 [0,0,0,1,0,0|3,0,0]=4 1392 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)I)O)I 240690a_100000212008_100000034356 [0,0,0,1,0,0|3,0,0]=4 1393 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)I)O)I 527a_100000212008_100000034356 [0,0,0,1,0,0|3,0,0]=4 1394 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)O)Br)O 240690a_100000212008_100009812877 [0,0,0,1,0,0|2,0,0]=3 1395 B16R2.375760 O=C(NC1CC1)c2cc(c(c(c2)O)Cl)O 240690a_100000212008_100000074654 [0,0,0,1,0,0|2,0,0]=3 1396 B16R1.1451 CCCCC(=O)Cc1cc(c(c(c1)Br)O)Br 1458a_100009996861_100000210211 [0,0,0,0,0,1|3,0,0]=4 1397 B16R1.1451 CCCCC(=O)Cc1cc(c(c(c1)C)O)C 1458a_200000099080_100000210211 [0,0,0,0,0,1|3,0,0]=4 1398 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Br)O)Br 22a_200000186426_100000210183 [0,0,0,0,0,1|3,0,0]=4 1399 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Br)O)Br 527a_200000186426_100000210183 [0,0,0,0,0,1|3,0,0]=4 1400 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Br)O)C 11a_100010064301_100000210183 [0,0,0,0,0,1|3,0,0]=4 1401 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Br)O)C 22a_100010064301_100000210183 [0,0,0,0,0,1|3,0,0]=4 1402 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Br)O)C 527a_100010064301_100000210183 [0,0,0,0,0,1|3,0,0]=4 1403 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)C)O)C 11a_100000703291_100000210183 [0,0,0,0,0,1|3,0,0]=4 1404 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)C)O)C 1626a_100000703291_100000210183 [0,0,0,0,0,1|3,0,0]=4 1405 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)C)O)C 22a_100000703291_100000210183 [0,0,0,0,0,1|3,0,0]=4 1406 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)C)O)C 527a_100000703291_100000210183 [0,0,0,0,0,1|3,0,0]=4 1407 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Cl)Cl)O 22a_100015839415_100000210183 [0,0,0,0,0,1|3,0,0]=4 1408 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Cl)O)Cl 22a_100000695418_100000210183 [0,0,0,0,0,1|3,0,0]=4 1409 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)Cl)O)Cl 527a_100000695418_100000210183 [0,0,0,0,0,1|3,0,0]=4 1410 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)F)O)F 1626a_100016987357_100000210183 [0,0,0,0,0,1|3,0,0]=4 1411 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)F)O)F 22a_100016987357_100000210183 [0,0,0,0,0,1|3,0,0]=4 1412 B16R1.1451 CCCCC(=O)Nc1cc(c(c(c1)F)O)F 527a_100016987357_100000210183 [0,0,0,0,0,1|3,0,0]=4 1413 B16R1.1451 CCCCC(C)Sc1cc(c(c(c1)O)O)O 62a_200011215066_100010658518 [0,0,0,0,0,1|2,0,1]=4 1414 B16R1.1451 CCCNC(=O)Cc1cc(c(c(c1)Br)O)Br 240690a_100020643023_100009996861 [0,0,0,0,0,1|3,0,0]=4 1415 B16R1.1451 CCCNC(=O)Cc1cc(c(c(c1)Br)O)Br 527a_100020643023_100009996861 [0,0,0,0,0,1|3,0,0]=4 1416 B16R1.1451 CCCNC(=O)Cc1cc(c(c(c1)C)O)C 240690a_100020643023_200000099080 [0,0,0,0,0,1|3,0,0]=4 1417 B16R1.1451 CCCNC(=O)Cc1cc(c(c(c1)C)O)C 527a_100020643023_200000099080 [0,0,0,0,0,1|3,0,0]=4 1418 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)Br)O)Br 2430a_200000186426_100020643023 [0,0,0,0,0,1|3,0,0]=4 1419 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)Br)O)C 2430a_100010064301_100020643023 [0,0,0,0,0,1|3,0,0]=4 1420 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)C)O)C 2430a_100000703291_100020643023 [0,0,0,0,0,1|3,0,0]=4 1421 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)Cl)Cl)O 2430a_100015839415_100020643023 [0,0,0,0,0,1|3,0,0]=4 1422 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)Cl)O)Cl 2430a_100000695418_100020643023 [0,0,0,0,0,1|3,0,0]=4 1423 B16R1.1451 CCCNC(=O)Nc1cc(c(c(c1)F)O)F 2430a_100016987357_100020643023 [0,0,0,0,0,1|3,0,0]=4 1424 B13R1.55 CCCC=Cc1cc(cc(c1)Br)O 271570a_100016258520_100010068917 [2,0,0,0,0,0|2,0,0]=4 1425 B13R1.55 CCCC=Cc1cc(cc(c1)Cl)O 271570a_100016258520_100010068924 [2,0,0,0,0,0|2,0,0]=4 1426 B13R1.55 CCCC=Cc1cc(cc(c1)F)O 271570a_100016258520_100000717995 [2,0,0,0,0,0|2,0,0]=4 1427 B13R1.55 CCCC=Cc1cc(cc(c1)O)C 271570a_100016258520_100011999630 [2,0,0,0,0,0|2,0,0]=4 1428 B13R1.55 CCCC=Cc1cc(cc(c1)O)O 271570a_100016258520_100009868816 [2,0,0,0,0,0|1,0,0]=3 1429 B13R1.55 CCCCNc1cc(cc(c1)O)O 34a_100000043371_100000210210 [2,0,0,0,0,0|2,0,0]=4 1430 B13R1.55 CCCCSc1cc(cc(c1)O)O 62a_100000210211_100009868816 [2,0,0,0,0,0|2,0,0]=4 1431 B13R1.55 CCCNCc1cc(cc(c1)O)O 207a_100020643023_100000043415 [2,0,0,0,0,0|1,0,1]=4 1432 B13R1.55 CCCNCc1cc(cc(c1)O)O 2230a_100159270720_100000210303 [2,0,0,0,0,0|1,0,1]=4 1433 B13R1.55 CCCNCc1cc(cc(c1)O)O 34a_100159270720_100000210303 [2,0,0,0,0,0|1,0,1]=4 1434 B13R1.55 CCNN=Cc1cc(cc(c1)O)O 4a_100000756455_100000043415 [2,0,0,0,0,0|2,0,0]=4 1435 B13R1.55 CCOC=Cc1cc(cc(c1)O)O 271570a_100016256518_100009868816 [2,0,0,0,0,0|2,0,0]=4 1436 B13R1.55 COCC=Cc1cc(cc(c1)O)O 271570a_100016286323_100009868816 [2,0,0,0,0,0|2,0,0]=4 1437 B13R1.136 CCCSc1cc(c(c(c1)F)O)O 62a_100000210303_100010114375 [2,0,0,0,0,0|1,1,0]=4 1438 B13R1.136 CCCSc1cc(c(c(c1)O)O)O 62a_100000210303_100010658518 [2,0,0,0,0,0|0,1,0]=3 1439 B13R1.136 COCSc1cc(c(c(c1)O)O)O 62a_100000766300_100010658518 [2,0,0,0,0,0|1,1,0]=4 1440 B13R1.136 CSCSc1cc(c(c(c1)O)O)O 62a_100011218213_100010658518 [2,0,0,0,0,0|1,1,0]=4 1441 B13R1.136 OCCSc1cc(c(c(c1)O)O)O 62a_100000211926_100010658518 [2,0,0,0,0,0|1,1,0]=4 1442 B13R1.136 Oc1cc(cc(c1O)O)SCCF 62a_100011217306_100010658518 [2,0,0,0,0,0|1,1,0]=4 1443 B13R1.669 CCCC=Cc1ccc(c(c1)Br)O 271570a_100016258520_100012361655 [2,0,0,0,0,0|2,0,0]=4 1444 B13R1.669 CCCC=Cc1ccc(c(c1)C)O 271570a_100016258520_100000186361 [2,0,0,0,0,0|2,0,0]=4 1445 B13R1.669 CCCC=Cc1ccc(c(c1)Cl)O 271570a_100016258520_100012360047 [2,0,0,0,0,0|2,0,0]=4 1446 B13R1.669 CCCC=Cc1ccc(c(c1)F)O 271570a_100016258520_100000185481 [2,0,0,0,0,0|2,0,0]=4 1447 B13R1.669 CCCC=Cc1ccc(c(c1)N)O 271570a_100016258520_100000752626 [2,0,0,0,0,0|2,0,0]=4 1448 B13R1.669 CCCC=Cc1ccc(c(c1)O)Br 271570a_100016258520_100012356990 [2,0,0,0,0,0|2,0,0]=4 1449 B13R1.669 CCCC=Cc1ccc(c(c1)O)C 271570a_100016258520_100000766334 [2,0,0,0,0,0|2,0,0]=4 1450 B13R1.669 CCCC=Cc1ccc(c(c1)O)Cl 271570a_100016258520_100011356854 [2,0,0,0,0,0|2,0,0]=4 1451 B13R1.669 CCCC=Cc1ccc(c(c1)O)F 271570a_100016258520_100000686035 [2,0,0,0,0,0|2,0,0]=4 1452 B13R1.669 CCCC=Cc1ccc(c(c1)O)N 271570a_100016258520_100000739049 [2,0,0,0,0,0|2,0,0]=4 1453 B13R1.669 CCCC=Cc1ccc(c(c1)O)O 271570a_100016258520_100009813601 [2,0,0,0,0,0|1,0,0]=3 1454 B13R1.669 CCCCNc1ccc(c(c1)O)O 34a_100102946323_100000210210 [2,0,0,0,0,0|2,0,0]=4 1455 B13R1.669 CCCCSc1ccc(c(c1)O)O 62a_100000210211_100009813601 [2,0,0,0,0,0|2,0,0]=4 1456 B13R1.669 CCCNCc1ccc(c(c1)O)O 34a_100000010075_100000210303 [2,0,0,0,0,0|1,0,1]=4 1457 B13R1.669 CCNN=Cc1ccc(c(c1)O)O 4a_100000756455_100000184535 [2,0,0,0,0,0|2,0,0]=4 1458 B13R1.669 CCOC=Cc1ccc(c(c1)O)O 271570a_100016256518_100009813601 [2,0,0,0,0,0|2,0,0]=4 1459 B13R1.669 COCC=Cc1ccc(c(c1)O)O 271570a_100016286323_100009813601 [2,0,0,0,0,0|2,0,0]=4 1460 B13R1.18 CCCCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210211 [2,0,0,0,0,0|2,0,0]=4 1461 B13R1.18 CCCCC(=O)c1cccc(c1)C 1458a_100000189346_100000210211 [2,0,0,0,0,0|2,0,0]=4 1462 B13R1.18 CCCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210211 [2,0,0,0,0,0|2,0,0]=4 1463 B13R1.18 CCCCC(=O)c1cccc(c1)F 1458a_100000210950_100000210211 [2,0,0,0,0,0|2,0,0]=4 1464 B13R1.18 CCCCC(=O)c1cccc(c1)I 1458a_100000184098_100000210211 [2,0,0,0,0,0|2,0,0]=4 1465 B13R1.18 CCCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210211 [2,0,0,0,0,0|1,0,0]=3 1466 B13R1.18 CCCCS(=O)c1cccc(c1)O 271570a_203496583355_200010264433 [2,0,0,0,0,0|2,0,0]=4 1467 B13R1.18 CCCNC(=O)c1cccc(c1)Br 11a_100020643023_100000210664 [2,0,0,0,0,0|2,0,0]=4 1468 B13R1.18 CCCNC(=O)c1cccc(c1)Br 1626a_100020643023_100000210664 [2,0,0,0,0,0|2,0,0]=4 1469 B13R1.18 CCCNC(=O)c1cccc(c1)Br 240690a_100020643023_100000210664 [2,0,0,0,0,0|2,0,0]=4 1470 B13R1.18 CCCNC(=O)c1cccc(c1)Br 527a_100020643023_100000210664 [2,0,0,0,0,0|2,0,0]=4 1471 B13R1.18 CCCNC(=O)c1cccc(c1)C 11a_100020643023_100000189346 [2,0,0,0,0,0|2,0,0]=4 1472 B13R1.18 CCCNC(=O)c1cccc(c1)C 1626a_100020643023_100000189346 [2,0,0,0,0,0|2,0,0]=4 1473 B13R1.18 CCCNC(=O)c1cccc(c1)C 240690a_100020643023_100000189346 [2,0,0,0,0,0|2,0,0]=4 1474 B13R1.18 CCCNC(=O)c1cccc(c1)C 527a_100020643023_100000189346 [2,0,0,0,0,0|2,0,0]=4 1475 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 11a_100020643023_100000210390 [2,0,0,0,0,0|2,0,0]=4 1476 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 1626a_100020643023_100000210390 [2,0,0,0,0,0|2,0,0]=4 1477 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 240690a_100020643023_100000210390 [2,0,0,0,0,0|2,0,0]=4 1478 B13R1.18 CCCNC(=O)c1cccc(c1)Cl 527a_100020643023_100000210390 [2,0,0,0,0,0|2,0,0]=4 1479 B13R1.18 CCCNC(=O)c1cccc(c1)F 11a_100020643023_100000210950 [2,0,0,0,0,0|2,0,0]=4 1480 B13R1.18 CCCNC(=O)c1cccc(c1)F 1626a_100020643023_100000210950 [2,0,0,0,0,0|2,0,0]=4 1481 B13R1.18 CCCNC(=O)c1cccc(c1)F 240690a_100020643023_100000210950 [2,0,0,0,0,0|2,0,0]=4 1482 B13R1.18 CCCNC(=O)c1cccc(c1)F 527a_100020643023_100000210950 [2,0,0,0,0,0|2,0,0]=4 1483 B13R1.18 CCCNC(=O)c1cccc(c1)I 11a_100020643023_100000184098 [2,0,0,0,0,0|2,0,0]=4 1484 B13R1.18 CCCNC(=O)c1cccc(c1)I 1626a_100020643023_100000184098 [2,0,0,0,0,0|2,0,0]=4 1485 B13R1.18 CCCNC(=O)c1cccc(c1)I 240690a_100020643023_100000184098 [2,0,0,0,0,0|2,0,0]=4 1486 B13R1.18 CCCNC(=O)c1cccc(c1)I 527a_100020643023_100000184098 [2,0,0,0,0,0|2,0,0]=4 1487 B13R1.18 CCCNC(=O)c1cccc(c1)O 240690a_100020643023_100000183914 [2,0,0,0,0,0|1,0,0]=3 1488 B13R1.18 CCCNC(=O)c1cccc(c1)O 271570a_203496583355_200000152271 [2,0,0,0,0,0|1,0,0]=3 1489 B13R1.18 CCCNC(=O)c1cccc(c1)O 527a_100020643023_100000183914 [2,0,0,0,0,0|1,0,0]=3 1490 B13R1.18 CCCNC(=O)c1cncc(c1)O 271570a_203496583355_200000152275 [2,0,0,0,0,0|2,0,0]=4 1491 B13R1.18 CCNNC(=O)c1cccc(c1)O 22a_100000756455_100000183914 [2,0,0,0,0,0|2,0,0]=4 1492 B13R1.18 CCOCC(=O)c1cccc(c1)O 34a_100121572206_100009813753 [2,0,0,0,0,0|2,0,0]=4 1493 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100000210202_100009813753 [2,0,0,0,0,0|2,0,0]=4 1494 B13R1.18 CCSCC(=O)c1cccc(c1)O 62a_100009813753_100000210202 [2,0,0,0,0,0|2,0,0]=4 1495 B13R1.18 COCCC(=O)c1cccc(c1)O 1458a_100000183914_100000233755 [2,0,0,0,0,0|2,0,0]=4 1496 B13R1.18 CSCCC(=O)c1cccc(c1)O 1458a_100000183914_100000751147 [2,0,0,0,0,0|2,0,0]=4 1497 B13R1.18 O=C(CCCF)c1cccc(c1)O 1458a_100000183914_100011934791 [2,0,0,0,0,0|2,0,0]=4 1498 B13R1.18 O=C(CCCO)c1cccc(c1)O 1458a_100000183914_100011215043 [2,0,0,0,0,0|2,0,0]=4 1499 B13R1.18 O=C(NCCF)c1cccc(c1)O 240690a_100000724931_100000183914 [2,0,0,0,0,0|2,0,0]=4 1500 B13R1.18 O=C(NCCF)c1cccc(c1)O 527a_100000724931_100000183914 [2,0,0,0,0,0|2,0,0]=4 1501 B13R1.18 O=C(NCCO)c1cccc(c1)O 240690a_100000210304_100000183914 [2,0,0,0,0,0|2,0,0]=4 1502 B13R1.18 O=C(NCCO)c1cccc(c1)O 271570a_203496583355_200000158903 [2,0,0,0,0,0|2,0,0]=4 1503 B13R1.18 O=C(NCCO)c1cccc(c1)O 527a_100000210304_100000183914 [2,0,0,0,0,0|2,0,0]=4 1504 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_100000210303 [2,0,0,0,0,0|2,0,0]=4 1505 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_100000210303 [2,0,0,0,0,0|2,0,0]=4 1506 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_100000210303 [2,0,0,0,0,0|2,0,0]=4 1507 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_100000210303 [2,0,0,0,0,0|2,0,0]=4 1508 B13R1.450 CCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210303 [2,0,0,0,0,0|1,0,0]=3 1509 B13R1.450 CCCC(=O)c1cc(cc(c1)C)C 1458a_100000210874_100000210303 [2,0,0,0,0,0|2,0,0]=4 1510 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_100000210303 [2,0,0,0,0,0|2,0,0]=4 1511 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_100000210303 [2,0,0,0,0,0|2,0,0]=4 1512 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_100000210303 [2,0,0,0,0,0|2,0,0]=4 1513 B13R1.450 CCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210303 [2,0,0,0,0,0|1,0,0]=3 1514 B13R1.450 CCCC(=O)c1cc(cc(c1)F)C 1458a_100000763163_100000210303 [2,0,0,0,0,0|2,0,0]=4 1515 B13R1.450 CCCC(=O)c1cc(cc(c1)F)F 1458a_100000211655_100000210303 [2,0,0,0,0,0|2,0,0]=4 1516 B13R1.450 CCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210303 [2,0,0,0,0,0|1,0,0]=3 1517 B13R1.450 CCCC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_100000210303 [2,0,0,0,0,0|2,0,0]=4 1518 B13R1.450 CCCC(=O)c1cc(cc(c1)I)C 1458a_100000729426_100000210303 [2,0,0,0,0,0|2,0,0]=4 1519 B13R1.450 CCCC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_100000210303 [2,0,0,0,0,0|2,0,0]=4 1520 B13R1.450 CCCC(=O)c1cc(cc(c1)I)F 1458a_100012047268_100000210303 [2,0,0,0,0,0|2,0,0]=4 1521 B13R1.450 CCCC(=O)c1cc(cc(c1)I)I 1458a_100011204819_100000210303 [2,0,0,0,0,0|2,0,0]=4 1522 B13R1.450 CCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210303 [2,0,0,0,0,0|1,0,0]=3 1523 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)O 240690a_100015525214_100011934545 [2,0,0,0,0,0|2,0,0]=4 1524 B13R1.450 CCNC(=O)c1cc(cc(c1)Br)O 527a_100015525214_100011934545 [2,0,0,0,0,0|2,0,0]=4 1525 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)O 240690a_100015525214_100011997059 [2,0,0,0,0,0|2,0,0]=4 1526 B13R1.450 CCNC(=O)c1cc(cc(c1)Cl)O 527a_100015525214_100011997059 [2,0,0,0,0,0|2,0,0]=4 1527 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 11a_100015525214_100012017291 [2,0,0,0,0,0|2,0,0]=4 1528 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 240690a_100015525214_100012017291 [2,0,0,0,0,0|2,0,0]=4 1529 B13R1.450 CCNC(=O)c1cc(cc(c1)F)O 527a_100015525214_100012017291 [2,0,0,0,0,0|2,0,0]=4 1530 B13R1.450 CCNC(=O)c1cc(cc(c1)O)C 240690a_100015525214_100000094094 [2,0,0,0,0,0|2,0,0]=4 1531 B13R1.450 CCNC(=O)c1cc(cc(c1)O)C 527a_100015525214_100000094094 [2,0,0,0,0,0|2,0,0]=4 1532 B13R1.450 CCNC(=O)c1cc(cc(c1)O)O 240690a_100015525214_100000690292 [2,0,0,0,0,0|1,0,0]=3 1533 B13R1.450 CCNC(=O)c1cc(cc(c1)O)O 527a_100015525214_100000690292 [2,0,0,0,0,0|1,0,0]=3 1534 B13R1.450 CCOC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_200012351389 [2,0,0,0,0,0|1,0,0]=3 1535 B13R1.450 CCOC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011295119 [2,0,0,0,0,0|1,0,0]=3 1536 B13R1.450 CCOC(=O)c1cc(cc(n1)C)O 271570a_203496583355_100010743377 [2,0,0,0,0,0|2,0,0]=4 1537 B13R1.450 CCOC(=O)c1cc(cc(n1)O)C 271570a_203496583355_200000094552 [2,0,0,0,0,0|2,0,0]=4 1538 B13R1.450 CCOC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100011830423 [2,0,0,0,0,0|2,0,0]=4 1539 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 2230a_106832991635_100010006762 [2,0,0,0,0,0|1,0,0]=3 1540 B13R1.450 CNCC(=O)c1cc(cc(c1)O)O 34a_100102657272_100010006762 [2,0,0,0,0,0|1,0,0]=3 1541 B13R1.450 CNNC(=O)c1cc(cc(c1)O)O 22a_100016993582_100000690292 [2,0,0,0,0,0|2,0,0]=4 1542 B13R1.450 COCC(=O)c1cc(cc(c1)O)O 34a_100138415774_100010006762 [2,0,0,0,0,0|1,0,0]=3 1543 B13R1.450 CSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_200000210301 [2,0,0,0,0,0|1,0,0]=3 1544 B13R1.450 CSCC(=O)c1cc(cc(c1)O)O 62a_200000210301_100010006762 [2,0,0,0,0,0|1,0,0]=3 1545 B13R1.450 Cc1cc(cc(c1)C(=O)CCF)O 1458a_100000094094_100011217306 [2,0,0,0,0,0|2,0,0]=4 1546 B13R1.450 Cc1cc(cc(c1)C(=O)CCO)O 1458a_100000094094_100000211926 [2,0,0,0,0,0|2,0,0]=4 1547 B13R1.450 O=C(CCF)c1cc(cc(c1)Br)O 1458a_100011934545_100011217306 [2,0,0,0,0,0|2,0,0]=4 1548 B13R1.450 O=C(CCF)c1cc(cc(c1)Cl)O 1458a_100011997059_100011217306 [2,0,0,0,0,0|2,0,0]=4 1549 B13R1.450 O=C(CCF)c1cc(cc(c1)F)O 1458a_100012017291_100011217306 [2,0,0,0,0,0|2,0,0]=4 1550 B13R1.450 O=C(CCO)c1cc(cc(c1)Br)O 1458a_100011934545_100000211926 [2,0,0,0,0,0|2,0,0]=4 1551 B13R1.450 O=C(CCO)c1cc(cc(c1)Cl)O 1458a_100011997059_100000211926 [2,0,0,0,0,0|2,0,0]=4 1552 B13R1.450 O=C(CCO)c1cc(cc(c1)F)O 1458a_100012017291_100000211926 [2,0,0,0,0,0|2,0,0]=4 1553 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)O)O 62a_100010006762_200025704644 [2,0,0,0,0,0|1,0,0]=3 1554 B13R1.450 [13CH3]SCC(=O)c1cc(cc(c1)O)O 62a_200025704644_100010006762 [2,0,0,0,0,0|1,0,0]=3 1555 B13R1.17 CCCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210211 [2,0,0,0,0,0|2,0,0]=4 1556 B13R1.17 CCCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210211 [2,0,0,0,0,0|2,0,0]=4 1557 B13R1.17 CCCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210211 [2,0,0,0,0,0|2,0,0]=4 1558 B13R1.17 CCCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210211 [2,0,0,0,0,0|2,0,0]=4 1559 B13R1.17 CCCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210211 [2,0,0,0,0,0|2,0,0]=4 1560 B13R1.17 CCCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210211 [2,0,0,0,0,0|1,0,0]=3 1561 B13R1.17 CCCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011215321 [2,0,0,0,0,0|1,0,0]=3 1562 B13R1.17 CCCCS(=O)c1ccc(cc1)O 271570a_203496583355_100016336038 [2,0,0,0,0,0|2,0,0]=4 1563 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 11a_100020643023_100000185839 [2,0,0,0,0,0|2,0,0]=4 1564 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 1626a_100020643023_100000185839 [2,0,0,0,0,0|2,0,0]=4 1565 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 240690a_100020643023_100000185839 [2,0,0,0,0,0|2,0,0]=4 1566 B13R1.17 CCCNC(=O)c1ccc(cc1)Br 527a_100020643023_100000185839 [2,0,0,0,0,0|2,0,0]=4 1567 B13R1.17 CCCNC(=O)c1ccc(cc1)C 11a_100020643023_100000188618 [2,0,0,0,0,0|2,0,0]=4 1568 B13R1.17 CCCNC(=O)c1ccc(cc1)C 1626a_100020643023_100000188618 [2,0,0,0,0,0|2,0,0]=4 1569 B13R1.17 CCCNC(=O)c1ccc(cc1)C 240690a_100020643023_100000188618 [2,0,0,0,0,0|2,0,0]=4 1570 B13R1.17 CCCNC(=O)c1ccc(cc1)C 527a_100020643023_100000188618 [2,0,0,0,0,0|2,0,0]=4 1571 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 11a_100020643023_100000210187 [2,0,0,0,0,0|2,0,0]=4 1572 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 1626a_100020643023_100000210187 [2,0,0,0,0,0|2,0,0]=4 1573 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 240690a_100020643023_100000210187 [2,0,0,0,0,0|2,0,0]=4 1574 B13R1.17 CCCNC(=O)c1ccc(cc1)Cl 527a_100020643023_100000210187 [2,0,0,0,0,0|2,0,0]=4 1575 B13R1.17 CCCNC(=O)c1ccc(cc1)F 11a_100020643023_100000187176 [2,0,0,0,0,0|2,0,0]=4 1576 B13R1.17 CCCNC(=O)c1ccc(cc1)F 1626a_100020643023_100000187176 [2,0,0,0,0,0|2,0,0]=4 1577 B13R1.17 CCCNC(=O)c1ccc(cc1)F 240690a_100020643023_100000187176 [2,0,0,0,0,0|2,0,0]=4 1578 B13R1.17 CCCNC(=O)c1ccc(cc1)F 527a_100020643023_100000187176 [2,0,0,0,0,0|2,0,0]=4 1579 B13R1.17 CCCNC(=O)c1ccc(cc1)I 11a_100020643023_100000187904 [2,0,0,0,0,0|2,0,0]=4 1580 B13R1.17 CCCNC(=O)c1ccc(cc1)I 1626a_100020643023_100000187904 [2,0,0,0,0,0|2,0,0]=4 1581 B13R1.17 CCCNC(=O)c1ccc(cc1)I 240690a_100020643023_100000187904 [2,0,0,0,0,0|2,0,0]=4 1582 B13R1.17 CCCNC(=O)c1ccc(cc1)I 527a_100020643023_100000187904 [2,0,0,0,0,0|2,0,0]=4 1583 B13R1.17 CCCNC(=O)c1ccc(cc1)O 240690a_100020643023_100000212099 [2,0,0,0,0,0|1,0,0]=3 1584 B13R1.17 CCCNC(=O)c1ccc(cc1)O 271570a_203496583355_200000152267 [2,0,0,0,0,0|1,0,0]=3 1585 B13R1.17 CCCNC(=O)c1ccc(cc1)O 527a_100020643023_100000212099 [2,0,0,0,0,0|1,0,0]=3 1586 B13R1.17 CCCNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781247 [2,0,0,0,0,0|2,0,0]=4 1587 B13R1.17 CCCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000161739 [2,0,0,0,0,0|2,0,0]=4 1588 B13R1.17 CCNNC(=O)c1ccc(cc1)O 22a_100000756455_100000212099 [2,0,0,0,0,0|2,0,0]=4 1589 B13R1.17 CCOCC(=O)c1ccc(cc1)O 34a_100121572206_100009814261 [2,0,0,0,0,0|2,0,0]=4 1590 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100000210202_100009814261 [2,0,0,0,0,0|2,0,0]=4 1591 B13R1.17 CCSCC(=O)c1ccc(cc1)O 62a_100009814261_100000210202 [2,0,0,0,0,0|2,0,0]=4 1592 B13R1.17 CNCCC(=O)c1ccc(cc1)O 2230a_106832991635_100009879949 [2,0,0,0,0,0|2,0,0]=4 1593 B13R1.17 CNCCC(=O)c1ccc(cc1)O 7a_106832991635_100009879949 [2,0,0,0,0,0|2,0,0]=4 1594 B13R1.17 COCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000233755 [2,0,0,0,0,0|2,0,0]=4 1595 B13R1.17 CSCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000751147 [2,0,0,0,0,0|2,0,0]=4 1596 B13R1.17 CSCCC(=O)c1ccc(cc1)O 62a_200000210301_100009879949 [2,0,0,0,0,0|2,0,0]=4 1597 B13R1.17 O=C(CCCF)c1ccc(cc1)O 1458a_100000212099_100011934791 [2,0,0,0,0,0|2,0,0]=4 1598 B13R1.17 O=C(CCCO)c1ccc(cc1)O 1458a_100000212099_100011215043 [2,0,0,0,0,0|2,0,0]=4 1599 B13R1.17 O=C(NCCF)c1ccc(cc1)O 240690a_100000724931_100000212099 [2,0,0,0,0,0|2,0,0]=4 1600 B13R1.17 O=C(NCCF)c1ccc(cc1)O 527a_100000724931_100000212099 [2,0,0,0,0,0|2,0,0]=4 1601 B13R1.17 O=C(NCCO)c1ccc(cc1)O 240690a_100000210304_100000212099 [2,0,0,0,0,0|2,0,0]=4 1602 B13R1.17 O=C(NCCO)c1ccc(cc1)O 271570a_203496583355_200000158904 [2,0,0,0,0,0|2,0,0]=4 1603 B13R1.17 O=C(NCCO)c1ccc(cc1)O 527a_100000210304_100000212099 [2,0,0,0,0,0|2,0,0]=4 1604 B13R1.17 [13CH3]SCCC(=O)c1ccc(cc1)O 62a_200025704644_100009879949 [2,0,0,0,0,0|2,0,0]=4 1605 B13R1.466 C#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000184674 [2,0,0,0,0,0|0,0,2]=4 1606 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210623 [2,0,0,0,0,0|0,0,2]=4 1607 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210303 [2,0,0,0,0,0|2,0,0]=4 1608 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210303 [2,0,0,0,0,0|2,0,0]=4 1609 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210303 [2,0,0,0,0,0|2,0,0]=4 1610 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210303 [2,0,0,0,0,0|2,0,0]=4 1611 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210303 [2,0,0,0,0,0|2,0,0]=4 1612 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210303 [2,0,0,0,0,0|1,0,0]=3 1613 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210303 [2,0,0,0,0,0|2,0,0]=4 1614 B13R1.466 CCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210303 [2,0,0,0,0,0|2,0,0]=4 1615 B13R1.466 CCCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210303 [2,0,0,0,0,0|2,0,0]=4 1616 B13R1.466 CCCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210303 [2,0,0,0,0,0|2,0,0]=4 1617 B13R1.466 CCCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210303 [2,0,0,0,0,0|2,0,0]=4 1618 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210303 [2,0,0,0,0,0|1,0,0]=3 1619 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012345043 [2,0,0,0,0,0|1,0,0]=3 1620 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210303 [2,0,0,0,0,0|2,0,0]=4 1621 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210303 [2,0,0,0,0,0|2,0,0]=4 1622 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210303 [2,0,0,0,0,0|2,0,0]=4 1623 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210303 [2,0,0,0,0,0|2,0,0]=4 1624 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210303 [2,0,0,0,0,0|2,0,0]=4 1625 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210303 [2,0,0,0,0,0|1,0,0]=3 1626 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210303 [2,0,0,0,0,0|2,0,0]=4 1627 B13R1.466 CCCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210303 [2,0,0,0,0,0|2,0,0]=4 1628 B13R1.466 CCCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210303 [2,0,0,0,0,0|2,0,0]=4 1629 B13R1.466 CCCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210303 [2,0,0,0,0,0|2,0,0]=4 1630 B13R1.466 CCCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210303 [2,0,0,0,0,0|2,0,0]=4 1631 B13R1.466 CCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210303 [2,0,0,0,0,0|1,0,0]=3 1632 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210303 [2,0,0,0,0,0|2,0,0]=4 1633 B13R1.466 CCCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210303 [2,0,0,0,0,0|2,0,0]=4 1634 B13R1.466 CCCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210303 [2,0,0,0,0,0|2,0,0]=4 1635 B13R1.466 CCCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210303 [2,0,0,0,0,0|2,0,0]=4 1636 B13R1.466 CCCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210303 [2,0,0,0,0,0|2,0,0]=4 1637 B13R1.466 CCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210303 [2,0,0,0,0,0|1,0,0]=3 1638 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210303 [2,0,0,0,0,0|1,0,0]=3 1639 B13R1.466 CCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210303 [2,0,0,0,0,0|1,0,0]=3 1640 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210303 [2,0,0,0,0,0|1,0,0]=3 1641 B13R1.466 CCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210303 [2,0,0,0,0,0|1,0,0]=3 1642 B13R1.466 CCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210303 [2,0,0,0,0,0|1,0,0]=3 1643 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [2,0,0,0,0,0|0,0,0]=2 1644 B13R1.466 CCNC(=O)c1ccc(c(c1)Br)O 240690a_100015525214_100000189672 [2,0,0,0,0,0|2,0,0]=4 1645 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 240690a_100015525214_100000685612 [2,0,0,0,0,0|2,0,0]=4 1646 B13R1.466 CCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012357431 [2,0,0,0,0,0|2,0,0]=4 1647 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 240690a_100015525214_100000212196 [2,0,0,0,0,0|2,0,0]=4 1648 B13R1.466 CCNC(=O)c1ccc(c(c1)Cl)O 527a_100015525214_100000212196 [2,0,0,0,0,0|2,0,0]=4 1649 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 240690a_100015525214_100000185466 [2,0,0,0,0,0|2,0,0]=4 1650 B13R1.466 CCNC(=O)c1ccc(c(c1)F)O 527a_100015525214_100000185466 [2,0,0,0,0,0|2,0,0]=4 1651 B13R1.466 CCNC(=O)c1ccc(c(c1)I)O 240690a_100015525214_100000037485 [2,0,0,0,0,0|2,0,0]=4 1652 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 240690a_100015525214_100000689001 [2,0,0,0,0,0|2,0,0]=4 1653 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Br 527a_100015525214_100000689001 [2,0,0,0,0,0|2,0,0]=4 1654 B13R1.466 CCNC(=O)c1ccc(c(c1)O)C 240690a_100015525214_100000233767 [2,0,0,0,0,0|2,0,0]=4 1655 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 240690a_100015525214_100011933997 [2,0,0,0,0,0|2,0,0]=4 1656 B13R1.466 CCNC(=O)c1ccc(c(c1)O)Cl 527a_100015525214_100011933997 [2,0,0,0,0,0|2,0,0]=4 1657 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 240690a_100015525214_100000035894 [2,0,0,0,0,0|2,0,0]=4 1658 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359900 [2,0,0,0,0,0|2,0,0]=4 1659 B13R1.466 CCNC(=O)c1ccc(c(c1)O)F 527a_100015525214_100000035894 [2,0,0,0,0,0|2,0,0]=4 1660 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 240690a_100015525214_100000239334 [2,0,0,0,0,0|2,0,0]=4 1661 B13R1.466 CCNC(=O)c1ccc(c(c1)O)I 527a_100015525214_100000239334 [2,0,0,0,0,0|2,0,0]=4 1662 B13R1.466 CCOC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100009880029 [2,0,0,0,0,0|2,0,0]=4 1663 B13R1.466 CCOC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294787 [2,0,0,0,0,0|1,0,0]=3 1664 B13R1.466 CCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100012229600 [2,0,0,0,0,0|1,0,0]=3 1665 B13R1.466 CCOC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_200012351148 [2,0,0,0,0,0|1,0,0]=3 1666 B13R1.466 CCOC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100011533738 [2,0,0,0,0,0|1,0,0]=3 1667 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O 271570a_203496583355_200011450955 [2,0,0,0,0,0|1,0,0]=3 1668 B13R1.466 CCOC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100012359631 [2,0,0,0,0,0|1,0,0]=3 1669 B13R1.466 CCOC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011934563 [2,0,0,0,0,0|1,0,0]=3 1670 B13R1.466 CCOC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100161115259 [2,0,0,0,0,0|1,0,0]=3 1671 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [2,0,0,0,0,0|0,0,0]=2 1672 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [2,0,0,0,0,0|0,0,0]=2 1673 B13R1.466 CCOC(=O)c1ccc(c(n1)O)C 271570a_203496583355_200009853511 [2,0,0,0,0,0|2,0,0]=4 1674 B13R1.466 CCOC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189761 [2,0,0,0,0,0|1,0,0]=3 1675 B13R1.466 CCOC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816805 [2,0,0,0,0,0|2,0,0]=4 