0 B17R2.193 Brc1ccc(cc1Br)CNc2ccccc2 207a_100000106764_100011215943 [0,0,0,0,0,0|4,0,0]=4 1 B17R2.193 Brc1ccc(cc1Br)CNc2ccccc2 270302a_100000106764_100011215943 [0,0,0,0,0,0|4,0,0]=4 2 B17R2.193 Brc1ccc(cc1Br)CNc2ccccc2 34a_100000106764_100012353900 [0,0,0,0,0,0|4,0,0]=4 3 B17R2.193 Brc1ccc(cc1Br)COc2ccccc2 34a_100000210340_100012353900 [0,0,0,0,0,0|3,1,0]=4 4 B17R2.193 Brc1ccc(cc1Br)COc2ccccc2 7a_100000210340_100012353900 [0,0,0,0,0,0|3,1,0]=4 5 B17R2.193 Brc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_100012353900 [0,0,0,0,0,0|3,0,0]=3 6 B17R2.193 Brc1ccc(cc1Br)CSc2ccccc2 62a_100012353900_100000041952 [0,0,0,0,0,0|3,0,0]=3 7 B17R2.193 Brc1ccc(cc1Br)CSc2ccccn2 62a_100011216584_100012353900 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.193 Brc1ccc(cc1Br)CSc2ccccn2 62a_100012353900_100011216584 [0,0,0,0,0,0|4,0,0]=4 9 B17R2.193 Brc1ccc(cc1Br)CSc2cccnc2 62a_100000210063_100012353900 [0,0,0,0,0,0|4,0,0]=4 10 B17R2.193 Brc1ccc(cc1Br)CSc2cccnc2 62a_100012353900_100000210063 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.193 Brc1ccc(cc1Br)CSc2ccncc2 62a_100000728582_100012353900 [0,0,0,0,0,0|4,0,0]=4 12 B17R2.193 Brc1ccc(cc1Br)CSc2ccncc2 62a_100012353900_100000728582 [0,0,0,0,0,0|4,0,0]=4 13 B17R2.193 Brc1ccc(cc1I)CNc2ccccc2 207a_100000106764_100010146563 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.193 Brc1ccc(cc1I)CNc2ccccc2 34a_100000106764_100010146616 [0,0,0,0,0,0|4,0,0]=4 15 B17R2.193 Brc1ccc(cc1I)COc2ccccc2 34a_100000210340_100010146616 [0,0,0,0,0,0|3,1,0]=4 16 B17R2.193 Brc1ccc(cc1I)COc2ccccc2 7a_100000210340_100010146616 [0,0,0,0,0,0|3,1,0]=4 17 B17R2.193 Brc1ccc(cc1I)CSc2ccccc2 62a_100000719477_100010146616 [0,0,0,0,0,0|3,0,0]=3 18 B17R2.193 Brc1ccc(cc1I)CSc2ccccc2 62a_100010146616_100000041952 [0,0,0,0,0,0|3,0,0]=3 19 B17R2.193 Brc1ccc(cc1I)CSc2ccccn2 62a_100010146616_100011216584 [0,0,0,0,0,0|4,0,0]=4 20 B17R2.193 Brc1ccc(cc1I)CSc2ccccn2 62a_100011216584_100010146616 [0,0,0,0,0,0|4,0,0]=4 21 B17R2.193 Brc1ccc(cc1I)CSc2cccnc2 62a_100000210063_100010146616 [0,0,0,0,0,0|4,0,0]=4 22 B17R2.193 Brc1ccc(cc1I)CSc2cccnc2 62a_100010146616_100000210063 [0,0,0,0,0,0|4,0,0]=4 23 B17R2.193 Brc1ccc(cc1I)CSc2ccncc2 62a_100000728582_100010146616 [0,0,0,0,0,0|4,0,0]=4 24 B17R2.193 Brc1ccc(cc1I)CSc2ccncc2 62a_100010146616_100000728582 [0,0,0,0,0,0|4,0,0]=4 25 B17R2.193 Cc1cc(ccc1Br)CNc2ccccc2 207a_100000106764_100000765772 [0,0,0,0,0,0|4,0,0]=4 26 B17R2.193 Cc1cc(ccc1Br)CNc2ccccc2 270302a_100000106764_100000765772 [0,0,0,0,0,0|4,0,0]=4 27 B17R2.193 Cc1cc(ccc1Br)CNc2ccccc2 34a_100000106764_100000727479 [0,0,0,0,0,0|4,0,0]=4 28 B17R2.193 Cc1cc(ccc1Br)COc2ccccc2 34a_100000210340_100000727479 [0,0,0,0,0,0|3,1,0]=4 29 B17R2.193 Cc1cc(ccc1Br)COc2ccccc2 7a_100000210340_100000727479 [0,0,0,0,0,0|3,1,0]=4 30 B17R2.193 Cc1cc(ccc1Br)CSc2ccccc2 62a_100000719477_100000727479 [0,0,0,0,0,0|3,0,0]=3 31 B17R2.193 Cc1cc(ccc1Br)CSc2ccccc2 62a_100000727479_100000041952 [0,0,0,0,0,0|3,0,0]=3 32 B17R2.193 Cc1cc(ccc1Br)CSc2ccccn2 62a_100000727479_100011216584 [0,0,0,0,0,0|4,0,0]=4 33 B17R2.193 Cc1cc(ccc1Br)CSc2ccccn2 62a_100011216584_100000727479 [0,0,0,0,0,0|4,0,0]=4 34 B17R2.193 Cc1cc(ccc1Br)CSc2cccnc2 62a_100000210063_100000727479 [0,0,0,0,0,0|4,0,0]=4 35 B17R2.193 Cc1cc(ccc1Br)CSc2cccnc2 62a_100000727479_100000210063 [0,0,0,0,0,0|4,0,0]=4 36 B17R2.193 Cc1cc(ccc1Br)CSc2ccncc2 62a_100000727479_100000728582 [0,0,0,0,0,0|4,0,0]=4 37 B17R2.193 Cc1cc(ccc1Br)CSc2ccncc2 62a_100000728582_100000727479 [0,0,0,0,0,0|4,0,0]=4 38 B17R2.193 Cc1cc(ccc1Cl)CNc2ccccc2 207a_100000106764_100000698814 [0,0,0,0,0,0|4,0,0]=4 39 B17R2.193 Cc1cc(ccc1Cl)CNc2ccccc2 270302a_100000106764_100000698814 [0,0,0,0,0,0|4,0,0]=4 40 B17R2.193 Cc1cc(ccc1Cl)CNc2ccccc2 34a_100000106764_100012184735 [0,0,0,0,0,0|4,0,0]=4 41 B17R2.193 Cc1cc(ccc1Cl)COc2ccccc2 34a_100000210340_100012184735 [0,0,0,0,0,0|3,1,0]=4 42 B17R2.193 Cc1cc(ccc1Cl)COc2ccccc2 7a_100000210340_100012184735 [0,0,0,0,0,0|3,1,0]=4 43 B17R2.193 Cc1cc(ccc1Cl)CSc2ccccc2 62a_100000719477_100012184735 [0,0,0,0,0,0|3,0,0]=3 44 B17R2.193 Cc1cc(ccc1Cl)CSc2ccccc2 62a_100012184735_100000041952 [0,0,0,0,0,0|3,0,0]=3 45 B17R2.193 Cc1cc(ccc1Cl)CSc2ccccn2 62a_100011216584_100012184735 [0,0,0,0,0,0|4,0,0]=4 46 B17R2.193 Cc1cc(ccc1Cl)CSc2ccccn2 62a_100012184735_100011216584 [0,0,0,0,0,0|4,0,0]=4 47 B17R2.193 Cc1cc(ccc1Cl)CSc2cccnc2 62a_100000210063_100012184735 [0,0,0,0,0,0|4,0,0]=4 48 B17R2.193 Cc1cc(ccc1Cl)CSc2cccnc2 62a_100012184735_100000210063 [0,0,0,0,0,0|4,0,0]=4 49 B17R2.193 Cc1cc(ccc1Cl)CSc2ccncc2 62a_100000728582_100012184735 [0,0,0,0,0,0|4,0,0]=4 50 B17R2.193 Cc1cc(ccc1Cl)CSc2ccncc2 62a_100012184735_100000728582 [0,0,0,0,0,0|4,0,0]=4 51 B17R2.193 Cc1cc(ccc1F)CNc2ccccc2 207a_100000106764_100000748208 [0,0,0,0,0,0|4,0,0]=4 52 B17R2.193 Cc1cc(ccc1F)CNc2ccccc2 270302a_100000106764_100000748208 [0,0,0,0,0,0|4,0,0]=4 53 B17R2.193 Cc1cc(ccc1F)CNc2ccccc2 34a_100000106764_100011216667 [0,0,0,0,0,0|4,0,0]=4 54 B17R2.193 Cc1cc(ccc1F)COc2ccccc2 34a_100000210340_100011216667 [0,0,0,0,0,0|3,1,0]=4 55 B17R2.193 Cc1cc(ccc1F)COc2ccccc2 7a_100000210340_100011216667 [0,0,0,0,0,0|3,1,0]=4 56 B17R2.193 Cc1cc(ccc1F)CSc2ccccc2 62a_100000719477_100011216667 [0,0,0,0,0,0|3,0,0]=3 57 B17R2.193 Cc1cc(ccc1F)CSc2ccccc2 62a_100011216667_100000041952 [0,0,0,0,0,0|3,0,0]=3 58 B17R2.193 Cc1cc(ccc1F)CSc2ccccn2 62a_100011216584_100011216667 [0,0,0,0,0,0|4,0,0]=4 59 B17R2.193 Cc1cc(ccc1F)CSc2ccccn2 62a_100011216667_100011216584 [0,0,0,0,0,0|4,0,0]=4 60 B17R2.193 Cc1cc(ccc1F)CSc2cccnc2 62a_100000210063_100011216667 [0,0,0,0,0,0|4,0,0]=4 61 B17R2.193 Cc1cc(ccc1F)CSc2cccnc2 62a_100011216667_100000210063 [0,0,0,0,0,0|4,0,0]=4 62 B17R2.193 Cc1cc(ccc1F)CSc2ccncc2 62a_100000728582_100011216667 [0,0,0,0,0,0|4,0,0]=4 63 B17R2.193 Cc1cc(ccc1F)CSc2ccncc2 62a_100011216667_100000728582 [0,0,0,0,0,0|4,0,0]=4 64 B17R2.193 Cc1cc(ccc1O)C#Cc2ccccc2 271570a_100000069678_100000186361 [0,0,0,0,0,0|3,0,1]=4 65 B17R2.193 Cc1cc(ccc1O)C=Cc2ccccc2 271570a_100102527694_100000186361 [0,0,0,0,0,0|3,0,1]=4 66 B17R2.193 Cc1cc(ccc1O)CNc2ccccc2 270302a_100000106764_100011215669 [0,0,0,0,0,0|3,0,0]=3 67 B17R2.193 Cc1cc(ccc1O)NCc2ccccc2 270302a_100011218179_100015611070 [0,0,0,0,0,0|4,0,0]=4 68 B17R2.193 Cc1cc(ccc1O)NCc2ccccc2 34a_100011218179_100015291786 [0,0,0,0,0,0|4,0,0]=4 69 B17R2.193 Cc1cc(ccc1O)NCc2ccccc2 7a_100011218179_100000211182 [0,0,0,0,0,0|4,0,0]=4 70 B17R2.193 Cc1cc(ccc1O)OCc2ccccc2 271570a_203496583355_200012047214 [0,0,0,0,0,0|4,0,0]=4 71 B17R2.193 Cc1cc(ccc1O)SCc2ccccc2 62a_100000211182_100000186361 [0,0,0,0,0,0|4,0,0]=4 72 B17R2.193 Cc1cc(ncc1Br)CNc2ccccc2 207a_100000106764_100009814806 [0,0,0,0,0,0|4,0,0]=4 73 B17R2.193 Cc1cc(ncc1O)C#Cc2ccccc2 271570a_100000069678_100000692680 [0,0,0,0,0,0|3,0,1]=4 74 B17R2.193 Cc1cc(ncc1O)C=Cc2ccccc2 271570a_100102527694_100000692680 [0,0,0,0,0,0|3,0,1]=4 75 B17R2.193 Cc1cc(ncc1O)OCc2ccccc2 271570a_203496583355_200012772083 [0,0,0,0,0,0|4,0,0]=4 76 B17R2.193 Cc1cc(ncc1O)SCc2ccccc2 62a_100000211182_100000692680 [0,0,0,0,0,0|4,0,0]=4 77 B17R2.193 Cc1ccc(cc1Br)CNc2ccccc2 207a_100000106764_100000695567 [0,0,0,0,0,0|4,0,0]=4 78 B17R2.193 Cc1ccc(cc1Br)CNc2ccccc2 270302a_100000106764_100000695567 [0,0,0,0,0,0|4,0,0]=4 79 B17R2.193 Cc1ccc(cc1Br)CNc2ccccc2 34a_100000106764_100012232412 [0,0,0,0,0,0|4,0,0]=4 80 B17R2.193 Cc1ccc(cc1Br)COc2ccccc2 34a_100000210340_100012232412 [0,0,0,0,0,0|3,1,0]=4 81 B17R2.193 Cc1ccc(cc1Br)COc2ccccc2 7a_100000210340_100012232412 [0,0,0,0,0,0|3,1,0]=4 82 B17R2.193 Cc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_100012232412 [0,0,0,0,0,0|3,0,0]=3 83 B17R2.193 Cc1ccc(cc1Br)CSc2ccccc2 62a_100012232412_100000041952 [0,0,0,0,0,0|3,0,0]=3 84 B17R2.193 Cc1ccc(cc1Br)CSc2ccccn2 62a_100011216584_100012232412 [0,0,0,0,0,0|4,0,0]=4 85 B17R2.193 Cc1ccc(cc1Br)CSc2ccccn2 62a_100012232412_100011216584 [0,0,0,0,0,0|4,0,0]=4 86 B17R2.193 Cc1ccc(cc1Br)CSc2cccnc2 62a_100000210063_100012232412 [0,0,0,0,0,0|4,0,0]=4 87 B17R2.193 Cc1ccc(cc1Br)CSc2cccnc2 62a_100012232412_100000210063 [0,0,0,0,0,0|4,0,0]=4 88 B17R2.193 Cc1ccc(cc1Br)CSc2ccncc2 62a_100000728582_100012232412 [0,0,0,0,0,0|4,0,0]=4 89 B17R2.193 Cc1ccc(cc1Br)CSc2ccncc2 62a_100012232412_100000728582 [0,0,0,0,0,0|4,0,0]=4 90 B17R2.193 Cc1ccc(cc1C)CNc2ccccc2 207a_100000106764_100000229942 [0,0,0,0,0,0|4,0,0]=4 91 B17R2.193 Cc1ccc(cc1C)CNc2ccccc2 270302a_100000106764_100000229942 [0,0,0,0,0,0|4,0,0]=4 92 B17R2.193 Cc1ccc(cc1C)CNc2ccccc2 34a_100000106764_100000742320 [0,0,0,0,0,0|4,0,0]=4 93 B17R2.193 Cc1ccc(cc1C)COc2ccccc2 34a_100000210340_100000742320 [0,0,0,0,0,0|3,1,0]=4 94 B17R2.193 Cc1ccc(cc1C)COc2ccccc2 7a_100000210340_100000742320 [0,0,0,0,0,0|3,1,0]=4 95 B17R2.193 Cc1ccc(cc1C)CSc2ccccc2 62a_100000719477_100000742320 [0,0,0,0,0,0|3,0,0]=3 96 B17R2.193 Cc1ccc(cc1C)CSc2ccccc2 62a_100000742320_100000041952 [0,0,0,0,0,0|3,0,0]=3 97 B17R2.193 Cc1ccc(cc1C)CSc2ccccn2 62a_100000742320_100011216584 [0,0,0,0,0,0|4,0,0]=4 98 B17R2.193 Cc1ccc(cc1C)CSc2ccccn2 62a_100011216584_100000742320 [0,0,0,0,0,0|4,0,0]=4 99 B17R2.193 Cc1ccc(cc1C)CSc2cccnc2 62a_100000210063_100000742320 [0,0,0,0,0,0|4,0,0]=4 100 B17R2.193 Cc1ccc(cc1C)CSc2cccnc2 62a_100000742320_100000210063 [0,0,0,0,0,0|4,0,0]=4 101 B17R2.193 Cc1ccc(cc1C)CSc2ccncc2 62a_100000728582_100000742320 [0,0,0,0,0,0|4,0,0]=4 102 B17R2.193 Cc1ccc(cc1C)CSc2ccncc2 62a_100000742320_100000728582 [0,0,0,0,0,0|4,0,0]=4 103 B17R2.193 Cc1ccc(cc1Cl)CNc2ccccc2 207a_100000106764_100000760539 [0,0,0,0,0,0|4,0,0]=4 104 B17R2.193 Cc1ccc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000760539 [0,0,0,0,0,0|4,0,0]=4 105 B17R2.193 Cc1ccc(cc1Cl)CNc2ccccc2 34a_100000106764_100011823929 [0,0,0,0,0,0|4,0,0]=4 106 B17R2.193 Cc1ccc(cc1Cl)COc2ccccc2 34a_100000210340_100011823929 [0,0,0,0,0,0|3,1,0]=4 107 B17R2.193 Cc1ccc(cc1Cl)COc2ccccc2 7a_100000210340_100011823929 [0,0,0,0,0,0|3,1,0]=4 108 B17R2.193 Cc1ccc(cc1Cl)CSc2ccccc2 62a_100000719477_100011823929 [0,0,0,0,0,0|3,0,0]=3 109 B17R2.193 Cc1ccc(cc1Cl)CSc2ccccc2 62a_100011823929_100000041952 [0,0,0,0,0,0|3,0,0]=3 110 B17R2.193 Cc1ccc(cc1Cl)CSc2ccccn2 62a_100011216584_100011823929 [0,0,0,0,0,0|4,0,0]=4 111 B17R2.193 Cc1ccc(cc1Cl)CSc2ccccn2 62a_100011823929_100011216584 [0,0,0,0,0,0|4,0,0]=4 112 B17R2.193 Cc1ccc(cc1Cl)CSc2cccnc2 62a_100000210063_100011823929 [0,0,0,0,0,0|4,0,0]=4 113 B17R2.193 Cc1ccc(cc1Cl)CSc2cccnc2 62a_100011823929_100000210063 [0,0,0,0,0,0|4,0,0]=4 114 B17R2.193 Cc1ccc(cc1Cl)CSc2ccncc2 62a_100000728582_100011823929 [0,0,0,0,0,0|4,0,0]=4 115 B17R2.193 Cc1ccc(cc1Cl)CSc2ccncc2 62a_100011823929_100000728582 [0,0,0,0,0,0|4,0,0]=4 116 B17R2.193 Cc1ccc(cc1F)CNc2ccccc2 207a_100000106764_100000753222 [0,0,0,0,0,0|4,0,0]=4 117 B17R2.193 Cc1ccc(cc1F)CNc2ccccc2 270302a_100000106764_100000753222 [0,0,0,0,0,0|4,0,0]=4 118 B17R2.193 Cc1ccc(cc1F)CNc2ccccc2 34a_100000106764_100011217369 [0,0,0,0,0,0|4,0,0]=4 119 B17R2.193 Cc1ccc(cc1F)COc2ccccc2 34a_100000210340_100011217369 [0,0,0,0,0,0|3,1,0]=4 120 B17R2.193 Cc1ccc(cc1F)COc2ccccc2 7a_100000210340_100011217369 [0,0,0,0,0,0|3,1,0]=4 121 B17R2.193 Cc1ccc(cc1F)CSc2ccccc2 62a_100000719477_100011217369 [0,0,0,0,0,0|3,0,0]=3 122 B17R2.193 Cc1ccc(cc1F)CSc2ccccc2 62a_100011217369_100000041952 [0,0,0,0,0,0|3,0,0]=3 123 B17R2.193 Cc1ccc(cc1F)CSc2ccccn2 62a_100011216584_100011217369 [0,0,0,0,0,0|4,0,0]=4 124 B17R2.193 Cc1ccc(cc1F)CSc2ccccn2 62a_100011217369_100011216584 [0,0,0,0,0,0|4,0,0]=4 125 B17R2.193 Cc1ccc(cc1F)CSc2cccnc2 62a_100000210063_100011217369 [0,0,0,0,0,0|4,0,0]=4 126 B17R2.193 Cc1ccc(cc1F)CSc2cccnc2 62a_100011217369_100000210063 [0,0,0,0,0,0|4,0,0]=4 127 B17R2.193 Cc1ccc(cc1F)CSc2ccncc2 62a_100000728582_100011217369 [0,0,0,0,0,0|4,0,0]=4 128 B17R2.193 Cc1ccc(cc1F)CSc2ccncc2 62a_100011217369_100000728582 [0,0,0,0,0,0|4,0,0]=4 129 B17R2.193 Cc1ccc(cc1I)CNc2ccccc2 207a_100000106764_100010197721 [0,0,0,0,0,0|4,0,0]=4 130 B17R2.193 Cc1ccc(cc1I)CNc2ccccc2 270302a_100000106764_100010197721 [0,0,0,0,0,0|4,0,0]=4 131 B17R2.193 Cc1ccc(cc1I)CNc2ccccc2 34a_100000106764_100010206137 [0,0,0,0,0,0|4,0,0]=4 132 B17R2.193 Cc1ccc(cc1I)COc2ccccc2 34a_100000210340_100010206137 [0,0,0,0,0,0|3,1,0]=4 133 B17R2.193 Cc1ccc(cc1I)COc2ccccc2 7a_100000210340_100010206137 [0,0,0,0,0,0|3,1,0]=4 134 B17R2.193 Cc1ccc(cc1I)CSc2ccccc2 62a_100000719477_100010206137 [0,0,0,0,0,0|3,0,0]=3 135 B17R2.193 Cc1ccc(cc1I)CSc2ccccc2 62a_100010206137_100000041952 [0,0,0,0,0,0|3,0,0]=3 136 B17R2.193 Cc1ccc(cc1I)CSc2ccccn2 62a_100010206137_100011216584 [0,0,0,0,0,0|4,0,0]=4 137 B17R2.193 Cc1ccc(cc1I)CSc2ccccn2 62a_100011216584_100010206137 [0,0,0,0,0,0|4,0,0]=4 138 B17R2.193 Cc1ccc(cc1I)CSc2cccnc2 62a_100000210063_100010206137 [0,0,0,0,0,0|4,0,0]=4 139 B17R2.193 Cc1ccc(cc1I)CSc2cccnc2 62a_100010206137_100000210063 [0,0,0,0,0,0|4,0,0]=4 140 B17R2.193 Cc1ccc(cc1I)CSc2ccncc2 62a_100000728582_100010206137 [0,0,0,0,0,0|4,0,0]=4 141 B17R2.193 Cc1ccc(cc1I)CSc2ccncc2 62a_100010206137_100000728582 [0,0,0,0,0,0|4,0,0]=4 142 B17R2.193 Cc1cnc(cc1Br)CNc2ccccc2 207a_100000106764_100010174032 [0,0,0,0,0,0|4,0,0]=4 143 B17R2.193 Clc1cc(ccc1Br)CNc2ccccc2 207a_100000106764_100000690054 [0,0,0,0,0,0|4,0,0]=4 144 B17R2.193 Clc1cc(ccc1Br)CNc2ccccc2 270302a_100000106764_100000690054 [0,0,0,0,0,0|4,0,0]=4 145 B17R2.193 Clc1cc(ccc1Br)CNc2ccccc2 34a_100000106764_100012353895 [0,0,0,0,0,0|4,0,0]=4 146 B17R2.193 Clc1cc(ccc1Br)COc2ccccc2 34a_100000210340_100012353895 [0,0,0,0,0,0|3,1,0]=4 147 B17R2.193 Clc1cc(ccc1Br)COc2ccccc2 7a_100000210340_100012353895 [0,0,0,0,0,0|3,1,0]=4 148 B17R2.193 Clc1cc(ccc1Br)CSc2ccccc2 62a_100000719477_100012353895 [0,0,0,0,0,0|3,0,0]=3 149 B17R2.193 Clc1cc(ccc1Br)CSc2ccccc2 62a_100012353895_100000041952 [0,0,0,0,0,0|3,0,0]=3 150 B17R2.193 Clc1cc(ccc1Br)CSc2ccccn2 62a_100011216584_100012353895 [0,0,0,0,0,0|4,0,0]=4 151 B17R2.193 Clc1cc(ccc1Br)CSc2ccccn2 62a_100012353895_100011216584 [0,0,0,0,0,0|4,0,0]=4 152 B17R2.193 Clc1cc(ccc1Br)CSc2cccnc2 62a_100000210063_100012353895 [0,0,0,0,0,0|4,0,0]=4 153 B17R2.193 Clc1cc(ccc1Br)CSc2cccnc2 62a_100012353895_100000210063 [0,0,0,0,0,0|4,0,0]=4 154 B17R2.193 Clc1cc(ccc1Br)CSc2ccncc2 62a_100000728582_100012353895 [0,0,0,0,0,0|4,0,0]=4 155 B17R2.193 Clc1cc(ccc1Br)CSc2ccncc2 62a_100012353895_100000728582 [0,0,0,0,0,0|4,0,0]=4 156 B17R2.193 Clc1cc(ccc1I)CNc2ccccc2 34a_100000106764_100012349665 [0,0,0,0,0,0|4,0,0]=4 157 B17R2.193 Clc1cc(ccc1I)COc2ccccc2 34a_100000210340_100012349665 [0,0,0,0,0,0|3,1,0]=4 158 B17R2.193 Clc1cc(ccc1I)COc2ccccc2 7a_100000210340_100012349665 [0,0,0,0,0,0|3,1,0]=4 159 B17R2.193 Clc1cc(ccc1I)CSc2ccccc2 62a_100000719477_100012349665 [0,0,0,0,0,0|3,0,0]=3 160 B17R2.193 Clc1cc(ccc1I)CSc2ccccc2 62a_100012349665_100000041952 [0,0,0,0,0,0|3,0,0]=3 161 B17R2.193 Clc1cc(ccc1I)CSc2ccccn2 62a_100011216584_100012349665 [0,0,0,0,0,0|4,0,0]=4 162 B17R2.193 Clc1cc(ccc1I)CSc2ccccn2 62a_100012349665_100011216584 [0,0,0,0,0,0|4,0,0]=4 163 B17R2.193 Clc1cc(ccc1I)CSc2cccnc2 62a_100000210063_100012349665 [0,0,0,0,0,0|4,0,0]=4 164 B17R2.193 Clc1cc(ccc1I)CSc2cccnc2 62a_100012349665_100000210063 [0,0,0,0,0,0|4,0,0]=4 165 B17R2.193 Clc1cc(ccc1I)CSc2ccncc2 62a_100000728582_100012349665 [0,0,0,0,0,0|4,0,0]=4 166 B17R2.193 Clc1cc(ccc1I)CSc2ccncc2 62a_100012349665_100000728582 [0,0,0,0,0,0|4,0,0]=4 167 B17R2.193 Clc1cc(cnc1Cl)CSc2ccccc2 62a_100000719477_100009843750 [0,0,0,0,0,0|4,0,0]=4 168 B17R2.193 Clc1cc(cnc1Cl)CSc2ccccc2 62a_100009843750_100000041952 [0,0,0,0,0,0|4,0,0]=4 169 B17R2.193 Clc1ccc(cc1Br)CNc2ccccc2 207a_100000106764_100000693810 [0,0,0,0,0,0|4,0,0]=4 170 B17R2.193 Clc1ccc(cc1Br)CNc2ccccc2 270302a_100000106764_100000693810 [0,0,0,0,0,0|4,0,0]=4 171 B17R2.193 Clc1ccc(cc1Br)CNc2ccccc2 34a_100000106764_100012353894 [0,0,0,0,0,0|4,0,0]=4 172 B17R2.193 Clc1ccc(cc1Br)COc2ccccc2 34a_100000210340_100012353894 [0,0,0,0,0,0|3,1,0]=4 173 B17R2.193 Clc1ccc(cc1Br)COc2ccccc2 7a_100000210340_100012353894 [0,0,0,0,0,0|3,1,0]=4 174 B17R2.193 Clc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_100012353894 [0,0,0,0,0,0|3,0,0]=3 175 B17R2.193 Clc1ccc(cc1Br)CSc2ccccc2 62a_100012353894_100000041952 [0,0,0,0,0,0|3,0,0]=3 176 B17R2.193 Clc1ccc(cc1Br)CSc2ccccn2 62a_100011216584_100012353894 [0,0,0,0,0,0|4,0,0]=4 177 B17R2.193 Clc1ccc(cc1Br)CSc2ccccn2 62a_100012353894_100011216584 [0,0,0,0,0,0|4,0,0]=4 178 B17R2.193 Clc1ccc(cc1Br)CSc2cccnc2 62a_100000210063_100012353894 [0,0,0,0,0,0|4,0,0]=4 179 B17R2.193 Clc1ccc(cc1Br)CSc2cccnc2 62a_100012353894_100000210063 [0,0,0,0,0,0|4,0,0]=4 180 B17R2.193 Clc1ccc(cc1Br)CSc2ccncc2 62a_100000728582_100012353894 [0,0,0,0,0,0|4,0,0]=4 181 B17R2.193 Clc1ccc(cc1Br)CSc2ccncc2 62a_100012353894_100000728582 [0,0,0,0,0,0|4,0,0]=4 182 B17R2.193 Clc1ccc(cc1Cl)CNc2ccccc2 207a_100000106764_100000188533 [0,0,0,0,0,0|4,0,0]=4 183 B17R2.193 Clc1ccc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000188533 [0,0,0,0,0,0|4,0,0]=4 184 B17R2.193 Clc1ccc(cc1Cl)CNc2ccccc2 34a_100000106764_100000184707 [0,0,0,0,0,0|4,0,0]=4 185 B17R2.193 Clc1ccc(cc1Cl)COc2ccccc2 34a_100000210340_100000184707 [0,0,0,0,0,0|3,1,0]=4 186 B17R2.193 Clc1ccc(cc1Cl)COc2ccccc2 7a_100000210340_100000184707 [0,0,0,0,0,0|3,1,0]=4 187 B17R2.193 Clc1ccc(cc1Cl)CSc2ccccc2 62a_100000184707_100000041952 [0,0,0,0,0,0|3,0,0]=3 188 B17R2.193 Clc1ccc(cc1Cl)CSc2ccccc2 62a_100000719477_100000184707 [0,0,0,0,0,0|3,0,0]=3 189 B17R2.193 Clc1ccc(cc1Cl)CSc2ccccn2 62a_100000184707_100011216584 [0,0,0,0,0,0|4,0,0]=4 190 B17R2.193 Clc1ccc(cc1Cl)CSc2ccccn2 62a_100011216584_100000184707 [0,0,0,0,0,0|4,0,0]=4 191 B17R2.193 Clc1ccc(cc1Cl)CSc2cccnc2 62a_100000184707_100000210063 [0,0,0,0,0,0|4,0,0]=4 192 B17R2.193 Clc1ccc(cc1Cl)CSc2cccnc2 62a_100000210063_100000184707 [0,0,0,0,0,0|4,0,0]=4 193 B17R2.193 Clc1ccc(cc1Cl)CSc2ccncc2 62a_100000184707_100000728582 [0,0,0,0,0,0|4,0,0]=4 194 B17R2.193 Clc1ccc(cc1Cl)CSc2ccncc2 62a_100000728582_100000184707 [0,0,0,0,0,0|4,0,0]=4 195 B17R2.193 Clc1ccc(cc1I)CNc2ccccc2 207a_100000106764_100010209939 [0,0,0,0,0,0|4,0,0]=4 196 B17R2.193 Clc1ncc(cc1I)CSc2ccccc2 62a_100000719477_100011072623 [0,0,0,0,0,0|4,0,0]=4 197 B17R2.193 Clc1ncc(cc1I)CSc2ccccc2 62a_100011072623_100000041952 [0,0,0,0,0,0|4,0,0]=4 198 B17R2.193 Fc1cc(ccc1Br)CNc2ccccc2 207a_100000106764_100000686674 [0,0,0,0,0,0|4,0,0]=4 199 B17R2.193 Fc1cc(ccc1Br)CNc2ccccc2 270302a_100000106764_100000686674 [0,0,0,0,0,0|4,0,0]=4 200 B17R2.193 Fc1cc(ccc1Br)CNc2ccccc2 34a_100000106764_100000767054 [0,0,0,0,0,0|4,0,0]=4 201 B17R2.193 Fc1cc(ccc1Br)COc2ccccc2 34a_100000210340_100000767054 [0,0,0,0,0,0|3,1,0]=4 202 B17R2.193 Fc1cc(ccc1Br)COc2ccccc2 7a_100000210340_100000767054 [0,0,0,0,0,0|3,1,0]=4 203 B17R2.193 Fc1cc(ccc1Br)CSc2ccccc2 62a_100000719477_100000767054 [0,0,0,0,0,0|3,0,0]=3 204 B17R2.193 Fc1cc(ccc1Br)CSc2ccccc2 62a_100000767054_100000041952 [0,0,0,0,0,0|3,0,0]=3 205 B17R2.193 Fc1cc(ccc1Br)CSc2ccccn2 62a_100000767054_100011216584 [0,0,0,0,0,0|4,0,0]=4 206 B17R2.193 Fc1cc(ccc1Br)CSc2ccccn2 62a_100011216584_100000767054 [0,0,0,0,0,0|4,0,0]=4 207 B17R2.193 Fc1cc(ccc1Br)CSc2cccnc2 62a_100000210063_100000767054 [0,0,0,0,0,0|4,0,0]=4 208 B17R2.193 Fc1cc(ccc1Br)CSc2cccnc2 62a_100000767054_100000210063 [0,0,0,0,0,0|4,0,0]=4 209 B17R2.193 Fc1cc(ccc1Br)CSc2ccncc2 62a_100000728582_100000767054 [0,0,0,0,0,0|4,0,0]=4 210 B17R2.193 Fc1cc(ccc1Br)CSc2ccncc2 62a_100000767054_100000728582 [0,0,0,0,0,0|4,0,0]=4 211 B17R2.193 Fc1cc(ccc1Cl)CNc2ccccc2 207a_100000106764_100000745630 [0,0,0,0,0,0|4,0,0]=4 212 B17R2.193 Fc1cc(ccc1Cl)CNc2ccccc2 270302a_100000106764_100000745630 [0,0,0,0,0,0|4,0,0]=4 213 B17R2.193 Fc1cc(ccc1Cl)CNc2ccccc2 34a_100000106764_100011519011 [0,0,0,0,0,0|4,0,0]=4 214 B17R2.193 Fc1cc(ccc1Cl)COc2ccccc2 34a_100000210340_100011519011 [0,0,0,0,0,0|3,1,0]=4 215 B17R2.193 Fc1cc(ccc1Cl)COc2ccccc2 7a_100000210340_100000716492 [0,0,0,0,0,0|3,1,0]=4 216 B17R2.193 Fc1cc(ccc1Cl)CSc2ccccc2 62a_100000716492_100000041952 [0,0,0,0,0,0|3,0,0]=3 217 B17R2.193 Fc1cc(ccc1Cl)CSc2ccccc2 62a_100000719477_100000716492 [0,0,0,0,0,0|3,0,0]=3 218 B17R2.193 Fc1cc(ccc1Cl)CSc2ccccn2 62a_100000716492_100011216584 [0,0,0,0,0,0|4,0,0]=4 219 B17R2.193 Fc1cc(ccc1Cl)CSc2ccccn2 62a_100011216584_100000716492 [0,0,0,0,0,0|4,0,0]=4 220 B17R2.193 Fc1cc(ccc1Cl)CSc2cccnc2 62a_100000210063_100000716492 [0,0,0,0,0,0|4,0,0]=4 221 B17R2.193 Fc1cc(ccc1Cl)CSc2cccnc2 62a_100000716492_100000210063 [0,0,0,0,0,0|4,0,0]=4 222 B17R2.193 Fc1cc(ccc1Cl)CSc2ccncc2 62a_100000716492_100000728582 [0,0,0,0,0,0|4,0,0]=4 223 B17R2.193 Fc1cc(ccc1Cl)CSc2ccncc2 62a_100000728582_100000716492 [0,0,0,0,0,0|4,0,0]=4 224 B17R2.193 Fc1cc(ccc1I)CNc2ccccc2 207a_100000106764_100000050832 [0,0,0,0,0,0|4,0,0]=4 225 B17R2.193 Fc1cc(ccc1I)CNc2ccccc2 34a_100000106764_100010149604 [0,0,0,0,0,0|4,0,0]=4 226 B17R2.193 Fc1cc(ccc1I)COc2ccccc2 34a_100000210340_100010149604 [0,0,0,0,0,0|3,1,0]=4 227 B17R2.193 Fc1cc(ccc1I)COc2ccccc2 7a_100000210340_100010149604 [0,0,0,0,0,0|3,1,0]=4 228 B17R2.193 Fc1cc(ccc1I)CSc2ccccc2 62a_100000719477_100010149604 [0,0,0,0,0,0|3,0,0]=3 229 B17R2.193 Fc1cc(ccc1I)CSc2ccccc2 62a_100010149604_100000041952 [0,0,0,0,0,0|3,0,0]=3 230 B17R2.193 Fc1cc(ccc1I)CSc2ccccn2 62a_100010149604_100011216584 [0,0,0,0,0,0|4,0,0]=4 231 B17R2.193 Fc1cc(ccc1I)CSc2ccccn2 62a_100011216584_100010149604 [0,0,0,0,0,0|4,0,0]=4 232 B17R2.193 Fc1cc(ccc1I)CSc2cccnc2 62a_100000210063_100010149604 [0,0,0,0,0,0|4,0,0]=4 233 B17R2.193 Fc1cc(ccc1I)CSc2cccnc2 62a_100010149604_100000210063 [0,0,0,0,0,0|4,0,0]=4 234 B17R2.193 Fc1cc(ccc1I)CSc2ccncc2 62a_100000728582_100010149604 [0,0,0,0,0,0|4,0,0]=4 235 B17R2.193 Fc1cc(ccc1I)CSc2ccncc2 62a_100010149604_100000728582 [0,0,0,0,0,0|4,0,0]=4 236 B17R2.193 Fc1ccc(cc1Br)CNc2ccccc2 207a_100000106764_100000211747 [0,0,0,0,0,0|4,0,0]=4 237 B17R2.193 Fc1ccc(cc1Br)CNc2ccccc2 270302a_100000106764_100000211747 [0,0,0,0,0,0|4,0,0]=4 238 B17R2.193 Fc1ccc(cc1Br)CNc2ccccc2 34a_100000106764_100011206884 [0,0,0,0,0,0|4,0,0]=4 239 B17R2.193 Fc1ccc(cc1Br)COc2ccccc2 34a_100000210340_100011206884 [0,0,0,0,0,0|3,1,0]=4 240 B17R2.193 Fc1ccc(cc1Br)COc2ccccc2 7a_100000210340_100011206884 [0,0,0,0,0,0|3,1,0]=4 241 B17R2.193 Fc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_100011206884 [0,0,0,0,0,0|3,0,0]=3 242 B17R2.193 Fc1ccc(cc1Br)CSc2ccccc2 62a_100011206884_100000041952 [0,0,0,0,0,0|3,0,0]=3 243 B17R2.193 Fc1ccc(cc1Br)CSc2ccccn2 62a_100011206884_100011216584 [0,0,0,0,0,0|4,0,0]=4 244 B17R2.193 Fc1ccc(cc1Br)CSc2ccccn2 62a_100011216584_100011206884 [0,0,0,0,0,0|4,0,0]=4 245 B17R2.193 Fc1ccc(cc1Br)CSc2cccnc2 62a_100000210063_100011206884 [0,0,0,0,0,0|4,0,0]=4 246 B17R2.193 Fc1ccc(cc1Br)CSc2cccnc2 62a_100011206884_100000210063 [0,0,0,0,0,0|4,0,0]=4 247 B17R2.193 Fc1ccc(cc1Br)CSc2ccncc2 62a_100000728582_100011206884 [0,0,0,0,0,0|4,0,0]=4 248 B17R2.193 Fc1ccc(cc1Br)CSc2ccncc2 62a_100011206884_100000728582 [0,0,0,0,0,0|4,0,0]=4 249 B17R2.193 Fc1ccc(cc1Cl)CNc2ccccc2 207a_100000106764_100000742290 [0,0,0,0,0,0|4,0,0]=4 250 B17R2.193 Fc1ccc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000742290 [0,0,0,0,0,0|4,0,0]=4 251 B17R2.193 Fc1ccc(cc1Cl)CNc2ccccc2 34a_100000106764_100011934319 [0,0,0,0,0,0|4,0,0]=4 252 B17R2.193 Fc1ccc(cc1Cl)COc2ccccc2 34a_100000210340_100011934319 [0,0,0,0,0,0|3,1,0]=4 253 B17R2.193 Fc1ccc(cc1Cl)COc2ccccc2 7a_100000210340_100000717365 [0,0,0,0,0,0|3,1,0]=4 254 B17R2.193 Fc1ccc(cc1Cl)CSc2ccccc2 62a_100000717365_100000041952 [0,0,0,0,0,0|3,0,0]=3 255 B17R2.193 Fc1ccc(cc1Cl)CSc2ccccc2 62a_100000719477_100011934319 [0,0,0,0,0,0|3,0,0]=3 256 B17R2.193 Fc1ccc(cc1Cl)CSc2ccccn2 62a_100000717365_100011216584 [0,0,0,0,0,0|4,0,0]=4 257 B17R2.193 Fc1ccc(cc1Cl)CSc2ccccn2 62a_100011216584_100011934319 [0,0,0,0,0,0|4,0,0]=4 258 B17R2.193 Fc1ccc(cc1Cl)CSc2cccnc2 62a_100000210063_100011934319 [0,0,0,0,0,0|4,0,0]=4 259 B17R2.193 Fc1ccc(cc1Cl)CSc2cccnc2 62a_100000717365_100000210063 [0,0,0,0,0,0|4,0,0]=4 260 B17R2.193 Fc1ccc(cc1Cl)CSc2ccncc2 62a_100000717365_100000728582 [0,0,0,0,0,0|4,0,0]=4 261 B17R2.193 Fc1ccc(cc1Cl)CSc2ccncc2 62a_100000728582_100011934319 [0,0,0,0,0,0|4,0,0]=4 262 B17R2.193 Fc1ccc(cc1F)CNc2ccccc2 207a_100000106764_100000211062 [0,0,0,0,0,0|4,0,0]=4 263 B17R2.193 Fc1ccc(cc1F)CNc2ccccc2 270302a_100000106764_100000211062 [0,0,0,0,0,0|4,0,0]=4 264 B17R2.193 Fc1ccc(cc1F)CNc2ccccc2 34a_100000106764_100000757363 [0,0,0,0,0,0|4,0,0]=4 265 B17R2.193 Fc1ccc(cc1F)COc2ccccc2 34a_100000210340_100000757363 [0,0,0,0,0,0|3,1,0]=4 266 B17R2.193 Fc1ccc(cc1F)COc2ccccc2 7a_100000210340_100000757363 [0,0,0,0,0,0|3,1,0]=4 267 B17R2.193 Fc1ccc(cc1F)CSc2ccccc2 62a_100000719477_100000757363 [0,0,0,0,0,0|3,0,0]=3 268 B17R2.193 Fc1ccc(cc1F)CSc2ccccc2 62a_100000757363_100000041952 [0,0,0,0,0,0|3,0,0]=3 269 B17R2.193 Fc1ccc(cc1F)CSc2ccccn2 62a_100000757363_100011216584 [0,0,0,0,0,0|4,0,0]=4 270 B17R2.193 Fc1ccc(cc1F)CSc2ccccn2 62a_100011216584_100000757363 [0,0,0,0,0,0|4,0,0]=4 271 B17R2.193 Fc1ccc(cc1F)CSc2cccnc2 62a_100000210063_100000757363 [0,0,0,0,0,0|4,0,0]=4 272 B17R2.193 Fc1ccc(cc1F)CSc2cccnc2 62a_100000757363_100000210063 [0,0,0,0,0,0|4,0,0]=4 273 B17R2.193 Fc1ccc(cc1F)CSc2ccncc2 62a_100000728582_100000757363 [0,0,0,0,0,0|4,0,0]=4 274 B17R2.193 Fc1ccc(cc1F)CSc2ccncc2 62a_100000757363_100000728582 [0,0,0,0,0,0|4,0,0]=4 275 B17R2.193 Fc1ccc(cc1I)CNc2ccccc2 207a_100000106764_100010188209 [0,0,0,0,0,0|4,0,0]=4 276 B17R2.193 Fc1ccc(cc1I)CNc2ccccc2 34a_100000106764_100010188208 [0,0,0,0,0,0|4,0,0]=4 277 B17R2.193 Fc1ccc(cc1I)COc2ccccc2 34a_100000210340_100010188208 [0,0,0,0,0,0|3,1,0]=4 278 B17R2.193 Fc1ccc(cc1I)COc2ccccc2 7a_100000210340_100010188208 [0,0,0,0,0,0|3,1,0]=4 279 B17R2.193 Fc1ccc(cc1I)CSc2ccccc2 62a_100000719477_100010188208 [0,0,0,0,0,0|3,0,0]=3 280 B17R2.193 Fc1ccc(cc1I)CSc2ccccc2 62a_100010188208_100000041952 [0,0,0,0,0,0|3,0,0]=3 281 B17R2.193 Fc1ccc(cc1I)CSc2ccccn2 62a_100010188208_100011216584 [0,0,0,0,0,0|4,0,0]=4 282 B17R2.193 Fc1ccc(cc1I)CSc2ccccn2 62a_100011216584_100010188208 [0,0,0,0,0,0|4,0,0]=4 283 B17R2.193 Fc1ccc(cc1I)CSc2cccnc2 62a_100000210063_100010188208 [0,0,0,0,0,0|4,0,0]=4 284 B17R2.193 Fc1ccc(cc1I)CSc2cccnc2 62a_100010188208_100000210063 [0,0,0,0,0,0|4,0,0]=4 285 B17R2.193 Fc1ccc(cc1I)CSc2ccncc2 62a_100000728582_100010188208 [0,0,0,0,0,0|4,0,0]=4 286 B17R2.193 Fc1ccc(cc1I)CSc2ccncc2 62a_100010188208_100000728582 [0,0,0,0,0,0|4,0,0]=4 287 B17R2.193 Fc1ncc(cc1Br)CSc2ccccc2 62a_100000719477_200010066439 [0,0,0,0,0,0|4,0,0]=4 288 B17R2.193 Fc1ncc(cc1Br)CSc2ccccc2 62a_200010066439_100000041952 [0,0,0,0,0,0|4,0,0]=4 289 B17R2.193 Nc1cc(ccc1O)C#Cc2ccccc2 271570a_100000069678_100000752626 [0,0,0,0,0,0|3,0,1]=4 290 B17R2.193 Nc1cc(ccc1O)C=Cc2ccccc2 271570a_100102527694_100000752626 [0,0,0,0,0,0|3,0,1]=4 291 B17R2.193 Nc1cc(ccc1O)SCc2ccccc2 62a_100000211182_100000752626 [0,0,0,0,0,0|4,0,0]=4 292 B17R2.193 Nc1cc(ccc1O)SCc2ccccc2 62a_100000752626_100015291786 [0,0,0,0,0,0|4,0,0]=4 293 B17R2.193 Nc1cc(ncc1O)C#Cc2ccccc2 271570a_100000069678_100009819941 [0,0,0,0,0,0|3,0,1]=4 294 B17R2.193 Nc1cc(ncc1O)C=Cc2ccccc2 271570a_100102527694_100009819941 [0,0,0,0,0,0|3,0,1]=4 295 B17R2.193 Nc1cc(ncc1O)SCc2ccccc2 62a_100000211182_100009819941 [0,0,0,0,0,0|4,0,0]=4 296 B17R2.193 Nc1cc(ncc1O)SCc2ccccc2 62a_100009819941_100015291786 [0,0,0,0,0,0|4,0,0]=4 297 B17R2.193 O=c1cc(occ1O)COc2ccccc2 7a_100000210340_100000010605 [0,0,0,0,0,0|0,1,0]=1 298 B17R2.193 O=c1cc(occ1O)COc2cccnc2 7a_100000210849_100000010605 [0,0,0,0,0,0|1,1,0]=2 299 B17R2.193 O=c1cc(occ1O)COc2cncnc2 7a_100000754086_100000010605 [0,0,0,0,0,0|2,1,0]=3 300 B17R2.193 O=c1cc(occ1O)CSC2C=CCCC2 62a_100000751183_100000010605 [0,0,0,0,0,0|0,0,4]=4 301 B17R2.193 O=c1cc(occ1O)CSc2ccccc2 62a_100000719477_100000010605 [0,0,0,0,0,0|0,0,0]=0 302 B17R2.193 O=c1cc(occ1O)CSc2ccccn2 62a_100011216584_100000010605 [0,0,0,0,0,0|1,0,0]=1 303 B17R2.193 O=c1cc(occ1O)CSc2cccnc2 62a_100000210063_100000010605 [0,0,0,0,0,0|1,0,0]=1 304 B17R2.193 O=c1cc(occ1O)CSc2cccnn2 62a_100016991348_100000010605 [0,0,0,0,0,0|2,0,0]=2 305 B17R2.193 O=c1cc(occ1O)CSc2ccncc2 62a_100000728582_100000010605 [0,0,0,0,0,0|1,0,0]=1 306 B17R2.193 O=c1cc(occ1O)CSc2ccncn2 62a_100000703185_100000010605 [0,0,0,0,0,0|2,0,0]=2 307 B17R2.193 O=c1cc(occ1O)CSc2ccnnc2 62a_100000732662_100000010605 [0,0,0,0,0,0|2,0,0]=2 308 B17R2.193 O=c1cc(occ1O)CSc2cnccn2 62a_100000211759_100000010605 [0,0,0,0,0,0|2,0,0]=2 309 B17R2.193 O=c1cc(occ1O)CSc2cncnc2 62a_100011206942_100000010605 [0,0,0,0,0,0|2,0,0]=2 310 B17R2.193 O=c1cc(occ1O)CSc2cnnnc2 62a_100009846058_100000010605 [0,0,0,0,0,0|3,0,0]=3 311 B17R2.193 O=c1cc(occ1O)CSc2ncccn2 62a_100000211032_100000010605 [0,0,0,0,0,0|2,0,0]=2 312 B17R2.193 Oc1ccc(cc1Br)C#Cc2ccccc2 271570a_100000069678_100012361655 [0,0,0,0,0,0|3,0,1]=4 313 B17R2.193 Oc1ccc(cc1Br)C=Cc2ccccc2 271570a_100102527694_100012361655 [0,0,0,0,0,0|3,0,1]=4 314 B17R2.193 Oc1ccc(cc1Br)NCc2ccccc2 270302a_100011534360_100015611070 [0,0,0,0,0,0|4,0,0]=4 315 B17R2.193 Oc1ccc(cc1Br)NCc2ccccc2 34a_100011534360_100015291786 [0,0,0,0,0,0|4,0,0]=4 316 B17R2.193 Oc1ccc(cc1Br)SCc2ccccc2 62a_100000211182_100012361655 [0,0,0,0,0,0|4,0,0]=4 317 B17R2.193 Oc1ccc(cc1Br)SCc2ccccc2 62a_100012361655_100015291786 [0,0,0,0,0,0|4,0,0]=4 318 B17R2.193 Oc1ccc(cc1Cl)C#Cc2ccccc2 271570a_100000069678_100012360047 [0,0,0,0,0,0|3,0,1]=4 319 B17R2.193 Oc1ccc(cc1Cl)C=Cc2ccccc2 271570a_100102527694_100012360047 [0,0,0,0,0,0|3,0,1]=4 320 B17R2.193 Oc1ccc(cc1Cl)NCc2ccccc2 270302a_100000744943_100015611070 [0,0,0,0,0,0|4,0,0]=4 321 B17R2.193 Oc1ccc(cc1Cl)NCc2ccccc2 34a_100000744943_100015291786 [0,0,0,0,0,0|4,0,0]=4 322 B17R2.193 Oc1ccc(cc1Cl)SCc2ccccc2 62a_100000211182_100012360047 [0,0,0,0,0,0|4,0,0]=4 323 B17R2.193 Oc1ccc(cc1Cl)SCc2ccccc2 62a_100012360047_100015291786 [0,0,0,0,0,0|4,0,0]=4 324 B17R2.193 Oc1ccc(cc1F)C#Cc2ccccc2 271570a_100000069678_100000185481 [0,0,0,0,0,0|3,0,1]=4 325 B17R2.193 Oc1ccc(cc1F)C=Cc2ccccc2 271570a_100102527694_100000185481 [0,0,0,0,0,0|3,0,1]=4 326 B17R2.193 Oc1ccc(cc1F)NCc2ccccc2 270302a_100011220035_100015611070 [0,0,0,0,0,0|4,0,0]=4 327 B17R2.193 Oc1ccc(cc1F)NCc2ccccc2 34a_100011220035_100015291786 [0,0,0,0,0,0|4,0,0]=4 328 B17R2.193 Oc1ccc(cc1F)NCc2ccccc2 7a_100011220035_100000211182 [0,0,0,0,0,0|4,0,0]=4 329 B17R2.193 Oc1ccc(cc1F)OCc2ccccc2 271570a_203496583355_200011830418 [0,0,0,0,0,0|4,0,0]=4 330 B17R2.193 Oc1ccc(cc1F)SCc2ccccc2 62a_100000185481_100015291786 [0,0,0,0,0,0|4,0,0]=4 331 B17R2.193 Oc1ccc(cc1F)SCc2ccccc2 62a_100000211182_100000185481 [0,0,0,0,0,0|4,0,0]=4 332 B17R2.193 Oc1ccc(cc1O)C#Cc2ccccc2 271570a_100000069678_100009813601 [0,0,0,0,0,0|2,0,2]=4 333 B17R2.193 Oc1ccc(cc1O)C=Cc2ccccc2 271570a_100102527694_100009813601 [0,0,0,0,0,0|2,0,2]=4 334 B17R2.193 Oc1ccc(cc1O)NCc2ccccc2 34a_100102946323_100015291786 [0,0,0,0,0,0|3,0,1]=4 335 B17R2.193 Oc1ccc(cc1O)OCc2ccccc2 271570a_203496583355_100010285348 [0,0,0,0,0,0|3,0,1]=4 336 B17R2.193 Oc1ccc(cc1O)SCc2ccccc2 62a_100000211182_100009813601 [0,0,0,0,0,0|3,0,1]=4 337 B17R2.193 Oc1ncc(cc1Br)CNc2ccccc2 207a_100000106764_100010064886 [0,0,0,0,0,0|4,0,0]=4 338 B17R2.193 Oc1ncc(cc1Br)CNc2ccccc2 270302a_100000106764_100010064886 [0,0,0,0,0,0|4,0,0]=4 339 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000186029 [1,0,0,0,0,0|3,0,0]=4 340 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000186029 [1,0,0,0,0,0|3,0,0]=4 341 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189115 [1,0,0,0,0,0|3,0,0]=4 342 B16R2.132 Brc1ccc(cc1)COc2ccccc2 34a_100000210340_100000189115 [1,0,0,0,0,0|2,1,0]=4 343 B16R2.132 Brc1ccc(cc1)COc2ccccc2 7a_100000210340_100011217064 [1,0,0,0,0,0|2,1,0]=4 344 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000189115_100000041952 [1,0,0,0,0,0|2,0,0]=3 345 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189115 [1,0,0,0,0,0|2,0,0]=3 346 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100000189115_100011216584 [1,0,0,0,0,0|3,0,0]=4 347 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189115 [1,0,0,0,0,0|3,0,0]=4 348 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000189115_100000210063 [1,0,0,0,0,0|3,0,0]=4 349 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189115 [1,0,0,0,0,0|3,0,0]=4 350 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000189115_100000728582 [1,0,0,0,0,0|3,0,0]=4 351 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189115 [1,0,0,0,0,0|3,0,0]=4 352 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100000719477_100009831999 [1,0,0,0,0,0|3,0,0]=4 353 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100009831999_100000041952 [1,0,0,0,0,0|3,0,0]=4 354 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000754260 [1,0,0,0,0,0|3,0,0]=4 355 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100000754260 [1,0,0,0,0,0|3,0,0]=4 356 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000702658 [1,0,0,0,0,0|3,0,0]=4 357 B16R2.132 Brc1ccc(nc1)COc2ccccc2 34a_100000210340_100000702658 [1,0,0,0,0,0|2,1,0]=4 358 B16R2.132 Brc1ccc(nc1)COc2ccccc2 7a_100000210340_100000702658 [1,0,0,0,0,0|2,1,0]=4 359 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000702658_100000041952 [1,0,0,0,0,0|2,0,0]=3 360 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000702658 [1,0,0,0,0,0|2,0,0]=3 361 B16R2.132 Brc1ccc(nc1)CSc2ccccn2 62a_100000702658_100011216584 [1,0,0,0,0,0|3,0,0]=4 362 B16R2.132 Brc1ccc(nc1)CSc2ccccn2 62a_100011216584_100000702658 [1,0,0,0,0,0|3,0,0]=4 363 B16R2.132 Brc1ccc(nc1)CSc2cccnc2 62a_100000210063_100000702658 [1,0,0,0,0,0|3,0,0]=4 364 B16R2.132 Brc1ccc(nc1)CSc2cccnc2 62a_100000702658_100000210063 [1,0,0,0,0,0|3,0,0]=4 365 B16R2.132 Brc1ccc(nc1)CSc2ccncc2 62a_100000702658_100000728582 [1,0,0,0,0,0|3,0,0]=4 366 B16R2.132 Brc1ccc(nc1)CSc2ccncc2 62a_100000728582_100000702658 [1,0,0,0,0,0|3,0,0]=4 367 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100000719477_100010064664 [1,0,0,0,0,0|3,0,0]=4 368 B16R2.132 Brc1cnc(nc1)CSc2ccccc2 62a_100010064664_100000041952 [1,0,0,0,0,0|3,0,0]=4 369 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000211033 [1,0,0,0,0,0|3,0,0]=4 370 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000211033 [1,0,0,0,0,0|3,0,0]=4 371 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000210814 [1,0,0,0,0,0|3,0,0]=4 372 B16R2.132 Cc1ccc(cc1)COc2ccccc2 34a_100000210340_100000210814 [1,0,0,0,0,0|2,1,0]=4 373 B16R2.132 Cc1ccc(cc1)COc2ccccc2 7a_100000210340_100000210814 [1,0,0,0,0,0|2,1,0]=4 374 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000210814_100000041952 [1,0,0,0,0,0|2,0,0]=3 375 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000210814 [1,0,0,0,0,0|2,0,0]=3 376 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100000210814_100011216584 [1,0,0,0,0,0|3,0,0]=4 377 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000210814 [1,0,0,0,0,0|3,0,0]=4 378 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000210814 [1,0,0,0,0,0|3,0,0]=4 379 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210814_100000210063 [1,0,0,0,0,0|3,0,0]=4 380 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000210814_100000728582 [1,0,0,0,0,0|3,0,0]=4 381 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000210814 [1,0,0,0,0,0|3,0,0]=4 382 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100000719477_100016987292 [1,0,0,0,0,0|3,0,0]=4 383 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100016987292_100000041952 [1,0,0,0,0,0|3,0,0]=4 384 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000050478 [1,0,0,0,0,0|3,0,0]=4 385 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000691093 [1,0,0,0,0,0|3,0,0]=4 386 B16R2.132 Cc1ccc(nc1)COc2ccccc2 34a_100000210340_100000691093 [1,0,0,0,0,0|2,1,0]=4 387 B16R2.132 Cc1ccc(nc1)COc2ccccc2 7a_100000210340_100000691093 [1,0,0,0,0,0|2,1,0]=4 388 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000691093_100000041952 [1,0,0,0,0,0|2,0,0]=3 389 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000691093 [1,0,0,0,0,0|2,0,0]=3 390 B16R2.132 Cc1ccc(nc1)CSc2ccccn2 62a_100000691093_100011216584 [1,0,0,0,0,0|3,0,0]=4 391 B16R2.132 Cc1ccc(nc1)CSc2ccccn2 62a_100011216584_100000691093 [1,0,0,0,0,0|3,0,0]=4 392 B16R2.132 Cc1ccc(nc1)CSc2cccnc2 62a_100000210063_100000691093 [1,0,0,0,0,0|3,0,0]=4 393 B16R2.132 Cc1ccc(nc1)CSc2cccnc2 62a_100000691093_100000210063 [1,0,0,0,0,0|3,0,0]=4 394 B16R2.132 Cc1ccc(nc1)CSc2ccncc2 62a_100000691093_100000728582 [1,0,0,0,0,0|3,0,0]=4 395 B16R2.132 Cc1ccc(nc1)CSc2ccncc2 62a_100000728582_100000691093 [1,0,0,0,0,0|3,0,0]=4 396 B16R2.132 Cc1cnc(cn1)CSc2ccccc2 62a_100000719477_100000752025 [1,0,0,0,0,0|3,0,0]=4 397 B16R2.132 Cc1cnc(cn1)CSc2ccccc2 62a_100000752025_100000041952 [1,0,0,0,0,0|3,0,0]=4 398 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000685645_100000041952 [1,0,0,0,0,0|3,0,0]=4 399 B16R2.132 Cc1cnc(nc1)CSc2ccccc2 62a_100000719477_100000685645 [1,0,0,0,0,0|3,0,0]=4 400 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000189385 [1,0,0,0,0,0|3,0,0]=4 401 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000189385 [1,0,0,0,0,0|3,0,0]=4 402 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000694040 [1,0,0,0,0,0|3,0,0]=4 403 B16R2.132 Clc1ccc(cc1)COc2ccccc2 34a_100000210340_100000694040 [1,0,0,0,0,0|2,1,0]=4 404 B16R2.132 Clc1ccc(cc1)COc2ccccc2 7a_100000210340_100000187161 [1,0,0,0,0,0|2,1,0]=4 405 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000187161_100000041952 [1,0,0,0,0,0|2,0,0]=3 406 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187161 [1,0,0,0,0,0|2,0,0]=3 407 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100000187161_100011216584 [1,0,0,0,0,0|3,0,0]=4 408 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187161 [1,0,0,0,0,0|3,0,0]=4 409 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000187161_100000210063 [1,0,0,0,0,0|3,0,0]=4 410 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187161 [1,0,0,0,0,0|3,0,0]=4 411 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000187161_100000728582 [1,0,0,0,0,0|3,0,0]=4 412 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187161 [1,0,0,0,0,0|3,0,0]=4 413 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000735431 [1,0,0,0,0,0|3,0,0]=4 414 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000735431_100000041952 [1,0,0,0,0,0|3,0,0]=4 415 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011361569 [1,0,0,0,0,0|3,0,0]=4 416 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100011361569 [1,0,0,0,0,0|3,0,0]=4 417 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 34a_100000106764_100012066911 [1,0,0,0,0,0|3,0,0]=4 418 B16R2.132 Clc1ccc(nc1)COc2ccccc2 34a_100000210340_100012066911 [1,0,0,0,0,0|2,1,0]=4 419 B16R2.132 Clc1ccc(nc1)COc2ccccc2 7a_100000210340_100012066911 [1,0,0,0,0,0|2,1,0]=4 420 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000697101 [1,0,0,0,0,0|2,0,0]=3 421 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100012066911_100000041952 [1,0,0,0,0,0|2,0,0]=3 422 B16R2.132 Clc1ccc(nc1)CSc2ccccn2 62a_100011216584_100000697101 [1,0,0,0,0,0|3,0,0]=4 423 B16R2.132 Clc1ccc(nc1)CSc2ccccn2 62a_100012066911_100011216584 [1,0,0,0,0,0|3,0,0]=4 424 B16R2.132 Clc1ccc(nc1)CSc2cccnc2 62a_100000210063_100000697101 [1,0,0,0,0,0|3,0,0]=4 425 B16R2.132 Clc1ccc(nc1)CSc2cccnc2 62a_100012066911_100000210063 [1,0,0,0,0,0|3,0,0]=4 426 B16R2.132 Clc1ccc(nc1)CSc2ccncc2 62a_100000728582_100000697101 [1,0,0,0,0,0|3,0,0]=4 427 B16R2.132 Clc1ccc(nc1)CSc2ccncc2 62a_100012066911_100000728582 [1,0,0,0,0,0|3,0,0]=4 428 B16R2.132 Clc1ccc(nn1)CSc2ccccc2 62a_100000719477_100016992710 [1,0,0,0,0,0|3,0,0]=4 429 B16R2.132 Clc1ccc(nn1)CSc2ccccc2 62a_100016992710_100000041952 [1,0,0,0,0,0|3,0,0]=4 430 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000210084 [1,0,0,0,0,0|3,0,0]=4 431 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000210084 [1,0,0,0,0,0|3,0,0]=4 432 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000198546 [1,0,0,0,0,0|3,0,0]=4 433 B16R2.132 Fc1ccc(cc1)COc2ccccc2 34a_100000210340_100000198546 [1,0,0,0,0,0|2,1,0]=4 434 B16R2.132 Fc1ccc(cc1)COc2ccccc2 7a_100000210340_100000198546 [1,0,0,0,0,0|2,1,0]=4 435 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000198546_100000041952 [1,0,0,0,0,0|2,0,0]=3 436 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187164 [1,0,0,0,0,0|2,0,0]=3 437 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100000198546_100011216584 [1,0,0,0,0,0|3,0,0]=4 438 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187164 [1,0,0,0,0,0|3,0,0]=4 439 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000198546_100000210063 [1,0,0,0,0,0|3,0,0]=4 440 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187164 [1,0,0,0,0,0|3,0,0]=4 441 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000198546_100000728582 [1,0,0,0,0,0|3,0,0]=4 442 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187164 [1,0,0,0,0,0|3,0,0]=4 443 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000099788 [1,0,0,0,0,0|3,0,0]=4 444 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100009820150_100000041952 [1,0,0,0,0,0|3,0,0]=4 445 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011934744 [1,0,0,0,0,0|3,0,0]=4 446 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000703193 [1,0,0,0,0,0|3,0,0]=4 447 B16R2.132 Fc1ccc(nc1)COc2ccccc2 34a_100000210340_100000703193 [1,0,0,0,0,0|2,1,0]=4 448 B16R2.132 Fc1ccc(nc1)COc2ccccc2 7a_100000210340_100000703193 [1,0,0,0,0,0|2,1,0]=4 449 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000703193_100000041952 [1,0,0,0,0,0|2,0,0]=3 450 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000703193 [1,0,0,0,0,0|2,0,0]=3 451 B16R2.132 Fc1ccc(nc1)CSc2ccccn2 62a_100000703193_100011216584 [1,0,0,0,0,0|3,0,0]=4 452 B16R2.132 Fc1ccc(nc1)CSc2ccccn2 62a_100011216584_100000703193 [1,0,0,0,0,0|3,0,0]=4 453 B16R2.132 Fc1ccc(nc1)CSc2cccnc2 62a_100000210063_100000703193 [1,0,0,0,0,0|3,0,0]=4 454 B16R2.132 Fc1ccc(nc1)CSc2cccnc2 62a_100000703193_100000210063 [1,0,0,0,0,0|3,0,0]=4 455 B16R2.132 Fc1ccc(nc1)CSc2ccncc2 62a_100000703193_100000728582 [1,0,0,0,0,0|3,0,0]=4 456 B16R2.132 Fc1ccc(nc1)CSc2ccncc2 62a_100000728582_100000703193 [1,0,0,0,0,0|3,0,0]=4 457 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 207a_100000106764_100000188517 [1,0,0,0,0,0|3,0,0]=4 458 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000188517 [1,0,0,0,0,0|3,0,0]=4 459 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189116 [1,0,0,0,0,0|3,0,0]=4 460 B16R2.132 Ic1ccc(cc1)COc2ccccc2 34a_100000210340_100000189116 [1,0,0,0,0,0|2,1,0]=4 461 B16R2.132 Ic1ccc(cc1)COc2ccccc2 7a_100000210340_100000189116 [1,0,0,0,0,0|2,1,0]=4 462 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000189116_100000041952 [1,0,0,0,0,0|2,0,0]=3 463 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189116 [1,0,0,0,0,0|2,0,0]=3 464 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100000189116_100011216584 [1,0,0,0,0,0|3,0,0]=4 465 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189116 [1,0,0,0,0,0|3,0,0]=4 466 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000189116_100000210063 [1,0,0,0,0,0|3,0,0]=4 467 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189116 [1,0,0,0,0,0|3,0,0]=4 468 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000189116_100000728582 [1,0,0,0,0,0|3,0,0]=4 469 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189116 [1,0,0,0,0,0|3,0,0]=4 470 B16R2.132 Oc1ccc(cc1)/C=C/c2ccccc2 271570a_203496583355_100016990502 [1,0,0,0,0,0|2,0,1]=4 471 B16R2.132 Oc1ccc(cc1)/N=N/c2ccccc2 271570a_203496583355_100029724385 [1,0,0,0,0,0|3,0,0]=4 472 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000185759 [1,0,0,0,0,0|2,0,1]=4 473 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_203496583355_100010000412 [1,0,0,0,0,0|2,0,1]=4 474 B16R2.132 Oc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000185759 [1,0,0,0,0,0|2,0,1]=4 475 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 270302a_100000185829_100015611070 [1,0,0,0,0,0|3,0,0]=4 476 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 271570a_203496583355_100000187040 [1,0,0,0,0,0|3,0,0]=4 477 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 34a_100000185829_100015291786 [1,0,0,0,0,0|3,0,0]=4 478 B16R2.132 Oc1ccc(cc1)OCc2ccccc2 271570a_203496583355_100000151783 [1,0,0,0,0,0|3,0,0]=4 479 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 271570a_203496583355_100009811532 [1,0,0,0,0,0|3,0,0]=4 480 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000185759 [1,0,0,0,0,0|3,0,0]=4 481 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 207a_100000106764_100011361521 [1,0,0,0,0,0|3,0,0]=4 482 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100011361521 [1,0,0,0,0,0|3,0,0]=4 483 B16R2.132 Oc1ccc(nc1)C#Cc2ccccc2 271570a_100000069678_100000685995 [1,0,0,0,0,0|2,0,1]=4 484 B16R2.132 Oc1ccc(nc1)C=Cc2ccccc2 271570a_100102527694_100000685995 [1,0,0,0,0,0|2,0,1]=4 485 B16R2.132 Oc1ccc(nc1)NCc2ccccc2 271570a_203496583355_200000239955 [1,0,0,0,0,0|3,0,0]=4 486 B16R2.132 Oc1ccc(nc1)OCc2ccccc2 271570a_203496583355_100011465491 [1,0,0,0,0,0|3,0,0]=4 487 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000744096 [1,0,0,0,0,0|3,0,0]=4 488 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000685995_100015291786 [1,0,0,0,0,0|3,0,0]=4 489 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100000719477_100010243470 [1,0,0,0,0,0|3,0,0]=4 490 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100010254460_100000041952 [1,0,0,0,0,0|3,0,0]=4 491 B16R2.252 Brc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210085 [1,0,0,0,0,0|3,0,0]=4 492 B16R2.252 Brc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210085 [1,0,0,0,0,0|3,0,0]=4 493 B16R2.252 Brc1cccc(c1)CNc2ccccc2 34a_100000106764_100000698116 [1,0,0,0,0,0|3,0,0]=4 494 B16R2.252 Brc1cccc(c1)COc2ccccc2 34a_100000210340_100000698116 [1,0,0,0,0,0|2,1,0]=4 495 B16R2.252 Brc1cccc(c1)COc2ccccc2 7a_100000210340_100000211773 [1,0,0,0,0,0|2,1,0]=4 496 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000211773_100000041952 [1,0,0,0,0,0|2,0,0]=3 497 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211773 [1,0,0,0,0,0|2,0,0]=3 498 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100000211773_100011216584 [1,0,0,0,0,0|3,0,0]=4 499 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211773 [1,0,0,0,0,0|3,0,0]=4 500 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211773 [1,0,0,0,0,0|3,0,0]=4 501 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000211773_100000210063 [1,0,0,0,0,0|3,0,0]=4 502 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000211773_100000728582 [1,0,0,0,0,0|3,0,0]=4 503 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211773 [1,0,0,0,0,0|3,0,0]=4 504 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100000719477_100009889011 [1,0,0,0,0,0|3,0,0]=4 505 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100009889011_100000041952 [1,0,0,0,0,0|3,0,0]=4 506 B16R2.252 Brc1ccnc(c1)CNc2ccccc2 34a_100000106764_100010173614 [1,0,0,0,0,0|3,0,0]=4 507 B16R2.252 Brc1ccnc(c1)COc2ccccc2 34a_100000210340_100010173614 [1,0,0,0,0,0|2,1,0]=4 508 B16R2.252 Brc1ccnc(c1)COc2ccccc2 7a_100000210340_100010173614 [1,0,0,0,0,0|2,1,0]=4 509 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100000719477_100010173614 [1,0,0,0,0,0|2,0,0]=3 510 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100010173614_100000041952 [1,0,0,0,0,0|2,0,0]=3 511 B16R2.252 Brc1ccnc(c1)CSc2ccccn2 62a_100010173614_100011216584 [1,0,0,0,0,0|3,0,0]=4 512 B16R2.252 Brc1ccnc(c1)CSc2ccccn2 62a_100011216584_100010173614 [1,0,0,0,0,0|3,0,0]=4 513 B16R2.252 Brc1ccnc(c1)CSc2cccnc2 62a_100000210063_100010173614 [1,0,0,0,0,0|3,0,0]=4 514 B16R2.252 Brc1ccnc(c1)CSc2cccnc2 62a_100010173614_100000210063 [1,0,0,0,0,0|3,0,0]=4 515 B16R2.252 Brc1ccnc(c1)CSc2ccncc2 62a_100000728582_100010173614 [1,0,0,0,0,0|3,0,0]=4 516 B16R2.252 Brc1ccnc(c1)CSc2ccncc2 62a_100010173614_100000728582 [1,0,0,0,0,0|3,0,0]=4 517 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000719477_100000738771 [1,0,0,0,0,0|3,0,0]=4 518 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000738771_100000041952 [1,0,0,0,0,0|3,0,0]=4 519 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_100000719477_200020672517 [1,0,0,0,0,0|3,0,0]=4 520 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_200020672517_100000041952 [1,0,0,0,0,0|3,0,0]=4 521 B16R2.252 Cc1cccc(c1)CNc2ccccc2 207a_100000106764_100000211157 [1,0,0,0,0,0|3,0,0]=4 522 B16R2.252 Cc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000211157 [1,0,0,0,0,0|3,0,0]=4 523 B16R2.252 Cc1cccc(c1)CNc2ccccc2 34a_100000106764_100000211840 [1,0,0,0,0,0|3,0,0]=4 524 B16R2.252 Cc1cccc(c1)COc2ccccc2 34a_100000210340_100000211840 [1,0,0,0,0,0|2,1,0]=4 525 B16R2.252 Cc1cccc(c1)COc2ccccc2 7a_100000210340_100000211840 [1,0,0,0,0,0|2,1,0]=4 526 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000211840_100000041952 [1,0,0,0,0,0|2,0,0]=3 527 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211840 [1,0,0,0,0,0|2,0,0]=3 528 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100000211840_100011216584 [1,0,0,0,0,0|3,0,0]=4 529 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211840 [1,0,0,0,0,0|3,0,0]=4 530 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211840 [1,0,0,0,0,0|3,0,0]=4 531 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000211840_100000210063 [1,0,0,0,0,0|3,0,0]=4 532 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000211840_100000728582 [1,0,0,0,0,0|3,0,0]=4 533 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211840 [1,0,0,0,0,0|3,0,0]=4 534 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000719477_100000757606 [1,0,0,0,0,0|3,0,0]=4 535 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000757606_100000041952 [1,0,0,0,0,0|3,0,0]=4 536 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 207a_100000106764_100011361488 [1,0,0,0,0,0|3,0,0]=4 537 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 34a_100000106764_100000718516 [1,0,0,0,0,0|3,0,0]=4 538 B16R2.252 Cc1ccnc(c1)COc2ccccc2 34a_100000210340_100000718516 [1,0,0,0,0,0|2,1,0]=4 539 B16R2.252 Cc1ccnc(c1)COc2ccccc2 7a_100000210340_100000718516 [1,0,0,0,0,0|2,1,0]=4 540 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000718516_100000041952 [1,0,0,0,0,0|2,0,0]=3 541 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000719477_100000718516 [1,0,0,0,0,0|2,0,0]=3 542 B16R2.252 Cc1ccnc(c1)CSc2ccccn2 62a_100000718516_100011216584 [1,0,0,0,0,0|3,0,0]=4 543 B16R2.252 Cc1ccnc(c1)CSc2ccccn2 62a_100011216584_100000718516 [1,0,0,0,0,0|3,0,0]=4 544 B16R2.252 Cc1ccnc(c1)CSc2cccnc2 62a_100000210063_100000718516 [1,0,0,0,0,0|3,0,0]=4 545 B16R2.252 Cc1ccnc(c1)CSc2cccnc2 62a_100000718516_100000210063 [1,0,0,0,0,0|3,0,0]=4 546 B16R2.252 Cc1ccnc(c1)CSc2ccncc2 62a_100000718516_100000728582 [1,0,0,0,0,0|3,0,0]=4 547 B16R2.252 Cc1ccnc(c1)CSc2ccncc2 62a_100000728582_100000718516 [1,0,0,0,0,0|3,0,0]=4 548 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000716715_100000041952 [1,0,0,0,0,0|3,0,0]=4 549 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000719477_100000716715 [1,0,0,0,0,0|3,0,0]=4 550 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000719477_100000764220 [1,0,0,0,0,0|3,0,0]=4 551 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000764220_100000041952 [1,0,0,0,0,0|3,0,0]=4 552 B16R2.252 Clc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210801 [1,0,0,0,0,0|3,0,0]=4 553 B16R2.252 Clc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210801 [1,0,0,0,0,0|3,0,0]=4 554 B16R2.252 Clc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187163 [1,0,0,0,0,0|3,0,0]=4 555 B16R2.252 Clc1cccc(c1)COc2ccccc2 34a_100000210340_100000187163 [1,0,0,0,0,0|2,1,0]=4 556 B16R2.252 Clc1cccc(c1)COc2ccccc2 7a_100000210340_100000187163 [1,0,0,0,0,0|2,1,0]=4 557 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000187163_100000041952 [1,0,0,0,0,0|2,0,0]=3 558 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000719477_100000187163 [1,0,0,0,0,0|2,0,0]=3 559 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100000187163_100011216584 [1,0,0,0,0,0|3,0,0]=4 560 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100011216584_100000187163 [1,0,0,0,0,0|3,0,0]=4 561 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000187163_100000210063 [1,0,0,0,0,0|3,0,0]=4 562 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000210063_100000187163 [1,0,0,0,0,0|3,0,0]=4 563 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000187163_100000728582 [1,0,0,0,0,0|3,0,0]=4 564 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000728582_100000187163 [1,0,0,0,0,0|3,0,0]=4 565 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000086093_100000041952 [1,0,0,0,0,0|3,0,0]=4 566 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000719477_100000086093 [1,0,0,0,0,0|3,0,0]=4 567 B16R2.252 Clc1ccnc(c1)CNc2ccccc2 34a_100000106764_100016988179 [1,0,0,0,0,0|3,0,0]=4 568 B16R2.252 Clc1ccnc(c1)COc2ccccc2 34a_100000210340_100016988179 [1,0,0,0,0,0|2,1,0]=4 569 B16R2.252 Clc1ccnc(c1)COc2ccccc2 7a_100000210340_100016988179 [1,0,0,0,0,0|2,1,0]=4 570 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100000719477_100016988179 [1,0,0,0,0,0|2,0,0]=3 571 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100016988179_100000041952 [1,0,0,0,0,0|2,0,0]=3 572 B16R2.252 Clc1ccnc(c1)CSc2ccccn2 62a_100011216584_100016988179 [1,0,0,0,0,0|3,0,0]=4 573 B16R2.252 Clc1ccnc(c1)CSc2ccccn2 62a_100016988179_100011216584 [1,0,0,0,0,0|3,0,0]=4 574 B16R2.252 Clc1ccnc(c1)CSc2cccnc2 62a_100000210063_100016988179 [1,0,0,0,0,0|3,0,0]=4 575 B16R2.252 Clc1ccnc(c1)CSc2cccnc2 62a_100016988179_100000210063 [1,0,0,0,0,0|3,0,0]=4 576 B16R2.252 Clc1ccnc(c1)CSc2ccncc2 62a_100000728582_100016988179 [1,0,0,0,0,0|3,0,0]=4 577 B16R2.252 Clc1ccnc(c1)CSc2ccncc2 62a_100016988179_100000728582 [1,0,0,0,0,0|3,0,0]=4 578 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100000719477_100016992070 [1,0,0,0,0,0|3,0,0]=4 579 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100016992070_100000041952 [1,0,0,0,0,0|3,0,0]=4 580 B16R2.252 Fc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210812 [1,0,0,0,0,0|3,0,0]=4 581 B16R2.252 Fc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210812 [1,0,0,0,0,0|3,0,0]=4 582 B16R2.252 Fc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187166 [1,0,0,0,0,0|3,0,0]=4 583 B16R2.252 Fc1cccc(c1)COc2ccccc2 34a_100000210340_100000187166 [1,0,0,0,0,0|2,1,0]=4 584 B16R2.252 Fc1cccc(c1)COc2ccccc2 7a_100000210340_100000230114 [1,0,0,0,0,0|2,1,0]=4 585 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000230114_100000041952 [1,0,0,0,0,0|2,0,0]=3 586 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000719477_100000230114 [1,0,0,0,0,0|2,0,0]=3 587 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100000230114_100011216584 [1,0,0,0,0,0|3,0,0]=4 588 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100011216584_100000230114 [1,0,0,0,0,0|3,0,0]=4 589 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000210063_100000230114 [1,0,0,0,0,0|3,0,0]=4 590 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000230114_100000210063 [1,0,0,0,0,0|3,0,0]=4 591 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000230114_100000728582 [1,0,0,0,0,0|3,0,0]=4 592 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000728582_100000230114 [1,0,0,0,0,0|3,0,0]=4 593 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100000719477_100009819644 [1,0,0,0,0,0|3,0,0]=4 594 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100009819644_100000041952 [1,0,0,0,0,0|3,0,0]=4 595 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000719477_100000725299 [1,0,0,0,0,0|3,0,0]=4 596 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000725299_100000041952 [1,0,0,0,0,0|3,0,0]=4 597 B16R2.252 Ic1cccc(c1)CNc2ccccc2 207a_100000106764_100000014684 [1,0,0,0,0,0|3,0,0]=4 598 B16R2.252 Ic1cccc(c1)CNc2ccccc2 270302a_100000106764_100000014684 [1,0,0,0,0,0|3,0,0]=4 599 B16R2.252 Ic1cccc(c1)CNc2ccccc2 34a_100000106764_100011218688 [1,0,0,0,0,0|3,0,0]=4 600 B16R2.252 Ic1cccc(c1)COc2ccccc2 34a_100000210340_100011218688 [1,0,0,0,0,0|2,1,0]=4 601 B16R2.252 Ic1cccc(c1)COc2ccccc2 7a_100000210340_100011218688 [1,0,0,0,0,0|2,1,0]=4 602 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100000719477_100011218688 [1,0,0,0,0,0|2,0,0]=3 603 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100011218688_100000041952 [1,0,0,0,0,0|2,0,0]=3 604 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011216584_100011218688 [1,0,0,0,0,0|3,0,0]=4 605 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011218688_100011216584 [1,0,0,0,0,0|3,0,0]=4 606 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100000210063_100011218688 [1,0,0,0,0,0|3,0,0]=4 607 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100011218688_100000210063 [1,0,0,0,0,0|3,0,0]=4 608 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100000728582_100011218688 [1,0,0,0,0,0|3,0,0]=4 609 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100011218688_100000728582 [1,0,0,0,0,0|3,0,0]=4 610 B16R2.252 O=c1cc[nH]c(c1)SCc2ccccc2 62a_100009817434_100015291786 [1,0,0,0,0,0|3,0,0]=4 611 B16R2.252 O=c1cccc([nH]1)CNc2ccccc2 207a_100000106764_100011935257 [1,0,0,0,0,0|3,0,0]=4 612 B16R2.252 Oc1cccc(c1)CNc2ccccc2 207a_100000106764_100000188321 [1,0,0,0,0,0|2,0,1]=4 613 B16R2.252 Oc1cccc(c1)CNc2ccccc2 34a_100000106764_100011660834 [1,0,0,0,0,0|2,0,1]=4 614 B16R2.252 Oc1cccc(c1)COc2ccccc2 271570a_203496583355_100000173242 [1,0,0,0,0,0|1,1,1]=4 615 B16R2.252 Oc1cccc(c1)COc2ccccc2 34a_100000210340_100011660834 [1,0,0,0,0,0|1,1,1]=4 616 B16R2.252 Oc1cccc(c1)COc2ccccc2 7a_100000210340_100000084143 [1,0,0,0,0,0|1,1,1]=4 617 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100000719477_100011660834 [1,0,0,0,0,0|1,0,1]=3 618 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100011660834_100000041952 [1,0,0,0,0,0|1,0,1]=3 619 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011216584_100011660834 [1,0,0,0,0,0|2,0,1]=4 620 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011660834_100011216584 [1,0,0,0,0,0|2,0,1]=4 621 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100000210063_100011660834 [1,0,0,0,0,0|2,0,1]=4 622 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100011660834_100000210063 [1,0,0,0,0,0|2,0,1]=4 623 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100000728582_100011660834 [1,0,0,0,0,0|2,0,1]=4 624 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100011660834_100000728582 [1,0,0,0,0,0|2,0,1]=4 625 B18R2.249 CC(Cc1cc(c(cn1)O)N)c2ccccc2 271570a_100000062452_100009819941 [0,1,0,0,0,0|3,0,0]=4 626 B18R2.249 CC(Cc1ccc(c(c1)Br)O)c2ccccc2 271570a_100000062452_100012361655 [0,1,0,0,0,0|3,0,0]=4 627 B18R2.249 CC(Cc1ccc(c(c1)Cl)O)c2ccccc2 271570a_100000062452_100012360047 [0,1,0,0,0,0|3,0,0]=4 628 B18R2.249 CC(Cc1ccc(c(c1)F)O)c2ccccc2 271570a_100000062452_100000185481 [0,1,0,0,0,0|3,0,0]=4 629 B18R2.249 CC(Cc1ccc(c(c1)N)O)c2ccccc2 271570a_100000062452_100000752626 [0,1,0,0,0,0|3,0,0]=4 630 B18R2.249 CC(Cc1ccc(c(c1)O)O)c2ccccc2 271570a_100000062452_100009813601 [0,1,0,0,0,0|2,0,1]=4 631 B18R2.249 CN(Cc1cc(=O)c(co1)O)c2ccccc2 2230a_100000210012_100000010605 [0,1,0,0,0,0|1,0,0]=2 632 B18R2.249 CN(Cc1cc(=O)c(co1)O)c2ccccc2 269982a_100000210012_100000010605 [0,1,0,0,0,0|1,0,0]=2 633 B18R2.249 Cc1cc(ccc1O)CC(C)c2ccccc2 271570a_100000062452_100000186361 [0,1,0,0,0,0|3,0,0]=4 634 B18R2.249 Cc1cc(ncc1O)CC(C)c2ccccc2 271570a_100000062452_100000692680 [0,1,0,0,0,0|3,0,0]=4 635 B18R2.249 O=C(Cc1cc(=O)c(co1)O)c2ccccc2 1458a_100000185807_100000010605 [0,1,0,0,0,0|1,0,0]=2 636 B18R2.2562 COc1ccc(cc1Br)CNc2ccccc2 207a_100000106764_100000173361 [0,1,0,0,0,0|3,0,0]=4 637 B18R2.2562 COc1ccc(cc1Br)CNc2ccccc2 270302a_100000106764_100000173361 [0,1,0,0,0,0|3,0,0]=4 638 B18R2.2562 COc1ccc(cc1Br)CNc2ccccc2 34a_100000106764_200011397701 [0,1,0,0,0,0|3,0,0]=4 639 B18R2.2562 COc1ccc(cc1Br)COc2ccccc2 34a_100000210340_200011397701 [0,1,0,0,0,0|2,1,0]=4 640 B18R2.2562 COc1ccc(cc1Br)COc2ccccc2 7a_100000210340_200011397701 [0,1,0,0,0,0|2,1,0]=4 641 B18R2.2562 COc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_200011397701 [0,1,0,0,0,0|2,0,0]=3 642 B18R2.2562 COc1ccc(cc1Br)CSc2ccccc2 62a_200011397701_100000041952 [0,1,0,0,0,0|2,0,0]=3 643 B18R2.2562 COc1ccc(cc1Br)CSc2ccccn2 62a_100011216584_200011397701 [0,1,0,0,0,0|3,0,0]=4 644 B18R2.2562 COc1ccc(cc1Br)CSc2ccccn2 62a_200011397701_100011216584 [0,1,0,0,0,0|3,0,0]=4 645 B18R2.2562 COc1ccc(cc1Br)CSc2cccnc2 62a_100000210063_200011397701 [0,1,0,0,0,0|3,0,0]=4 646 B18R2.2562 COc1ccc(cc1Br)CSc2cccnc2 62a_200011397701_100000210063 [0,1,0,0,0,0|3,0,0]=4 647 B18R2.2562 COc1ccc(cc1Br)CSc2ccncc2 62a_100000728582_200011397701 [0,1,0,0,0,0|3,0,0]=4 648 B18R2.2562 COc1ccc(cc1Br)CSc2ccncc2 62a_200011397701_100000728582 [0,1,0,0,0,0|3,0,0]=4 649 B18R2.2562 COc1ccc(cc1C)CNc2ccccc2 207a_100000106764_100000239718 [0,1,0,0,0,0|3,0,0]=4 650 B18R2.2562 COc1ccc(cc1C)CNc2ccccc2 270302a_100000106764_100000239718 [0,1,0,0,0,0|3,0,0]=4 651 B18R2.2562 COc1ccc(cc1C)CNc2ccccc2 34a_100000106764_200011290836 [0,1,0,0,0,0|3,0,0]=4 652 B18R2.2562 COc1ccc(cc1C)COc2ccccc2 34a_100000210340_200011290836 [0,1,0,0,0,0|2,1,0]=4 653 B18R2.2562 COc1ccc(cc1C)COc2ccccc2 7a_100000210340_200011290836 [0,1,0,0,0,0|2,1,0]=4 654 B18R2.2562 COc1ccc(cc1C)CSc2ccccc2 62a_100000719477_200011290836 [0,1,0,0,0,0|2,0,0]=3 655 B18R2.2562 COc1ccc(cc1C)CSc2ccccc2 62a_200011290836_100000041952 [0,1,0,0,0,0|2,0,0]=3 656 B18R2.2562 COc1ccc(cc1C)CSc2ccccn2 62a_100011216584_200011290836 [0,1,0,0,0,0|3,0,0]=4 657 B18R2.2562 COc1ccc(cc1C)CSc2ccccn2 62a_200011290836_100011216584 [0,1,0,0,0,0|3,0,0]=4 658 B18R2.2562 COc1ccc(cc1C)CSc2cccnc2 62a_100000210063_200011290836 [0,1,0,0,0,0|3,0,0]=4 659 B18R2.2562 COc1ccc(cc1C)CSc2cccnc2 62a_200011290836_100000210063 [0,1,0,0,0,0|3,0,0]=4 660 B18R2.2562 COc1ccc(cc1C)CSc2ccncc2 62a_100000728582_200011290836 [0,1,0,0,0,0|3,0,0]=4 661 B18R2.2562 COc1ccc(cc1C)CSc2ccncc2 62a_200011290836_100000728582 [0,1,0,0,0,0|3,0,0]=4 662 B18R2.2562 COc1ccc(cc1Cl)CNc2ccccc2 207a_100000106764_100000186747 [0,1,0,0,0,0|3,0,0]=4 663 B18R2.2562 COc1ccc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000186747 [0,1,0,0,0,0|3,0,0]=4 664 B18R2.2562 COc1ccc(cc1Cl)CNc2ccccc2 34a_100000106764_100000693707 [0,1,0,0,0,0|3,0,0]=4 665 B18R2.2562 COc1ccc(cc1Cl)COc2ccccc2 34a_100000210340_100000693707 [0,1,0,0,0,0|2,1,0]=4 666 B18R2.2562 COc1ccc(cc1Cl)COc2ccccc2 7a_100000210340_100000693707 [0,1,0,0,0,0|2,1,0]=4 667 B18R2.2562 COc1ccc(cc1Cl)CSc2ccccc2 62a_100000693707_100000041952 [0,1,0,0,0,0|2,0,0]=3 668 B18R2.2562 COc1ccc(cc1Cl)CSc2ccccc2 62a_100000719477_100000693707 [0,1,0,0,0,0|2,0,0]=3 669 B18R2.2562 COc1ccc(cc1Cl)CSc2ccccn2 62a_100000693707_100011216584 [0,1,0,0,0,0|3,0,0]=4 670 B18R2.2562 COc1ccc(cc1Cl)CSc2ccccn2 62a_100011216584_100000693707 [0,1,0,0,0,0|3,0,0]=4 671 B18R2.2562 COc1ccc(cc1Cl)CSc2cccnc2 62a_100000210063_100000693707 [0,1,0,0,0,0|3,0,0]=4 672 B18R2.2562 COc1ccc(cc1Cl)CSc2cccnc2 62a_100000693707_100000210063 [0,1,0,0,0,0|3,0,0]=4 673 B18R2.2562 COc1ccc(cc1Cl)CSc2ccncc2 62a_100000693707_100000728582 [0,1,0,0,0,0|3,0,0]=4 674 B18R2.2562 COc1ccc(cc1Cl)CSc2ccncc2 62a_100000728582_100000693707 [0,1,0,0,0,0|3,0,0]=4 675 B18R2.2562 COc1ccc(cc1F)CNc2ccccc2 207a_100000106764_100000204617 [0,1,0,0,0,0|3,0,0]=4 676 B18R2.2562 COc1ccc(cc1F)CNc2ccccc2 270302a_100000106764_100000204617 [0,1,0,0,0,0|3,0,0]=4 677 B18R2.2562 COc1ccc(cc1F)CNc2ccccc2 34a_100000106764_100000189595 [0,1,0,0,0,0|3,0,0]=4 678 B18R2.2562 COc1ccc(cc1F)COc2ccccc2 34a_100000210340_100000189595 [0,1,0,0,0,0|2,1,0]=4 679 B18R2.2562 COc1ccc(cc1F)COc2ccccc2 7a_100000210340_100000189595 [0,1,0,0,0,0|2,1,0]=4 680 B18R2.2562 COc1ccc(cc1F)CSc2ccccc2 62a_100000189595_100000041952 [0,1,0,0,0,0|2,0,0]=3 681 B18R2.2562 COc1ccc(cc1F)CSc2ccccc2 62a_100000719477_100000189595 [0,1,0,0,0,0|2,0,0]=3 682 B18R2.2562 COc1ccc(cc1F)CSc2ccccn2 62a_100000189595_100011216584 [0,1,0,0,0,0|3,0,0]=4 683 B18R2.2562 COc1ccc(cc1F)CSc2ccccn2 62a_100011216584_100000189595 [0,1,0,0,0,0|3,0,0]=4 684 B18R2.2562 COc1ccc(cc1F)CSc2cccnc2 62a_100000189595_100000210063 [0,1,0,0,0,0|3,0,0]=4 685 B18R2.2562 COc1ccc(cc1F)CSc2cccnc2 62a_100000210063_100000189595 [0,1,0,0,0,0|3,0,0]=4 686 B18R2.2562 COc1ccc(cc1F)CSc2ccncc2 62a_100000189595_100000728582 [0,1,0,0,0,0|3,0,0]=4 687 B18R2.2562 COc1ccc(cc1F)CSc2ccncc2 62a_100000728582_100000189595 [0,1,0,0,0,0|3,0,0]=4 688 B18R2.2562 COc1ccc(cc1I)CNc2ccccc2 207a_100000106764_100009827998 [0,1,0,0,0,0|3,0,0]=4 689 B18R2.2562 COc1ccc(cc1I)CNc2ccccc2 270302a_100000106764_100009827998 [0,1,0,0,0,0|3,0,0]=4 690 B18R2.2562 COc1cnc(cc1Br)CNc2ccccc2 207a_100000106764_100010893078 [0,1,0,0,0,0|3,0,0]=4 691 B18R2.2562 COc1coc(cc1=O)COc2ccccc2 7a_100000210340_100000081511 [0,1,0,0,0,0|0,1,0]=2 692 B18R2.2562 COc1coc(cc1=O)COc2cccnc2 7a_100000210849_100000081511 [0,1,0,0,0,0|1,1,0]=3 693 B18R2.2562 COc1coc(cc1=O)COc2cncnc2 7a_100000754086_100000081511 [0,1,0,0,0,0|2,1,0]=4 694 B18R2.2562 COc1coc(cc1=O)CSc2ccccc2 62a_100000719477_100000081511 [0,1,0,0,0,0|0,0,0]=1 695 B18R2.2562 COc1coc(cc1=O)CSc2ccccn2 62a_100011216584_100000081511 [0,1,0,0,0,0|1,0,0]=2 696 B18R2.2562 COc1coc(cc1=O)CSc2cccnc2 62a_100000210063_100000081511 [0,1,0,0,0,0|1,0,0]=2 697 B18R2.2562 COc1coc(cc1=O)CSc2cccnn2 62a_100016991348_100000081511 [0,1,0,0,0,0|2,0,0]=3 698 B18R2.2562 COc1coc(cc1=O)CSc2ccncc2 62a_100000728582_100000081511 [0,1,0,0,0,0|1,0,0]=2 699 B18R2.2562 COc1coc(cc1=O)CSc2ccncn2 62a_100000703185_100000081511 [0,1,0,0,0,0|2,0,0]=3 700 B18R2.2562 COc1coc(cc1=O)CSc2ccnnc2 62a_100000732662_100000081511 [0,1,0,0,0,0|2,0,0]=3 701 B18R2.2562 COc1coc(cc1=O)CSc2cnccn2 62a_100000211759_100000081511 [0,1,0,0,0,0|2,0,0]=3 702 B18R2.2562 COc1coc(cc1=O)CSc2cncnc2 62a_100011206942_100000081511 [0,1,0,0,0,0|2,0,0]=3 703 B18R2.2562 COc1coc(cc1=O)CSc2cnnnc2 62a_100009846058_100000081511 [0,1,0,0,0,0|3,0,0]=4 704 B18R2.2562 COc1coc(cc1=O)CSc2ncccn2 62a_100000211032_100000081511 [0,1,0,0,0,0|2,0,0]=3 705 B18R2.2562 N#Cc1ccc(cc1Br)CSc2ccccc2 62a_100000719477_100012355662 [0,1,0,0,0,0|3,0,0]=4 706 B18R2.2562 N#Cc1ccc(cc1Br)CSc2ccccc2 62a_100012355662_100000041952 [0,1,0,0,0,0|3,0,0]=4 707 B18R2.2562 N#Cc1ccc(cc1Cl)CSc2ccccc2 62a_100000719477_100010147163 [0,1,0,0,0,0|3,0,0]=4 708 B18R2.2562 N#Cc1ccc(cc1F)CSc2ccccc2 62a_100000719477_100011217145 [0,1,0,0,0,0|3,0,0]=4 709 B18R2.2562 O=Cc1ccc(cc1F)CSc2ccccc2 62a_100000719477_100010142638 [0,1,0,0,0,0|2,0,1]=4 710 B18R2.2562 O=Cc1ccc(cc1F)CSc2ccccc2 62a_100010142638_100000041952 [0,1,0,0,0,0|2,0,1]=4 711 B18R2.2686 COc1cc(ccc1Br)CSc2ccccc2 62a_100000719477_100010110085 [0,1,0,0,0,0|2,0,1]=4 712 B18R2.2686 COc1cc(ccc1Br)CSc2ccccc2 62a_100010110085_100000041952 [0,1,0,0,0,0|2,0,1]=4 713 B18R2.2686 COc1cc(ccc1Cl)CSc2ccccc2 62a_100000719477_200010214485 [0,1,0,0,0,0|2,0,1]=4 714 B18R2.2686 COc1cc(ccc1Cl)CSc2ccccc2 62a_200010214485_100000041952 [0,1,0,0,0,0|2,0,1]=4 715 B18R2.2686 COc1cc(ccc1F)CSc2ccccc2 62a_100000719477_100012349856 [0,1,0,0,0,0|2,0,1]=4 716 B18R2.2686 COc1cc(ccc1F)CSc2ccccc2 62a_100012349856_100000041952 [0,1,0,0,0,0|2,0,1]=4 717 B18R2.2686 N#Cc1cc(ccc1Br)CSc2ccccc2 62a_100000719477_100010128727 [0,1,0,0,0,0|3,0,0]=4 718 B18R2.2686 N#Cc1cc(ccc1Br)CSc2ccccc2 62a_100010128727_100000041952 [0,1,0,0,0,0|3,0,0]=4 719 B18R2.2686 N#Cc1cc(ccc1Cl)CSc2ccccc2 62a_100000719477_100010147165 [0,1,0,0,0,0|3,0,0]=4 720 B18R2.2686 N#Cc1cc(ccc1F)CSc2ccccc2 62a_100000687583_100000041952 [0,1,0,0,0,0|3,0,0]=4 721 B18R2.2686 N#Cc1cc(ccc1F)CSc2ccccc2 62a_100000719477_100000687583 [0,1,0,0,0,0|3,0,0]=4 722 B18R2.2686 O=Cc1cc(ccc1O)C#Cc2ccccc2 271570a_100000069678_100000186750 [0,1,0,0,0,0|2,0,1]=4 723 B18R2.2686 O=Cc1cc(ccc1O)C=Cc2ccccc2 271570a_100102527694_100000186750 [0,1,0,0,0,0|2,0,1]=4 724 B18R2.2686 O=Cc1cc(ccc1O)COc2ccccc2 7a_100000210340_100000008128 [0,1,0,0,0,0|1,1,0]=3 725 B18R2.2686 O=Cc1cc(ccc1O)COc2cccnc2 7a_100000210849_100000008128 [0,1,0,0,0,0|2,1,0]=4 726 B18R2.2686 O=Cc1cc(ccc1O)CSc2ccccc2 62a_100000719477_100000008128 [0,1,0,0,0,0|1,0,0]=2 727 B18R2.2686 O=Cc1cc(ccc1O)CSc2ccccn2 62a_100011216584_100000008128 [0,1,0,0,0,0|2,0,0]=3 728 B18R2.2686 O=Cc1cc(ccc1O)CSc2cccnc2 62a_100000210063_100000008128 [0,1,0,0,0,0|2,0,0]=3 729 B18R2.2686 O=Cc1cc(ccc1O)CSc2cccnn2 62a_100016991348_100000008128 [0,1,0,0,0,0|3,0,0]=4 730 B18R2.2686 O=Cc1cc(ccc1O)CSc2ccncc2 62a_100000728582_100000008128 [0,1,0,0,0,0|2,0,0]=3 731 B18R2.2686 O=Cc1cc(ccc1O)CSc2ccncn2 62a_100000703185_100000008128 [0,1,0,0,0,0|3,0,0]=4 732 B18R2.2686 O=Cc1cc(ccc1O)CSc2ccnnc2 62a_100000732662_100000008128 [0,1,0,0,0,0|3,0,0]=4 733 B18R2.2686 O=Cc1cc(ccc1O)CSc2cnccn2 62a_100000211759_100000008128 [0,1,0,0,0,0|3,0,0]=4 734 B18R2.2686 O=Cc1cc(ccc1O)CSc2cncnc2 62a_100011206942_100000008128 [0,1,0,0,0,0|3,0,0]=4 735 B18R2.2686 O=Cc1cc(ccc1O)CSc2ncccn2 62a_100000211032_100000008128 [0,1,0,0,0,0|3,0,0]=4 736 B18R2.2686 O=Cc1cc(ccc1O)OCc2ccccc2 271570a_203496583355_100012340526 [0,1,0,0,0,0|3,0,0]=4 737 B18R2.2686 O=Cc1cc(ccc1O)SCc2ccccc2 62a_100000211182_100000186750 [0,1,0,0,0,0|3,0,0]=4 738 B18R2.2686 O=Cc1cc(ncc1O)SCc2ccccc2 62a_100000211182_100000048449 [0,1,0,0,0,0|3,0,0]=4 739 B18R2.6533 Cc1cc(c(cc1F)F)CSc2ccccc2 62a_100000719477_100012347589 [0,1,0,0,0,0|3,0,0]=4 740 B18R2.6533 Cc1cc(c(cc1F)F)CSc2ccccc2 62a_100012347589_100000041952 [0,1,0,0,0,0|3,0,0]=4 741 B18R2.6533 Clc1cc(c(cc1Cl)CSc2ccccc2)Cl 62a_100000719477_100010220947 [0,1,0,0,0,0|3,0,0]=4 742 B18R2.6533 Clc1cc(c(cc1Cl)CSc2ccccc2)Cl 62a_100010220947_100000041952 [0,1,0,0,0,0|3,0,0]=4 743 B18R2.6533 Fc1cc(c(cc1Br)F)CSc2ccccc2 62a_100000719477_100012024439 [0,1,0,0,0,0|3,0,0]=4 744 B18R2.6533 Fc1cc(c(cc1Br)F)CSc2ccccc2 62a_100012024439_100000041952 [0,1,0,0,0,0|3,0,0]=4 745 B18R2.6533 Fc1cc(c(cc1Cl)CSc2ccccc2)F 62a_100000719477_100010994231 [0,1,0,0,0,0|3,0,0]=4 746 B18R2.6533 Fc1cc(c(cc1Cl)CSc2ccccc2)F 62a_100010994231_100000041952 [0,1,0,0,0,0|3,0,0]=4 747 B18R2.6533 Fc1cc(c(cc1Cl)Cl)CSc2ccccc2 62a_100000719477_100009813697 [0,1,0,0,0,0|3,0,0]=4 748 B18R2.6533 Fc1cc(c(cc1Cl)Cl)CSc2ccccc2 62a_100009813697_100000041952 [0,1,0,0,0,0|3,0,0]=4 749 B18R2.6533 Fc1cc(c(cc1Cl)F)CSc2ccccc2 62a_100000719477_200012361342 [0,1,0,0,0,0|3,0,0]=4 750 B18R2.6533 Fc1cc(c(cc1Cl)F)CSc2ccccc2 62a_200012361342_100000041952 [0,1,0,0,0,0|3,0,0]=4 751 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)Br 62a_100000719477_100010077255 [0,1,0,0,0,0|3,0,0]=4 752 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)Br 62a_100010077255_100000041952 [0,1,0,0,0,0|3,0,0]=4 753 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)Cl 62a_100000719477_100011830393 [0,1,0,0,0,0|3,0,0]=4 754 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)Cl 62a_100011830393_100000041952 [0,1,0,0,0,0|3,0,0]=4 755 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)F 62a_100000719477_100011218792 [0,1,0,0,0,0|3,0,0]=4 756 B18R2.6533 Fc1cc(c(cc1F)CSc2ccccc2)F 62a_100011218792_100000041952 [0,1,0,0,0,0|3,0,0]=4 757 B18R2.6533 Fc1cc(c(cc1I)CSc2ccccc2)F 62a_100000719477_100019984567 [0,1,0,0,0,0|3,0,0]=4 758 B18R2.6533 Fc1cc(c(cc1I)CSc2ccccc2)F 62a_100019984567_100000041952 [0,1,0,0,0,0|3,0,0]=4 759 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)Br 62a_100000727479_100000752885 [0,1,0,0,0,0|3,0,0]=4 760 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)Br 62a_100000752885_100000727479 [0,1,0,0,0,0|3,0,0]=4 761 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)Cl 62a_100000727479_100000755918 [0,1,0,0,0,0|3,0,0]=4 762 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)Cl 62a_100000755918_100000727479 [0,1,0,0,0,0|3,0,0]=4 763 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)F 62a_100000211213_100000727479 [0,1,0,0,0,0|3,0,0]=4 764 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)F 62a_100000727479_100000211213 [0,1,0,0,0,0|3,0,0]=4 765 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)N 62a_100000185761_100000727479 [0,1,0,0,0,0|3,0,0]=4 766 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)N 62a_100000727479_100000185761 [0,1,0,0,0,0|3,0,0]=4 767 B18R2.9259 Cc1cc(ccc1Br)CSc2ccc(cc2)O 62a_100000727479_100000185759 [0,1,0,0,0,0|3,0,0]=4 768 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)Br 62a_100000752885_100012184735 [0,1,0,0,0,0|3,0,0]=4 769 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)Br 62a_100012184735_100000752885 [0,1,0,0,0,0|3,0,0]=4 770 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)Cl 62a_100000755918_100012184735 [0,1,0,0,0,0|3,0,0]=4 771 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)Cl 62a_100012184735_100000755918 [0,1,0,0,0,0|3,0,0]=4 772 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)F 62a_100000211213_100012184735 [0,1,0,0,0,0|3,0,0]=4 773 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)F 62a_100012184735_100000211213 [0,1,0,0,0,0|3,0,0]=4 774 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)N 62a_100000185761_100012184735 [0,1,0,0,0,0|3,0,0]=4 775 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)N 62a_100012184735_100000185761 [0,1,0,0,0,0|3,0,0]=4 776 B18R2.9259 Cc1cc(ccc1Cl)CSc2ccc(cc2)O 62a_100012184735_100000185759 [0,1,0,0,0,0|3,0,0]=4 777 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)Br 62a_100000752885_100011216667 [0,1,0,0,0,0|3,0,0]=4 778 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)Br 62a_100011216667_100000752885 [0,1,0,0,0,0|3,0,0]=4 779 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)Cl 62a_100000755918_100011216667 [0,1,0,0,0,0|3,0,0]=4 780 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)Cl 62a_100011216667_100000755918 [0,1,0,0,0,0|3,0,0]=4 781 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)F 62a_100000211213_100011216667 [0,1,0,0,0,0|3,0,0]=4 782 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)F 62a_100011216667_100000211213 [0,1,0,0,0,0|3,0,0]=4 783 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)N 62a_100000185761_100011216667 [0,1,0,0,0,0|3,0,0]=4 784 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)N 62a_100011216667_100000185761 [0,1,0,0,0,0|3,0,0]=4 785 B18R2.9259 Cc1cc(ccc1F)CSc2ccc(cc2)O 62a_100011216667_100000185759 [0,1,0,0,0,0|3,0,0]=4 786 B18R2.9259 Cc1cc(ccc1O)CNc2ccc(cc2)Br 270302a_100000210018_100011215669 [0,1,0,0,0,0|3,0,0]=4 787 B18R2.9259 Cc1cc(ccc1O)CNc2ccc(cc2)Cl 270302a_100000210052_100011215669 [0,1,0,0,0,0|3,0,0]=4 788 B18R2.9259 Cc1cc(ccc1O)CNc2ccc(cc2)F 270302a_100000185862_100011215669 [0,1,0,0,0,0|3,0,0]=4 789 B18R2.9259 Cc1cc(ccc1O)CNc2ccc(cc2)I 270302a_100000185761_100011215669 [0,1,0,0,0,0|3,0,0]=4 790 B18R2.9259 Cc1cc(ccc1O)CNc2ccc(cc2)O 270302a_100000185829_100011215669 [0,1,0,0,0,0|3,0,0]=4 791 B18R2.9259 Cc1ccc(cc1)NCc2ccc(c(c2)C)O 270302a_100000124888_100011215669 [0,1,0,0,0,0|3,0,0]=4 792 B18R2.9259 Cc1ccc(cc1)OCc2cc(=O)c(co2)O 7a_100000210336_100000010605 [0,1,0,0,0,0|0,1,0]=2 793 B18R2.9259 Cc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100000186775_100000010605 [0,1,0,0,0,0|0,0,0]=1 794 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100000186775_100012353900 [0,1,0,0,0,0|3,0,0]=4 795 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000186775 [0,1,0,0,0,0|3,0,0]=4 796 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)C 62a_100000186775_100012232412 [0,1,0,0,0,0|3,0,0]=4 797 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)C 62a_100012232412_100000186775 [0,1,0,0,0,0|3,0,0]=4 798 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100000186775_100012353894 [0,1,0,0,0,0|3,0,0]=4 799 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000186775 [0,1,0,0,0,0|3,0,0]=4 800 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100000186775_100011206884 [0,1,0,0,0,0|3,0,0]=4 801 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000186775 [0,1,0,0,0,0|3,0,0]=4 802 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)Br 62a_100000186775_100000727479 [0,1,0,0,0,0|3,0,0]=4 803 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)Br 62a_100000727479_100000186775 [0,1,0,0,0,0|3,0,0]=4 804 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)C 62a_100000186775_100000742320 [0,1,0,0,0,0|3,0,0]=4 805 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)C 62a_100000742320_100000186775 [0,1,0,0,0,0|3,0,0]=4 806 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)Cl 62a_100000186775_100012184735 [0,1,0,0,0,0|3,0,0]=4 807 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)Cl 62a_100012184735_100000186775 [0,1,0,0,0,0|3,0,0]=4 808 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)F 62a_100000186775_100011216667 [0,1,0,0,0,0|3,0,0]=4 809 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)C)F 62a_100011216667_100000186775 [0,1,0,0,0,0|3,0,0]=4 810 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100000186775_100012353895 [0,1,0,0,0,0|3,0,0]=4 811 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000186775 [0,1,0,0,0,0|3,0,0]=4 812 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)C 62a_100000186775_100011823929 [0,1,0,0,0,0|3,0,0]=4 813 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)C 62a_100011823929_100000186775 [0,1,0,0,0,0|3,0,0]=4 814 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000186775 [0,1,0,0,0,0|3,0,0]=4 815 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000186775_100000184707 [0,1,0,0,0,0|3,0,0]=4 816 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000186775_100011934319 [0,1,0,0,0,0|3,0,0]=4 817 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000186775 [0,1,0,0,0,0|3,0,0]=4 818 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100000186775_100012349665 [0,1,0,0,0,0|3,0,0]=4 819 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000186775 [0,1,0,0,0,0|3,0,0]=4 820 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000186775_100000767054 [0,1,0,0,0,0|3,0,0]=4 821 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000186775 [0,1,0,0,0,0|3,0,0]=4 822 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)C 62a_100000186775_100011217369 [0,1,0,0,0,0|3,0,0]=4 823 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)C 62a_100011217369_100000186775 [0,1,0,0,0,0|3,0,0]=4 824 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000186775_100000716492 [0,1,0,0,0,0|3,0,0]=4 825 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000186775 [0,1,0,0,0,0|3,0,0]=4 826 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000186775_100000757363 [0,1,0,0,0,0|3,0,0]=4 827 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000757363_100000186775 [0,1,0,0,0,0|3,0,0]=4 828 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100000186775_100010149604 [0,1,0,0,0,0|3,0,0]=4 829 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100010149604_100000186775 [0,1,0,0,0,0|3,0,0]=4 830 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100000186775_100010146616 [0,1,0,0,0,0|3,0,0]=4 831 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000186775 [0,1,0,0,0,0|3,0,0]=4 832 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)C 62a_100000186775_100010206137 [0,1,0,0,0,0|3,0,0]=4 833 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)C 62a_100010206137_100000186775 [0,1,0,0,0,0|3,0,0]=4 834 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100000186775_100010188208 [0,1,0,0,0,0|3,0,0]=4 835 B18R2.9259 Cc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100010188208_100000186775 [0,1,0,0,0,0|3,0,0]=4 836 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_100000752885_100012232412 [0,1,0,0,0,0|3,0,0]=4 837 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_100012232412_100000752885 [0,1,0,0,0,0|3,0,0]=4 838 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_100000755918_100012232412 [0,1,0,0,0,0|3,0,0]=4 839 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_100012232412_100000755918 [0,1,0,0,0,0|3,0,0]=4 840 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)F 62a_100000211213_100012232412 [0,1,0,0,0,0|3,0,0]=4 841 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)F 62a_100012232412_100000211213 [0,1,0,0,0,0|3,0,0]=4 842 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)N 62a_100000185761_100012232412 [0,1,0,0,0,0|3,0,0]=4 843 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)N 62a_100012232412_100000185761 [0,1,0,0,0,0|3,0,0]=4 844 B18R2.9259 Cc1ccc(cc1Br)CSc2ccc(cc2)O 62a_100012232412_100000185759 [0,1,0,0,0,0|3,0,0]=4 845 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)Br 