1676 B13R1.466 CCOC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010004467 [2,0,0,0,0,0|1,0,0]=3 1677 B13R1.466 CCOC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010179890 [2,0,0,0,0,0|1,0,0]=3 1678 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)O 7a_106832991635_200010170092 [2,0,0,0,0,0|2,0,0]=4 1679 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [2,0,0,0,0,0|1,0,0]=3 1680 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200000210301_200010170092 [2,0,0,0,0,0|2,0,0]=4 1681 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200000210301 [2,0,0,0,0,0|2,0,0]=4 1682 B13R1.466 CSCC(=O)c1ccc(c(c1)O)O 62a_200000210301_100000183813 [2,0,0,0,0,0|1,0,0]=3 1683 B13R1.466 Cc1cc(ccc1O)C(=O)CCF 1458a_100000685612_100011217306 [2,0,0,0,0,0|2,0,0]=4 1684 B13R1.466 Cc1cc(ccc1O)C(=O)CCO 1458a_100000685612_100000211926 [2,0,0,0,0,0|2,0,0]=4 1685 B13R1.466 Cc1ccc(cc1O)C(=O)CCF 1458a_100000233767_100011217306 [2,0,0,0,0,0|2,0,0]=4 1686 B13R1.466 Cc1ccc(cc1O)C(=O)CCO 1458a_100000233767_100000211926 [2,0,0,0,0,0|2,0,0]=4 1687 B13R1.466 N#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011214920 [2,0,0,0,0,0|1,0,1]=4 1688 B13R1.466 O=C(CCF)c1ccc(c(c1)Br)O 1458a_100000189672_100011217306 [2,0,0,0,0,0|2,0,0]=4 1689 B13R1.466 O=C(CCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100011217306 [2,0,0,0,0,0|2,0,0]=4 1690 B13R1.466 O=C(CCF)c1ccc(c(c1)F)O 1458a_100000185466_100011217306 [2,0,0,0,0,0|2,0,0]=4 1691 B13R1.466 O=C(CCF)c1ccc(c(c1)I)O 1458a_100000037485_100011217306 [2,0,0,0,0,0|2,0,0]=4 1692 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Br 1458a_100000689001_100011217306 [2,0,0,0,0,0|2,0,0]=4 1693 B13R1.466 O=C(CCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100011217306 [2,0,0,0,0,0|2,0,0]=4 1694 B13R1.466 O=C(CCF)c1ccc(c(c1)O)F 1458a_100000035894_100011217306 [2,0,0,0,0,0|2,0,0]=4 1695 B13R1.466 O=C(CCF)c1ccc(c(c1)O)I 1458a_100000239334_100011217306 [2,0,0,0,0,0|2,0,0]=4 1696 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [2,0,0,0,0,0|1,0,0]=3 1697 B13R1.466 O=C(CCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000211926 [2,0,0,0,0,0|2,0,0]=4 1698 B13R1.466 O=C(CCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000211926 [2,0,0,0,0,0|2,0,0]=4 1699 B13R1.466 O=C(CCO)c1ccc(c(c1)F)O 1458a_100000185466_100000211926 [2,0,0,0,0,0|2,0,0]=4 1700 B13R1.466 O=C(CCO)c1ccc(c(c1)I)O 1458a_100000037485_100000211926 [2,0,0,0,0,0|2,0,0]=4 1701 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000211926 [2,0,0,0,0,0|2,0,0]=4 1702 B13R1.466 O=C(CCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000211926 [2,0,0,0,0,0|2,0,0]=4 1703 B13R1.466 O=C(CCO)c1ccc(c(c1)O)F 1458a_100000035894_100000211926 [2,0,0,0,0,0|2,0,0]=4 1704 B13R1.466 O=C(CCO)c1ccc(c(c1)O)I 1458a_100000239334_100000211926 [2,0,0,0,0,0|2,0,0]=4 1705 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [2,0,0,0,0,0|1,0,0]=3 1706 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200025704644 [2,0,0,0,0,0|2,0,0]=4 1707 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200025704644_200010170092 [2,0,0,0,0,0|2,0,0]=4 1708 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)O)O 62a_200025704644_100000183813 [2,0,0,0,0,0|1,0,0]=3 1709 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210202 [2,0,0,0,0,0|2,0,0]=4 1710 B13R1.2678 CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210202 [2,0,0,0,0,0|1,0,0]=3 1711 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000210202 [2,0,0,0,0,0|2,0,0]=4 1712 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210202 [2,0,0,0,0,0|2,0,0]=4 1713 B13R1.2678 CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210202 [2,0,0,0,0,0|1,0,0]=3 1714 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210202 [2,0,0,0,0,0|2,0,0]=4 1715 B13R1.2678 CCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210202 [2,0,0,0,0,0|2,0,0]=4 1716 B13R1.2678 CCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210202 [2,0,0,0,0,0|2,0,0]=4 1717 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210202 [2,0,0,0,0,0|1,0,0]=3 1718 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210202 [2,0,0,0,0,0|1,0,0]=3 1719 B13R1.2678 CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210202 [2,0,0,0,0,0|0,0,0]=2 1720 B13R1.2678 CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100102657272_200009992764 [2,0,0,0,0,0|2,0,0]=4 1721 B13R1.2678 CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100102657272_200000078382 [2,0,0,0,0,0|2,0,0]=4 1722 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100102657272_100009812877 [2,0,0,0,0,0|2,0,0]=4 1723 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100102657272_100000031928 [2,0,0,0,0,0|2,0,0]=4 1724 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)C)O 527a_100102657272_100000031928 [2,0,0,0,0,0|2,0,0]=4 1725 B13R1.2678 CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100102657272_100000074654 [2,0,0,0,0,0|2,0,0]=4 1726 B13R1.2678 COC(=O)c1cc(c(c(c1)Br)O)Cl 271570a_203496583355_100012361296 [2,0,0,0,0,0|2,0,0]=4 1727 B13R1.2678 COC(=O)c1cc(c(c(c1)C)O)C 271570a_203496583355_100010209423 [2,0,0,0,0,0|2,0,0]=4 1728 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)C)O 271570a_203496583355_100012360618 [2,0,0,0,0,0|2,0,0]=4 1729 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)O)O 271570a_203496583355_100135280131 [2,0,0,0,0,0|1,0,0]=3 1730 B13R1.2678 COC(=O)c1cc(c(c(c1)F)C)O 271570a_203496583355_100012920391 [2,0,0,0,0,0|2,0,0]=4 1731 B13R1.2678 COC(=O)c1cc(c(c(c1)F)F)O 271570a_203496583355_100010189562 [2,0,0,0,0,0|2,0,0]=4 1732 B13R1.2678 COC(=O)c1cc(c(c(c1)F)N)O 271570a_203496583355_100010170820 [2,0,0,0,0,0|2,0,0]=4 1733 B13R1.2678 COC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_200010155432 [2,0,0,0,0,0|2,0,0]=4 1734 B13R1.2678 COC(=O)c1cc(c(c(c1)O)C)N 271570a_203496583355_100012353609 [2,0,0,0,0,0|2,0,0]=4 1735 B13R1.2678 COC(=O)c1cc(c(c(c1)O)F)N 271570a_203496583355_200010713629 [2,0,0,0,0,0|2,0,0]=4 1736 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)C 271570a_203496583355_100010177015 [2,0,0,0,0,0|2,0,0]=4 1737 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)N 271570a_203496583355_100010128412 [2,0,0,0,0,0|2,0,0]=4 1738 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)N 271570a_203496583355_100010372079 [2,0,0,0,0,0|1,0,0]=3 1739 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_100010192586 [2,0,0,0,0,0|0,0,0]=2 1740 B13R1.2678 Cc1c(cc(cc1O)C(=O)CF)O 1458a_100000031928_100015361967 [2,0,0,0,0,0|2,0,0]=4 1741 B13R1.2678 O=C(CF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100015361967 [2,0,0,0,0,0|2,0,0]=4 1742 B13R1.2678 O=C(CF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100015361967 [2,0,0,0,0,0|2,0,0]=4 1743 B13R1.2678 O=C(CF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100015361967 [2,0,0,0,0,0|2,0,0]=4 1744 B13R1.2678 O=C(CF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100015361967 [2,0,0,0,0,0|1,0,0]=3 1745 B15R1.552 CCCCCSc1cc(c(c(c1)O)O)O 62a_100000210326_100010658518 [1,1,0,0,0,0|1,0,1]=4 1746 B15R1.552 CCCNN=Cc1cc(c(c(c1)Br)O)O 4a_100000740057_100000687232 [1,1,0,0,0,0|2,0,0]=4 1747 B15R1.552 CCCNN=Cc1cc(c(c(c1)O)O)O 4a_100000740057_100000042491 [1,1,0,0,0,0|1,0,0]=3 1748 B15R1.552 CCOCCSc1cc(c(c(c1)O)O)O 62a_100000210147_100010658518 [1,1,0,0,0,0|2,0,0]=4 1749 B15R1.552 CCSCCSc1cc(c(c(c1)O)O)O 62a_100000757381_100010658518 [1,1,0,0,0,0|2,0,0]=4 1750 B15R1.552 COCCCSc1cc(c(c(c1)O)O)O 62a_100000709357_100010658518 [1,1,0,0,0,0|2,0,0]=4 1751 B15R1.552 OCCCCSc1cc(c(c(c1)O)O)O 62a_100000210776_100010658518 [1,1,0,0,0,0|2,0,0]=4 1752 B15R1.552 OCCNN=Cc1cc(c(c(c1)O)O)O 4a_100000210001_100000042491 [1,1,0,0,0,0|2,0,0]=4 1753 B15R1.552 Oc1cc(cc(c1O)O)SCCCCF 62a_100000729493_100010658518 [1,1,0,0,0,0|2,0,0]=4 1754 B15R1.766 CCCC(C)Sc1cc(c(c(c1)O)O)O 62a_100000766640_100010658518 [1,1,0,0,0,0|2,0,0]=4 1755 B15R1.2993 CCC(C)CSc1cc(c(c(c1)O)O)O 62a_100000748023_100010658518 [1,1,0,0,0,0|2,0,0]=4 1756 B15R1.2993 CCC(O)CSc1cc(c(c(c1)O)O)O 62a_100011218378_100010658518 [1,1,0,0,0,0|2,0,0]=4 1757 B15R1.2993 CC[C@H](C)CSc1cc(c(c(c1)O)O)O 62a_100009816398_100010658518 [1,1,0,0,0,0|2,0,0]=4 1758 B15R1.4141 CCCC=Cc1cc(c(c(c1)OC)F)O 271570a_100016258520_200015524394 [1,1,0,0,0,0|2,0,0]=4 1759 B15R1.4141 CCCCSc1cc(c(c(c1)OC)O)O 62a_100000210211_200159242197 [1,1,0,0,0,0|2,0,0]=4 1760 B15R1.4141 CCNN=Cc1cc(c(c(c1)OC)O)O 4a_100000756455_100000010769 [1,1,0,0,0,0|2,0,0]=4 1761 B15R1.28956 CC(C)CCSc1cc(c(c(c1)O)O)O 62a_100000210312_100010658518 [1,1,0,0,0,0|2,0,0]=4 1762 B15R1.28956 CC(C)NN=Cc1cc(c(c(c1)O)O)O 4a_100000741168_100000042491 [1,1,0,0,0,0|2,0,0]=4 1763 B15R1.28956 CC(O)CCSc1cc(c(c(c1)O)O)O 62a_100012276601_100010658518 [1,1,0,0,0,0|2,0,0]=4 1764 B15R1.748 CCC(C)CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000748023 [1,1,0,0,0,0|2,0,0]=4 1765 B15R1.748 CCC(C)CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000748023 [1,1,0,0,0,0|2,0,0]=4 1766 B15R1.748 CCC(C)CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000748023 [1,1,0,0,0,0|2,0,0]=4 1767 B15R1.748 CCC(C)CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000748023 [1,1,0,0,0,0|2,0,0]=4 1768 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)Br)O 240690a_100000209981_100011934545 [1,1,0,0,0,0|2,0,0]=4 1769 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)Br)O 527a_100000209981_100011934545 [1,1,0,0,0,0|2,0,0]=4 1770 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)Cl)O 240690a_100000209981_100011997059 [1,1,0,0,0,0|2,0,0]=4 1771 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)Cl)O 527a_100000209981_100011997059 [1,1,0,0,0,0|2,0,0]=4 1772 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)F)O 11a_100000209981_100012017291 [1,1,0,0,0,0|2,0,0]=4 1773 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)F)O 240690a_100000209981_100012017291 [1,1,0,0,0,0|2,0,0]=4 1774 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)F)O 527a_100000209981_100012017291 [1,1,0,0,0,0|2,0,0]=4 1775 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)O)C 240690a_100000209981_100000094094 [1,1,0,0,0,0|2,0,0]=4 1776 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)O)C 527a_100000209981_100000094094 [1,1,0,0,0,0|2,0,0]=4 1777 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)O)O 240690a_100000209981_100000690292 [1,1,0,0,0,0|1,0,0]=3 1778 B15R1.748 CCC(C)NC(=O)c1cc(cc(c1)O)O 527a_100000209981_100000690292 [1,1,0,0,0,0|1,0,0]=3 1779 B15R1.748 CCC(O)CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100011218378 [1,1,0,0,0,0|2,0,0]=4 1780 B15R1.748 CCC(O)CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100011218378 [1,1,0,0,0,0|2,0,0]=4 1781 B15R1.748 CCC(O)CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100011218378 [1,1,0,0,0,0|2,0,0]=4 1782 B15R1.748 CCC(O)CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100011218378 [1,1,0,0,0,0|2,0,0]=4 1783 B15R1.748 CCN(C)CC(=O)c1cc(cc(c1)O)O 2230a_100000225621_100010006762 [1,1,0,0,0,0|2,0,0]=4 1784 B15R1.748 CCN(C)CC(=O)c1cc(cc(c1)O)O 269982a_100000225621_100010006762 [1,1,0,0,0,0|2,0,0]=4 1785 B15R1.748 CC[C@H](C)CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100009816398 [1,1,0,0,0,0|2,0,0]=4 1786 B15R1.748 CC[C@H](C)CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100009816398 [1,1,0,0,0,0|2,0,0]=4 1787 B15R1.748 CC[C@H](C)CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100009816398 [1,1,0,0,0,0|2,0,0]=4 1788 B15R1.748 CC[C@H](C)CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100009816398 [1,1,0,0,0,0|2,0,0]=4 1789 B15R1.748 C[C@H](CF)NC(=O)c1cc(cc(c1)O)O 240690a_100102880703_100000690292 [1,1,0,0,0,0|2,0,0]=4 1790 B15R1.748 C[C@H](CF)NC(=O)c1cc(cc(c1)O)O 527a_100102880703_100000690292 [1,1,0,0,0,0|2,0,0]=4 1791 B15R1.748 C[C@H](CO)NC(=O)c1cc(cc(c1)O)O 240690a_100000737577_100000690292 [1,1,0,0,0,0|2,0,0]=4 1792 B15R1.748 C[C@H](CO)NC(=O)c1cc(cc(c1)O)O 527a_100000737577_100000690292 [1,1,0,0,0,0|2,0,0]=4 1793 B15R1.1216 CCCCC(=O)c1cc(cc(c1)CO)Cl 1458a_100009925505_100000210211 [1,1,0,0,0,0|2,0,0]=4 1794 B15R1.1216 CCCCC(=O)c1cc(cc(c1)CO)F 1458a_100012278920_100000210211 [1,1,0,0,0,0|2,0,0]=4 1795 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)Br 1458a_100011934030_100000210211 [1,1,0,0,0,0|2,0,0]=4 1796 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)C 1458a_100000117910_100000210211 [1,1,0,0,0,0|2,0,0]=4 1797 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)Cl 1458a_100000066651_100000210211 [1,1,0,0,0,0|2,0,0]=4 1798 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)F 1458a_100011934639_100000210211 [1,1,0,0,0,0|2,0,0]=4 1799 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)I 1458a_200010292657_100000210211 [1,1,0,0,0,0|2,0,0]=4 1800 B15R1.1216 CCCCC(=O)c1cc(cc(c1)OC)O 1458a_100000083963_100000210211 [1,1,0,0,0,0|1,0,0]=3 1801 B15R1.1216 CCCNC(=O)c1cc(cc(c1)CO)Cl 240690a_100020643023_100009925505 [1,1,0,0,0,0|2,0,0]=4 1802 B15R1.1216 CCCNC(=O)c1cc(cc(c1)CO)F 240690a_100020643023_100012278920 [1,1,0,0,0,0|2,0,0]=4 1803 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Br 11a_100020643023_100011934030 [1,1,0,0,0,0|2,0,0]=4 1804 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Br 1626a_100020643023_100011934030 [1,1,0,0,0,0|2,0,0]=4 1805 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Br 240690a_100020643023_100011934030 [1,1,0,0,0,0|2,0,0]=4 1806 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Br 527a_100020643023_100011934030 [1,1,0,0,0,0|2,0,0]=4 1807 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)C 11a_100020643023_100000117910 [1,1,0,0,0,0|2,0,0]=4 1808 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)C 1626a_100020643023_100000117910 [1,1,0,0,0,0|2,0,0]=4 1809 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)C 240690a_100020643023_100000117910 [1,1,0,0,0,0|2,0,0]=4 1810 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)C 527a_100020643023_100000117910 [1,1,0,0,0,0|2,0,0]=4 1811 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Cl 11a_100020643023_100000066651 [1,1,0,0,0,0|2,0,0]=4 1812 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Cl 1626a_100020643023_100000066651 [1,1,0,0,0,0|2,0,0]=4 1813 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Cl 240690a_100020643023_100000066651 [1,1,0,0,0,0|2,0,0]=4 1814 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)Cl 527a_100020643023_100000066651 [1,1,0,0,0,0|2,0,0]=4 1815 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)F 11a_100020643023_100011934639 [1,1,0,0,0,0|2,0,0]=4 1816 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)F 1626a_100020643023_100011934639 [1,1,0,0,0,0|2,0,0]=4 1817 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)F 240690a_100020643023_100011934639 [1,1,0,0,0,0|2,0,0]=4 1818 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)F 527a_100020643023_100011934639 [1,1,0,0,0,0|2,0,0]=4 1819 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)I 11a_100020643023_200010292657 [1,1,0,0,0,0|2,0,0]=4 1820 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)I 1626a_100020643023_200010292657 [1,1,0,0,0,0|2,0,0]=4 1821 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)I 240690a_100020643023_200010292657 [1,1,0,0,0,0|2,0,0]=4 1822 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)I 527a_100020643023_200010292657 [1,1,0,0,0,0|2,0,0]=4 1823 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)O 240690a_100020643023_100000083963 [1,1,0,0,0,0|1,0,0]=3 1824 B15R1.1216 CCCNC(=O)c1cc(cc(c1)OC)O 527a_100020643023_100000083963 [1,1,0,0,0,0|1,0,0]=3 1825 B15R1.1216 CCNNC(=O)c1cc(cc(c1)OC)O 22a_100000756455_100000083963 [1,1,0,0,0,0|2,0,0]=4 1826 B15R1.1216 COCCC(=O)c1cc(cc(c1)OC)O 1458a_100000083963_100000233755 [1,1,0,0,0,0|2,0,0]=4 1827 B15R1.1216 COc1cc(cc(c1)C(=O)CCCF)O 1458a_100000083963_100011934791 [1,1,0,0,0,0|2,0,0]=4 1828 B15R1.1216 COc1cc(cc(c1)C(=O)CCCO)O 1458a_100000083963_100011215043 [1,1,0,0,0,0|2,0,0]=4 1829 B15R1.1216 COc1cc(cc(c1)C(=O)CCSC)O 1458a_100000083963_100000751147 [1,1,0,0,0,0|2,0,0]=4 1830 B15R1.1216 COc1cc(cc(c1)C(=O)NCCF)O 240690a_100000724931_100000083963 [1,1,0,0,0,0|2,0,0]=4 1831 B15R1.1216 COc1cc(cc(c1)C(=O)NCCF)O 527a_100000724931_100000083963 [1,1,0,0,0,0|2,0,0]=4 1832 B15R1.1216 COc1cc(cc(c1)C(=O)NCCO)O 240690a_100000210304_100000083963 [1,1,0,0,0,0|2,0,0]=4 1833 B15R1.1216 COc1cc(cc(c1)C(=O)NCCO)O 527a_100000210304_100000083963 [1,1,0,0,0,0|2,0,0]=4 1834 B15R1.1386 C#CCCNC(=O)c1cc(cc(c1)O)O 240690a_100000755551_100000690292 [1,1,0,0,0,0|1,0,1]=4 1835 B15R1.1386 C#CCCNC(=O)c1cc(cc(c1)O)O 527a_100000755551_100000690292 [1,1,0,0,0,0|1,0,1]=4 1836 B15R1.1386 C#CCOCC(=O)c1cc(cc(c1)O)O 34a_100000210247_100010006762 [1,1,0,0,0,0|0,0,2]=4 1837 B15R1.1386 C=CCCNC(=O)c1cc(cc(c1)O)O 240690a_100015191253_100000690292 [1,1,0,0,0,0|1,0,1]=4 1838 B15R1.1386 C=CCCNC(=O)c1cc(cc(c1)O)O 527a_100015191253_100000690292 [1,1,0,0,0,0|1,0,1]=4 1839 B15R1.1386 C=CCOCC(=O)c1cc(cc(c1)O)O 34a_200000210373_100010006762 [1,1,0,0,0,0|0,0,2]=4 1840 B15R1.1386 CC#CCNC(=O)c1cc(cc(c1)O)O 527a_100000685387_100000690292 [1,1,0,0,0,0|1,0,1]=4 1841 B15R1.1386 CCCCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210326 [1,1,0,0,0,0|2,0,0]=4 1842 B15R1.1386 CCCCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210326 [1,1,0,0,0,0|2,0,0]=4 1843 B15R1.1386 CCCCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210326 [1,1,0,0,0,0|2,0,0]=4 1844 B15R1.1386 CCCCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000210326 [1,1,0,0,0,0|2,0,0]=4 1845 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)Br)O 240690a_100000102301_100011934545 [1,1,0,0,0,0|2,0,0]=4 1846 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)Br)O 527a_100000102301_100011934545 [1,1,0,0,0,0|2,0,0]=4 1847 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)Cl)O 240690a_100000102301_100011997059 [1,1,0,0,0,0|2,0,0]=4 1848 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)Cl)O 527a_100000102301_100011997059 [1,1,0,0,0,0|2,0,0]=4 1849 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)F)O 11a_100000102301_100012017291 [1,1,0,0,0,0|2,0,0]=4 1850 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)F)O 240690a_100000102301_100012017291 [1,1,0,0,0,0|2,0,0]=4 1851 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)F)O 527a_100000102301_100012017291 [1,1,0,0,0,0|2,0,0]=4 1852 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)O)C 240690a_100000102301_100000094094 [1,1,0,0,0,0|2,0,0]=4 1853 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)O)C 527a_100000102301_100000094094 [1,1,0,0,0,0|2,0,0]=4 1854 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)O)O 240690a_100000102301_100000690292 [1,1,0,0,0,0|1,0,0]=3 1855 B15R1.1386 CCCCNC(=O)c1cc(cc(c1)O)O 527a_100000102301_100000690292 [1,1,0,0,0,0|1,0,0]=3 1856 B15R1.1386 CCCNN=C(C)c1cc(cc(c1)O)O 4a_100000740057_100000032396 [1,1,0,0,0,0|2,0,0]=4 1857 B15R1.1386 CCCNNC(=O)c1cc(cc(c1)Br)O 22a_100000740057_100011934545 [1,1,0,0,0,0|2,0,0]=4 1858 B15R1.1386 CCCNNC(=O)c1cc(cc(c1)Cl)O 22a_100000740057_100011997059 [1,1,0,0,0,0|2,0,0]=4 1859 B15R1.1386 CCCNNC(=O)c1cc(cc(c1)F)O 22a_100000740057_100012017291 [1,1,0,0,0,0|2,0,0]=4 1860 B15R1.1386 CCCNNC(=O)c1cc(cc(c1)O)C 22a_100000740057_100000094094 [1,1,0,0,0,0|2,0,0]=4 1861 B15R1.1386 CCCNNC(=O)c1cc(cc(c1)O)O 22a_100000740057_100000690292 [1,1,0,0,0,0|1,0,0]=3 1862 B15R1.1386 CCCOCC(=O)c1cc(cc(c1)Cl)Cl 34a_100000210258_200012340517 [1,1,0,0,0,0|2,0,0]=4 1863 B15R1.1386 CCCOCC(=O)c1cc(cc(c1)F)F 34a_100000210258_100011216790 [1,1,0,0,0,0|2,0,0]=4 1864 B15R1.1386 CCCOCC(=O)c1cc(cc(c1)F)F 34a_100012568930_100000210303 [1,1,0,0,0,0|2,0,0]=4 1865 B15R1.1386 CCCOCC(=O)c1cc(cc(c1)F)F 7a_100012568930_100000210303 [1,1,0,0,0,0|2,0,0]=4 1866 B15R1.1386 CCCOCC(=O)c1cc(cc(c1)O)O 34a_100000210258_100010006762 [1,1,0,0,0,0|0,0,0]=2 1867 B15R1.1386 CCCSCC(=O)c1cc(cc(c1)O)O 62a_100000210303_100010006762 [1,1,0,0,0,0|0,1,0]=3 1868 B15R1.1386 CCCSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100000210303 [1,1,0,0,0,0|0,1,0]=3 1869 B15R1.1386 CCOCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100011215890 [1,1,0,0,0,0|2,0,0]=4 1870 B15R1.1386 CCOCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100011215890 [1,1,0,0,0,0|2,0,0]=4 1871 B15R1.1386 CCOCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100011215890 [1,1,0,0,0,0|2,0,0]=4 1872 B15R1.1386 CCOCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100011215890 [1,1,0,0,0,0|2,0,0]=4 1873 B15R1.1386 CCSCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000757381 [1,1,0,0,0,0|2,0,0]=4 1874 B15R1.1386 CCSCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000757381 [1,1,0,0,0,0|2,0,0]=4 1875 B15R1.1386 CCSCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000757381 [1,1,0,0,0,0|2,0,0]=4 1876 B15R1.1386 CCSCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000757381 [1,1,0,0,0,0|2,0,0]=4 1877 B15R1.1386 COCCCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000740836 [1,1,0,0,0,0|2,0,0]=4 1878 B15R1.1386 COCCCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000740836 [1,1,0,0,0,0|2,0,0]=4 1879 B15R1.1386 COCCCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000740836 [1,1,0,0,0,0|2,0,0]=4 1880 B15R1.1386 COCCCC(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000740836 [1,1,0,0,0,0|2,0,0]=4 1881 B15R1.1386 COCCNC(=O)c1cc(cc(c1)Br)O 240690a_100000209980_100011934545 [1,1,0,0,0,0|2,0,0]=4 1882 B15R1.1386 COCCNC(=O)c1cc(cc(c1)Br)O 527a_100000209980_100011934545 [1,1,0,0,0,0|2,0,0]=4 1883 B15R1.1386 COCCNC(=O)c1cc(cc(c1)Cl)O 240690a_100000209980_100011997059 [1,1,0,0,0,0|2,0,0]=4 1884 B15R1.1386 COCCNC(=O)c1cc(cc(c1)Cl)O 527a_100000209980_100011997059 [1,1,0,0,0,0|2,0,0]=4 1885 B15R1.1386 COCCNC(=O)c1cc(cc(c1)F)O 240690a_100000209980_100012017291 [1,1,0,0,0,0|2,0,0]=4 1886 B15R1.1386 COCCNC(=O)c1cc(cc(c1)F)O 527a_100000209980_100012017291 [1,1,0,0,0,0|2,0,0]=4 1887 B15R1.1386 COCCNC(=O)c1cc(cc(c1)O)C 240690a_100000209980_100000094094 [1,1,0,0,0,0|2,0,0]=4 1888 B15R1.1386 COCCNC(=O)c1cc(cc(c1)O)C 527a_100000209980_100000094094 [1,1,0,0,0,0|2,0,0]=4 1889 B15R1.1386 COCCNC(=O)c1cc(cc(c1)O)O 240690a_100000209980_100000690292 [1,1,0,0,0,0|1,0,0]=3 1890 B15R1.1386 COCCNC(=O)c1cc(cc(c1)O)O 527a_100000209980_100000690292 [1,1,0,0,0,0|1,0,0]=3 1891 B15R1.1386 COCSCC(=O)c1cc(cc(c1)O)O 62a_100000766300_100010006762 [1,1,0,0,0,0|1,1,0]=4 1892 B15R1.1386 COCSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100000766300 [1,1,0,0,0,0|1,1,0]=4 1893 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)Br)O 240690a_100020590264_100011934545 [1,1,0,0,0,0|2,0,0]=4 1894 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)Br)O 527a_100020590264_100011934545 [1,1,0,0,0,0|2,0,0]=4 1895 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)Cl)O 240690a_100020590264_100011997059 [1,1,0,0,0,0|2,0,0]=4 1896 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)Cl)O 527a_100020590264_100011997059 [1,1,0,0,0,0|2,0,0]=4 1897 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)F)O 11a_100020590264_100012017291 [1,1,0,0,0,0|2,0,0]=4 1898 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)F)O 240690a_100020590264_100012017291 [1,1,0,0,0,0|2,0,0]=4 1899 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)F)O 527a_100020590264_100012017291 [1,1,0,0,0,0|2,0,0]=4 1900 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)O)C 240690a_100020590264_100000094094 [1,1,0,0,0,0|2,0,0]=4 1901 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)O)C 527a_100020590264_100000094094 [1,1,0,0,0,0|2,0,0]=4 1902 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)O)O 240690a_100020590264_100000690292 [1,1,0,0,0,0|1,0,0]=3 1903 B15R1.1386 CSCCNC(=O)c1cc(cc(c1)O)O 527a_100020590264_100000690292 [1,1,0,0,0,0|1,0,0]=3 1904 B15R1.1386 CSCSCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100011218213 [1,1,0,0,0,0|1,1,0]=4 1905 B15R1.1386 CSCSCC(=O)c1cc(cc(c1)O)O 62a_100011218213_100010006762 [1,1,0,0,0,0|1,1,0]=4 1906 B15R1.1386 Cc1cc(cc(c1)C(=O)CCCCF)O 1458a_100000094094_100000729493 [1,1,0,0,0,0|2,0,0]=4 1907 B15R1.1386 Cc1cc(cc(c1)C(=O)CCCCO)O 1458a_100000094094_100000210776 [1,1,0,0,0,0|2,0,0]=4 1908 B15R1.1386 Cc1cc(cc(c1)C(=O)NCCCF)O 240690a_100015189416_100000094094 [1,1,0,0,0,0|2,0,0]=4 1909 B15R1.1386 Cc1cc(cc(c1)C(=O)NCCCF)O 527a_100015189416_100000094094 [1,1,0,0,0,0|2,0,0]=4 1910 B15R1.1386 Cc1cc(cc(c1)C(=O)NCCCO)O 240690a_100000182051_100000094094 [1,1,0,0,0,0|2,0,0]=4 1911 B15R1.1386 Cc1cc(cc(c1)C(=O)NCCCO)O 527a_100000182051_100000094094 [1,1,0,0,0,0|2,0,0]=4 1912 B15R1.1386 N#CCCNC(=O)c1cc(cc(c1)O)O 240690a_100000720768_100000690292 [1,1,0,0,0,0|1,0,1]=4 1913 B15R1.1386 N#CCCNC(=O)c1cc(cc(c1)O)O 527a_100000720768_100000690292 [1,1,0,0,0,0|1,0,1]=4 1914 B15R1.1386 NCCOCC(=O)c1cc(cc(c1)O)O 34a_100000210304_100010006762 [1,1,0,0,0,0|1,0,0]=3 1915 B15R1.1386 O=C(CCCCF)c1cc(cc(c1)Br)O 1458a_100011934545_100000729493 [1,1,0,0,0,0|2,0,0]=4 1916 B15R1.1386 O=C(CCCCF)c1cc(cc(c1)Cl)O 1458a_100011997059_100000729493 [1,1,0,0,0,0|2,0,0]=4 1917 B15R1.1386 O=C(CCCCF)c1cc(cc(c1)F)O 1458a_100012017291_100000729493 [1,1,0,0,0,0|2,0,0]=4 1918 B15R1.1386 O=C(CCCCO)c1cc(cc(c1)Br)O 1458a_100011934545_100000210776 [1,1,0,0,0,0|2,0,0]=4 1919 B15R1.1386 O=C(CCCCO)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210776 [1,1,0,0,0,0|2,0,0]=4 1920 B15R1.1386 O=C(CCCCO)c1cc(cc(c1)F)O 1458a_100012017291_100000210776 [1,1,0,0,0,0|2,0,0]=4 1921 B15R1.1386 O=C(CNCCF)c1cc(cc(c1)O)O 34a_100000724931_100010006762 [1,1,0,0,0,0|2,0,0]=4 1922 B15R1.1386 O=C(CNCCO)c1cc(cc(c1)O)O 2230a_100016997473_100010006762 [1,1,0,0,0,0|2,0,0]=4 1923 B15R1.1386 O=C(CNCCO)c1cc(cc(c1)O)O 34a_100016990907_100010006762 [1,1,0,0,0,0|2,0,0]=4 1924 B15R1.1386 O=C(COCCBr)c1cc(cc(c1)O)O 34a_100000211926_100010006762 [1,1,0,0,0,0|1,0,0]=3 1925 B15R1.1386 O=C(CSCCF)c1cc(cc(c1)O)O 62a_100010006762_100011217306 [1,1,0,0,0,0|1,1,0]=4 1926 B15R1.1386 O=C(CSCCF)c1cc(cc(c1)O)O 62a_100011217306_100010006762 [1,1,0,0,0,0|1,1,0]=4 1927 B15R1.1386 O=C(CSCCO)c1cc(cc(c1)O)O 62a_100000211926_100010006762 [1,1,0,0,0,0|1,1,0]=4 1928 B15R1.1386 O=C(CSCCO)c1cc(cc(c1)O)O 62a_100010006762_100000211926 [1,1,0,0,0,0|1,1,0]=4 1929 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)Br)O 240690a_100015189416_100011934545 [1,1,0,0,0,0|2,0,0]=4 1930 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)Br)O 527a_100015189416_100011934545 [1,1,0,0,0,0|2,0,0]=4 1931 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)Cl)O 240690a_100015189416_100011997059 [1,1,0,0,0,0|2,0,0]=4 1932 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)Cl)O 527a_100015189416_100011997059 [1,1,0,0,0,0|2,0,0]=4 1933 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)F)O 11a_100015189416_100012017291 [1,1,0,0,0,0|2,0,0]=4 1934 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)F)O 240690a_100015189416_100012017291 [1,1,0,0,0,0|2,0,0]=4 1935 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)F)O 527a_100015189416_100012017291 [1,1,0,0,0,0|2,0,0]=4 1936 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)O)O 240690a_100015189416_100000690292 [1,1,0,0,0,0|1,0,0]=3 1937 B15R1.1386 O=C(NCCCF)c1cc(cc(c1)O)O 527a_100015189416_100000690292 [1,1,0,0,0,0|1,0,0]=3 1938 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)Br)O 240690a_100000182051_100011934545 [1,1,0,0,0,0|2,0,0]=4 1939 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)Br)O 527a_100000182051_100011934545 [1,1,0,0,0,0|2,0,0]=4 1940 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)Cl)O 240690a_100000182051_100011997059 [1,1,0,0,0,0|2,0,0]=4 1941 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)Cl)O 527a_100000182051_100011997059 [1,1,0,0,0,0|2,0,0]=4 1942 