62a_100000742320_100000752885 [0,1,0,0,0,0|3,0,0]=4 846 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)Br 62a_100000752885_100000742320 [0,1,0,0,0,0|3,0,0]=4 847 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)Cl 62a_100000742320_100000755918 [0,1,0,0,0,0|3,0,0]=4 848 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)Cl 62a_100000755918_100000742320 [0,1,0,0,0,0|3,0,0]=4 849 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)F 62a_100000211213_100000742320 [0,1,0,0,0,0|3,0,0]=4 850 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)F 62a_100000742320_100000211213 [0,1,0,0,0,0|3,0,0]=4 851 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)N 62a_100000185761_100000742320 [0,1,0,0,0,0|3,0,0]=4 852 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)N 62a_100000742320_100000185761 [0,1,0,0,0,0|3,0,0]=4 853 B18R2.9259 Cc1ccc(cc1C)CSc2ccc(cc2)O 62a_100000742320_100000185759 [0,1,0,0,0,0|3,0,0]=4 854 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100000752885_100011823929 [0,1,0,0,0,0|3,0,0]=4 855 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100011823929_100000752885 [0,1,0,0,0,0|3,0,0]=4 856 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100000755918_100011823929 [0,1,0,0,0,0|3,0,0]=4 857 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100011823929_100000755918 [0,1,0,0,0,0|3,0,0]=4 858 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)F 62a_100000211213_100011823929 [0,1,0,0,0,0|3,0,0]=4 859 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)F 62a_100011823929_100000211213 [0,1,0,0,0,0|3,0,0]=4 860 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)N 62a_100000185761_100011823929 [0,1,0,0,0,0|3,0,0]=4 861 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)N 62a_100011823929_100000185761 [0,1,0,0,0,0|3,0,0]=4 862 B18R2.9259 Cc1ccc(cc1Cl)CSc2ccc(cc2)O 62a_100011823929_100000185759 [0,1,0,0,0,0|3,0,0]=4 863 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100000752885_100011217369 [0,1,0,0,0,0|3,0,0]=4 864 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100011217369_100000752885 [0,1,0,0,0,0|3,0,0]=4 865 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100000755918_100011217369 [0,1,0,0,0,0|3,0,0]=4 866 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100011217369_100000755918 [0,1,0,0,0,0|3,0,0]=4 867 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)F 62a_100000211213_100011217369 [0,1,0,0,0,0|3,0,0]=4 868 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)F 62a_100011217369_100000211213 [0,1,0,0,0,0|3,0,0]=4 869 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)N 62a_100000185761_100011217369 [0,1,0,0,0,0|3,0,0]=4 870 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)N 62a_100011217369_100000185761 [0,1,0,0,0,0|3,0,0]=4 871 B18R2.9259 Cc1ccc(cc1F)CSc2ccc(cc2)O 62a_100011217369_100000185759 [0,1,0,0,0,0|3,0,0]=4 872 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)Br 62a_100000752885_100010206137 [0,1,0,0,0,0|3,0,0]=4 873 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)Br 62a_100010206137_100000752885 [0,1,0,0,0,0|3,0,0]=4 874 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)Cl 62a_100000755918_100010206137 [0,1,0,0,0,0|3,0,0]=4 875 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)Cl 62a_100010206137_100000755918 [0,1,0,0,0,0|3,0,0]=4 876 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)F 62a_100000211213_100010206137 [0,1,0,0,0,0|3,0,0]=4 877 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)F 62a_100010206137_100000211213 [0,1,0,0,0,0|3,0,0]=4 878 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)N 62a_100000185761_100010206137 [0,1,0,0,0,0|3,0,0]=4 879 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)N 62a_100010206137_100000185761 [0,1,0,0,0,0|3,0,0]=4 880 B18R2.9259 Cc1ccc(cc1I)CSc2ccc(cc2)O 62a_100010206137_100000185759 [0,1,0,0,0,0|3,0,0]=4 881 B18R2.9259 Cc1ccc(cn1)OCc2cc(=O)c(co2)O 7a_100000745506_100000010605 [0,1,0,0,0,0|1,1,0]=3 882 B18R2.9259 Cc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000751577_100000010605 [0,1,0,0,0,0|1,0,0]=2 883 B18R2.9259 Cc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100011192072_100000010605 [0,1,0,0,0,0|1,0,0]=2 884 B18R2.9259 Cc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100000744512_100000010605 [0,1,0,0,0,0|2,0,0]=3 885 B18R2.9259 Cc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100011999403_100000010605 [0,1,0,0,0,0|2,0,0]=3 886 B18R2.9259 Cc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000061069_100000010605 [0,1,0,0,0,0|2,0,0]=3 887 B18R2.9259 Cc1ncc(cn1)OCc2cc(=O)c(co2)O 7a_100000062939_100000010605 [0,1,0,0,0,0|2,1,0]=4 888 B18R2.9259 Cc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100000686985_100000010605 [0,1,0,0,0,0|2,0,0]=3 889 B18R2.9259 Clc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000755918 [0,1,0,0,0,0|3,0,0]=4 890 B18R2.9259 Clc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000755918_100000184707 [0,1,0,0,0,0|3,0,0]=4 891 B18R2.9259 Clc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100000755918_100012349665 [0,1,0,0,0,0|3,0,0]=4 892 B18R2.9259 Clc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000755918 [0,1,0,0,0,0|3,0,0]=4 893 B18R2.9259 Fc1cc(ccc1Br)CSc2ccc(cc2)Br 62a_100000752885_100000767054 [0,1,0,0,0,0|3,0,0]=4 894 B18R2.9259 Fc1cc(ccc1Br)CSc2ccc(cc2)Br 62a_100000767054_100000752885 [0,1,0,0,0,0|3,0,0]=4 895 B18R2.9259 Fc1cc(ccc1Br)CSc2ccc(cc2)Cl 62a_100000755918_100000767054 [0,1,0,0,0,0|3,0,0]=4 896 B18R2.9259 Fc1cc(ccc1Br)CSc2ccc(cc2)Cl 62a_100000767054_100000755918 [0,1,0,0,0,0|3,0,0]=4 897 B18R2.9259 Fc1cc(ccc1Cl)CSc2ccc(cc2)Br 62a_100000716492_100000752885 [0,1,0,0,0,0|3,0,0]=4 898 B18R2.9259 Fc1cc(ccc1Cl)CSc2ccc(cc2)Br 62a_100000752885_100000716492 [0,1,0,0,0,0|3,0,0]=4 899 B18R2.9259 Fc1cc(ccc1Cl)CSc2ccc(cc2)Cl 62a_100000716492_100000755918 [0,1,0,0,0,0|3,0,0]=4 900 B18R2.9259 Fc1cc(ccc1Cl)CSc2ccc(cc2)Cl 62a_100000755918_100000716492 [0,1,0,0,0,0|3,0,0]=4 901 B18R2.9259 Fc1cc(ccc1I)CSc2ccc(cc2)Br 62a_100000752885_100010149604 [0,1,0,0,0,0|3,0,0]=4 902 B18R2.9259 Fc1cc(ccc1I)CSc2ccc(cc2)Br 62a_100010149604_100000752885 [0,1,0,0,0,0|3,0,0]=4 903 B18R2.9259 Fc1cc(ccc1I)CSc2ccc(cc2)Cl 62a_100000755918_100010149604 [0,1,0,0,0,0|3,0,0]=4 904 B18R2.9259 Fc1cc(ccc1I)CSc2ccc(cc2)Cl 62a_100010149604_100000755918 [0,1,0,0,0,0|3,0,0]=4 905 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100000211213_100012353900 [0,1,0,0,0,0|3,0,0]=4 906 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000211213 [0,1,0,0,0,0|3,0,0]=4 907 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100000211213_100012353894 [0,1,0,0,0,0|3,0,0]=4 908 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000211213 [0,1,0,0,0,0|3,0,0]=4 909 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100000211213_100011206884 [0,1,0,0,0,0|3,0,0]=4 910 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000211213 [0,1,0,0,0,0|3,0,0]=4 911 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100000211213_100012353895 [0,1,0,0,0,0|3,0,0]=4 912 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000211213 [0,1,0,0,0,0|3,0,0]=4 913 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000211213 [0,1,0,0,0,0|3,0,0]=4 914 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000211213_100000184707 [0,1,0,0,0,0|3,0,0]=4 915 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000211213_100011934319 [0,1,0,0,0,0|3,0,0]=4 916 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000211213 [0,1,0,0,0,0|3,0,0]=4 917 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100000211213_100012349665 [0,1,0,0,0,0|3,0,0]=4 918 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000211213 [0,1,0,0,0,0|3,0,0]=4 919 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000211213_100000767054 [0,1,0,0,0,0|3,0,0]=4 920 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000211213 [0,1,0,0,0,0|3,0,0]=4 921 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000211213_100000716492 [0,1,0,0,0,0|3,0,0]=4 922 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000211213 [0,1,0,0,0,0|3,0,0]=4 923 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000211213_100000757363 [0,1,0,0,0,0|3,0,0]=4 924 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000757363_100000211213 [0,1,0,0,0,0|3,0,0]=4 925 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100000211213_100010149604 [0,1,0,0,0,0|3,0,0]=4 926 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100010149604_100000211213 [0,1,0,0,0,0|3,0,0]=4 927 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100000211213_100010146616 [0,1,0,0,0,0|3,0,0]=4 928 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000211213 [0,1,0,0,0,0|3,0,0]=4 929 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100000211213_100010188208 [0,1,0,0,0,0|3,0,0]=4 930 B18R2.9259 Fc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100010188208_100000211213 [0,1,0,0,0,0|3,0,0]=4 931 B18R2.9259 Fc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_100000752885_100011206884 [0,1,0,0,0,0|3,0,0]=4 932 B18R2.9259 Fc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_100011206884_100000752885 [0,1,0,0,0,0|3,0,0]=4 933 B18R2.9259 Fc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_100000755918_100011206884 [0,1,0,0,0,0|3,0,0]=4 934 B18R2.9259 Fc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_100011206884_100000755918 [0,1,0,0,0,0|3,0,0]=4 935 B18R2.9259 Fc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100000717365_100000752885 [0,1,0,0,0,0|3,0,0]=4 936 B18R2.9259 Fc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100000752885_100011934319 [0,1,0,0,0,0|3,0,0]=4 937 B18R2.9259 Fc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100000717365_100000755918 [0,1,0,0,0,0|3,0,0]=4 938 B18R2.9259 Fc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100000755918_100011934319 [0,1,0,0,0,0|3,0,0]=4 939 B18R2.9259 Fc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100000752885_100000757363 [0,1,0,0,0,0|3,0,0]=4 940 B18R2.9259 Fc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100000757363_100000752885 [0,1,0,0,0,0|3,0,0]=4 941 B18R2.9259 Fc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100000755918_100000757363 [0,1,0,0,0,0|3,0,0]=4 942 B18R2.9259 Fc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100000757363_100000755918 [0,1,0,0,0,0|3,0,0]=4 943 B18R2.9259 Fc1ccc(cc1I)CSc2ccc(cc2)Br 62a_100000752885_100010188208 [0,1,0,0,0,0|3,0,0]=4 944 B18R2.9259 Fc1ccc(cc1I)CSc2ccc(cc2)Br 62a_100010188208_100000752885 [0,1,0,0,0,0|3,0,0]=4 945 B18R2.9259 Fc1ccc(cc1I)CSc2ccc(cc2)Cl 62a_100000755918_100010188208 [0,1,0,0,0,0|3,0,0]=4 946 B18R2.9259 Fc1ccc(cc1I)CSc2ccc(cc2)Cl 62a_100010188208_100000755918 [0,1,0,0,0,0|3,0,0]=4 947 B18R2.9259 Nc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100000185761_100000010605 [0,1,0,0,0,0|0,0,0]=1 948 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100000185761_100012353900 [0,1,0,0,0,0|3,0,0]=4 949 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000185761 [0,1,0,0,0,0|3,0,0]=4 950 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100000185761_100012353894 [0,1,0,0,0,0|3,0,0]=4 951 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000185761 [0,1,0,0,0,0|3,0,0]=4 952 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100000185761_100011206884 [0,1,0,0,0,0|3,0,0]=4 953 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000185761 [0,1,0,0,0,0|3,0,0]=4 954 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100000185761_100012353895 [0,1,0,0,0,0|3,0,0]=4 955 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000185761 [0,1,0,0,0,0|3,0,0]=4 956 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000185761 [0,1,0,0,0,0|3,0,0]=4 957 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000185761_100000184707 [0,1,0,0,0,0|3,0,0]=4 958 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000185761_100011934319 [0,1,0,0,0,0|3,0,0]=4 959 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000185761 [0,1,0,0,0,0|3,0,0]=4 960 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100000185761_100012349665 [0,1,0,0,0,0|3,0,0]=4 961 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000185761 [0,1,0,0,0,0|3,0,0]=4 962 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000185761_100000767054 [0,1,0,0,0,0|3,0,0]=4 963 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000185761 [0,1,0,0,0,0|3,0,0]=4 964 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000185761_100000716492 [0,1,0,0,0,0|3,0,0]=4 965 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000185761 [0,1,0,0,0,0|3,0,0]=4 966 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000185761_100000757363 [0,1,0,0,0,0|3,0,0]=4 967 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000757363_100000185761 [0,1,0,0,0,0|3,0,0]=4 968 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100000185761_100010149604 [0,1,0,0,0,0|3,0,0]=4 969 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100010149604_100000185761 [0,1,0,0,0,0|3,0,0]=4 970 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100000185761_100010146616 [0,1,0,0,0,0|3,0,0]=4 971 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000185761 [0,1,0,0,0,0|3,0,0]=4 972 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100000185761_100010188208 [0,1,0,0,0,0|3,0,0]=4 973 B18R2.9259 Nc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100010188208_100000185761 [0,1,0,0,0,0|3,0,0]=4 974 B18R2.9259 Nc1ccc(cn1)OCc2cc(=O)c(co2)O 7a_100015188713_100000010605 [0,1,0,0,0,0|1,1,0]=3 975 B18R2.9259 Nc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000187370_100000010605 [0,1,0,0,0,0|1,0,0]=2 976 B18R2.9259 Nc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000737798_100000010605 [0,1,0,0,0,0|1,0,0]=2 977 B18R2.9259 Nc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100010219413_100000010605 [0,1,0,0,0,0|2,0,0]=3 978 B18R2.9259 Nc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100000744751_100000010605 [0,1,0,0,0,0|2,0,0]=3 979 B18R2.9259 Nc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000068403_100000010605 [0,1,0,0,0,0|2,0,0]=3 980 B18R2.9259 Nc1ncc(cn1)OCc2cc(=O)c(co2)O 7a_100000087137_100000010605 [0,1,0,0,0,0|2,1,0]=4 981 B18R2.9259 Nc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100000766020_100000010605 [0,1,0,0,0,0|2,0,0]=3 982 B18R2.9259 Nc1ncc(nn1)SCc2cc(=O)c(co2)O 62a_100000691435_100000010605 [0,1,0,0,0,0|3,0,0]=4 983 B18R2.9259 O=c1cc(occ1O)CNc2ccc(cc2)Br 2230a_100000210018_100000010605 [0,1,0,0,0,0|1,0,0]=2 984 B18R2.9259 O=c1cc(occ1O)CNc2ccc(cc2)Cl 2230a_100000210052_100000010605 [0,1,0,0,0,0|1,0,0]=2 985 B18R2.9259 O=c1cc(occ1O)COc2ccc(cc2)Br 7a_100000185759_100000010605 [0,1,0,0,0,0|0,1,0]=2 986 B18R2.9259 O=c1cc(occ1O)COc2ccc(cc2)Cl 7a_100000210216_100000010605 [0,1,0,0,0,0|0,1,0]=2 987 B18R2.9259 O=c1cc(occ1O)COc2ccc(cc2)I 7a_100000212066_100000010605 [0,1,0,0,0,0|0,1,0]=2 988 B18R2.9259 O=c1cc(occ1O)COc2ccc(nc2)Br 7a_100000685995_100000010605 [0,1,0,0,0,0|1,1,0]=3 989 B18R2.9259 O=c1cc(occ1O)COc2ccc(nc2)Cl 7a_100000744096_100000010605 [0,1,0,0,0,0|1,1,0]=3 990 B18R2.9259 O=c1cc(occ1O)COc2ccc(nc2)F 7a_100000688820_100000010605 [0,1,0,0,0,0|1,1,0]=3 991 B18R2.9259 O=c1cc(occ1O)COc2ccc(nc2)I 7a_100000687607_100000010605 [0,1,0,0,0,0|1,1,0]=3 992 B18R2.9259 O=c1cc(occ1O)COc2cnc(nc2)Br 7a_100000730009_100000010605 [0,1,0,0,0,0|2,1,0]=4 993 B18R2.9259 O=c1cc(occ1O)COc2cnc(nc2)Cl 7a_100000092845_100000010605 [0,1,0,0,0,0|2,1,0]=4 994 B18R2.9259 O=c1cc(occ1O)COc2cnc(nc2)F 7a_200009874573_100000010605 [0,1,0,0,0,0|2,1,0]=4 995 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cc2)Br 62a_100000752885_100000010605 [0,1,0,0,0,0|0,0,0]=1 996 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cc2)Cl 62a_100000755918_100000010605 [0,1,0,0,0,0|0,0,0]=1 997 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cc2)F 62a_100000211213_100000010605 [0,1,0,0,0,0|0,0,0]=1 998 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cn2)Br 62a_100000686858_100000010605 [0,1,0,0,0,0|1,0,0]=2 999 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cn2)Cl 62a_100011356976_100000010605 [0,1,0,0,0,0|1,0,0]=2 1000 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cn2)F 62a_100000744514_100000010605 [0,1,0,0,0,0|1,0,0]=2 1001 B18R2.9259 O=c1cc(occ1O)CSc2ccc(cn2)O 62a_100000685995_100000010605 [0,1,0,0,0,0|1,0,0]=2 1002 B18R2.9259 O=c1cc(occ1O)CSc2ccc(nc2)Br 62a_100009814638_100000010605 [0,1,0,0,0,0|1,0,0]=2 1003 B18R2.9259 O=c1cc(occ1O)CSc2ccc(nc2)Cl 62a_100000034144_100000010605 [0,1,0,0,0,0|1,0,0]=2 1004 B18R2.9259 O=c1cc(occ1O)CSc2ccc(nc2)F 62a_100000042367_100000010605 [0,1,0,0,0,0|1,0,0]=2 1005 B18R2.9259 O=c1cc(occ1O)CSc2ccc(nn2)Cl 62a_100000068654_100000010605 [0,1,0,0,0,0|2,0,0]=3 1006 B18R2.9259 O=c1cc(occ1O)CSc2cnc(cn2)Br 62a_100010187541_100000010605 [0,1,0,0,0,0|2,0,0]=3 1007 B18R2.9259 O=c1cc(occ1O)CSc2cnc(cn2)Cl 62a_100010214907_100000010605 [0,1,0,0,0,0|2,0,0]=3 1008 B18R2.9259 O=c1cc(occ1O)CSc2cnc(cn2)F 62a_100009856528_100000010605 [0,1,0,0,0,0|2,0,0]=3 1009 B18R2.9259 O=c1cc(occ1O)CSc2cnc(cn2)O 62a_100011934580_100000010605 [0,1,0,0,0,0|2,0,0]=3 1010 B18R2.9259 O=c1cc(occ1O)CSc2cnc(nc2)Br 62a_200012349914_100000010605 [0,1,0,0,0,0|2,0,0]=3 1011 B18R2.9259 O=c1cc(occ1O)CSc2cnc(nc2)Cl 62a_100000059775_100000010605 [0,1,0,0,0,0|2,0,0]=3 1012 B18R2.9259 O=c1cc(occ1O)CSc2cnc(nc2)F 62a_100000685262_100000010605 [0,1,0,0,0,0|2,0,0]=3 1013 B18R2.9259 O=c1cc(occ1O)CSc2ncc(cn2)Br 62a_100000690281_100000010605 [0,1,0,0,0,0|2,0,0]=3 1014 B18R2.9259 O=c1cc(occ1O)CSc2ncc(cn2)Cl 62a_100011356929_100000010605 [0,1,0,0,0,0|2,0,0]=3 1015 B18R2.9259 O=c1cc(occ1O)CSc2ncc(cn2)F 62a_100000685220_100000010605 [0,1,0,0,0,0|2,0,0]=3 1016 B18R2.9259 O=c1cc(occ1O)CSc2ncc(cn2)O 62a_100000730009_100000010605 [0,1,0,0,0,0|2,0,0]=3 1017 B18R2.9259 O=c1ccc(c[nH]1)SCc2cc(=O)c(co2)O 62a_100000212171_100000010605 [0,1,0,0,0,0|1,0,0]=2 1018 B18R2.9259 O=c1ccc(n[nH]1)SCc2cc(=O)c(co2)O 62a_100009820020_100000010605 [0,1,0,0,0,0|2,0,0]=3 1019 B18R2.9259 O=c1ncc(c[nH]1)SCc2cc(=O)c(co2)O 62a_102495366499_100000010605 [0,1,0,0,0,0|2,0,0]=3 1020 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000185759 [0,1,0,0,0,0|3,0,0]=4 1021 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000185759 [0,1,0,0,0,0|3,0,0]=4 1022 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000185759 [0,1,0,0,0,0|3,0,0]=4 1023 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000185759 [0,1,0,0,0,0|3,0,0]=4 1024 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000185759 [0,1,0,0,0,0|3,0,0]=4 1025 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000185759 [0,1,0,0,0,0|3,0,0]=4 1026 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000185759 [0,1,0,0,0,0|3,0,0]=4 1027 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000185759 [0,1,0,0,0,0|3,0,0]=4 1028 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000185759 [0,1,0,0,0,0|3,0,0]=4 1029 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)F)F 62a_100000757363_100000185759 [0,1,0,0,0,0|3,0,0]=4 1030 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)F)I 62a_100010149604_100000185759 [0,1,0,0,0,0|3,0,0]=4 1031 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000185759 [0,1,0,0,0,0|3,0,0]=4 1032 B18R2.9259 Oc1ccc(cc1)SCc2ccc(c(c2)I)F 62a_100010188208_100000185759 [0,1,0,0,0,0|3,0,0]=4 1033 B18R2.32351 Cc1ccc(c(c1F)F)CSc2ccccc2 62a_100000719477_100009813564 [0,1,0,0,0,0|3,0,0]=4 1034 B18R2.32351 Cc1ccc(c(c1F)F)CSc2ccccc2 62a_100009813564_100000041952 [0,1,0,0,0,0|3,0,0]=4 1035 B18R2.32351 Fc1ccc(c(c1Cl)F)CSc2ccccc2 62a_100000719477_100009814552 [0,1,0,0,0,0|3,0,0]=4 1036 B18R2.32351 Fc1ccc(c(c1Cl)F)CSc2ccccc2 62a_100009814552_100000041952 [0,1,0,0,0,0|3,0,0]=4 1037 B18R2.32351 Fc1ccc(c(c1F)Br)CSc2ccccc2 62a_100000719477_100016216887 [0,1,0,0,0,0|3,0,0]=4 1038 B18R2.32351 Fc1ccc(c(c1F)Br)CSc2ccccc2 62a_100016216887_100000041952 [0,1,0,0,0,0|3,0,0]=4 1039 B18R2.32351 Fc1ccc(c(c1F)F)CSc2ccccc2 62a_100000719477_100011218744 [0,1,0,0,0,0|3,0,0]=4 1040 B18R2.32351 Fc1ccc(c(c1F)F)CSc2ccccc2 62a_100011218744_100000041952 [0,1,0,0,0,0|3,0,0]=4 1041 B18R2.38706 Cc1cc(cc(c1F)C)CSc2ccccc2 62a_100000719477_100011352456 [0,1,0,0,0,0|3,0,0]=4 1042 B18R2.38706 Cc1cc(cc(c1F)C)CSc2ccccc2 62a_100011352456_100000041952 [0,1,0,0,0,0|3,0,0]=4 1043 B18R2.38706 Cc1cc(cc(c1O)C)CNc2ccccc2 270302a_100000106764_100000184764 [0,1,0,0,0,0|3,0,0]=4 1044 B18R2.38706 Fc1cc(cc(c1Cl)F)CSc2ccccc2 62a_100000719477_100010769323 [0,1,0,0,0,0|3,0,0]=4 1045 B18R2.38706 Fc1cc(cc(c1Cl)F)CSc2ccccc2 62a_100010769323_100000041952 [0,1,0,0,0,0|3,0,0]=4 1046 B18R2.38706 Fc1cc(cc(c1F)F)CSc2ccccc2 62a_100000719477_100011216845 [0,1,0,0,0,0|3,0,0]=4 1047 B18R2.38706 Fc1cc(cc(c1F)F)CSc2ccccc2 62a_100011216845_100000041952 [0,1,0,0,0,0|3,0,0]=4 1048 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2Br 62a_100000695589_100000727479 [0,1,0,0,0,0|3,0,0]=4 1049 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2Br 62a_100000727479_100000695589 [0,1,0,0,0,0|3,0,0]=4 1050 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2C 62a_100000210755_100000727479 [0,1,0,0,0,0|3,0,0]=4 1051 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2C 62a_100000727479_100000210755 [0,1,0,0,0,0|3,0,0]=4 1052 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2Cl 62a_100000727479_100000764095 [0,1,0,0,0,0|3,0,0]=4 1053 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2Cl 62a_100000764095_100000727479 [0,1,0,0,0,0|3,0,0]=4 1054 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2F 62a_100000727479_100011215700 [0,1,0,0,0,0|3,0,0]=4 1055 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2F 62a_100011215700_100000727479 [0,1,0,0,0,0|3,0,0]=4 1056 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2N 62a_100000210017_100000727479 [0,1,0,0,0,0|3,0,0]=4 1057 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2N 62a_100000727479_100000210017 [0,1,0,0,0,0|3,0,0]=4 1058 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2O 62a_100000727479_100000739446 [0,1,0,0,0,0|3,0,0]=4 1059 B18R2.39765 Cc1cc(ccc1Br)CSc2ccccc2O 62a_100000739446_100000727479 [0,1,0,0,0,0|3,0,0]=4 1060 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2Br 62a_100000695589_100012184735 [0,1,0,0,0,0|3,0,0]=4 1061 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2Br 62a_100012184735_100000695589 [0,1,0,0,0,0|3,0,0]=4 1062 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2C 62a_100000210755_100012184735 [0,1,0,0,0,0|3,0,0]=4 1063 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2C 62a_100012184735_100000210755 [0,1,0,0,0,0|3,0,0]=4 1064 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2Cl 62a_100000764095_100012184735 [0,1,0,0,0,0|3,0,0]=4 1065 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2Cl 62a_100012184735_100000764095 [0,1,0,0,0,0|3,0,0]=4 1066 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2F 62a_100011215700_100012184735 [0,1,0,0,0,0|3,0,0]=4 1067 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2F 62a_100012184735_100011215700 [0,1,0,0,0,0|3,0,0]=4 1068 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2N 62a_100000210017_100012184735 [0,1,0,0,0,0|3,0,0]=4 1069 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2N 62a_100012184735_100000210017 [0,1,0,0,0,0|3,0,0]=4 1070 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2O 62a_100000739446_100012184735 [0,1,0,0,0,0|3,0,0]=4 1071 B18R2.39765 Cc1cc(ccc1Cl)CSc2ccccc2O 62a_100012184735_100000739446 [0,1,0,0,0,0|3,0,0]=4 1072 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2Br 62a_100000695589_100011216667 [0,1,0,0,0,0|3,0,0]=4 1073 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2Br 62a_100011216667_100000695589 [0,1,0,0,0,0|3,0,0]=4 1074 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2C 62a_100000210755_100011216667 [0,1,0,0,0,0|3,0,0]=4 1075 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2C 62a_100011216667_100000210755 [0,1,0,0,0,0|3,0,0]=4 1076 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2Cl 62a_100000764095_100011216667 [0,1,0,0,0,0|3,0,0]=4 1077 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2Cl 62a_100011216667_100000764095 [0,1,0,0,0,0|3,0,0]=4 1078 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2F 62a_100011215700_100011216667 [0,1,0,0,0,0|3,0,0]=4 1079 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2F 62a_100011216667_100011215700 [0,1,0,0,0,0|3,0,0]=4 1080 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2N 62a_100000210017_100011216667 [0,1,0,0,0,0|3,0,0]=4 1081 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2N 62a_100011216667_100000210017 [0,1,0,0,0,0|3,0,0]=4 1082 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2O 62a_100000739446_100011216667 [0,1,0,0,0,0|3,0,0]=4 1083 B18R2.39765 Cc1cc(ccc1F)CSc2ccccc2O 62a_100011216667_100000739446 [0,1,0,0,0,0|3,0,0]=4 1084 B18R2.39765 Cc1cc(ccc1O)CNc2ccccc2C 270302a_100015192222_100011215669 [0,1,0,0,0,0|3,0,0]=4 1085 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2Br 62a_100000695589_100012232412 [0,1,0,0,0,0|3,0,0]=4 1086 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2Br 62a_100012232412_100000695589 [0,1,0,0,0,0|3,0,0]=4 1087 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2C 62a_100000210755_100012232412 [0,1,0,0,0,0|3,0,0]=4 1088 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2C 62a_100012232412_100000210755 [0,1,0,0,0,0|3,0,0]=4 1089 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2Cl 62a_100000764095_100012232412 [0,1,0,0,0,0|3,0,0]=4 1090 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2Cl 62a_100012232412_100000764095 [0,1,0,0,0,0|3,0,0]=4 1091 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2F 62a_100011215700_100012232412 [0,1,0,0,0,0|3,0,0]=4 1092 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2F 62a_100012232412_100011215700 [0,1,0,0,0,0|3,0,0]=4 1093 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2N 62a_100000210017_100012232412 [0,1,0,0,0,0|3,0,0]=4 1094 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2N 62a_100012232412_100000210017 [0,1,0,0,0,0|3,0,0]=4 1095 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2O 62a_100000739446_100012232412 [0,1,0,0,0,0|3,0,0]=4 1096 B18R2.39765 Cc1ccc(cc1Br)CSc2ccccc2O 62a_100012232412_100000739446 [0,1,0,0,0,0|3,0,0]=4 1097 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2Br 62a_100000695589_100000742320 [0,1,0,0,0,0|3,0,0]=4 1098 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2Br 62a_100000742320_100000695589 [0,1,0,0,0,0|3,0,0]=4 1099 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2C 62a_100000210755_100000742320 [0,1,0,0,0,0|3,0,0]=4 1100 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2C 62a_100000742320_100000210755 [0,1,0,0,0,0|3,0,0]=4 1101 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2Cl 62a_100000742320_100000764095 [0,1,0,0,0,0|3,0,0]=4 1102 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2Cl 62a_100000764095_100000742320 [0,1,0,0,0,0|3,0,0]=4 1103 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2F 62a_100000742320_100011215700 [0,1,0,0,0,0|3,0,0]=4 1104 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2F 62a_100011215700_100000742320 [0,1,0,0,0,0|3,0,0]=4 1105 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2N 62a_100000210017_100000742320 [0,1,0,0,0,0|3,0,0]=4 1106 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2N 62a_100000742320_100000210017 [0,1,0,0,0,0|3,0,0]=4 1107 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2O 62a_100000739446_100000742320 [0,1,0,0,0,0|3,0,0]=4 1108 B18R2.39765 Cc1ccc(cc1C)CSc2ccccc2O 62a_100000742320_100000739446 [0,1,0,0,0,0|3,0,0]=4 1109 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2Br 62a_100000695589_100011823929 [0,1,0,0,0,0|3,0,0]=4 1110 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2Br 62a_100011823929_100000695589 [0,1,0,0,0,0|3,0,0]=4 1111 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2C 62a_100000210755_100011823929 [0,1,0,0,0,0|3,0,0]=4 1112 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2C 62a_100011823929_100000210755 [0,1,0,0,0,0|3,0,0]=4 1113 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000764095_100011823929 [0,1,0,0,0,0|3,0,0]=4 1114 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100011823929_100000764095 [0,1,0,0,0,0|3,0,0]=4 1115 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2F 62a_100011215700_100011823929 [0,1,0,0,0,0|3,0,0]=4 1116 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2F 62a_100011823929_100011215700 [0,1,0,0,0,0|3,0,0]=4 1117 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2N 62a_100000210017_100011823929 [0,1,0,0,0,0|3,0,0]=4 1118 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2N 62a_100011823929_100000210017 [0,1,0,0,0,0|3,0,0]=4 1119 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2O 62a_100000739446_100011823929 [0,1,0,0,0,0|3,0,0]=4 1120 B18R2.39765 Cc1ccc(cc1Cl)CSc2ccccc2O 62a_100011823929_100000739446 [0,1,0,0,0,0|3,0,0]=4 1121 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2Br 62a_100000695589_100011217369 [0,1,0,0,0,0|3,0,0]=4 1122 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2Br 62a_100011217369_100000695589 [0,1,0,0,0,0|3,0,0]=4 1123 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2C 62a_100000210755_100011217369 [0,1,0,0,0,0|3,0,0]=4 1124 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2C 62a_100011217369_100000210755 [0,1,0,0,0,0|3,0,0]=4 1125 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2Cl 62a_100000764095_100011217369 [0,1,0,0,0,0|3,0,0]=4 1126 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2Cl 62a_100011217369_100000764095 [0,1,0,0,0,0|3,0,0]=4 1127 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2F 62a_100011215700_100011217369 [0,1,0,0,0,0|3,0,0]=4 1128 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2F 62a_100011217369_100011215700 [0,1,0,0,0,0|3,0,0]=4 1129 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2N 62a_100000210017_100011217369 [0,1,0,0,0,0|3,0,0]=4 1130 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2N 62a_100011217369_100000210017 [0,1,0,0,0,0|3,0,0]=4 1131 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2O 62a_100000739446_100011217369 [0,1,0,0,0,0|3,0,0]=4 1132 B18R2.39765 Cc1ccc(cc1F)CSc2ccccc2O 62a_100011217369_100000739446 [0,1,0,0,0,0|3,0,0]=4 1133 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2Br 62a_100000695589_100010206137 [0,1,0,0,0,0|3,0,0]=4 1134 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2Br 62a_100010206137_100000695589 [0,1,0,0,0,0|3,0,0]=4 1135 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2C 62a_100000210755_100010206137 [0,1,0,0,0,0|3,0,0]=4 1136 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2C 62a_100010206137_100000210755 [0,1,0,0,0,0|3,0,0]=4 1137 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2Cl 62a_100000764095_100010206137 [0,1,0,0,0,0|3,0,0]=4 1138 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2Cl 62a_100010206137_100000764095 [0,1,0,0,0,0|3,0,0]=4 1139 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2F 62a_100010206137_100011215700 [0,1,0,0,0,0|3,0,0]=4 1140 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2F 62a_100011215700_100010206137 [0,1,0,0,0,0|3,0,0]=4 1141 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2N 62a_100000210017_100010206137 [0,1,0,0,0,0|3,0,0]=4 1142 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2N 62a_100010206137_100000210017 [0,1,0,0,0,0|3,0,0]=4 1143 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2O 62a_100000739446_100010206137 [0,1,0,0,0,0|3,0,0]=4 1144 B18R2.39765 Cc1ccc(cc1I)CSc2ccccc2O 62a_100010206137_100000739446 [0,1,0,0,0,0|3,0,0]=4 1145 B18R2.39765 Cc1ccccc1OCc2cc(=O)c(co2)O 7a_100000210338_100000010605 [0,1,0,0,0,0|0,1,0]=2 1146 B18R2.39765 Cc1ccccc1SCc2cc(=O)c(co2)O 62a_100000210755_100000010605 [0,1,0,0,0,0|0,0,0]=1 1147 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100000210755_100012353900 [0,1,0,0,0,0|3,0,0]=4 1148 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100012353900_100000210755 [0,1,0,0,0,0|3,0,0]=4 1149 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100000210755_100012353894 [0,1,0,0,0,0|3,0,0]=4 1150 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000210755 [0,1,0,0,0,0|3,0,0]=4 1151 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)F 62a_100000210755_100011206884 [0,1,0,0,0,0|3,0,0]=4 1152 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Br)F 62a_100011206884_100000210755 [0,1,0,0,0,0|3,0,0]=4 1153 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100000210755_100012353895 [0,1,0,0,0,0|3,0,0]=4 1154 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000210755 [0,1,0,0,0,0|3,0,0]=4 1155 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000210755 [0,1,0,0,0,0|3,0,0]=4 1156 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000210755_100000184707 [0,1,0,0,0,0|3,0,0]=4 1157 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000210755_100011934319 [0,1,0,0,0,0|3,0,0]=4 1158 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000717365_100000210755 [0,1,0,0,0,0|3,0,0]=4 1159 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100000210755_100012349665 [0,1,0,0,0,0|3,0,0]=4 1160 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100012349665_100000210755 [0,1,0,0,0,0|3,0,0]=4 1161 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000210755_100000767054 [0,1,0,0,0,0|3,0,0]=4 1162 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000767054_100000210755 [0,1,0,0,0,0|3,0,0]=4 1163 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000210755_100000716492 [0,1,0,0,0,0|3,0,0]=4 1164 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000716492_100000210755 [0,1,0,0,0,0|3,0,0]=4 1165 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)F 62a_100000210755_100000757363 [0,1,0,0,0,0|3,0,0]=4 1166 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)F 62a_100000757363_100000210755 [0,1,0,0,0,0|3,0,0]=4 1167 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)I 62a_100000210755_100010149604 [0,1,0,0,0,0|3,0,0]=4 1168 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)F)I 62a_100010149604_100000210755 [0,1,0,0,0,0|3,0,0]=4 1169 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)I)Br 62a_100000210755_100010146616 [0,1,0,0,0,0|3,0,0]=4 1170 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)I)Br 62a_100010146616_100000210755 [0,1,0,0,0,0|3,0,0]=4 1171 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)I)F 62a_100000210755_100010188208 [0,1,0,0,0,0|3,0,0]=4 1172 B18R2.39765 Cc1ccccc1SCc2ccc(c(c2)I)F 62a_100010188208_100000210755 [0,1,0,0,0,0|3,0,0]=4 1173 B18R2.39765 Cc1cccnc1SCc2cc(=O)c(co2)O 62a_100000751373_100000010605 [0,1,0,0,0,0|1,0,0]=2 1174 B18R2.39765 Cc1ccncc1OCc2cc(=O)c(co2)O 7a_100011997053_100000010605 [0,1,0,0,0,0|1,1,0]=3 1175 B18R2.39765 Cc1ccncc1SCc2cc(=O)c(co2)O 62a_100000761580_100000010605 [0,1,0,0,0,0|1,0,0]=2 1176 B18R2.39765 Cc1cnccc1SCc2cc(=O)c(co2)O 62a_100000765111_100000010605 [0,1,0,0,0,0|1,0,0]=2 1177 B18R2.39765 Cc1cncnc1SCc2cc(=O)c(co2)O 62a_100011998708_100000010605 [0,1,0,0,0,0|2,0,0]=3 1178 B18R2.39765 Cc1ncccc1OCc2cc(=O)c(co2)O 7a_100000745507_100000010605 [0,1,0,0,0,0|1,1,0]=3 1179 B18R2.39765 Cc1ncccc1SCc2cc(=O)c(co2)O 62a_100000751574_100000010605 [0,1,0,0,0,0|1,0,0]=2 1180 B18R2.39765 Cc1nccnc1SCc2cc(=O)c(co2)O 62a_100011999405_100000010605 [0,1,0,0,0,0|2,0,0]=3 1181 B18R2.39765 Cc1ncncc1SCc2cc(=O)c(co2)O 62a_100009819671_100000010605 [0,1,0,0,0,0|2,0,0]=3 1182 B18R2.39765 Clc1cc(ccc1I)CSc2ccccc2Cl 62a_100000764095_100012349665 [0,1,0,0,0,0|3,0,0]=4 1183 B18R2.39765 Clc1cc(ccc1I)CSc2ccccc2Cl 62a_100012349665_100000764095 [0,1,0,0,0,0|3,0,0]=4 1184 B18R2.39765 Clc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000184707_100000764095 [0,1,0,0,0,0|3,0,0]=4 1185 B18R2.39765 Clc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000764095_100000184707 [0,1,0,0,0,0|3,0,0]=4 1186 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2Br 62a_100000695589_100000767054 [0,1,0,0,0,0|3,0,0]=4 1187 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2Br 62a_100000767054_100000695589 [0,1,0,0,0,0|3,0,0]=4 1188 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2Cl 62a_100000764095_100000767054 [0,1,0,0,0,0|3,0,0]=4 1189 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2Cl 62a_100000767054_100000764095 [0,1,0,0,0,0|3,0,0]=4 1190 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2F 62a_100000767054_100011215700 [0,1,0,0,0,0|3,0,0]=4 1191 B18R2.39765 Fc1cc(ccc1Br)CSc2ccccc2F 62a_100011215700_100000767054 [0,1,0,0,0,0|3,0,0]=4 1192 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2Br 62a_100000695589_100000716492 [0,1,0,0,0,0|3,0,0]=4 1193 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2Br 62a_100000716492_100000695589 [0,1,0,0,0,0|3,0,0]=4 1194 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2Cl 62a_100000716492_100000764095 [0,1,0,0,0,0|3,0,0]=4 1195 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2Cl 62a_100000764095_100000716492 [0,1,0,0,0,0|3,0,0]=4 1196 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2F 62a_100000716492_100011215700 [0,1,0,0,0,0|3,0,0]=4 1197 B18R2.39765 Fc1cc(ccc1Cl)CSc2ccccc2F 62a_100011215700_100000716492 [0,1,0,0,0,0|3,0,0]=4 1198 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2Br 62a_100000695589_100010149604 [0,1,0,0,0,0|3,0,0]=4 1199 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2Br 62a_100010149604_100000695589 [0,1,0,0,0,0|3,0,0]=4 1200 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2Cl 62a_100000764095_100010149604 [0,1,0,0,0,0|3,0,0]=4 1201 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2Cl 62a_100010149604_100000764095 [0,1,0,0,0,0|3,0,0]=4 1202 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2F 62a_100010149604_100011215700 [0,1,0,0,0,0|3,0,0]=4 1203 B18R2.39765 Fc1cc(ccc1I)CSc2ccccc2F 62a_100011215700_100010149604 [0,1,0,0,0,0|3,0,0]=4 1204 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2Br 62a_100000695589_100011206884 [0,1,0,0,0,0|3,0,0]=4 1205 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2Br 62a_100011206884_100000695589 [0,1,0,0,0,0|3,0,0]=4 1206 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2Cl 62a_100000764095_100011206884 [0,1,0,0,0,0|3,0,0]=4 1207 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2Cl 62a_100011206884_100000764095 [0,1,0,0,0,0|3,0,0]=4 1208 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2F 62a_100011206884_100011215700 [0,1,0,0,0,0|3,0,0]=4 1209 B18R2.39765 Fc1ccc(cc1Br)CSc2ccccc2F 62a_100011215700_100011206884 [0,1,0,0,0,0|3,0,0]=4 1210 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2Br 62a_100000695589_100011934319 [0,1,0,0,0,0|3,0,0]=4 1211 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2Br 62a_100000717365_100000695589 [0,1,0,0,0,0|3,0,0]=4 1212 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000717365_100000764095 [0,1,0,0,0,0|3,0,0]=4 1213 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000764095_100011934319 [0,1,0,0,0,0|3,0,0]=4 1214 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2F 62a_100000717365_100011215700 [0,1,0,0,0,0|3,0,0]=4 1215 B18R2.39765 Fc1ccc(cc1Cl)CSc2ccccc2F 62a_100011215700_100011934319 [0,1,0,0,0,0|3,0,0]=4 1216 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2Br 62a_100000695589_100000757363 [0,1,0,0,0,0|3,0,0]=4 1217 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2Br 62a_100000757363_100000695589 [0,1,0,0,0,0|3,0,0]=4 1218 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2Cl 62a_100000757363_100000764095 [0,1,0,0,0,0|3,0,0]=4 1219 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2Cl 62a_100000764095_100000757363 [0,1,0,0,0,0|3,0,0]=4 1220 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2F 62a_100000757363_100011215700 [0,1,0,0,0,0|3,0,0]=4 1221 B18R2.39765 Fc1ccc(cc1F)CSc2ccccc2F 62a_100011215700_100000757363 [0,1,0,0,0,0|3,0,0]=4 1222 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2Br 62a_100000695589_100010188208 [0,1,0,0,0,0|3,0,0]=4 1223 