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)F)O 240690a_100000182051_100012017291 [1,1,0,0,0,0|2,0,0]=4 1943 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)F)O 527a_100000182051_100012017291 [1,1,0,0,0,0|2,0,0]=4 1944 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)O)O 240690a_100000182051_100000690292 [1,1,0,0,0,0|1,0,0]=3 1945 B15R1.1386 O=C(NCCCO)c1cc(cc(c1)O)O 527a_100000182051_100000690292 [1,1,0,0,0,0|1,0,0]=3 1946 B15R1.1386 O=C(NNCCO)c1cc(cc(c1)O)O 22a_100000210001_100000690292 [1,1,0,0,0,0|2,0,0]=4 1947 B15R1.3941 CCCC(C)C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000766640 [1,1,0,0,0,0|2,0,0]=4 1948 B15R1.3941 CCCC(C)C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000766640 [1,1,0,0,0,0|2,0,0]=4 1949 B15R1.3941 CCCC(C)C(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000766640 [1,1,0,0,0,0|2,0,0]=4 1950 B15R1.3941 CCCC(C)C(=O)c1cc(cc(c1)O)C 1458a_100000094094_100000766640 [1,1,0,0,0,0|2,0,0]=4 1951 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)Br)O 240690a_100000747261_100011934545 [1,1,0,0,0,0|2,0,0]=4 1952 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)Br)O 527a_100000747261_100011934545 [1,1,0,0,0,0|2,0,0]=4 1953 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)Cl)O 240690a_100000747261_100011997059 [1,1,0,0,0,0|2,0,0]=4 1954 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)Cl)O 527a_100000747261_100011997059 [1,1,0,0,0,0|2,0,0]=4 1955 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)F)O 11a_100000747261_100012017291 [1,1,0,0,0,0|2,0,0]=4 1956 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)F)O 240690a_100000747261_100012017291 [1,1,0,0,0,0|2,0,0]=4 1957 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)F)O 527a_100000747261_100012017291 [1,1,0,0,0,0|2,0,0]=4 1958 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)O)C 240690a_100000747261_100000094094 [1,1,0,0,0,0|2,0,0]=4 1959 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)O)C 527a_100000747261_100000094094 [1,1,0,0,0,0|2,0,0]=4 1960 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)O)O 240690a_100000747261_100000690292 [1,1,0,0,0,0|1,0,0]=3 1961 B15R1.3941 CCCN(C)C(=O)c1cc(cc(c1)O)O 527a_100000747261_100000690292 [1,1,0,0,0,0|1,0,0]=3 1962 B15R1.3941 CN(CCO)C(=O)c1cc(cc(c1)O)O 240690a_100000210263_100000690292 [1,1,0,0,0,0|2,0,0]=4 1963 B15R1.3941 CN(CCO)C(=O)c1cc(cc(c1)O)O 527a_100000210263_100000690292 [1,1,0,0,0,0|2,0,0]=4 1964 B15R1.5450 C=C(C)CNC(=O)c1cc(cc(c1)O)O 240690a_100000765925_100000690292 [1,1,0,0,0,0|1,0,1]=4 1965 B15R1.5450 C=C(C)CNC(=O)c1cc(cc(c1)O)O 527a_100000765925_100000690292 [1,1,0,0,0,0|1,0,1]=4 1966 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100000210312 [1,1,0,0,0,0|2,0,0]=4 1967 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100000210312 [1,1,0,0,0,0|2,0,0]=4 1968 B15R1.5450 CC(C)CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100000210312 [1,1,0,0,0,0|2,0,0]=4 1969 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)O 240690a_100000210953_100011934545 [1,1,0,0,0,0|2,0,0]=4 1970 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Br)O 527a_100000210953_100011934545 [1,1,0,0,0,0|2,0,0]=4 1971 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)O 240690a_100000210953_100011997059 [1,1,0,0,0,0|2,0,0]=4 1972 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)Cl)O 527a_100000210953_100011997059 [1,1,0,0,0,0|2,0,0]=4 1973 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 11a_100000210953_100012017291 [1,1,0,0,0,0|2,0,0]=4 1974 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 240690a_100000210953_100012017291 [1,1,0,0,0,0|2,0,0]=4 1975 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)F)O 527a_100000210953_100012017291 [1,1,0,0,0,0|2,0,0]=4 1976 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)O)O 240690a_100000210953_100000690292 [1,1,0,0,0,0|1,0,0]=3 1977 B15R1.5450 CC(C)CNC(=O)c1cc(cc(c1)O)O 527a_100000210953_100000690292 [1,1,0,0,0,0|1,0,0]=3 1978 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)O)O 2230a_100138425928_100010006762 [1,1,0,0,0,0|2,0,0]=4 1979 B15R1.5450 CC(C)NCC(=O)c1cc(cc(c1)O)O 34a_100138425928_100010006762 [1,1,0,0,0,0|2,0,0]=4 1980 B15R1.5450 CC(C)NNC(=O)c1cc(cc(c1)O)O 22a_100000741168_100000690292 [1,1,0,0,0,0|2,0,0]=4 1981 B15R1.5450 CC(C)OCC(=O)c1cc(cc(c1)O)O 34a_100000212225_100010006762 [1,1,0,0,0,0|2,0,0]=4 1982 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)O)O 62a_100000210206_100010006762 [1,1,0,0,0,0|2,0,0]=4 1983 B15R1.5450 CC(C)SCC(=O)c1cc(cc(c1)O)O 62a_100010006762_100000210206 [1,1,0,0,0,0|2,0,0]=4 1984 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_100012276601 [1,1,0,0,0,0|2,0,0]=4 1985 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_100012276601 [1,1,0,0,0,0|2,0,0]=4 1986 B15R1.5450 CC(O)CCC(=O)c1cc(cc(c1)F)O 1458a_100012017291_100012276601 [1,1,0,0,0,0|2,0,0]=4 1987 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)O 240690a_100000210904_100011934545 [1,1,0,0,0,0|2,0,0]=4 1988 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Br)O 527a_100000210904_100011934545 [1,1,0,0,0,0|2,0,0]=4 1989 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)O 240690a_100000210904_100011997059 [1,1,0,0,0,0|2,0,0]=4 1990 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)Cl)O 527a_100000210904_100011997059 [1,1,0,0,0,0|2,0,0]=4 1991 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 11a_100000210904_100012017291 [1,1,0,0,0,0|2,0,0]=4 1992 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 240690a_100000210904_100012017291 [1,1,0,0,0,0|2,0,0]=4 1993 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)F)O 527a_100000210904_100012017291 [1,1,0,0,0,0|2,0,0]=4 1994 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)O)O 240690a_100000210904_100000690292 [1,1,0,0,0,0|1,0,0]=3 1995 B15R1.5450 CC(O)CNC(=O)c1cc(cc(c1)O)O 527a_100000210904_100000690292 [1,1,0,0,0,0|1,0,0]=3 1996 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)C)O 1458a_100000094094_100000210312 [1,1,0,0,0,0|2,0,0]=4 1997 B15R1.5450 Cc1cc(cc(c1)C(=O)CCC(C)O)O 1458a_100000094094_100012276601 [1,1,0,0,0,0|2,0,0]=4 1998 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)O 240690a_100000210953_100000094094 [1,1,0,0,0,0|2,0,0]=4 1999 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)C)O 527a_100000210953_100000094094 [1,1,0,0,0,0|2,0,0]=4 2000 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)O 240690a_100000210904_100000094094 [1,1,0,0,0,0|2,0,0]=4 2001 B15R1.5450 Cc1cc(cc(c1)C(=O)NCC(C)O)O 527a_100000210904_100000094094 [1,1,0,0,0,0|2,0,0]=4 2002 B15R1.5450 O=C(NCC(F)F)c1cc(cc(c1)O)O 240690a_100000765723_100000690292 [1,1,0,0,0,0|2,0,0]=4 2003 B15R1.5450 O=C(NCC(F)F)c1cc(cc(c1)O)O 527a_100000765723_100000690292 [1,1,0,0,0,0|2,0,0]=4 2004 B15R1.45495 CCCCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210211 [1,1,0,0,0,0|2,0,0]=4 2005 B15R1.45495 CCCCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210211 [1,1,0,0,0,0|2,0,0]=4 2006 B15R1.45495 CCCNC(=O)c1cc(cc(c1C)O)Br 240690a_100020643023_100011101721 [1,1,0,0,0,0|2,0,0]=4 2007 B15R1.45495 CCCNC(=O)c1cc(cc(c1C)O)Br 527a_100020643023_100011101721 [1,1,0,0,0,0|2,0,0]=4 2008 B15R1.758 CCC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000210414_100000183813 [1,1,0,0,0,0|1,0,1]=4 2009 B15R1.758 CCC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000747405 [1,1,0,0,0,0|1,0,1]=4 2010 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000748023 [1,1,0,0,0,0|2,0,0]=4 2011 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000748023 [1,1,0,0,0,0|2,0,0]=4 2012 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000748023 [1,1,0,0,0,0|2,0,0]=4 2013 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000748023 [1,1,0,0,0,0|2,0,0]=4 2014 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000748023 [1,1,0,0,0,0|2,0,0]=4 2015 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000748023 [1,1,0,0,0,0|2,0,0]=4 2016 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000748023 [1,1,0,0,0,0|2,0,0]=4 2017 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000748023 [1,1,0,0,0,0|2,0,0]=4 2018 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000748023 [1,1,0,0,0,0|2,0,0]=4 2019 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000748023 [1,1,0,0,0,0|2,0,0]=4 2020 B15R1.758 CCC(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748023 [1,1,0,0,0,0|1,0,0]=3 2021 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Br)O 240690a_100000209981_100000189672 [1,1,0,0,0,0|2,0,0]=4 2022 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)C)O 240690a_100000209981_100000685612 [1,1,0,0,0,0|2,0,0]=4 2023 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)O 240690a_100000209981_100000212196 [1,1,0,0,0,0|2,0,0]=4 2024 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)Cl)O 527a_100000209981_100000212196 [1,1,0,0,0,0|2,0,0]=4 2025 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)O 240690a_100000209981_100000185466 [1,1,0,0,0,0|2,0,0]=4 2026 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)F)O 527a_100000209981_100000185466 [1,1,0,0,0,0|2,0,0]=4 2027 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)O 1626a_100000209981_100000037485 [1,1,0,0,0,0|2,0,0]=4 2028 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)I)O 240690a_100000209981_100000037485 [1,1,0,0,0,0|2,0,0]=4 2029 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Br 240690a_100000209981_100000689001 [1,1,0,0,0,0|2,0,0]=4 2030 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Br 527a_100000209981_100000689001 [1,1,0,0,0,0|2,0,0]=4 2031 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)C 240690a_100000209981_100000233767 [1,1,0,0,0,0|2,0,0]=4 2032 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Cl 240690a_100000209981_100011933997 [1,1,0,0,0,0|2,0,0]=4 2033 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)Cl 527a_100000209981_100011933997 [1,1,0,0,0,0|2,0,0]=4 2034 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)F 240690a_100000209981_100000035894 [1,1,0,0,0,0|2,0,0]=4 2035 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)F 527a_100000209981_100000035894 [1,1,0,0,0,0|2,0,0]=4 2036 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 1626a_100000209981_100000239334 [1,1,0,0,0,0|2,0,0]=4 2037 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 240690a_100000209981_100000239334 [1,1,0,0,0,0|2,0,0]=4 2038 B15R1.758 CCC(C)NC(=O)c1ccc(c(c1)O)I 527a_100000209981_100000239334 [1,1,0,0,0,0|2,0,0]=4 2039 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100011218378 [1,1,0,0,0,0|2,0,0]=4 2040 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100011218378 [1,1,0,0,0,0|2,0,0]=4 2041 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100011218378 [1,1,0,0,0,0|2,0,0]=4 2042 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100011218378 [1,1,0,0,0,0|2,0,0]=4 2043 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100011218378 [1,1,0,0,0,0|2,0,0]=4 2044 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100011218378 [1,1,0,0,0,0|2,0,0]=4 2045 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100011218378 [1,1,0,0,0,0|2,0,0]=4 2046 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011218378 [1,1,0,0,0,0|2,0,0]=4 2047 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100011218378 [1,1,0,0,0,0|2,0,0]=4 2048 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100011218378 [1,1,0,0,0,0|2,0,0]=4 2049 B15R1.758 CCC(O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011218378 [1,1,0,0,0,0|1,0,0]=3 2050 B15R1.758 CCN(C)CC(=O)c1ccc(c(c1)O)O 269982a_100000225621_100000183813 [1,1,0,0,0,0|2,0,0]=4 2051 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100009816398 [1,1,0,0,0,0|2,0,0]=4 2052 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100009816398 [1,1,0,0,0,0|2,0,0]=4 2053 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100009816398 [1,1,0,0,0,0|2,0,0]=4 2054 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100009816398 [1,1,0,0,0,0|2,0,0]=4 2055 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100009816398 [1,1,0,0,0,0|2,0,0]=4 2056 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100009816398 [1,1,0,0,0,0|2,0,0]=4 2057 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100009816398 [1,1,0,0,0,0|2,0,0]=4 2058 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100009816398 [1,1,0,0,0,0|2,0,0]=4 2059 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100009816398 [1,1,0,0,0,0|2,0,0]=4 2060 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100009816398 [1,1,0,0,0,0|2,0,0]=4 2061 B15R1.758 CC[C@H](C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009816398 [1,1,0,0,0,0|1,0,0]=3 2062 B15R1.758 C[C@@H](CO)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000059175 [1,1,0,0,0,0|2,0,0]=4 2063 B15R1.889 C=C(C)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000730704 [1,1,0,0,0,0|1,0,1]=4 2064 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210312 [1,1,0,0,0,0|2,0,0]=4 2065 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210312 [1,1,0,0,0,0|2,0,0]=4 2066 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210312 [1,1,0,0,0,0|2,0,0]=4 2067 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210312 [1,1,0,0,0,0|2,0,0]=4 2068 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210312 [1,1,0,0,0,0|2,0,0]=4 2069 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210312 [1,1,0,0,0,0|2,0,0]=4 2070 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210312 [1,1,0,0,0,0|2,0,0]=4 2071 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210312 [1,1,0,0,0,0|2,0,0]=4 2072 B15R1.889 CC(C)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210312 [1,1,0,0,0,0|1,0,0]=3 2073 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210953_100000189672 [1,1,0,0,0,0|2,0,0]=4 2074 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210953_100000212196 [1,1,0,0,0,0|2,0,0]=4 2075 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210953_100000212196 [1,1,0,0,0,0|2,0,0]=4 2076 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210953_100000185466 [1,1,0,0,0,0|2,0,0]=4 2077 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)F)O 527a_100000210953_100000185466 [1,1,0,0,0,0|2,0,0]=4 2078 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 1626a_100000210953_100000037485 [1,1,0,0,0,0|2,0,0]=4 2079 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210953_100000037485 [1,1,0,0,0,0|2,0,0]=4 2080 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210953_100000689001 [1,1,0,0,0,0|2,0,0]=4 2081 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210953_100000689001 [1,1,0,0,0,0|2,0,0]=4 2082 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210953_100011933997 [1,1,0,0,0,0|2,0,0]=4 2083 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210953_100011933997 [1,1,0,0,0,0|2,0,0]=4 2084 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210953_100000035894 [1,1,0,0,0,0|2,0,0]=4 2085 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)F 527a_100000210953_100000035894 [1,1,0,0,0,0|2,0,0]=4 2086 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 1626a_100000210953_100000239334 [1,1,0,0,0,0|2,0,0]=4 2087 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210953_100000239334 [1,1,0,0,0,0|2,0,0]=4 2088 B15R1.889 CC(C)CNC(=O)c1ccc(c(c1)O)I 527a_100000210953_100000239334 [1,1,0,0,0,0|2,0,0]=4 2089 B15R1.889 CC(C)SCC(=O)c1ccc(c(c1)O)O 62a_100000210206_100000183813 [1,1,0,0,0,0|2,0,0]=4 2090 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100012276601 [1,1,0,0,0,0|2,0,0]=4 2091 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100012276601 [1,1,0,0,0,0|2,0,0]=4 2092 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100012276601 [1,1,0,0,0,0|2,0,0]=4 2093 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100012276601 [1,1,0,0,0,0|2,0,0]=4 2094 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100012276601 [1,1,0,0,0,0|2,0,0]=4 2095 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100012276601 [1,1,0,0,0,0|2,0,0]=4 2096 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100012276601 [1,1,0,0,0,0|2,0,0]=4 2097 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100012276601 [1,1,0,0,0,0|2,0,0]=4 2098 B15R1.889 CC(O)CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100012276601 [1,1,0,0,0,0|1,0,0]=3 2099 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Br)O 240690a_100000210904_100000189672 [1,1,0,0,0,0|2,0,0]=4 2100 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 240690a_100000210904_100000212196 [1,1,0,0,0,0|2,0,0]=4 2101 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)Cl)O 527a_100000210904_100000212196 [1,1,0,0,0,0|2,0,0]=4 2102 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 240690a_100000210904_100000185466 [1,1,0,0,0,0|2,0,0]=4 2103 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)F)O 527a_100000210904_100000185466 [1,1,0,0,0,0|2,0,0]=4 2104 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)I)O 240690a_100000210904_100000037485 [1,1,0,0,0,0|2,0,0]=4 2105 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 240690a_100000210904_100000689001 [1,1,0,0,0,0|2,0,0]=4 2106 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Br 527a_100000210904_100000689001 [1,1,0,0,0,0|2,0,0]=4 2107 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 240690a_100000210904_100011933997 [1,1,0,0,0,0|2,0,0]=4 2108 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)Cl 527a_100000210904_100011933997 [1,1,0,0,0,0|2,0,0]=4 2109 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 240690a_100000210904_100000035894 [1,1,0,0,0,0|2,0,0]=4 2110 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)F 527a_100000210904_100000035894 [1,1,0,0,0,0|2,0,0]=4 2111 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 240690a_100000210904_100000239334 [1,1,0,0,0,0|2,0,0]=4 2112 B15R1.889 CC(O)CNC(=O)c1ccc(c(c1)O)I 527a_100000210904_100000239334 [1,1,0,0,0,0|2,0,0]=4 2113 B15R1.889 Cc1cc(ccc1O)C(=O)CCC(C)C 1458a_100000685612_100000210312 [1,1,0,0,0,0|2,0,0]=4 2114 B15R1.889 Cc1cc(ccc1O)C(=O)CCC(C)O 1458a_100000685612_100012276601 [1,1,0,0,0,0|2,0,0]=4 2115 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)C 240690a_100000210953_100000685612 [1,1,0,0,0,0|2,0,0]=4 2116 B15R1.889 Cc1cc(ccc1O)C(=O)NCC(C)O 240690a_100000210904_100000685612 [1,1,0,0,0,0|2,0,0]=4 2117 B15R1.889 Cc1ccc(cc1O)C(=O)CCC(C)C 1458a_100000233767_100000210312 [1,1,0,0,0,0|2,0,0]=4 2118 B15R1.889 Cc1ccc(cc1O)C(=O)CCC(C)O 1458a_100000233767_100012276601 [1,1,0,0,0,0|2,0,0]=4 2119 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)C 240690a_100000210953_100000233767 [1,1,0,0,0,0|2,0,0]=4 2120 B15R1.889 Cc1ccc(cc1O)C(=O)NCC(C)O 240690a_100000210904_100000233767 [1,1,0,0,0,0|2,0,0]=4 2121 B15R1.1243 CCCCC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_100000210211 [1,1,0,0,0,0|2,0,0]=4 2122 B15R1.1243 CCCCC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_100000210211 [1,1,0,0,0,0|2,0,0]=4 2123 B15R1.1243 CCCCC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_100000210211 [1,1,0,0,0,0|2,0,0]=4 2124 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210211 [1,1,0,0,0,0|2,0,0]=4 2125 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210211 [1,1,0,0,0,0|2,0,0]=4 2126 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210211 [1,1,0,0,0,0|2,0,0]=4 2127 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210211 [1,1,0,0,0,0|2,0,0]=4 2128 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210211 [1,1,0,0,0,0|2,0,0]=4 2129 B15R1.1243 CCCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210211 [1,1,0,0,0,0|1,0,0]=3 2130 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)Br 1626a_100020643023_100010218026 [1,1,0,0,0,0|2,0,0]=4 2131 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)Br 240690a_100020643023_100010218026 [1,1,0,0,0,0|2,0,0]=4 2132 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)F 1626a_100020643023_100011803322 [1,1,0,0,0,0|2,0,0]=4 2133 B15R1.1243 CCCNC(=O)c1ccc(c(c1)CO)F 240690a_100020643023_100011803322 [1,1,0,0,0,0|2,0,0]=4 2134 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 11a_100020643023_100011934951 [1,1,0,0,0,0|2,0,0]=4 2135 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 1626a_100020643023_100011934951 [1,1,0,0,0,0|2,0,0]=4 2136 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 240690a_100020643023_100011934951 [1,1,0,0,0,0|2,0,0]=4 2137 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Br 527a_100020643023_100011934951 [1,1,0,0,0,0|2,0,0]=4 2138 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 11a_100020643023_100000212341 [1,1,0,0,0,0|2,0,0]=4 2139 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 1626a_100020643023_100000212341 [1,1,0,0,0,0|2,0,0]=4 2140 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 240690a_100020643023_100000212341 [1,1,0,0,0,0|2,0,0]=4 2141 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)C 527a_100020643023_100000212341 [1,1,0,0,0,0|2,0,0]=4 2142 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 11a_100020643023_100000181799 [1,1,0,0,0,0|2,0,0]=4 2143 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 1626a_100020643023_100000181799 [1,1,0,0,0,0|2,0,0]=4 2144 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 240690a_100020643023_100000181799 [1,1,0,0,0,0|2,0,0]=4 2145 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)Cl 527a_100020643023_100000181799 [1,1,0,0,0,0|2,0,0]=4 2146 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 11a_100020643023_100000757635 [1,1,0,0,0,0|2,0,0]=4 2147 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 1626a_100020643023_100000757635 [1,1,0,0,0,0|2,0,0]=4 2148 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 240690a_100020643023_100000757635 [1,1,0,0,0,0|2,0,0]=4 2149 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)F 527a_100020643023_100000757635 [1,1,0,0,0,0|2,0,0]=4 2150 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 11a_100020643023_100012356290 [1,1,0,0,0,0|2,0,0]=4 2151 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 1626a_100020643023_100012356290 [1,1,0,0,0,0|2,0,0]=4 2152 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 240690a_100020643023_100012356290 [1,1,0,0,0,0|2,0,0]=4 2153 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)I 527a_100020643023_100012356290 [1,1,0,0,0,0|2,0,0]=4 2154 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)O 240690a_100020643023_100000687070 [1,1,0,0,0,0|1,0,0]=3 2155 B15R1.1243 CCCNC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_200010239580 [1,1,0,0,0,0|1,0,0]=3 2156 B15R1.1243 CCNNC(=O)c1ccc(c(c1)OC)O 22a_100000756455_100000687070 [1,1,0,0,0,0|2,0,0]=4 2157 B15R1.1243 CCOCC(=O)c1ccc(c(c1)CO)O 34a_100121572206_100010262812 [1,1,0,0,0,0|2,0,0]=4 2158 B15R1.1243 CCSCC(=O)c1ccc(c(c1)CO)O 62a_100000210202_100010262812 [1,1,0,0,0,0|2,0,0]=4 2159 B15R1.1243 CCSCC(=O)c1ccc(c(c1)CO)O 62a_100010262812_100000210202 [1,1,0,0,0,0|2,0,0]=4 2160 B15R1.1243 CCSCC(=O)c1ccc(c(c1)OC)O 62a_100010206313_100000210202 [1,1,0,0,0,0|2,0,0]=4 2161 B15R1.1243 COCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000233755 [1,1,0,0,0,0|2,0,0]=4 2162 B15R1.1243 COc1cc(ccc1O)C(=O)CCCF 1458a_100000687070_100011934791 [1,1,0,0,0,0|2,0,0]=4 2163 B15R1.1243 COc1cc(ccc1O)C(=O)CCCO 1458a_100000687070_100011215043 [1,1,0,0,0,0|2,0,0]=4 2164 B15R1.1243 COc1cc(ccc1O)C(=O)CCSC 1458a_100000687070_100000751147 [1,1,0,0,0,0|2,0,0]=4 2165 B15R1.1243 COc1cc(ccc1O)C(=O)NCCF 240690a_100000724931_100000687070 [1,1,0,0,0,0|2,0,0]=4 2166 B15R1.1243 COc1cc(ccc1O)C(=O)NCCO 240690a_100000210304_100000687070 [1,1,0,0,0,0|2,0,0]=4 2167 B15R1.1245 C=Cc1ccc(cc1C)C(=O)OCCC 271570a_100011290941_200013322381 [1,1,0,0,0,0|2,0,0]=4 2168 B15R1.1245 CCCCC(=O)c1ccc(c(c1)Br)OC 1458a_100000187947_100000210211 [1,1,0,0,0,0|2,0,0]=4 2169 B15R1.1245 CCCCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210211 [1,1,0,0,0,0|2,0,0]=4 2170 B15R1.1245 CCCCC(=O)c1ccc(c(c1)Cl)OC 1458a_100000188346_100000210211 [1,1,0,0,0,0|2,0,0]=4 2171 B15R1.1245 CCCCC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_100000210211 [1,1,0,0,0,0|2,0,0]=4 2172 B15R1.1245 CCCCC(=O)c1ccc(c(c1)F)OC 1458a_100000186160_100000210211 [1,1,0,0,0,0|2,0,0]=4 2173 B15R1.1245 CCCCC(=O)c1ccc(c(c1)I)OC 1458a_100000188716_100000210211 [1,1,0,0,0,0|2,0,0]=4 2174 B15R1.1245 CCCCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210211 [1,1,0,0,0,0|2,0,0]=4 2175 B15R1.1245 CCCCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210211 [1,1,0,0,0,0|1,0,0]=3 2176 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 11a_100020643023_100000187947 [1,1,0,0,0,0|2,0,0]=4 2177 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 1626a_100020643023_100000187947 [1,1,0,0,0,0|2,0,0]=4 2178 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 240690a_100020643023_100000187947 [1,1,0,0,0,0|2,0,0]=4 2179 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Br)OC 527a_100020643023_100000187947 [1,1,0,0,0,0|2,0,0]=4 2180 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 11a_100020643023_100011202886 [1,1,0,0,0,0|2,0,0]=4 2181 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 1626a_100020643023_100011202886 [1,1,0,0,0,0|2,0,0]=4 2182 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 240690a_100020643023_100011202886 [1,1,0,0,0,0|2,0,0]=4 2183 B15R1.1245 CCCNC(=O)c1ccc(c(c1)C)OC 527a_100020643023_100011202886 [1,1,0,0,0,0|2,0,0]=4 2184 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 11a_100020643023_100000188346 [1,1,0,0,0,0|2,0,0]=4 2185 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 1626a_100020643023_100000188346 [1,1,0,0,0,0|2,0,0]=4 2186 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 240690a_100020643023_100000188346 [1,1,0,0,0,0|2,0,0]=4 2187 B15R1.1245 CCCNC(=O)c1ccc(c(c1)Cl)OC 527a_100020643023_100000188346 [1,1,0,0,0,0|2,0,0]=4 2188 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)CO 1626a_100020643023_100000687192 [1,1,0,0,0,0|2,0,0]=4 2189 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)CO 240690a_100020643023_100000687192 [1,1,0,0,0,0|2,0,0]=4 2190 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 11a_100020643023_100000186160 [1,1,0,0,0,0|2,0,0]=4 2191 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 1626a_100020643023_100000186160 [1,1,0,0,0,0|2,0,0]=4 2192 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 240690a_100020643023_100000186160 [1,1,0,0,0,0|2,0,0]=4 2193 B15R1.1245 CCCNC(=O)c1ccc(c(c1)F)OC 527a_100020643023_100000186160 [1,1,0,0,0,0|2,0,0]=4 2194 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 11a_100020643023_100000188716 [1,1,0,0,0,0|2,0,0]=4 2195 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 1626a_100020643023_100000188716 [1,1,0,0,0,0|2,0,0]=4 2196 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 240690a_100020643023_100000188716 [1,1,0,0,0,0|2,0,0]=4 2197 B15R1.1245 CCCNC(=O)c1ccc(c(c1)I)OC 527a_100020643023_100000188716 [1,1,0,0,0,0|2,0,0]=4 2198 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)CC 240690a_100020643023_100000089006 [1,1,0,0,0,0|2,0,0]=4 2199 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)CC 527a_100020643023_100000089006 [1,1,0,0,0,0|2,0,0]=4 2200 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)OC 240690a_100020643023_100000766810 [1,1,0,0,0,0|1,0,0]=3 2201 B15R1.1245 CCCNC(=O)c1ccc(c(c1)O)OC 527a_100020643023_100000766810 [1,1,0,0,0,0|1,0,0]=3 2202 B15R1.1245 CCCOC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200013322381 [1,1,0,0,0,0|2,0,0]=4 2203 B15R1.1245 CCCOC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200013322381 [1,1,0,0,0,0|1,1,0]=4 2204 B15R1.1245 CCCOC(=O)c1ccc(c(c1)C)SC 62a_200013322381_200000210301 [1,1,0,0,0,0|1,1,0]=4 2205 B15R1.1245 CCCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200013322381_200025704644 [1,1,0,0,0,0|1,1,0]=4 2206 B15R1.1245 CCCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200013322381 [1,1,0,0,0,0|1,1,0]=4 2207 B15R1.1245 CCNNC(=O)c1ccc(c(c1)O)OC 22a_100000756455_100000766810 [1,1,0,0,0,0|2,0,0]=4 2208 B15R1.1245 COCCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000233755 [1,1,0,0,0,0|2,0,0]=4 2209 B15R1.1245 COc1ccc(cc1O)C(=O)CCCF 1458a_100000766810_100011934791 [1,1,0,0,0,0|2,0,0]=4 2210 B15R1.1245 COc1ccc(cc1O)C(=O)CCCO 1458a_100000766810_100011215043 [1,1,0,0,0,0|2,0,0]=4 2211 B15R1.1245 COc1ccc(cc1O)C(=O)CCSC 1458a_100000766810_100000751147 [1,1,0,0,0,0|2,0,0]=4 2212 B15R1.1245 COc1ccc(cc1O)C(=O)NCCF 240690a_100000724931_100000766810 [1,1,0,0,0,0|2,0,0]=4 2213 B15R1.1245 COc1ccc(cc1O)C(=O)NCCF 527a_100000724931_100000766810 [1,1,0,0,0,0|2,0,0]=4 2214 B15R1.1245 COc1ccc(cc1O)C(=O)NCCO 240690a_100000210304_100000766810 [1,1,0,0,0,0|2,0,0]=4 2215 B15R1.1245 COc1ccc(cc1O)C(=O)NCCO 527a_100000210304_100000766810 [1,1,0,0,0,0|2,0,0]=4 2216 B15R1.1404 C#CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000731252 [1,1,0,0,0,0|1,0,1]=4 2217 B15R1.1404 C=CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000757094 [1,1,0,0,0,0|1,0,1]=4 2218 B15R1.1404 CC/C=C\CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100103147603 [1,1,0,0,0,0|1,0,1]=4 2219 B15R1.1404 CCC#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009813939 [1,1,0,0,0,0|1,0,1]=4 2220 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210326 [1,1,0,0,0,0|2,0,0]=4 2221 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210326 [1,1,0,0,0,0|2,0,0]=4 2222 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210326 [1,1,0,0,0,0|2,0,0]=4 2223 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210326 [1,1,0,0,0,0|2,0,0]=4 2224 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210326 [1,1,0,0,0,0|2,0,0]=4 2225 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210326 [1,1,0,0,0,0|2,0,0]=4 2226 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210326 [1,1,0,0,0,0|2,0,0]=4 2227 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210326 [1,1,0,0,0,0|2,0,0]=4 2228 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210326 [1,1,0,0,0,0|2,0,0]=4 2229 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210326 [1,1,0,0,0,0|2,0,0]=4 2230 B15R1.1404 CCCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210326 [1,1,0,0,0,0|1,0,0]=3 2231 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000102301_100000189672 [1,1,0,0,0,0|2,0,0]=4 2232 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)O 240690a_100000102301_100000685612 [1,1,0,0,0,0|2,0,0]=4 2233 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012359895 [1,1,0,0,0,0|2,0,0]=4 2234 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000102301_100000212196 [1,1,0,0,0,0|2,0,0]=4 2235 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000102301_100000212196 [1,1,0,0,0,0|2,0,0]=4 2236 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)O 240690a_100000102301_100000185466 [1,1,0,0,0,0|2,0,0]=4 2237 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)F)O 527a_100000102301_100000185466 [1,1,0,0,0,0|2,0,0]=4 2238 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)O 1626a_100000102301_100000037485 [1,1,0,0,0,0|2,0,0]=4 2239 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)I)O 240690a_100000102301_100000037485 [1,1,0,0,0,0|2,0,0]=4 2240 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000102301_100000689001 [1,1,0,0,0,0|2,0,0]=4 2241 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Br 527a_100000102301_100000689001 [1,1,0,0,0,0|2,0,0]=4 2242 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)C 240690a_100000102301_100000233767 [1,1,0,0,0,0|2,0,0]=4 2243 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000102301_100011933997 [1,1,0,0,0,0|2,0,0]=4 2244 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000102301_100011933997 [1,1,0,0,0,0|2,0,0]=4 2245 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 240690a_100000102301_100000035894 [1,1,0,0,0,0|2,0,0]=4 2246 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359903 [1,1,0,0,0,0|2,0,0]=4 2247 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)F 527a_100000102301_100000035894 [1,1,0,0,0,0|2,0,0]=4 2248 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 1626a_100000102301_100000239334 [1,1,0,0,0,0|2,0,0]=4 2249 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 240690a_100000102301_100000239334 [1,1,0,0,0,0|2,0,0]=4 2250 B15R1.1404 CCCCNC(=O)c1ccc(c(c1)O)I 527a_100000102301_100000239334 [1,1,0,0,0,0|2,0,0]=4 2251 B15R1.1404 CCCNN=C(C)c1ccc(c(c1)O)O 4a_100000740057_100000025746 [1,1,0,0,0,0|2,0,0]=4 2252 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Br)O 22a_100000740057_100000189672 [1,1,0,0,0,0|2,0,0]=4 2253 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)C)O 22a_100000740057_100000685612 [1,1,0,0,0,0|2,0,0]=4 2254 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)Cl)O 22a_100000740057_100000212196 [1,1,0,0,0,0|2,0,0]=4 2255 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)F)O 22a_100000740057_100000185466 [1,1,0,0,0,0|2,0,0]=4 2256 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)I)O 22a_100000740057_100000037485 [1,1,0,0,0,0|2,0,0]=4 2257 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)Br 22a_100000740057_100000689001 [1,1,0,0,0,0|2,0,0]=4 2258 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)C 22a_100000740057_100000233767 [1,1,0,0,0,0|2,0,0]=4 2259 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)Cl 22a_100000740057_100011933997 [1,1,0,0,0,0|2,0,0]=4 2260 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)F 22a_100000740057_100000035894 [1,1,0,0,0,0|2,0,0]=4 2261 B15R1.1404 CCCNNC(=O)c1ccc(c(c1)O)I 22a_100000740057_100000239334 [1,1,0,0,0,0|2,0,0]=4 2262 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Br)C 34a_100000210258_100012346676 [1,1,0,0,0,0|2,0,0]=4 2263 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Br)F 34a_100000210258_100011217175 [1,1,0,0,0,0|2,0,0]=4 2264 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Cl)Br 34a_100000210258_200012349649 [1,1,0,0,0,0|2,0,0]=4 2265 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Cl)Cl 7a_100000246375_100000210303 [1,1,0,0,0,0|2,0,0]=4 2266 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)Cl)F 34a_100000210258_100000757878 [1,1,0,0,0,0|2,0,0]=4 2267 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)F)Br 34a_100000210258_100012361357 [1,1,0,0,0,0|2,0,0]=4 2268 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)F)C 34a_100000210258_100011219196 [1,1,0,0,0,0|2,0,0]=4 2269 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)F)Cl 34a_100000210258_100012351892 [1,1,0,0,0,0|2,0,0]=4 2270 B15R1.1404 CCCOCC(=O)c1ccc(c(c1)F)F 34a_100000210258_100000183380 [1,1,0,0,0,0|2,0,0]=4 2271 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)Cl)O 62a_100000210303_200010170092 [1,1,0,0,0,0|1,1,0]=4 2272 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_100000210303 [1,1,0,0,0,0|1,1,0]=4 2273 B15R1.1404 CCCSCC(=O)c1ccc(c(c1)O)O 62a_100000210303_100000183813 [1,1,0,0,0,0|0,1,0]=3 2274 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100011215890 [1,1,0,0,0,0|2,0,0]=4 2275 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100011215890 [1,1,0,0,0,0|2,0,0]=4 2276 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100011215890 [1,1,0,0,0,0|2,0,0]=4 2277 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100011215890 [1,1,0,0,0,0|2,0,0]=4 2278 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100011215890 [1,1,0,0,0,0|2,0,0]=4 2279 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100011215890 [1,1,0,0,0,0|2,0,0]=4 2280 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100011215890 [1,1,0,0,0,0|2,0,0]=4 2281 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100011215890 [1,1,0,0,0,0|2,0,0]=4 2282 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100011215890 [1,1,0,0,0,0|2,0,0]=4 2283 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100011215890 [1,1,0,0,0,0|2,0,0]=4 2284 B15R1.1404 CCOCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011215890 [1,1,0,0,0,0|1,0,0]=3 2285 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000757381 [1,1,0,0,0,0|2,0,0]=4 2286 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000757381 [1,1,0,0,0,0|2,0,0]=4 2287 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000757381 [1,1,0,0,0,0|2,0,0]=4 2288 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000757381 [1,1,0,0,0,0|2,0,0]=4 2289 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000757381 [1,1,0,0,0,0|2,0,0]=4 2290 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000757381 [1,1,0,0,0,0|2,0,0]=4 2291 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000757381 [1,1,0,0,0,0|2,0,0]=4 2292 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000757381 [1,1,0,0,0,0|2,0,0]=4 2293 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000757381 [1,1,0,0,0,0|2,0,0]=4 2294 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000757381 [1,1,0,0,0,0|2,0,0]=4 2295 B15R1.1404 CCSCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000757381 [1,1,0,0,0,0|1,0,0]=3 2296 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000740836 [1,1,0,0,0,0|2,0,0]=4 2297 B15R1.1404 COCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000740836 [1,1,0,0,0,0|2,0,0]=4 2298 B15R1.1404 COCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000740836 [1,1,0,0,0,0|2,0,0]=4 2299 B15R1.1404 COCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000740836 [1,1,0,0,0,0|2,0,0]=4 2300 B15R1.1404 COCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000740836 [1,1,0,0,0,0|2,0,0]=4 2301 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000740836 [1,1,0,0,0,0|2,0,0]=4 2302 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000740836 [1,1,0,0,0,0|2,0,0]=4 2303 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000740836 [1,1,0,0,0,0|2,0,0]=4 2304 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000740836 [1,1,0,0,0,0|2,0,0]=4 2305 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000740836 [1,1,0,0,0,0|2,0,0]=4 2306 B15R1.1404 COCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000740836 [1,1,0,0,0,0|1,0,0]=3 2307 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Br)O 240690a_100000209980_100000189672 [1,1,0,0,0,0|2,0,0]=4 2308 B15R1.1404 COCCNC(=O)c1ccc(c(c1)C)O 240690a_100000209980_100000685612 [1,1,0,0,0,0|2,0,0]=4 2309 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100000209980_100000212196 [1,1,0,0,0,0|2,0,0]=4 2310 B15R1.1404 COCCNC(=O)c1ccc(c(c1)Cl)O 527a_100000209980_100000212196 [1,1,0,0,0,0|2,0,0]=4 2311 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)O 240690a_100000209980_100000185466 [1,1,0,0,0,0|2,0,0]=4 2312 B15R1.1404 COCCNC(=O)c1ccc(c(c1)F)O 527a_100000209980_100000185466 [1,1,0,0,0,0|2,0,0]=4 2313 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)O 1626a_100000209980_100000037485 [1,1,0,0,0,0|2,0,0]=4 2314 B15R1.1404 COCCNC(=O)c1ccc(c(c1)I)O 240690a_100000209980_100000037485 [1,1,0,0,0,0|2,0,0]=4 2315 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Br 240690a_100000209980_100000689001 [1,1,0,0,0,0|2,0,0]=4 2316 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Br 527a_100000209980_100000689001 [1,1,0,0,0,0|2,0,0]=4 2317 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)C 240690a_100000209980_100000233767 [1,1,0,0,0,0|2,0,0]=4 2318 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100000209980_100011933997 [1,1,0,0,0,0|2,0,0]=4 2319 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)Cl 527a_100000209980_100011933997 [1,1,0,0,0,0|2,0,0]=4 2320 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)F 240690a_100000209980_100000035894 [1,1,0,0,0,0|2,0,0]=4 2321 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)F 527a_100000209980_100000035894 [1,1,0,0,0,0|2,0,0]=4 2322 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 1626a_100000209980_100000239334 [1,1,0,0,0,0|2,0,0]=4 2323 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 240690a_100000209980_100000239334 [1,1,0,0,0,0|2,0,0]=4 2324 B15R1.1404 COCCNC(=O)c1ccc(c(c1)O)I 527a_100000209980_100000239334 [1,1,0,0,0,0|2,0,0]=4 2325 B15R1.1404 COCSCC(=O)c1ccc(c(c1)O)O 62a_100000766300_100000183813 [1,1,0,0,0,0|1,1,0]=4 2326 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Br)O 240690a_100020590264_100000189672 [1,1,0,0,0,0|2,0,0]=4 2327 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)C)O 240690a_100020590264_100000685612 [1,1,0,0,0,0|2,0,0]=4 2328 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)O 240690a_100020590264_100000212196 [1,1,0,0,0,0|2,0,0]=4 2329 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)Cl)O 527a_100020590264_100000212196 [1,1,0,0,0,0|2,0,0]=4 2330 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)O 240690a_100020590264_100000185466 [1,1,0,0,0,0|2,0,0]=4 2331 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)F)O 527a_100020590264_100000185466 [1,1,0,0,0,0|2,0,0]=4 2332 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)O 1626a_100020590264_100000037485 [1,1,0,0,0,0|2,0,0]=4 2333 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)I)O 240690a_100020590264_100000037485 [1,1,0,0,0,0|2,0,0]=4 2334 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Br 240690a_100020590264_100000689001 [1,1,0,0,0,0|2,0,0]=4 2335 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Br 527a_100020590264_100000689001 [1,1,0,0,0,0|2,0,0]=4 2336 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)C 240690a_100020590264_100000233767 [1,1,0,0,0,0|2,0,0]=4 2337 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Cl 240690a_100020590264_100011933997 [1,1,0,0,0,0|2,0,0]=4 2338 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)Cl 527a_100020590264_100011933997 [1,1,0,0,0,0|2,0,0]=4 2339 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)F 240690a_100020590264_100000035894 [1,1,0,0,0,0|2,0,0]=4 2340 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)F 527a_100020590264_100000035894 [1,1,0,0,0,0|2,0,0]=4 2341 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 1626a_100020590264_100000239334 [1,1,0,0,0,0|2,0,0]=4 2342 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 240690a_100020590264_100000239334 [1,1,0,0,0,0|2,0,0]=4 2343 B15R1.1404 CSCCNC(=O)c1ccc(c(c1)O)I 527a_100020590264_100000239334 [1,1,0,0,0,0|2,0,0]=4 2344 B15R1.1404 CSCSCC(=O)c1ccc(c(c1)O)O 62a_100011218213_100000183813 [1,1,0,0,0,0|1,1,0]=4 2345 B15R1.1404 Cc1cc(ccc1O)C(=O)CCCCF 1458a_100000685612_100000729493 [1,1,0,0,0,0|2,0,0]=4 2346 B15R1.1404 Cc1cc(ccc1O)C(=O)CCCCO 1458a_100000685612_100000210776 [1,1,0,0,0,0|2,0,0]=4 2347 B15R1.1404 Cc1cc(ccc1O)C(=O)NCCCF 240690a_100015189416_100000685612 [1,1,0,0,0,0|2,0,0]=4 2348 B15R1.1404 Cc1cc(ccc1O)C(=O)NCCCO 240690a_100000182051_100000685612 [1,1,0,0,0,0|2,0,0]=4 2349 B15R1.1404 Cc1ccc(cc1O)C(=O)CCCCF 1458a_100000233767_100000729493 [1,1,0,0,0,0|2,0,0]=4 2350 B15R1.1404 Cc1ccc(cc1O)C(=O)CCCCO 1458a_100000233767_100000210776 [1,1,0,0,0,0|2,0,0]=4 2351 B15R1.1404 Cc1ccc(cc1O)C(=O)NCCCF 240690a_100015189416_100000233767 [1,1,0,0,0,0|2,0,0]=4 2352 B15R1.1404 Cc1ccc(cc1O)C(=O)NCCCO 240690a_100000182051_100000233767 [1,1,0,0,0,0|2,0,0]=4 2353 B15R1.1404 N#CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000211468 [1,1,0,0,0,0|1,0,1]=4 2354 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)Br)O 1458a_100000189672_100000729493 [1,1,0,0,0,0|2,0,0]=4 2355 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)Cl)O 1458a_100000212196_100000729493 [1,1,0,0,0,0|2,0,0]=4 2356 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)F)O 1458a_100000185466_100000729493 [1,1,0,0,0,0|2,0,0]=4 2357 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)I)O 1458a_100000037485_100000729493 [1,1,0,0,0,0|2,0,0]=4 2358 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)Br 1458a_100000689001_100000729493 [1,1,0,0,0,0|2,0,0]=4 2359 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)Cl 1458a_100011933997_100000729493 [1,1,0,0,0,0|2,0,0]=4 2360 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)F 1458a_100000035894_100000729493 [1,1,0,0,0,0|2,0,0]=4 2361 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)I 1458a_100000239334_100000729493 [1,1,0,0,0,0|2,0,0]=4 2362 B15R1.1404 O=C(CCCCF)c1ccc(c(c1)O)O 1458a_100000212155_100000729493 [1,1,0,0,0,0|1,0,0]=3 2363 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Br)O 1458a_100000189672_100000210776 [1,1,0,0,0,0|2,0,0]=4 2364 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210776 [1,1,0,0,0,0|2,0,0]=4 2365 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)F)O 1458a_100000185466_100000210776 [1,1,0,0,0,0|2,0,0]=4 2366 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)I)O 1458a_100000037485_100000210776 [1,1,0,0,0,0|2,0,0]=4 2367 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)Br 1458a_100000689001_100000210776 [1,1,0,0,0,0|2,0,0]=4 2368 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210776 [1,1,0,0,0,0|2,0,0]=4 2369 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)F 1458a_100000035894_100000210776 [1,1,0,0,0,0|2,0,0]=4 2370 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)I 1458a_100000239334_100000210776 [1,1,0,0,0,0|2,0,0]=4 2371 B15R1.1404 O=C(CCCCO)c1ccc(c(c1)O)O 1458a_100000212155_100000210776 [1,1,0,0,0,0|1,0,0]=3 2372 B15R1.1404 O=C(CSCCF)c1ccc(c(c1)O)O 62a_100011217306_100000183813 [1,1,0,0,0,0|1,1,0]=4 2373 B15R1.1404 O=C(CSCCO)c1ccc(c(c1)O)O 62a_100000211926_100000183813 [1,1,0,0,0,0|1,1,0]=4 2374 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Br)O 240690a_100015189416_100000189672 [1,1,0,0,0,0|2,0,0]=4 2375 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)O 240690a_100015189416_100000212196 [1,1,0,0,0,0|2,0,0]=4 2376 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)Cl)O 527a_100015189416_100000212196 [1,1,0,0,0,0|2,0,0]=4 2377 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)O 240690a_100015189416_100000185466 [1,1,0,0,0,0|2,0,0]=4 2378 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)F)O 527a_100015189416_100000185466 [1,1,0,0,0,0|2,0,0]=4 2379 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)O 1626a_100015189416_100000037485 [1,1,0,0,0,0|2,0,0]=4 2380 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)I)O 240690a_100015189416_100000037485 [1,1,0,0,0,0|2,0,0]=4 2381 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Br 240690a_100015189416_100000689001 [1,1,0,0,0,0|2,0,0]=4 2382 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Br 527a_100015189416_100000689001 [1,1,0,0,0,0|2,0,0]=4 2383 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Cl 240690a_100015189416_100011933997 [1,1,0,0,0,0|2,0,0]=4 2384 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)Cl 527a_100015189416_100011933997 [1,1,0,0,0,0|2,0,0]=4 2385 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)F 240690a_100015189416_100000035894 [1,1,0,0,0,0|2,0,0]=4 2386 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)F 527a_100015189416_100000035894 [1,1,0,0,0,0|2,0,0]=4 2387 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 1626a_100015189416_100000239334 [1,1,0,0,0,0|2,0,0]=4 2388 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 240690a_100015189416_100000239334 [1,1,0,0,0,0|2,0,0]=4 2389 B15R1.1404 O=C(NCCCF)c1ccc(c(c1)O)I 527a_100015189416_100000239334 [1,1,0,0,0,0|2,0,0]=4 2390 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Br)O 240690a_100000182051_100000189672 [1,1,0,0,0,0|2,0,0]=4 2391 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)O 240690a_100000182051_100000212196 [1,1,0,0,0,0|2,0,0]=4 2392 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)Cl)O 527a_100000182051_100000212196 [1,1,0,0,0,0|2,0,0]=4 2393 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)O 240690a_100000182051_100000185466 [1,1,0,0,0,0|2,0,0]=4 2394 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)F)O 527a_100000182051_100000185466 [1,1,0,0,0,0|2,0,0]=4 2395 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)I)O 240690a_100000182051_100000037485 [1,1,0,0,0,0|2,0,0]=4 2396 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Br 240690a_100000182051_100000689001 [1,1,0,0,0,0|2,0,0]=4 2397 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Br 527a_100000182051_100000689001 [1,1,0,0,0,0|2,0,0]=4 2398 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Cl 240690a_100000182051_100011933997 [1,1,0,0,0,0|2,0,0]=4 2399 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)Cl 527a_100000182051_100011933997 [1,1,0,0,0,0|2,0,0]=4 2400 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)F 240690a_100000182051_100000035894 [1,1,0,0,0,0|2,0,0]=4 2401 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)F 527a_100000182051_100000035894 [1,1,0,0,0,0|2,0,0]=4 2402 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)I 240690a_100000182051_100000239334 [1,1,0,0,0,0|2,0,0]=4 2403 B15R1.1404 O=C(NCCCO)c1ccc(c(c1)O)I 527a_100000182051_100000239334 [1,1,0,0,0,0|2,0,0]=4 2404 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210211 [1,1,0,0,0,0|2,0,0]=4 2405 B15R1.2345 CCCCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210211 [1,1,0,0,0,0|2,0,0]=4 2406 B15R1.2345 CCCCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210211 [1,1,0,0,0,0|2,0,0]=4 2407 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)C)O 240690a_100020643023_100009839767 [1,1,0,0,0,0|2,0,0]=4 2408 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)O)Cl 240690a_100020643023_200009924051 [1,1,0,0,0,0|2,0,0]=4 2409 B15R1.2345 CCCNC(=O)c1cc(c(cc1F)O)Cl 527a_100020643023_200009924051 [1,1,0,0,0,0|2,0,0]=4 2410 B15R1.2345 CCCNC(=O)c1cc(c(cc1O)O)Br 527a_100020643023_100009813906 [1,1,0,0,0,0|2,0,0]=4 2411 B15R1.2346 CCCCC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_100000210211 [1,1,0,0,0,0|2,0,0]=4 2412 B15R1.2346 CCCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210211 [1,1,0,0,0,0|1,0,0]=3 2413 B15R1.2346 CCCCC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_100000210211 [1,1,0,0,0,0|2,0,0]=4 2414 B15R1.2346 CCCCC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_100000210211 [1,1,0,0,0,0|2,0,0]=4 2415 B15R1.2346 CCCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210211 [1,1,0,0,0,0|1,0,0]=3 2416 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)O)Br 240690a_100020643023_100016068111 [1,1,0,0,0,0|2,0,0]=4 2417 B15R1.2346 CCCNC(=O)c1ccc(c(c1Br)O)Br 527a_100020643023_100016068111 [1,1,0,0,0,0|2,0,0]=4 2418 B15R1.2346 CCCNC(=O)c1ccc(c(c1Cl)O)O 240690a_100020643023_100009910189 [1,1,0,0,0,0|1,0,0]=3 2419 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)F)O 240690a_100020643023_100000036740 [1,1,0,0,0,0|2,0,0]=4 2420 B15R1.2346 CCCNC(=O)c1ccc(c(c1F)O)F 240690a_100020643023_100000084588 [1,1,0,0,0,0|2,0,0]=4 2421 B15R1.2346 CCNNC(=O)c1ccc(c(c1Cl)O)O 22a_100000756455_100009910189 [1,1,0,0,0,0|2,0,0]=4 2422 B15R1.2346 COCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000233755 [1,1,0,0,0,0|2,0,0]=4 2423 B15R1.2346 COCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000233755 [1,1,0,0,0,0|2,0,0]=4 2424 B15R1.2346 CSCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000751147 [1,1,0,0,0,0|2,0,0]=4 2425 B15R1.2346 CSCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000751147 [1,1,0,0,0,0|2,0,0]=4 2426 B15R1.2346 O=C(CCCF)c1ccc(c(c1Cl)O)O 1458a_100009910189_100011934791 [1,1,0,0,0,0|2,0,0]=4 2427 B15R1.2346 O=C(CCCF)c1ccc(c(c1O)O)O 1458a_100000037941_100011934791 [1,1,0,0,0,0|2,0,0]=4 2428 B15R1.2346 O=C(CCCO)c1ccc(c(c1Cl)O)O 1458a_100009910189_100011215043 [1,1,0,0,0,0|2,0,0]=4 2429 B15R1.2346 O=C(CCCO)c1ccc(c(c1O)O)O 1458a_100000037941_100011215043 [1,1,0,0,0,0|2,0,0]=4 2430 B15R1.2346 O=C(NCCF)c1ccc(c(c1Cl)O)O 240690a_100000724931_100009910189 [1,1,0,0,0,0|2,0,0]=4 2431 B15R1.2346 O=C(NCCO)c1ccc(c(c1Cl)O)O 240690a_100000210304_100009910189 [1,1,0,0,0,0|2,0,0]=4 2432 B15R1.3956 CC(CCO)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009893172 [1,1,0,0,0,0|2,0,0]=4 2433 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000766640 [1,1,0,0,0,0|2,0,0]=4 2434 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000766640 [1,1,0,0,0,0|2,0,0]=4 2435 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000766640 [1,1,0,0,0,0|2,0,0]=4 2436 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000766640 [1,1,0,0,0,0|2,0,0]=4 2437 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000766640 [1,1,0,0,0,0|2,0,0]=4 2438 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000766640 [1,1,0,0,0,0|2,0,0]=4 2439 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000766640 [1,1,0,0,0,0|2,0,0]=4 2440 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000766640 [1,1,0,0,0,0|2,0,0]=4 2441 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000766640 [1,1,0,0,0,0|2,0,0]=4 2442 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000766640 [1,1,0,0,0,0|2,0,0]=4 2443 B15R1.3956 CCCC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000766640 [1,1,0,0,0,0|1,0,0]=3 2444 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Br)O 240690a_100000747261_100000189672 [1,1,0,0,0,0|2,0,0]=4 2445 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)C)O 240690a_100000747261_100000685612 [1,1,0,0,0,0|2,0,0]=4 2446 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)O 240690a_100000747261_100000212196 [1,1,0,0,0,0|2,0,0]=4 2447 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)Cl)O 527a_100000747261_100000212196 [1,1,0,0,0,0|2,0,0]=4 2448 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)O 240690a_100000747261_100000185466 [1,1,0,0,0,0|2,0,0]=4 2449 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)F)O 527a_100000747261_100000185466 [1,1,0,0,0,0|2,0,0]=4 2450 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)O 1626a_100000747261_100000037485 [1,1,0,0,0,0|2,0,0]=4 2451 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)I)O 240690a_100000747261_100000037485 [1,1,0,0,0,0|2,0,0]=4 2452 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Br 240690a_100000747261_100000689001 [1,1,0,0,0,0|2,0,0]=4 2453 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Br 527a_100000747261_100000689001 [1,1,0,0,0,0|2,0,0]=4 2454 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)C 240690a_100000747261_100000233767 [1,1,0,0,0,0|2,0,0]=4 2455 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Cl 240690a_100000747261_100011933997 [1,1,0,0,0,0|2,0,0]=4 2456 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)Cl 527a_100000747261_100011933997 [1,1,0,0,0,0|2,0,0]=4 2457 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)F 240690a_100000747261_100000035894 [1,1,0,0,0,0|2,0,0]=4 2458 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)F 527a_100000747261_100000035894 [1,1,0,0,0,0|2,0,0]=4 2459 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 1626a_100000747261_100000239334 [1,1,0,0,0,0|2,0,0]=4 2460 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 240690a_100000747261_100000239334 [1,1,0,0,0,0|2,0,0]=4 2461 B15R1.3956 CCCN(C)C(=O)c1ccc(c(c1)O)I 527a_100000747261_100000239334 [1,1,0,0,0,0|2,0,0]=4 2462 B15R1.3956 COCC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000765312 [1,1,0,0,0,0|2,0,0]=4 2463 B15R1.2886 C#CC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000035995 [1,1,0,0,0,0|0,0,2]=4 2464 B15R1.2886 CC(C#N)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000703298 [1,1,0,0,0,0|1,0,1]=4 2465 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000758301 [1,1,0,0,0,0|2,0,0]=4 2466 