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2Br 62a_100010188208_100000695589 [0,1,0,0,0,0|3,0,0]=4 1224 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2Cl 62a_100000764095_100010188208 [0,1,0,0,0,0|3,0,0]=4 1225 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2Cl 62a_100010188208_100000764095 [0,1,0,0,0,0|3,0,0]=4 1226 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2F 62a_100010188208_100011215700 [0,1,0,0,0,0|3,0,0]=4 1227 B18R2.39765 Fc1ccc(cc1I)CSc2ccccc2F 62a_100011215700_100010188208 [0,1,0,0,0,0|3,0,0]=4 1228 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100011215700_100012353900 [0,1,0,0,0,0|3,0,0]=4 1229 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100012353900_100011215700 [0,1,0,0,0,0|3,0,0]=4 1230 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100011215700_100012353894 [0,1,0,0,0,0|3,0,0]=4 1231 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100012353894_100011215700 [0,1,0,0,0,0|3,0,0]=4 1232 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100011215700_100012353895 [0,1,0,0,0,0|3,0,0]=4 1233 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100012353895_100011215700 [0,1,0,0,0,0|3,0,0]=4 1234 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100011215700 [0,1,0,0,0,0|3,0,0]=4 1235 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100011215700_100000184707 [0,1,0,0,0,0|3,0,0]=4 1236 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100011215700_100012349665 [0,1,0,0,0,0|3,0,0]=4 1237 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100012349665_100011215700 [0,1,0,0,0,0|3,0,0]=4 1238 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)I)Br 62a_100010146616_100011215700 [0,1,0,0,0,0|3,0,0]=4 1239 B18R2.39765 Fc1ccccc1SCc2ccc(c(c2)I)Br 62a_100011215700_100010146616 [0,1,0,0,0,0|3,0,0]=4 1240 B18R2.39765 Nc1ccccc1OCc2cc(=O)c(co2)O 7a_100000185747_100000010605 [0,1,0,0,0,0|0,1,0]=2 1241 B18R2.39765 Nc1ccccc1SCc2cc(=O)c(co2)O 62a_100000210017_100000010605 [0,1,0,0,0,0|0,0,0]=1 1242 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100000210017_100012353900 [0,1,0,0,0,0|3,0,0]=4 1243 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100012353900_100000210017 [0,1,0,0,0,0|3,0,0]=4 1244 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100000210017_100012353894 [0,1,0,0,0,0|3,0,0]=4 1245 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000210017 [0,1,0,0,0,0|3,0,0]=4 1246 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)F 62a_100000210017_100011206884 [0,1,0,0,0,0|3,0,0]=4 1247 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Br)F 62a_100011206884_100000210017 [0,1,0,0,0,0|3,0,0]=4 1248 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100000210017_100012353895 [0,1,0,0,0,0|3,0,0]=4 1249 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000210017 [0,1,0,0,0,0|3,0,0]=4 1250 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000210017 [0,1,0,0,0,0|3,0,0]=4 1251 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000210017_100000184707 [0,1,0,0,0,0|3,0,0]=4 1252 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000210017_100011934319 [0,1,0,0,0,0|3,0,0]=4 1253 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000717365_100000210017 [0,1,0,0,0,0|3,0,0]=4 1254 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100000210017_100012349665 [0,1,0,0,0,0|3,0,0]=4 1255 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100012349665_100000210017 [0,1,0,0,0,0|3,0,0]=4 1256 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000210017_100000767054 [0,1,0,0,0,0|3,0,0]=4 1257 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000767054_100000210017 [0,1,0,0,0,0|3,0,0]=4 1258 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000210017_100000716492 [0,1,0,0,0,0|3,0,0]=4 1259 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000716492_100000210017 [0,1,0,0,0,0|3,0,0]=4 1260 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)F 62a_100000210017_100000757363 [0,1,0,0,0,0|3,0,0]=4 1261 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)F 62a_100000757363_100000210017 [0,1,0,0,0,0|3,0,0]=4 1262 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)I 62a_100000210017_100010149604 [0,1,0,0,0,0|3,0,0]=4 1263 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)F)I 62a_100010149604_100000210017 [0,1,0,0,0,0|3,0,0]=4 1264 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)I)Br 62a_100000210017_100010146616 [0,1,0,0,0,0|3,0,0]=4 1265 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)I)Br 62a_100010146616_100000210017 [0,1,0,0,0,0|3,0,0]=4 1266 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)I)F 62a_100000210017_100010188208 [0,1,0,0,0,0|3,0,0]=4 1267 B18R2.39765 Nc1ccccc1SCc2ccc(c(c2)I)F 62a_100010188208_100000210017 [0,1,0,0,0,0|3,0,0]=4 1268 B18R2.39765 Nc1cccnc1SCc2cc(=O)c(co2)O 62a_100000688686_100000010605 [0,1,0,0,0,0|1,0,0]=2 1269 B18R2.39765 Nc1ccncc1SCc2cc(=O)c(co2)O 62a_100000047001_100000010605 [0,1,0,0,0,0|1,0,0]=2 1270 B18R2.39765 Nc1cnccc1SCc2cc(=O)c(co2)O 62a_100000756074_100000010605 [0,1,0,0,0,0|1,0,0]=2 1271 B18R2.39765 Nc1cncnc1SCc2cc(=O)c(co2)O 62a_100000709731_100000010605 [0,1,0,0,0,0|2,0,0]=3 1272 B18R2.39765 Nc1cnncc1SCc2cc(=O)c(co2)O 62a_100009829405_100000010605 [0,1,0,0,0,0|2,0,0]=3 1273 B18R2.39765 Nc1ncccc1OCc2cc(=O)c(co2)O 7a_100000211975_100000010605 [0,1,0,0,0,0|1,1,0]=3 1274 B18R2.39765 Nc1ncccc1SCc2cc(=O)c(co2)O 62a_100000045569_100000010605 [0,1,0,0,0,0|1,0,0]=2 1275 B18R2.39765 Nc1nccnc1SCc2cc(=O)c(co2)O 62a_100000747729_100000010605 [0,1,0,0,0,0|2,0,0]=3 1276 B18R2.39765 Nc1ncncc1OCc2cc(=O)c(co2)O 7a_100000112926_100000010605 [0,1,0,0,0,0|2,1,0]=4 1277 B18R2.39765 Nc1ncncc1SCc2cc(=O)c(co2)O 62a_100011996079_100000010605 [0,1,0,0,0,0|2,0,0]=3 1278 B18R2.39765 O=c1cc(occ1O)COc2cccc[n+]2[O-] 7a_100000211761_100000010605 [0,1,0,0,0,0|1,1,0]=3 1279 B18R2.39765 O=c1cc(occ1O)COc2ccccc2Br 7a_100000181306_100000010605 [0,1,0,0,0,0|0,1,0]=2 1280 B18R2.39765 O=c1cc(occ1O)COc2ccccc2Cl 7a_100000210172_100000010605 [0,1,0,0,0,0|0,1,0]=2 1281 B18R2.39765 O=c1cc(occ1O)COc2ccccc2F 7a_100000210171_100000010605 [0,1,0,0,0,0|0,1,0]=2 1282 B18R2.39765 O=c1cc(occ1O)COc2ccccc2I 7a_100000739446_100000010605 [0,1,0,0,0,0|0,1,0]=2 1283 B18R2.39765 O=c1cc(occ1O)COc2cccnc2Br 7a_100000744436_100000010605 [0,1,0,0,0,0|1,1,0]=3 1284 B18R2.39765 O=c1cc(occ1O)COc2cccnc2Cl 7a_100000757616_100000010605 [0,1,0,0,0,0|1,1,0]=3 1285 B18R2.39765 O=c1cc(occ1O)COc2cccnc2F 7a_100000061740_100000010605 [0,1,0,0,0,0|1,1,0]=3 1286 B18R2.39765 O=c1cc(occ1O)COc2cccnc2I 7a_100000034122_100000010605 [0,1,0,0,0,0|1,1,0]=3 1287 B18R2.39765 O=c1cc(occ1O)COc2cccoc2=O 7a_100000077404_100000010605 [0,1,0,0,0,0|1,1,0]=3 1288 B18R2.39765 O=c1cc(occ1O)CSc2c[nH]ccc2=O 62a_100009998708_100000010605 [0,1,0,0,0,0|1,0,0]=2 1289 B18R2.39765 O=c1cc(occ1O)CSc2c[nH]ccc2=S 62a_200012280681_100000010605 [0,1,0,0,0,0|1,0,0]=2 1290 B18R2.39765 O=c1cc(occ1O)CSc2ccccc2Br 62a_100000695589_100000010605 [0,1,0,0,0,0|0,0,0]=1 1291 B18R2.39765 O=c1cc(occ1O)CSc2ccccc2Cl 62a_100000764095_100000010605 [0,1,0,0,0,0|0,0,0]=1 1292 B18R2.39765 O=c1cc(occ1O)CSc2ccccc2F 62a_100011215700_100000010605 [0,1,0,0,0,0|0,0,0]=1 1293 B18R2.39765 O=c1cc(occ1O)CSc2ccccc2O 62a_100000739446_100000010605 [0,1,0,0,0,0|0,0,0]=1 1294 B18R2.39765 O=c1cc(occ1O)CSc2cccnc2Br 62a_100010202626_100000010605 [0,1,0,0,0,0|1,0,0]=2 1295 B18R2.39765 O=c1cc(occ1O)CSc2cccnc2Cl 62a_100000036424_100000010605 [0,1,0,0,0,0|1,0,0]=2 1296 B18R2.39765 O=c1cc(occ1O)CSc2cccnc2F 62a_100009816115_100000010605 [0,1,0,0,0,0|1,0,0]=2 1297 B18R2.39765 O=c1cc(occ1O)CSc2cccnc2O 62a_100000760158_100000010605 [0,1,0,0,0,0|1,0,0]=2 1298 B18R2.39765 O=c1cc(occ1O)CSc2ccncc2Br 62a_100000726257_100000010605 [0,1,0,0,0,0|1,0,0]=2 1299 B18R2.39765 O=c1cc(occ1O)CSc2ccncc2Cl 62a_100000708259_100000010605 [0,1,0,0,0,0|1,0,0]=2 1300 B18R2.39765 O=c1cc(occ1O)CSc2ccncc2F 62a_100000047030_100000010605 [0,1,0,0,0,0|1,0,0]=2 1301 B18R2.39765 O=c1cc(occ1O)CSc2ccncc2O 62a_100009817591_100000010605 [0,1,0,0,0,0|1,0,0]=2 1302 B18R2.39765 O=c1cc(occ1O)CSc2cnccc2Br 62a_100010138639_100000010605 [0,1,0,0,0,0|1,0,0]=2 1303 B18R2.39765 O=c1cc(occ1O)CSc2cnccc2Cl 62a_100009995489_100000010605 [0,1,0,0,0,0|1,0,0]=2 1304 B18R2.39765 O=c1cc(occ1O)CSc2cnccc2F 62a_100009820683_100000010605 [0,1,0,0,0,0|1,0,0]=2 1305 B18R2.39765 O=c1cc(occ1O)CSc2cncnc2Br 62a_200012461658_100000010605 [0,1,0,0,0,0|2,0,0]=3 1306 B18R2.39765 O=c1cc(occ1O)CSc2cncnc2Cl 62a_100000758962_100000010605 [0,1,0,0,0,0|2,0,0]=3 1307 B18R2.39765 O=c1cc(occ1O)CSc2cncnc2O 62a_100000751107_100000010605 [0,1,0,0,0,0|2,0,0]=3 1308 B18R2.39765 O=c1cc(occ1O)CSc2ncccc2Br 62a_100000696092_100000010605 [0,1,0,0,0,0|1,0,0]=2 1309 B18R2.39765 O=c1cc(occ1O)CSc2ncccc2Cl 62a_100011356963_100000010605 [0,1,0,0,0,0|1,0,0]=2 1310 B18R2.39765 O=c1cc(occ1O)CSc2ncccc2F 62a_100000685392_100000010605 [0,1,0,0,0,0|1,0,0]=2 1311 B18R2.39765 O=c1cc(occ1O)CSc2ncccc2O 62a_100000034122_100000010605 [0,1,0,0,0,0|1,0,0]=2 1312 B18R2.39765 O=c1cc(occ1O)CSc2nccnc2Cl 62a_100010886584_100000010605 [0,1,0,0,0,0|2,0,0]=3 1313 B18R2.39765 O=c1cc(occ1O)CSc2nccnc2F 62a_200010125657_100000010605 [0,1,0,0,0,0|2,0,0]=3 1314 B18R2.39765 O=c1cc(occ1O)CSc2ncncc2F 62a_100000069762_100000010605 [0,1,0,0,0,0|2,0,0]=3 1315 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100000739446_100012353900 [0,1,0,0,0,0|3,0,0]=4 1316 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)Br 62a_100012353900_100000739446 [0,1,0,0,0,0|3,0,0]=4 1317 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100000739446_100012353894 [0,1,0,0,0,0|3,0,0]=4 1318 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000739446 [0,1,0,0,0,0|3,0,0]=4 1319 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)F 62a_100000739446_100011206884 [0,1,0,0,0,0|3,0,0]=4 1320 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Br)F 62a_100011206884_100000739446 [0,1,0,0,0,0|3,0,0]=4 1321 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100000739446_100012353895 [0,1,0,0,0,0|3,0,0]=4 1322 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000739446 [0,1,0,0,0,0|3,0,0]=4 1323 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000739446 [0,1,0,0,0,0|3,0,0]=4 1324 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)Cl 62a_100000739446_100000184707 [0,1,0,0,0,0|3,0,0]=4 1325 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000717365_100000739446 [0,1,0,0,0,0|3,0,0]=4 1326 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)F 62a_100000739446_100011934319 [0,1,0,0,0,0|3,0,0]=4 1327 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100000739446_100012349665 [0,1,0,0,0,0|3,0,0]=4 1328 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)Cl)I 62a_100012349665_100000739446 [0,1,0,0,0,0|3,0,0]=4 1329 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000739446_100000767054 [0,1,0,0,0,0|3,0,0]=4 1330 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)Br 62a_100000767054_100000739446 [0,1,0,0,0,0|3,0,0]=4 1331 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000716492_100000739446 [0,1,0,0,0,0|3,0,0]=4 1332 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)Cl 62a_100000739446_100000716492 [0,1,0,0,0,0|3,0,0]=4 1333 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)F 62a_100000739446_100000757363 [0,1,0,0,0,0|3,0,0]=4 1334 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)F 62a_100000757363_100000739446 [0,1,0,0,0,0|3,0,0]=4 1335 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)I 62a_100000739446_100010149604 [0,1,0,0,0,0|3,0,0]=4 1336 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)F)I 62a_100010149604_100000739446 [0,1,0,0,0,0|3,0,0]=4 1337 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)I)Br 62a_100000739446_100010146616 [0,1,0,0,0,0|3,0,0]=4 1338 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)I)Br 62a_100010146616_100000739446 [0,1,0,0,0,0|3,0,0]=4 1339 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)I)F 62a_100000739446_100010188208 [0,1,0,0,0,0|3,0,0]=4 1340 B18R2.39765 Oc1ccccc1SCc2ccc(c(c2)I)F 62a_100010188208_100000739446 [0,1,0,0,0,0|3,0,0]=4 1341 B18R2.65908 C[n+]1cccc(c1)SCc2cc(=O)c(co2)O 62a_100009996589_100000010605 [0,1,0,0,0,0|1,0,0]=2 1342 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)Br 62a_100000691529_100000727479 [0,1,0,0,0,0|3,0,0]=4 1343 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)Br 62a_100000727479_100000691529 [0,1,0,0,0,0|3,0,0]=4 1344 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)Cl 62a_100000699651_100000727479 [0,1,0,0,0,0|3,0,0]=4 1345 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)Cl 62a_100000727479_100000699651 [0,1,0,0,0,0|3,0,0]=4 1346 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)F 62a_100000685547_100000727479 [0,1,0,0,0,0|3,0,0]=4 1347 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)F 62a_100000727479_100000685547 [0,1,0,0,0,0|3,0,0]=4 1348 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)N 62a_100000210019_100000727479 [0,1,0,0,0,0|3,0,0]=4 1349 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)N 62a_100000727479_100000210019 [0,1,0,0,0,0|3,0,0]=4 1350 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)O 62a_100000727479_100000211634 [0,1,0,0,0,0|3,0,0]=4 1351 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)[S] 62a_100000727479_114929384022 [0,1,0,0,0,0|3,0,0]=4 1352 B18R2.65908 Cc1cc(ccc1Br)CSc2cccc(c2)[S] 62a_114929384022_100000727479 [0,1,0,0,0,0|3,0,0]=4 1353 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)Br 62a_100000691529_100012184735 [0,1,0,0,0,0|3,0,0]=4 1354 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)Br 62a_100012184735_100000691529 [0,1,0,0,0,0|3,0,0]=4 1355 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)Cl 62a_100000699651_100012184735 [0,1,0,0,0,0|3,0,0]=4 1356 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)Cl 62a_100012184735_100000699651 [0,1,0,0,0,0|3,0,0]=4 1357 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)F 62a_100000685547_100012184735 [0,1,0,0,0,0|3,0,0]=4 1358 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)F 62a_100012184735_100000685547 [0,1,0,0,0,0|3,0,0]=4 1359 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)N 62a_100000210019_100012184735 [0,1,0,0,0,0|3,0,0]=4 1360 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)N 62a_100012184735_100000210019 [0,1,0,0,0,0|3,0,0]=4 1361 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)O 62a_100012184735_100000211634 [0,1,0,0,0,0|3,0,0]=4 1362 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)[S] 62a_100012184735_114929384022 [0,1,0,0,0,0|3,0,0]=4 1363 B18R2.65908 Cc1cc(ccc1Cl)CSc2cccc(c2)[S] 62a_114929384022_100012184735 [0,1,0,0,0,0|3,0,0]=4 1364 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)Br 62a_100000691529_100011216667 [0,1,0,0,0,0|3,0,0]=4 1365 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)Br 62a_100011216667_100000691529 [0,1,0,0,0,0|3,0,0]=4 1366 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)Cl 62a_100000699651_100011216667 [0,1,0,0,0,0|3,0,0]=4 1367 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)Cl 62a_100011216667_100000699651 [0,1,0,0,0,0|3,0,0]=4 1368 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)F 62a_100000685547_100011216667 [0,1,0,0,0,0|3,0,0]=4 1369 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)F 62a_100011216667_100000685547 [0,1,0,0,0,0|3,0,0]=4 1370 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)N 62a_100000210019_100011216667 [0,1,0,0,0,0|3,0,0]=4 1371 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)N 62a_100011216667_100000210019 [0,1,0,0,0,0|3,0,0]=4 1372 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)O 62a_100011216667_100000211634 [0,1,0,0,0,0|3,0,0]=4 1373 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)[S] 62a_100011216667_114929384022 [0,1,0,0,0,0|3,0,0]=4 1374 B18R2.65908 Cc1cc(ccc1F)CSc2cccc(c2)[S] 62a_114929384022_100011216667 [0,1,0,0,0,0|3,0,0]=4 1375 B18R2.65908 Cc1cc(ccc1O)CNc2cccc(c2)Br 270302a_100000210019_100011215669 [0,1,0,0,0,0|3,0,0]=4 1376 B18R2.65908 Cc1cc(ccc1O)CNc2cccc(c2)Cl 270302a_100000185859_100011215669 [0,1,0,0,0,0|3,0,0]=4 1377 B18R2.65908 Cc1cc(ccc1O)CNc2cccc(c2)F 270302a_100000210047_100011215669 [0,1,0,0,0,0|3,0,0]=4 1378 B18R2.65908 Cc1cc(ccc1O)CNc2cccc(c2)I 270302a_100000211102_100011215669 [0,1,0,0,0,0|3,0,0]=4 1379 B18R2.65908 Cc1cc(ccc1O)CNc2cccc(c2)O 270302a_100000210217_100011215669 [0,1,0,0,0,0|3,0,0]=4 1380 B18R2.65908 Cc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100000758586_100000010605 [0,1,0,0,0,0|1,0,0]=2 1381 B18R2.65908 Cc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000744208_100000010605 [0,1,0,0,0,0|2,0,0]=3 1382 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)Br 62a_100000691529_100012232412 [0,1,0,0,0,0|3,0,0]=4 1383 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)Br 62a_100012232412_100000691529 [0,1,0,0,0,0|3,0,0]=4 1384 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_100000699651_100012232412 [0,1,0,0,0,0|3,0,0]=4 1385 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_100012232412_100000699651 [0,1,0,0,0,0|3,0,0]=4 1386 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)F 62a_100000685547_100012232412 [0,1,0,0,0,0|3,0,0]=4 1387 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)F 62a_100012232412_100000685547 [0,1,0,0,0,0|3,0,0]=4 1388 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)N 62a_100000210019_100012232412 [0,1,0,0,0,0|3,0,0]=4 1389 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)N 62a_100012232412_100000210019 [0,1,0,0,0,0|3,0,0]=4 1390 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)O 62a_100012232412_100000211634 [0,1,0,0,0,0|3,0,0]=4 1391 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_100012232412_114929384022 [0,1,0,0,0,0|3,0,0]=4 1392 B18R2.65908 Cc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_114929384022_100012232412 [0,1,0,0,0,0|3,0,0]=4 1393 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)Br 62a_100000691529_100000742320 [0,1,0,0,0,0|3,0,0]=4 1394 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)Br 62a_100000742320_100000691529 [0,1,0,0,0,0|3,0,0]=4 1395 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)Cl 62a_100000699651_100000742320 [0,1,0,0,0,0|3,0,0]=4 1396 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)Cl 62a_100000742320_100000699651 [0,1,0,0,0,0|3,0,0]=4 1397 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)F 62a_100000685547_100000742320 [0,1,0,0,0,0|3,0,0]=4 1398 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)F 62a_100000742320_100000685547 [0,1,0,0,0,0|3,0,0]=4 1399 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)N 62a_100000210019_100000742320 [0,1,0,0,0,0|3,0,0]=4 1400 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)N 62a_100000742320_100000210019 [0,1,0,0,0,0|3,0,0]=4 1401 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)O 62a_100000742320_100000211634 [0,1,0,0,0,0|3,0,0]=4 1402 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)[S] 62a_100000742320_114929384022 [0,1,0,0,0,0|3,0,0]=4 1403 B18R2.65908 Cc1ccc(cc1C)CSc2cccc(c2)[S] 62a_114929384022_100000742320 [0,1,0,0,0,0|3,0,0]=4 1404 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100000691529_100011823929 [0,1,0,0,0,0|3,0,0]=4 1405 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100011823929_100000691529 [0,1,0,0,0,0|3,0,0]=4 1406 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100000699651_100011823929 [0,1,0,0,0,0|3,0,0]=4 1407 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100011823929_100000699651 [0,1,0,0,0,0|3,0,0]=4 1408 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)F 62a_100000685547_100011823929 [0,1,0,0,0,0|3,0,0]=4 1409 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)F 62a_100011823929_100000685547 [0,1,0,0,0,0|3,0,0]=4 1410 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)N 62a_100000210019_100011823929 [0,1,0,0,0,0|3,0,0]=4 1411 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)N 62a_100011823929_100000210019 [0,1,0,0,0,0|3,0,0]=4 1412 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)O 62a_100011823929_100000211634 [0,1,0,0,0,0|3,0,0]=4 1413 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_100011823929_114929384022 [0,1,0,0,0,0|3,0,0]=4 1414 B18R2.65908 Cc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_114929384022_100011823929 [0,1,0,0,0,0|3,0,0]=4 1415 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)Br 62a_100000691529_100011217369 [0,1,0,0,0,0|3,0,0]=4 1416 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)Br 62a_100011217369_100000691529 [0,1,0,0,0,0|3,0,0]=4 1417 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100000699651_100011217369 [0,1,0,0,0,0|3,0,0]=4 1418 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100011217369_100000699651 [0,1,0,0,0,0|3,0,0]=4 1419 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)F 62a_100000685547_100011217369 [0,1,0,0,0,0|3,0,0]=4 1420 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)F 62a_100011217369_100000685547 [0,1,0,0,0,0|3,0,0]=4 1421 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)N 62a_100000210019_100011217369 [0,1,0,0,0,0|3,0,0]=4 1422 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)N 62a_100011217369_100000210019 [0,1,0,0,0,0|3,0,0]=4 1423 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)O 62a_100011217369_100000211634 [0,1,0,0,0,0|3,0,0]=4 1424 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)[S] 62a_100011217369_114929384022 [0,1,0,0,0,0|3,0,0]=4 1425 B18R2.65908 Cc1ccc(cc1F)CSc2cccc(c2)[S] 62a_114929384022_100011217369 [0,1,0,0,0,0|3,0,0]=4 1426 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)Br 62a_100000691529_100010206137 [0,1,0,0,0,0|3,0,0]=4 1427 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)Br 62a_100010206137_100000691529 [0,1,0,0,0,0|3,0,0]=4 1428 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)Cl 62a_100000699651_100010206137 [0,1,0,0,0,0|3,0,0]=4 1429 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)Cl 62a_100010206137_100000699651 [0,1,0,0,0,0|3,0,0]=4 1430 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)F 62a_100000685547_100010206137 [0,1,0,0,0,0|3,0,0]=4 1431 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)F 62a_100010206137_100000685547 [0,1,0,0,0,0|3,0,0]=4 1432 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)N 62a_100000210019_100010206137 [0,1,0,0,0,0|3,0,0]=4 1433 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)N 62a_100010206137_100000210019 [0,1,0,0,0,0|3,0,0]=4 1434 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)O 62a_100010206137_100000211634 [0,1,0,0,0,0|3,0,0]=4 1435 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)[S] 62a_100010206137_114929384022 [0,1,0,0,0,0|3,0,0]=4 1436 B18R2.65908 Cc1ccc(cc1I)CSc2cccc(c2)[S] 62a_114929384022_100010206137 [0,1,0,0,0,0|3,0,0]=4 1437 B18R2.65908 Cc1cccc(c1)NCc2cc(=O)c(co2)O 2230a_100000188690_100000010605 [0,1,0,0,0,0|1,0,0]=2 1438 B18R2.65908 Cc1cccc(c1)NCc2ccc(c(c2)C)O 270302a_100000188690_100011215669 [0,1,0,0,0,0|3,0,0]=4 1439 B18R2.65908 Cc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000210337_100000010605 [0,1,0,0,0,0|0,1,0]=2 1440 B18R2.65908 Cc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100011215228_100000010605 [0,1,0,0,0,0|0,0,0]=1 1441 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100011215228_100012353900 [0,1,0,0,0,0|3,0,0]=4 1442 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100011215228 [0,1,0,0,0,0|3,0,0]=4 1443 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)C 62a_100011215228_100012232412 [0,1,0,0,0,0|3,0,0]=4 1444 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)C 62a_100012232412_100011215228 [0,1,0,0,0,0|3,0,0]=4 1445 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100011215228_100012353894 [0,1,0,0,0,0|3,0,0]=4 1446 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100011215228 [0,1,0,0,0,0|3,0,0]=4 1447 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100011206884_100011215228 [0,1,0,0,0,0|3,0,0]=4 1448 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100011215228_100011206884 [0,1,0,0,0,0|3,0,0]=4 1449 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)Br 62a_100000727479_100011215228 [0,1,0,0,0,0|3,0,0]=4 1450 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)Br 62a_100011215228_100000727479 [0,1,0,0,0,0|3,0,0]=4 1451 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)C 62a_100000742320_100011215228 [0,1,0,0,0,0|3,0,0]=4 1452 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)C 62a_100011215228_100000742320 [0,1,0,0,0,0|3,0,0]=4 1453 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)Cl 62a_100011215228_100012184735 [0,1,0,0,0,0|3,0,0]=4 1454 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)Cl 62a_100012184735_100011215228 [0,1,0,0,0,0|3,0,0]=4 1455 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)F 62a_100011215228_100011216667 [0,1,0,0,0,0|3,0,0]=4 1456 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)C)F 62a_100011216667_100011215228 [0,1,0,0,0,0|3,0,0]=4 1457 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100011215228_100012353895 [0,1,0,0,0,0|3,0,0]=4 1458 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100011215228 [0,1,0,0,0,0|3,0,0]=4 1459 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)C 62a_100011215228_100011823929 [0,1,0,0,0,0|3,0,0]=4 1460 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)C 62a_100011823929_100011215228 [0,1,0,0,0,0|3,0,0]=4 1461 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100011215228 [0,1,0,0,0,0|3,0,0]=4 1462 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100011215228_100000184707 [0,1,0,0,0,0|3,0,0]=4 1463 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100011215228 [0,1,0,0,0,0|3,0,0]=4 1464 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100011215228_100011934319 [0,1,0,0,0,0|3,0,0]=4 1465 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100011215228_100012349665 [0,1,0,0,0,0|3,0,0]=4 1466 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100011215228 [0,1,0,0,0,0|3,0,0]=4 1467 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000767054_100011215228 [0,1,0,0,0,0|3,0,0]=4 1468 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100011215228_100000767054 [0,1,0,0,0,0|3,0,0]=4 1469 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)C 62a_100011215228_100011217369 [0,1,0,0,0,0|3,0,0]=4 1470 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)C 62a_100011217369_100011215228 [0,1,0,0,0,0|3,0,0]=4 1471 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100011215228 [0,1,0,0,0,0|3,0,0]=4 1472 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100011215228_100000716492 [0,1,0,0,0,0|3,0,0]=4 1473 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000757363_100011215228 [0,1,0,0,0,0|3,0,0]=4 1474 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100011215228_100000757363 [0,1,0,0,0,0|3,0,0]=4 1475 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100010149604_100011215228 [0,1,0,0,0,0|3,0,0]=4 1476 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100011215228_100010149604 [0,1,0,0,0,0|3,0,0]=4 1477 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100010146616_100011215228 [0,1,0,0,0,0|3,0,0]=4 1478 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100011215228_100010146616 [0,1,0,0,0,0|3,0,0]=4 1479 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)C 62a_100010206137_100011215228 [0,1,0,0,0,0|3,0,0]=4 1480 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)C 62a_100011215228_100010206137 [0,1,0,0,0,0|3,0,0]=4 1481 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100010188208_100011215228 [0,1,0,0,0,0|3,0,0]=4 1482 B18R2.65908 Cc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100011215228_100010188208 [0,1,0,0,0,0|3,0,0]=4 1483 B18R2.65908 Cc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100000742759_100000010605 [0,1,0,0,0,0|1,0,0]=2 1484 B18R2.65908 Cc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100000750283_100000010605 [0,1,0,0,0,0|1,0,0]=2 1485 B18R2.65908 Cc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100011243806_100000010605 [0,1,0,0,0,0|2,0,0]=3 1486 B18R2.65908 Cc1cncc(c1)OCc2cc(=O)c(co2)O 7a_100011830280_100000010605 [0,1,0,0,0,0|1,1,0]=3 1487 B18R2.65908 Cc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100000760492_100000010605 [0,1,0,0,0,0|1,0,0]=2 1488 B18R2.65908 Cc1cncc(n1)SCc2cc(=O)c(co2)O 62a_100000754123_100000010605 [0,1,0,0,0,0|2,0,0]=3 1489 B18R2.65908 Cc1cnnc(c1)SCc2cc(=O)c(co2)O 62a_100000070100_100000010605 [0,1,0,0,0,0|2,0,0]=3 1490 B18R2.65908 Cc1nccc(n1)SCc2cc(=O)c(co2)O 62a_100000749937_100000010605 [0,1,0,0,0,0|2,0,0]=3 1491 B18R2.65908 Clc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000699651 [0,1,0,0,0,0|3,0,0]=4 1492 B18R2.65908 Clc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000699651_100000184707 [0,1,0,0,0,0|3,0,0]=4 1493 B18R2.65908 Clc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100000699651_100012349665 [0,1,0,0,0,0|3,0,0]=4 1494 B18R2.65908 Clc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000699651 [0,1,0,0,0,0|3,0,0]=4 1495 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)Br 62a_100000691529_100000767054 [0,1,0,0,0,0|3,0,0]=4 1496 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)Br 62a_100000767054_100000691529 [0,1,0,0,0,0|3,0,0]=4 1497 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)Cl 62a_100000699651_100000767054 [0,1,0,0,0,0|3,0,0]=4 1498 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)Cl 62a_100000767054_100000699651 [0,1,0,0,0,0|3,0,0]=4 1499 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)[S] 62a_100000767054_114929384022 [0,1,0,0,0,0|3,0,0]=4 1500 B18R2.65908 Fc1cc(ccc1Br)CSc2cccc(c2)[S] 62a_114929384022_100000767054 [0,1,0,0,0,0|3,0,0]=4 1501 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)Br 62a_100000691529_100000716492 [0,1,0,0,0,0|3,0,0]=4 1502 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)Br 62a_100000716492_100000691529 [0,1,0,0,0,0|3,0,0]=4 1503 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)Cl 62a_100000699651_100000716492 [0,1,0,0,0,0|3,0,0]=4 1504 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)Cl 62a_100000716492_100000699651 [0,1,0,0,0,0|3,0,0]=4 1505 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)[S] 62a_100000716492_114929384022 [0,1,0,0,0,0|3,0,0]=4 1506 B18R2.65908 Fc1cc(ccc1Cl)CSc2cccc(c2)[S] 62a_114929384022_100000716492 [0,1,0,0,0,0|3,0,0]=4 1507 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)Br 62a_100000691529_100010149604 [0,1,0,0,0,0|3,0,0]=4 1508 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)Br 62a_100010149604_100000691529 [0,1,0,0,0,0|3,0,0]=4 1509 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)Cl 62a_100000699651_100010149604 [0,1,0,0,0,0|3,0,0]=4 1510 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)Cl 62a_100010149604_100000699651 [0,1,0,0,0,0|3,0,0]=4 1511 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)[S] 62a_100010149604_114929384022 [0,1,0,0,0,0|3,0,0]=4 1512 B18R2.65908 Fc1cc(ccc1I)CSc2cccc(c2)[S] 62a_114929384022_100010149604 [0,1,0,0,0,0|3,0,0]=4 1513 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)Br 62a_100000691529_100011206884 [0,1,0,0,0,0|3,0,0]=4 1514 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)Br 62a_100011206884_100000691529 [0,1,0,0,0,0|3,0,0]=4 1515 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_100000699651_100011206884 [0,1,0,0,0,0|3,0,0]=4 1516 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_100011206884_100000699651 [0,1,0,0,0,0|3,0,0]=4 1517 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_100011206884_114929384022 [0,1,0,0,0,0|3,0,0]=4 1518 B18R2.65908 Fc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_114929384022_100011206884 [0,1,0,0,0,0|3,0,0]=4 1519 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100000691529_100011934319 [0,1,0,0,0,0|3,0,0]=4 1520 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100000717365_100000691529 [0,1,0,0,0,0|3,0,0]=4 1521 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100000699651_100011934319 [0,1,0,0,0,0|3,0,0]=4 1522 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100000717365_100000699651 [0,1,0,0,0,0|3,0,0]=4 1523 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_100000717365_114929384022 [0,1,0,0,0,0|3,0,0]=4 1524 B18R2.65908 Fc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_114929384022_100011934319 [0,1,0,0,0,0|3,0,0]=4 1525 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)Br 62a_100000691529_100000757363 [0,1,0,0,0,0|3,0,0]=4 1526 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)Br 62a_100000757363_100000691529 [0,1,0,0,0,0|3,0,0]=4 1527 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100000699651_100000757363 [0,1,0,0,0,0|3,0,0]=4 1528 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100000757363_100000699651 [0,1,0,0,0,0|3,0,0]=4 1529 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)[S] 62a_100000757363_114929384022 [0,1,0,0,0,0|3,0,0]=4 1530 B18R2.65908 Fc1ccc(cc1F)CSc2cccc(c2)[S] 62a_114929384022_100000757363 [0,1,0,0,0,0|3,0,0]=4 1531 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)Br 62a_100000691529_100010188208 [0,1,0,0,0,0|3,0,0]=4 1532 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)Br 62a_100010188208_100000691529 [0,1,0,0,0,0|3,0,0]=4 1533 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)Cl 62a_100000699651_100010188208 [0,1,0,0,0,0|3,0,0]=4 1534 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)Cl 62a_100010188208_100000699651 [0,1,0,0,0,0|3,0,0]=4 1535 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)[S] 62a_100010188208_114929384022 [0,1,0,0,0,0|3,0,0]=4 1536 B18R2.65908 Fc1ccc(cc1I)CSc2cccc(c2)[S] 62a_114929384022_100010188208 [0,1,0,0,0,0|3,0,0]=4 1537 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100000685547_100012353900 [0,1,0,0,0,0|3,0,0]=4 1538 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000685547 [0,1,0,0,0,0|3,0,0]=4 1539 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100000685547_100012353894 [0,1,0,0,0,0|3,0,0]=4 1540 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000685547 [0,1,0,0,0,0|3,0,0]=4 1541 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100000685547_100011206884 [0,1,0,0,0,0|3,0,0]=4 1542 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000685547 [0,1,0,0,0,0|3,0,0]=4 1543 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100000685547_100012353895 [0,1,0,0,0,0|3,0,0]=4 1544 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000685547 [0,1,0,0,0,0|3,0,0]=4 1545 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000685547 [0,1,0,0,0,0|3,0,0]=4 1546 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000685547_100000184707 [0,1,0,0,0,0|3,0,0]=4 1547 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000685547_100011934319 [0,1,0,0,0,0|3,0,0]=4 1548 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000685547 [0,1,0,0,0,0|3,0,0]=4 1549 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100000685547_100012349665 [0,1,0,0,0,0|3,0,0]=4 1550 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000685547 [0,1,0,0,0,0|3,0,0]=4 1551 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000685547_100000767054 [0,1,0,0,0,0|3,0,0]=4 1552 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000685547 [0,1,0,0,0,0|3,0,0]=4 1553 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000685547_100000716492 [0,1,0,0,0,0|3,0,0]=4 1554 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000685547 [0,1,0,0,0,0|3,0,0]=4 1555 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000685547_100000757363 [0,1,0,0,0,0|3,0,0]=4 1556 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000757363_100000685547 [0,1,0,0,0,0|3,0,0]=4 1557 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100000685547_100010149604 [0,1,0,0,0,0|3,0,0]=4 1558 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100010149604_100000685547 [0,1,0,0,0,0|3,0,0]=4 1559 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100000685547_100010146616 [0,1,0,0,0,0|3,0,0]=4 1560 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000685547 [0,1,0,0,0,0|3,0,0]=4 1561 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100000685547_100010188208 [0,1,0,0,0,0|3,0,0]=4 1562 B18R2.65908 Fc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100010188208_100000685547 [0,1,0,0,0,0|3,0,0]=4 1563 B18R2.65908 Nc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100000049665_100000010605 [0,1,0,0,0,0|1,0,0]=2 1564 B18R2.65908 Nc1cc(cnn1)SCc2cc(=O)c(co2)O 62a_100000130277_100000010605 [0,1,0,0,0,0|2,0,0]=3 1565 B18R2.65908 Nc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000701291_100000010605 [0,1,0,0,0,0|2,0,0]=3 1566 B18R2.65908 Nc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100000210019_100000010605 [0,1,0,0,0,0|0,0,0]=1 1567 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100000210019_100012353900 [0,1,0,0,0,0|3,0,0]=4 1568 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000210019 [0,1,0,0,0,0|3,0,0]=4 1569 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100000210019_100012353894 [0,1,0,0,0,0|3,0,0]=4 1570 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000210019 [0,1,0,0,0,0|3,0,0]=4 1571 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100000210019_100011206884 [0,1,0,0,0,0|3,0,0]=4 1572 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000210019 [0,1,0,0,0,0|3,0,0]=4 1573 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100000210019_100012353895 [0,1,0,0,0,0|3,0,0]=4 1574 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000210019 [0,1,0,0,0,0|3,0,0]=4 1575 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000210019 [0,1,0,0,0,0|3,0,0]=4 1576 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000210019_100000184707 [0,1,0,0,0,0|3,0,0]=4 1577 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000210019_100011934319 [0,1,0,0,0,0|3,0,0]=4 1578 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000210019 [0,1,0,0,0,0|3,0,0]=4 1579 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100000210019_100012349665 [0,1,0,0,0,0|3,0,0]=4 1580 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000210019 [0,1,0,0,0,0|3,0,0]=4 1581 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000210019_100000767054 [0,1,0,0,0,0|3,0,0]=4 1582 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000210019 [0,1,0,0,0,0|3,0,0]=4 1583 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000210019_100000716492 [0,1,0,0,0,0|3,0,0]=4 1584 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000210019 [0,1,0,0,0,0|3,0,0]=4 1585 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000210019_100000757363 [0,1,0,0,0,0|3,0,0]=4 1586 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000757363_100000210019 [0,1,0,0,0,0|3,0,0]=4 1587 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100000210019_100010149604 [0,1,0,0,0,0|3,0,0]=4 1588 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100010149604_100000210019 [0,1,0,0,0,0|3,0,0]=4 1589 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100000210019_100010146616 [0,1,0,0,0,0|3,0,0]=4 1590 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000210019 [0,1,0,0,0,0|3,0,0]=4 1591 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100000210019_100010188208 [0,1,0,0,0,0|3,0,0]=4 1592 B18R2.65908 Nc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100010188208_100000210019 [0,1,0,0,0,0|3,0,0]=4 1593 B18R2.65908 Nc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100000740741_100000010605 [0,1,0,0,0,0|1,0,0]=2 1594 B18R2.65908 Nc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100009814236_100000010605 [0,1,0,0,0,0|1,0,0]=2 1595 B18R2.65908 Nc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100000757536_100000010605 [0,1,0,0,0,0|2,0,0]=3 1596 B18R2.65908 Nc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100000687067_100000010605 [0,1,0,0,0,0|1,0,0]=2 1597 B18R2.65908 Nc1cncc(n1)SCc2cc(=O)c(co2)O 62a_100000747728_100000010605 [0,1,0,0,0,0|2,0,0]=3 