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000758301 [1,1,0,0,0,0|1,0,0]=3 2467 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100000758301 [1,1,0,0,0,0|2,0,0]=4 2468 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000758301 [1,1,0,0,0,0|2,0,0]=4 2469 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000758301 [1,1,0,0,0,0|1,0,0]=3 2470 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000758301 [1,1,0,0,0,0|2,0,0]=4 2471 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000758301 [1,1,0,0,0,0|2,0,0]=4 2472 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000758301 [1,1,0,0,0,0|2,0,0]=4 2473 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000758301 [1,1,0,0,0,0|1,0,0]=3 2474 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000758301 [1,1,0,0,0,0|1,0,0]=3 2475 B15R1.2886 CCC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000758301 [1,1,0,0,0,0|0,0,0]=2 2476 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000225621_200009992764 [1,1,0,0,0,0|2,0,0]=4 2477 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000225621_200000078382 [1,1,0,0,0,0|2,0,0]=4 2478 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000225621_100009812877 [1,1,0,0,0,0|2,0,0]=4 2479 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)O)C)O 240690a_100000225621_100000031928 [1,1,0,0,0,0|2,0,0]=4 2480 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)O)C)O 527a_100000225621_100000031928 [1,1,0,0,0,0|2,0,0]=4 2481 B15R1.2886 CCN(C)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000225621_100000074654 [1,1,0,0,0,0|2,0,0]=4 2482 B15R1.9719 CCCC(=O)c1cc(c(c(c1F)F)O)F 1458a_100000088966_100000210303 [1,1,0,0,0,0|2,0,0]=4 2483 B15R1.9719 CCCC(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_100000210303 [1,1,0,0,0,0|2,0,0]=4 2484 B15R1.28954 C=C(C)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000748629 [1,1,0,0,0,0|1,0,1]=4 2485 B15R1.28954 C=C(C)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000748629 [1,1,0,0,0,0|1,0,1]=4 2486 B15R1.28954 C=C(C)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000748629 [1,1,0,0,0,0|1,0,1]=4 2487 B15R1.28954 C=C(C)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000748629 [1,1,0,0,0,0|1,0,1]=4 2488 B15R1.28954 C=C(C)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000748629 [1,1,0,0,0,0|0,0,1]=3 2489 B15R1.28954 C=C(F)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009893438 [1,1,0,0,0,0|0,0,2]=4 2490 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100000210624 [1,1,0,0,0,0|2,0,0]=4 2491 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210624 [1,1,0,0,0,0|1,0,0]=3 2492 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100000210624 [1,1,0,0,0,0|2,0,0]=4 2493 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210624 [1,1,0,0,0,0|1,0,0]=3 2494 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100000210624 [1,1,0,0,0,0|2,0,0]=4 2495 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100000210624 [1,1,0,0,0,0|2,0,0]=4 2496 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100000210624 [1,1,0,0,0,0|2,0,0]=4 2497 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210624 [1,1,0,0,0,0|1,0,0]=3 2498 B15R1.28954 CC(C)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210624 [1,1,0,0,0,0|0,0,0]=2 2499 B15R1.28954 CC(C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100138425928_200009992764 [1,1,0,0,0,0|2,0,0]=4 2500 B15R1.28954 CC(C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100138425928_200000078382 [1,1,0,0,0,0|2,0,0]=4 2501 B15R1.28954 CC(C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100138425928_100009812877 [1,1,0,0,0,0|2,0,0]=4 2502 B15R1.28954 CC(C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100138425928_100000074654 [1,1,0,0,0,0|2,0,0]=4 2503 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011218427 [1,1,0,0,0,0|2,0,0]=4 2504 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011218427 [1,1,0,0,0,0|1,0,0]=3 2505 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011218427 [1,1,0,0,0,0|2,0,0]=4 2506 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011218427 [1,1,0,0,0,0|1,0,0]=3 2507 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011218427 [1,1,0,0,0,0|2,0,0]=4 2508 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011218427 [1,1,0,0,0,0|2,0,0]=4 2509 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011218427 [1,1,0,0,0,0|2,0,0]=4 2510 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011218427 [1,1,0,0,0,0|1,0,0]=3 2511 B15R1.28954 CC(O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011218427 [1,1,0,0,0,0|0,0,0]=2 2512 B15R1.28954 Cc1c(cc(cc1O)C(=O)CC(C)C)O 1458a_100000031928_100000210624 [1,1,0,0,0,0|1,0,0]=3 2513 B15R1.28954 Cc1c(cc(cc1O)C(=O)CC(C)O)O 1458a_100000031928_100011218427 [1,1,0,0,0,0|1,0,0]=3 2514 B15R1.28954 Cc1c(cc(cc1O)C(=O)CC(F)F)O 1458a_100000031928_100011934356 [1,1,0,0,0,0|2,0,0]=4 2515 B15R1.28954 Cc1c(cc(cc1O)C(=O)NC(C)C)O 240690a_100138425928_100000031928 [1,1,0,0,0,0|2,0,0]=4 2516 B15R1.28954 Cc1c(cc(cc1O)C(=O)NC(C)C)O 527a_100138425928_100000031928 [1,1,0,0,0,0|2,0,0]=4 2517 B15R1.28954 Cc1cc(cc(c1O)C)C(=O)CC(C)C 1458a_100011219978_100000210624 [1,1,0,0,0,0|2,0,0]=4 2518 B15R1.28954 Cc1cc(cc(c1O)C)C(=O)CC(C)O 1458a_100011219978_100011218427 [1,1,0,0,0,0|2,0,0]=4 2519 B15R1.28954 NC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000187820 [1,1,0,0,0,0|1,0,1]=4 2520 B15R1.28954 O=C(CC(F)F)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011934356 [1,1,0,0,0,0|2,0,0]=4 2521 B15R1.28954 O=C(CC(F)F)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011934356 [1,1,0,0,0,0|2,0,0]=4 2522 B15R1.28954 O=C(CC(F)F)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011934356 [1,1,0,0,0,0|2,0,0]=4 2523 B15R1.28954 O=C(CC(F)F)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011934356 [1,1,0,0,0,0|1,0,0]=3 2524 B15R1.28954 O=C(C[N+](=O)[O-])c1cc(c(c(c1)O)O)O 1458a_100000212154_100000761209 [1,1,0,0,0,0|2,0,0]=4 2525 B15R1.28954 O=C([O-])CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100020667443 [1,1,0,0,0,0|1,0,1]=4 2526 B15R1.36497 C#CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000184674 [1,1,0,0,0,0|0,0,2]=4 2527 B15R1.36497 C=CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210623 [1,1,0,0,0,0|0,0,2]=4 2528 B15R1.36497 CCCC(=O)c1cc(c(c(c1)OC)Cl)Br 1458a_100020639751_100000210303 [1,1,0,0,0,0|2,0,0]=4 2529 B15R1.36497 CCCC(=O)c1cc(c(c(c1)OC)F)F 1458a_100000081826_100000210303 [1,1,0,0,0,0|2,0,0]=4 2530 B15R1.36497 CCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000210303 [1,1,0,0,0,0|1,0,0]=3 2531 B15R1.36497 CCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210303 [1,1,0,0,0,0|0,0,0]=2 2532 B15R1.36497 CCNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100015525214_100000209947 [1,1,0,0,0,0|2,0,0]=4 2533 B15R1.36497 CNNC(=O)c1cc(c(c(c1)OC)O)O 22a_100016993582_100000061230 [1,1,0,0,0,0|2,0,0]=4 2534 B15R1.36497 COc1cc(cc(c1O)Cl)C(=O)CCF 1458a_100000209947_100011217306 [1,1,0,0,0,0|2,0,0]=4 2535 B15R1.36497 COc1cc(cc(c1O)Cl)C(=O)CCO 1458a_100000209947_100000211926 [1,1,0,0,0,0|2,0,0]=4 2536 B15R1.36497 COc1cc(cc(c1O)O)C(=O)CC#N 1458a_100000061230_100011214920 [1,1,0,0,0,0|1,0,1]=4 2537 B15R1.36497 COc1cc(cc(c1O)O)C(=O)CCF 1458a_100000061230_100011217306 [1,1,0,0,0,0|1,0,0]=3 2538 B15R1.36497 COc1cc(cc(c1O)O)C(=O)CCO 1458a_100000061230_100000211926 [1,1,0,0,0,0|1,0,0]=3 2539 B15R1.36498 C#CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000184674 [1,1,0,0,0,0|0,0,2]=4 2540 B15R1.36498 C=CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000210623 [1,1,0,0,0,0|0,0,2]=4 2541 B15R1.36498 CCCC(=O)c1cc(c(c(c1)Br)OC)Br 1458a_100012337705_100000210303 [1,1,0,0,0,0|2,0,0]=4 2542 B15R1.36498 CCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000210303 [1,1,0,0,0,0|1,0,0]=3 2543 B15R1.36498 CCCC(=O)c1cc(c(c(c1)C)OC)C 1458a_100000696790_100000210303 [1,1,0,0,0,0|2,0,0]=4 2544 B15R1.36498 CCCC(=O)c1cc(c(c(c1)Cl)OC)Cl 1458a_100000013545_100000210303 [1,1,0,0,0,0|2,0,0]=4 2545 B15R1.36498 CCCC(=O)c1cc(c(c(c1)Cl)OC)F 1458a_100011356498_100000210303 [1,1,0,0,0,0|2,0,0]=4 2546 B15R1.36498 CCCC(=O)c1cc(c(c(c1)F)CO)F 1458a_200009844098_100000210303 [1,1,0,0,0,0|2,0,0]=4 2547 B15R1.36498 CCCC(=O)c1cc(c(c(c1)F)OC)F 1458a_100011216840_100000210303 [1,1,0,0,0,0|2,0,0]=4 2548 B15R1.36498 CCCC(=O)c1cc(c(c(c1)I)OC)F 1458a_100012920440_100000210303 [1,1,0,0,0,0|2,0,0]=4 2549 B15R1.36498 CCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000210303 [1,1,0,0,0,0|0,0,0]=2 2550 B15R1.36498 CCNC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100015525214_100010760816 [1,1,0,0,0,0|2,0,0]=4 2551 B15R1.36498 CCNC(=O)c1cc(c(c(c1)Br)OC)O 527a_100015525214_100010760816 [1,1,0,0,0,0|2,0,0]=4 2552 B15R1.36498 CCOC(=O)c1cc(c(c(c1)Br)OC)Br 7a_100010164392_200000210301 [1,1,0,0,0,0|2,0,0]=4 2553 B15R1.36498 CCOC(=O)c1cc(c(c(c1)Br)O[13CH3])Br 7a_100010164392_200025704644 [1,1,0,0,0,0|2,0,0]=4 2554 B15R1.36498 CCOC(=O)c1cc(c(c(c1)Cl)OC)Cl 7a_100000172512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2555 B15R1.36498 CCOC(=O)c1cc(c(c(c1)Cl)O[13CH3])Cl 7a_100000172512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2556 B15R1.36498 CCOC(=O)c1cc(c(c(c1)I)OC)I 7a_100009990389_200000210301 [1,1,0,0,0,0|2,0,0]=4 2557 B15R1.36498 CCOC(=O)c1cc(c(c(c1)I)O[13CH3])I 7a_100009990389_200025704644 [1,1,0,0,0,0|2,0,0]=4 2558 B15R1.36498 CNNC(=O)c1cc(c(c(c1)O)OC)O 22a_100016993582_100000073573 [1,1,0,0,0,0|2,0,0]=4 2559 B15R1.36498 COc1c(cc(cc1Br)C(=O)CCF)O 1458a_100010760816_100011217306 [1,1,0,0,0,0|2,0,0]=4 2560 B15R1.36498 COc1c(cc(cc1Br)C(=O)CCO)O 1458a_100010760816_100000211926 [1,1,0,0,0,0|2,0,0]=4 2561 B15R1.36498 COc1c(cc(cc1O)C(=O)CC#N)O 1458a_100000073573_100011214920 [1,1,0,0,0,0|1,0,1]=4 2562 B15R1.36498 COc1c(cc(cc1O)C(=O)CCF)O 1458a_100000073573_100011217306 [1,1,0,0,0,0|1,0,0]=3 2563 B15R1.36498 COc1c(cc(cc1O)C(=O)CCO)O 1458a_100000073573_100000211926 [1,1,0,0,0,0|1,0,0]=3 2564 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Br)O)Br 22a_200000186426_100000745993 [0,1,0,0,0,1|2,0,0]=4 2565 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Br)O)Br 527a_200000186426_100000745993 [0,1,0,0,0,1|2,0,0]=4 2566 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Br)O)C 11a_100010064301_100000745993 [0,1,0,0,0,1|2,0,0]=4 2567 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Br)O)C 22a_100010064301_100000745993 [0,1,0,0,0,1|2,0,0]=4 2568 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Br)O)C 527a_100010064301_100000745993 [0,1,0,0,0,1|2,0,0]=4 2569 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)C)O)C 11a_100000703291_100000745993 [0,1,0,0,0,1|2,0,0]=4 2570 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)C)O)C 1626a_100000703291_100000745993 [0,1,0,0,0,1|2,0,0]=4 2571 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)C)O)C 22a_100000703291_100000745993 [0,1,0,0,0,1|2,0,0]=4 2572 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)C)O)C 527a_100000703291_100000745993 [0,1,0,0,0,1|2,0,0]=4 2573 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Cl)Cl)O 22a_100015839415_100000745993 [0,1,0,0,0,1|2,0,0]=4 2574 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Cl)O)Cl 22a_100000695418_100000745993 [0,1,0,0,0,1|2,0,0]=4 2575 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)Cl)O)Cl 527a_100000695418_100000745993 [0,1,0,0,0,1|2,0,0]=4 2576 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)F)O)F 1626a_100016987357_100000745993 [0,1,0,0,0,1|2,0,0]=4 2577 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)F)O)F 22a_100016987357_100000745993 [0,1,0,0,0,1|2,0,0]=4 2578 B17R1.1840 CCCOCC(=O)Nc1cc(c(c(c1)F)O)F 527a_100016987357_100000745993 [0,1,0,0,0,1|2,0,0]=4 2579 B17R1.29887 CCCCC(=O)Cc1cc(c(c(c1)OC)O)Br 1458a_100009814412_100000210211 [0,1,0,0,0,1|2,0,0]=4 2580 B17R1.29887 CCCNC(=O)Cc1cc(c(c(c1)OC)O)Br 240690a_100020643023_100009814412 [0,1,0,0,0,1|2,0,0]=4 2581 B17R1.29887 CCCNC(=O)Cc1cc(c(c(c1)OC)O)Br 527a_100020643023_100009814412 [0,1,0,0,0,1|2,0,0]=4 2582 B17R1.59814 C#CCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100010269958 [0,2,0,0,0,0|2,0,0]=4 2583 B17R1.59814 C#CCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100010269958 [0,2,0,0,0,0|2,0,0]=4 2584 B17R1.59814 C#CCCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100010269958 [0,2,0,0,0,0|2,0,0]=4 2585 B17R1.59814 C#CCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100010269958 [0,2,0,0,0,0|2,0,0]=4 2586 B17R1.59814 C#CCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100010269958 [0,2,0,0,0,0|1,0,0]=3 2587 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000718082_200009992764 [0,2,0,0,0,0|2,0,0]=4 2588 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000718082_200000078382 [0,2,0,0,0,0|2,0,0]=4 2589 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000718082_100009812877 [0,2,0,0,0,0|2,0,0]=4 2590 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000718082_100000031928 [0,2,0,0,0,0|2,0,0]=4 2591 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000718082_100000031928 [0,2,0,0,0,0|2,0,0]=4 2592 B17R1.59814 C#CCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000718082_100000074654 [0,2,0,0,0,0|2,0,0]=4 2593 B17R1.59814 C#CCOCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100010402529 [0,2,0,0,0,0|0,0,2]=4 2594 B17R1.59814 C=CCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215482 [0,2,0,0,0,0|2,0,0]=4 2595 B17R1.59814 C=CCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215482 [0,2,0,0,0,0|2,0,0]=4 2596 B17R1.59814 C=CCCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011215482 [0,2,0,0,0,0|2,0,0]=4 2597 B17R1.59814 C=CCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215482 [0,2,0,0,0,0|2,0,0]=4 2598 B17R1.59814 C=CCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215482 [0,2,0,0,0,0|1,0,0]=3 2599 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000700776_200009992764 [0,2,0,0,0,0|2,0,0]=4 2600 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000700776_200000078382 [0,2,0,0,0,0|2,0,0]=4 2601 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000700776_100009812877 [0,2,0,0,0,0|2,0,0]=4 2602 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000700776_100000031928 [0,2,0,0,0,0|2,0,0]=4 2603 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000700776_100000031928 [0,2,0,0,0,0|2,0,0]=4 2604 B17R1.59814 C=CCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000700776_100000074654 [0,2,0,0,0,0|2,0,0]=4 2605 B17R1.59814 CC/C=C\CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100015370543 [0,2,0,0,0,0|2,0,0]=4 2606 B17R1.59814 CC/C=C\CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100015370543 [0,2,0,0,0,0|2,0,0]=4 2607 B17R1.59814 CC/C=C\CCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100015370543 [0,2,0,0,0,0|2,0,0]=4 2608 B17R1.59814 CC/C=C\CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100015370543 [0,2,0,0,0,0|2,0,0]=4 2609 B17R1.59814 CC/C=C\CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100015370543 [0,2,0,0,0,0|1,0,0]=3 2610 B17R1.59814 CCCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210757 [0,2,0,0,0,0|2,0,0]=4 2611 B17R1.59814 CCCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210757 [0,2,0,0,0,0|2,0,0]=4 2612 B17R1.59814 CCCCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000210757 [0,2,0,0,0,0|2,0,0]=4 2613 B17R1.59814 CCCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000210757 [0,2,0,0,0,0|2,0,0]=4 2614 B17R1.59814 CCCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210757 [0,2,0,0,0,0|1,0,0]=3 2615 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000209983_200009992764 [0,2,0,0,0,0|2,0,0]=4 2616 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000209983_200000078382 [0,2,0,0,0,0|2,0,0]=4 2617 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000209983_100009812877 [0,2,0,0,0,0|2,0,0]=4 2618 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000209983_100000031928 [0,2,0,0,0,0|2,0,0]=4 2619 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000209983_100000031928 [0,2,0,0,0,0|2,0,0]=4 2620 B17R1.59814 CCCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000209983_100000074654 [0,2,0,0,0,0|2,0,0]=4 2621 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100025702795_200009992764 [0,2,0,0,0,0|2,0,0]=4 2622 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100025702795_200000078382 [0,2,0,0,0,0|2,0,0]=4 2623 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100025702795_100009812877 [0,2,0,0,0,0|2,0,0]=4 2624 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)O)C)O 22a_100025702795_100000031928 [0,2,0,0,0,0|2,0,0]=4 2625 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100025702795_100000074654 [0,2,0,0,0,0|2,0,0]=4 2626 B17R1.59814 CCCCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100025702795_100000212154 [0,2,0,0,0,0|1,0,0]=3 2627 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011995733 [0,2,0,0,0,0|2,0,0]=4 2628 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011995733 [0,2,0,0,0,0|1,0,0]=3 2629 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100011995733 [0,2,0,0,0,0|2,0,0]=4 2630 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011995733 [0,2,0,0,0,0|2,0,0]=4 2631 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011995733 [0,2,0,0,0,0|1,0,0]=3 2632 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011995733 [0,2,0,0,0,0|2,0,0]=4 2633 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011995733 [0,2,0,0,0,0|2,0,0]=4 2634 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011995733 [0,2,0,0,0,0|2,0,0]=4 2635 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011995733 [0,2,0,0,0,0|1,0,0]=3 2636 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011995733 [0,2,0,0,0,0|1,0,0]=3 2637 B17R1.59814 CCCCOCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011995733 [0,2,0,0,0,0|0,0,0]=2 2638 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_100011215938 [0,2,0,0,0,0|2,0,0]=4 2639 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215938 [0,2,0,0,0,0|1,0,0]=3 2640 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_100011215938 [0,2,0,0,0,0|2,0,0]=4 2641 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_100011215938 [0,2,0,0,0,0|2,0,0]=4 2642 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215938 [0,2,0,0,0,0|1,0,0]=3 2643 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_100011215938 [0,2,0,0,0,0|2,0,0]=4 2644 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_100011215938 [0,2,0,0,0,0|2,0,0]=4 2645 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_100011215938 [0,2,0,0,0,0|2,0,0]=4 2646 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011215938 [0,2,0,0,0,0|1,0,0]=3 2647 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215938 [0,2,0,0,0,0|1,0,0]=3 2648 B17R1.59814 CCCOCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215938 [0,2,0,0,0,0|0,0,0]=2 2649 B17R1.59814 CCOCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100012232248 [0,2,0,0,0,0|2,0,0]=4 2650 B17R1.59814 CCOCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100012232248 [0,2,0,0,0,0|2,0,0]=4 2651 B17R1.59814 CCOCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100012232248 [0,2,0,0,0,0|2,0,0]=4 2652 B17R1.59814 CCOCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100012232248 [0,2,0,0,0,0|2,0,0]=4 2653 B17R1.59814 CCOCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100012232248 [0,2,0,0,0,0|1,0,0]=3 2654 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100011200944_200009992764 [0,2,0,0,0,0|2,0,0]=4 2655 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100011200944_200000078382 [0,2,0,0,0,0|2,0,0]=4 2656 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100011200944_100009812877 [0,2,0,0,0,0|2,0,0]=4 2657 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100011200944_100000031928 [0,2,0,0,0,0|2,0,0]=4 2658 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100011200944_100000031928 [0,2,0,0,0,0|2,0,0]=4 2659 B17R1.59814 CCOCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100011200944_100000074654 [0,2,0,0,0,0|2,0,0]=4 2660 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000106463_200009992764 [0,2,0,0,0,0|2,0,0]=4 2661 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000106463_200000078382 [0,2,0,0,0,0|2,0,0]=4 2662 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000106463_100009812877 [0,2,0,0,0,0|2,0,0]=4 2663 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000106463_100000031928 [0,2,0,0,0,0|2,0,0]=4 2664 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000106463_100000031928 [0,2,0,0,0,0|2,0,0]=4 2665 B17R1.59814 CCSCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000106463_100000074654 [0,2,0,0,0,0|2,0,0]=4 2666 B17R1.59814 COCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000755781 [0,2,0,0,0,0|2,0,0]=4 2667 B17R1.59814 COCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000755781 [0,2,0,0,0,0|2,0,0]=4 2668 B17R1.59814 COCCCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000755781 [0,2,0,0,0,0|2,0,0]=4 2669 B17R1.59814 COCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000755781 [0,2,0,0,0,0|2,0,0]=4 2670 B17R1.59814 COCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000755781 [0,2,0,0,0,0|1,0,0]=3 2671 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100150723488_200009992764 [0,2,0,0,0,0|2,0,0]=4 2672 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100150723488_200000078382 [0,2,0,0,0,0|2,0,0]=4 2673 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100150723488_100009812877 [0,2,0,0,0,0|2,0,0]=4 2674 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100150723488_100000031928 [0,2,0,0,0,0|2,0,0]=4 2675 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100150723488_100000031928 [0,2,0,0,0,0|2,0,0]=4 2676 B17R1.59814 COCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100150723488_100000074654 [0,2,0,0,0,0|2,0,0]=4 2677 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000741390_200009992764 [0,2,0,0,0,0|2,0,0]=4 2678 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000741390_200000078382 [0,2,0,0,0,0|2,0,0]=4 2679 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000741390_100009812877 [0,2,0,0,0,0|2,0,0]=4 2680 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)O)C)O 22a_100000741390_100000031928 [0,2,0,0,0,0|2,0,0]=4 2681 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000741390_100000074654 [0,2,0,0,0,0|2,0,0]=4 2682 B17R1.59814 COCCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000741390_100000212154 [0,2,0,0,0,0|1,0,0]=3 2683 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000749238_200009992764 [0,2,0,0,0,0|2,0,0]=4 2684 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000749238_200000078382 [0,2,0,0,0,0|2,0,0]=4 2685 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000749238_100009812877 [0,2,0,0,0,0|2,0,0]=4 2686 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)O)C)O 240690a_100000749238_100000031928 [0,2,0,0,0,0|2,0,0]=4 2687 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)O)C)O 527a_100000749238_100000031928 [0,2,0,0,0,0|2,0,0]=4 2688 B17R1.59814 CSCCCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000749238_100000074654 [0,2,0,0,0,0|2,0,0]=4 2689 B17R1.59814 Cc1c(cc(cc1O)C(=O)CCCCC#N)O 1458a_100000031928_100000211819 [0,2,0,0,0,0|2,0,0]=4 2690 B17R1.59814 Cc1c(cc(cc1O)C(=O)CCCCCF)O 1458a_100000031928_100000729378 [0,2,0,0,0,0|2,0,0]=4 2691 B17R1.59814 Cc1c(cc(cc1O)C(=O)CCCCCO)O 1458a_100000031928_100000746330 [0,2,0,0,0,0|2,0,0]=4 2692 B17R1.59814 Cc1c(cc(cc1O)C(=O)CCOCCO)O 1458a_100000031928_100011215305 [0,2,0,0,0,0|2,0,0]=4 2693 B17R1.59814 Cc1c(cc(cc1O)C(=O)NCCCCO)O 240690a_100000750430_100000031928 [0,2,0,0,0,0|2,0,0]=4 2694 B17R1.59814 Cc1c(cc(cc1O)C(=O)NCCCCO)O 527a_100000750430_100000031928 [0,2,0,0,0,0|2,0,0]=4 2695 B17R1.59814 N#CCCCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000211819 [0,2,0,0,0,0|2,0,0]=4 2696 B17R1.59814 N#CCCCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000211819 [0,2,0,0,0,0|2,0,0]=4 2697 B17R1.59814 N#CCCCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000211819 [0,2,0,0,0,0|2,0,0]=4 2698 B17R1.59814 N#CCCCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000211819 [0,2,0,0,0,0|1,0,0]=3 2699 B17R1.59814 N#CCCNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000229987_100000212154 [0,2,0,0,0,0|1,0,1]=4 2700 B17R1.59814 N#CCOCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000047693 [0,2,0,0,0,0|1,0,1]=4 2701 B17R1.59814 O=C(CCCCCF)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000729378 [0,2,0,0,0,0|2,0,0]=4 2702 B17R1.59814 O=C(CCCCCF)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000729378 [0,2,0,0,0,0|2,0,0]=4 2703 B17R1.59814 O=C(CCCCCF)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000729378 [0,2,0,0,0,0|2,0,0]=4 2704 B17R1.59814 O=C(CCCCCF)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000729378 [0,2,0,0,0,0|1,0,0]=3 2705 B17R1.59814 O=C(CCCCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000746330 [0,2,0,0,0,0|2,0,0]=4 2706 B17R1.59814 O=C(CCCCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000746330 [0,2,0,0,0,0|2,0,0]=4 2707 B17R1.59814 O=C(CCCCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000746330 [0,2,0,0,0,0|2,0,0]=4 2708 B17R1.59814 O=C(CCCCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000746330 [0,2,0,0,0,0|1,0,0]=3 2709 B17R1.59814 O=C(CCOCCO)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215305 [0,2,0,0,0,0|2,0,0]=4 2710 B17R1.59814 O=C(CCOCCO)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215305 [0,2,0,0,0,0|2,0,0]=4 2711 B17R1.59814 O=C(CCOCCO)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215305 [0,2,0,0,0,0|2,0,0]=4 2712 B17R1.59814 O=C(CCOCCO)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215305 [0,2,0,0,0,0|1,0,0]=3 2713 B17R1.59814 O=C(NCCCCO)c1cc(c(c(c1)Br)O)O 240690a_100000750430_200009992764 [0,2,0,0,0,0|2,0,0]=4 2714 B17R1.59814 O=C(NCCCCO)c1cc(c(c(c1)Cl)O)O 240690a_100000750430_200000078382 [0,2,0,0,0,0|2,0,0]=4 2715 B17R1.59814 O=C(NCCCCO)c1cc(c(c(c1)O)Br)O 240690a_100000750430_100009812877 [0,2,0,0,0,0|2,0,0]=4 2716 B17R1.59814 O=C(NCCCCO)c1cc(c(c(c1)O)Cl)O 240690a_100000750430_100000074654 [0,2,0,0,0,0|2,0,0]=4 2717 B17R1.76157 C=C(C)CNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000729518_100000212154 [0,2,0,0,0,0|1,0,1]=4 2718 B17R1.76157 CC(=CCCC(=O)c1cc(c(c(c1)O)O)O)C 1458a_100000212154_100011217483 [0,2,0,0,0,0|1,0,1]=4 2719 B17R1.76157 CC(=O)CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215641 [0,2,0,0,0,0|2,0,0]=4 2720 B17R1.76157 CC(=O)CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215641 [0,2,0,0,0,0|2,0,0]=4 2721 B17R1.76157 CC(=O)CCCC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011215641 [0,2,0,0,0,0|2,0,0]=4 2722 B17R1.76157 CC(=O)CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215641 [0,2,0,0,0,0|2,0,0]=4 2723 B17R1.76157 CC(=O)CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215641 [0,2,0,0,0,0|1,0,0]=3 2724 B17R1.76157 CC(=O)NCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000189650 [0,2,0,0,0,0|1,0,1]=4 2725 B17R1.76157 CC(=O)OCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100009814007 [0,2,0,0,0,0|1,0,1]=4 2726 B17R1.76157 CC(C)CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011214892 [0,2,0,0,0,0|2,0,0]=4 2727 B17R1.76157 CC(C)CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011214892 [0,2,0,0,0,0|2,0,0]=4 2728 B17R1.76157 CC(C)CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011214892 [0,2,0,0,0,0|2,0,0]=4 2729 B17R1.76157 CC(C)CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011214892 [0,2,0,0,0,0|1,0,0]=3 2730 B17R1.76157 CC(C)CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000210545_200009992764 [0,2,0,0,0,0|2,0,0]=4 2731 B17R1.76157 CC(C)CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000210545_200000078382 [0,2,0,0,0,0|2,0,0]=4 2732 B17R1.76157 CC(C)CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000210545_100009812877 [0,2,0,0,0,0|2,0,0]=4 2733 B17R1.76157 CC(C)CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000210545_100000074654 [0,2,0,0,0,0|2,0,0]=4 2734 B17R1.76157 CC(C)CNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000696102_200009992764 [0,2,0,0,0,0|2,0,0]=4 2735 B17R1.76157 CC(C)CNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000696102_200000078382 [0,2,0,0,0,0|2,0,0]=4 2736 B17R1.76157 CC(C)CNNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000696102_100009812877 [0,2,0,0,0,0|2,0,0]=4 2737 B17R1.76157 CC(C)CNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000696102_100000074654 [0,2,0,0,0,0|2,0,0]=4 2738 B17R1.76157 CC(C)CNNC(=O)c1cc(c(c(c1)O)O)O 22a_100000696102_100000212154 [0,2,0,0,0,0|1,0,0]=3 2739 B17R1.76157 CC(C)OCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000211751 [0,2,0,0,0,0|2,0,0]=4 2740 B17R1.76157 CC(C)OCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000211751 [0,2,0,0,0,0|2,0,0]=4 2741 B17R1.76157 CC(C)OCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000211751 [0,2,0,0,0,0|2,0,0]=4 2742 B17R1.76157 CC(C)OCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000211751 [0,2,0,0,0,0|1,0,0]=3 2743 B17R1.76157 CC(C)SCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000730970 [0,2,0,0,0,0|2,0,0]=4 2744 B17R1.76157 CC(C)SCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000730970 [0,2,0,0,0,0|2,0,0]=4 2745 B17R1.76157 CC(C)SCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000730970 [0,2,0,0,0,0|2,0,0]=4 2746 B17R1.76157 CC(C)SCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000730970 [0,2,0,0,0,0|1,0,0]=3 2747 B17R1.76157 CC(O)CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200000718107 [0,2,0,0,0,0|2,0,0]=4 2748 B17R1.76157 CC(O)CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200000718107 [0,2,0,0,0,0|2,0,0]=4 2749 B17R1.76157 CC(O)CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200000718107 [0,2,0,0,0,0|2,0,0]=4 2750 B17R1.76157 CC(O)CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000718107 [0,2,0,0,0,0|1,0,0]=3 2751 B17R1.76157 CC(O)CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_200000755665_200009992764 [0,2,0,0,0,0|2,0,0]=4 2752 B17R1.76157 CC(O)CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_200000755665_200000078382 [0,2,0,0,0,0|2,0,0]=4 2753 B17R1.76157 CC(O)CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_200000755665_100009812877 [0,2,0,0,0,0|2,0,0]=4 2754 B17R1.76157 CC(O)CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_200000755665_100000074654 [0,2,0,0,0,0|2,0,0]=4 2755 B17R1.76157 CC(O)CNNC(=O)c1cc(c(c(c1)Br)O)O 22a_200000730056_200009992764 [0,2,0,0,0,0|2,0,0]=4 2756 B17R1.76157 CC(O)CNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_200000730056_200000078382 [0,2,0,0,0,0|2,0,0]=4 2757 B17R1.76157 CC(O)CNNC(=O)c1cc(c(c(c1)O)Br)O 22a_200000730056_100009812877 [0,2,0,0,0,0|2,0,0]=4 2758 B17R1.76157 CC(O)CNNC(=O)c1cc(c(c(c1)O)Cl)O 22a_200000730056_100000074654 [0,2,0,0,0,0|2,0,0]=4 2759 B17R1.76157 CC(O)CNNC(=O)c1cc(c(c(c1)O)O)O 22a_200000730056_100000212154 [0,2,0,0,0,0|1,0,0]=3 2760 B17R1.76157 CN(C)CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000695564 [0,2,0,0,0,0|2,0,0]=4 2761 B17R1.76157 CN(C)CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000695564 [0,2,0,0,0,0|2,0,0]=4 2762 B17R1.76157 CN(C)CCCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000695564 [0,2,0,0,0,0|2,0,0]=4 2763 B17R1.76157 CN(C)CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000695564 [0,2,0,0,0,0|1,0,0]=3 2764 B17R1.76157 CN(C)CCNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000210585_200009992764 [0,2,0,0,0,0|2,0,0]=4 2765 B17R1.76157 CN(C)CCNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000210585_200000078382 [0,2,0,0,0,0|2,0,0]=4 2766 B17R1.76157 CN(C)CCNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000210585_100009812877 [0,2,0,0,0,0|2,0,0]=4 2767 B17R1.76157 CN(C)CCNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000210585_100000074654 [0,2,0,0,0,0|2,0,0]=4 2768 B17R1.76157 Cc1c(cc(cc1O)C(=O)CCCC(C)C)O 1458a_100000031928_100011214892 [0,2,0,0,0,0|2,0,0]=4 2769 B17R1.76157 Cc1c(cc(cc1O)C(=O)CCCC(C)O)O 1458a_100000031928_200000718107 [0,2,0,0,0,0|2,0,0]=4 2770 B17R1.76157 Cc1c(cc(cc1O)C(=O)CCCN(C)C)O 1458a_100000031928_100000695564 [0,2,0,0,0,0|2,0,0]=4 2771 B17R1.76157 Cc1c(cc(cc1O)C(=O)CCOC(C)C)O 1458a_100000031928_100000211751 [0,2,0,0,0,0|2,0,0]=4 2772 B17R1.76157 Cc1c(cc(cc1O)C(=O)CCSC(C)C)O 1458a_100000031928_100000730970 [0,2,0,0,0,0|2,0,0]=4 2773 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCC(C)C)O 240690a_100000210545_100000031928 [0,2,0,0,0,0|2,0,0]=4 2774 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCC(C)C)O 527a_100000210545_100000031928 [0,2,0,0,0,0|2,0,0]=4 2775 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCC(C)O)O 240690a_200000755665_100000031928 [0,2,0,0,0,0|2,0,0]=4 2776 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCC(C)O)O 527a_200000755665_100000031928 [0,2,0,0,0,0|2,0,0]=4 2777 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCN(C)C)O 240690a_100000210585_100000031928 [0,2,0,0,0,0|2,0,0]=4 2778 B17R1.76157 Cc1c(cc(cc1O)C(=O)NCCN(C)C)O 527a_100000210585_100000031928 [0,2,0,0,0,0|2,0,0]=4 2779 B17R1.76157 Cc1c(cc(cc1O)C(=O)NNCC(C)C)O 22a_100000696102_100000031928 [0,2,0,0,0,0|2,0,0]=4 2780 B17R1.76157 Cc1c(cc(cc1O)C(=O)NNCC(C)O)O 22a_200000730056_100000031928 [0,2,0,0,0,0|2,0,0]=4 2781 B17R1.76157 NC(=O)CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100102525003 [0,2,0,0,0,0|1,0,1]=4 2782 B17R1.130989 CCCC(=O)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000747444 [0,2,0,0,0,0|2,0,0]=4 2783 B17R1.130989 CCCC(=O)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000747444 [0,2,0,0,0,0|2,0,0]=4 2784 B17R1.130989 CCCC(=O)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100000747444 [0,2,0,0,0,0|2,0,0]=4 2785 B17R1.130989 CCCC(=O)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000747444 [0,2,0,0,0,0|2,0,0]=4 2786 B17R1.130989 CCCC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000747444 [0,2,0,0,0,0|1,0,0]=3 2787 B17R1.130989 CCCC(C)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011216630 [0,2,0,0,0,0|2,0,0]=4 2788 B17R1.130989 CCCC(C)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011216630 [0,2,0,0,0,0|2,0,0]=4 2789 B17R1.130989 CCCC(C)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011216630 [0,2,0,0,0,0|2,0,0]=4 2790 B17R1.130989 CCCC(C)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011216630 [0,2,0,0,0,0|2,0,0]=4 2791 B17R1.130989 CCCC(C)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011216630 [0,2,0,0,0,0|1,0,0]=3 2792 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000741246_200009992764 [0,2,0,0,0,0|2,0,0]=4 2793 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000741246_200000078382 [0,2,0,0,0,0|2,0,0]=4 2794 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000741246_100009812877 [0,2,0,0,0,0|2,0,0]=4 2795 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000741246_100000031928 [0,2,0,0,0,0|2,0,0]=4 2796 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000741246_100000031928 [0,2,0,0,0,0|2,0,0]=4 2797 B17R1.130989 CCCC(C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000741246_100000074654 [0,2,0,0,0,0|2,0,0]=4 2798 B17R1.130989 CCNC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000183381 [0,2,0,0,0,0|1,0,1]=4 2799 B17R1.130989 CCOC(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000188475 [0,2,0,0,0,0|1,0,1]=4 2800 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000764878_200009992764 [0,2,0,0,0,0|2,0,0]=4 2801 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000764878_200000078382 [0,2,0,0,0,0|2,0,0]=4 2802 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000764878_100009812877 [0,2,0,0,0,0|2,0,0]=4 2803 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000764878_100000031928 [0,2,0,0,0,0|2,0,0]=4 2804 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000764878_100000031928 [0,2,0,0,0,0|2,0,0]=4 2805 B17R1.130989 COC[C@@H](C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000764878_100000074654 [0,2,0,0,0,0|2,0,0]=4 2806 B17R1.130989 C[C@H](CCO)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000706166_200009992764 [0,2,0,0,0,0|2,0,0]=4 2807 B17R1.130989 C[C@H](CCO)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000706166_200000078382 [0,2,0,0,0,0|2,0,0]=4 2808 B17R1.130989 C[C@H](CCO)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000706166_100009812877 [0,2,0,0,0,0|2,0,0]=4 2809 B17R1.130989 C[C@H](CCO)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000706166_100000074654 [0,2,0,0,0,0|2,0,0]=4 2810 B17R1.130989 Cc1c(cc(cc1O)C(=O)N[C@H](C)CCO)O 240690a_100000706166_100000031928 [0,2,0,0,0,0|2,0,0]=4 2811 B17R1.130989 Cc1c(cc(cc1O)C(=O)N[C@H](C)CCO)O 527a_100000706166_100000031928 [0,2,0,0,0,0|2,0,0]=4 2812 B17R1.153059 CC(CO)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000744482_200009992764 [0,2,0,0,0,0|2,0,0]=4 2813 B17R1.153059 CC(CO)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000744482_200000078382 [0,2,0,0,0,0|2,0,0]=4 2814 B17R1.153059 CC(CO)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000744482_100009812877 [0,2,0,0,0,0|2,0,0]=4 2815 B17R1.153059 CC(CO)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000744482_100000074654 [0,2,0,0,0,0|2,0,0]=4 2816 B17R1.153059 CCC(=O)NNC(=O)c1cc(c(c(c1)O)O)O 22a_100000183195_100000212154 [0,2,0,0,0,0|1,0,1]=4 2817 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020588543_200009992764 [0,2,0,0,0,0|2,0,0]=4 2818 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020588543_200000078382 [0,2,0,0,0,0|2,0,0]=4 2819 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020588543_100009812877 [0,2,0,0,0,0|2,0,0]=4 2820 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020588543_100000031928 [0,2,0,0,0,0|2,0,0]=4 2821 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)O)C)O 527a_100020588543_100000031928 [0,2,0,0,0,0|2,0,0]=4 2822 B17R1.153059 CCC(C)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020588543_100000074654 [0,2,0,0,0,0|2,0,0]=4 2823 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)Br)O)O 22a_100000718999_200009992764 [0,2,0,0,0,0|2,0,0]=4 2824 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100000718999_200000078382 [0,2,0,0,0,0|2,0,0]=4 2825 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)O)Br)O 22a_100000718999_100009812877 [0,2,0,0,0,0|2,0,0]=4 2826 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)O)C)O 22a_100000718999_100000031928 [0,2,0,0,0,0|2,0,0]=4 2827 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)O)Cl)O 22a_100000718999_100000074654 [0,2,0,0,0,0|2,0,0]=4 2828 B17R1.153059 CCC(C)NNC(=O)c1cc(c(c(c1)O)O)O 22a_100000718999_100000212154 [0,2,0,0,0,0|1,0,0]=3 2829 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100011218483_200009992764 [0,2,0,0,0,0|2,0,0]=4 2830 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100011218483_200000078382 [0,2,0,0,0,0|2,0,0]=4 2831 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100011218483_100009812877 [0,2,0,0,0,0|2,0,0]=4 2832 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100011218483_100000031928 [0,2,0,0,0,0|2,0,0]=4 2833 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)O)C)O 527a_100011218483_100000031928 [0,2,0,0,0,0|2,0,0]=4 2834 B17R1.153059 CCC(O)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100011218483_100000074654 [0,2,0,0,0,0|2,0,0]=4 2835 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020591295_200009992764 [0,2,0,0,0,0|2,0,0]=4 2836 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020591295_200000078382 [0,2,0,0,0,0|2,0,0]=4 2837 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020591295_100009812877 [0,2,0,0,0,0|2,0,0]=4 2838 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)O)C)O 240690a_100020591295_100000031928 [0,2,0,0,0,0|2,0,0]=4 2839 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)O)C)O 527a_100020591295_100000031928 [0,2,0,0,0,0|2,0,0]=4 2840 B17R1.153059 CO[C@H](C)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020591295_100000074654 [0,2,0,0,0,0|2,0,0]=4 2841 B17R1.153059 Cc1c(cc(cc1O)C(=O)NCC(C)CO)O 240690a_100000744482_100000031928 [0,2,0,0,0,0|2,0,0]=4 2842 B17R1.153059 Cc1c(cc(cc1O)C(=O)NCC(C)CO)O 527a_100000744482_100000031928 [0,2,0,0,0,0|2,0,0]=4 2843 B17R1.153059 Cc1c(cc(cc1O)C(=O)NC[C@@H](F)CO)O 240690a_100015665980_100000031928 [0,2,0,0,0,0|2,0,0]=4 2844 B17R1.153059 Cc1c(cc(cc1O)C(=O)NC[C@@H](F)CO)O 527a_100015665980_100000031928 [0,2,0,0,0,0|2,0,0]=4 2845 B17R1.153059 Cc1c(cc(cc1O)C(=O)NC[C@H](O)CO)O 240690a_100020644852_100000031928 [0,2,0,0,0,0|2,0,0]=4 2846 B17R1.153059 Cc1c(cc(cc1O)C(=O)NC[C@H](O)CO)O 527a_100020644852_100000031928 [0,2,0,0,0,0|2,0,0]=4 2847 B17R1.153059 O=C(NC[C@@H](F)CO)c1cc(c(c(c1)Br)O)O 240690a_100015665980_200009992764 [0,2,0,0,0,0|2,0,0]=4 2848 B17R1.153059 O=C(NC[C@@H](F)CO)c1cc(c(c(c1)Cl)O)O 240690a_100015665980_200000078382 [0,2,0,0,0,0|2,0,0]=4 2849 B17R1.153059 O=C(NC[C@@H](F)CO)c1cc(c(c(c1)O)Br)O 240690a_100015665980_100009812877 [0,2,0,0,0,0|2,0,0]=4 2850 B17R1.153059 O=C(NC[C@@H](F)CO)c1cc(c(c(c1)O)Cl)O 240690a_100015665980_100000074654 [0,2,0,0,0,0|2,0,0]=4 2851 B17R1.153059 O=C(NC[C@H](O)CO)c1cc(c(c(c1)Br)O)O 240690a_100020644852_200009992764 [0,2,0,0,0,0|2,0,0]=4 2852 B17R1.153059 O=C(NC[C@H](O)CO)c1cc(c(c(c1)Cl)O)O 240690a_100020644852_200000078382 [0,2,0,0,0,0|2,0,0]=4 2853 B17R1.153059 O=C(NC[C@H](O)CO)c1cc(c(c(c1)O)Br)O 240690a_100020644852_100009812877 [0,2,0,0,0,0|2,0,0]=4 2854 B17R1.153059 O=C(NC[C@H](O)CO)c1cc(c(c(c1)O)Cl)O 240690a_100020644852_100000074654 [0,2,0,0,0,0|2,0,0]=4 2855 B17R1.184434 C#CCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000731252 [0,2,0,0,0,0|1,0,1]=4 2856 B17R1.184434 C=CCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000757094 [0,2,0,0,0,0|1,0,1]=4 2857 B17R1.184434 CC/C=C\CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100103147603 [0,2,0,0,0,0|1,0,1]=4 2858 B17R1.184434 CCC#CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100009813939 [0,2,0,0,0,0|1,0,1]=4 2859 B17R1.184434 CCCCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000210326 [0,2,0,0,0,0|2,0,0]=4 2860 B17R1.184434 CCCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210326 [0,2,0,0,0,0|1,0,0]=3 2861 B17R1.184434 CCCCNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100000102301_100000209947 [0,2,0,0,0,0|2,0,0]=4 2862 B17R1.184434 CCCNNC(=O)c1cc(c(c(c1)OC)O)Cl 22a_100000740057_100000209947 [0,2,0,0,0,0|2,0,0]=4 2863 B17R1.184434 CCCNNC(=O)c1cc(c(c(c1)OC)O)O 22a_100000740057_100000061230 [0,2,0,0,0,0|1,0,0]=3 2864 B17R1.184434 CCOCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100011215890 [0,2,0,0,0,0|2,0,0]=4 2865 B17R1.184434 CCOCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100011215890 [0,2,0,0,0,0|1,0,0]=3 2866 B17R1.184434 CCSCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000757381 [0,2,0,0,0,0|2,0,0]=4 2867 B17R1.184434 CCSCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000757381 [0,2,0,0,0,0|1,0,0]=3 2868 B17R1.184434 COCCCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000740836 [0,2,0,0,0,0|2,0,0]=4 2869 B17R1.184434 COCCCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000740836 [0,2,0,0,0,0|1,0,0]=3 2870 B17R1.184434 COCCNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100000209980_100000209947 [0,2,0,0,0,0|2,0,0]=4 2871 B17R1.184434 COc1cc(cc(c1O)Cl)C(=O)CCCCF 1458a_100000209947_100000729493 [0,2,0,0,0,0|2,0,0]=4 2872 B17R1.184434 COc1cc(cc(c1O)Cl)C(=O)CCCCO 1458a_100000209947_100000210776 [0,2,0,0,0,0|2,0,0]=4 2873 B17R1.184434 COc1cc(cc(c1O)Cl)C(=O)NCCCF 240690a_100015189416_100000209947 [0,2,0,0,0,0|2,0,0]=4 2874 B17R1.184434 COc1cc(cc(c1O)Cl)C(=O)NCCCO 240690a_100000182051_100000209947 [0,2,0,0,0,0|2,0,0]=4 2875 B17R1.184434 COc1cc(cc(c1O)Cl)C(=O)NCCSC 240690a_100020590264_100000209947 [0,2,0,0,0,0|2,0,0]=4 2876 B17R1.184434 COc1cc(cc(c1O)O)C(=O)CCCC#N 1458a_100000061230_100000211468 [0,2,0,0,0,0|1,0,1]=4 2877 B17R1.184434 COc1cc(cc(c1O)O)C(=O)CCCCF 1458a_100000061230_100000729493 [0,2,0,0,0,0|1,0,0]=3 2878 B17R1.184434 COc1cc(cc(c1O)O)C(=O)CCCCO 1458a_100000061230_100000210776 [0,2,0,0,0,0|1,0,0]=3 2879 B17R1.184434 COc1cc(cc(c1O)O)C(=O)NNCCO 22a_100000210001_100000061230 [0,2,0,0,0,0|2,0,0]=4 2880 B17R1.184435 C#CCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000731252 [0,2,0,0,0,0|1,0,1]=4 2881 B17R1.184435 C=CCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000757094 [0,2,0,0,0,0|1,0,1]=4 2882 B17R1.184435 CC/C=C\CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100103147603 [0,2,0,0,0,0|1,0,1]=4 2883 B17R1.184435 CCC#CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100009813939 [0,2,0,0,0,0|1,0,1]=4 2884 B17R1.184435 CCCCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000210326 [0,2,0,0,0,0|2,0,0]=4 2885 B17R1.184435 CCCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000210326 [0,2,0,0,0,0|1,0,0]=3 2886 B17R1.184435 CCCCNC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100000102301_100010760816 [0,2,0,0,0,0|2,0,0]=4 2887 B17R1.184435 CCCCNC(=O)c1cc(c(c(c1)Br)OC)O 527a_100000102301_100010760816 [0,2,0,0,0,0|2,0,0]=4 2888 B17R1.184435 CCCNNC(=O)c1cc(c(c(c1)Br)OC)O 22a_100000740057_100010760816 [0,2,0,0,0,0|2,0,0]=4 2889 B17R1.184435 CCCNNC(=O)c1cc(c(c(c1)O)OC)O 22a_100000740057_100000073573 [0,2,0,0,0,0|1,0,0]=3 2890 B17R1.184435 CCOCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100011215890 [0,2,0,0,0,0|2,0,0]=4 2891 B17R1.184435 CCOCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100011215890 [0,2,0,0,0,0|1,0,0]=3 2892 B17R1.184435 CCSCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000757381 [0,2,0,0,0,0|2,0,0]=4 2893 B17R1.184435 CCSCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000757381 [0,2,0,0,0,0|1,0,0]=3 2894 B17R1.184435 COCCCC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000740836 [0,2,0,0,0,0|2,0,0]=4 2895 B17R1.184435 COCCCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000740836 [0,2,0,0,0,0|1,0,0]=3 2896 B17R1.184435 COCCNC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100000209980_100010760816 [0,2,0,0,0,0|2,0,0]=4 2897 B17R1.184435 COCCNC(=O)c1cc(c(c(c1)Br)OC)O 527a_100000209980_100010760816 [0,2,0,0,0,0|2,0,0]=4 2898 B17R1.184435 COc1c(cc(cc1Br)C(=O)CCCCF)O 1458a_100010760816_100000729493 [0,2,0,0,0,0|2,0,0]=4 2899 B17R1.184435 COc1c(cc(cc1Br)C(=O)CCCCO)O 1458a_100010760816_100000210776 [0,2,0,0,0,0|2,0,0]=4 2900 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCCF)O 240690a_100015189416_100010760816 [0,2,0,0,0,0|2,0,0]=4 2901 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCCF)O 527a_100015189416_100010760816 [0,2,0,0,0,0|2,0,0]=4 2902 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCCO)O 240690a_100000182051_100010760816 [0,2,0,0,0,0|2,0,0]=4 2903 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCCO)O 527a_100000182051_100010760816 [0,2,0,0,0,0|2,0,0]=4 2904 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCSC)O 240690a_100020590264_100010760816 [0,2,0,0,0,0|2,0,0]=4 2905 B17R1.184435 COc1c(cc(cc1Br)C(=O)NCCSC)O 527a_100020590264_100010760816 [0,2,0,0,0,0|2,0,0]=4 2906 B17R1.184435 COc1c(cc(cc1O)C(=O)CCCC#N)O 1458a_100000073573_100000211468 [0,2,0,0,0,0|1,0,1]=4 2907 B17R1.184435 COc1c(cc(cc1O)C(=O)CCCCF)O 1458a_100000073573_100000729493 [0,2,0,0,0,0|1,0,0]=3 2908 B17R1.184435 COc1c(cc(cc1O)C(=O)CCCCO)O 1458a_100000073573_100000210776 [0,2,0,0,0,0|1,0,0]=3 2909 B17R1.184435 COc1c(cc(cc1O)C(=O)NNCCO)O 22a_100000210001_100000073573 [0,2,0,0,0,0|2,0,0]=4 2910 B17R1.67152 CCCCC(=O)c1cc(c(c(c1Cl)Cl)O)OC 1458a_200000065980_100000210211 [0,2,0,0,0,0|2,0,0]=4 2911 B17R1.67152 CCCNC(=O)c1cc(c(c(c1Cl)Cl)O)OC 240690a_100020643023_200000065980 [0,2,0,0,0,0|2,0,0]=4 2912 B17R1.14694 CCC(=O)CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000747405 [0,2,0,0,0,0|1,0,1]=4 2913 B17R1.14694 CCC(C)CC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000748023 [0,2,0,0,0,0|2,0,0]=4 2914 B17R1.14694 CCC(C)CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000748023 [0,2,0,0,0,0|1,0,0]=3 2915 B17R1.14694 CCC(C)NC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100000209981_100000209947 [0,2,0,0,0,0|2,0,0]=4 2916 B17R1.14694 CCC(O)CC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100011218378 [0,2,0,0,0,0|2,0,0]=4 2917 B17R1.14694 CCC(O)CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100011218378 [0,2,0,0,0,0|1,0,0]=3 2918 B17R1.14694 CC[C@H](C)CC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100009816398 [0,2,0,0,0,0|2,0,0]=4 2919 B17R1.14694 CC[C@H](C)CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100009816398 [0,2,0,0,0,0|1,0,0]=3 2920 B17R1.14694 COc1cc(cc(c1O)O)C(=O)C[C@@H](C)CO 1458a_100000061230_100000059175 [0,2,0,0,0,0|2,0,0]=4 2921 B17R1.59003 CCC(=O)CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000747405 [0,2,0,0,0,0|1,0,1]=4 2922 B17R1.59003 CCC(C)CC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000748023 [0,2,0,0,0,0|2,0,0]=4 2923 B17R1.59003 CCC(C)CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000748023 [0,2,0,0,0,0|1,0,0]=3 2924 B17R1.59003 CCC(C)NC(=O)c1cc(c(c(c1)Br)OC)O 240690a_100000209981_100010760816 [0,2,0,0,0,0|2,0,0]=4 2925 B17R1.59003 CCC(C)NC(=O)c1cc(c(c(c1)Br)OC)O 527a_100000209981_100010760816 [0,2,0,0,0,0|2,0,0]=4 2926 B17R1.59003 CCC(O)CC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100011218378 [0,2,0,0,0,0|2,0,0]=4 2927 B17R1.59003 CCC(O)CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100011218378 [0,2,0,0,0,0|1,0,0]=3 2928 B17R1.59003 CC[C@H](C)CC(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100009816398 [0,2,0,0,0,0|2,0,0]=4 2929 B17R1.59003 CC[C@H](C)CC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100009816398 [0,2,0,0,0,0|1,0,0]=3 2930 B17R1.59003 COc1c(cc(cc1O)C(=O)C[C@@H](C)CO)O 1458a_100000073573_100000059175 [0,2,0,0,0,0|2,0,0]=4 2931 B17R1.76156 CC(C)C(=O)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000753385 [0,2,0,0,0,0|1,0,1]=4 2932 B17R1.76156 CC(C)C(C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000211541_200009992764 [0,2,0,0,0,0|2,0,0]=4 2933 B17R1.76156 CC(C)C(C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000211541_200000078382 [0,2,0,0,0,0|2,0,0]=4 2934 B17R1.76156 CC(C)C(C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000211541_100009812877 [0,2,0,0,0,0|2,0,0]=4 2935 B17R1.76156 CC(C)C(C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000211541_100000074654 [0,2,0,0,0,0|2,0,0]=4 2936 B17R1.76156 Cc1c(cc(cc1O)C(=O)NC(C)C(C)C)O 240690a_100000211541_100000031928 [0,2,0,0,0,0|2,0,0]=4 2937 B17R1.76156 Cc1c(cc(cc1O)C(=O)NC(C)C(C)C)O 527a_100000211541_100000031928 [0,2,0,0,0,0|2,0,0]=4 2938 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000211385_200009992764 [0,2,0,0,0,0|2,0,0]=4 2939 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000211385_200000078382 [0,2,0,0,0,0|2,0,0]=4 2940 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000211385_100009812877 [0,2,0,0,0,0|2,0,0]=4 2941 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000211385_100000031928 [0,2,0,0,0,0|2,0,0]=4 2942 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000211385_100000031928 [0,2,0,0,0,0|2,0,0]=4 2943 B17R1.92811 CCC(C)(C)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000211385_100000074654 [0,2,0,0,0,0|2,0,0]=4 2944 B17R1.92811 CCS(=O)(=O)NC(=O)c1cc(c(c(c1)O)O)O 2740a_100000171174_100000212154 [0,2,0,0,0,0|2,0,0]=4 2945 B17R1.101756 CCC(CC)CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011215472 [0,2,0,0,0,0|2,0,0]=4 2946 B17R1.101756 CCC(CC)CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011215472 [0,2,0,0,0,0|2,0,0]=4 2947 B17R1.101756 CCC(CC)CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011215472 [0,2,0,0,0,0|2,0,0]=4 2948 B17R1.101756 CCC(CC)CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011215472 [0,2,0,0,0,0|2,0,0]=4 2949 B17R1.101756 CCC(CC)CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011215472 [0,2,0,0,0,0|1,0,0]=3 2950 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000199018_200009992764 [0,2,0,0,0,0|2,0,0]=4 2951 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000199018_200000078382 [0,2,0,0,0,0|2,0,0]=4 2952 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000199018_100009812877 [0,2,0,0,0,0|2,0,0]=4 2953 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000199018_100000031928 [0,2,0,0,0,0|2,0,0]=4 2954 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000199018_100000031928 [0,2,0,0,0,0|2,0,0]=4 2955 B17R1.101756 CCC(CC)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000199018_100000074654 [0,2,0,0,0,0|2,0,0]=4 2956 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000709445_200009992764 [0,2,0,0,0,0|2,0,0]=4 2957 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000709445_200000078382 [0,2,0,0,0,0|2,0,0]=4 2958 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000709445_100009812877 [0,2,0,0,0,0|2,0,0]=4 2959 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)O)C)O 240690a_100000709445_100000031928 [0,2,0,0,0,0|2,0,0]=4 2960 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)O)C)O 527a_100000709445_100000031928 [0,2,0,0,0,0|2,0,0]=4 2961 B17R1.101756 CC[C@@H](CO)NC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000709445_100000074654 [0,2,0,0,0,0|2,0,0]=4 2962 B17R1.101756 COC(CC(=O)c1cc(c(c(c1)O)O)O)OC 1458a_100000212154_100000751394 [0,2,0,0,0,0|2,0,0]=4 2963 B17R1.179756 CCC(=O)C(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000742827 [0,2,0,0,0,0|1,0,1]=4 2964 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000741768_200009992764 [0,2,0,0,0,0|2,0,0]=4 2965 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000741768_200000078382 [0,2,0,0,0,0|2,0,0]=4 2966 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000741768_100009812877 [0,2,0,0,0,0|2,0,0]=4 2967 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)O)C)O 240690a_100000741768_100000031928 [0,2,0,0,0,0|2,0,0]=4 2968 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)O)C)O 527a_100000741768_100000031928 [0,2,0,0,0,0|2,0,0]=4 2969 B17R1.179756 CCC(C)N(C)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000741768_100000074654 [0,2,0,0,0,0|2,0,0]=4 2970 B17R1.457 C=C(C)CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000730704 [0,2,0,0,0,0|1,0,1]=4 2971 B17R1.457 COc1cc(cc(c1O)Cl)C(=O)CCC(C)C 1458a_100000209947_100000210312 [0,2,0,0,0,0|2,0,0]=4 2972 B17R1.457 COc1cc(cc(c1O)Cl)C(=O)CCC(C)O 1458a_100000209947_100012276601 [0,2,0,0,0,0|2,0,0]=4 2973 B17R1.457 COc1cc(cc(c1O)Cl)C(=O)NCC(C)C 240690a_100000210953_100000209947 [0,2,0,0,0,0|2,0,0]=4 2974 B17R1.457 COc1cc(cc(c1O)Cl)C(=O)NCC(C)O 240690a_100000210904_100000209947 [0,2,0,0,0,0|2,0,0]=4 2975 B17R1.457 COc1cc(cc(c1O)O)C(=O)CCC(C)C 1458a_100000061230_100000210312 [0,2,0,0,0,0|1,0,0]=3 2976 B17R1.457 COc1cc(cc(c1O)O)C(=O)CCC(C)O 1458a_100000061230_100012276601 [0,2,0,0,0,0|1,0,0]=3 2977 B17R1.457 COc1cc(cc(c1O)O)C(=O)NNC(C)C 22a_100000741168_100000061230 [0,2,0,0,0,0|2,0,0]=4 2978 B17R1.58981 C=C(C)CCC(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000730704 [0,2,0,0,0,0|1,0,1]=4 2979 B17R1.58981 COc1c(cc(cc1Br)C(=O)CCC(C)C)O 