1598 B18R2.65908 Nc1cnnc(c1)SCc2cc(=O)c(co2)O 62a_100011996757_100000010605 [0,1,0,0,0,0|2,0,0]=3 1599 B18R2.65908 Nc1nccc(n1)SCc2cc(=O)c(co2)O 62a_100000055538_100000010605 [0,1,0,0,0,0|2,0,0]=3 1600 B18R2.65908 Nc1ncnc(n1)SCc2cc(=O)c(co2)O 62a_100000123831_100000010605 [0,1,0,0,0,0|3,0,0]=4 1601 B18R2.65908 O=c1cc(cc[nH]1)SCc2cc(=O)c(co2)O 62a_100009816521_100000010605 [0,1,0,0,0,0|1,0,0]=2 1602 B18R2.65908 O=c1cc(nc[nH]1)SCc2cc(=O)c(co2)O 62a_100012002517_100000010605 [0,1,0,0,0,0|2,0,0]=3 1603 B18R2.65908 O=c1cc(occ1O)COc2ccc[n+](c2)[O-] 7a_100000039713_100000010605 [0,1,0,0,0,0|1,1,0]=3 1604 B18R2.65908 O=c1cc(occ1O)COc2cccc(c2)Br 7a_100000210342_100000010605 [0,1,0,0,0,0|0,1,0]=2 1605 B18R2.65908 O=c1cc(occ1O)COc2cccc(c2)Cl 7a_100000210295_100000010605 [0,1,0,0,0,0|0,1,0]=2 1606 B18R2.65908 O=c1cc(occ1O)COc2cccc(c2)F 7a_100000210426_100000010605 [0,1,0,0,0,0|0,1,0]=2 1607 B18R2.65908 O=c1cc(occ1O)COc2cccc(c2)I 7a_100000211634_100000010605 [0,1,0,0,0,0|0,1,0]=2 1608 B18R2.65908 O=c1cc(occ1O)COc2cncc(c2)Br 7a_100000754920_100000010605 [0,1,0,0,0,0|1,1,0]=3 1609 B18R2.65908 O=c1cc(occ1O)COc2cncc(c2)Cl 7a_100000032511_100000010605 [0,1,0,0,0,0|1,1,0]=3 1610 B18R2.65908 O=c1cc(occ1O)COc2cncc(c2)F 7a_100011830296_100000010605 [0,1,0,0,0,0|1,1,0]=3 1611 B18R2.65908 O=c1cc(occ1O)CSc2cc(ccn2)Cl 62a_100010167805_100000010605 [0,1,0,0,0,0|1,0,0]=2 1612 B18R2.65908 O=c1cc(occ1O)CSc2cc(ccn2)F 62a_100000764206_100000010605 [0,1,0,0,0,0|1,0,0]=2 1613 B18R2.65908 O=c1cc(occ1O)CSc2cc(ncn2)Cl 62a_100010161198_100000010605 [0,1,0,0,0,0|2,0,0]=3 1614 B18R2.65908 O=c1cc(occ1O)CSc2cc(ncn2)F 62a_200009880791_100000010605 [0,1,0,0,0,0|2,0,0]=3 1615 B18R2.65908 O=c1cc(occ1O)CSc2cccc(c2)Br 62a_100000691529_100000010605 [0,1,0,0,0,0|0,0,0]=1 1616 B18R2.65908 O=c1cc(occ1O)CSc2cccc(c2)Cl 62a_100000699651_100000010605 [0,1,0,0,0,0|0,0,0]=1 1617 B18R2.65908 O=c1cc(occ1O)CSc2cccc(c2)F 62a_100000685547_100000010605 [0,1,0,0,0,0|0,0,0]=1 1618 B18R2.65908 O=c1cc(occ1O)CSc2cccc(c2)[S] 62a_114929384022_100000010605 [0,1,0,0,0,0|0,0,0]=1 1619 B18R2.65908 O=c1cc(occ1O)CSc2cccc(n2)Br 62a_100000684672_100000010605 [0,1,0,0,0,0|1,0,0]=2 1620 B18R2.65908 O=c1cc(occ1O)CSc2cccc(n2)Cl 62a_100000051397_100000010605 [0,1,0,0,0,0|1,0,0]=2 1621 B18R2.65908 O=c1cc(occ1O)CSc2cccc(n2)F 62a_100009815982_100000010605 [0,1,0,0,0,0|1,0,0]=2 1622 B18R2.65908 O=c1cc(occ1O)CSc2ccnc(c2)Br 62a_100009814637_100000010605 [0,1,0,0,0,0|1,0,0]=2 1623 B18R2.65908 O=c1cc(occ1O)CSc2ccnc(c2)Cl 62a_100000035001_100000010605 [0,1,0,0,0,0|1,0,0]=2 1624 B18R2.65908 O=c1cc(occ1O)CSc2ccnc(c2)F 62a_100009816116_100000010605 [0,1,0,0,0,0|1,0,0]=2 1625 B18R2.65908 O=c1cc(occ1O)CSc2ccnc(n2)Cl 62a_100010154678_100000010605 [0,1,0,0,0,0|2,0,0]=3 1626 B18R2.65908 O=c1cc(occ1O)CSc2cncc(c2)Br 62a_100000728054_100000010605 [0,1,0,0,0,0|1,0,0]=2 1627 B18R2.65908 O=c1cc(occ1O)CSc2cncc(c2)Cl 62a_100000049639_100000010605 [0,1,0,0,0,0|1,0,0]=2 1628 B18R2.65908 O=c1cc(occ1O)CSc2cncc(c2)F 62a_100000744099_100000010605 [0,1,0,0,0,0|1,0,0]=2 1629 B18R2.65908 O=c1cc(occ1O)CSc2cncc(c2)O 62a_100000754920_100000010605 [0,1,0,0,0,0|1,0,0]=2 1630 B18R2.65908 O=c1cc(occ1O)CSc2cncc(n2)Cl 62a_100010892449_100000010605 [0,1,0,0,0,0|2,0,0]=3 1631 B18R2.65908 O=c1cc(occ1O)CSc2cncc(n2)F 62a_200009863489_100000010605 [0,1,0,0,0,0|2,0,0]=3 1632 B18R2.65908 O=c1cc[nH]c(c1)SCc2cc(=O)c(co2)O 62a_100009817434_100000010605 [0,1,0,0,0,0|1,0,0]=2 1633 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Br)Br 62a_100012353900_100000211634 [0,1,0,0,0,0|3,0,0]=4 1634 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_100000211634 [0,1,0,0,0,0|3,0,0]=4 1635 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Br)F 62a_100011206884_100000211634 [0,1,0,0,0,0|3,0,0]=4 1636 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_100000211634 [0,1,0,0,0,0|3,0,0]=4 1637 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000211634 [0,1,0,0,0,0|3,0,0]=4 1638 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Cl)F 62a_100000717365_100000211634 [0,1,0,0,0,0|3,0,0]=4 1639 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_100000211634 [0,1,0,0,0,0|3,0,0]=4 1640 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)F)Br 62a_100000767054_100000211634 [0,1,0,0,0,0|3,0,0]=4 1641 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)F)Cl 62a_100000716492_100000211634 [0,1,0,0,0,0|3,0,0]=4 1642 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)F)F 62a_100000757363_100000211634 [0,1,0,0,0,0|3,0,0]=4 1643 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)F)I 62a_100010149604_100000211634 [0,1,0,0,0,0|3,0,0]=4 1644 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100010146616_100000211634 [0,1,0,0,0,0|3,0,0]=4 1645 B18R2.65908 Oc1cccc(c1)SCc2ccc(c(c2)I)F 62a_100010188208_100000211634 [0,1,0,0,0,0|3,0,0]=4 1646 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_100012353894_114929384022 [0,1,0,0,0,0|3,0,0]=4 1647 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Br)Cl 62a_114929384022_100012353894 [0,1,0,0,0,0|3,0,0]=4 1648 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_100012353895_114929384022 [0,1,0,0,0,0|3,0,0]=4 1649 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)Br 62a_114929384022_100012353895 [0,1,0,0,0,0|3,0,0]=4 1650 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_100000184707_114929384022 [0,1,0,0,0,0|3,0,0]=4 1651 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)Cl 62a_114929384022_100000184707 [0,1,0,0,0,0|3,0,0]=4 1652 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_100012349665_114929384022 [0,1,0,0,0,0|3,0,0]=4 1653 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)Cl)I 62a_114929384022_100012349665 [0,1,0,0,0,0|3,0,0]=4 1654 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)I)Br 62a_100010146616_114929384022 [0,1,0,0,0,0|3,0,0]=4 1655 B18R2.65908 [S]c1cccc(c1)SCc2ccc(c(c2)I)Br 62a_114929384022_100010146616 [0,1,0,0,0,0|3,0,0]=4 1656 B16R1.6728 COC(=O)/C=C(\CSc1ccccc1)/OC 62a_100000719477_100016998490 [0,0,1,0,0,0|2,0,1]=4 1657 B16R1.6728 COC(=O)/C=C(\CSc1ccccc1)/OC 62a_100016998490_100000041952 [0,0,1,0,0,0|2,0,1]=4 1658 B16R1.7995 C=CCC(C=C)OCc1cc(=O)c(co1)O 7a_100000038011_100000010605 [0,0,1,0,0,0|0,1,2]=4 1659 B16R2.124 Brc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012356285 [0,0,0,0,1,0|3,0,0]=4 1660 B16R2.124 Brc1ccc(cc1Br)Sc2ccccc2 62a_100012356285_100000041952 [0,0,0,0,1,0|3,0,0]=4 1661 B16R2.124 Cc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100009813585 [0,0,0,0,1,0|3,0,0]=4 1662 B16R2.124 Cc1cc(ccc1Br)Sc2ccccc2 62a_100009813585_100000041952 [0,0,0,0,1,0|3,0,0]=4 1663 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccc2 62a_100000049509_100000041952 [0,0,0,0,1,0|3,0,0]=4 1664 B16R2.124 Cc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100000049509 [0,0,0,0,1,0|3,0,0]=4 1665 B16R2.124 Cc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100011218330 [0,0,0,0,1,0|3,0,0]=4 1666 B16R2.124 Cc1cc(ccc1F)Sc2ccccc2 62a_100011218330_100000041952 [0,0,0,0,1,0|3,0,0]=4 1667 B16R2.124 Cc1cc(ccc1N)Sc2ccccc2 62a_100000211769_100000041952 [0,0,0,0,1,0|3,0,0]=4 1668 B16R2.124 Cc1cc(ccc1N)Sc2ccccc2 62a_100000719477_100000211769 [0,0,0,0,1,0|3,0,0]=4 1669 B16R2.124 Cc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000186361 [0,0,0,0,1,0|2,0,0]=3 1670 B16R2.124 Cc1cc(ccc1O)Sc2ccccn2 62a_100011216584_100000186361 [0,0,0,0,1,0|3,0,0]=4 1671 B16R2.124 Cc1cc(ccc1O)Sc2cccnc2 62a_100000210063_100000186361 [0,0,0,0,1,0|3,0,0]=4 1672 B16R2.124 Cc1cc(ccc1O)Sc2ccncc2 62a_100000728582_100000186361 [0,0,0,0,1,0|3,0,0]=4 1673 B16R2.124 Cc1cc(cnc1O)Sc2ccccc2 62a_100000685391_100000041952 [0,0,0,0,1,0|3,0,0]=4 1674 B16R2.124 Cc1cc(cnc1O)Sc2ccccc2 62a_100000719477_100000685391 [0,0,0,0,1,0|3,0,0]=4 1675 B16R2.124 Cc1cc(ncc1Br)Sc2ccccc2 62a_100000719477_100012356354 [0,0,0,0,1,0|3,0,0]=4 1676 B16R2.124 Cc1cc(ncc1Br)Sc2ccccc2 62a_100012356354_100000041952 [0,0,0,0,1,0|3,0,0]=4 1677 B16R2.124 Cc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100009818257 [0,0,0,0,1,0|3,0,0]=4 1678 B16R2.124 Cc1cc(ncc1F)Sc2ccccc2 62a_100009818257_100000041952 [0,0,0,0,1,0|3,0,0]=4 1679 B16R2.124 Cc1cc(ncc1N)Sc2ccccc2 62a_100000067204_100000041952 [0,0,0,0,1,0|3,0,0]=4 1680 B16R2.124 Cc1cc(ncc1N)Sc2ccccc2 62a_100000719477_100000067204 [0,0,0,0,1,0|3,0,0]=4 1681 B16R2.124 Cc1cc(ncc1O)Sc2ccccc2 62a_100000719477_100000692680 [0,0,0,0,1,0|2,0,0]=3 1682 B16R2.124 Cc1cc(ncc1O)Sc2ccccn2 62a_100011216584_100000692680 [0,0,0,0,1,0|3,0,0]=4 1683 B16R2.124 Cc1cc(ncc1O)Sc2cccnc2 62a_100000210063_100000692680 [0,0,0,0,1,0|3,0,0]=4 1684 B16R2.124 Cc1cc(ncc1O)Sc2ccncc2 62a_100000728582_100000692680 [0,0,0,0,1,0|3,0,0]=4 1685 B16R2.124 Cc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100011847877 [0,0,0,0,1,0|3,0,0]=4 1686 B16R2.124 Cc1ccc(cc1Br)Sc2ccccc2 62a_100011847877_100000041952 [0,0,0,0,1,0|3,0,0]=4 1687 B16R2.124 Cc1ccc(cc1C)Sc2ccccc2 62a_100000719477_100011215607 [0,0,0,0,1,0|3,0,0]=4 1688 B16R2.124 Cc1ccc(cc1C)Sc2ccccc2 62a_100011215607_100000041952 [0,0,0,0,1,0|3,0,0]=4 1689 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011216363 [0,0,0,0,1,0|3,0,0]=4 1690 B16R2.124 Cc1ccc(cc1Cl)Sc2ccccc2 62a_100011216363_100000041952 [0,0,0,0,1,0|3,0,0]=4 1691 B16R2.124 Cc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000720648 [0,0,0,0,1,0|3,0,0]=4 1692 B16R2.124 Cc1ccc(cc1F)Sc2ccccc2 62a_100000720648_100000041952 [0,0,0,0,1,0|3,0,0]=4 1693 B16R2.124 Cc1ccc(cc1N)Sc2ccccc2 62a_100000719477_100000761890 [0,0,0,0,1,0|3,0,0]=4 1694 B16R2.124 Cc1ccc(cc1N)Sc2ccccc2 62a_100000761890_100000041952 [0,0,0,0,1,0|3,0,0]=4 1695 B16R2.124 Cc1ccc(cc1O)Sc2ccccc2 62a_100000685420_100000041952 [0,0,0,0,1,0|2,0,1]=4 1696 B16R2.124 Cc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100000685420 [0,0,0,0,1,0|2,0,1]=4 1697 B16R2.124 Cc1cnc(cc1C)Sc2ccccc2 62a_100000719477_100009850809 [0,0,0,0,1,0|3,0,0]=4 1698 B16R2.124 Cc1cnc(cc1C)Sc2ccccc2 62a_100009850809_100000041952 [0,0,0,0,1,0|3,0,0]=4 1699 B16R2.124 Cc1cnc(cc1F)Sc2ccccc2 62a_100000719477_100009841206 [0,0,0,0,1,0|3,0,0]=4 1700 B16R2.124 Cc1cnc(cc1F)Sc2ccccc2 62a_100009841206_100000041952 [0,0,0,0,1,0|3,0,0]=4 1701 B16R2.124 Cc1cnc(cc1N)Sc2ccccc2 62a_100000126663_100000041952 [0,0,0,0,1,0|3,0,0]=4 1702 B16R2.124 Cc1cnc(cc1N)Sc2ccccc2 62a_100000719477_100000126663 [0,0,0,0,1,0|3,0,0]=4 1703 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000704368_100000041952 [0,0,0,0,1,0|2,0,1]=4 1704 B16R2.124 Cc1cnc(cc1O)Sc2ccccc2 62a_100000719477_100000704368 [0,0,0,0,1,0|2,0,1]=4 1705 B16R2.124 Cc1nc(ccc1O)Sc2ccccc2 62a_100000719477_100010233687 [0,0,0,0,1,0|3,0,0]=4 1706 B16R2.124 Cc1nc(ccc1O)Sc2ccccc2 62a_100010233687_100000041952 [0,0,0,0,1,0|3,0,0]=4 1707 B16R2.124 Clc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100012047281 [0,0,0,0,1,0|3,0,0]=4 1708 B16R2.124 Clc1cc(ccc1Br)Sc2ccccc2 62a_100012047281_100000041952 [0,0,0,0,1,0|3,0,0]=4 1709 B16R2.124 Clc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012353702 [0,0,0,0,1,0|3,0,0]=4 1710 B16R2.124 Clc1ccc(cc1Br)Sc2ccccc2 62a_100012353702_100000041952 [0,0,0,0,1,0|3,0,0]=4 1711 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011214914 [0,0,0,0,1,0|3,0,0]=4 1712 B16R2.124 Clc1ccc(cc1Cl)Sc2ccccc2 62a_100011214914_100000041952 [0,0,0,0,1,0|3,0,0]=4 1713 B16R2.124 Cn1ccc(cc1=O)Sc2ccccc2 62a_100000719477_100009820031 [0,0,0,0,1,0|3,0,0]=4 1714 B16R2.124 Cn1ccc(cc1=O)Sc2ccccc2 62a_100009820031_100000041952 [0,0,0,0,1,0|3,0,0]=4 1715 B16R2.124 Cn1cnc(cc1=O)Sc2ccccc2 62a_100000719477_100012179353 [0,0,0,0,1,0|3,0,0]=4 1716 B16R2.124 Cn1cnc(cc1=O)Sc2ccccc2 62a_100012179353_100000041952 [0,0,0,0,1,0|3,0,0]=4 1717 B16R2.124 Fc1cc(ccc1Br)Sc2ccccc2 62a_100000685389_100000041952 [0,0,0,0,1,0|3,0,0]=4 1718 B16R2.124 Fc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100000685389 [0,0,0,0,1,0|3,0,0]=4 1719 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100011216805 [0,0,0,0,1,0|3,0,0]=4 1720 B16R2.124 Fc1cc(ccc1Cl)Sc2ccccc2 62a_100011216805_100000041952 [0,0,0,0,1,0|3,0,0]=4 1721 B16R2.124 Fc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012047266 [0,0,0,0,1,0|3,0,0]=4 1722 B16R2.124 Fc1ccc(cc1Br)Sc2ccccc2 62a_100012047266_100000041952 [0,0,0,0,1,0|3,0,0]=4 1723 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011215976 [0,0,0,0,1,0|3,0,0]=4 1724 B16R2.124 Fc1ccc(cc1Cl)Sc2ccccc2 62a_100011215976_100000041952 [0,0,0,0,1,0|3,0,0]=4 1725 B16R2.124 Fc1ccc(cc1F)Sc2ccccc2 62a_100000703953_100000041952 [0,0,0,0,1,0|3,0,0]=4 1726 B16R2.124 Fc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000703953 [0,0,0,0,1,0|3,0,0]=4 1727 B16R2.124 Nc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100000750456 [0,0,0,0,1,0|3,0,0]=4 1728 B16R2.124 Nc1cc(ccc1Br)Sc2ccccc2 62a_100000750456_100000041952 [0,0,0,0,1,0|3,0,0]=4 1729 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_200000761891 [0,0,0,0,1,0|3,0,0]=4 1730 B16R2.124 Nc1cc(ccc1Cl)Sc2ccccc2 62a_200000761891_100000041952 [0,0,0,0,1,0|3,0,0]=4 1731 B16R2.124 Nc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100000740924 [0,0,0,0,1,0|3,0,0]=4 1732 B16R2.124 Nc1cc(ccc1F)Sc2ccccc2 62a_100000740924_100000041952 [0,0,0,0,1,0|3,0,0]=4 1733 B16R2.124 Nc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000752626 [0,0,0,0,1,0|2,0,0]=3 1734 B16R2.124 Nc1cc(ccc1O)Sc2ccccc2 62a_100000752626_100000041952 [0,0,0,0,1,0|2,0,0]=3 1735 B16R2.124 Nc1cc(ccc1O)Sc2ccccn2 62a_100000752626_100011216584 [0,0,0,0,1,0|3,0,0]=4 1736 B16R2.124 Nc1cc(ccc1O)Sc2ccccn2 62a_100011216584_100000752626 [0,0,0,0,1,0|3,0,0]=4 1737 B16R2.124 Nc1cc(ccc1O)Sc2cccnc2 62a_100000210063_100000752626 [0,0,0,0,1,0|3,0,0]=4 1738 B16R2.124 Nc1cc(ccc1O)Sc2cccnc2 62a_100000752626_100000210063 [0,0,0,0,1,0|3,0,0]=4 1739 B16R2.124 Nc1cc(ccc1O)Sc2ccncc2 62a_100000728582_100000752626 [0,0,0,0,1,0|3,0,0]=4 1740 B16R2.124 Nc1cc(ccc1O)Sc2ccncc2 62a_100000752626_100000728582 [0,0,0,0,1,0|3,0,0]=4 1741 B16R2.124 Nc1cc(cnc1O)Sc2ccccc2 62a_100000719477_100000743729 [0,0,0,0,1,0|3,0,0]=4 1742 B16R2.124 Nc1cc(cnc1O)Sc2ccccc2 62a_100000743729_100000041952 [0,0,0,0,1,0|3,0,0]=4 1743 B16R2.124 Nc1cc(ncc1F)Sc2ccccc2 62a_100000126464_100000041952 [0,0,0,0,1,0|3,0,0]=4 1744 B16R2.124 Nc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100000126464 [0,0,0,0,1,0|3,0,0]=4 1745 B16R2.124 Nc1cc(ncc1O)Sc2ccccc2 62a_100000719477_100009819941 [0,0,0,0,1,0|2,0,0]=3 1746 B16R2.124 Nc1cc(ncc1O)Sc2ccccc2 62a_100009819941_100000041952 [0,0,0,0,1,0|2,0,0]=3 1747 B16R2.124 Nc1cc(ncc1O)Sc2ccccn2 62a_100009819941_100011216584 [0,0,0,0,1,0|3,0,0]=4 1748 B16R2.124 Nc1cc(ncc1O)Sc2ccccn2 62a_100011216584_100009819941 [0,0,0,0,1,0|3,0,0]=4 1749 B16R2.124 Nc1cc(ncc1O)Sc2cccnc2 62a_100000210063_100009819941 [0,0,0,0,1,0|3,0,0]=4 1750 B16R2.124 Nc1cc(ncc1O)Sc2cccnc2 62a_100009819941_100000210063 [0,0,0,0,1,0|3,0,0]=4 1751 B16R2.124 Nc1cc(ncc1O)Sc2ccncc2 62a_100000728582_100009819941 [0,0,0,0,1,0|3,0,0]=4 1752 B16R2.124 Nc1cc(ncc1O)Sc2ccncc2 62a_100009819941_100000728582 [0,0,0,0,1,0|3,0,0]=4 1753 B16R2.124 Nc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100000750455 [0,0,0,0,1,0|3,0,0]=4 1754 B16R2.124 Nc1ccc(cc1Br)Sc2ccccc2 62a_100000750455_100000041952 [0,0,0,0,1,0|3,0,0]=4 1755 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100011218065 [0,0,0,0,1,0|3,0,0]=4 1756 B16R2.124 Nc1ccc(cc1Cl)Sc2ccccc2 62a_100011218065_100000041952 [0,0,0,0,1,0|3,0,0]=4 1757 B16R2.124 Nc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100011215594 [0,0,0,0,1,0|3,0,0]=4 1758 B16R2.124 Nc1ccc(cc1F)Sc2ccccc2 62a_100011215594_100000041952 [0,0,0,0,1,0|3,0,0]=4 1759 B16R2.124 Nc1ccc(cc1N)Sc2ccccc2 62a_100000719477_100011534411 [0,0,0,0,1,0|3,0,0]=4 1760 B16R2.124 Nc1ccc(cc1N)Sc2ccccc2 62a_100000741789_100000041952 [0,0,0,0,1,0|3,0,0]=4 1761 B16R2.124 Nc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100000739049 [0,0,0,0,1,0|2,0,1]=4 1762 B16R2.124 Nc1ccc(cc1O)Sc2ccccc2 62a_100000739049_100000041952 [0,0,0,0,1,0|2,0,1]=4 1763 B16R2.124 Nc1cnc(cc1N)Sc2ccccc2 62a_100000067514_100000041952 [0,0,0,0,1,0|3,0,0]=4 1764 B16R2.124 Nc1cnc(cc1N)Sc2ccccc2 62a_100000719477_100000067514 [0,0,0,0,1,0|3,0,0]=4 1765 B16R2.124 Nc1nc(ccc1O)Sc2ccccc2 62a_100000685527_100000041952 [0,0,0,0,1,0|3,0,0]=4 1766 B16R2.124 Nc1nc(ccc1O)Sc2ccccc2 62a_100000719477_100000685527 [0,0,0,0,1,0|3,0,0]=4 1767 B16R2.124 Oc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100012356990 [0,0,0,0,1,0|2,0,1]=4 1768 B16R2.124 Oc1cc(ccc1Br)Sc2ccccc2 62a_100012356990_100000041952 [0,0,0,0,1,0|2,0,1]=4 1769 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100011356854 [0,0,0,0,1,0|2,0,1]=4 1770 B16R2.124 Oc1cc(ccc1Cl)Sc2ccccc2 62a_100011356854_100000041952 [0,0,0,0,1,0|2,0,1]=4 1771 B16R2.124 Oc1cc(ccc1F)Sc2ccccc2 62a_100000686035_100000041952 [0,0,0,0,1,0|2,0,1]=4 1772 B16R2.124 Oc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100000686035 [0,0,0,0,1,0|2,0,1]=4 1773 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100009854642 [0,0,0,0,1,0|2,0,1]=4 1774 B16R2.124 Oc1cc(ncc1F)Sc2ccccc2 62a_100009854642_100000041952 [0,0,0,0,1,0|2,0,1]=4 1775 B16R2.124 Oc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100012361655 [0,0,0,0,1,0|2,0,0]=3 1776 B16R2.124 Oc1ccc(cc1Br)Sc2ccccc2 62a_100012361655_100000041952 [0,0,0,0,1,0|2,0,0]=3 1777 B16R2.124 Oc1ccc(cc1Br)Sc2ccccn2 62a_100011216584_100012361655 [0,0,0,0,1,0|3,0,0]=4 1778 B16R2.124 Oc1ccc(cc1Br)Sc2ccccn2 62a_100012361655_100011216584 [0,0,0,0,1,0|3,0,0]=4 1779 B16R2.124 Oc1ccc(cc1Br)Sc2cccnc2 62a_100000210063_100012361655 [0,0,0,0,1,0|3,0,0]=4 1780 B16R2.124 Oc1ccc(cc1Br)Sc2cccnc2 62a_100012361655_100000210063 [0,0,0,0,1,0|3,0,0]=4 1781 B16R2.124 Oc1ccc(cc1Br)Sc2ccncc2 62a_100000728582_100012361655 [0,0,0,0,1,0|3,0,0]=4 1782 B16R2.124 Oc1ccc(cc1Br)Sc2ccncc2 62a_100012361655_100000728582 [0,0,0,0,1,0|3,0,0]=4 1783 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100012360047 [0,0,0,0,1,0|2,0,0]=3 1784 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccc2 62a_100012360047_100000041952 [0,0,0,0,1,0|2,0,0]=3 1785 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccn2 62a_100011216584_100012360047 [0,0,0,0,1,0|3,0,0]=4 1786 B16R2.124 Oc1ccc(cc1Cl)Sc2ccccn2 62a_100012360047_100011216584 [0,0,0,0,1,0|3,0,0]=4 1787 B16R2.124 Oc1ccc(cc1Cl)Sc2cccnc2 62a_100000210063_100012360047 [0,0,0,0,1,0|3,0,0]=4 1788 B16R2.124 Oc1ccc(cc1Cl)Sc2cccnc2 62a_100012360047_100000210063 [0,0,0,0,1,0|3,0,0]=4 1789 B16R2.124 Oc1ccc(cc1Cl)Sc2ccncc2 62a_100000728582_100012360047 [0,0,0,0,1,0|3,0,0]=4 1790 B16R2.124 Oc1ccc(cc1Cl)Sc2ccncc2 62a_100012360047_100000728582 [0,0,0,0,1,0|3,0,0]=4 1791 B16R2.124 Oc1ccc(cc1F)Sc2ccccc2 62a_100000185481_100000041952 [0,0,0,0,1,0|2,0,0]=3 1792 B16R2.124 Oc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000185481 [0,0,0,0,1,0|2,0,0]=3 1793 B16R2.124 Oc1ccc(cc1F)Sc2ccccn2 62a_100000185481_100011216584 [0,0,0,0,1,0|3,0,0]=4 1794 B16R2.124 Oc1ccc(cc1F)Sc2ccccn2 62a_100011216584_100000185481 [0,0,0,0,1,0|3,0,0]=4 1795 B16R2.124 Oc1ccc(cc1F)Sc2cccnc2 62a_100000185481_100000210063 [0,0,0,0,1,0|3,0,0]=4 1796 B16R2.124 Oc1ccc(cc1F)Sc2cccnc2 62a_100000210063_100000185481 [0,0,0,0,1,0|3,0,0]=4 1797 B16R2.124 Oc1ccc(cc1F)Sc2ccncc2 62a_100000185481_100000728582 [0,0,0,0,1,0|3,0,0]=4 1798 B16R2.124 Oc1ccc(cc1F)Sc2ccncc2 62a_100000728582_100000185481 [0,0,0,0,1,0|3,0,0]=4 1799 B16R2.124 Oc1ccc(cc1O)Oc2ccccc2 271570a_203496583355_200010989656 [0,0,0,0,1,0|1,1,1]=4 1800 B16R2.124 Oc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100009813601 [0,0,0,0,1,0|1,0,1]=3 1801 B16R2.124 Oc1ccc(cc1O)Sc2ccccn2 62a_100011216584_100009813601 [0,0,0,0,1,0|2,0,1]=4 1802 B16R2.124 Oc1ccc(cc1O)Sc2cccnc2 62a_100000210063_100009813601 [0,0,0,0,1,0|2,0,1]=4 1803 B16R2.124 Oc1ccc(cc1O)Sc2ccncc2 62a_100000728582_100009813601 [0,0,0,0,1,0|2,0,1]=4 1804 B16R2.124 Oc1ccc(nc1Br)Sc2ccccc2 62a_100000719477_100000725334 [0,0,0,0,1,0|3,0,0]=4 1805 B16R2.124 Oc1ccc(nc1Br)Sc2ccccc2 62a_100000725334_100000041952 [0,0,0,0,1,0|3,0,0]=4 1806 B16R2.124 Oc1ccc(nc1Cl)Sc2ccccc2 62a_100000719477_100000721234 [0,0,0,0,1,0|3,0,0]=4 1807 B16R2.124 Oc1ccc(nc1F)Sc2ccccc2 62a_100000719477_100009819667 [0,0,0,0,1,0|3,0,0]=4 1808 B16R2.124 Oc1ccc(nc1F)Sc2ccccc2 62a_100009819667_100000041952 [0,0,0,0,1,0|3,0,0]=4 1809 B16R2.124 Oc1ncc(cc1Cl)Sc2ccccc2 62a_100000719477_100010238531 [0,0,0,0,1,0|3,0,0]=4 1810 B16R2.124 Oc1ncc(cc1Cl)Sc2ccccc2 62a_100010238531_100000041952 [0,0,0,0,1,0|3,0,0]=4 1811 B16R2.1063 O=c1cc(occ1O)COc2ccsc2 7a_100000106738_100000010605 [0,0,0,0,1,0|1,1,0]=3 1812 B16R2.1063 O=c1cc(occ1O)CSc2c[nH]cn2 62a_100000756875_100000010605 [0,0,0,0,1,0|2,0,0]=3 1813 B16R2.1063 O=c1cc(occ1O)CSc2c[nH]nn2 62a_100009819707_100000010605 [0,0,0,0,1,0|3,0,0]=4 1814 B16R2.1063 O=c1cc(occ1O)CSc2cc[nH]n2 62a_100000062575_100000010605 [0,0,0,0,1,0|2,0,0]=3 1815 B16R2.1063 O=c1cc(occ1O)CSc2ccco2 62a_100009814098_100000010605 [0,0,0,0,1,0|1,0,0]=2 1816 B16R2.1063 O=c1cc(occ1O)CSc2cccs2 62a_100011215356_100000010605 [0,0,0,0,1,0|1,0,0]=2 1817 B16R2.1063 O=c1cc(occ1O)CSc2ccoc2 62a_100011215275_100000010605 [0,0,0,0,1,0|1,0,0]=2 1818 B16R2.1063 O=c1cc(occ1O)CSc2ccon2 62a_100009818083_100000010605 [0,0,0,0,1,0|2,0,0]=3 1819 B16R2.1063 O=c1cc(occ1O)CSc2ccsc2 62a_100000738268_100000010605 [0,0,0,0,1,0|1,0,0]=2 1820 B16R2.1063 O=c1cc(occ1O)CSc2ccsn2 62a_100009818082_100000010605 [0,0,0,0,1,0|2,0,0]=3 1821 B16R2.1063 O=c1cc(occ1O)CSc2cn[nH]c2 62a_100000238712_100000010605 [0,0,0,0,1,0|2,0,0]=3 1822 B16R2.1063 O=c1cc(occ1O)CSc2cnco2 62a_100020591547_100000010605 [0,0,0,0,1,0|2,0,0]=3 1823 B16R2.1063 O=c1cc(occ1O)CSc2cncs2 62a_100011934649_100000010605 [0,0,0,0,1,0|2,0,0]=3 1824 B16R2.1063 O=c1cc(occ1O)CSc2cnoc2 62a_100009815712_100000010605 [0,0,0,0,1,0|2,0,0]=3 1825 B16R2.1063 O=c1cc(occ1O)CSc2cnsc2 62a_100009815736_100000010605 [0,0,0,0,1,0|2,0,0]=3 1826 B16R2.1063 O=c1cc(occ1O)CSc2cscn2 62a_100000751502_100000010605 [0,0,0,0,1,0|2,0,0]=3 1827 B16R2.1063 O=c1cc(occ1O)CSc2nc[nH]n2 62a_100000761765_100000010605 [0,0,0,0,1,0|3,0,0]=4 1828 B16R2.1063 O=c1cc(occ1O)CSc2ncc[nH]2 62a_100025796157_100000010605 [0,0,0,0,1,0|2,0,0]=3 1829 B16R2.1063 O=c1cc(occ1O)CSc2ncco2 62a_100011787736_100000010605 [0,0,0,0,1,0|2,0,0]=3 1830 B16R2.1063 O=c1cc(occ1O)CSc2nccs2 62a_100000211983_100000010605 [0,0,0,0,1,0|2,0,0]=3 1831 B16R2.1063 O=c1cc(occ1O)CSc2ncns2 62a_100000693119_100000010605 [0,0,0,0,1,0|3,0,0]=4 1832 B16R2.1063 O=c1cc(occ1O)CSc2nncs2 62a_100000739804_100000010605 [0,0,0,0,1,0|3,0,0]=4 1833 B16R2.2884 Brc1cc(oc1Br)CNc2ccccc2 207a_100000106764_100000188521 [0,0,0,0,1,0|3,0,0]=4 1834 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012353900 [0,0,0,0,0,1|3,0,0]=4 1835 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccc2 62a_100012353900_100015291786 [0,0,0,0,0,1|3,0,0]=4 1836 B18R2.8976 Brc1ccc(cc1Br)NCSc2ccccc2 2230a_100011306057_100011218342 [0,0,0,0,0,1|3,0,0]=4 1837 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010146616 [0,0,0,0,0,1|3,0,0]=4 1838 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccc2 62a_100010146616_100015291786 [0,0,0,0,0,1|3,0,0]=4 1839 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100000727479 [0,0,0,0,0,1|3,0,0]=4 1840 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccc2 62a_100000727479_100015291786 [0,0,0,0,0,1|3,0,0]=4 1841 B18R2.8976 Cc1cc(ccc1Br)NCSc2ccccc2 2230a_100000210723_100011218342 [0,0,0,0,0,1|3,0,0]=4 1842 B18R2.8976 Cc1cc(ccc1Br)SCSc2ccccc2 62a_100009813585_100011218342 [0,0,0,0,0,1|3,0,0]=4 1843 B18R2.8976 Cc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100009813585 [0,0,0,0,0,1|3,0,0]=4 1844 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccc2 62a_100000211182_100012184735 [0,0,0,0,0,1|3,0,0]=4 1845 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccc2 62a_100012184735_100015291786 [0,0,0,0,0,1|3,0,0]=4 1846 B18R2.8976 Cc1cc(ccc1Cl)NCSc2ccccc2 2230a_100000187808_100011218342 [0,0,0,0,0,1|3,0,0]=4 1847 B18R2.8976 Cc1cc(ccc1Cl)SCSc2ccccc2 62a_100000049509_100011218342 [0,0,0,0,0,1|3,0,0]=4 1848 B18R2.8976 Cc1cc(ccc1Cl)SCSc2ccccc2 62a_100011218342_100000049509 [0,0,0,0,0,1|3,0,0]=4 1849 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccc2 62a_100000211182_100011216667 [0,0,0,0,0,1|3,0,0]=4 1850 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccc2 62a_100011216667_100015291786 [0,0,0,0,0,1|3,0,0]=4 1851 B18R2.8976 Cc1cc(ccc1F)NCSc2ccccc2 2230a_100000750164_100011218342 [0,0,0,0,0,1|3,0,0]=4 1852 B18R2.8976 Cc1cc(ccc1F)SCSc2ccccc2 62a_100011218330_100011218342 [0,0,0,0,0,1|3,0,0]=4 1853 B18R2.8976 Cc1cc(ccc1F)SCSc2ccccc2 62a_100011218342_100011218330 [0,0,0,0,0,1|3,0,0]=4 1854 B18R2.8976 Cc1cc(ccc1N)SCSc2ccccc2 62a_100000211769_100011218342 [0,0,0,0,0,1|3,0,0]=4 1855 B18R2.8976 Cc1cc(ccc1N)SCSc2ccccc2 62a_100011218342_100000211769 [0,0,0,0,0,1|3,0,0]=4 1856 B18R2.8976 Cc1cc(ccc1O)NCCc2ccccc2 34a_100011218179_100000765856 [0,0,0,0,0,1|3,0,0]=4 1857 B18R2.8976 Cc1cc(ccc1O)NCCc2ccccc2 7a_100011218179_100000765856 [0,0,0,0,0,1|3,0,0]=4 1858 B18R2.8976 Cc1cc(ccc1O)SCCc2ccccc2 62a_100000765856_100000186361 [0,0,0,0,0,1|3,0,0]=4 1859 B18R2.8976 Cc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000186361 [0,0,0,0,0,1|2,0,0]=3 1860 B18R2.8976 Cc1cc(cnc1O)SCSc2ccccc2 62a_100000685391_100011218342 [0,0,0,0,0,1|3,0,0]=4 1861 B18R2.8976 Cc1cc(cnc1O)SCSc2ccccc2 62a_100011218342_100000685391 [0,0,0,0,0,1|3,0,0]=4 1862 B18R2.8976 Cc1cc(ncc1Br)SCSc2ccccc2 62a_100011218342_100012356354 [0,0,0,0,0,1|3,0,0]=4 1863 B18R2.8976 Cc1cc(ncc1Br)SCSc2ccccc2 62a_100012356354_100011218342 [0,0,0,0,0,1|3,0,0]=4 1864 B18R2.8976 Cc1cc(ncc1F)SCSc2ccccc2 62a_100009818257_100011218342 [0,0,0,0,0,1|3,0,0]=4 1865 B18R2.8976 Cc1cc(ncc1F)SCSc2ccccc2 62a_100011218342_100009818257 [0,0,0,0,0,1|3,0,0]=4 1866 B18R2.8976 Cc1cc(ncc1N)SCSc2ccccc2 62a_100000067204_100011218342 [0,0,0,0,0,1|3,0,0]=4 1867 B18R2.8976 Cc1cc(ncc1N)SCSc2ccccc2 62a_100011218342_100000067204 [0,0,0,0,0,1|3,0,0]=4 1868 B18R2.8976 Cc1cc(ncc1O)SCCc2ccccc2 62a_100000765856_100000692680 [0,0,0,0,0,1|3,0,0]=4 1869 B18R2.8976 Cc1cc(ncc1O)SCSc2ccccc2 62a_100011218342_100000692680 [0,0,0,0,0,1|2,0,0]=3 1870 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012232412 [0,0,0,0,0,1|3,0,0]=4 1871 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccc2 62a_100012232412_100015291786 [0,0,0,0,0,1|3,0,0]=4 1872 B18R2.8976 Cc1ccc(cc1Br)NCSc2ccccc2 2230a_100000736455_100011218342 [0,0,0,0,0,1|3,0,0]=4 1873 B18R2.8976 Cc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100011847877 [0,0,0,0,0,1|3,0,0]=4 1874 B18R2.8976 Cc1ccc(cc1Br)SCSc2ccccc2 62a_100011847877_100011218342 [0,0,0,0,0,1|3,0,0]=4 1875 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccc2 62a_100000211182_100000742320 [0,0,0,0,0,1|3,0,0]=4 1876 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccc2 62a_100000742320_100015291786 [0,0,0,0,0,1|3,0,0]=4 1877 B18R2.8976 Cc1ccc(cc1C)NCSc2ccccc2 2230a_100000724040_100011218342 [0,0,0,0,0,1|3,0,0]=4 1878 B18R2.8976 Cc1ccc(cc1C)SCSc2ccccc2 62a_100011215607_100011218342 [0,0,0,0,0,1|3,0,0]=4 1879 B18R2.8976 Cc1ccc(cc1C)SCSc2ccccc2 62a_100011218342_100011215607 [0,0,0,0,0,1|3,0,0]=4 1880 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100011823929 [0,0,0,0,0,1|3,0,0]=4 1881 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccc2 62a_100011823929_100015291786 [0,0,0,0,0,1|3,0,0]=4 1882 B18R2.8976 Cc1ccc(cc1Cl)NCSc2ccccc2 2230a_100000188892_100011218342 [0,0,0,0,0,1|3,0,0]=4 1883 B18R2.8976 Cc1ccc(cc1Cl)SCSc2ccccc2 62a_100011216363_100011218342 [0,0,0,0,0,1|3,0,0]=4 1884 B18R2.8976 Cc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100011216363 [0,0,0,0,0,1|3,0,0]=4 1885 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccc2 62a_100000211182_100011217369 [0,0,0,0,0,1|3,0,0]=4 1886 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccc2 62a_100011217369_100015291786 [0,0,0,0,0,1|3,0,0]=4 1887 B18R2.8976 Cc1ccc(cc1F)NCSc2ccccc2 2230a_100000210958_100011218342 [0,0,0,0,0,1|3,0,0]=4 1888 B18R2.8976 Cc1ccc(cc1F)SCSc2ccccc2 62a_100000720648_100011218342 [0,0,0,0,0,1|3,0,0]=4 1889 B18R2.8976 Cc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100000720648 [0,0,0,0,0,1|3,0,0]=4 1890 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010206137 [0,0,0,0,0,1|3,0,0]=4 1891 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccc2 62a_100010206137_100015291786 [0,0,0,0,0,1|3,0,0]=4 1892 B18R2.8976 Cc1ccc(cc1N)SCSc2ccccc2 62a_100000761890_100011218342 [0,0,0,0,0,1|3,0,0]=4 1893 B18R2.8976 Cc1ccc(cc1N)SCSc2ccccc2 62a_100011218342_100000761890 [0,0,0,0,0,1|3,0,0]=4 1894 B18R2.8976 Cc1ccc(cc1O)SCSc2ccccc2 62a_100000685420_100011218342 [0,0,0,0,0,1|2,0,1]=4 1895 B18R2.8976 Cc1ccc(cc1O)SCSc2ccccc2 62a_100011218342_100000685420 [0,0,0,0,0,1|2,0,1]=4 1896 B18R2.8976 Cc1cnc(cc1C)SCSc2ccccc2 62a_100009850809_100011218342 [0,0,0,0,0,1|3,0,0]=4 1897 B18R2.8976 Cc1cnc(cc1C)SCSc2ccccc2 62a_100011218342_100009850809 [0,0,0,0,0,1|3,0,0]=4 1898 B18R2.8976 Cc1cnc(cc1F)SCSc2ccccc2 62a_100009841206_100011218342 [0,0,0,0,0,1|3,0,0]=4 1899 B18R2.8976 Cc1cnc(cc1F)SCSc2ccccc2 62a_100011218342_100009841206 [0,0,0,0,0,1|3,0,0]=4 1900 B18R2.8976 Cc1cnc(cc1N)SCSc2ccccc2 62a_100000126663_100011218342 [0,0,0,0,0,1|3,0,0]=4 1901 B18R2.8976 Cc1cnc(cc1N)SCSc2ccccc2 62a_100011218342_100000126663 [0,0,0,0,0,1|3,0,0]=4 1902 B18R2.8976 Cc1cnc(cc1O)SCSc2ccccc2 62a_100000704368_100011218342 [0,0,0,0,0,1|2,0,1]=4 1903 B18R2.8976 Cc1cnc(cc1O)SCSc2ccccc2 62a_100011218342_100000704368 [0,0,0,0,0,1|2,0,1]=4 1904 B18R2.8976 Cc1nc(ccc1O)SCSc2ccccc2 62a_100010233687_100011218342 [0,0,0,0,0,1|3,0,0]=4 1905 B18R2.8976 Cc1nc(ccc1O)SCSc2ccccc2 62a_100011218342_100010233687 [0,0,0,0,0,1|3,0,0]=4 1906 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100012353895 [0,0,0,0,0,1|3,0,0]=4 1907 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccc2 62a_100012353895_100015291786 [0,0,0,0,0,1|3,0,0]=4 1908 B18R2.8976 Clc1cc(ccc1Br)NCSc2ccccc2 2230a_100000687081_100011218342 [0,0,0,0,0,1|3,0,0]=4 1909 B18R2.8976 Clc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100012047281 [0,0,0,0,0,1|3,0,0]=4 1910 B18R2.8976 Clc1cc(ccc1Br)SCSc2ccccc2 62a_100012047281_100011218342 [0,0,0,0,0,1|3,0,0]=4 1911 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccc2 62a_100000211182_100012349665 [0,0,0,0,0,1|3,0,0]=4 1912 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccc2 62a_100012349665_100015291786 [0,0,0,0,0,1|3,0,0]=4 1913 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012353894 [0,0,0,0,0,1|3,0,0]=4 1914 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccc2 62a_100012353894_100015291786 [0,0,0,0,0,1|3,0,0]=4 1915 B18R2.8976 Clc1ccc(cc1Br)NCSc2ccccc2 2230a_100000686031_100011218342 [0,0,0,0,0,1|3,0,0]=4 1916 B18R2.8976 Clc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100012353702 [0,0,0,0,0,1|3,0,0]=4 1917 B18R2.8976 Clc1ccc(cc1Br)SCSc2ccccc2 62a_100012353702_100011218342 [0,0,0,0,0,1|3,0,0]=4 1918 B18R2.8976 Clc1ccc(cc1Cl)CCSc2ccccc2 62a_100000719477_100011713676 [0,0,0,0,0,1|3,0,0]=4 1919 B18R2.8976 Clc1ccc(cc1Cl)CCSc2ccccc2 62a_100011713676_100000041952 [0,0,0,0,0,1|3,0,0]=4 1920 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccc2 62a_100000184707_100015291786 [0,0,0,0,0,1|3,0,0]=4 1921 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100000184707 [0,0,0,0,0,1|3,0,0]=4 1922 B18R2.8976 Clc1ccc(cc1Cl)NCSc2ccccc2 2230a_100000184108_100011218342 [0,0,0,0,0,1|3,0,0]=4 1923 B18R2.8976 Clc1ccc(cc1Cl)SCSc2ccccc2 62a_100011214914_100011218342 [0,0,0,0,0,1|3,0,0]=4 1924 B18R2.8976 Clc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100011214914 [0,0,0,0,0,1|3,0,0]=4 1925 B18R2.8976 Cn1ccc(cc1=O)SCSc2ccccc2 62a_100009820031_100011218342 [0,0,0,0,0,1|3,0,0]=4 1926 B18R2.8976 Cn1ccc(cc1=O)SCSc2ccccc2 62a_100011218342_100009820031 [0,0,0,0,0,1|3,0,0]=4 1927 B18R2.8976 Cn1cnc(cc1=O)SCSc2ccccc2 62a_100011218342_100012179353 [0,0,0,0,0,1|3,0,0]=4 1928 B18R2.8976 Cn1cnc(cc1=O)SCSc2ccccc2 62a_100012179353_100011218342 [0,0,0,0,0,1|3,0,0]=4 1929 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100000767054 [0,0,0,0,0,1|3,0,0]=4 1930 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccc2 62a_100000767054_100015291786 [0,0,0,0,0,1|3,0,0]=4 1931 B18R2.8976 Fc1cc(ccc1Br)NCSc2ccccc2 2230a_100000759894_100011218342 [0,0,0,0,0,1|3,0,0]=4 1932 B18R2.8976 Fc1cc(ccc1Br)SCSc2ccccc2 62a_100000685389_100011218342 [0,0,0,0,0,1|3,0,0]=4 1933 B18R2.8976 Fc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100000685389 [0,0,0,0,0,1|3,0,0]=4 1934 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccc2 62a_100000211182_100000716492 [0,0,0,0,0,1|3,0,0]=4 1935 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccc2 62a_100000716492_100015291786 [0,0,0,0,0,1|3,0,0]=4 1936 B18R2.8976 Fc1cc(ccc1Cl)NCSc2ccccc2 2230a_100000739366_100011218342 [0,0,0,0,0,1|3,0,0]=4 1937 B18R2.8976 Fc1cc(ccc1Cl)SCSc2ccccc2 62a_100011216805_100011218342 [0,0,0,0,0,1|3,0,0]=4 1938 B18R2.8976 Fc1cc(ccc1Cl)SCSc2ccccc2 62a_100011218342_100011216805 [0,0,0,0,0,1|3,0,0]=4 1939 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccc2 62a_100000211182_100010149604 [0,0,0,0,0,1|3,0,0]=4 1940 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccc2 62a_100010149604_100015291786 [0,0,0,0,0,1|3,0,0]=4 1941 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100011206884 [0,0,0,0,0,1|3,0,0]=4 1942 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccc2 62a_100011206884_100015291786 [0,0,0,0,0,1|3,0,0]=4 1943 B18R2.8976 Fc1ccc(cc1Br)NCSc2ccccc2 2230a_100000760356_100011218342 [0,0,0,0,0,1|3,0,0]=4 1944 B18R2.8976 Fc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100012047266 [0,0,0,0,0,1|3,0,0]=4 1945 B18R2.8976 Fc1ccc(cc1Br)SCSc2ccccc2 62a_100012047266_100011218342 [0,0,0,0,0,1|3,0,0]=4 1946 B18R2.8976 Fc1ccc(cc1Cl)CCSc2ccccc2 62a_100000719477_100012361305 [0,0,0,0,0,1|3,0,0]=4 1947 B18R2.8976 Fc1ccc(cc1Cl)CCSc2ccccc2 62a_100012361305_100000041952 [0,0,0,0,0,1|3,0,0]=4 1948 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100011934319 [0,0,0,0,0,1|3,0,0]=4 1949 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccc2 62a_100000717365_100015291786 [0,0,0,0,0,1|3,0,0]=4 1950 B18R2.8976 Fc1ccc(cc1Cl)NCSc2ccccc2 2230a_100000211060_100011218342 [0,0,0,0,0,1|3,0,0]=4 1951 B18R2.8976 Fc1ccc(cc1Cl)SCSc2ccccc2 62a_100011215976_100011218342 [0,0,0,0,0,1|3,0,0]=4 1952 B18R2.8976 Fc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100011215976 [0,0,0,0,0,1|3,0,0]=4 1953 B18R2.8976 Fc1ccc(cc1F)CCSc2ccccc2 62a_100000690553_100000041952 [0,0,0,0,0,1|3,0,0]=4 1954 B18R2.8976 Fc1ccc(cc1F)CCSc2ccccc2 62a_100000719477_100000690553 [0,0,0,0,0,1|3,0,0]=4 1955 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccc2 62a_100000211182_100000757363 [0,0,0,0,0,1|3,0,0]=4 1956 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccc2 62a_100000757363_100015291786 [0,0,0,0,0,1|3,0,0]=4 1957 B18R2.8976 Fc1ccc(cc1F)NCSc2ccccc2 2230a_100000210724_100011218342 [0,0,0,0,0,1|3,0,0]=4 1958 B18R2.8976 Fc1ccc(cc1F)SCSc2ccccc2 62a_100000703953_100011218342 [0,0,0,0,0,1|3,0,0]=4 1959 B18R2.8976 Fc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100000703953 [0,0,0,0,0,1|3,0,0]=4 1960 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010188208 [0,0,0,0,0,1|3,0,0]=4 1961 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccc2 62a_100010188208_100015291786 [0,0,0,0,0,1|3,0,0]=4 1962 B18R2.8976 Nc1cc(ccc1Br)SCSc2ccccc2 62a_100000750456_100011218342 [0,0,0,0,0,1|3,0,0]=4 1963 B18R2.8976 Nc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100000750456 [0,0,0,0,0,1|3,0,0]=4 1964 B18R2.8976 Nc1cc(ccc1Cl)SCSc2ccccc2 62a_100011218342_200000761891 [0,0,0,0,0,1|3,0,0]=4 1965 B18R2.8976 Nc1cc(ccc1Cl)SCSc2ccccc2 62a_200000761891_100011218342 [0,0,0,0,0,1|3,0,0]=4 1966 B18R2.8976 Nc1cc(ccc1F)SCSc2ccccc2 62a_100000740924_100011218342 [0,0,0,0,0,1|3,0,0]=4 1967 B18R2.8976 Nc1cc(ccc1F)SCSc2ccccc2 62a_100011218342_100000740924 [0,0,0,0,0,1|3,0,0]=4 1968 B18R2.8976 Nc1cc(ccc1O)SCCc2ccccc2 62a_100000752626_100011218657 [0,0,0,0,0,1|3,0,0]=4 1969 B18R2.8976 Nc1cc(ccc1O)SCCc2ccccc2 62a_100000765856_100000752626 [0,0,0,0,0,1|3,0,0]=4 1970 B18R2.8976 Nc1cc(ccc1O)SCSc2ccccc2 62a_100000752626_100011218342 [0,0,0,0,0,1|2,0,0]=3 1971 B18R2.8976 Nc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000752626 [0,0,0,0,0,1|2,0,0]=3 1972 B18R2.8976 Nc1cc(cnc1O)SCSc2ccccc2 62a_100000743729_100011218342 [0,0,0,0,0,1|3,0,0]=4 1973 B18R2.8976 Nc1cc(cnc1O)SCSc2ccccc2 62a_100011218342_100000743729 [0,0,0,0,0,1|3,0,0]=4 1974 B18R2.8976 Nc1cc(ncc1F)SCSc2ccccc2 62a_100000126464_100011218342 [0,0,0,0,0,1|3,0,0]=4 1975 B18R2.8976 Nc1cc(ncc1F)SCSc2ccccc2 62a_100011218342_100000126464 [0,0,0,0,0,1|3,0,0]=4 1976 B18R2.8976 Nc1cc(ncc1O)SCCc2ccccc2 62a_100000765856_100009819941 [0,0,0,0,0,1|3,0,0]=4 1977 B18R2.8976 Nc1cc(ncc1O)SCCc2ccccc2 62a_100009819941_100011218657 [0,0,0,0,0,1|3,0,0]=4 1978 B18R2.8976 Nc1cc(ncc1O)SCSc2ccccc2 62a_100009819941_100011218342 [0,0,0,0,0,1|2,0,0]=3 1979 B18R2.8976 Nc1cc(ncc1O)SCSc2ccccc2 62a_100011218342_100009819941 [0,0,0,0,0,1|2,0,0]=3 1980 B18R2.8976 Nc1ccc(cc1Br)SCSc2ccccc2 62a_100000750455_100011218342 [0,0,0,0,0,1|3,0,0]=4 1981 B18R2.8976 Nc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100000750455 [0,0,0,0,0,1|3,0,0]=4 1982 B18R2.8976 Nc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218065_100011218342 [0,0,0,0,0,1|3,0,0]=4 1983 B18R2.8976 Nc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100011218065 [0,0,0,0,0,1|3,0,0]=4 1984 B18R2.8976 Nc1ccc(cc1F)SCSc2ccccc2 62a_100011215594_100011218342 [0,0,0,0,0,1|3,0,0]=4 1985 B18R2.8976 Nc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100011215594 [0,0,0,0,0,1|3,0,0]=4 1986 B18R2.8976 Nc1ccc(cc1N)SCSc2ccccc2 62a_100000741789_100011218342 [0,0,0,0,0,1|3,0,0]=4 1987 B18R2.8976 Nc1ccc(cc1N)SCSc2ccccc2 62a_100011218342_100011534411 [0,0,0,0,0,1|3,0,0]=4 1988 B18R2.8976 Nc1ccc(cc1O)SCSc2ccccc2 62a_100000739049_100011218342 [0,0,0,0,0,1|2,0,1]=4 1989 B18R2.8976 Nc1ccc(cc1O)SCSc2ccccc2 62a_100011218342_100000739049 [0,0,0,0,0,1|2,0,1]=4 1990 B18R2.8976 Nc1cnc(cc1N)SCSc2ccccc2 62a_100000067514_100011218342 [0,0,0,0,0,1|3,0,0]=4 1991 B18R2.8976 Nc1cnc(cc1N)SCSc2ccccc2 62a_100011218342_100000067514 [0,0,0,0,0,1|3,0,0]=4 1992 B18R2.8976 Nc1nc(ccc1O)SCSc2ccccc2 62a_100000685527_100011218342 [0,0,0,0,0,1|3,0,0]=4 1993 B18R2.8976 Nc1nc(ccc1O)SCSc2ccccc2 62a_100011218342_100000685527 [0,0,0,0,0,1|3,0,0]=4 1994 B18R2.8976 O=c1cc(occ1O)CNCc2ccccc2 2230a_100015324214_100000010605 [0,0,0,0,0,1|1,0,0]=2 1995 B18R2.8976 O=c1cc(occ1O)CNCc2cccnn2 2230a_100159270163_100000010605 [0,0,0,0,0,1|3,0,0]=4 1996 B18R2.8976 O=c1cc(occ1O)CNCc2cncnc2 2230a_100011243677_100000010605 [0,0,0,0,0,1|3,0,0]=4 1997 B18R2.8976 O=c1cc(occ1O)COCc2ccccc2 7a_100000210790_100000010605 [0,0,0,0,0,1|0,1,0]=2 1998 B18R2.8976 O=c1cc(occ1O)CSCc2ccccc2 62a_100000211182_100000010605 [0,0,0,0,0,1|0,0,0]=1 1999 B18R2.8976 O=c1cc(occ1O)CSCc2ccccn2 62a_100000721315_100000010605 [0,0,0,0,0,1|1,0,0]=2 2000 B18R2.8976 O=c1cc(occ1O)CSCc2cccnc2 62a_100000741622_100000010605 [0,0,0,0,0,1|1,0,0]=2 2001 B18R2.8976 O=c1cc(occ1O)CSCc2cccnn2 62a_100016990269_100000010605 [0,0,0,0,0,1|2,0,0]=3 2002 B18R2.8976 O=c1cc(occ1O)CSCc2ccncc2 62a_100015193705_100000010605 [0,0,0,0,0,1|1,0,0]=2 2003 B18R2.8976 O=c1cc(occ1O)CSCc2cnccn2 62a_100016995436_100000010605 [0,0,0,0,0,1|2,0,0]=3 2004 B18R2.8976 O=c1cc(occ1O)CSCc2cncnc2 62a_100015196519_100000010605 [0,0,0,0,0,1|2,0,0]=3 2005 B18R2.8976 O=c1cc(occ1O)CSCc2ncccn2 62a_100000703007_100000010605 [0,0,0,0,0,1|2,0,0]=3 2006 B18R2.8976 Oc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100012356990 [0,0,0,0,0,1|2,0,1]=4 2007 B18R2.8976 Oc1cc(ccc1Br)SCSc2ccccc2 62a_100012356990_100011218342 [0,0,0,0,0,1|2,0,1]=4 2008 B18R2.8976 Oc1cc(ccc1Cl)SCSc2ccccc2 62a_100011218342_100011356854 [0,0,0,0,0,1|2,0,1]=4 2009 B18R2.8976 Oc1cc(ccc1Cl)SCSc2ccccc2 62a_100011356854_100011218342 [0,0,0,0,0,1|2,0,1]=4 2010 B18R2.8976 Oc1cc(ccc1F)SCSc2ccccc2 62a_100000686035_100011218342 [0,0,0,0,0,1|2,0,1]=4 2011 B18R2.8976 Oc1cc(ccc1F)SCSc2ccccc2 62a_100011218342_100000686035 [0,0,0,0,0,1|2,0,1]=4 2012 B18R2.8976 Oc1cc(ncc1F)SCSc2ccccc2 62a_100009854642_100011218342 [0,0,0,0,0,1|2,0,1]=4 2013 B18R2.8976 Oc1cc(ncc1F)SCSc2ccccc2 62a_100011218342_100009854642 [0,0,0,0,0,1|2,0,1]=4 2014 B18R2.8976 Oc1ccc(cc1Br)NCCc2ccccc2 34a_100011534360_100000765856 [0,0,0,0,0,1|3,0,0]=4 2015 B18R2.8976 Oc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100012361655 [0,0,0,0,0,1|3,0,0]=4 2016 B18R2.8976 Oc1ccc(cc1Br)SCCc2ccccc2 62a_100012361655_100011218657 [0,0,0,0,0,1|3,0,0]=4 2017 B18R2.8976 Oc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100012361655 [0,0,0,0,0,1|2,0,0]=3 2018 B18R2.8976 Oc1ccc(cc1Br)SCSc2ccccc2 62a_100012361655_100011218342 [0,0,0,0,0,1|2,0,0]=3 2019 B18R2.8976 Oc1ccc(cc1Cl)NCCc2ccccc2 34a_100000744943_100000765856 [0,0,0,0,0,1|3,0,0]=4 2020 B18R2.8976 Oc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100012360047 [0,0,0,0,0,1|3,0,0]=4 2021 B18R2.8976 Oc1ccc(cc1Cl)SCCc2ccccc2 62a_100012360047_100011218657 [0,0,0,0,0,1|3,0,0]=4 2022 B18R2.8976 Oc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100012360047 [0,0,0,0,0,1|2,0,0]=3 2023 B18R2.8976 Oc1ccc(cc1Cl)SCSc2ccccc2 62a_100012360047_100011218342 [0,0,0,0,0,1|2,0,0]=3 2024 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccc2 270004a_100000758358_100015611070 [0,0,0,0,0,1|3,0,0]=4 2025 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccc2 34a_100000758358_100015291786 [0,0,0,0,0,1|3,0,0]=4 2026 B18R2.8976 Oc1ccc(cc1F)NCCc2ccccc2 34a_100011220035_100000765856 [0,0,0,0,0,1|3,0,0]=4 2027 B18R2.8976 Oc1ccc(cc1F)NCCc2ccccc2 7a_100011220035_100000765856 [0,0,0,0,0,1|3,0,0]=4 2028 B18R2.8976 Oc1ccc(cc1F)SCCc2ccccc2 62a_100000185481_100011218657 [0,0,0,0,0,1|3,0,0]=4 2029 B18R2.8976 Oc1ccc(cc1F)SCCc2ccccc2 62a_100000765856_100000185481 [0,0,0,0,0,1|3,0,0]=4 2030 B18R2.8976 Oc1ccc(cc1F)SCSc2ccccc2 62a_100000185481_100011218342 [0,0,0,0,0,1|2,0,0]=3 2031 B18R2.8976 Oc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100000185481 [0,0,0,0,0,1|2,0,0]=3 2032 B18R2.8976 Oc1ccc(cc1O)CCOc2ccccc2 7a_100000210340_200010393615 [0,0,0,0,0,1|1,1,1]=4 2033 B18R2.8976 Oc1ccc(cc1O)CCSc2ccccc2 62a_100000719477_200010393615 [0,0,0,0,0,1|1,0,1]=3 2034 B18R2.8976 Oc1ccc(cc1O)CCSc2ccccn2 62a_100011216584_200010393615 [0,0,0,0,0,1|2,0,1]=4 2035 B18R2.8976 Oc1ccc(cc1O)CCSc2cccnc2 62a_100000210063_200010393615 [0,0,0,0,0,1|2,0,1]=4 2036 B18R2.8976 Oc1ccc(cc1O)CCSc2ccncc2 62a_100000728582_200010393615 [0,0,0,0,0,1|2,0,1]=4 2037 B18R2.8976 Oc1ccc(cc1O)CNCc2ccccc2 34a_100000010075_100015291786 [0,0,0,0,0,1|2,0,1]=4 2038 B18R2.8976 Oc1ccc(cc1O)NCCc2ccccc2 34a_100102946323_100000765856 [0,0,0,0,0,1|2,0,1]=4 2039 B18R2.8976 Oc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100009813601 [0,0,0,0,0,1|2,0,1]=4 2040 B18R2.8976 Oc1ccc(cc1O)SCSc2ccccc2 62a_100011218342_100009813601 [0,0,0,0,0,1|1,0,1]=3 2041 B18R2.8976 Oc1ccc(nc1Br)SCSc2ccccc2 62a_100000725334_100011218342 [0,0,0,0,0,1|3,0,0]=4 2042 B18R2.8976 Oc1ccc(nc1Br)SCSc2ccccc2 62a_100011218342_100000725334 [0,0,0,0,0,1|3,0,0]=4 2043 B18R2.8976 Oc1ccc(nc1Cl)SCSc2ccccc2 62a_100011218342_100000721234 [0,0,0,0,0,1|3,0,0]=4 2044 B18R2.8976 Oc1ccc(nc1F)SCSc2ccccc2 62a_100009819667_100011218342 [0,0,0,0,0,1|3,0,0]=4 2045 B18R2.8976 Oc1ccc(nc1F)SCSc2ccccc2 62a_100011218342_100009819667 [0,0,0,0,0,1|3,0,0]=4 2046 B18R2.8976 Oc1ncc(cc1Cl)SCSc2ccccc2 62a_100010238531_100011218342 [0,0,0,0,0,1|3,0,0]=4 2047 B18R2.8976 Oc1ncc(cc1Cl)SCSc2ccccc2 62a_100011218342_100010238531 [0,0,0,0,0,1|3,0,0]=4 2048 B15R2.2195 c1ccc(cc1)CNc2ccccc2 207a_100000106764_100015611070 [2,0,0,0,0,0|2,0,0]=4 2049 B15R2.2195 c1ccc(cc1)CNc2ccccc2 270302a_100000106764_100015611070 [2,0,0,0,0,0|2,0,0]=4 2050 B15R2.2195 c1ccc(cc1)CNc2ccccc2 34a_100000106764_100015291786 [2,0,0,0,0,0|2,0,0]=4 2051 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [2,0,0,0,0,0|1,1,0]=4 2052 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [2,0,0,0,0,0|1,1,0]=4 2053 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000211182_100000041952 [2,0,0,0,0,0|1,0,0]=3 2054 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000719477_100015291786 [2,0,0,0,0,0|1,0,0]=3 2055 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100000211182_100011216584 [2,0,0,0,0,0|2,0,0]=4 2056 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100011216584_100015291786 [2,0,0,0,0,0|2,0,0]=4 2057 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000210063_100015291786 [2,0,0,0,0,0|2,0,0]=4 2058 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000211182_100000210063 [2,0,0,0,0,0|2,0,0]=4 2059 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000211182_100000728582 [2,0,0,0,0,0|2,0,0]=4 2060 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000728582_100015291786 [2,0,0,0,0,0|2,0,0]=4 2061 B15R2.2195 c1ccc(cc1)NCc2ccccn2 207a_100000106764_100000209966 [2,0,0,0,0,0|2,0,0]=4 2062 B15R2.2195 c1ccc(cc1)NCc2ccccn2 270302a_100000106764_100000209966 [2,0,0,0,0,0|2,0,0]=4 2063 B15R2.2195 c1ccc(cc1)NCc2ccccn2 34a_100000106764_100000721315 [2,0,0,0,0,0|2,0,0]=4 2064 B15R2.2195 c1ccc(cc1)OCc2ccccn2 34a_100000210340_100000721315 [2,0,0,0,0,0|1,1,0]=4 2065 B15R2.2195 c1ccc(cc1)OCc2ccccn2 7a_100000210340_100000721315 [2,0,0,0,0,0|1,1,0]=4 2066 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000719477_100000721315 [2,0,0,0,0,0|1,0,0]=3 2067 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000721315_100000041952 [2,0,0,0,0,0|1,0,0]=3 2068 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000719477_100000741622 [2,0,0,0,0,0|2,0,0]=4 2069 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000741622_100000041952 [2,0,0,0,0,0|2,0,0]=4 2070 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100000719477_100016990269 [2,0,0,0,0,0|2,0,0]=4 2071 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100016990269_100000041952 [2,0,0,0,0,0|2,0,0]=4 2072 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100000719477_100015193705 [2,0,0,0,0,0|2,0,0]=4 2073 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100015193705_100000041952 [2,0,0,0,0,0|2,0,0]=4 2074 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100000719477_100016995436 [2,0,0,0,0,0|2,0,0]=4 2075 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100016995436_100000041952 [2,0,0,0,0,0|2,0,0]=4 2076 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000703007_100000041952 [2,0,0,0,0,0|2,0,0]=4 2077 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000719477_100000703007 [2,0,0,0,0,0|2,0,0]=4 2078 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100000721315_100011216584 [2,0,0,0,0,0|2,0,0]=4 2079 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100011216584_100000721315 [2,0,0,0,0,0|2,0,0]=4 2080 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000210063_100000721315 [2,0,0,0,0,0|2,0,0]=4 2081 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000721315_100000210063 [2,0,0,0,0,0|2,0,0]=4 2082 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000721315_100000728582 [2,0,0,0,0,0|2,0,0]=4 2083 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000728582_100000721315 [2,0,0,0,0,0|2,0,0]=4 2084 B17R2.48 C#Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000140223 [1,1,0,0,0,0|2,0,0]=4 2085 B17R2.48 C=Cc1ccc(cc1)CSc2ccccc2 62a_100000034074_100000041952 [1,1,0,0,0,0|2,0,0]=4 2086 B17R2.48 C=Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000034074 [1,1,0,0,0,0|2,0,0]=4 2087 B17R2.48 CCc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000747183 [1,1,0,0,0,0|2,0,0]=4 2088 B17R2.48 CCc1ccc(cc1)CSc2ccccc2 62a_100000757233_100000041952 [1,1,0,0,0,0|2,0,0]=4 2089 B17R2.48 COc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000169835 [1,1,0,0,0,0|2,0,0]=4 2090 B17R2.48 COc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000169835 [1,1,0,0,0,0|2,0,0]=4 2091 B17R2.48 COc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000742318 [1,1,0,0,0,0|2,0,0]=4 2092 B17R2.48 COc1ccc(cc1)COc2ccccc2 34a_100000210340_100000742318 [1,1,0,0,0,0|1,1,0]=4 2093 B17R2.48 COc1ccc(cc1)COc2ccccc2 7a_100000210340_100000742318 [1,1,0,0,0,0|1,1,0]=4 2094 B17R2.48 COc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000742318 [1,1,0,0,0,0|1,0,0]=3 2095 B17R2.48 COc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000742318 [1,1,0,0,0,0|2,0,0]=4 2096 B17R2.48 COc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000742318 [1,1,0,0,0,0|2,0,0]=4 2097 B17R2.48 COc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000742318 [1,1,0,0,0,0|2,0,0]=4 2098 B17R2.48 COc1ccc(cn1)CSc2ccccc2 62a_100000719477_100020631284 [1,1,0,0,0,0|2,0,0]=4 2099 B17R2.48 COc1ccc(cn1)CSc2ccccc2 62a_100020631284_100000041952 [1,1,0,0,0,0|2,0,0]=4 2100 B17R2.48 COc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000701244 [1,1,0,0,0,0|2,0,0]=4 2101 B17R2.48 COc1ccc(nc1)CNc2ccccc2 34a_100000106764_200000757186 [1,1,0,0,0,0|2,0,0]=4 2102 B17R2.48 COc1ccc(nc1)COc2ccccc2 34a_100000210340_200000757186 [1,1,0,0,0,0|1,1,0]=4 2103 B17R2.48 COc1ccc(nc1)COc2ccccc2 7a_100000210340_200000757186 [1,1,0,0,0,0|1,1,0]=4 2104 B17R2.48 COc1ccc(nc1)CSc2ccccc2 62a_100000719477_200000757186 [1,1,0,0,0,0|1,0,0]=3 2105 B17R2.48 COc1ccc(nc1)CSc2ccccc2 62a_200000757186_100000041952 [1,1,0,0,0,0|1,0,0]=3 2106 B17R2.48 COc1ccc(nc1)CSc2ccccn2 62a_100011216584_200000757186 [1,1,0,0,0,0|2,0,0]=4 2107 B17R2.48 COc1ccc(nc1)CSc2ccccn2 62a_200000757186_100011216584 [1,1,0,0,0,0|2,0,0]=4 2108 B17R2.48 COc1ccc(nc1)CSc2cccnc2 62a_100000210063_200000757186 [1,1,0,0,0,0|2,0,0]=4 2109 B17R2.48 COc1ccc(nc1)CSc2cccnc2 62a_200000757186_100000210063 [1,1,0,0,0,0|2,0,0]=4 2110 B17R2.48 COc1ccc(nc1)CSc2ccncc2 62a_100000728582_200000757186 [1,1,0,0,0,0|2,0,0]=4 2111 B17R2.48 COc1ccc(nc1)CSc2ccncc2 62a_200000757186_100000728582 [1,1,0,0,0,0|2,0,0]=4 2112 B17R2.48 CSc1ccc(cc1)CSc2ccccc2 62a_100000181263_100000041952 [1,1,0,0,0,0|1,1,0]=4 2113 B17R2.48 CSc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000181263 [1,1,0,0,0,0|1,1,0]=4 2114 B17R2.48 N#Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000184898 [1,1,0,0,0,0|2,0,0]=4 2115 B17R2.48 N#Cc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000693164 [1,1,0,0,0,0|2,0,0]=4 2116 B17R2.48 O=Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100009816848 [1,1,0,0,0,0|1,0,1]=4 2117 B17R2.48 O=Cc1ccc(cc1)CSc2ccccc2 62a_100009816848_100000041952 [1,1,0,0,0,0|1,0,1]=4 2118 B17R2.48 OCc1ccc(cc1)CNc2ccccc2 207a_100000106764_100009832023 [1,1,0,0,0,0|2,0,0]=4 2119 B17R2.48 OCc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100009832023 [1,1,0,0,0,0|2,0,0]=4 2120 B17R2.48 OCc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000067286 [1,1,0,0,0,0|2,0,0]=4 2121 B17R2.48 OCc1ccc(cc1)COc2ccccc2 34a_100000210340_100000067286 [1,1,0,0,0,0|1,1,0]=4 2122 B17R2.48 OCc1ccc(cc1)COc2ccccc2 7a_100000210340_100000067286 [1,1,0,0,0,0|1,1,0]=4 2123 B17R2.48 OCc1ccc(cc1)CSc2ccccc2 62a_100000067286_100000041952 [1,1,0,0,0,0|1,0,0]=3 2124 B17R2.48 OCc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000067286 [1,1,0,0,0,0|1,0,0]=3 2125 B17R2.48 OCc1ccc(cc1)CSc2ccccn2 62a_100000067286_100011216584 [1,1,0,0,0,0|2,0,0]=4 2126 B17R2.48 OCc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000067286 [1,1,0,0,0,0|2,0,0]=4 2127 B17R2.48 OCc1ccc(cc1)CSc2cccnc2 62a_100000067286_100000210063 [1,1,0,0,0,0|2,0,0]=4 2128 B17R2.48 OCc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000067286 [1,1,0,0,0,0|2,0,0]=4 2129 B17R2.48 OCc1ccc(cc1)CSc2ccncc2 62a_100000067286_100000728582 [1,1,0,0,0,0|2,0,0]=4 2130 B17R2.48 OCc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000067286 [1,1,0,0,0,0|2,0,0]=4 2131 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)Br 62a_100000719477_100000755118 [1,1,0,0,0,0|2,0,0]=4 2132 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)Br 62a_100000755118_100000041952 [1,1,0,0,0,0|2,0,0]=4 2133 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)Cl 62a_100000684792_100000041952 [1,1,0,0,0,0|2,0,0]=4 2134 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)Cl 62a_100000719477_100000684792 [1,1,0,0,0,0|2,0,0]=4 2135 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)F 62a_100000719477_100000743420 [1,1,0,0,0,0|2,0,0]=4 2136 B17R2.192 CC(Sc1ccccc1)c2ccc(cc2)F 62a_100000743420_100000041952 [1,1,0,0,0,0|2,0,0]=4 2137 B17R2.192 Cc1ccc(cc1)C(C)Sc2ccccc2 62a_100000719477_100011261388 [1,1,0,0,0,0|2,0,0]=4 2138 B17R2.192 Cc1ccc(cc1)C(C)Sc2ccccc2 62a_100011261388_100000041952 [1,1,0,0,0,0|2,0,0]=4 2139 B17R2.207 Brc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000189115_100000752885 [1,1,0,0,0,0|2,0,0]=4 2140 B17R2.207 Brc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000752885_100000189115 [1,1,0,0,0,0|2,0,0]=4 2141 B17R2.207 Brc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000752885 [1,1,0,0,0,0|2,0,0]=4 2142 B17R2.207 Brc1ccc(cc1)SCc2ccc(cc2)I 62a_100000752885_100000189116 [1,1,0,0,0,0|2,0,0]=4 2143 B17R2.207 Brc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000752885 [1,1,0,0,0,0|2,0,0]=4 2144 B17R2.207 Brc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000752885_100000702658 [1,1,0,0,0,0|2,0,0]=4 2145 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000210814_100000752885 [1,1,0,0,0,0|2,0,0]=4 2146 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000752885_100000210814 [1,1,0,0,0,0|2,0,0]=4 2147 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)C 62a_100000186775_100000210814 [1,1,0,0,0,0|2,0,0]=4 2148 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)C 62a_100000210814_100000186775 [1,1,0,0,0,0|2,0,0]=4 2149 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000210814_100000755918 [1,1,0,0,0,0|2,0,0]=4 2150 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000755918_100000210814 [1,1,0,0,0,0|2,0,0]=4 2151 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)F 62a_100000210814_100000211213 [1,1,0,0,0,0|2,0,0]=4 2152 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)F 62a_100000211213_100000210814 [1,1,0,0,0,0|2,0,0]=4 2153 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)N 62a_100000185761_100000210814 [1,1,0,0,0,0|2,0,0]=4 2154 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)N 62a_100000210814_100000185761 [1,1,0,0,0,0|2,0,0]=4 2155 B17R2.207 Cc1ccc(cc1)CSc2ccc(cc2)O 62a_100000210814_100000185759 [1,1,0,0,0,0|2,0,0]=4 2156 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000186775_100000189115 [1,1,0,0,0,0|2,0,0]=4 2157 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000189115_100000186775 [1,1,0,0,0,0|2,0,0]=4 2158 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000186775_100000187161 [1,1,0,0,0,0|2,0,0]=4 2159 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000187161_100000186775 [1,1,0,0,0,0|2,0,0]=4 2160 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)F 62a_100000186775_100000187164 [1,1,0,0,0,0|2,0,0]=4 2161 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)F 62a_100000198546_100000186775 [1,1,0,0,0,0|2,0,0]=4 2162 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)I 62a_100000186775_100000189116 [1,1,0,0,0,0|2,0,0]=4 2163 B17R2.207 Cc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000186775 [1,1,0,0,0,0|2,0,0]=4 2164 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000186775_100000702658 [1,1,0,0,0,0|2,0,0]=4 2165 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000186775 [1,1,0,0,0,0|2,0,0]=4 2166 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)C 62a_100000186775_100000691093 [1,1,0,0,0,0|2,0,0]=4 2167 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)C 62a_100000691093_100000186775 [1,1,0,0,0,0|2,0,0]=4 2168 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100000186775_100000697101 [1,1,0,0,0,0|2,0,0]=4 2169 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000186775 [1,1,0,0,0,0|2,0,0]=4 2170 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)F 62a_100000186775_100000703193 [1,1,0,0,0,0|2,0,0]=4 2171 B17R2.207 Cc1ccc(cc1)SCc2ccc(cn2)F 62a_100000703193_100000186775 [1,1,0,0,0,0|2,0,0]=4 2172 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)Br 62a_100000691093_100000752885 [1,1,0,0,0,0|2,0,0]=4 2173 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)Br 62a_100000752885_100000691093 [1,1,0,0,0,0|2,0,0]=4 2174 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)Cl 62a_100000691093_100000755918 [1,1,0,0,0,0|2,0,0]=4 2175 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)Cl 62a_100000755918_100000691093 [1,1,0,0,0,0|2,0,0]=4 2176 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)F 62a_100000211213_100000691093 [1,1,0,0,0,0|2,0,0]=4 2177 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)F 62a_100000691093_100000211213 [1,1,0,0,0,0|2,0,0]=4 2178 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)N 62a_100000185761_100000691093 [1,1,0,0,0,0|2,0,0]=4 2179 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)N 62a_100000691093_100000185761 [1,1,0,0,0,0|2,0,0]=4 2180 B17R2.207 Cc1ccc(nc1)CSc2ccc(cc2)O 62a_100000691093_100000185759 [1,1,0,0,0,0|2,0,0]=4 2181 B17R2.207 Clc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000187161_100000752885 [1,1,0,0,0,0|2,0,0]=4 2182 B17R2.207 Clc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000752885_100000187161 [1,1,0,0,0,0|2,0,0]=4 2183 B17R2.207 Clc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000187161_100000755918 [1,1,0,0,0,0|2,0,0]=4 2184 B17R2.207 Clc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000755918_100000187161 [1,1,0,0,0,0|2,0,0]=4 2185 B17R2.207 Clc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000189115_100000755918 [1,1,0,0,0,0|2,0,0]=4 2186 B17R2.207 Clc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000755918_100000189115 [1,1,0,0,0,0|2,0,0]=4 2187 B17R2.207 Clc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000755918 [1,1,0,0,0,0|2,0,0]=4 2188 B17R2.207 Clc1ccc(cc1)SCc2ccc(cc2)I 62a_100000755918_100000189116 [1,1,0,0,0,0|2,0,0]=4 2189 B17R2.207 Clc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000755918 [1,1,0,0,0,0|2,0,0]=4 2190 B17R2.207 Clc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000755918_100000702658 [1,1,0,0,0,0|2,0,0]=4 2191 B17R2.207 Clc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100000755918_100000697101 [1,1,0,0,0,0|2,0,0]=4 2192 B17R2.207 Clc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000755918 [1,1,0,0,0,0|2,0,0]=4 2193 B17R2.207 Clc1ccc(nc1)CSc2ccc(cc2)Br 62a_100000752885_100000697101 [1,1,0,0,0,0|2,0,0]=4 2194 B17R2.207 Clc1ccc(nc1)CSc2ccc(cc2)Br 62a_100012066911_100000752885 [1,1,0,0,0,0|2,0,0]=4 2195 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000198546_100000752885 [1,1,0,0,0,0|2,0,0]=4 2196 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)Br 62a_100000752885_100000187164 [1,1,0,0,0,0|2,0,0]=4 2197 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000198546_100000755918 [1,1,0,0,0,0|2,0,0]=4 2198 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)Cl 62a_100000755918_100000187164 [1,1,0,0,0,0|2,0,0]=4 2199 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)F 62a_100000198546_100000211213 [1,1,0,0,0,0|2,0,0]=4 2200 B17R2.207 Fc1ccc(cc1)CSc2ccc(cc2)F 62a_100000211213_100000187164 [1,1,0,0,0,0|2,0,0]=4 2201 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000189115_100000211213 [1,1,0,0,0,0|2,0,0]=4 2202 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000211213_100000189115 [1,1,0,0,0,0|2,0,0]=4 2203 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000187161_100000211213 [1,1,0,0,0,0|2,0,0]=4 2204 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000211213_100000187161 [1,1,0,0,0,0|2,0,0]=4 2205 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000211213 [1,1,0,0,0,0|2,0,0]=4 2206 B17R2.207 Fc1ccc(cc1)SCc2ccc(cc2)I 62a_100000211213_100000189116 [1,1,0,0,0,0|2,0,0]=4 2207 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000211213_100000702658 [1,1,0,0,0,0|2,0,0]=4 2208 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000211213 [1,1,0,0,0,0|2,0,0]=4 2209 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100000211213_100000697101 [1,1,0,0,0,0|2,0,0]=4 2210 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000211213 [1,1,0,0,0,0|2,0,0]=4 2211 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)F 62a_100000211213_100000703193 [1,1,0,0,0,0|2,0,0]=4 2212 B17R2.207 Fc1ccc(cc1)SCc2ccc(cn2)F 62a_100000703193_100000211213 [1,1,0,0,0,0|2,0,0]=4 2213 B17R2.207 Fc1ccc(nc1)CSc2ccc(cc2)Br 62a_100000703193_100000752885 [1,1,0,0,0,0|2,0,0]=4 2214 B17R2.207 Fc1ccc(nc1)CSc2ccc(cc2)Br 62a_100000752885_100000703193 [1,1,0,0,0,0|2,0,0]=4 2215 B17R2.207 Fc1ccc(nc1)CSc2ccc(cc2)Cl 62a_100000703193_100000755918 [1,1,0,0,0,0|2,0,0]=4 2216 B17R2.207 Fc1ccc(nc1)CSc2ccc(cc2)Cl 62a_100000755918_100000703193 [1,1,0,0,0,0|2,0,0]=4 2217 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000185761_100000189115 [1,1,0,0,0,0|2,0,0]=4 2218 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000189115_100000185761 [1,1,0,0,0,0|2,0,0]=4 2219 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000185761_100000187161 [1,1,0,0,0,0|2,0,0]=4 2220 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000187161_100000185761 [1,1,0,0,0,0|2,0,0]=4 2221 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)F 62a_100000185761_100000187164 [1,1,0,0,0,0|2,0,0]=4 2222 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)F 62a_100000198546_100000185761 [1,1,0,0,0,0|2,0,0]=4 2223 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)I 62a_100000185761_100000189116 [1,1,0,0,0,0|2,0,0]=4 2224 B17R2.207 Nc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000185761 [1,1,0,0,0,0|2,0,0]=4 2225 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000185761_100000702658 [1,1,0,0,0,0|2,0,0]=4 2226 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000185761 [1,1,0,0,0,0|2,0,0]=4 2227 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100000185761_100000697101 [1,1,0,0,0,0|2,0,0]=4 2228 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000185761 [1,1,0,0,0,0|2,0,0]=4 2229 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)F 62a_100000185761_100000703193 [1,1,0,0,0,0|2,0,0]=4 2230 B17R2.207 Nc1ccc(cc1)SCc2ccc(cn2)F 62a_100000703193_100000185761 [1,1,0,0,0,0|2,0,0]=4 2231 B17R2.207 Oc1ccc(cc1)SCc2ccc(cc2)Br 62a_100000189115_100000185759 [1,1,0,0,0,0|2,0,0]=4 2232 B17R2.207 Oc1ccc(cc1)SCc2ccc(cc2)Cl 62a_100000187161_100000185759 [1,1,0,0,0,0|2,0,0]=4 2233 B17R2.207 Oc1ccc(cc1)SCc2ccc(cc2)F 62a_100000198546_100000185759 [1,1,0,0,0,0|2,0,0]=4 2234 B17R2.207 Oc1ccc(cc1)SCc2ccc(cc2)I 62a_100000189116_100000185759 [1,1,0,0,0,0|2,0,0]=4 2235 B17R2.207 Oc1ccc(cc1)SCc2ccc(cn2)Br 62a_100000702658_100000185759 [1,1,0,0,0,0|2,0,0]=4 2236 B17R2.207 Oc1ccc(cc1)SCc2ccc(cn2)Cl 62a_100012066911_100000185759 [1,1,0,0,0,0|2,0,0]=4 2237 B17R2.207 Oc1ccc(cc1)SCc2ccc(cn2)F 62a_100000703193_100000185759 [1,1,0,0,0,0|2,0,0]=4 2238 B17R2.209 CC(Cc1ccc(cc1)O)c2ccccc2 271570a_100000062452_100000185759 [1,1,0,0,0,0|2,0,0]=4 2239 B17R2.209 CC(Cc1ccc(cn1)O)c2ccccc2 271570a_100000062452_100000685995 [1,1,0,0,0,0|2,0,0]=4 2240 B17R2.209 O=C(Cc1ccc(cc1)O)c2ccccc2 271570a_203496583355_100011267665 [1,1,0,0,0,0|2,0,0]=4 2241 B17R2.215 Brc1ccc(cc1)CSc2cccc(c2)Br 62a_100000189115_100000691529 [1,1,0,0,0,0|2,0,0]=4 2242 B17R2.215 Brc1ccc(cc1)CSc2cccc(c2)Br 62a_100000691529_100000189115 [1,1,0,0,0,0|2,0,0]=4 2243 B17R2.215 Brc1ccc(nc1)CSc2cccc(c2)Br 62a_100000691529_100000702658 [1,1,0,0,0,0|2,0,0]=4 2244 B17R2.215 Brc1ccc(nc1)CSc2cccc(c2)Br 62a_100000702658_100000691529 [1,1,0,0,0,0|2,0,0]=4 2245 B17R2.215 Brc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100000691529 [1,1,0,0,0,0|2,0,0]=4 2246 B17R2.215 Brc1cccc(c1)SCc2ccc(cc2)I 62a_100000691529_100000189116 [1,1,0,0,0,0|2,0,0]=4 2247 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)Br 62a_100000210814_100000691529 [1,1,0,0,0,0|2,0,0]=4 2248 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)Br 62a_100000691529_100000210814 [1,1,0,0,0,0|2,0,0]=4 2249 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)C 62a_100000210814_100011215228 [1,1,0,0,0,0|2,0,0]=4 2250 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)C 62a_100011215228_100000210814 [1,1,0,0,0,0|2,0,0]=4 2251 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000210814_100000699651 [1,1,0,0,0,0|2,0,0]=4 2252 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000699651_100000210814 [1,1,0,0,0,0|2,0,0]=4 2253 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)F 62a_100000210814_100000685547 [1,1,0,0,0,0|2,0,0]=4 2254 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)F 62a_100000685547_100000210814 [1,1,0,0,0,0|2,0,0]=4 2255 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)N 62a_100000210019_100000210814 [1,1,0,0,0,0|2,0,0]=4 2256 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)N 62a_100000210814_100000210019 [1,1,0,0,0,0|2,0,0]=4 2257 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)O 62a_100000210814_100000211634 [1,1,0,0,0,0|2,0,0]=4 2258 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)[S] 62a_100000210814_114929384022 [1,1,0,0,0,0|2,0,0]=4 2259 B17R2.215 Cc1ccc(cc1)CSc2cccc(c2)[S] 62a_114929384022_100000210814 [1,1,0,0,0,0|2,0,0]=4 2260 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)Br 62a_100000691093_100000691529 [1,1,0,0,0,0|2,0,0]=4 2261 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)Br 62a_100000691529_100000691093 [1,1,0,0,0,0|2,0,0]=4 2262 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)C 62a_100000691093_100011215228 [1,1,0,0,0,0|2,0,0]=4 2263 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)C 62a_100011215228_100000691093 [1,1,0,0,0,0|2,0,0]=4 2264 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)Cl 62a_100000691093_100000699651 [1,1,0,0,0,0|2,0,0]=4 2265 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)Cl 62a_100000699651_100000691093 [1,1,0,0,0,0|2,0,0]=4 2266 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)F 62a_100000685547_100000691093 [1,1,0,0,0,0|2,0,0]=4 2267 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)F 62a_100000691093_100000685547 [1,1,0,0,0,0|2,0,0]=4 2268 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)N 62a_100000210019_100000691093 [1,1,0,0,0,0|2,0,0]=4 2269 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)N 62a_100000691093_100000210019 [1,1,0,0,0,0|2,0,0]=4 2270 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)O 62a_100000691093_100000211634 [1,1,0,0,0,0|2,0,0]=4 2271 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)[S] 62a_100000691093_114929384022 [1,1,0,0,0,0|2,0,0]=4 2272 B17R2.215 Cc1ccc(nc1)CSc2cccc(c2)[S] 62a_114929384022_100000691093 [1,1,0,0,0,0|2,0,0]=4 2273 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_100011215228 [1,1,0,0,0,0|2,0,0]=4 2274 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)Br 62a_100011215228_100000189115 [1,1,0,0,0,0|2,0,0]=4 2275 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000187161_100011215228 [1,1,0,0,0,0|2,0,0]=4 2276 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)Cl 62a_100011215228_100000187161 [1,1,0,0,0,0|2,0,0]=4 2277 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)F 62a_100000198546_100011215228 [1,1,0,0,0,0|2,0,0]=4 2278 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)F 62a_100011215228_100000187164 [1,1,0,0,0,0|2,0,0]=4 2279 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100011215228 [1,1,0,0,0,0|2,0,0]=4 2280 B17R2.215 Cc1cccc(c1)SCc2ccc(cc2)I 62a_100011215228_100000189116 [1,1,0,0,0,0|2,0,0]=4 2281 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_100011215228 [1,1,0,0,0,0|2,0,0]=4 2282 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)Br 62a_100011215228_100000702658 [1,1,0,0,0,0|2,0,0]=4 2283 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)Cl 62a_100011215228_100000697101 [1,1,0,0,0,0|2,0,0]=4 2284 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)Cl 62a_100012066911_100011215228 [1,1,0,0,0,0|2,0,0]=4 2285 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)F 62a_100000703193_100011215228 [1,1,0,0,0,0|2,0,0]=4 2286 B17R2.215 Cc1cccc(c1)SCc2ccc(cn2)F 62a_100011215228_100000703193 [1,1,0,0,0,0|2,0,0]=4 2287 B17R2.215 Clc1ccc(cc1)CSc2cccc(c2)Br 62a_100000187161_100000691529 [1,1,0,0,0,0|2,0,0]=4 2288 B17R2.215 Clc1ccc(cc1)CSc2cccc(c2)Br 62a_100000691529_100000187161 [1,1,0,0,0,0|2,0,0]=4 2289 B17R2.215 Clc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000187161_100000699651 [1,1,0,0,0,0|2,0,0]=4 2290 B17R2.215 Clc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000699651_100000187161 [1,1,0,0,0,0|2,0,0]=4 2291 B17R2.215 Clc1ccc(nc1)CSc2cccc(c2)Br 62a_100000691529_100000697101 [1,1,0,0,0,0|2,0,0]=4 2292 B17R2.215 Clc1ccc(nc1)CSc2cccc(c2)Br 62a_100012066911_100000691529 [1,1,0,0,0,0|2,0,0]=4 2293 B17R2.215 Clc1ccc(nc1)CSc2cccc(c2)Cl 62a_100000699651_100000697101 [1,1,0,0,0,0|2,0,0]=4 2294 B17R2.215 Clc1ccc(nc1)CSc2cccc(c2)Cl 62a_100012066911_100000699651 [1,1,0,0,0,0|2,0,0]=4 2295 B17R2.215 Clc1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_100000699651 [1,1,0,0,0,0|2,0,0]=4 2296 B17R2.215 Clc1cccc(c1)SCc2ccc(cc2)Br 62a_100000699651_100000189115 [1,1,0,0,0,0|2,0,0]=4 2297 B17R2.215 Clc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100000699651 [1,1,0,0,0,0|2,0,0]=4 2298 B17R2.215 Clc1cccc(c1)SCc2ccc(cc2)I 62a_100000699651_100000189116 [1,1,0,0,0,0|2,0,0]=4 2299 B17R2.215 Clc1cccc(c1)SCc2ccc(cn2)Br 62a_100000699651_100000702658 [1,1,0,0,0,0|2,0,0]=4 2300 B17R2.215 Clc1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_100000699651 [1,1,0,0,0,0|2,0,0]=4 2301 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)Br 62a_100000198546_100000691529 [1,1,0,0,0,0|2,0,0]=4 2302 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)Br 62a_100000691529_100000187164 [1,1,0,0,0,0|2,0,0]=4 2303 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000198546_100000699651 [1,1,0,0,0,0|2,0,0]=4 2304 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)Cl 62a_100000699651_100000187164 [1,1,0,0,0,0|2,0,0]=4 2305 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)F 62a_100000198546_100000685547 [1,1,0,0,0,0|2,0,0]=4 2306 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)F 62a_100000685547_100000187164 [1,1,0,0,0,0|2,0,0]=4 2307 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)[S] 62a_100000198546_114929384022 [1,1,0,0,0,0|2,0,0]=4 2308 B17R2.215 Fc1ccc(cc1)CSc2cccc(c2)[S] 62a_114929384022_100000187164 [1,1,0,0,0,0|2,0,0]=4 2309 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)Br 62a_100000691529_100000703193 [1,1,0,0,0,0|2,0,0]=4 2310 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)Br 62a_100000703193_100000691529 [1,1,0,0,0,0|2,0,0]=4 2311 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)Cl 62a_100000699651_100000703193 [1,1,0,0,0,0|2,0,0]=4 2312 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)Cl 62a_100000703193_100000699651 [1,1,0,0,0,0|2,0,0]=4 2313 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)F 62a_100000685547_100000703193 [1,1,0,0,0,0|2,0,0]=4 2314 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)F 62a_100000703193_100000685547 [1,1,0,0,0,0|2,0,0]=4 2315 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)[S] 62a_100000703193_114929384022 [1,1,0,0,0,0|2,0,0]=4 2316 B17R2.215 Fc1ccc(nc1)CSc2cccc(c2)[S] 62a_114929384022_100000703193 [1,1,0,0,0,0|2,0,0]=4 2317 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_100000685547 [1,1,0,0,0,0|2,0,0]=4 2318 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)Br 62a_100000685547_100000189115 [1,1,0,0,0,0|2,0,0]=4 2319 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000187161_100000685547 [1,1,0,0,0,0|2,0,0]=4 2320 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000685547_100000187161 [1,1,0,0,0,0|2,0,0]=4 2321 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100000685547 [1,1,0,0,0,0|2,0,0]=4 2322 B17R2.215 Fc1cccc(c1)SCc2ccc(cc2)I 62a_100000685547_100000189116 [1,1,0,0,0,0|2,0,0]=4 2323 B17R2.215 Fc1cccc(c1)SCc2ccc(cn2)Br 62a_100000685547_100000702658 [1,1,0,0,0,0|2,0,0]=4 2324 B17R2.215 Fc1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_100000685547 [1,1,0,0,0,0|2,0,0]=4 2325 B17R2.215 Fc1cccc(c1)SCc2ccc(cn2)Cl 62a_100000685547_100000697101 [1,1,0,0,0,0|2,0,0]=4 2326 B17R2.215 Fc1cccc(c1)SCc2ccc(cn2)Cl 62a_100012066911_100000685547 [1,1,0,0,0,0|2,0,0]=4 2327 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_100000210019 [1,1,0,0,0,0|2,0,0]=4 2328 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)Br 62a_100000210019_100000189115 [1,1,0,0,0,0|2,0,0]=4 2329 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000187161_100000210019 [1,1,0,0,0,0|2,0,0]=4 2330 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000210019_100000187161 [1,1,0,0,0,0|2,0,0]=4 2331 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)F 62a_100000198546_100000210019 [1,1,0,0,0,0|2,0,0]=4 2332 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)F 62a_100000210019_100000187164 [1,1,0,0,0,0|2,0,0]=4 2333 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100000210019 [1,1,0,0,0,0|2,0,0]=4 2334 B17R2.215 Nc1cccc(c1)SCc2ccc(cc2)I 62a_100000210019_100000189116 [1,1,0,0,0,0|2,0,0]=4 2335 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)Br 62a_100000210019_100000702658 [1,1,0,0,0,0|2,0,0]=4 2336 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_100000210019 [1,1,0,0,0,0|2,0,0]=4 2337 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)Cl 62a_100000210019_100000697101 [1,1,0,0,0,0|2,0,0]=4 2338 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)Cl 62a_100012066911_100000210019 [1,1,0,0,0,0|2,0,0]=4 2339 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)F 62a_100000210019_100000703193 [1,1,0,0,0,0|2,0,0]=4 2340 B17R2.215 Nc1cccc(c1)SCc2ccc(cn2)F 62a_100000703193_100000210019 [1,1,0,0,0,0|2,0,0]=4 2341 B17R2.215 Oc1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_100000211634 [1,1,0,0,0,0|2,0,0]=4 2342 B17R2.215 Oc1cccc(c1)SCc2ccc(cc2)Cl 62a_100000187161_100000211634 [1,1,0,0,0,0|2,0,0]=4 2343 B17R2.215 Oc1cccc(c1)SCc2ccc(cc2)F 62a_100000198546_100000211634 [1,1,0,0,0,0|2,0,0]=4 2344 B17R2.215 Oc1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_100000211634 [1,1,0,0,0,0|2,0,0]=4 2345 B17R2.215 Oc1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_100000211634 [1,1,0,0,0,0|2,0,0]=4 2346 B17R2.215 Oc1cccc(c1)SCc2ccc(cn2)Cl 62a_100012066911_100000211634 [1,1,0,0,0,0|2,0,0]=4 2347 B17R2.215 Oc1cccc(c1)SCc2ccc(cn2)F 62a_100000703193_100000211634 [1,1,0,0,0,0|2,0,0]=4 2348 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)Br 62a_100000189115_114929384022 [1,1,0,0,0,0|2,0,0]=4 2349 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)Br 62a_114929384022_100000189115 [1,1,0,0,0,0|2,0,0]=4 2350 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)Cl 62a_100000187161_114929384022 [1,1,0,0,0,0|2,0,0]=4 2351 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)Cl 62a_114929384022_100000187161 [1,1,0,0,0,0|2,0,0]=4 2352 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)I 62a_100000189116_114929384022 [1,1,0,0,0,0|2,0,0]=4 2353 B17R2.215 [S]c1cccc(c1)SCc2ccc(cc2)I 62a_114929384022_100000189116 [1,1,0,0,0,0|2,0,0]=4 2354 B17R2.215 [S]c1cccc(c1)SCc2ccc(cn2)Br 62a_100000702658_114929384022 [1,1,0,0,0,0|2,0,0]=4 2355 B17R2.215 [S]c1cccc(c1)SCc2ccc(cn2)Br 62a_114929384022_100000702658 [1,1,0,0,0,0|2,0,0]=4 2356 B17R2.215 [S]c1cccc(c1)SCc2ccc(cn2)Cl 62a_100012066911_114929384022 [1,1,0,0,0,0|2,0,0]=4 2357 B17R2.215 [S]c1cccc(c1)SCc2ccc(cn2)Cl 62a_114929384022_100000697101 [1,1,0,0,0,0|2,0,0]=4 2358 B17R2.496 Brc1ccc(cc1)CSc2ccccc2Br 62a_100000189115_100000695589 [1,1,0,0,0,0|2,0,0]=4 2359 B17R2.496 Brc1ccc(cc1)CSc2ccccc2Br 62a_100000695589_100000189115 [1,1,0,0,0,0|2,0,0]=4 2360 B17R2.496 Brc1ccc(nc1)CSc2ccccc2Br 62a_100000695589_100000702658 [1,1,0,0,0,0|2,0,0]=4 2361 B17R2.496 Brc1ccc(nc1)CSc2ccccc2Br 62a_100000702658_100000695589 [1,1,0,0,0,0|2,0,0]=4 2362 B17R2.496 Brc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100000695589 [1,1,0,0,0,0|2,0,0]=4 2363 B17R2.496 Brc1ccccc1SCc2ccc(cc2)I 62a_100000695589_100000189116 [1,1,0,0,0,0|2,0,0]=4 2364 B17R2.496 Cc1ccc(cc1)CSc2ccccc2Br 62a_100000210814_100000695589 [1,1,0,0,0,0|2,0,0]=4 2365 B17R2.496 Cc1ccc(cc1)CSc2ccccc2Br 62a_100000695589_100000210814 [1,1,0,0,0,0|2,0,0]=4 2366 B17R2.496 Cc1ccc(cc1)CSc2ccccc2C 62a_100000210755_100000210814 [1,1,0,0,0,0|2,0,0]=4 2367 B17R2.496 Cc1ccc(cc1)CSc2ccccc2C 62a_100000210814_100000210755 [1,1,0,0,0,0|2,0,0]=4 2368 B17R2.496 Cc1ccc(cc1)CSc2ccccc2Cl 62a_100000210814_100000764095 [1,1,0,0,0,0|2,0,0]=4 2369 B17R2.496 Cc1ccc(cc1)CSc2ccccc2Cl 62a_100000764095_100000210814 [1,1,0,0,0,0|2,0,0]=4 2370 B17R2.496 Cc1ccc(cc1)CSc2ccccc2F 62a_100000210814_100011215700 [1,1,0,0,0,0|2,0,0]=4 2371 B17R2.496 Cc1ccc(cc1)CSc2ccccc2F 62a_100011215700_100000210814 [1,1,0,0,0,0|2,0,0]=4 2372 B17R2.496 Cc1ccc(cc1)CSc2ccccc2N 62a_100000210017_100000210814 [1,1,0,0,0,0|2,0,0]=4 2373 B17R2.496 Cc1ccc(cc1)CSc2ccccc2N 62a_100000210814_100000210017 [1,1,0,0,0,0|2,0,0]=4 2374 B17R2.496 Cc1ccc(cc1)CSc2ccccc2O 62a_100000210814_100000739446 [1,1,0,0,0,0|2,0,0]=4 2375 B17R2.496 Cc1ccc(cc1)CSc2ccccc2O 62a_100000739446_100000210814 [1,1,0,0,0,0|2,0,0]=4 2376 B17R2.496 Cc1ccc(nc1)CSc2ccccc2Br 62a_100000691093_100000695589 [1,1,0,0,0,0|2,0,0]=4 2377 B17R2.496 Cc1ccc(nc1)CSc2ccccc2Br 62a_100000695589_100000691093 [1,1,0,0,0,0|2,0,0]=4 2378 B17R2.496 Cc1ccc(nc1)CSc2ccccc2C 62a_100000210755_100000691093 [1,1,0,0,0,0|2,0,0]=4 2379 B17R2.496 Cc1ccc(nc1)CSc2ccccc2C 62a_100000691093_100000210755 [1,1,0,0,0,0|2,0,0]=4 2380 B17R2.496 Cc1ccc(nc1)CSc2ccccc2Cl 62a_100000691093_100000764095 [1,1,0,0,0,0|2,0,0]=4 2381 B17R2.496 Cc1ccc(nc1)CSc2ccccc2Cl 62a_100000764095_100000691093 [1,1,0,0,0,0|2,0,0]=4 2382 B17R2.496 Cc1ccc(nc1)CSc2ccccc2F 62a_100000691093_100011215700 [1,1,0,0,0,0|2,0,0]=4 2383 B17R2.496 Cc1ccc(nc1)CSc2ccccc2F 62a_100011215700_100000691093 [1,1,0,0,0,0|2,0,0]=4 2384 B17R2.496 Cc1ccc(nc1)CSc2ccccc2N 62a_100000210017_100000691093 [1,1,0,0,0,0|2,0,0]=4 2385 B17R2.496 Cc1ccc(nc1)CSc2ccccc2N 62a_100000691093_100000210017 [1,1,0,0,0,0|2,0,0]=4 2386 B17R2.496 Cc1ccc(nc1)CSc2ccccc2O 62a_100000691093_100000739446 [1,1,0,0,0,0|2,0,0]=4 2387 B17R2.496 Cc1ccc(nc1)CSc2ccccc2O 62a_100000739446_100000691093 [1,1,0,0,0,0|2,0,0]=4 2388 B17R2.496 Cc1ccccc1SCc2ccc(cc2)Br 62a_100000189115_100000210755 [1,1,0,0,0,0|2,0,0]=4 2389 B17R2.496 Cc1ccccc1SCc2ccc(cc2)Br 62a_100000210755_100000189115 [1,1,0,0,0,0|2,0,0]=4 2390 B17R2.496 Cc1ccccc1SCc2ccc(cc2)Cl 62a_100000187161_100000210755 [1,1,0,0,0,0|2,0,0]=4 2391 B17R2.496 Cc1ccccc1SCc2ccc(cc2)Cl 62a_100000210755_100000187161 [1,1,0,0,0,0|2,0,0]=4 2392 B17R2.496 Cc1ccccc1SCc2ccc(cc2)F 62a_100000198546_100000210755 [1,1,0,0,0,0|2,0,0]=4 2393 B17R2.496 Cc1ccccc1SCc2ccc(cc2)F 62a_100000210755_100000187164 [1,1,0,0,0,0|2,0,0]=4 2394 B17R2.496 Cc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100000210755 [1,1,0,0,0,0|2,0,0]=4 2395 B17R2.496 Cc1ccccc1SCc2ccc(cc2)I 62a_100000210755_100000189116 [1,1,0,0,0,0|2,0,0]=4 2396 B17R2.496 Cc1ccccc1SCc2ccc(cn2)Br 62a_100000210755_100000702658 [1,1,0,0,0,0|2,0,0]=4 2397 B17R2.496 Cc1ccccc1SCc2ccc(cn2)Br 62a_100000702658_100000210755 [1,1,0,0,0,0|2,0,0]=4 2398 B17R2.496 Cc1ccccc1SCc2ccc(cn2)Cl 62a_100000210755_100000697101 [1,1,0,0,0,0|2,0,0]=4 2399 B17R2.496 Cc1ccccc1SCc2ccc(cn2)Cl 62a_100012066911_100000210755 [1,1,0,0,0,0|2,0,0]=4 2400 B17R2.496 Cc1ccccc1SCc2ccc(cn2)F 62a_100000210755_100000703193 [1,1,0,0,0,0|2,0,0]=4 2401 B17R2.496 Cc1ccccc1SCc2ccc(cn2)F 62a_100000703193_100000210755 [1,1,0,0,0,0|2,0,0]=4 2402 B17R2.496 Clc1ccc(cc1)CSc2ccccc2Br 62a_100000187161_100000695589 [1,1,0,0,0,0|2,0,0]=4 2403 B17R2.496 Clc1ccc(cc1)CSc2ccccc2Br 62a_100000695589_100000187161 [1,1,0,0,0,0|2,0,0]=4 2404 B17R2.496 Clc1ccc(cc1)CSc2ccccc2Cl 62a_100000187161_100000764095 [1,1,0,0,0,0|2,0,0]=4 2405 B17R2.496 Clc1ccc(cc1)CSc2ccccc2Cl 62a_100000764095_100000187161 [1,1,0,0,0,0|2,0,0]=4 2406 B17R2.496 Clc1ccc(nc1)CSc2ccccc2Br 62a_100000695589_100000697101 [1,1,0,0,0,0|2,0,0]=4 2407 B17R2.496 Clc1ccc(nc1)CSc2ccccc2Br 62a_100012066911_100000695589 [1,1,0,0,0,0|2,0,0]=4 2408 B17R2.496 Clc1ccc(nc1)CSc2ccccc2Cl 62a_100000764095_100000697101 [1,1,0,0,0,0|2,0,0]=4 2409 B17R2.496 Clc1ccc(nc1)CSc2ccccc2Cl 62a_100012066911_100000764095 [1,1,0,0,0,0|2,0,0]=4 2410 B17R2.496 Clc1ccccc1SCc2ccc(cc2)Br 62a_100000189115_100000764095 [1,1,0,0,0,0|2,0,0]=4 2411 B17R2.496 Clc1ccccc1SCc2ccc(cc2)Br 62a_100000764095_100000189115 [1,1,0,0,0,0|2,0,0]=4 2412 B17R2.496 Clc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100000764095 [1,1,0,0,0,0|2,0,0]=4 2413 B17R2.496 Clc1ccccc1SCc2ccc(cc2)I 62a_100000764095_100000189116 [1,1,0,0,0,0|2,0,0]=4 2414 B17R2.496 Clc1ccccc1SCc2ccc(cn2)Br 62a_100000702658_100000764095 [1,1,0,0,0,0|2,0,0]=4 2415 B17R2.496 Clc1ccccc1SCc2ccc(cn2)Br 62a_100000764095_100000702658 [1,1,0,0,0,0|2,0,0]=4 2416 B17R2.496 Fc1ccc(cc1)CSc2ccccc2Br 62a_100000198546_100000695589 [1,1,0,0,0,0|2,0,0]=4 2417 B17R2.496 Fc1ccc(cc1)CSc2ccccc2Br 62a_100000695589_100000187164 [1,1,0,0,0,0|2,0,0]=4 2418 B17R2.496 Fc1ccc(cc1)CSc2ccccc2Cl 62a_100000198546_100000764095 [1,1,0,0,0,0|2,0,0]=4 2419 B17R2.496 Fc1ccc(cc1)CSc2ccccc2Cl 62a_100000764095_100000187164 [1,1,0,0,0,0|2,0,0]=4 2420 B17R2.496 Fc1ccc(cc1)CSc2ccccc2F 62a_100000198546_100011215700 [1,1,0,0,0,0|2,0,0]=4 2421 B17R2.496 Fc1ccc(cc1)CSc2ccccc2F 62a_100011215700_100000187164 [1,1,0,0,0,0|2,0,0]=4 2422 B17R2.496 Fc1ccc(nc1)CSc2ccccc2Br 62a_100000695589_100000703193 [1,1,0,0,0,0|2,0,0]=4 2423 B17R2.496 Fc1ccc(nc1)CSc2ccccc2Br 62a_100000703193_100000695589 [1,1,0,0,0,0|2,0,0]=4 2424 B17R2.496 Fc1ccc(nc1)CSc2ccccc2Cl 62a_100000703193_100000764095 [1,1,0,0,0,0|2,0,0]=4 2425 B17R2.496 Fc1ccc(nc1)CSc2ccccc2Cl 62a_100000764095_100000703193 [1,1,0,0,0,0|2,0,0]=4 2426 B17R2.496 Fc1ccc(nc1)CSc2ccccc2F 62a_100000703193_100011215700 [1,1,0,0,0,0|2,0,0]=4 2427 B17R2.496 Fc1ccc(nc1)CSc2ccccc2F 62a_100011215700_100000703193 [1,1,0,0,0,0|2,0,0]=4 2428 B17R2.496 Fc1ccccc1SCc2ccc(cc2)Br 62a_100000189115_100011215700 [1,1,0,0,0,0|2,0,0]=4 2429 B17R2.496 Fc1ccccc1SCc2ccc(cc2)Br 62a_100011215700_100000189115 [1,1,0,0,0,0|2,0,0]=4 2430 B17R2.496 Fc1ccccc1SCc2ccc(cc2)Cl 62a_100000187161_100011215700 [1,1,0,0,0,0|2,0,0]=4 2431 B17R2.496 Fc1ccccc1SCc2ccc(cc2)Cl 62a_100011215700_100000187161 [1,1,0,0,0,0|2,0,0]=4 2432 B17R2.496 Fc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100011215700 [1,1,0,0,0,0|2,0,0]=4 2433 B17R2.496 Fc1ccccc1SCc2ccc(cc2)I 62a_100011215700_100000189116 [1,1,0,0,0,0|2,0,0]=4 2434 B17R2.496 Fc1ccccc1SCc2ccc(cn2)Br 62a_100000702658_100011215700 [1,1,0,0,0,0|2,0,0]=4 2435 B17R2.496 Fc1ccccc1SCc2ccc(cn2)Br 62a_100011215700_100000702658 [1,1,0,0,0,0|2,0,0]=4 2436 B17R2.496 Fc1ccccc1SCc2ccc(cn2)Cl 62a_100011215700_100000697101 [1,1,0,0,0,0|2,0,0]=4 2437 B17R2.496 Fc1ccccc1SCc2ccc(cn2)Cl 62a_100012066911_100011215700 [1,1,0,0,0,0|2,0,0]=4 2438 B17R2.496 Nc1ccccc1SCc2ccc(cc2)Br 62a_100000189115_100000210017 [1,1,0,0,0,0|2,0,0]=4 2439 B17R2.496 Nc1ccccc1SCc2ccc(cc2)Br 62a_100000210017_100000189115 [1,1,0,0,0,0|2,0,0]=4 2440 B17R2.496 Nc1ccccc1SCc2ccc(cc2)Cl 62a_100000187161_100000210017 [1,1,0,0,0,0|2,0,0]=4 2441 B17R2.496 Nc1ccccc1SCc2ccc(cc2)Cl 62a_100000210017_100000187161 [1,1,0,0,0,0|2,0,0]=4 2442 B17R2.496 Nc1ccccc1SCc2ccc(cc2)F 62a_100000198546_100000210017 [1,1,0,0,0,0|2,0,0]=4 2443 B17R2.496 Nc1ccccc1SCc2ccc(cc2)F 62a_100000210017_100000187164 [1,1,0,0,0,0|2,0,0]=4 2444 B17R2.496 Nc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100000210017 [1,1,0,0,0,0|2,0,0]=4 2445 B17R2.496 Nc1ccccc1SCc2ccc(cc2)I 62a_100000210017_100000189116 [1,1,0,0,0,0|2,0,0]=4 2446 B17R2.496 Nc1ccccc1SCc2ccc(cn2)Br 62a_100000210017_100000702658 [1,1,0,0,0,0|2,0,0]=4 2447 B17R2.496 Nc1ccccc1SCc2ccc(cn2)Br 62a_100000702658_100000210017 [1,1,0,0,0,0|2,0,0]=4 2448 B17R2.496 Nc1ccccc1SCc2ccc(cn2)Cl 62a_100000210017_100000697101 [1,1,0,0,0,0|2,0,0]=4 2449 B17R2.496 Nc1ccccc1SCc2ccc(cn2)Cl 62a_100012066911_100000210017 [1,1,0,0,0,0|2,0,0]=4 2450 B17R2.496 Nc1ccccc1SCc2ccc(cn2)F 62a_100000210017_100000703193 [1,1,0,0,0,0|2,0,0]=4 2451 B17R2.496 Nc1ccccc1SCc2ccc(cn2)F 62a_100000703193_100000210017 [1,1,0,0,0,0|2,0,0]=4 2452 B17R2.496 Oc1ccccc1SCc2ccc(cc2)Br 62a_100000189115_100000739446 [1,1,0,0,0,0|2,0,0]=4 2453 B17R2.496 Oc1ccccc1SCc2ccc(cc2)Br 62a_100000739446_100000189115 [1,1,0,0,0,0|2,0,0]=4 2454 B17R2.496 Oc1ccccc1SCc2ccc(cc2)Cl 62a_100000187161_100000739446 [1,1,0,0,0,0|2,0,0]=4 2455 B17R2.496 Oc1ccccc1SCc2ccc(cc2)Cl 62a_100000739446_100000187161 [1,1,0,0,0,0|2,0,0]=4 2456 B17R2.496 Oc1ccccc1SCc2ccc(cc2)F 62a_100000198546_100000739446 [1,1,0,0,0,0|2,0,0]=4 2457 B17R2.496 Oc1ccccc1SCc2ccc(cc2)F 62a_100000739446_100000187164 [1,1,0,0,0,0|2,0,0]=4 2458 B17R2.496 Oc1ccccc1SCc2ccc(cc2)I 62a_100000189116_100000739446 [1,1,0,0,0,0|2,0,0]=4 2459 B17R2.496 Oc1ccccc1SCc2ccc(cc2)I 62a_100000739446_100000189116 [1,1,0,0,0,0|2,0,0]=4 2460 B17R2.496 Oc1ccccc1SCc2ccc(cn2)Br 62a_100000702658_100000739446 [1,1,0,0,0,0|2,0,0]=4 2461 B17R2.496 Oc1ccccc1SCc2ccc(cn2)Br 62a_100000739446_100000702658 [1,1,0,0,0,0|2,0,0]=4 2462 B17R2.496 Oc1ccccc1SCc2ccc(cn2)Cl 62a_100000739446_100000697101 [1,1,0,0,0,0|2,0,0]=4 2463 B17R2.496 Oc1ccccc1SCc2ccc(cn2)Cl 62a_100012066911_100000739446 [1,1,0,0,0,0|2,0,0]=4 2464 B17R2.496 Oc1ccccc1SCc2ccc(cn2)F 62a_100000703193_100000739446 [1,1,0,0,0,0|2,0,0]=4 2465 B17R2.496 Oc1ccccc1SCc2ccc(cn2)F 62a_100000739446_100000703193 [1,1,0,0,0,0|2,0,0]=4 2466 B17R2.5360 Brc1cc(ccc1CSc2ccccc2)I 62a_100000719477_100010146610 [1,1,0,0,0,0|2,0,0]=4 2467 B17R2.5360 Brc1cc(ccc1CSc2ccccc2)I 62a_100010146610_100000041952 [1,1,0,0,0,0|2,0,0]=4 2468 B17R2.5360 Brc1ccc(c(c1)Br)CSc2ccccc2 62a_100000719477_200012351560 [1,1,0,0,0,0|2,0,0]=4 2469 B17R2.5360 Brc1ccc(c(c1)Br)CSc2ccccc2 62a_200012351560_100000041952 [1,1,0,0,0,0|2,0,0]=4 2470 B17R2.5360 Brc1ccc(c(c1)I)CSc2ccccc2 62a_100000719477_100010146615 [1,1,0,0,0,0|2,0,0]=4 2471 B17R2.5360 Brc1ccc(c(c1)I)CSc2ccccc2 62a_100010146615_100000041952 [1,1,0,0,0,0|2,0,0]=4 2472 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)Br 62a_100000708836_100000041952 [1,1,0,0,0,0|2,0,0]=4 2473 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)Br 62a_100000719477_100000708836 [1,1,0,0,0,0|2,0,0]=4 2474 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)Cl 62a_100000719477_100012361307 [1,1,0,0,0,0|2,0,0]=4 2475 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)Cl 62a_100012361307_100000041952 [1,1,0,0,0,0|2,0,0]=4 2476 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)F 62a_100000700533_100000041952 [1,1,0,0,0,0|2,0,0]=4 2477 B17R2.5360 Cc1cc(ccc1CSc2ccccc2)F 62a_100000719477_100000700533 [1,1,0,0,0,0|2,0,0]=4 2478 B17R2.5360 Cc1ccc(c(c1)C)CSc2ccccc2 62a_100000719477_100011219618 [1,1,0,0,0,0|2,0,0]=4 2479 B17R2.5360 Cc1ccc(c(c1)C)CSc2ccccc2 62a_100011219618_100000041952 [1,1,0,0,0,0|2,0,0]=4 2480 B17R2.5360 Cc1ccc(c(c1)Cl)CSc2ccccc2 62a_100000719477_100012349684 [1,1,0,0,0,0|2,0,0]=4 2481 B17R2.5360 Cc1ccc(c(c1)Cl)CSc2ccccc2 62a_100012349684_100000041952 [1,1,0,0,0,0|2,0,0]=4 2482 B17R2.5360 Cc1ccc(c(c1)F)CSc2ccccc2 62a_100000719477_100011217900 [1,1,0,0,0,0|2,0,0]=4 2483 B17R2.5360 Cc1ccc(c(c1)F)CSc2ccccc2 62a_100011217900_100000041952 [1,1,0,0,0,0|2,0,0]=4 2484 B17R2.5360 Cc1cnc(c(c1)C)CSc2ccccc2 62a_100000719477_100016990036 [1,1,0,0,0,0|2,0,0]=4 2485 B17R2.5360 Cc1cnc(c(c1)C)CSc2ccccc2 62a_100016990036_100000041952 [1,1,0,0,0,0|2,0,0]=4 2486 B17R2.5360 Clc1cc(ccc1CSc2ccccc2)Br 62a_100000719477_100011740631 [1,1,0,0,0,0|2,0,0]=4 2487 B17R2.5360 Clc1cc(ccc1CSc2ccccc2)Br 62a_100011740631_100000041952 [1,1,0,0,0,0|2,0,0]=4 2488 B17R2.5360 Clc1ccc(c(c1)Br)CSc2ccccc2 62a_100000719477_100000755608 [1,1,0,0,0,0|2,0,0]=4 2489 B17R2.5360 Clc1ccc(c(c1)Br)CSc2ccccc2 62a_100000755608_100000041952 [1,1,0,0,0,0|2,0,0]=4 2490 B17R2.5360 Clc1ccc(c(c1)Cl)CSc2ccccc2 62a_100000188473_100000041952 [1,1,0,0,0,0|2,0,0]=4 2491 B17R2.5360 Clc1ccc(c(c1)Cl)CSc2ccccc2 62a_100000719477_100000188473 [1,1,0,0,0,0|2,0,0]=4 2492 B17R2.5360 Clc1ccc(c(c1)I)CSc2ccccc2 62a_100000719477_100010254388 [1,1,0,0,0,0|2,0,0]=4 2493 B17R2.5360 Clc1ccc(c(c1)I)CSc2ccccc2 62a_100010254388_100000041952 [1,1,0,0,0,0|2,0,0]=4 2494 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)Br 62a_100000211606_100000041952 [1,1,0,0,0,0|2,0,0]=4 2495 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)Br 62a_100000719477_100000211606 [1,1,0,0,0,0|2,0,0]=4 2496 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)Cl 62a_100000709361_100000041952 [1,1,0,0,0,0|2,0,0]=4 2497 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)Cl 62a_100000719477_100000709361 [1,1,0,0,0,0|2,0,0]=4 2498 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)I 62a_100000719477_100010244991 [1,1,0,0,0,0|2,0,0]=4 2499 B17R2.5360 Fc1cc(ccc1CSc2ccccc2)I 62a_100010244991_100000041952 [1,1,0,0,0,0|2,0,0]=4 2500 B17R2.5360 Fc1cc(cnc1CSc2ccccc2)Cl 62a_100000719477_200009879301 [1,1,0,0,0,0|2,0,0]=4 2501 B17R2.5360 Fc1cc(cnc1CSc2ccccc2)Cl 62a_200009879301_100000041952 [1,1,0,0,0,0|2,0,0]=4 2502 B17R2.5360 Fc1ccc(c(c1)Br)CSc2ccccc2 62a_100000243222_100000041952 [1,1,0,0,0,0|2,0,0]=4 2503 B17R2.5360 Fc1ccc(c(c1)Br)CSc2ccccc2 62a_100000719477_100000243222 [1,1,0,0,0,0|2,0,0]=4 2504 B17R2.5360 Fc1ccc(c(c1)Cl)CSc2ccccc2 62a_100000187853_100000041952 [1,1,0,0,0,0|2,0,0]=4 2505 B17R2.5360 Fc1ccc(c(c1)Cl)CSc2ccccc2 62a_100000719477_100000187853 [1,1,0,0,0,0|2,0,0]=4 2506 B17R2.5360 Fc1ccc(c(c1)F)CSc2ccccc2 62a_100000719477_100000748237 [1,1,0,0,0,0|2,0,0]=4 2507 B17R2.5360 Fc1ccc(c(c1)F)CSc2ccccc2 62a_100000748237_100000041952 [1,1,0,0,0,0|2,0,0]=4 2508 B17R2.5360 Fc1ccc(c(c1)I)CSc2ccccc2 62a_100000719477_100012354799 [1,1,0,0,0,0|2,0,0]=4 2509 B17R2.5360 Fc1ccc(c(c1)I)CSc2ccccc2 62a_100012354799_100000041952 [1,1,0,0,0,0|2,0,0]=4 2510 B17R2.1819 COc1cccc(c1)CSc2ccccc2 62a_100000688526_100000041952 [1,1,0,0,0,0|1,0,1]=4 2511 B17R2.1819 COc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211672 [1,1,0,0,0,0|1,0,1]=4 2512 B17R2.1819 COc1ccnc(c1)CSc2ccccc2 62a_100000719477_100000752681 [1,1,0,0,0,0|1,0,1]=4 2513 B17R2.1819 COc1ccnc(c1)CSc2ccccc2 62a_100000752681_100000041952 [1,1,0,0,0,0|1,0,1]=4 2514 B17R2.1819 N#Cc1cccc(c1)CSc2ccccc2 62a_100000719477_100000233786 [1,1,0,0,0,0|2,0,0]=4 2515 B17R2.1819 O=Cc1cccc(c1)CNc2ccccc2 34a_100000106764_100009816774 [1,1,0,0,0,0|2,0,0]=4 2516 B17R2.1819 O=Cc1cccc(c1)COc2ccccc2 34a_100000210340_100009816774 [1,1,0,0,0,0|1,1,0]=4 2517 B17R2.1819 O=Cc1cccc(c1)COc2ccccc2 7a_100000210340_100009816774 [1,1,0,0,0,0|1,1,0]=4 2518 B17R2.1819 O=Cc1cccc(c1)CSc2ccccc2 62a_100000719477_100009816774 [1,1,0,0,0,0|1,0,0]=3 2519 B17R2.1819 O=Cc1cccc(c1)CSc2ccccc2 62a_100009816774_100000041952 [1,1,0,0,0,0|1,0,0]=3 2520 B17R2.1819 O=Cc1cccc(c1)CSc2ccccn2 62a_100009816774_100011216584 [1,1,0,0,0,0|2,0,0]=4 2521 B17R2.1819 O=Cc1cccc(c1)CSc2ccccn2 62a_100011216584_100009816774 [1,1,0,0,0,0|2,0,0]=4 2522 B17R2.1819 O=Cc1cccc(c1)CSc2cccnc2 62a_100000210063_100009816774 [1,1,0,0,0,0|2,0,0]=4 2523 B17R2.1819 O=Cc1cccc(c1)CSc2cccnc2 62a_100009816774_100000210063 [1,1,0,0,0,0|2,0,0]=4 2524 B17R2.1819 O=Cc1cccc(c1)CSc2ccncc2 62a_100000728582_100009816774 [1,1,0,0,0,0|2,0,0]=4 2525 B17R2.1819 O=Cc1cccc(c1)CSc2ccncc2 62a_100009816774_100000728582 [1,1,0,0,0,0|2,0,0]=4 2526 B17R2.1819 OCc1cccc(c1)CSc2ccccc2 62a_100000719477_100010188025 [1,1,0,0,0,0|1,0,1]=4 2527 B17R2.1819 OCc1cccc(c1)CSc2ccccc2 62a_100010188025_100000041952 [1,1,0,0,0,0|1,0,1]=4 2528 B17R2.3212 Brc1cc(cc(c1)CSc2ccccc2)Br 62a_100000719477_100011216082 [1,1,0,0,0,0|2,0,0]=4 2529 B17R2.3212 Brc1cc(cc(c1)CSc2ccccc2)Br 62a_100011216082_100000041952 [1,1,0,0,0,0|2,0,0]=4 2530 B17R2.3212 Brc1cc(cc(c1)CSc2ccccc2)I 62a_100000719477_100010146614 [1,1,0,0,0,0|2,0,0]=4 2531 B17R2.3212 Brc1cc(cc(c1)CSc2ccccc2)I 62a_100010146614_100000041952 [1,1,0,0,0,0|2,0,0]=4 2532 B17R2.3212 Cc1cc(=O)cc(o1)OCc2ccccc2 34a_100016989201_100015291786 [1,1,0,0,0,0|2,0,0]=4 2533 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)Br 62a_100000719477_100012348363 [1,1,0,0,0,0|2,0,0]=4 2534 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)Br 62a_100012348363_100000041952 [1,1,0,0,0,0|2,0,0]=4 2535 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)C 62a_100000181317_100000041952 [1,1,0,0,0,0|2,0,0]=4 2536 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)C 62a_100000719477_100000181317 [1,1,0,0,0,0|2,0,0]=4 2537 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)F 62a_100000719477_100011219130 [1,1,0,0,0,0|2,0,0]=4 2538 B17R2.3212 Cc1cc(cc(c1)CSc2ccccc2)F 62a_100011219130_100000041952 [1,1,0,0,0,0|2,0,0]=4 2539 B17R2.3212 Cc1cc(nc(c1)CSc2ccccc2)C 62a_100000719477_100012357514 [1,1,0,0,0,0|2,0,0]=4 2540 B17R2.3212 Cc1cc(nc(c1)CSc2ccccc2)C 62a_100012357514_100000041952 [1,1,0,0,0,0|2,0,0]=4 2541 B17R2.3212 Clc1cc(cc(c1)CSc2ccccc2)Cl 62a_100000719477_100011219208 [1,1,0,0,0,0|2,0,0]=4 2542 B17R2.3212 Clc1cc(cc(c1)CSc2ccccc2)Cl 62a_100011219208_100000041952 [1,1,0,0,0,0|2,0,0]=4 2543 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)Br 62a_100000719477_100000766940 [1,1,0,0,0,0|2,0,0]=4 2544 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)Br 62a_100000766940_100000041952 [1,1,0,0,0,0|2,0,0]=4 2545 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)Cl 62a_100000719477_100011219885 [1,1,0,0,0,0|2,0,0]=4 2546 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)Cl 62a_100011219885_100000041952 [1,1,0,0,0,0|2,0,0]=4 2547 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)F 62a_100000697002_100000041952 [1,1,0,0,0,0|2,0,0]=4 2548 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)F 62a_100000719477_100000697002 [1,1,0,0,0,0|2,0,0]=4 2549 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)I 62a_100000719477_100010149605 [1,1,0,0,0,0|2,0,0]=4 2550 B17R2.3212 Fc1cc(cc(c1)CSc2ccccc2)I 62a_100010149605_100000041952 [1,1,0,0,0,0|2,0,0]=4 2551 B17R2.3212 O=c1cc(nc([nH]1)O)CSc2ccccc2 62a_100000719477_100000185147 [1,1,0,0,0,0|2,0,0]=4 2552 B17R2.5274 Brc1c(cccc1CSc2ccccc2)I 62a_100000719477_100010254545 [1,1,0,0,0,0|2,0,0]=4 2553 B17R2.5274 Brc1c(cccc1CSc2ccccc2)I 62a_100010254545_100000041952 [1,1,0,0,0,0|2,0,0]=4 2554 B17R2.5274 Cc1c(cccc1CSc2ccccc2)Br 62a_100000694682_100000041952 [1,1,0,0,0,0|2,0,0]=4 2555 B17R2.5274 Cc1c(cccc1CSc2ccccc2)Br 62a_100000719477_100000694682 [1,1,0,0,0,0|2,0,0]=4 2556 B17R2.5274 Cc1c(cccc1CSc2ccccc2)Cl 62a_100000719477_100012186920 [1,1,0,0,0,0|2,0,0]=4 2557 B17R2.5274 Cc1c(cccc1CSc2ccccc2)Cl 62a_100012186920_100000041952 [1,1,0,0,0,0|2,0,0]=4 2558 B17R2.5274 Cc1c(cccc1CSc2ccccc2)F 62a_100000719477_100009813626 [1,1,0,0,0,0|2,0,0]=4 2559 B17R2.5274 Cc1c(cccc1CSc2ccccc2)F 62a_100009813626_100000041952 [1,1,0,0,0,0|2,0,0]=4 2560 B17R2.5274 Cc1c(cccc1CSc2ccccc2)I 62a_100000719477_100010150147 [1,1,0,0,0,0|2,0,0]=4 2561 B17R2.5274 Cc1c(cccc1CSc2ccccc2)I 62a_100010150147_100000041952 [1,1,0,0,0,0|2,0,0]=4 2562 B17R2.5274 Cc1c(ccnc1CSc2ccccc2)Cl 62a_100000719477_100020614443 [1,1,0,0,0,0|2,0,0]=4 2563 B17R2.5274 Cc1c(ccnc1CSc2ccccc2)Cl 62a_100020614443_100000041952 [1,1,0,0,0,0|2,0,0]=4 2564 B17R2.5274 Cc1cccc(c1Br)CSc2ccccc2 62a_100000719477_200012349612 [1,1,0,0,0,0|2,0,0]=4 2565 B17R2.5274 Cc1cccc(c1Br)CSc2ccccc2 62a_200012349612_100000041952 [1,1,0,0,0,0|2,0,0]=4 2566 B17R2.5274 Cc1cccc(c1C)CSc2ccccc2 62a_100000719477_100011515928 [1,1,0,0,0,0|2,0,0]=4 2567 B17R2.5274 Cc1cccc(c1C)CSc2ccccc2 62a_100011515928_100000041952 [1,1,0,0,0,0|2,0,0]=4 2568 B17R2.5274 Cc1cccc(c1F)CSc2ccccc2 62a_100000719477_100011216058 [1,1,0,0,0,0|2,0,0]=4 2569 B17R2.5274 Cc1cccc(c1F)CSc2ccccc2 62a_100011216058_100000041952 [1,1,0,0,0,0|2,0,0]=4 2570 B17R2.5274 Clc1c(cccc1CSc2ccccc2)Br 62a_100000719477_100012349491 [1,1,0,0,0,0|2,0,0]=4 2571 B17R2.5274 Clc1c(cccc1CSc2ccccc2)Br 62a_100012349491_100000041952 [1,1,0,0,0,0|2,0,0]=4 2572 B17R2.5274 Clc1cccc(c1Br)CSc2ccccc2 62a_100000719477_100010145525 [1,1,0,0,0,0|2,0,0]=4 2573 B17R2.5274 Clc1cccc(c1Br)CSc2ccccc2 62a_100010145525_100000041952 [1,1,0,0,0,0|2,0,0]=4 2574 B17R2.5274 Clc1cccc(c1Cl)CSc2ccccc2 62a_100000719477_100000723366 [1,1,0,0,0,0|2,0,0]=4 2575 B17R2.5274 Clc1cccc(c1Cl)CSc2ccccc2 62a_100000720918_100000041952 [1,1,0,0,0,0|2,0,0]=4 2576 B17R2.5274 Fc1c(cccc1CSc2ccccc2)Br 62a_100000719477_100012356506 [1,1,0,0,0,0|2,0,0]=4 2577 B17R2.5274 Fc1c(cccc1CSc2ccccc2)Br 62a_100012356506_100000041952 [1,1,0,0,0,0|2,0,0]=4 2578 B17R2.5274 Fc1c(cccc1CSc2ccccc2)Cl 62a_100000716733_100000041952 [1,1,0,0,0,0|2,0,0]=4 2579 B17R2.5274 Fc1c(cccc1CSc2ccccc2)Cl 62a_100000719477_100000716733 [1,1,0,0,0,0|2,0,0]=4 2580 B17R2.5274 Fc1cccc(c1Br)CSc2ccccc2 62a_100000719477_100012351116 [1,1,0,0,0,0|2,0,0]=4 2581 B17R2.5274 Fc1cccc(c1Br)CSc2ccccc2 62a_100012351116_100000041952 [1,1,0,0,0,0|2,0,0]=4 2582 B17R2.5274 Fc1cccc(c1Cl)CSc2ccccc2 62a_100000696688_100000041952 [1,1,0,0,0,0|2,0,0]=4 2583 B17R2.5274 Fc1cccc(c1Cl)CSc2ccccc2 62a_100000719477_100000696688 [1,1,0,0,0,0|2,0,0]=4 2584 B17R2.5274 Fc1cccc(c1F)CSc2ccccc2 62a_100000217499_100000041952 [1,1,0,0,0,0|2,0,0]=4 2585 B17R2.5274 Fc1cccc(c1F)CSc2ccccc2 62a_100000719477_100000217499 [1,1,0,0,0,0|2,0,0]=4 2586 B17R2.5274 Fc1cccc(c1I)CSc2ccccc2 62a_100000719477_100010149603 [1,1,0,0,0,0|2,0,0]=4 2587 B17R2.5274 Fc1cccc(c1I)CSc2ccccc2 62a_100010149603_100000041952 [1,1,0,0,0,0|2,0,0]=4 2588 B17R2.5300 Brc1cccc(c1)CSc2cccc(c2)Br 62a_100000211773_100000691529 [1,1,0,0,0,0|2,0,0]=4 2589 B17R2.5300 Brc1cccc(c1)CSc2cccc(c2)Br 62a_100000691529_100000211773 [1,1,0,0,0,0|2,0,0]=4 2590 B17R2.5300 Brc1cccc(c1)SCc2cc(ccn2)Br 62a_100000691529_100010173614 [1,1,0,0,0,0|2,0,0]=4 2591 B17R2.5300 Brc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100000691529 [1,1,0,0,0,0|2,0,0]=4 2592 B17R2.5300 Brc1cccc(c1)SCc2cccc(c2)I 62a_100000691529_100011218688 [1,1,0,0,0,0|2,0,0]=4 2593 B17R2.5300 Brc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100000691529 [1,1,0,0,0,0|2,0,0]=4 2594 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)Br 62a_100000211840_100000691529 [1,1,0,0,0,0|2,0,0]=4 2595 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)Br 62a_100000691529_100000211840 [1,1,0,0,0,0|2,0,0]=4 2596 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)C 62a_100000211840_100011215228 [1,1,0,0,0,0|2,0,0]=4 2597 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)C 62a_100011215228_100000211840 [1,1,0,0,0,0|2,0,0]=4 2598 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)Cl 62a_100000211840_100000699651 [1,1,0,0,0,0|2,0,0]=4 2599 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)Cl 62a_100000699651_100000211840 [1,1,0,0,0,0|2,0,0]=4 2600 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)F 62a_100000211840_100000685547 [1,1,0,0,0,0|2,0,0]=4 2601 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)F 62a_100000685547_100000211840 [1,1,0,0,0,0|2,0,0]=4 2602 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)N 62a_100000210019_100000211840 [1,1,0,0,0,0|2,0,0]=4 2603 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)N 62a_100000211840_100000210019 [1,1,0,0,0,0|2,0,0]=4 2604 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)O 62a_100000211840_100000211634 [1,1,0,0,0,0|2,0,0]=4 2605 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)[S] 62a_100000211840_114929384022 [1,1,0,0,0,0|2,0,0]=4 2606 B17R2.5300 Cc1cccc(c1)CSc2cccc(c2)[S] 62a_114929384022_100000211840 [1,1,0,0,0,0|2,0,0]=4 2607 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100011215228 [1,1,0,0,0,0|2,0,0]=4 2608 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)Br 62a_100011215228_100010173614 [1,1,0,0,0,0|2,0,0]=4 2609 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)C 62a_100000718516_100011215228 [1,1,0,0,0,0|2,0,0]=4 2610 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)C 62a_100011215228_100000718516 [1,1,0,0,0,0|2,0,0]=4 2611 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)Cl 62a_100011215228_100016988179 [1,1,0,0,0,0|2,0,0]=4 2612 B17R2.5300 Cc1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_100011215228 [1,1,0,0,0,0|2,0,0]=4 2613 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_100011215228 [1,1,0,0,0,0|2,0,0]=4 2614 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)Br 62a_100011215228_100000211773 [1,1,0,0,0,0|2,0,0]=4 2615 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)Cl 62a_100000187163_100011215228 [1,1,0,0,0,0|2,0,0]=4 2616 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)Cl 62a_100011215228_100000187163 [1,1,0,0,0,0|2,0,0]=4 2617 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)F 62a_100000230114_100011215228 [1,1,0,0,0,0|2,0,0]=4 2618 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)F 62a_100011215228_100000230114 [1,1,0,0,0,0|2,0,0]=4 2619 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)I 62a_100011215228_100011218688 [1,1,0,0,0,0|2,0,0]=4 2620 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100011215228 [1,1,0,0,0,0|2,0,0]=4 2621 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)O 62a_100011215228_100011660834 [1,1,0,0,0,0|1,0,1]=4 2622 B17R2.5300 Cc1cccc(c1)SCc2cccc(c2)O 62a_100011660834_100011215228 [1,1,0,0,0,0|1,0,1]=4 2623 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)Br 62a_100000691529_100000718516 [1,1,0,0,0,0|2,0,0]=4 2624 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)Br 62a_100000718516_100000691529 [1,1,0,0,0,0|2,0,0]=4 2625 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)Cl 62a_100000699651_100000718516 [1,1,0,0,0,0|2,0,0]=4 2626 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)Cl 62a_100000718516_100000699651 [1,1,0,0,0,0|2,0,0]=4 2627 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)F 62a_100000685547_100000718516 [1,1,0,0,0,0|2,0,0]=4 2628 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)F 62a_100000718516_100000685547 [1,1,0,0,0,0|2,0,0]=4 2629 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)N 62a_100000210019_100000718516 [1,1,0,0,0,0|2,0,0]=4 2630 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)N 62a_100000718516_100000210019 [1,1,0,0,0,0|2,0,0]=4 2631 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)O 62a_100000718516_100000211634 [1,1,0,0,0,0|2,0,0]=4 2632 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)[S] 62a_100000718516_114929384022 [1,1,0,0,0,0|2,0,0]=4 2633 B17R2.5300 Cc1ccnc(c1)CSc2cccc(c2)[S] 62a_114929384022_100000718516 [1,1,0,0,0,0|2,0,0]=4 2634 B17R2.5300 Clc1cccc(c1)CSc2cccc(c2)Br 62a_100000187163_100000691529 [1,1,0,0,0,0|2,0,0]=4 2635 B17R2.5300 Clc1cccc(c1)CSc2cccc(c2)Br 62a_100000691529_100000187163 [1,1,0,0,0,0|2,0,0]=4 2636 B17R2.5300 Clc1cccc(c1)CSc2cccc(c2)Cl 62a_100000187163_100000699651 [1,1,0,0,0,0|2,0,0]=4 2637 B17R2.5300 Clc1cccc(c1)CSc2cccc(c2)Cl 62a_100000699651_100000187163 [1,1,0,0,0,0|2,0,0]=4 2638 B17R2.5300 Clc1cccc(c1)SCc2cc(ccn2)Br 62a_100000699651_100010173614 [1,1,0,0,0,0|2,0,0]=4 2639 B17R2.5300 Clc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100000699651 [1,1,0,0,0,0|2,0,0]=4 2640 B17R2.5300 Clc1cccc(c1)SCc2cc(ccn2)Cl 62a_100000699651_100016988179 [1,1,0,0,0,0|2,0,0]=4 2641 B17R2.5300 Clc1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_100000699651 [1,1,0,0,0,0|2,0,0]=4 2642 B17R2.5300 Clc1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_100000699651 [1,1,0,0,0,0|2,0,0]=4 2643 B17R2.5300 Clc1cccc(c1)SCc2cccc(c2)Br 62a_100000699651_100000211773 [1,1,0,0,0,0|2,0,0]=4 2644 B17R2.5300 Clc1cccc(c1)SCc2cccc(c2)I 62a_100000699651_100011218688 [1,1,0,0,0,0|2,0,0]=4 2645 B17R2.5300 Clc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100000699651 [1,1,0,0,0,0|2,0,0]=4 2646 B17R2.5300 Clc1ccnc(c1)CSc2cccc(c2)Br 62a_100000691529_100016988179 [1,1,0,0,0,0|2,0,0]=4 2647 B17R2.5300 Clc1ccnc(c1)CSc2cccc(c2)Br 62a_100016988179_100000691529 [1,1,0,0,0,0|2,0,0]=4 2648 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)Br 62a_100000230114_100000691529 [1,1,0,0,0,0|2,0,0]=4 2649 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)Br 62a_100000691529_100000230114 [1,1,0,0,0,0|2,0,0]=4 2650 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)Cl 62a_100000230114_100000699651 [1,1,0,0,0,0|2,0,0]=4 2651 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)Cl 62a_100000699651_100000230114 [1,1,0,0,0,0|2,0,0]=4 2652 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)F 62a_100000230114_100000685547 [1,1,0,0,0,0|2,0,0]=4 2653 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)F 62a_100000685547_100000230114 [1,1,0,0,0,0|2,0,0]=4 2654 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)[S] 62a_100000230114_114929384022 [1,1,0,0,0,0|2,0,0]=4 2655 B17R2.5300 Fc1cccc(c1)CSc2cccc(c2)[S] 62a_114929384022_100000230114 [1,1,0,0,0,0|2,0,0]=4 2656 B17R2.5300 Fc1cccc(c1)SCc2cc(ccn2)Br 62a_100000685547_100010173614 [1,1,0,0,0,0|2,0,0]=4 2657 B17R2.5300 Fc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100000685547 [1,1,0,0,0,0|2,0,0]=4 2658 B17R2.5300 Fc1cccc(c1)SCc2cc(ccn2)Cl 62a_100000685547_100016988179 [1,1,0,0,0,0|2,0,0]=4 2659 B17R2.5300 Fc1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_100000685547 [1,1,0,0,0,0|2,0,0]=4 2660 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_100000685547 [1,1,0,0,0,0|2,0,0]=4 2661 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)Br 62a_100000685547_100000211773 [1,1,0,0,0,0|2,0,0]=4 2662 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)Cl 62a_100000187163_100000685547 [1,1,0,0,0,0|2,0,0]=4 2663 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)Cl 62a_100000685547_100000187163 [1,1,0,0,0,0|2,0,0]=4 2664 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)I 62a_100000685547_100011218688 [1,1,0,0,0,0|2,0,0]=4 2665 B17R2.5300 Fc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100000685547 [1,1,0,0,0,0|2,0,0]=4 2666 B17R2.5300 Nc1cccc(c1)SCc2cc(ccn2)Br 62a_100000210019_100010173614 [1,1,0,0,0,0|2,0,0]=4 2667 B17R2.5300 Nc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100000210019 [1,1,0,0,0,0|2,0,0]=4 2668 B17R2.5300 Nc1cccc(c1)SCc2cc(ccn2)Cl 62a_100000210019_100016988179 [1,1,0,0,0,0|2,0,0]=4 2669 B17R2.5300 Nc1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_100000210019 [1,1,0,0,0,0|2,0,0]=4 2670 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)Br 62a_100000210019_100000211773 [1,1,0,0,0,0|2,0,0]=4 2671 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_100000210019 [1,1,0,0,0,0|2,0,0]=4 2672 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)Cl 62a_100000187163_100000210019 [1,1,0,0,0,0|2,0,0]=4 2673 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)Cl 62a_100000210019_100000187163 [1,1,0,0,0,0|2,0,0]=4 2674 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)F 62a_100000210019_100000230114 [1,1,0,0,0,0|2,0,0]=4 2675 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)F 62a_100000230114_100000210019 [1,1,0,0,0,0|2,0,0]=4 2676 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)I 62a_100000210019_100011218688 [1,1,0,0,0,0|2,0,0]=4 2677 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100000210019 [1,1,0,0,0,0|2,0,0]=4 2678 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)O 62a_100000210019_100011660834 [1,1,0,0,0,0|1,0,1]=4 2679 B17R2.5300 Nc1cccc(c1)SCc2cccc(c2)O 62a_100011660834_100000210019 [1,1,0,0,0,0|1,0,1]=4 2680 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)Br 62a_100000691529_100011660834 [1,1,0,0,0,0|1,0,1]=4 2681 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)Br 62a_100011660834_100000691529 [1,1,0,0,0,0|1,0,1]=4 2682 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)Cl 62a_100000699651_100011660834 [1,1,0,0,0,0|1,0,1]=4 2683 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)Cl 62a_100011660834_100000699651 [1,1,0,0,0,0|1,0,1]=4 2684 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)F 62a_100000685547_100011660834 [1,1,0,0,0,0|1,0,1]=4 2685 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)F 62a_100011660834_100000685547 [1,1,0,0,0,0|1,0,1]=4 2686 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)O 62a_100011660834_100000211634 [1,1,0,0,0,0|1,0,1]=4 2687 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)[S] 62a_100011660834_114929384022 [1,1,0,0,0,0|1,0,1]=4 2688 B17R2.5300 Oc1cccc(c1)CSc2cccc(c2)[S] 62a_114929384022_100011660834 [1,1,0,0,0,0|1,0,1]=4 2689 B17R2.5300 Oc1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_100000211634 [1,1,0,0,0,0|2,0,0]=4 2690 B17R2.5300 Oc1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_100000211634 [1,1,0,0,0,0|2,0,0]=4 2691 B17R2.5300 Oc1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_100000211634 [1,1,0,0,0,0|2,0,0]=4 2692 B17R2.5300 Oc1cccc(c1)SCc2cccc(c2)Cl 62a_100000187163_100000211634 [1,1,0,0,0,0|2,0,0]=4 2693 B17R2.5300 Oc1cccc(c1)SCc2cccc(c2)F 62a_100000230114_100000211634 [1,1,0,0,0,0|2,0,0]=4 2694 B17R2.5300 Oc1cccc(c1)SCc2cccc(c2)I 62a_100011218688_100000211634 [1,1,0,0,0,0|2,0,0]=4 2695 B17R2.5300 [S]c1cccc(c1)SCc2cc(ccn2)Br 62a_100010173614_114929384022 [1,1,0,0,0,0|2,0,0]=4 2696 B17R2.5300 [S]c1cccc(c1)SCc2cc(ccn2)Br 62a_114929384022_100010173614 [1,1,0,0,0,0|2,0,0]=4 2697 B17R2.5300 [S]c1cccc(c1)SCc2cc(ccn2)Cl 62a_100016988179_114929384022 [1,1,0,0,0,0|2,0,0]=4 2698 B17R2.5300 [S]c1cccc(c1)SCc2cc(ccn2)Cl 62a_114929384022_100016988179 [1,1,0,0,0,0|2,0,0]=4 2699 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)Br 62a_100000211773_114929384022 [1,1,0,0,0,0|2,0,0]=4 2700 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)Br 62a_114929384022_100000211773 [1,1,0,0,0,0|2,0,0]=4 2701 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)Cl 62a_100000187163_114929384022 [1,1,0,0,0,0|2,0,0]=4 2702 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)Cl 62a_114929384022_100000187163 [1,1,0,0,0,0|2,0,0]=4 2703 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)I 62a_100011218688_114929384022 [1,1,0,0,0,0|2,0,0]=4 2704 B17R2.5300 [S]c1cccc(c1)SCc2cccc(c2)I 62a_114929384022_100011218688 [1,1,0,0,0,0|2,0,0]=4 2705 B17R2.5365 Brc1ccc(c(c1)CSc2ccccc2)Br 62a_100000719477_100011982794 [1,1,0,0,0,0|2,0,0]=4 2706 B17R2.5365 Brc1ccc(c(c1)CSc2ccccc2)Br 62a_100011982794_100000041952 [1,1,0,0,0,0|2,0,0]=4 2707 B17R2.5365 Brc1ccc(c(c1)CSc2ccccc2)I 62a_100000719477_100012362523 [1,1,0,0,0,0|2,0,0]=4 2708 B17R2.5365 Brc1ccc(c(c1)CSc2ccccc2)I 62a_100012362523_100000041952 [1,1,0,0,0,0|2,0,0]=4 2709 B17R2.5365 Brc1ccc(cc1CSc2ccccc2)I 62a_100000719477_100012355412 [1,1,0,0,0,0|2,0,0]=4 2710 B17R2.5365 Brc1ccc(cc1CSc2ccccc2)I 62a_100012355412_100000041952 [1,1,0,0,0,0|2,0,0]=4 2711 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)C 62a_100000184699_100000041952 [1,1,0,0,0,0|2,0,0]=4 2712 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)C 62a_100000719477_100000184699 [1,1,0,0,0,0|2,0,0]=4 2713 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)Cl 62a_100000719477_100009871730 [1,1,0,0,0,0|2,0,0]=4 2714 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)Cl 62a_100009871730_100000041952 [1,1,0,0,0,0|2,0,0]=4 2715 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)F 62a_100000719477_100011260760 [1,1,0,0,0,0|2,0,0]=4 2716 B17R2.5365 Cc1ccc(c(c1)CSc2ccccc2)F 62a_100011260760_100000041952 [1,1,0,0,0,0|2,0,0]=4 2717 B17R2.5365 Cc1ccc(cc1CSc2ccccc2)Cl 62a_100000719477_100012186985 [1,1,0,0,0,0|2,0,0]=4 2718 B17R2.5365 Cc1ccc(cc1CSc2ccccc2)Cl 62a_100012186985_100000041952 [1,1,0,0,0,0|2,0,0]=4 2719 B17R2.5365 Cc1ccc(cc1CSc2ccccc2)F 62a_100000709795_100000041952 [1,1,0,0,0,0|2,0,0]=4 2720 B17R2.5365 Cc1ccc(cc1CSc2ccccc2)F 62a_100000719477_100000709795 [1,1,0,0,0,0|2,0,0]=4 2721 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)Br 62a_100000719477_100000733903 [1,1,0,0,0,0|2,0,0]=4 2722 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)Br 62a_100000733903_100000041952 [1,1,0,0,0,0|2,0,0]=4 2723 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)Cl 62a_100000719477_100000756322 [1,1,0,0,0,0|2,0,0]=4 2724 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)Cl 62a_100000756322_100000041952 [1,1,0,0,0,0|2,0,0]=4 2725 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)I 62a_100000719477_100012348826 [1,1,0,0,0,0|2,0,0]=4 2726 B17R2.5365 Clc1ccc(c(c1)CSc2ccccc2)I 62a_100012348826_100000041952 [1,1,0,0,0,0|2,0,0]=4 2727 B17R2.5365 Clc1ccc(cc1CSc2ccccc2)Br 62a_100000719477_100000763347 [1,1,0,0,0,0|2,0,0]=4 2728 B17R2.5365 Clc1ccc(cc1CSc2ccccc2)Br 62a_100000763347_100000041952 [1,1,0,0,0,0|2,0,0]=4 2729 B17R2.5365 Clc1ccc(cc1CSc2ccccc2)I 62a_100000719477_100010188191 [1,1,0,0,0,0|2,0,0]=4 2730 B17R2.5365 Clc1ccc(cc1CSc2ccccc2)I 62a_100010188191_100000041952 [1,1,0,0,0,0|2,0,0]=4 2731 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)Br 62a_100000719477_100000736370 [1,1,0,0,0,0|2,0,0]=4 2732 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)Br 62a_100000736370_100000041952 [1,1,0,0,0,0|2,0,0]=4 2733 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)Cl 62a_100000709952_100000041952 [1,1,0,0,0,0|2,0,0]=4 2734 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)Cl 62a_100000719477_100000709952 [1,1,0,0,0,0|2,0,0]=4 2735 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)F 62a_100000685659_100000041952 [1,1,0,0,0,0|2,0,0]=4 2736 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)F 62a_100000719477_100000685659 [1,1,0,0,0,0|2,0,0]=4 2737 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)I 62a_100000719477_100010149606 [1,1,0,0,0,0|2,0,0]=4 2738 B17R2.5365 Fc1ccc(c(c1)CSc2ccccc2)I 62a_100010149606_100000041952 [1,1,0,0,0,0|2,0,0]=4 2739 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)Br 62a_100000719477_100000736399 [1,1,0,0,0,0|2,0,0]=4 2740 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)Br 62a_100000736399_100000041952 [1,1,0,0,0,0|2,0,0]=4 2741 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)Cl 62a_100000716957_100000041952 [1,1,0,0,0,0|2,0,0]=4 2742 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)Cl 62a_100000719477_100000716957 [1,1,0,0,0,0|2,0,0]=4 2743 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)I 62a_100000719477_200010149601 [1,1,0,0,0,0|2,0,0]=4 2744 B17R2.5365 Fc1ccc(cc1CSc2ccccc2)I 62a_200010149601_100000041952 [1,1,0,0,0,0|2,0,0]=4 2745 B17R2.5365 Oc1ccc(cc1CSc2ccccc2)F 62a_100000719477_100010161318 [1,1,0,0,0,0|2,0,0]=4 2746 B17R2.5365 Oc1ccc(cc1CSc2ccccc2)F 62a_100010161318_100000041952 [1,1,0,0,0,0|2,0,0]=4 2747 B17R2.41893 Brc1cccc(c1)CSc2ccccc2Br 62a_100000211773_100000695589 [1,1,0,0,0,0|2,0,0]=4 2748 B17R2.41893 Brc1cccc(c1)CSc2ccccc2Br 62a_100000695589_100000211773 [1,1,0,0,0,0|2,0,0]=4 2749 B17R2.41893 Brc1ccccc1SCc2cccc(c2)I 62a_100000695589_100011218688 [1,1,0,0,0,0|2,0,0]=4 2750 B17R2.41893 Brc1ccccc1SCc2cccc(c2)I 62a_100011218688_100000695589 [1,1,0,0,0,0|2,0,0]=4 2751 B17R2.41893 Brc1ccnc(c1)CSc2ccccc2Br 62a_100000695589_100010173614 [1,1,0,0,0,0|2,0,0]=4 2752 B17R2.41893 Brc1ccnc(c1)CSc2ccccc2Br 62a_100010173614_100000695589 [1,1,0,0,0,0|2,0,0]=4 2753 B17R2.41893 Cc1cccc(c1)CSc2ccccc2Br 62a_100000211840_100000695589 [1,1,0,0,0,0|2,0,0]=4 2754 B17R2.41893 Cc1cccc(c1)CSc2ccccc2Br 62a_100000695589_100000211840 [1,1,0,0,0,0|2,0,0]=4 2755 B17R2.41893 Cc1cccc(c1)CSc2ccccc2C 62a_100000210755_100000211840 [1,1,0,0,0,0|2,0,0]=4 2756 B17R2.41893 Cc1cccc(c1)CSc2ccccc2C 62a_100000211840_100000210755 [1,1,0,0,0,0|2,0,0]=4 2757 B17R2.41893 Cc1cccc(c1)CSc2ccccc2Cl 62a_100000211840_100000764095 [1,1,0,0,0,0|2,0,0]=4 2758 B17R2.41893 Cc1cccc(c1)CSc2ccccc2Cl 62a_100000764095_100000211840 [1,1,0,0,0,0|2,0,0]=4 2759 B17R2.41893 Cc1cccc(c1)CSc2ccccc2F 62a_100000211840_100011215700 [1,1,0,0,0,0|2,0,0]=4 2760 B17R2.41893 Cc1cccc(c1)CSc2ccccc2F 62a_100011215700_100000211840 [1,1,0,0,0,0|2,0,0]=4 2761 B17R2.41893 Cc1cccc(c1)CSc2ccccc2N 62a_100000210017_100000211840 [1,1,0,0,0,0|2,0,0]=4 2762 B17R2.41893 Cc1cccc(c1)CSc2ccccc2N 62a_100000211840_100000210017 [1,1,0,0,0,0|2,0,0]=4 2763 B17R2.41893 Cc1cccc(c1)CSc2ccccc2O 62a_100000211840_100000739446 [1,1,0,0,0,0|2,0,0]=4 2764 B17R2.41893 Cc1cccc(c1)CSc2ccccc2O 62a_100000739446_100000211840 [1,1,0,0,0,0|2,0,0]=4 2765 B17R2.41893 Cc1ccccc1SCc2cc(ccn2)Br 62a_100000210755_100010173614 [1,1,0,0,0,0|2,0,0]=4 2766 B17R2.41893 Cc1ccccc1SCc2cc(ccn2)Br 62a_100010173614_100000210755 [1,1,0,0,0,0|2,0,0]=4 2767 B17R2.41893 Cc1ccccc1SCc2cc(ccn2)Cl 62a_100000210755_100016988179 [1,1,0,0,0,0|2,0,0]=4 2768 B17R2.41893 Cc1ccccc1SCc2cc(ccn2)Cl 62a_100016988179_100000210755 [1,1,0,0,0,0|2,0,0]=4 2769 B17R2.41893 Cc1ccccc1SCc2cccc(c2)Br 62a_100000210755_100000211773 [1,1,0,0,0,0|2,0,0]=4 2770 B17R2.41893 Cc1ccccc1SCc2cccc(c2)Br 62a_100000211773_100000210755 [1,1,0,0,0,0|2,0,0]=4 2771 B17R2.41893 Cc1ccccc1SCc2cccc(c2)Cl 62a_100000187163_100000210755 [1,1,0,0,0,0|2,0,0]=4 2772 B17R2.41893 Cc1ccccc1SCc2cccc(c2)Cl 62a_100000210755_100000187163 [1,1,0,0,0,0|2,0,0]=4 2773 B17R2.41893 Cc1ccccc1SCc2cccc(c2)F 62a_100000210755_100000230114 [1,1,0,0,0,0|2,0,0]=4 2774 B17R2.41893 Cc1ccccc1SCc2cccc(c2)F 62a_100000230114_100000210755 [1,1,0,0,0,0|2,0,0]=4 2775 B17R2.41893 Cc1ccccc1SCc2cccc(c2)I 62a_100000210755_100011218688 [1,1,0,0,0,0|2,0,0]=4 2776 B17R2.41893 Cc1ccccc1SCc2cccc(c2)I 62a_100011218688_100000210755 [1,1,0,0,0,0|2,0,0]=4 2777 B17R2.41893 Cc1ccccc1SCc2cccc(c2)O 62a_100000210755_100011660834 [1,1,0,0,0,0|1,0,1]=4 2778 B17R2.41893 Cc1ccccc1SCc2cccc(c2)O 62a_100011660834_100000210755 [1,1,0,0,0,0|1,0,1]=4 2779 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2Br 62a_100000695589_100000718516 [1,1,0,0,0,0|2,0,0]=4 2780 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2Br 62a_100000718516_100000695589 [1,1,0,0,0,0|2,0,0]=4 2781 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2C 62a_100000210755_100000718516 [1,1,0,0,0,0|2,0,0]=4 2782 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2C 62a_100000718516_100000210755 [1,1,0,0,0,0|2,0,0]=4 2783 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2Cl 62a_100000718516_100000764095 [1,1,0,0,0,0|2,0,0]=4 2784 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2Cl 62a_100000764095_100000718516 [1,1,0,0,0,0|2,0,0]=4 2785 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2F 62a_100000718516_100011215700 [1,1,0,0,0,0|2,0,0]=4 2786 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2F 62a_100011215700_100000718516 [1,1,0,0,0,0|2,0,0]=4 2787 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2N 62a_100000210017_100000718516 [1,1,0,0,0,0|2,0,0]=4 2788 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2N 62a_100000718516_100000210017 [1,1,0,0,0,0|2,0,0]=4 2789 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2O 62a_100000718516_100000739446 [1,1,0,0,0,0|2,0,0]=4 2790 B17R2.41893 Cc1ccnc(c1)CSc2ccccc2O 62a_100000739446_100000718516 [1,1,0,0,0,0|2,0,0]=4 2791 B17R2.41893 Clc1cccc(c1)CSc2ccccc2Br 62a_100000187163_100000695589 [1,1,0,0,0,0|2,0,0]=4 2792 B17R2.41893 Clc1cccc(c1)CSc2ccccc2Br 62a_100000695589_100000187163 [1,1,0,0,0,0|2,0,0]=4 2793 B17R2.41893 Clc1cccc(c1)CSc2ccccc2Cl 62a_100000187163_100000764095 [1,1,0,0,0,0|2,0,0]=4 2794 B17R2.41893 Clc1cccc(c1)CSc2ccccc2Cl 62a_100000764095_100000187163 [1,1,0,0,0,0|2,0,0]=4 2795 B17R2.41893 Clc1ccccc1SCc2cc(ccn2)Br 62a_100000764095_100010173614 [1,1,0,0,0,0|2,0,0]=4 2796 B17R2.41893 Clc1ccccc1SCc2cc(ccn2)Br 62a_100010173614_100000764095 [1,1,0,0,0,0|2,0,0]=4 2797 B17R2.41893 Clc1ccccc1SCc2cccc(c2)Br 62a_100000211773_100000764095 [1,1,0,0,0,0|2,0,0]=4 2798 B17R2.41893 Clc1ccccc1SCc2cccc(c2)Br 62a_100000764095_100000211773 [1,1,0,0,0,0|2,0,0]=4 2799 B17R2.41893 Clc1ccccc1SCc2cccc(c2)I 62a_100000764095_100011218688 [1,1,0,0,0,0|2,0,0]=4 2800 B17R2.41893 Clc1ccccc1SCc2cccc(c2)I 62a_100011218688_100000764095 [1,1,0,0,0,0|2,0,0]=4 2801 B17R2.41893 Clc1ccnc(c1)CSc2ccccc2Br 62a_100000695589_100016988179 [1,1,0,0,0,0|2,0,0]=4 2802 B17R2.41893 Clc1ccnc(c1)CSc2ccccc2Br 62a_100016988179_100000695589 [1,1,0,0,0,0|2,0,0]=4 2803 B17R2.41893 Clc1ccnc(c1)CSc2ccccc2Cl 62a_100000764095_100016988179 [1,1,0,0,0,0|2,0,0]=4 2804 B17R2.41893 Clc1ccnc(c1)CSc2ccccc2Cl 62a_100016988179_100000764095 [1,1,0,0,0,0|2,0,0]=4 2805 B17R2.41893 Fc1cccc(c1)CSc2ccccc2Br 62a_100000230114_100000695589 [1,1,0,0,0,0|2,0,0]=4 2806 B17R2.41893 Fc1cccc(c1)CSc2ccccc2Br 62a_100000695589_100000230114 [1,1,0,0,0,0|2,0,0]=4 