1458a_100010760816_100000210312 [0,2,0,0,0,0|2,0,0]=4 2980 B17R1.58981 COc1c(cc(cc1Br)C(=O)CCC(C)O)O 1458a_100010760816_100012276601 [0,2,0,0,0,0|2,0,0]=4 2981 B17R1.58981 COc1c(cc(cc1Br)C(=O)NCC(C)C)O 240690a_100000210953_100010760816 [0,2,0,0,0,0|2,0,0]=4 2982 B17R1.58981 COc1c(cc(cc1Br)C(=O)NCC(C)C)O 527a_100000210953_100010760816 [0,2,0,0,0,0|2,0,0]=4 2983 B17R1.58981 COc1c(cc(cc1Br)C(=O)NCC(C)O)O 240690a_100000210904_100010760816 [0,2,0,0,0,0|2,0,0]=4 2984 B17R1.58981 COc1c(cc(cc1Br)C(=O)NCC(C)O)O 527a_100000210904_100010760816 [0,2,0,0,0,0|2,0,0]=4 2985 B17R1.58981 COc1c(cc(cc1O)C(=O)CCC(C)C)O 1458a_100000073573_100000210312 [0,2,0,0,0,0|1,0,0]=3 2986 B17R1.58981 COc1c(cc(cc1O)C(=O)CCC(C)O)O 1458a_100000073573_100012276601 [0,2,0,0,0,0|1,0,0]=3 2987 B17R1.58981 COc1c(cc(cc1O)C(=O)NNC(C)C)O 22a_100000741168_100000073573 [0,2,0,0,0,0|2,0,0]=4 2988 B17R1.76155 CC(C)CC(C)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000731052 [0,2,0,0,0,0|2,0,0]=4 2989 B17R1.76155 CC(C)CC(C)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000731052 [0,2,0,0,0,0|2,0,0]=4 2990 B17R1.76155 CC(C)CC(C)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000731052 [0,2,0,0,0,0|2,0,0]=4 2991 B17R1.76155 CC(C)CC(C)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000731052 [0,2,0,0,0,0|1,0,0]=3 2992 B17R1.76155 CC(C)CN(C)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000747067_200009992764 [0,2,0,0,0,0|2,0,0]=4 2993 B17R1.76155 CC(C)CN(C)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000747067_200000078382 [0,2,0,0,0,0|2,0,0]=4 2994 B17R1.76155 CC(C)CN(C)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000747067_100009812877 [0,2,0,0,0,0|2,0,0]=4 2995 B17R1.76155 CC(C)CN(C)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000747067_100000074654 [0,2,0,0,0,0|2,0,0]=4 2996 B17R1.76155 CC(O)CN(C)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000227577_200009992764 [0,2,0,0,0,0|2,0,0]=4 2997 B17R1.76155 CC(O)CN(C)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000227577_200000078382 [0,2,0,0,0,0|2,0,0]=4 2998 B17R1.76155 CC(O)CN(C)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000227577_100009812877 [0,2,0,0,0,0|2,0,0]=4 2999 B17R1.76155 CC(O)CN(C)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000227577_100000074654 [0,2,0,0,0,0|2,0,0]=4 3000 B17R1.76155 Cc1c(cc(cc1O)C(=O)C(C)CC(C)C)O 1458a_100000031928_100000731052 [0,2,0,0,0,0|2,0,0]=4 3001 B17R1.76155 Cc1c(cc(cc1O)C(=O)N(C)CC(C)C)O 240690a_100000747067_100000031928 [0,2,0,0,0,0|2,0,0]=4 3002 B17R1.76155 Cc1c(cc(cc1O)C(=O)N(C)CC(C)C)O 527a_100000747067_100000031928 [0,2,0,0,0,0|2,0,0]=4 3003 B17R1.76155 Cc1c(cc(cc1O)C(=O)N(C)CC(C)O)O 240690a_100000227577_100000031928 [0,2,0,0,0,0|2,0,0]=4 3004 B17R1.76155 Cc1c(cc(cc1O)C(=O)N(C)CC(C)O)O 527a_100000227577_100000031928 [0,2,0,0,0,0|2,0,0]=4 3005 B17R1.304823 CC(C)(C)CCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000755188 [0,2,0,0,0,0|2,0,0]=4 3006 B17R1.304823 CC(C)(C)CCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000755188 [0,2,0,0,0,0|2,0,0]=4 3007 B17R1.304823 CC(C)(C)CCC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100000755188 [0,2,0,0,0,0|2,0,0]=4 3008 B17R1.304823 CC(C)(C)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000755188 [0,2,0,0,0,0|1,0,0]=3 3009 B17R1.304823 CC(C)(C)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000743828_200009992764 [0,2,0,0,0,0|2,0,0]=4 3010 B17R1.304823 CC(C)(C)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000743828_200000078382 [0,2,0,0,0,0|2,0,0]=4 3011 B17R1.304823 CC(C)(C)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000743828_100009812877 [0,2,0,0,0,0|2,0,0]=4 3012 B17R1.304823 CC(C)(C)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000743828_100000074654 [0,2,0,0,0,0|2,0,0]=4 3013 B17R1.304823 CC(C)(C)NNC(=O)c1cc(c(c(c1)O)O)O 22a_100000725372_100000212154 [0,2,0,0,0,0|2,0,0]=4 3014 B17R1.304823 CC(C)(F)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100020643315_200009992764 [0,2,0,0,0,0|2,0,0]=4 3015 B17R1.304823 CC(C)(F)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100020643315_200000078382 [0,2,0,0,0,0|2,0,0]=4 3016 B17R1.304823 CC(C)(F)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100020643315_100009812877 [0,2,0,0,0,0|2,0,0]=4 3017 B17R1.304823 CC(C)(F)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100020643315_100000074654 [0,2,0,0,0,0|2,0,0]=4 3018 B17R1.304823 CC(C)(O)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000751335_200009992764 [0,2,0,0,0,0|2,0,0]=4 3019 B17R1.304823 CC(C)(O)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000751335_200000078382 [0,2,0,0,0,0|2,0,0]=4 3020 B17R1.304823 CC(C)(O)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000751335_100009812877 [0,2,0,0,0,0|2,0,0]=4 3021 B17R1.304823 CC(C)(O)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000751335_100000074654 [0,2,0,0,0,0|2,0,0]=4 3022 B17R1.304823 CC(F)(F)CNC(=O)c1cc(c(c(c1)Br)O)O 240690a_100000731000_200009992764 [0,2,0,0,0,0|2,0,0]=4 3023 B17R1.304823 CC(F)(F)CNC(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000731000_200000078382 [0,2,0,0,0,0|2,0,0]=4 3024 B17R1.304823 CC(F)(F)CNC(=O)c1cc(c(c(c1)O)Br)O 240690a_100000731000_100009812877 [0,2,0,0,0,0|2,0,0]=4 3025 B17R1.304823 CC(F)(F)CNC(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000731000_100000074654 [0,2,0,0,0,0|2,0,0]=4 3026 B17R1.304823 CS(=O)(=O)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000731031 [0,2,0,0,0,0|2,0,0]=4 3027 B17R1.304823 C[N+](C)(C)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000085578 [0,2,0,0,0,0|2,0,0]=4 3028 B17R1.304823 C[Si](C)(C)CCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000733723 [0,2,0,0,0,0|1,1,0]=4 3029 B17R1.304823 Cc1c(cc(cc1O)C(=O)CCC(C)(C)C)O 1458a_100000031928_100000755188 [0,2,0,0,0,0|2,0,0]=4 3030 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)C)O 240690a_100000743828_100000031928 [0,2,0,0,0,0|2,0,0]=4 3031 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)C)O 527a_100000743828_100000031928 [0,2,0,0,0,0|2,0,0]=4 3032 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)F)O 240690a_100020643315_100000031928 [0,2,0,0,0,0|2,0,0]=4 3033 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)F)O 527a_100020643315_100000031928 [0,2,0,0,0,0|2,0,0]=4 3034 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)O)O 240690a_100000751335_100000031928 [0,2,0,0,0,0|2,0,0]=4 3035 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(C)O)O 527a_100000751335_100000031928 [0,2,0,0,0,0|2,0,0]=4 3036 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(F)F)O 240690a_100000731000_100000031928 [0,2,0,0,0,0|2,0,0]=4 3037 B17R1.304823 Cc1c(cc(cc1O)C(=O)NCC(C)(F)F)O 527a_100000731000_100000031928 [0,2,0,0,0,0|2,0,0]=4 3038 B17R1.304823 O=C(CCC(F)(F)F)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011219754 [0,2,0,0,0,0|2,0,0]=4 3039 B17R1.176793 CCCC(CC)C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100011219200 [0,2,0,0,0,0|2,0,0]=4 3040 B17R1.176793 CCCC(CC)C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100011219200 [0,2,0,0,0,0|2,0,0]=4 3041 B17R1.176793 CCCC(CC)C(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_100011219200 [0,2,0,0,0,0|2,0,0]=4 3042 B17R1.176793 CCCC(CC)C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_100011219200 [0,2,0,0,0,0|2,0,0]=4 3043 B17R1.176793 CCCC(CC)C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100011219200 [0,2,0,0,0,0|1,0,0]=3 3044 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)Br)O)O 240690a_100000226822_200009992764 [0,2,0,0,0,0|2,0,0]=4 3045 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)Cl)O)O 240690a_100000226822_200000078382 [0,2,0,0,0,0|2,0,0]=4 3046 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)O)Br)O 240690a_100000226822_100009812877 [0,2,0,0,0,0|2,0,0]=4 3047 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)O)C)O 240690a_100000226822_100000031928 [0,2,0,0,0,0|2,0,0]=4 3048 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)O)C)O 527a_100000226822_100000031928 [0,2,0,0,0,0|2,0,0]=4 3049 B17R1.176793 CCCN(CC)C(=O)c1cc(c(c(c1)O)Cl)O 240690a_100000226822_100000074654 [0,2,0,0,0,0|2,0,0]=4 3050 B17R1.207021 CCCC(C)C(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000766640 [0,2,0,0,0,0|2,0,0]=4 3051 B17R1.207021 CCCC(C)C(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000766640 [0,2,0,0,0,0|1,0,0]=3 3052 B17R1.207021 CCCN(C)C(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100000747261_100000209947 [0,2,0,0,0,0|2,0,0]=4 3053 B17R1.207021 COCC(C)C(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000765312 [0,2,0,0,0,0|2,0,0]=4 3054 B17R1.207021 COc1cc(cc(c1O)O)C(=O)C(C)CCO 1458a_100000061230_100009893172 [0,2,0,0,0,0|2,0,0]=4 3055 B17R1.207022 CCCC(C)C(=O)c1cc(c(c(c1)Br)OC)O 1458a_100010760816_100000766640 [0,2,0,0,0,0|2,0,0]=4 3056 B17R1.207022 CCCC(C)C(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000766640 [0,2,0,0,0,0|1,0,0]=3 3057 B17R1.207022 CCCN(C)C(=O)c1cc(c(c(c1)Br)OC)O 240690a_100000747261_100010760816 [0,2,0,0,0,0|2,0,0]=4 3058 B17R1.207022 CCCN(C)C(=O)c1cc(c(c(c1)Br)OC)O 527a_100000747261_100010760816 [0,2,0,0,0,0|2,0,0]=4 3059 B17R1.207022 COCC(C)C(=O)c1cc(c(c(c1)O)OC)O 1458a_100000073573_100000765312 [0,2,0,0,0,0|2,0,0]=4 3060 B17R1.207022 COc1c(cc(cc1O)C(=O)C(C)CCO)O 1458a_100000073573_100009893172 [0,2,0,0,0,0|2,0,0]=4 3061 B17R1.67159 CCCCC(=O)c1cc(c(c(c1)OCC)O)Cl 1458a_100000010658_100000210211 [0,2,0,0,0,0|2,0,0]=4 3062 B17R1.67159 CCCNC(=O)c1cc(c(c(c1)OCC)O)Cl 240690a_100020643023_100000010658 [0,2,0,0,0,0|2,0,0]=4 3063 B17R1.67160 CCCCC(=O)c1cc(c(c(c1)OC)Br)OC 1458a_100000212323_100000210211 [0,2,0,0,0,0|2,0,0]=4 3064 B17R1.67160 CCCCC(=O)c1cc(c(c(c1)OC)C)OC 1458a_100000211643_100000210211 [0,2,0,0,0,0|2,0,0]=4 3065 B17R1.67160 CCCCC(=O)c1cc(c(c(c1)OC)O)OC 1458a_100000692901_100000210211 [0,2,0,0,0,0|1,0,0]=3 3066 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)Br)OC 11a_100020643023_100000212323 [0,2,0,0,0,0|2,0,0]=4 3067 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)Br)OC 1626a_100020643023_100000212323 [0,2,0,0,0,0|2,0,0]=4 3068 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)Br)OC 240690a_100020643023_100000212323 [0,2,0,0,0,0|2,0,0]=4 3069 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)Br)OC 527a_100020643023_100000212323 [0,2,0,0,0,0|2,0,0]=4 3070 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)C)OC 11a_100020643023_100000211643 [0,2,0,0,0,0|2,0,0]=4 3071 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)C)OC 1626a_100020643023_100000211643 [0,2,0,0,0,0|2,0,0]=4 3072 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)C)OC 240690a_100020643023_100000211643 [0,2,0,0,0,0|2,0,0]=4 3073 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)C)OC 527a_100020643023_100000211643 [0,2,0,0,0,0|2,0,0]=4 3074 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)O)OC 240690a_100020643023_100000692901 [0,2,0,0,0,0|1,0,0]=3 3075 B17R1.67160 CCCNC(=O)c1cc(c(c(c1)OC)O)OC 527a_100020643023_100000692901 [0,2,0,0,0,0|1,0,0]=3 3076 B17R1.67160 CCNNC(=O)c1cc(c(c(c1)OC)O)OC 22a_100000756455_100000692901 [0,2,0,0,0,0|2,0,0]=4 3077 B17R1.67160 COCCC(=O)c1cc(c(c(c1)OC)O)OC 1458a_100000692901_100000233755 [0,2,0,0,0,0|2,0,0]=4 3078 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)CCCF 1458a_100000692901_100011934791 [0,2,0,0,0,0|2,0,0]=4 3079 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)CCCO 1458a_100000692901_100011215043 [0,2,0,0,0,0|2,0,0]=4 3080 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)CCSC 1458a_100000692901_100000751147 [0,2,0,0,0,0|2,0,0]=4 3081 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)NCCF 240690a_100000724931_100000692901 [0,2,0,0,0,0|2,0,0]=4 3082 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)NCCF 527a_100000724931_100000692901 [0,2,0,0,0,0|2,0,0]=4 3083 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)NCCO 240690a_100000210304_100000692901 [0,2,0,0,0,0|2,0,0]=4 3084 B17R1.67160 COc1cc(cc(c1O)OC)C(=O)NCCO 527a_100000210304_100000692901 [0,2,0,0,0,0|2,0,0]=4 3085 B17R1.67161 CCCCC(=O)c1cc(c(c(c1)OC)OC)Cl 1458a_100000180162_100000210211 [0,2,0,0,0,0|2,0,0]=4 3086 B17R1.67161 CCCCC(=O)c1cc(c(c(c1)OC)OC)O 1458a_100000032013_100000210211 [0,2,0,0,0,0|1,0,0]=3 3087 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)Cl 11a_100020643023_100000180162 [0,2,0,0,0,0|2,0,0]=4 3088 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)Cl 1626a_100020643023_100000180162 [0,2,0,0,0,0|2,0,0]=4 3089 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)Cl 240690a_100020643023_100000180162 [0,2,0,0,0,0|2,0,0]=4 3090 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)Cl 527a_100020643023_100000180162 [0,2,0,0,0,0|2,0,0]=4 3091 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)O 240690a_100020643023_100000032013 [0,2,0,0,0,0|1,0,0]=3 3092 B17R1.67161 CCCNC(=O)c1cc(c(c(c1)OC)OC)O 527a_100020643023_100000032013 [0,2,0,0,0,0|1,0,0]=3 3093 B17R1.67161 CCNNC(=O)c1cc(c(c(c1)OC)OC)O 22a_100000756455_100000032013 [0,2,0,0,0,0|2,0,0]=4 3094 B17R1.67161 COCCC(=O)c1cc(c(c(c1)OC)OC)O 1458a_100000032013_100000233755 [0,2,0,0,0,0|2,0,0]=4 3095 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)CCCF 1458a_100000032013_100011934791 [0,2,0,0,0,0|2,0,0]=4 3096 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)CCCO 1458a_100000032013_100011215043 [0,2,0,0,0,0|2,0,0]=4 3097 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)CCSC 1458a_100000032013_100000751147 [0,2,0,0,0,0|2,0,0]=4 3098 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)NCCF 240690a_100000724931_100000032013 [0,2,0,0,0,0|2,0,0]=4 3099 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)NCCF 527a_100000724931_100000032013 [0,2,0,0,0,0|2,0,0]=4 3100 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)NCCO 240690a_100000210304_100000032013 [0,2,0,0,0,0|2,0,0]=4 3101 B17R1.67161 COc1cc(cc(c1OC)O)C(=O)NCCO 527a_100000210304_100000032013 [0,2,0,0,0,0|2,0,0]=4 3102 B17R1.67164 CCCCC(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O 1458a_100009843786_100000210211 [0,2,0,0,0,0|1,0,1]=4 3103 B17R1.67164 CCCNC(=O)c1cc(c(c(c1)[N+](=O)[O-])O)O 240690a_100020643023_100009843786 [0,2,0,0,0,0|1,0,1]=4 3104 B15R2.152902 Oc1cc(cc(c1O)O)SCC2CC2 62a_100000756562_100010658518 [1,0,0,1,0,0|2,0,0]=4 3105 B15R2.27 Cc1cc(cc(c1)C2=CCCCO2)O 271570a_100010177797_100011999630 [1,0,0,1,0,0|2,0,0]=4 3106 B15R2.27 Oc1cc(cc(c1)C2=CCCCC2)O 271570a_100000062251_100009868816 [1,0,0,1,0,0|2,0,0]=4 3107 B15R2.27 Oc1cc(cc(c1)C2=CCCCO2)Br 271570a_100010177797_100010068917 [1,0,0,1,0,0|2,0,0]=4 3108 B15R2.27 Oc1cc(cc(c1)C2=CCCCO2)Cl 271570a_100010177797_100010068924 [1,0,0,1,0,0|2,0,0]=4 3109 B15R2.27 Oc1cc(cc(c1)C2=CCCCO2)F 271570a_100010177797_100000717995 [1,0,0,1,0,0|2,0,0]=4 3110 B15R2.27 Oc1cc(cc(c1)C2=CCCCO2)O 271570a_100010177797_100009868816 [1,0,0,1,0,0|1,0,0]=3 3111 B15R2.6869 Cc1cc(cc(c1)C(=O)C2CCC2)O 1458a_100000094094_100000749161 [1,0,0,1,0,0|2,0,0]=4 3112 B15R2.6869 Cc1cc(cc(c1)C(=O)N2CCC2)O 240690a_100000754969_100000094094 [1,0,0,1,0,0|2,0,0]=4 3113 B15R2.6869 Cc1cc(cc(c1)C(=O)N2CCC2)O 527a_100000754969_100000094094 [1,0,0,1,0,0|2,0,0]=4 3114 B15R2.6869 O=C(c1cc(cc(c1)Br)O)C2CCC2 1458a_100011934545_100000749161 [1,0,0,1,0,0|2,0,0]=4 3115 B15R2.6869 O=C(c1cc(cc(c1)Br)O)N2CCC2 240690a_100000754969_100011934545 [1,0,0,1,0,0|2,0,0]=4 3116 B15R2.6869 O=C(c1cc(cc(c1)Br)O)N2CCC2 527a_100000754969_100011934545 [1,0,0,1,0,0|2,0,0]=4 3117 B15R2.6869 O=C(c1cc(cc(c1)Cl)O)C2CCC2 1458a_100011997059_100000749161 [1,0,0,1,0,0|2,0,0]=4 3118 B15R2.6869 O=C(c1cc(cc(c1)Cl)O)N2CCC2 240690a_100000754969_100011997059 [1,0,0,1,0,0|2,0,0]=4 3119 B15R2.6869 O=C(c1cc(cc(c1)Cl)O)N2CCC2 527a_100000754969_100011997059 [1,0,0,1,0,0|2,0,0]=4 3120 B15R2.6869 O=C(c1cc(cc(c1)F)O)C2CCC2 1458a_100012017291_100000749161 [1,0,0,1,0,0|2,0,0]=4 3121 B15R2.6869 O=C(c1cc(cc(c1)F)O)N2CCC2 11a_100000754969_100012017291 [1,0,0,1,0,0|2,0,0]=4 3122 B15R2.6869 O=C(c1cc(cc(c1)F)O)N2CCC2 240690a_100000754969_100012017291 [1,0,0,1,0,0|2,0,0]=4 3123 B15R2.6869 O=C(c1cc(cc(c1)F)O)N2CCC2 527a_100000754969_100012017291 [1,0,0,1,0,0|2,0,0]=4 3124 B15R2.6869 O=C(c1cc(cc(c1)O)O)N2CCC2 240690a_100000754969_100000690292 [1,0,0,1,0,0|1,0,0]=3 3125 B15R2.6869 O=C(c1cc(cc(c1)O)O)N2CCC2 527a_100000754969_100000690292 [1,0,0,1,0,0|1,0,0]=3 3126 B15R2.6870 Cc1cc(cc(c1)C(=O)CC2CC2)O 1458a_100000094094_100000742324 [1,0,0,1,0,0|2,0,0]=4 3127 B15R2.6870 Cc1cc(cc(c1)C(=O)NC2CC2)O 240690a_100000212008_100000094094 [1,0,0,1,0,0|2,0,0]=4 3128 B15R2.6870 Cc1cc(cc(c1)C(=O)NC2CC2)O 527a_100000212008_100000094094 [1,0,0,1,0,0|2,0,0]=4 3129 B15R2.6870 O=C(CC1CC1)c2cc(cc(c2)Br)O 1458a_100011934545_100000742324 [1,0,0,1,0,0|2,0,0]=4 3130 B15R2.6870 O=C(CC1CC1)c2cc(cc(c2)Cl)O 1458a_100011997059_100000742324 [1,0,0,1,0,0|2,0,0]=4 3131 B15R2.6870 O=C(CC1CC1)c2cc(cc(c2)F)O 1458a_100012017291_100000742324 [1,0,0,1,0,0|2,0,0]=4 3132 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)Br)O 240690a_100000212008_100011934545 [1,0,0,1,0,0|2,0,0]=4 3133 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)Br)O 527a_100000212008_100011934545 [1,0,0,1,0,0|2,0,0]=4 3134 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)Cl)O 240690a_100000212008_100011997059 [1,0,0,1,0,0|2,0,0]=4 3135 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)Cl)O 527a_100000212008_100011997059 [1,0,0,1,0,0|2,0,0]=4 3136 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)F)O 240690a_100000212008_100012017291 [1,0,0,1,0,0|2,0,0]=4 3137 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)F)O 527a_100000212008_100012017291 [1,0,0,1,0,0|2,0,0]=4 3138 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)O)O 240690a_100000212008_100000690292 [1,0,0,1,0,0|1,0,0]=3 3139 B15R2.6870 O=C(NC1CC1)c2cc(cc(c2)O)O 527a_100000212008_100000690292 [1,0,0,1,0,0|1,0,0]=3 3140 B15R2.94 Cc1cc(ccc1O)C2=CCCCO2 271570a_100010177797_100000186361 [1,0,0,1,0,0|2,0,0]=4 3141 B15R2.94 Cc1ccc(cc1O)C2=CCCCO2 271570a_100010177797_100000766334 [1,0,0,1,0,0|2,0,0]=4 3142 B15R2.94 Nc1cc(ccc1O)C2=CCCCO2 271570a_100010177797_100000752626 [1,0,0,1,0,0|2,0,0]=4 3143 B15R2.94 Nc1ccc(cc1O)C2=CCCCO2 271570a_100010177797_100000739049 [1,0,0,1,0,0|2,0,0]=4 3144 B15R2.94 Oc1cc(ccc1Br)C2=CCCCO2 271570a_100010177797_100012356990 [1,0,0,1,0,0|2,0,0]=4 3145 B15R2.94 Oc1cc(ccc1Cl)C2=CCCCO2 271570a_100010177797_100011356854 [1,0,0,1,0,0|2,0,0]=4 3146 B15R2.94 Oc1cc(ccc1F)C2=CCCCO2 271570a_100010177797_100000686035 [1,0,0,1,0,0|2,0,0]=4 3147 B15R2.94 Oc1ccc(cc1Br)C2=CCCCO2 271570a_100010177797_100012361655 [1,0,0,1,0,0|2,0,0]=4 3148 B15R2.94 Oc1ccc(cc1Cl)C2=CCCCO2 271570a_100010177797_100012360047 [1,0,0,1,0,0|2,0,0]=4 3149 B15R2.94 Oc1ccc(cc1F)C2=CCCCO2 271570a_100010177797_100000185481 [1,0,0,1,0,0|2,0,0]=4 3150 B15R2.94 Oc1ccc(cc1O)C2=CCCCC2 271570a_100000062251_100009813601 [1,0,0,1,0,0|2,0,0]=4 3151 B15R2.94 Oc1ccc(cc1O)C2=CCCCO2 271570a_100010177797_100009813601 [1,0,0,1,0,0|1,0,0]=3 3152 B15R2.18898 Cc1cc(ccc1O)C(=O)CC2CC2 1458a_100000685612_100000742324 [1,0,0,1,0,0|2,0,0]=4 3153 B15R2.18898 Cc1cc(ccc1O)C(=O)NC2CC2 240690a_100000212008_100000685612 [1,0,0,1,0,0|2,0,0]=4 3154 B15R2.18898 Cc1ccc(cc1O)C(=O)CC2CC2 1458a_100000233767_100000742324 [1,0,0,1,0,0|2,0,0]=4 3155 B15R2.18898 Cc1ccc(cc1O)C(=O)NC2CC2 240690a_100000212008_100000233767 [1,0,0,1,0,0|2,0,0]=4 3156 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)Br)O 1458a_100000189672_100000742324 [1,0,0,1,0,0|2,0,0]=4 3157 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)Cl)O 1458a_100000212196_100000742324 [1,0,0,1,0,0|2,0,0]=4 3158 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)F)O 1458a_100000185466_100000742324 [1,0,0,1,0,0|2,0,0]=4 3159 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)I)O 1458a_100000037485_100000742324 [1,0,0,1,0,0|2,0,0]=4 3160 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)Br 1458a_100000689001_100000742324 [1,0,0,1,0,0|2,0,0]=4 3161 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)Cl 1458a_100011933997_100000742324 [1,0,0,1,0,0|2,0,0]=4 3162 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)F 1458a_100000035894_100000742324 [1,0,0,1,0,0|2,0,0]=4 3163 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)I 1458a_100000239334_100000742324 [1,0,0,1,0,0|2,0,0]=4 3164 B15R2.18898 O=C(CC1CC1)c2ccc(c(c2)O)O 1458a_100000212155_100000742324 [1,0,0,1,0,0|1,0,0]=3 3165 B15R2.18898 O=C(CC1CO1)c2ccc(c(c2)O)O 1458a_100000212155_100011216344 [1,0,0,1,0,0|2,0,0]=4 3166 B15R2.18898 O=C(CC1CS1)c2ccc(c(c2)O)O 1458a_100000212155_100000031435 [1,0,0,1,0,0|2,0,0]=4 3167 B15R2.18898 O=C(C[C@@H]1CO1)c2ccc(c(c2)O)O 1458a_100000212155_100000745022 [1,0,0,1,0,0|2,0,0]=4 3168 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Br)O 240690a_100000212008_100000189672 [1,0,0,1,0,0|2,0,0]=4 3169 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)O 240690a_100000212008_100000212196 [1,0,0,1,0,0|2,0,0]=4 3170 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)Cl)O 527a_100000212008_100000212196 [1,0,0,1,0,0|2,0,0]=4 3171 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)O 240690a_100000212008_100000185466 [1,0,0,1,0,0|2,0,0]=4 3172 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)F)O 527a_100000212008_100000185466 [1,0,0,1,0,0|2,0,0]=4 3173 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)O 1626a_100000212008_100000037485 [1,0,0,1,0,0|2,0,0]=4 3174 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)I)O 240690a_100000212008_100000037485 [1,0,0,1,0,0|2,0,0]=4 3175 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Br 240690a_100000212008_100000689001 [1,0,0,1,0,0|2,0,0]=4 3176 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Br 527a_100000212008_100000689001 [1,0,0,1,0,0|2,0,0]=4 3177 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Cl 240690a_100000212008_100011933997 [1,0,0,1,0,0|2,0,0]=4 3178 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)Cl 527a_100000212008_100011933997 [1,0,0,1,0,0|2,0,0]=4 3179 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 240690a_100000212008_100000035894 [1,0,0,1,0,0|2,0,0]=4 3180 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 271570a_203496583355_200012359902 [1,0,0,1,0,0|2,0,0]=4 3181 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)F 527a_100000212008_100000035894 [1,0,0,1,0,0|2,0,0]=4 3182 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 1626a_100000212008_100000239334 [1,0,0,1,0,0|2,0,0]=4 3183 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 240690a_100000212008_100000239334 [1,0,0,1,0,0|2,0,0]=4 3184 B15R2.18898 O=C(NC1CC1)c2ccc(c(c2)O)I 527a_100000212008_100000239334 [1,0,0,1,0,0|2,0,0]=4 3185 B15R2.19038 Cc1cc(ccc1O)C(=O)C2CCC2 1458a_100000685612_100000749161 [1,0,0,1,0,0|2,0,0]=4 3186 B15R2.19038 Cc1cc(ccc1O)C(=O)N2CCC2 240690a_100000754969_100000685612 [1,0,0,1,0,0|2,0,0]=4 3187 B15R2.19038 Cc1ccc(cc1O)C(=O)C2CCC2 1458a_100000233767_100000749161 [1,0,0,1,0,0|2,0,0]=4 3188 B15R2.19038 Cc1ccc(cc1O)C(=O)N2CCC2 240690a_100000754969_100000233767 [1,0,0,1,0,0|2,0,0]=4 3189 B15R2.19038 O=C(c1ccc(c(c1)Br)O)C2CCC2 1458a_100000189672_100000749161 [1,0,0,1,0,0|2,0,0]=4 3190 B15R2.19038 O=C(c1ccc(c(c1)Br)O)N2CCC2 240690a_100000754969_100000189672 [1,0,0,1,0,0|2,0,0]=4 3191 B15R2.19038 O=C(c1ccc(c(c1)Cl)O)C2CCC2 1458a_100000212196_100000749161 [1,0,0,1,0,0|2,0,0]=4 3192 B15R2.19038 O=C(c1ccc(c(c1)Cl)O)N2CCC2 240690a_100000754969_100000212196 [1,0,0,1,0,0|2,0,0]=4 3193 B15R2.19038 O=C(c1ccc(c(c1)Cl)O)N2CCC2 527a_100000754969_100000212196 [1,0,0,1,0,0|2,0,0]=4 3194 B15R2.19038 O=C(c1ccc(c(c1)F)O)C2CCC2 1458a_100000185466_100000749161 [1,0,0,1,0,0|2,0,0]=4 3195 B15R2.19038 O=C(c1ccc(c(c1)F)O)N2CCC2 240690a_100000754969_100000185466 [1,0,0,1,0,0|2,0,0]=4 3196 B15R2.19038 O=C(c1ccc(c(c1)F)O)N2CCC2 527a_100000754969_100000185466 [1,0,0,1,0,0|2,0,0]=4 3197 B15R2.19038 O=C(c1ccc(c(c1)I)O)C2CCC2 1458a_100000037485_100000749161 [1,0,0,1,0,0|2,0,0]=4 3198 B15R2.19038 O=C(c1ccc(c(c1)I)O)N2CCC2 240690a_100000754969_100000037485 [1,0,0,1,0,0|2,0,0]=4 3199 B15R2.19038 O=C(c1ccc(c(c1)O)Br)C2CCC2 1458a_100000689001_100000749161 [1,0,0,1,0,0|2,0,0]=4 3200 B15R2.19038 O=C(c1ccc(c(c1)O)Br)N2CCC2 240690a_100000754969_100000689001 [1,0,0,1,0,0|2,0,0]=4 3201 B15R2.19038 O=C(c1ccc(c(c1)O)Br)N2CCC2 527a_100000754969_100000689001 [1,0,0,1,0,0|2,0,0]=4 3202 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)C2CCC2 1458a_100011933997_100000749161 [1,0,0,1,0,0|2,0,0]=4 3203 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)N2CCC2 240690a_100000754969_100011933997 [1,0,0,1,0,0|2,0,0]=4 3204 B15R2.19038 O=C(c1ccc(c(c1)O)Cl)N2CCC2 527a_100000754969_100011933997 [1,0,0,1,0,0|2,0,0]=4 3205 B15R2.19038 O=C(c1ccc(c(c1)O)F)C2CCC2 1458a_100000035894_100000749161 [1,0,0,1,0,0|2,0,0]=4 3206 B15R2.19038 O=C(c1ccc(c(c1)O)F)N2CCC2 240690a_100000754969_100000035894 [1,0,0,1,0,0|2,0,0]=4 3207 B15R2.19038 O=C(c1ccc(c(c1)O)F)N2CCC2 527a_100000754969_100000035894 [1,0,0,1,0,0|2,0,0]=4 3208 B15R2.19038 O=C(c1ccc(c(c1)O)I)C2CCC2 1458a_100000239334_100000749161 [1,0,0,1,0,0|2,0,0]=4 3209 B15R2.19038 O=C(c1ccc(c(c1)O)I)N2CCC2 240690a_100000754969_100000239334 [1,0,0,1,0,0|2,0,0]=4 3210 B15R2.19038 O=C(c1ccc(c(c1)O)I)N2CCC2 527a_100000754969_100000239334 [1,0,0,1,0,0|2,0,0]=4 3211 B15R2.19038 O=C(c1ccc(c(c1)O)O)C2CCC2 1458a_100000212155_100000749161 [1,0,0,1,0,0|1,0,0]=3 3212 B15R2.19038 O=C(c1ccc(c(c1)O)O)C2COC2 1458a_100000212155_100000687716 [1,0,0,1,0,0|2,0,0]=4 3213 B17R2.23784 Cc1c(cc(cc1O)C(=O)C2CCCC2)O 1458a_100000031928_100000179811 [0,1,0,1,0,0|2,0,0]=4 3214 B17R2.23784 Cc1c(cc(cc1O)C(=O)C2CCOC2)O 1458a_100000031928_100000690089 [0,1,0,1,0,0|2,0,0]=4 3215 B17R2.23784 Cc1c(cc(cc1O)C(=O)N2CCCC2)O 240690a_100000188435_100000031928 [0,1,0,1,0,0|2,0,0]=4 3216 B17R2.23784 Cc1c(cc(cc1O)C(=O)N2CCCC2)O 527a_100000188435_100000031928 [0,1,0,1,0,0|2,0,0]=4 3217 B17R2.23784 Cc1c(cc(cc1O)C(=O)N2CCSC2)O 240690a_100011215254_100000031928 [0,1,0,1,0,0|2,0,0]=4 3218 B17R2.23784 Cc1c(cc(cc1O)C(=O)N2CCSC2)O 527a_100011215254_100000031928 [0,1,0,1,0,0|2,0,0]=4 3219 B17R2.23784 O=C(c1cc(c(c(c1)Br)O)O)C2CCCC2 1458a_200009992764_100000179811 [0,1,0,1,0,0|2,0,0]=4 3220 B17R2.23784 O=C(c1cc(c(c(c1)Br)O)O)C2CCOC2 1458a_200009992764_100000690089 [0,1,0,1,0,0|2,0,0]=4 3221 B17R2.23784 O=C(c1cc(c(c(c1)Br)O)O)N2CCCC2 240690a_100000188435_200009992764 [0,1,0,1,0,0|2,0,0]=4 3222 B17R2.23784 O=C(c1cc(c(c(c1)Br)O)O)N2CCSC2 240690a_100011215254_200009992764 [0,1,0,1,0,0|2,0,0]=4 3223 B17R2.23784 O=C(c1cc(c(c(c1)Cl)O)O)C2CCCC2 1458a_200000078382_100000179811 [0,1,0,1,0,0|2,0,0]=4 3224 B17R2.23784 O=C(c1cc(c(c(c1)Cl)O)O)C2CCOC2 1458a_200000078382_100000690089 [0,1,0,1,0,0|2,0,0]=4 3225 B17R2.23784 O=C(c1cc(c(c(c1)Cl)O)O)N2CCCC2 240690a_100000188435_200000078382 [0,1,0,1,0,0|2,0,0]=4 3226 B17R2.23784 O=C(c1cc(c(c(c1)Cl)O)O)N2CCSC2 240690a_100011215254_200000078382 [0,1,0,1,0,0|2,0,0]=4 3227 B17R2.23784 O=C(c1cc(c(c(c1)O)Br)O)N2CCCC2 240690a_100000188435_100009812877 [0,1,0,1,0,0|2,0,0]=4 3228 B17R2.23784 O=C(c1cc(c(c(c1)O)Br)O)N2CCSC2 240690a_100011215254_100009812877 [0,1,0,1,0,0|2,0,0]=4 3229 B17R2.23784 O=C(c1cc(c(c(c1)O)Cl)O)C2CCCC2 1458a_100000074654_100000179811 [0,1,0,1,0,0|2,0,0]=4 3230 B17R2.23784 O=C(c1cc(c(c(c1)O)Cl)O)C2CCOC2 1458a_100000074654_100000690089 [0,1,0,1,0,0|2,0,0]=4 3231 B17R2.23784 O=C(c1cc(c(c(c1)O)Cl)O)N2CCCC2 240690a_100000188435_100000074654 [0,1,0,1,0,0|2,0,0]=4 3232 B17R2.23784 O=C(c1cc(c(c(c1)O)Cl)O)N2CCSC2 240690a_100011215254_100000074654 [0,1,0,1,0,0|2,0,0]=4 3233 B17R2.23784 O=C(c1cc(c(c(c1)O)O)O)C2CCCC2 1458a_100000212154_100000179811 [0,1,0,1,0,0|1,0,0]=3 3234 B17R2.23784 O=C(c1cc(c(c(c1)O)O)O)C2CCOC2 1458a_100000212154_100000690089 [0,1,0,1,0,0|1,0,0]=3 3235 B17R2.96301 CCc1noc(n1)c2cc(c(c(c2)O)O)O 270196a_200000212204_100000212154 [0,1,0,1,0,0|1,0,1]=4 3236 B17R2.176314 Cc1c(cc(cc1O)C(=O)N[C@@H]2C[C@@H]2F)O 240690a_100015190264_100000031928 [0,1,0,1,0,0|2,0,0]=4 3237 B17R2.176314 Cc1c(cc(cc1O)C(=O)N[C@@H]2C[C@@H]2F)O 527a_100015190264_100000031928 [0,1,0,1,0,0|2,0,0]=4 3238 B17R2.176314 Cc1c(cc(cc1O)C(=O)N[C@@H]2C[C@H]2F)O 240690a_100025746932_100000031928 [0,1,0,1,0,0|2,0,0]=4 3239 B17R2.176314 Cc1c(cc(cc1O)C(=O)N[C@@H]2C[C@H]2F)O 527a_100025746932_100000031928 [0,1,0,1,0,0|2,0,0]=4 3240 B17R2.176314 O=C(N[C@@H]1C[C@@H]1F)c2cc(c(c(c2)Br)O)O 240690a_100015190264_200009992764 [0,1,0,1,0,0|2,0,0]=4 3241 B17R2.176314 O=C(N[C@@H]1C[C@@H]1F)c2cc(c(c(c2)Cl)O)O 240690a_100015190264_200000078382 [0,1,0,1,0,0|2,0,0]=4 3242 B17R2.176314 O=C(N[C@@H]1C[C@@H]1F)c2cc(c(c(c2)O)Br)O 240690a_100015190264_100009812877 [0,1,0,1,0,0|2,0,0]=4 3243 B17R2.176314 O=C(N[C@@H]1C[C@@H]1F)c2cc(c(c(c2)O)Cl)O 240690a_100015190264_100000074654 [0,1,0,1,0,0|2,0,0]=4 3244 B17R2.176314 O=C(N[C@@H]1C[C@H]1F)c2cc(c(c(c2)Br)O)O 240690a_100025746932_200009992764 [0,1,0,1,0,0|2,0,0]=4 3245 B17R2.176314 O=C(N[C@@H]1C[C@H]1F)c2cc(c(c(c2)Cl)O)O 240690a_100025746932_200000078382 [0,1,0,1,0,0|2,0,0]=4 3246 B17R2.176314 O=C(N[C@@H]1C[C@H]1F)c2cc(c(c(c2)O)Br)O 240690a_100025746932_100009812877 [0,1,0,1,0,0|2,0,0]=4 3247 B17R2.176314 O=C(N[C@@H]1C[C@H]1F)c2cc(c(c(c2)O)Cl)O 240690a_100025746932_100000074654 [0,1,0,1,0,0|2,0,0]=4 3248 B17R2.771180 Cc1c(cc(cc1O)C(=O)CC2CCC2)O 1458a_100000031928_100000763275 [0,1,0,1,0,0|2,0,0]=4 3249 B17R2.771180 Cc1c(cc(cc1O)C(=O)CC2CCO2)O 1458a_100000031928_100000103362 [0,1,0,1,0,0|2,0,0]=4 3250 B17R2.771180 Cc1c(cc(cc1O)C(=O)CC2COC2)O 1458a_100000031928_100010264016 [0,1,0,1,0,0|2,0,0]=4 3251 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2CCC2)O 240690a_100000749019_100000031928 [0,1,0,1,0,0|2,0,0]=4 3252 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2CCC2)O 527a_100000749019_100000031928 [0,1,0,1,0,0|2,0,0]=4 3253 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2COC2)O 240690a_100016991112_100000031928 [0,1,0,1,0,0|2,0,0]=4 3254 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2COC2)O 527a_100016991112_100000031928 [0,1,0,1,0,0|2,0,0]=4 3255 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2CSC2)O 240690a_100016994217_100000031928 [0,1,0,1,0,0|2,0,0]=4 3256 B17R2.771180 Cc1c(cc(cc1O)C(=O)NC2CSC2)O 527a_100016994217_100000031928 [0,1,0,1,0,0|2,0,0]=4 3257 B17R2.771180 O=C(CC1CCC1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000763275 [0,1,0,1,0,0|2,0,0]=4 3258 B17R2.771180 O=C(CC1CCC1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000763275 [0,1,0,1,0,0|2,0,0]=4 3259 B17R2.771180 O=C(CC1CCC1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000763275 [0,1,0,1,0,0|2,0,0]=4 3260 B17R2.771180 O=C(CC1CCC1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000763275 [0,1,0,1,0,0|1,0,0]=3 3261 B17R2.771180 O=C(CC1CCO1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000103362 [0,1,0,1,0,0|2,0,0]=4 3262 B17R2.771180 O=C(CC1CCO1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000103362 [0,1,0,1,0,0|2,0,0]=4 3263 B17R2.771180 O=C(CC1CCO1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000103362 [0,1,0,1,0,0|2,0,0]=4 3264 B17R2.771180 O=C(CC1CCO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000103362 [0,1,0,1,0,0|1,0,0]=3 3265 B17R2.771180 O=C(CC1COC1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100010264016 [0,1,0,1,0,0|2,0,0]=4 3266 B17R2.771180 O=C(CC1COC1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100010264016 [0,1,0,1,0,0|2,0,0]=4 3267 B17R2.771180 O=C(CC1COC1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100010264016 [0,1,0,1,0,0|2,0,0]=4 3268 B17R2.771180 O=C(CC1COC1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100010264016 [0,1,0,1,0,0|1,0,0]=3 3269 B17R2.771180 O=C(NC1CCC1)c2cc(c(c(c2)Br)O)O 240690a_100000749019_200009992764 [0,1,0,1,0,0|2,0,0]=4 3270 B17R2.771180 O=C(NC1CCC1)c2cc(c(c(c2)Cl)O)O 240690a_100000749019_200000078382 [0,1,0,1,0,0|2,0,0]=4 3271 B17R2.771180 O=C(NC1CCC1)c2cc(c(c(c2)O)Br)O 240690a_100000749019_100009812877 [0,1,0,1,0,0|2,0,0]=4 3272 B17R2.771180 O=C(NC1CCC1)c2cc(c(c(c2)O)Cl)O 240690a_100000749019_100000074654 [0,1,0,1,0,0|2,0,0]=4 3273 B17R2.771180 O=C(NC1COC1)c2cc(c(c(c2)Br)O)O 240690a_100016991112_200009992764 [0,1,0,1,0,0|2,0,0]=4 3274 B17R2.771180 O=C(NC1COC1)c2cc(c(c(c2)Cl)O)O 240690a_100016991112_200000078382 [0,1,0,1,0,0|2,0,0]=4 3275 B17R2.771180 O=C(NC1COC1)c2cc(c(c(c2)O)Br)O 240690a_100016991112_100009812877 [0,1,0,1,0,0|2,0,0]=4 3276 B17R2.771180 O=C(NC1COC1)c2cc(c(c(c2)O)Cl)O 240690a_100016991112_100000074654 [0,1,0,1,0,0|2,0,0]=4 3277 B17R2.771180 O=C(NC1CSC1)c2cc(c(c(c2)Br)O)O 240690a_100016994217_200009992764 [0,1,0,1,0,0|2,0,0]=4 3278 B17R2.771180 O=C(NC1CSC1)c2cc(c(c(c2)Cl)O)O 240690a_100016994217_200000078382 [0,1,0,1,0,0|2,0,0]=4 3279 B17R2.771180 O=C(NC1CSC1)c2cc(c(c(c2)O)Br)O 240690a_100016994217_100009812877 [0,1,0,1,0,0|2,0,0]=4 3280 B17R2.771180 O=C(NC1CSC1)c2cc(c(c(c2)O)Cl)O 240690a_100016994217_100000074654 [0,1,0,1,0,0|2,0,0]=4 3281 B17R2.882091 Cc1c(cc(cc1O)C(=O)CCC2CC2)O 1458a_100000031928_100000694398 [0,1,0,1,0,0|2,0,0]=4 3282 B17R2.882091 Cc1c(cc(cc1O)C(=O)CCC2CO2)O 1458a_100000031928_100000732470 [0,1,0,1,0,0|2,0,0]=4 3283 B17R2.882091 Cc1c(cc(cc1O)C(=O)NCC2CC2)O 240690a_100000735609_100000031928 [0,1,0,1,0,0|2,0,0]=4 3284 B17R2.882091 Cc1c(cc(cc1O)C(=O)NCC2CC2)O 527a_100000735609_100000031928 [0,1,0,1,0,0|2,0,0]=4 3285 B17R2.882091 Cc1c(cc(cc1O)C(=O)NNC2CC2)O 22a_100000701032_100000031928 [0,1,0,1,0,0|2,0,0]=4 3286 B17R2.882091 O=C(CCC1CC1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000694398 [0,1,0,1,0,0|2,0,0]=4 3287 B17R2.882091 O=C(CCC1CC1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000694398 [0,1,0,1,0,0|2,0,0]=4 3288 B17R2.882091 O=C(CCC1CC1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000694398 [0,1,0,1,0,0|2,0,0]=4 3289 B17R2.882091 O=C(CCC1CC1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000694398 [0,1,0,1,0,0|1,0,0]=3 3290 B17R2.882091 O=C(CCC1CO1)c2cc(c(c(c2)Br)O)O 1458a_200009992764_100000732470 [0,1,0,1,0,0|2,0,0]=4 3291 B17R2.882091 O=C(CCC1CO1)c2cc(c(c(c2)Cl)O)O 1458a_200000078382_100000732470 [0,1,0,1,0,0|2,0,0]=4 3292 B17R2.882091 O=C(CCC1CO1)c2cc(c(c(c2)O)Cl)O 1458a_100000074654_100000732470 [0,1,0,1,0,0|2,0,0]=4 3293 B17R2.882091 O=C(CCC1CO1)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000732470 [0,1,0,1,0,0|1,0,0]=3 3294 B17R2.882091 O=C(NCC1CC1)c2cc(c(c(c2)Br)O)O 240690a_100000735609_200009992764 [0,1,0,1,0,0|2,0,0]=4 3295 B17R2.882091 O=C(NCC1CC1)c2cc(c(c(c2)Cl)O)O 240690a_100000735609_200000078382 [0,1,0,1,0,0|2,0,0]=4 3296 B17R2.882091 O=C(NCC1CC1)c2cc(c(c(c2)O)Br)O 240690a_100000735609_100009812877 [0,1,0,1,0,0|2,0,0]=4 3297 B17R2.882091 O=C(NCC1CC1)c2cc(c(c(c2)O)Cl)O 240690a_100000735609_100000074654 [0,1,0,1,0,0|2,0,0]=4 3298 B17R2.882091 O=C(NNC1CC1)c2cc(c(c(c2)Br)O)O 22a_100000701032_200009992764 [0,1,0,1,0,0|2,0,0]=4 3299 B17R2.882091 O=C(NNC1CC1)c2cc(c(c(c2)Cl)O)O 22a_100000701032_200000078382 [0,1,0,1,0,0|2,0,0]=4 3300 B17R2.882091 O=C(NNC1CC1)c2cc(c(c(c2)O)Br)O 22a_100000701032_100009812877 [0,1,0,1,0,0|2,0,0]=4 3301 B17R2.882091 O=C(NNC1CC1)c2cc(c(c(c2)O)Cl)O 22a_100000701032_100000074654 [0,1,0,1,0,0|2,0,0]=4 3302 B17R2.882091 O=C(NNC1CC1)c2cc(c(c(c2)O)O)O 22a_100000701032_100000212154 [0,1,0,1,0,0|1,0,0]=3 3303 B17R2.923290 CC1CCN1C(=O)c2cc(c(c(c2)Br)O)O 240690a_100000755817_200009992764 [0,1,0,1,0,0|2,0,0]=4 3304 B17R2.923290 CC1CCN1C(=O)c2cc(c(c(c2)Cl)O)O 240690a_100000755817_200000078382 [0,1,0,1,0,0|2,0,0]=4 3305 B17R2.923290 CC1CCN1C(=O)c2cc(c(c(c2)O)Br)O 240690a_100000755817_100009812877 [0,1,0,1,0,0|2,0,0]=4 3306 B17R2.923290 CC1CCN1C(=O)c2cc(c(c(c2)O)Cl)O 240690a_100000755817_100000074654 [0,1,0,1,0,0|2,0,0]=4 3307 B17R2.923290 Cc1c(cc(cc1O)C(=O)N2CCC2C)O 240690a_100000755817_100000031928 [0,1,0,1,0,0|2,0,0]=4 3308 B17R2.923290 Cc1c(cc(cc1O)C(=O)N2CCC2C)O 527a_100000755817_100000031928 [0,1,0,1,0,0|2,0,0]=4 3309 B17R2.923290 O=C1CCC1C(=O)c2cc(c(c(c2)O)O)O 1458a_100000212154_100009892977 [0,1,0,1,0,0|1,0,1]=4 3310 B17R2.176313 CC1(CC1)NC(=O)c2cc(c(c(c2)Br)O)O 240690a_100000757604_200009992764 [0,1,0,1,0,0|2,0,0]=4 3311 B17R2.176313 CC1(CC1)NC(=O)c2cc(c(c(c2)Cl)O)O 240690a_100000757604_200000078382 [0,1,0,1,0,0|2,0,0]=4 3312 B17R2.176313 CC1(CC1)NC(=O)c2cc(c(c(c2)O)Br)O 240690a_100000757604_100009812877 [0,1,0,1,0,0|2,0,0]=4 3313 B17R2.176313 CC1(CC1)NC(=O)c2cc(c(c(c2)O)Cl)O 240690a_100000757604_100000074654 [0,1,0,1,0,0|2,0,0]=4 3314 B17R2.176313 CC1(CO1)CC(=O)c2cc(c(c(c2)O)O)O 1458a_100000212154_100000760498 [0,1,0,1,0,0|2,0,0]=4 3315 B17R2.176313 Cc1c(cc(cc1O)C(=O)NC2(CC2)C)O 240690a_100000757604_100000031928 [0,1,0,1,0,0|2,0,0]=4 3316 B17R2.176313 Cc1c(cc(cc1O)C(=O)NC2(CC2)C)O 527a_100000757604_100000031928 [0,1,0,1,0,0|2,0,0]=4 3317 B17R2.798326 CC1CN(C1)C(=O)c2cc(c(c(c2)Br)O)O 240690a_100000702820_200009992764 [0,1,0,1,0,0|2,0,0]=4 3318 B17R2.798326 CC1CN(C1)C(=O)c2cc(c(c(c2)Cl)O)O 240690a_100000702820_200000078382 [0,1,0,1,0,0|2,0,0]=4 3319 B17R2.798326 CC1CN(C1)C(=O)c2cc(c(c(c2)O)Br)O 240690a_100000702820_100009812877 [0,1,0,1,0,0|2,0,0]=4 3320 B17R2.798326 CC1CN(C1)C(=O)c2cc(c(c(c2)O)Cl)O 240690a_100000702820_100000074654 [0,1,0,1,0,0|2,0,0]=4 3321 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)C)O 240690a_100000702820_100000031928 [0,1,0,1,0,0|2,0,0]=4 3322 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)C)O 527a_100000702820_100000031928 [0,1,0,1,0,0|2,0,0]=4 3323 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)F)O 240690a_100000690557_100000031928 [0,1,0,1,0,0|2,0,0]=4 3324 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)F)O 527a_100000690557_100000031928 [0,1,0,1,0,0|2,0,0]=4 3325 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)O)O 240690a_100000749847_100000031928 [0,1,0,1,0,0|2,0,0]=4 3326 B17R2.798326 Cc1c(cc(cc1O)C(=O)N2CC(C2)O)O 527a_100000749847_100000031928 [0,1,0,1,0,0|2,0,0]=4 3327 B17R2.798326 O=C(c1cc(c(c(c1)Br)O)O)N2CC(C2)F 240690a_100000690557_200009992764 [0,1,0,1,0,0|2,0,0]=4 3328 B17R2.798326 O=C(c1cc(c(c(c1)Br)O)O)N2CC(C2)O 240690a_100000749847_200009992764 [0,1,0,1,0,0|2,0,0]=4 3329 B17R2.798326 O=C(c1cc(c(c(c1)Cl)O)O)N2CC(C2)F 240690a_100000690557_200000078382 [0,1,0,1,0,0|2,0,0]=4 3330 B17R2.798326 O=C(c1cc(c(c(c1)Cl)O)O)N2CC(C2)O 240690a_100000749847_200000078382 [0,1,0,1,0,0|2,0,0]=4 3331 B17R2.798326 O=C(c1cc(c(c(c1)O)Br)O)N2CC(C2)F 240690a_100000690557_100009812877 [0,1,0,1,0,0|2,0,0]=4 3332 B17R2.798326 O=C(c1cc(c(c(c1)O)Br)O)N2CC(C2)O 240690a_100000749847_100009812877 [0,1,0,1,0,0|2,0,0]=4 3333 B17R2.798326 O=C(c1cc(c(c(c1)O)Cl)O)N2CC(C2)F 240690a_100000690557_100000074654 [0,1,0,1,0,0|2,0,0]=4 3334 B17R2.798326 O=C(c1cc(c(c(c1)O)Cl)O)N2CC(C2)O 240690a_100000749847_100000074654 [0,1,0,1,0,0|2,0,0]=4 3335 B17R2.882119 CN(C(=O)c1cc(c(c(c1)Br)O)O)C2CC2 240690a_100000226674_200009992764 [0,1,0,1,0,0|2,0,0]=4 3336 B17R2.882119 CN(C(=O)c1cc(c(c(c1)Cl)O)O)C2CC2 240690a_100000226674_200000078382 [0,1,0,1,0,0|2,0,0]=4 3337 B17R2.882119 CN(C(=O)c1cc(c(c(c1)O)Br)O)C2CC2 240690a_100000226674_100009812877 [0,1,0,1,0,0|2,0,0]=4 3338 B17R2.882119 CN(C(=O)c1cc(c(c(c1)O)Cl)O)C2CC2 240690a_100000226674_100000074654 [0,1,0,1,0,0|2,0,0]=4 3339 B17R2.882119 Cc1c(cc(cc1O)C(=O)N(C)C2CC2)O 240690a_100000226674_100000031928 [0,1,0,1,0,0|2,0,0]=4 3340 B17R2.882119 Cc1c(cc(cc1O)C(=O)N(C)C2CC2)O 527a_100000226674_100000031928 [0,1,0,1,0,0|2,0,0]=4 3341 B17R2.107 COc1cc(cc(c1F)O)C2=CCCCO2 271570a_100010177797_200015524394 [0,1,0,1,0,0|2,0,0]=4 3342 B17R2.43164 COc1cc(cc(c1O)Cl)C(=O)CC2CC2 1458a_100000209947_100000742324 [0,1,0,1,0,0|2,0,0]=4 3343 B17R2.43164 COc1cc(cc(c1O)Cl)C(=O)NC2CC2 240690a_100000212008_100000209947 [0,1,0,1,0,0|2,0,0]=4 3344 B17R2.43164 COc1cc(cc(c1O)O)C(=O)CC2CC2 1458a_100000061230_100000742324 [0,1,0,1,0,0|1,0,0]=3 3345 B17R2.43164 COc1cc(cc(c1O)O)C(=O)CC2CO2 1458a_100000061230_100011216344 [0,1,0,1,0,0|2,0,0]=4 3346 B17R2.43164 COc1cc(cc(c1O)O)C(=O)CC2CS2 1458a_100000061230_100000031435 [0,1,0,1,0,0|2,0,0]=4 3347 B17R2.43164 COc1cc(cc(c1O)O)C(=O)C[C@@H]2CO2 1458a_100000061230_100000745022 [0,1,0,1,0,0|2,0,0]=4 3348 B17R2.74711 CCCCC(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_100000210211 [0,1,0,1,0,0|2,0,0]=4 3349 B17R2.74711 CCCNC(=O)c1cc(c2c(c1)OCO2)Br 11a_100020643023_100000744664 [0,1,0,1,0,0|2,0,0]=4 3350 B17R2.74711 CCCNC(=O)c1cc(c2c(c1)OCO2)Br 1626a_100020643023_100000744664 [0,1,0,1,0,0|2,0,0]=4 3351 B17R2.74711 CCCNC(=O)c1cc(c2c(c1)OCO2)Br 240690a_100020643023_100000744664 [0,1,0,1,0,0|2,0,0]=4 3352 B17R2.74711 CCCNC(=O)c1cc(c2c(c1)OCO2)Br 527a_100020643023_100000744664 [0,1,0,1,0,0|2,0,0]=4 3353 B17R2.278454 COc1cc(cc(c1O)Cl)C(=O)C2CCC2 1458a_100000209947_100000749161 [0,1,0,1,0,0|2,0,0]=4 3354 B17R2.278454 COc1cc(cc(c1O)Cl)C(=O)N2CCC2 240690a_100000754969_100000209947 [0,1,0,1,0,0|2,0,0]=4 3355 B17R2.278454 COc1cc(cc(c1O)O)C(=O)C2CCC2 1458a_100000061230_100000749161 [0,1,0,1,0,0|1,0,0]=3 3356 B17R2.278454 COc1cc(cc(c1O)O)C(=O)C2COC2 1458a_100000061230_100000687716 [0,1,0,1,0,0|2,0,0]=4 3357 B17R2.138091 COc1c(cc(cc1Br)C(=O)C2CCC2)O 1458a_100010760816_100000749161 [0,1,0,1,0,0|2,0,0]=4 3358 B17R2.138091 COc1c(cc(cc1Br)C(=O)N2CCC2)O 240690a_100000754969_100010760816 [0,1,0,1,0,0|2,0,0]=4 3359 B17R2.138091 COc1c(cc(cc1Br)C(=O)N2CCC2)O 527a_100000754969_100010760816 [0,1,0,1,0,0|2,0,0]=4 3360 B17R2.138091 COc1c(cc(cc1O)C(=O)C2CCC2)O 1458a_100000073573_100000749161 [0,1,0,1,0,0|1,0,0]=3 3361 B17R2.138091 COc1c(cc(cc1O)C(=O)C2COC2)O 1458a_100000073573_100000687716 [0,1,0,1,0,0|2,0,0]=4 3362 B17R2.138092 COc1c(cc(cc1Br)C(=O)CC2CC2)O 1458a_100010760816_100000742324 [0,1,0,1,0,0|2,0,0]=4 3363 B17R2.138092 COc1c(cc(cc1Br)C(=O)NC2CC2)O 240690a_100000212008_100010760816 [0,1,0,1,0,0|2,0,0]=4 3364 B17R2.138092 COc1c(cc(cc1Br)C(=O)NC2CC2)O 527a_100000212008_100010760816 [0,1,0,1,0,0|2,0,0]=4 3365 B17R2.138092 COc1c(cc(cc1O)C(=O)CC2CC2)O 1458a_100000073573_100000742324 [0,1,0,1,0,0|1,0,0]=3 3366 B17R2.138092 COc1c(cc(cc1O)C(=O)CC2CO2)O 1458a_100000073573_100011216344 [0,1,0,1,0,0|2,0,0]=4 3367 B17R2.138092 COc1c(cc(cc1O)C(=O)CC2CS2)O 1458a_100000073573_100000031435 [0,1,0,1,0,0|2,0,0]=4 3368 B17R2.138092 COc1c(cc(cc1O)C(=O)C[C@@H]2CO2)O 1458a_100000073573_100000745022 [0,1,0,1,0,0|2,0,0]=4 3369 B15R1.3898 CCCCC(=Cc1cc(cc(c1)O)O)Br 271570a_206741709834_100009868816 [1,0,0,0,0,1|2,0,0]=4 3370 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000210183 [1,0,0,0,0,1|2,0,0]=4 3371 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000210183 [1,0,0,0,0,1|2,0,0]=4 3372 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000210183 [1,0,0,0,0,1|2,0,0]=4 3373 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000210183 [1,0,0,0,0,1|2,0,0]=4 3374 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100000210183 [1,0,0,0,0,1|2,0,0]=4 3375 B15R1.3898 CCCCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000210183 [1,0,0,0,0,1|1,0,0]=3 3376 B15R1.3898 CCCNC(=O)Cc1cc(cc(c1)O)O 240690a_100020643023_100000080560 [1,0,0,0,0,1|1,0,0]=3 3377 B15R1.3898 CCCNC(=O)Cc1cc(cc(c1)O)O 527a_100020643023_100000080560 [1,0,0,0,0,1|1,0,0]=3 3378 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)Cl)O 2430a_100000123917_100020643023 [1,0,0,0,0,1|2,0,0]=4 3379 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)Cl)O 512a_100000123917_100020643023 [1,0,0,0,0,1|2,0,0]=4 3380 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)O)C 2430a_100011995906_100020643023 [1,0,0,0,0,1|2,0,0]=4 3381 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)O)C 512a_100011995906_100020643023 [1,0,0,0,0,1|2,0,0]=4 3382 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)O)O 2430a_100000043371_100020643023 [1,0,0,0,0,1|1,0,0]=3 3383 B15R1.3898 CCCNC(=O)Nc1cc(cc(c1)O)O 512a_100000043371_100020643023 [1,0,0,0,0,1|1,0,0]=3 3384 B15R1.3898 CCNNC(=O)Cc1cc(cc(c1)O)O 22a_100000756455_100000080560 [1,0,0,0,0,1|2,0,0]=4 3385 B15R1.3898 CCNNC(=O)Nc1cc(cc(c1)O)O 512a_100000043371_100000756455 [1,0,0,0,0,1|2,0,0]=4 3386 B15R1.3898 CCOCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000211967 [1,0,0,0,0,1|2,0,0]=4 3387 B15R1.3898 CCSCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000230394 [1,0,0,0,0,1|2,0,0]=4 3388 B15R1.3898 COCCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000749529 [1,0,0,0,0,1|2,0,0]=4 3389 B15R1.3898 CSCCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000174002 [1,0,0,0,0,1|2,0,0]=4 3390 B15R1.3898 O=C(Cc1cc(cc(c1)O)O)NCCF 240690a_100000724931_100000080560 [1,0,0,0,0,1|2,0,0]=4 3391 B15R1.3898 O=C(Cc1cc(cc(c1)O)O)NCCF 527a_100000724931_100000080560 [1,0,0,0,0,1|2,0,0]=4 3392 B15R1.3898 O=C(Cc1cc(cc(c1)O)O)NCCO 240690a_100000210304_100000080560 [1,0,0,0,0,1|2,0,0]=4 3393 B15R1.3898 O=C(Cc1cc(cc(c1)O)O)NCCO 527a_100000210304_100000080560 [1,0,0,0,0,1|2,0,0]=4 3394 B15R1.3898 O=C(NCCF)Nc1cc(cc(c1)O)O 2430a_100000043371_100000724931 [1,0,0,0,0,1|2,0,0]=4 3395 B15R1.3898 O=C(NCCF)Nc1cc(cc(c1)O)O 512a_100000043371_100000724931 [1,0,0,0,0,1|2,0,0]=4 3396 B15R1.3898 O=C(NCCO)Nc1cc(cc(c1)O)O 2430a_100000043371_100000210304 [1,0,0,0,0,1|2,0,0]=4 3397 B15R1.3898 O=C(NCCO)Nc1cc(cc(c1)O)O 512a_100000043371_100000210304 [1,0,0,0,0,1|2,0,0]=4 3398 B15R1.3908 CCC#CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100011827653 [1,0,0,0,0,1|1,0,1]=4 3399 B15R1.3908 CCC=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000212282 [1,0,0,0,0,1|1,0,1]=4 3400 B15R1.3908 CCCCC(=Cc1ccc(c(c1)O)O)Br 271570a_206741709834_100009813601 [1,0,0,0,0,1|2,0,0]=4 3401 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210211 [1,0,0,0,0,1|2,0,0]=4 3402 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210211 [1,0,0,0,0,1|2,0,0]=4 3403 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210211 [1,0,0,0,0,1|2,0,0]=4 3404 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210211 [1,0,0,0,0,1|2,0,0]=4 3405 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210211 [1,0,0,0,0,1|2,0,0]=4 3406 B15R1.3908 CCCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210211 [1,0,0,0,0,1|1,0,0]=3 3407 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210183 [1,0,0,0,0,1|2,0,0]=4 3408 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210183 [1,0,0,0,0,1|2,0,0]=4 3409 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000210183 [1,0,0,0,0,1|2,0,0]=4 3410 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000210183 [1,0,0,0,0,1|2,0,0]=4 3411 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000210183 [1,0,0,0,0,1|2,0,0]=4 3412 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210183 [1,0,0,0,0,1|2,0,0]=4 3413 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000210183 [1,0,0,0,0,1|2,0,0]=4 3414 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000210183 [1,0,0,0,0,1|2,0,0]=4 3415 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000210183 [1,0,0,0,0,1|2,0,0]=4 3416 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000210183 [1,0,0,0,0,1|2,0,0]=4 3417 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000210183 [1,0,0,0,0,1|2,0,0]=4 3418 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210183 [1,0,0,0,0,1|2,0,0]=4 3419 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000210183 [1,0,0,0,0,1|2,0,0]=4 3420 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000210183 [1,0,0,0,0,1|2,0,0]=4 3421 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210183 [1,0,0,0,0,1|1,0,0]=3 3422 B15R1.3908 CCCCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210183 [1,0,0,0,0,1|1,0,0]=3 3423 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100020643023_100009990404 [1,0,0,0,0,1|2,0,0]=4 3424 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Br)O 527a_100020643023_100009990404 [1,0,0,0,0,1|2,0,0]=4 3425 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)O 240690a_100020643023_100000083968 [1,0,0,0,0,1|2,0,0]=4 3426 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)C)O 527a_100020643023_100000083968 [1,0,0,0,0,1|2,0,0]=4 3427 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100020643023_100000035197 [1,0,0,0,0,1|2,0,0]=4 3428 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100020643023_100000035197 [1,0,0,0,0,1|2,0,0]=4 3429 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)O 240690a_100020643023_100000039761 [1,0,0,0,0,1|2,0,0]=4 3430 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)F)O 527a_100020643023_100000039761 [1,0,0,0,0,1|2,0,0]=4 3431 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 11a_100020643023_100000082272 [1,0,0,0,0,1|2,0,0]=4 3432 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 240690a_100020643023_100000082272 [1,0,0,0,0,1|2,0,0]=4 3433 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)C 527a_100020643023_100000082272 [1,0,0,0,0,1|2,0,0]=4 3434 B15R1.3908 CCCNC(=O)Cc1ccc(c(c1)O)O 527a_100020643023_100000031429 [1,0,0,0,0,1|1,0,0]=3 3435 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100020643023 [1,0,0,0,0,1|2,0,0]=4 3436 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100020643023 [1,0,0,0,0,1|2,0,0]=4 3437 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100020643023 [1,0,0,0,0,1|2,0,0]=4 3438 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100020643023 [1,0,0,0,0,1|2,0,0]=4 3439 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100020643023 [1,0,0,0,0,1|2,0,0]=4 3440 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100020643023 [1,0,0,0,0,1|2,0,0]=4 3441 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100020643023 [1,0,0,0,0,1|2,0,0]=4 3442 B15R1.3908 CCCNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100020643023 [1,0,0,0,0,1|1,0,0]=3 3443 B15R1.3908 CCNNC(=O)Cc1ccc(c(c1)O)O 22a_100000756455_100000031429 [1,0,0,0,0,1|2,0,0]=4 3444 B15R1.3908 CCOCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000211967 [1,0,0,0,0,1|2,0,0]=4 3445 B15R1.3908 CCOCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000211967 [1,0,0,0,0,1|2,0,0]=4 3446 B15R1.3908 CCSCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000230394 [1,0,0,0,0,1|2,0,0]=4 3447 B15R1.3908 CCSCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000230394 [1,0,0,0,0,1|2,0,0]=4 3448 B15R1.3908 COCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000233755 [1,0,0,0,0,1|2,0,0]=4 3449 B15R1.3908 COCCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000749529 [1,0,0,0,0,1|2,0,0]=4 3450 B15R1.3908 COCCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000749529 [1,0,0,0,0,1|2,0,0]=4 3451 B15R1.3908 CSCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000751147 [1,0,0,0,0,1|2,0,0]=4 3452 B15R1.3908 CSCCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000174002 [1,0,0,0,0,1|2,0,0]=4 3453 B15R1.3908 CSCCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000174002 [1,0,0,0,0,1|2,0,0]=4 3454 B15R1.3908 O=C(CCCF)Cc1ccc(c(c1)O)O 1458a_100000031429_100011934791 [1,0,0,0,0,1|2,0,0]=4 3455 B15R1.3908 O=C(CCCO)Cc1ccc(c(c1)O)O 1458a_100000031429_100011215043 [1,0,0,0,0,1|2,0,0]=4 3456 B15R1.3908 O=C(Cc1ccc(c(c1)O)O)NCCF 527a_100000724931_100000031429 [1,0,0,0,0,1|2,0,0]=4 3457 B15R1.3908 O=C(Cc1ccc(c(c1)O)O)NCCO 527a_100000210304_100000031429 [1,0,0,0,0,1|2,0,0]=4 3458 B15R1.3908 O=C(NCCF)Nc1ccc(c(c1)O)O 2430a_100102946323_100000724931 [1,0,0,0,0,1|2,0,0]=4 3459 B15R1.3908 O=C(NCCO)Nc1ccc(c(c1)O)O 2430a_100102946323_100000210304 [1,0,0,0,0,1|2,0,0]=4 3460 B17R1.9317 C=C(CSc1cc(c(c(c1)O)O)O)OCOC 62a_100000042856_100010658518 [0,0,0,0,0,2|2,0,0]=4 3461 B17R1.9317 C=CCOC(=O)CSc1cc(c(c(c1)O)O)O 62a_100000033060_100010658518 [0,0,0,0,0,2|0,0,2]=4 3462 B17R1.9317 CCCNC(=O)CSc1cc(c(c(c1)F)O)O 62a_100000183358_100010114375 [0,0,0,0,0,2|2,0,0]=4 3463 B17R1.9317 CCCNC(=O)CSc1cc(c(c(c1)O)O)O 62a_100000183358_100010658518 [0,0,0,0,0,2|1,0,0]=3 3464 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Br)O)Br 34a_200000186426_200011215008 [0,0,0,0,0,2|2,0,0]=4 3465 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Br)O)C 34a_100010064301_200011215008 [0,0,0,0,0,2|2,0,0]=4 3466 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Br)O)C 7a_100010064301_200011215008 [0,0,0,0,0,2|2,0,0]=4 3467 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)C)O)C 34a_100000703291_200011215008 [0,0,0,0,0,2|2,0,0]=4 3468 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)C)O)C 7a_100000703291_200011215008 [0,0,0,0,0,2|2,0,0]=4 3469 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_200011215008 [0,0,0,0,0,2|2,0,0]=4 3470 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_200011215008 [0,0,0,0,0,2|2,0,0]=4 3471 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_200011215008 [0,0,0,0,0,2|2,0,0]=4 3472 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_200011215008 [0,0,0,0,0,2|2,0,0]=4 3473 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)F)O)F 34a_100016987357_200011215008 [0,0,0,0,0,2|2,0,0]=4 3474 B17R1.9317 CCCOC(=O)CNc1cc(c(c(c1)F)O)F 7a_100016987357_200011215008 [0,0,0,0,0,2|2,0,0]=4 3475 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Br)O)C 62a_100010982682_200011215008 [0,0,0,0,0,2|2,0,0]=4 3476 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Br)O)C 62a_200011215008_100010982682 [0,0,0,0,0,2|2,0,0]=4 3477 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)C)O)C 62a_100011216129_200011215008 [0,0,0,0,0,2|2,0,0]=4 3478 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)C)O)C 62a_200011215008_100011216129 [0,0,0,0,0,2|2,0,0]=4 3479 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Cl)O)C 62a_200011215008_200015900153 [0,0,0,0,0,2|2,0,0]=4 3480 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Cl)O)C 62a_200015900153_200011215008 [0,0,0,0,0,2|2,0,0]=4 3481 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_200011215008 [0,0,0,0,0,2|2,0,0]=4 3482 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)Cl)O)Cl 62a_200011215008_100012339652 [0,0,0,0,0,2|2,0,0]=4 3483 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)F)O 62a_100000709865_200011215008 [0,0,0,0,0,2|2,0,0]=4 3484 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)F)O 62a_200011215008_100000709865 [0,0,0,0,0,2|2,0,0]=4 3485 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)N)O 62a_100015475841_200011215008 [0,0,0,0,0,2|2,0,0]=4 3486 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)N)O 62a_200011215008_100015475841 [0,0,0,0,0,2|2,0,0]=4 3487 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)O)F 62a_100011216917_200011215008 [0,0,0,0,0,2|2,0,0]=4 3488 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)O)F 62a_200011215008_100011216917 [0,0,0,0,0,2|2,0,0]=4 3489 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)O)N 62a_100011217383_200011215008 [0,0,0,0,0,2|2,0,0]=4 3490 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)O)N 62a_200011215008_100011217383 [0,0,0,0,0,2|2,0,0]=4 3491 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)F)O)O 62a_200011215008_100010114375 [0,0,0,0,0,2|1,0,0]=3 3492 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)N)O)C 62a_100011825904_200011215008 [0,0,0,0,0,2|2,0,0]=4 3493 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)N)O)C 62a_200011215008_100011825904 [0,0,0,0,0,2|2,0,0]=4 3494 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)O)N)C 62a_100010371313_200011215008 [0,0,0,0,0,2|2,0,0]=4 3495 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)O)N)C 62a_200011215008_100010371313 [0,0,0,0,0,2|2,0,0]=4 3496 B17R1.9317 CCCOC(=O)CSc1cc(c(c(c1)O)O)O 62a_200011215008_100010658518 [0,0,0,0,0,2|0,0,0]=2 3497 B17R1.9317 CCNNC(=O)C=Cc1cc(c(c(c1)O)O)O 22a_100000756455_100016254167 [0,0,0,0,0,2|2,0,0]=4