2807 B17R2.41893 Fc1cccc(c1)CSc2ccccc2Cl 62a_100000230114_100000764095 [1,1,0,0,0,0|2,0,0]=4 2808 B17R2.41893 Fc1cccc(c1)CSc2ccccc2Cl 62a_100000764095_100000230114 [1,1,0,0,0,0|2,0,0]=4 2809 B17R2.41893 Fc1cccc(c1)CSc2ccccc2F 62a_100000230114_100011215700 [1,1,0,0,0,0|2,0,0]=4 2810 B17R2.41893 Fc1cccc(c1)CSc2ccccc2F 62a_100011215700_100000230114 [1,1,0,0,0,0|2,0,0]=4 2811 B17R2.41893 Fc1ccccc1SCc2cc(ccn2)Br 62a_100010173614_100011215700 [1,1,0,0,0,0|2,0,0]=4 2812 B17R2.41893 Fc1ccccc1SCc2cc(ccn2)Br 62a_100011215700_100010173614 [1,1,0,0,0,0|2,0,0]=4 2813 B17R2.41893 Fc1ccccc1SCc2cc(ccn2)Cl 62a_100011215700_100016988179 [1,1,0,0,0,0|2,0,0]=4 2814 B17R2.41893 Fc1ccccc1SCc2cc(ccn2)Cl 62a_100016988179_100011215700 [1,1,0,0,0,0|2,0,0]=4 2815 B17R2.41893 Fc1ccccc1SCc2cccc(c2)Br 62a_100000211773_100011215700 [1,1,0,0,0,0|2,0,0]=4 2816 B17R2.41893 Fc1ccccc1SCc2cccc(c2)Br 62a_100011215700_100000211773 [1,1,0,0,0,0|2,0,0]=4 2817 B17R2.41893 Fc1ccccc1SCc2cccc(c2)Cl 62a_100000187163_100011215700 [1,1,0,0,0,0|2,0,0]=4 2818 B17R2.41893 Fc1ccccc1SCc2cccc(c2)Cl 62a_100011215700_100000187163 [1,1,0,0,0,0|2,0,0]=4 2819 B17R2.41893 Fc1ccccc1SCc2cccc(c2)I 62a_100011215700_100011218688 [1,1,0,0,0,0|2,0,0]=4 2820 B17R2.41893 Fc1ccccc1SCc2cccc(c2)I 62a_100011218688_100011215700 [1,1,0,0,0,0|2,0,0]=4 2821 B17R2.41893 Nc1ccccc1SCc2cc(ccn2)Br 62a_100000210017_100010173614 [1,1,0,0,0,0|2,0,0]=4 2822 B17R2.41893 Nc1ccccc1SCc2cc(ccn2)Br 62a_100010173614_100000210017 [1,1,0,0,0,0|2,0,0]=4 2823 B17R2.41893 Nc1ccccc1SCc2cc(ccn2)Cl 62a_100000210017_100016988179 [1,1,0,0,0,0|2,0,0]=4 2824 B17R2.41893 Nc1ccccc1SCc2cc(ccn2)Cl 62a_100016988179_100000210017 [1,1,0,0,0,0|2,0,0]=4 2825 B17R2.41893 Nc1ccccc1SCc2cccc(c2)Br 62a_100000210017_100000211773 [1,1,0,0,0,0|2,0,0]=4 2826 B17R2.41893 Nc1ccccc1SCc2cccc(c2)Br 62a_100000211773_100000210017 [1,1,0,0,0,0|2,0,0]=4 2827 B17R2.41893 Nc1ccccc1SCc2cccc(c2)Cl 62a_100000187163_100000210017 [1,1,0,0,0,0|2,0,0]=4 2828 B17R2.41893 Nc1ccccc1SCc2cccc(c2)Cl 62a_100000210017_100000187163 [1,1,0,0,0,0|2,0,0]=4 2829 B17R2.41893 Nc1ccccc1SCc2cccc(c2)F 62a_100000210017_100000230114 [1,1,0,0,0,0|2,0,0]=4 2830 B17R2.41893 Nc1ccccc1SCc2cccc(c2)F 62a_100000230114_100000210017 [1,1,0,0,0,0|2,0,0]=4 2831 B17R2.41893 Nc1ccccc1SCc2cccc(c2)I 62a_100000210017_100011218688 [1,1,0,0,0,0|2,0,0]=4 2832 B17R2.41893 Nc1ccccc1SCc2cccc(c2)I 62a_100011218688_100000210017 [1,1,0,0,0,0|2,0,0]=4 2833 B17R2.41893 Nc1ccccc1SCc2cccc(c2)O 62a_100000210017_100011660834 [1,1,0,0,0,0|1,0,1]=4 2834 B17R2.41893 Nc1ccccc1SCc2cccc(c2)O 62a_100011660834_100000210017 [1,1,0,0,0,0|1,0,1]=4 2835 B17R2.41893 Oc1cccc(c1)CSc2ccccc2Br 62a_100000695589_100011660834 [1,1,0,0,0,0|1,0,1]=4 2836 B17R2.41893 Oc1cccc(c1)CSc2ccccc2Br 62a_100011660834_100000695589 [1,1,0,0,0,0|1,0,1]=4 2837 B17R2.41893 Oc1cccc(c1)CSc2ccccc2Cl 62a_100000764095_100011660834 [1,1,0,0,0,0|1,0,1]=4 2838 B17R2.41893 Oc1cccc(c1)CSc2ccccc2Cl 62a_100011660834_100000764095 [1,1,0,0,0,0|1,0,1]=4 2839 B17R2.41893 Oc1cccc(c1)CSc2ccccc2F 62a_100011215700_100011660834 [1,1,0,0,0,0|1,0,1]=4 2840 B17R2.41893 Oc1cccc(c1)CSc2ccccc2F 62a_100011660834_100011215700 [1,1,0,0,0,0|1,0,1]=4 2841 B17R2.41893 Oc1cccc(c1)CSc2ccccc2O 62a_100000739446_100011660834 [1,1,0,0,0,0|1,0,1]=4 2842 B17R2.41893 Oc1cccc(c1)CSc2ccccc2O 62a_100011660834_100000739446 [1,1,0,0,0,0|1,0,1]=4 2843 B17R2.41893 Oc1ccccc1SCc2cc(ccn2)Br 62a_100000739446_100010173614 [1,1,0,0,0,0|2,0,0]=4 2844 B17R2.41893 Oc1ccccc1SCc2cc(ccn2)Br 62a_100010173614_100000739446 [1,1,0,0,0,0|2,0,0]=4 2845 B17R2.41893 Oc1ccccc1SCc2cc(ccn2)Cl 62a_100000739446_100016988179 [1,1,0,0,0,0|2,0,0]=4 2846 B17R2.41893 Oc1ccccc1SCc2cc(ccn2)Cl 62a_100016988179_100000739446 [1,1,0,0,0,0|2,0,0]=4 2847 B17R2.41893 Oc1ccccc1SCc2cccc(c2)Br 62a_100000211773_100000739446 [1,1,0,0,0,0|2,0,0]=4 2848 B17R2.41893 Oc1ccccc1SCc2cccc(c2)Br 62a_100000739446_100000211773 [1,1,0,0,0,0|2,0,0]=4 2849 B17R2.41893 Oc1ccccc1SCc2cccc(c2)Cl 62a_100000187163_100000739446 [1,1,0,0,0,0|2,0,0]=4 2850 B17R2.41893 Oc1ccccc1SCc2cccc(c2)Cl 62a_100000739446_100000187163 [1,1,0,0,0,0|2,0,0]=4 2851 B17R2.41893 Oc1ccccc1SCc2cccc(c2)F 62a_100000230114_100000739446 [1,1,0,0,0,0|2,0,0]=4 2852 B17R2.41893 Oc1ccccc1SCc2cccc(c2)F 62a_100000739446_100000230114 [1,1,0,0,0,0|2,0,0]=4 2853 B17R2.41893 Oc1ccccc1SCc2cccc(c2)I 62a_100000739446_100011218688 [1,1,0,0,0,0|2,0,0]=4 2854 B17R2.41893 Oc1ccccc1SCc2cccc(c2)I 62a_100011218688_100000739446 [1,1,0,0,0,0|2,0,0]=4 2855 B17R2.472 Cc1cc(ccc1O)Sc2ccc(cc2)Br 62a_100000752885_100000186361 [0,1,0,0,1,0|2,0,0]=4 2856 B17R2.472 Cc1cc(ccc1O)Sc2ccc(cc2)Cl 62a_100000755918_100000186361 [0,1,0,0,1,0|2,0,0]=4 2857 B17R2.472 Cc1cc(ccc1O)Sc2ccc(cc2)F 62a_100000211213_100000186361 [0,1,0,0,1,0|2,0,0]=4 2858 B17R2.472 Cc1cc(ccc1O)Sc2ccc(cc2)N 62a_100000185761_100000186361 [0,1,0,0,1,0|2,0,0]=4 2859 B17R2.472 Cc1cc(ncc1O)Sc2ccc(cc2)Br 62a_100000752885_100000692680 [0,1,0,0,1,0|2,0,0]=4 2860 B17R2.472 Cc1cc(ncc1O)Sc2ccc(cc2)Cl 62a_100000755918_100000692680 [0,1,0,0,1,0|2,0,0]=4 2861 B17R2.472 Cc1cc(ncc1O)Sc2ccc(cc2)F 62a_100000211213_100000692680 [0,1,0,0,1,0|2,0,0]=4 2862 B17R2.472 Cc1cc(ncc1O)Sc2ccc(cc2)N 62a_100000185761_100000692680 [0,1,0,0,1,0|2,0,0]=4 2863 B17R2.472 Cc1ccc(cc1)Sc2cc(c(cn2)O)C 62a_100000186775_100000692680 [0,1,0,0,1,0|2,0,0]=4 2864 B17R2.472 Cc1ccc(cc1)Sc2cc(c(cn2)O)N 62a_100000186775_100009819941 [0,1,0,0,1,0|2,0,0]=4 2865 B17R2.472 Cc1ccc(cc1)Sc2cc(c(cn2)O)N 62a_100009819941_100000186775 [0,1,0,0,1,0|2,0,0]=4 2866 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)Br)O 62a_100000186775_100012361655 [0,1,0,0,1,0|2,0,0]=4 2867 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)Br)O 62a_100012361655_100000186775 [0,1,0,0,1,0|2,0,0]=4 2868 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)C)O 62a_100000186775_100000186361 [0,1,0,0,1,0|2,0,0]=4 2869 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)Cl)O 62a_100000186775_100012360047 [0,1,0,0,1,0|2,0,0]=4 2870 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100000186775 [0,1,0,0,1,0|2,0,0]=4 2871 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)F)O 62a_100000185481_100000186775 [0,1,0,0,1,0|2,0,0]=4 2872 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)F)O 62a_100000186775_100000185481 [0,1,0,0,1,0|2,0,0]=4 2873 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)N)O 62a_100000186775_100000752626 [0,1,0,0,1,0|2,0,0]=4 2874 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)N)O 62a_100000752626_100000186775 [0,1,0,0,1,0|2,0,0]=4 2875 B17R2.472 Cc1ccc(cc1)Sc2ccc(c(c2)O)O 62a_100000186775_100009813601 [0,1,0,0,1,0|1,0,1]=4 2876 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)Br 62a_100000752626_100000752885 [0,1,0,0,1,0|2,0,0]=4 2877 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)Br 62a_100000752885_100000752626 [0,1,0,0,1,0|2,0,0]=4 2878 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)Cl 62a_100000752626_100000755918 [0,1,0,0,1,0|2,0,0]=4 2879 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)Cl 62a_100000755918_100000752626 [0,1,0,0,1,0|2,0,0]=4 2880 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)F 62a_100000211213_100000752626 [0,1,0,0,1,0|2,0,0]=4 2881 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)F 62a_100000752626_100000211213 [0,1,0,0,1,0|2,0,0]=4 2882 B17R2.472 Nc1cc(ccc1O)Sc2ccc(cc2)O 62a_100000752626_100000185759 [0,1,0,0,1,0|2,0,0]=4 2883 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)Br 62a_100000752885_100009819941 [0,1,0,0,1,0|2,0,0]=4 2884 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)Br 62a_100009819941_100000752885 [0,1,0,0,1,0|2,0,0]=4 2885 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)Cl 62a_100000755918_100009819941 [0,1,0,0,1,0|2,0,0]=4 2886 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)Cl 62a_100009819941_100000755918 [0,1,0,0,1,0|2,0,0]=4 2887 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)F 62a_100000211213_100009819941 [0,1,0,0,1,0|2,0,0]=4 2888 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)F 62a_100009819941_100000211213 [0,1,0,0,1,0|2,0,0]=4 2889 B17R2.472 Nc1cc(ncc1O)Sc2ccc(cc2)O 62a_100009819941_100000185759 [0,1,0,0,1,0|2,0,0]=4 2890 B17R2.472 Nc1ccc(cc1)Sc2cc(c(cn2)O)N 62a_100000185761_100009819941 [0,1,0,0,1,0|2,0,0]=4 2891 B17R2.472 Nc1ccc(cc1)Sc2cc(c(cn2)O)N 62a_100009819941_100000185761 [0,1,0,0,1,0|2,0,0]=4 2892 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)Br)O 62a_100000185761_100012361655 [0,1,0,0,1,0|2,0,0]=4 2893 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)Br)O 62a_100012361655_100000185761 [0,1,0,0,1,0|2,0,0]=4 2894 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)Cl)O 62a_100000185761_100012360047 [0,1,0,0,1,0|2,0,0]=4 2895 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100000185761 [0,1,0,0,1,0|2,0,0]=4 2896 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)F)O 62a_100000185481_100000185761 [0,1,0,0,1,0|2,0,0]=4 2897 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)F)O 62a_100000185761_100000185481 [0,1,0,0,1,0|2,0,0]=4 2898 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)N)O 62a_100000185761_100000752626 [0,1,0,0,1,0|2,0,0]=4 2899 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)N)O 62a_100000752626_100000185761 [0,1,0,0,1,0|2,0,0]=4 2900 B17R2.472 Nc1ccc(cc1)Sc2ccc(c(c2)O)O 62a_100000185761_100009813601 [0,1,0,0,1,0|1,0,1]=4 2901 B17R2.472 Oc1ccc(cc1)Sc2ccc(c(c2)Br)O 62a_100012361655_100000185759 [0,1,0,0,1,0|2,0,0]=4 2902 B17R2.472 Oc1ccc(cc1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100000185759 [0,1,0,0,1,0|2,0,0]=4 2903 B17R2.472 Oc1ccc(cc1)Sc2ccc(c(c2)F)O 62a_100000185481_100000185759 [0,1,0,0,1,0|2,0,0]=4 2904 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)Br 62a_100000752885_100012361655 [0,1,0,0,1,0|2,0,0]=4 2905 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)Br 62a_100012361655_100000752885 [0,1,0,0,1,0|2,0,0]=4 2906 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)Cl 62a_100000755918_100012361655 [0,1,0,0,1,0|2,0,0]=4 2907 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)Cl 62a_100012361655_100000755918 [0,1,0,0,1,0|2,0,0]=4 2908 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)F 62a_100000211213_100012361655 [0,1,0,0,1,0|2,0,0]=4 2909 B17R2.472 Oc1ccc(cc1Br)Sc2ccc(cc2)F 62a_100012361655_100000211213 [0,1,0,0,1,0|2,0,0]=4 2910 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)Br 62a_100000752885_100012360047 [0,1,0,0,1,0|2,0,0]=4 2911 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)Br 62a_100012360047_100000752885 [0,1,0,0,1,0|2,0,0]=4 2912 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)Cl 62a_100000755918_100012360047 [0,1,0,0,1,0|2,0,0]=4 2913 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)Cl 62a_100012360047_100000755918 [0,1,0,0,1,0|2,0,0]=4 2914 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)F 62a_100000211213_100012360047 [0,1,0,0,1,0|2,0,0]=4 2915 B17R2.472 Oc1ccc(cc1Cl)Sc2ccc(cc2)F 62a_100012360047_100000211213 [0,1,0,0,1,0|2,0,0]=4 2916 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)Br 62a_100000185481_100000752885 [0,1,0,0,1,0|2,0,0]=4 2917 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)Br 62a_100000752885_100000185481 [0,1,0,0,1,0|2,0,0]=4 2918 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)Cl 62a_100000185481_100000755918 [0,1,0,0,1,0|2,0,0]=4 2919 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)Cl 62a_100000755918_100000185481 [0,1,0,0,1,0|2,0,0]=4 2920 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)F 62a_100000185481_100000211213 [0,1,0,0,1,0|2,0,0]=4 2921 B17R2.472 Oc1ccc(cc1F)Sc2ccc(cc2)F 62a_100000211213_100000185481 [0,1,0,0,1,0|2,0,0]=4 2922 B17R2.472 Oc1ccc(cc1O)Sc2ccc(cc2)Br 62a_100000752885_100009813601 [0,1,0,0,1,0|1,0,1]=4 2923 B17R2.472 Oc1ccc(cc1O)Sc2ccc(cc2)Cl 62a_100000755918_100009813601 [0,1,0,0,1,0|1,0,1]=4 2924 B17R2.472 Oc1ccc(cc1O)Sc2ccc(cc2)F 62a_100000211213_100009813601 [0,1,0,0,1,0|1,0,1]=4 2925 B17R2.2418 COc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100011249507 [0,1,0,0,1,0|2,0,0]=4 2926 B17R2.2418 COc1ccc(cc1Br)Sc2ccccc2 62a_100011249507_100000041952 [0,1,0,0,1,0|2,0,0]=4 2927 B17R2.2418 COc1ccc(cc1C)Sc2ccccc2 62a_100000719477_100011219705 [0,1,0,0,1,0|2,0,0]=4 2928 B17R2.2418 COc1ccc(cc1C)Sc2ccccc2 62a_100011219705_100000041952 [0,1,0,0,1,0|2,0,0]=4 2929 B17R2.2418 COc1ccc(cc1Cl)Sc2ccccc2 62a_100000719477_100012355395 [0,1,0,0,1,0|2,0,0]=4 2930 B17R2.2418 COc1ccc(cc1Cl)Sc2ccccc2 62a_100012355395_100000041952 [0,1,0,0,1,0|2,0,0]=4 2931 B17R2.2418 COc1ccc(cc1F)Sc2ccccc2 62a_100000171752_100000041952 [0,1,0,0,1,0|2,0,0]=4 2932 B17R2.2418 COc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100000171752 [0,1,0,0,1,0|2,0,0]=4 2933 B17R2.2418 COc1ccc(cc1N)Sc2ccccc2 62a_100000719477_100011249504 [0,1,0,0,1,0|2,0,0]=4 2934 B17R2.2418 COc1ccc(cc1N)Sc2ccccc2 62a_100011249504_100000041952 [0,1,0,0,1,0|2,0,0]=4 2935 B17R2.2418 COc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100009816560 [0,1,0,0,1,0|1,0,1]=4 2936 B17R2.2418 COc1cnc(cc1N)Sc2ccccc2 62a_100000719477_100010896307 [0,1,0,0,1,0|2,0,0]=4 2937 B17R2.2418 COc1cnc(cc1N)Sc2ccccc2 62a_100010896307_100000041952 [0,1,0,0,1,0|2,0,0]=4 2938 B17R2.2418 COc1cnc(cc1O)Sc2ccccc2 62a_100000719477_100010264082 [0,1,0,0,1,0|1,0,1]=4 2939 B17R2.2418 Cc1cc(ccc1CO)Sc2ccccc2 62a_100000719477_100000748258 [0,1,0,0,1,0|2,0,0]=4 2940 B17R2.2418 Cc1cc(ccc1CO)Sc2ccccc2 62a_100000748258_100000041952 [0,1,0,0,1,0|2,0,0]=4 2941 B17R2.2418 Cc1cc(ncc1CO)Sc2ccccc2 62a_100000719477_100010277336 [0,1,0,0,1,0|2,0,0]=4 2942 B17R2.2418 Cc1cc(ncc1CO)Sc2ccccc2 62a_100010277336_100000041952 [0,1,0,0,1,0|2,0,0]=4 2943 B17R2.2418 Nc1cc(ccc1CO)Sc2ccccc2 62a_100000718831_100000041952 [0,1,0,0,1,0|2,0,0]=4 2944 B17R2.2418 Nc1cc(ccc1CO)Sc2ccccc2 62a_100000719477_100000718831 [0,1,0,0,1,0|2,0,0]=4 2945 B17R2.2418 Nc1cc(ncc1CO)Sc2ccccc2 62a_100000719477_100009830438 [0,1,0,0,1,0|2,0,0]=4 2946 B17R2.2418 Nc1cc(ncc1CO)Sc2ccccc2 62a_100009830438_100000041952 [0,1,0,0,1,0|2,0,0]=4 2947 B17R2.2418 OCc1ccc(cc1Br)Sc2ccccc2 62a_100000719477_100010240206 [0,1,0,0,1,0|2,0,0]=4 2948 B17R2.2418 OCc1ccc(cc1Br)Sc2ccccc2 62a_100010240206_100000041952 [0,1,0,0,1,0|2,0,0]=4 2949 B17R2.2418 OCc1ccc(cc1F)Sc2ccccc2 62a_100000719477_100011191541 [0,1,0,0,1,0|2,0,0]=4 2950 B17R2.2418 OCc1ccc(cc1F)Sc2ccccc2 62a_100011191541_100000041952 [0,1,0,0,1,0|2,0,0]=4 2951 B17R2.2418 OCc1ccc(cc1O)Sc2ccccc2 62a_100000071718_100000041952 [0,1,0,0,1,0|1,0,1]=4 2952 B17R2.2418 OCc1ccc(cc1O)Sc2ccccc2 62a_100000719477_100000071718 [0,1,0,0,1,0|1,0,1]=4 2953 B17R2.2492 CCc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100012338938 [0,1,0,0,1,0|2,0,0]=4 2954 B17R2.2492 COc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000694246 [0,1,0,0,1,0|1,0,1]=4 2955 B17R2.2492 Cc1ccc(cc1C=O)Sc2ccccc2 62a_100000719477_100011361606 [0,1,0,0,1,0|2,0,0]=4 2956 B17R2.2492 Cc1ccc(cc1C=O)Sc2ccccc2 62a_100011361606_100000041952 [0,1,0,0,1,0|2,0,0]=4 2957 B17R2.2492 N#Cc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000687585 [0,1,0,0,1,0|2,0,0]=4 2958 B17R2.2492 NCc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000730032 [0,1,0,0,1,0|2,0,0]=4 2959 B17R2.2492 NCc1cc(ccc1O)Sc2ccccc2 62a_100000730032_100000041952 [0,1,0,0,1,0|2,0,0]=4 2960 B17R2.2492 Nc1ccc(cc1C=O)Sc2ccccc2 62a_100011935258_100000041952 [0,1,0,0,1,0|2,0,0]=4 2961 B17R2.2492 O=Cc1cc(ccc1Br)Sc2ccccc2 62a_100000719477_100010185652 [0,1,0,0,1,0|2,0,0]=4 2962 B17R2.2492 O=Cc1cc(ccc1Br)Sc2ccccc2 62a_100010185652_100000041952 [0,1,0,0,1,0|2,0,0]=4 2963 B17R2.2492 O=Cc1cc(ccc1Cl)Sc2ccccc2 62a_100000719477_100010254384 [0,1,0,0,1,0|2,0,0]=4 2964 B17R2.2492 O=Cc1cc(ccc1Cl)Sc2ccccc2 62a_100010254384_100000041952 [0,1,0,0,1,0|2,0,0]=4 2965 B17R2.2492 O=Cc1cc(ccc1F)Sc2ccccc2 62a_100000050626_100000041952 [0,1,0,0,1,0|2,0,0]=4 2966 B17R2.2492 O=Cc1cc(ccc1F)Sc2ccccc2 62a_100000719477_100000050626 [0,1,0,0,1,0|2,0,0]=4 2967 B17R2.2492 O=Cc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000186750 [0,1,0,0,1,0|1,0,0]=3 2968 B17R2.2492 O=Cc1cc(ccc1O)Sc2ccccn2 62a_100011216584_100000186750 [0,1,0,0,1,0|2,0,0]=4 2969 B17R2.2492 O=Cc1cc(ccc1O)Sc2cccnc2 62a_100000210063_100000186750 [0,1,0,0,1,0|2,0,0]=4 2970 B17R2.2492 O=Cc1cc(ccc1O)Sc2ccncc2 62a_100000728582_100000186750 [0,1,0,0,1,0|2,0,0]=4 2971 B17R2.2492 O=Cc1cc(cnc1O)Sc2ccccc2 62a_100000719477_100010064889 [0,1,0,0,1,0|2,0,0]=4 2972 B17R2.2492 O=Cc1cc(cnc1O)Sc2ccccc2 62a_100010064889_100000041952 [0,1,0,0,1,0|2,0,0]=4 2973 B17R2.2492 O=Cc1cc(ncc1Br)Sc2ccccc2 62a_100000719477_200135154921 [0,1,0,0,1,0|2,0,0]=4 2974 B17R2.2492 O=Cc1cc(ncc1Br)Sc2ccccc2 62a_200135154921_100000041952 [0,1,0,0,1,0|2,0,0]=4 2975 B17R2.2492 O=Cc1cc(ncc1F)Sc2ccccc2 62a_100000707870_100000041952 [0,1,0,0,1,0|2,0,0]=4 2976 B17R2.2492 O=Cc1cc(ncc1F)Sc2ccccc2 62a_100000719477_100000707870 [0,1,0,0,1,0|2,0,0]=4 2977 B17R2.2492 O=Cc1cc(ncc1O)Sc2ccccc2 62a_100000719477_100000048449 [0,1,0,0,1,0|1,0,0]=3 2978 B17R2.2492 O=Cc1cc(ncc1O)Sc2ccccn2 62a_100011216584_100000048449 [0,1,0,0,1,0|2,0,0]=4 2979 B17R2.2492 O=Cc1cc(ncc1O)Sc2cccnc2 62a_100000210063_100000048449 [0,1,0,0,1,0|2,0,0]=4 2980 B17R2.2492 O=Cc1cc(ncc1O)Sc2ccncc2 62a_100000728582_100000048449 [0,1,0,0,1,0|2,0,0]=4 2981 B17R2.2492 OCc1cc(ccc1O)Sc2ccccc2 62a_100000184703_100000041952 [0,1,0,0,1,0|1,0,1]=4 2982 B17R2.2492 OCc1cc(ccc1O)Sc2ccccc2 62a_100000719477_100000184703 [0,1,0,0,1,0|1,0,1]=4 2983 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2Br 62a_100000695589_100000186361 [0,1,0,0,1,0|2,0,0]=4 2984 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2C 62a_100000210755_100000186361 [0,1,0,0,1,0|2,0,0]=4 2985 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2Cl 62a_100000764095_100000186361 [0,1,0,0,1,0|2,0,0]=4 2986 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2F 62a_100011215700_100000186361 [0,1,0,0,1,0|2,0,0]=4 2987 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2N 62a_100000210017_100000186361 [0,1,0,0,1,0|2,0,0]=4 2988 B17R2.5115 Cc1cc(ccc1O)Sc2ccccc2O 62a_100000739446_100000186361 [0,1,0,0,1,0|2,0,0]=4 2989 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2Br 62a_100000695589_100000692680 [0,1,0,0,1,0|2,0,0]=4 2990 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2C 62a_100000210755_100000692680 [0,1,0,0,1,0|2,0,0]=4 2991 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2Cl 62a_100000764095_100000692680 [0,1,0,0,1,0|2,0,0]=4 2992 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2F 62a_100011215700_100000692680 [0,1,0,0,1,0|2,0,0]=4 2993 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2N 62a_100000210017_100000692680 [0,1,0,0,1,0|2,0,0]=4 2994 B17R2.5115 Cc1cc(ncc1O)Sc2ccccc2O 62a_100000739446_100000692680 [0,1,0,0,1,0|2,0,0]=4 2995 B17R2.5115 Cc1ccccc1Sc2cc(c(cn2)O)N 62a_100000210755_100009819941 [0,1,0,0,1,0|2,0,0]=4 2996 B17R2.5115 Cc1ccccc1Sc2cc(c(cn2)O)N 62a_100009819941_100000210755 [0,1,0,0,1,0|2,0,0]=4 2997 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)Br)O 62a_100000210755_100012361655 [0,1,0,0,1,0|2,0,0]=4 2998 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)Br)O 62a_100012361655_100000210755 [0,1,0,0,1,0|2,0,0]=4 2999 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)Cl)O 62a_100000210755_100012360047 [0,1,0,0,1,0|2,0,0]=4 3000 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)Cl)O 62a_100012360047_100000210755 [0,1,0,0,1,0|2,0,0]=4 3001 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)F)O 62a_100000185481_100000210755 [0,1,0,0,1,0|2,0,0]=4 3002 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)F)O 62a_100000210755_100000185481 [0,1,0,0,1,0|2,0,0]=4 3003 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)N)O 62a_100000210755_100000752626 [0,1,0,0,1,0|2,0,0]=4 3004 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)N)O 62a_100000752626_100000210755 [0,1,0,0,1,0|2,0,0]=4 3005 B17R2.5115 Cc1ccccc1Sc2ccc(c(c2)O)O 62a_100000210755_100009813601 [0,1,0,0,1,0|1,0,1]=4 3006 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2Br 62a_100000695589_100000752626 [0,1,0,0,1,0|2,0,0]=4 3007 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2Br 62a_100000752626_100000695589 [0,1,0,0,1,0|2,0,0]=4 3008 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2Cl 62a_100000752626_100000764095 [0,1,0,0,1,0|2,0,0]=4 3009 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2Cl 62a_100000764095_100000752626 [0,1,0,0,1,0|2,0,0]=4 3010 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2F 62a_100000752626_100011215700 [0,1,0,0,1,0|2,0,0]=4 3011 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2F 62a_100011215700_100000752626 [0,1,0,0,1,0|2,0,0]=4 3012 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2N 62a_100000210017_100000752626 [0,1,0,0,1,0|2,0,0]=4 3013 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2N 62a_100000752626_100000210017 [0,1,0,0,1,0|2,0,0]=4 3014 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2O 62a_100000739446_100000752626 [0,1,0,0,1,0|2,0,0]=4 3015 B17R2.5115 Nc1cc(ccc1O)Sc2ccccc2O 62a_100000752626_100000739446 [0,1,0,0,1,0|2,0,0]=4 3016 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2Br 62a_100000695589_100009819941 [0,1,0,0,1,0|2,0,0]=4 3017 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2Br 62a_100009819941_100000695589 [0,1,0,0,1,0|2,0,0]=4 3018 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2Cl 62a_100000764095_100009819941 [0,1,0,0,1,0|2,0,0]=4 3019 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2Cl 62a_100009819941_100000764095 [0,1,0,0,1,0|2,0,0]=4 3020 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2F 62a_100009819941_100011215700 [0,1,0,0,1,0|2,0,0]=4 3021 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2F 62a_100011215700_100009819941 [0,1,0,0,1,0|2,0,0]=4 3022 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2N 62a_100000210017_100009819941 [0,1,0,0,1,0|2,0,0]=4 3023 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2N 62a_100009819941_100000210017 [0,1,0,0,1,0|2,0,0]=4 3024 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2O 62a_100000739446_100009819941 [0,1,0,0,1,0|2,0,0]=4 3025 B17R2.5115 Nc1cc(ncc1O)Sc2ccccc2O 62a_100009819941_100000739446 [0,1,0,0,1,0|2,0,0]=4 3026 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)Br)O 62a_100000210017_100012361655 [0,1,0,0,1,0|2,0,0]=4 3027 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)Br)O 62a_100012361655_100000210017 [0,1,0,0,1,0|2,0,0]=4 3028 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)Cl)O 62a_100000210017_100012360047 [0,1,0,0,1,0|2,0,0]=4 3029 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)Cl)O 62a_100012360047_100000210017 [0,1,0,0,1,0|2,0,0]=4 3030 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)F)O 62a_100000185481_100000210017 [0,1,0,0,1,0|2,0,0]=4 3031 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)F)O 62a_100000210017_100000185481 [0,1,0,0,1,0|2,0,0]=4 3032 B17R2.5115 Nc1ccccc1Sc2ccc(c(c2)O)O 62a_100000210017_100009813601 [0,1,0,0,1,0|1,0,1]=4 3033 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2Br 62a_100000695589_100012361655 [0,1,0,0,1,0|2,0,0]=4 3034 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2Br 62a_100012361655_100000695589 [0,1,0,0,1,0|2,0,0]=4 3035 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2Cl 62a_100000764095_100012361655 [0,1,0,0,1,0|2,0,0]=4 3036 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2Cl 62a_100012361655_100000764095 [0,1,0,0,1,0|2,0,0]=4 3037 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2F 62a_100011215700_100012361655 [0,1,0,0,1,0|2,0,0]=4 3038 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2F 62a_100012361655_100011215700 [0,1,0,0,1,0|2,0,0]=4 3039 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2O 62a_100000739446_100012361655 [0,1,0,0,1,0|2,0,0]=4 3040 B17R2.5115 Oc1ccc(cc1Br)Sc2ccccc2O 62a_100012361655_100000739446 [0,1,0,0,1,0|2,0,0]=4 3041 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2Br 62a_100000695589_100012360047 [0,1,0,0,1,0|2,0,0]=4 3042 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2Br 62a_100012360047_100000695589 [0,1,0,0,1,0|2,0,0]=4 3043 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2Cl 62a_100000764095_100012360047 [0,1,0,0,1,0|2,0,0]=4 3044 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2Cl 62a_100012360047_100000764095 [0,1,0,0,1,0|2,0,0]=4 3045 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2F 62a_100011215700_100012360047 [0,1,0,0,1,0|2,0,0]=4 3046 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2F 62a_100012360047_100011215700 [0,1,0,0,1,0|2,0,0]=4 3047 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2O 62a_100000739446_100012360047 [0,1,0,0,1,0|2,0,0]=4 3048 B17R2.5115 Oc1ccc(cc1Cl)Sc2ccccc2O 62a_100012360047_100000739446 [0,1,0,0,1,0|2,0,0]=4 3049 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2Br 62a_100000185481_100000695589 [0,1,0,0,1,0|2,0,0]=4 3050 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2Br 62a_100000695589_100000185481 [0,1,0,0,1,0|2,0,0]=4 3051 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2Cl 62a_100000185481_100000764095 [0,1,0,0,1,0|2,0,0]=4 3052 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2Cl 62a_100000764095_100000185481 [0,1,0,0,1,0|2,0,0]=4 3053 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2F 62a_100000185481_100011215700 [0,1,0,0,1,0|2,0,0]=4 3054 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2F 62a_100011215700_100000185481 [0,1,0,0,1,0|2,0,0]=4 3055 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2O 62a_100000185481_100000739446 [0,1,0,0,1,0|2,0,0]=4 3056 B17R2.5115 Oc1ccc(cc1F)Sc2ccccc2O 62a_100000739446_100000185481 [0,1,0,0,1,0|2,0,0]=4 3057 B17R2.5115 Oc1ccc(cc1O)Sc2ccccc2Br 62a_100000695589_100009813601 [0,1,0,0,1,0|1,0,1]=4 3058 B17R2.5115 Oc1ccc(cc1O)Sc2ccccc2Cl 62a_100000764095_100009813601 [0,1,0,0,1,0|1,0,1]=4 3059 B17R2.5115 Oc1ccc(cc1O)Sc2ccccc2F 62a_100011215700_100009813601 [0,1,0,0,1,0|1,0,1]=4 3060 B17R2.5115 Oc1ccc(cc1O)Sc2ccccc2O 62a_100000739446_100009813601 [0,1,0,0,1,0|1,0,1]=4 3061 B17R2.5352 Cc1cc(c(cc1O)C)Sc2ccccc2 62a_100000698207_100000041952 [0,1,0,0,1,0|2,0,0]=4 3062 B17R2.5352 Cc1cc(c(cc1O)C)Sc2ccccc2 62a_100000719477_100000698207 [0,1,0,0,1,0|2,0,0]=4 3063 B17R2.5352 Cc1cc(c(cc1Sc2ccccc2)F)O 62a_100000719477_100012355673 [0,1,0,0,1,0|2,0,0]=4 3064 B17R2.5352 Cc1cc(c(cc1Sc2ccccc2)F)O 62a_100012355673_100000041952 [0,1,0,0,1,0|2,0,0]=4 3065 B17R2.5352 Cc1cc(c(cc1Sc2ccccc2)N)O 62a_100000719477_200010235796 [0,1,0,0,1,0|2,0,0]=4 3066 B17R2.5352 Cc1cc(c(cc1Sc2ccccc2)N)O 62a_200010235796_100000041952 [0,1,0,0,1,0|2,0,0]=4 3067 B17R2.5352 Nc1cc(c(cc1O)Cl)Sc2ccccc2 62a_100000719477_100011011175 [0,1,0,0,1,0|2,0,0]=4 3068 B17R2.5352 Nc1cc(c(cc1O)Cl)Sc2ccccc2 62a_100011011175_100000041952 [0,1,0,0,1,0|2,0,0]=4 3069 B17R2.5352 Nc1cc(c(cc1O)F)Sc2ccccc2 62a_100000719477_100012359894 [0,1,0,0,1,0|2,0,0]=4 3070 B17R2.5352 Nc1cc(c(cc1O)F)Sc2ccccc2 62a_100012359894_100000041952 [0,1,0,0,1,0|2,0,0]=4 3071 B17R2.5352 Oc1cc(c(cc1F)Sc2ccccc2)F 62a_100000719477_100011830439 [0,1,0,0,1,0|2,0,0]=4 3072 B17R2.5352 Oc1cc(c(cc1F)Sc2ccccc2)F 62a_100011830439_100000041952 [0,1,0,0,1,0|2,0,0]=4 3073 B17R2.5355 Cc1c(ccc(c1C)Sc2ccccc2)O 62a_100000719477_100012353674 [0,1,0,0,1,0|2,0,0]=4 3074 B17R2.5355 Cc1c(ccc(c1C)Sc2ccccc2)O 62a_100012353674_100000041952 [0,1,0,0,1,0|2,0,0]=4 3075 B17R2.5355 Cc1c(ccc(c1F)Sc2ccccc2)O 62a_100000719477_100010390934 [0,1,0,0,1,0|2,0,0]=4 3076 B17R2.5355 Cc1c(ccc(c1F)Sc2ccccc2)O 62a_100010390934_100000041952 [0,1,0,0,1,0|2,0,0]=4 3077 B17R2.5355 Cc1c(ccc(c1N)O)Sc2ccccc2 62a_100000719477_100013039247 [0,1,0,0,1,0|2,0,0]=4 3078 B17R2.5355 Cc1c(ccc(c1N)O)Sc2ccccc2 62a_100013039247_100000041952 [0,1,0,0,1,0|2,0,0]=4 3079 B17R2.5355 Oc1ccc(c(c1F)F)Sc2ccccc2 62a_100000719477_100011830415 [0,1,0,0,1,0|2,0,0]=4 3080 B17R2.5355 Oc1ccc(c(c1F)F)Sc2ccccc2 62a_100011830415_100000041952 [0,1,0,0,1,0|2,0,0]=4 3081 B17R2.36760 Cc1cc(cc(c1O)Br)Sc2ccccc2 62a_100000719477_100010982682 [0,1,0,0,1,0|2,0,0]=4 3082 B17R2.36760 Cc1cc(cc(c1O)Br)Sc2ccccc2 62a_100010982682_100000041952 [0,1,0,0,1,0|2,0,0]=4 3083 B17R2.36760 Cc1cc(cc(c1O)C)Sc2ccccc2 62a_100000719477_100011216129 [0,1,0,0,1,0|2,0,0]=4 3084 B17R2.36760 Cc1cc(cc(c1O)C)Sc2ccccc2 62a_100011216129_100000041952 [0,1,0,0,1,0|2,0,0]=4 3085 B17R2.36760 Cc1cc(cc(c1O)Cl)Sc2ccccc2 62a_100000719477_200015900153 [0,1,0,0,1,0|2,0,0]=4 3086 B17R2.36760 Cc1cc(cc(c1O)Cl)Sc2ccccc2 62a_200015900153_100000041952 [0,1,0,0,1,0|2,0,0]=4 3087 B17R2.36760 Cc1cc(cc(c1O)N)Sc2ccccc2 62a_100000719477_100011825904 [0,1,0,0,1,0|2,0,0]=4 3088 B17R2.36760 Cc1cc(cc(c1O)N)Sc2ccccc2 62a_100011825904_100000041952 [0,1,0,0,1,0|2,0,0]=4 3089 B17R2.36760 Nc1cc(cc(c1O)F)Sc2ccccc2 62a_100000719477_100011217383 [0,1,0,0,1,0|2,0,0]=4 3090 B17R2.36760 Nc1cc(cc(c1O)F)Sc2ccccc2 62a_100011217383_100000041952 [0,1,0,0,1,0|2,0,0]=4 3091 B17R2.36760 Oc1c(cc(cc1Cl)Sc2ccccc2)Cl 62a_100000719477_100012339652 [0,1,0,0,1,0|2,0,0]=4 3092 B17R2.36760 Oc1c(cc(cc1Cl)Sc2ccccc2)Cl 62a_100012339652_100000041952 [0,1,0,0,1,0|2,0,0]=4 3093 B17R2.36760 Oc1c(cc(cc1F)Sc2ccccc2)F 62a_100000719477_100011216917 [0,1,0,0,1,0|2,0,0]=4 3094 B17R2.36760 Oc1c(cc(cc1F)Sc2ccccc2)F 62a_100011216917_100000041952 [0,1,0,0,1,0|2,0,0]=4 3095 B17R2.36760 Oc1cc(cc(c1O)F)Sc2ccccc2 62a_100000719477_100010114375 [0,1,0,0,1,0|1,0,1]=4 3096 B17R2.36760 Oc1cc(cc(c1O)O)Sc2ccccc2 62a_100000719477_100010658518 [0,1,0,0,1,0|1,0,1]=4 3097 B17R2.41860 Cc1cc(ccc1O)Sc2cccc(c2)Br 62a_100000691529_100000186361 [0,1,0,0,1,0|2,0,0]=4 3098 B17R2.41860 Cc1cc(ccc1O)Sc2cccc(c2)Cl 62a_100000699651_100000186361 [0,1,0,0,1,0|2,0,0]=4 3099 B17R2.41860 Cc1cc(ccc1O)Sc2cccc(c2)F 62a_100000685547_100000186361 [0,1,0,0,1,0|2,0,0]=4 3100 B17R2.41860 Cc1cc(ccc1O)Sc2cccc(c2)N 62a_100000210019_100000186361 [0,1,0,0,1,0|2,0,0]=4 3101 B17R2.41860 Cc1cc(ccc1O)Sc2cccc(c2)[S] 62a_114929384022_100000186361 [0,1,0,0,1,0|2,0,0]=4 3102 B17R2.41860 Cc1cc(ncc1O)Sc2cccc(c2)Br 62a_100000691529_100000692680 [0,1,0,0,1,0|2,0,0]=4 3103 B17R2.41860 Cc1cc(ncc1O)Sc2cccc(c2)Cl 62a_100000699651_100000692680 [0,1,0,0,1,0|2,0,0]=4 3104 B17R2.41860 Cc1cc(ncc1O)Sc2cccc(c2)F 62a_100000685547_100000692680 [0,1,0,0,1,0|2,0,0]=4 3105 B17R2.41860 Cc1cc(ncc1O)Sc2cccc(c2)N 62a_100000210019_100000692680 [0,1,0,0,1,0|2,0,0]=4 3106 B17R2.41860 Cc1cc(ncc1O)Sc2cccc(c2)[S] 62a_114929384022_100000692680 [0,1,0,0,1,0|2,0,0]=4 3107 B17R2.41860 Cc1cccc(c1)Sc2cc(c(cn2)O)C 62a_100011215228_100000692680 [0,1,0,0,1,0|2,0,0]=4 3108 B17R2.41860 Cc1cccc(c1)Sc2cc(c(cn2)O)N 62a_100009819941_100011215228 [0,1,0,0,1,0|2,0,0]=4 3109 B17R2.41860 Cc1cccc(c1)Sc2cc(c(cn2)O)N 62a_100011215228_100009819941 [0,1,0,0,1,0|2,0,0]=4 3110 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)Br)O 62a_100011215228_100012361655 [0,1,0,0,1,0|2,0,0]=4 3111 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)Br)O 62a_100012361655_100011215228 [0,1,0,0,1,0|2,0,0]=4 3112 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)C)O 62a_100011215228_100000186361 [0,1,0,0,1,0|2,0,0]=4 3113 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)Cl)O 62a_100011215228_100012360047 [0,1,0,0,1,0|2,0,0]=4 3114 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100011215228 [0,1,0,0,1,0|2,0,0]=4 3115 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)F)O 62a_100000185481_100011215228 [0,1,0,0,1,0|2,0,0]=4 3116 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)F)O 62a_100011215228_100000185481 [0,1,0,0,1,0|2,0,0]=4 3117 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)N)O 62a_100000752626_100011215228 [0,1,0,0,1,0|2,0,0]=4 3118 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)N)O 62a_100011215228_100000752626 [0,1,0,0,1,0|2,0,0]=4 3119 B17R2.41860 Cc1cccc(c1)Sc2ccc(c(c2)O)O 62a_100011215228_100009813601 [0,1,0,0,1,0|1,0,1]=4 3120 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)Br 62a_100000691529_100000752626 [0,1,0,0,1,0|2,0,0]=4 3121 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)Br 62a_100000752626_100000691529 [0,1,0,0,1,0|2,0,0]=4 3122 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)Cl 62a_100000699651_100000752626 [0,1,0,0,1,0|2,0,0]=4 3123 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)Cl 62a_100000752626_100000699651 [0,1,0,0,1,0|2,0,0]=4 3124 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)F 62a_100000685547_100000752626 [0,1,0,0,1,0|2,0,0]=4 3125 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)F 62a_100000752626_100000685547 [0,1,0,0,1,0|2,0,0]=4 3126 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)O 62a_100000752626_100000211634 [0,1,0,0,1,0|2,0,0]=4 3127 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)[S] 62a_100000752626_114929384022 [0,1,0,0,1,0|2,0,0]=4 3128 B17R2.41860 Nc1cc(ccc1O)Sc2cccc(c2)[S] 62a_114929384022_100000752626 [0,1,0,0,1,0|2,0,0]=4 3129 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)Br 62a_100000691529_100009819941 [0,1,0,0,1,0|2,0,0]=4 3130 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)Br 62a_100009819941_100000691529 [0,1,0,0,1,0|2,0,0]=4 3131 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)Cl 62a_100000699651_100009819941 [0,1,0,0,1,0|2,0,0]=4 3132 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)Cl 62a_100009819941_100000699651 [0,1,0,0,1,0|2,0,0]=4 3133 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)F 62a_100000685547_100009819941 [0,1,0,0,1,0|2,0,0]=4 3134 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)F 62a_100009819941_100000685547 [0,1,0,0,1,0|2,0,0]=4 3135 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)O 62a_100009819941_100000211634 [0,1,0,0,1,0|2,0,0]=4 3136 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)[S] 62a_100009819941_114929384022 [0,1,0,0,1,0|2,0,0]=4 3137 B17R2.41860 Nc1cc(ncc1O)Sc2cccc(c2)[S] 62a_114929384022_100009819941 [0,1,0,0,1,0|2,0,0]=4 3138 B17R2.41860 Nc1cccc(c1)Sc2cc(c(cn2)O)N 62a_100000210019_100009819941 [0,1,0,0,1,0|2,0,0]=4 3139 B17R2.41860 Nc1cccc(c1)Sc2cc(c(cn2)O)N 62a_100009819941_100000210019 [0,1,0,0,1,0|2,0,0]=4 3140 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)Br)O 62a_100000210019_100012361655 [0,1,0,0,1,0|2,0,0]=4 3141 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)Br)O 62a_100012361655_100000210019 [0,1,0,0,1,0|2,0,0]=4 3142 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)Cl)O 62a_100000210019_100012360047 [0,1,0,0,1,0|2,0,0]=4 3143 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100000210019 [0,1,0,0,1,0|2,0,0]=4 3144 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)F)O 62a_100000185481_100000210019 [0,1,0,0,1,0|2,0,0]=4 3145 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)F)O 62a_100000210019_100000185481 [0,1,0,0,1,0|2,0,0]=4 3146 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)N)O 62a_100000210019_100000752626 [0,1,0,0,1,0|2,0,0]=4 3147 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)N)O 62a_100000752626_100000210019 [0,1,0,0,1,0|2,0,0]=4 3148 B17R2.41860 Nc1cccc(c1)Sc2ccc(c(c2)O)O 62a_100000210019_100009813601 [0,1,0,0,1,0|1,0,1]=4 3149 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)Br 62a_100000691529_100012361655 [0,1,0,0,1,0|2,0,0]=4 3150 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)Br 62a_100012361655_100000691529 [0,1,0,0,1,0|2,0,0]=4 3151 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)Cl 62a_100000699651_100012361655 [0,1,0,0,1,0|2,0,0]=4 3152 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)Cl 62a_100012361655_100000699651 [0,1,0,0,1,0|2,0,0]=4 3153 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)F 62a_100000685547_100012361655 [0,1,0,0,1,0|2,0,0]=4 3154 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)F 62a_100012361655_100000685547 [0,1,0,0,1,0|2,0,0]=4 3155 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)[S] 62a_100012361655_114929384022 [0,1,0,0,1,0|2,0,0]=4 3156 B17R2.41860 Oc1ccc(cc1Br)Sc2cccc(c2)[S] 62a_114929384022_100012361655 [0,1,0,0,1,0|2,0,0]=4 3157 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)Br 62a_100000691529_100012360047 [0,1,0,0,1,0|2,0,0]=4 3158 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)Br 62a_100012360047_100000691529 [0,1,0,0,1,0|2,0,0]=4 3159 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)Cl 62a_100000699651_100012360047 [0,1,0,0,1,0|2,0,0]=4 3160 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)Cl 62a_100012360047_100000699651 [0,1,0,0,1,0|2,0,0]=4 3161 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)F 62a_100000685547_100012360047 [0,1,0,0,1,0|2,0,0]=4 3162 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)F 62a_100012360047_100000685547 [0,1,0,0,1,0|2,0,0]=4 3163 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)[S] 62a_100012360047_114929384022 [0,1,0,0,1,0|2,0,0]=4 3164 B17R2.41860 Oc1ccc(cc1Cl)Sc2cccc(c2)[S] 62a_114929384022_100012360047 [0,1,0,0,1,0|2,0,0]=4 3165 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)Br 62a_100000185481_100000691529 [0,1,0,0,1,0|2,0,0]=4 3166 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)Br 62a_100000691529_100000185481 [0,1,0,0,1,0|2,0,0]=4 3167 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)Cl 62a_100000185481_100000699651 [0,1,0,0,1,0|2,0,0]=4 3168 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)Cl 62a_100000699651_100000185481 [0,1,0,0,1,0|2,0,0]=4 3169 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)F 62a_100000185481_100000685547 [0,1,0,0,1,0|2,0,0]=4 3170 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)F 62a_100000685547_100000185481 [0,1,0,0,1,0|2,0,0]=4 3171 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)[S] 62a_100000185481_114929384022 [0,1,0,0,1,0|2,0,0]=4 3172 B17R2.41860 Oc1ccc(cc1F)Sc2cccc(c2)[S] 62a_114929384022_100000185481 [0,1,0,0,1,0|2,0,0]=4 3173 B17R2.41860 Oc1ccc(cc1O)Sc2cccc(c2)Br 62a_100000691529_100009813601 [0,1,0,0,1,0|1,0,1]=4 3174 B17R2.41860 Oc1ccc(cc1O)Sc2cccc(c2)Cl 62a_100000699651_100009813601 [0,1,0,0,1,0|1,0,1]=4 3175 B17R2.41860 Oc1ccc(cc1O)Sc2cccc(c2)F 62a_100000685547_100009813601 [0,1,0,0,1,0|1,0,1]=4 3176 B17R2.41860 Oc1ccc(cc1O)Sc2cccc(c2)[S] 62a_114929384022_100009813601 [0,1,0,0,1,0|1,0,1]=4 3177 B17R2.41860 Oc1cccc(c1)Sc2ccc(c(c2)Br)O 62a_100012361655_100000211634 [0,1,0,0,1,0|2,0,0]=4 3178 B17R2.41860 Oc1cccc(c1)Sc2ccc(c(c2)Cl)O 62a_100012360047_100000211634 [0,1,0,0,1,0|2,0,0]=4 3179 B17R2.41860 Oc1cccc(c1)Sc2ccc(c(c2)F)O 62a_100000185481_100000211634 [0,1,0,0,1,0|2,0,0]=4 3180 B17R2.2502 O=Cc1cc(ccc1O)CSc2ccco2 62a_100009814098_100000008128 [0,1,0,0,1,0|2,0,0]=4 3181 B17R2.2502 O=Cc1cc(ccc1O)CSc2cccs2 62a_100011215356_100000008128 [0,1,0,0,1,0|2,0,0]=4 3182 B17R2.2502 O=Cc1cc(ccc1O)CSc2ccoc2 62a_100011215275_100000008128 [0,1,0,0,1,0|2,0,0]=4 3183 B17R2.2502 O=Cc1cc(ccc1O)CSc2ccsc2 62a_100000738268_100000008128 [0,1,0,0,1,0|2,0,0]=4 3184 B17R2.12247 COc1coc(cc1=O)COc2ccsc2 7a_100000106738_100000081511 [0,1,0,0,1,0|1,1,0]=4 3185 B17R2.12247 COc1coc(cc1=O)CSc2c[nH]cn2 62a_100000756875_100000081511 [0,1,0,0,1,0|2,0,0]=4 3186 B17R2.12247 COc1coc(cc1=O)CSc2cc[nH]n2 62a_100000062575_100000081511 [0,1,0,0,1,0|2,0,0]=4 3187 B17R2.12247 COc1coc(cc1=O)CSc2ccco2 62a_100009814098_100000081511 [0,1,0,0,1,0|1,0,0]=3 3188 B17R2.12247 COc1coc(cc1=O)CSc2cccs2 62a_100011215356_100000081511 [0,1,0,0,1,0|1,0,0]=3 3189 B17R2.12247 COc1coc(cc1=O)CSc2ccoc2 62a_100011215275_100000081511 [0,1,0,0,1,0|1,0,0]=3 3190 B17R2.12247 COc1coc(cc1=O)CSc2ccon2 62a_100009818083_100000081511 [0,1,0,0,1,0|2,0,0]=4 3191 B17R2.12247 COc1coc(cc1=O)CSc2ccsc2 62a_100000738268_100000081511 [0,1,0,0,1,0|1,0,0]=3 3192 B17R2.12247 COc1coc(cc1=O)CSc2ccsn2 62a_100009818082_100000081511 [0,1,0,0,1,0|2,0,0]=4 3193 B17R2.12247 COc1coc(cc1=O)CSc2cn[nH]c2 62a_100000238712_100000081511 [0,1,0,0,1,0|2,0,0]=4 3194 B17R2.12247 COc1coc(cc1=O)CSc2cnco2 62a_100020591547_100000081511 [0,1,0,0,1,0|2,0,0]=4 3195 B17R2.12247 COc1coc(cc1=O)CSc2cncs2 62a_100011934649_100000081511 [0,1,0,0,1,0|2,0,0]=4 3196 B17R2.12247 COc1coc(cc1=O)CSc2cnoc2 62a_100009815712_100000081511 [0,1,0,0,1,0|2,0,0]=4 3197 B17R2.12247 COc1coc(cc1=O)CSc2cnsc2 62a_100009815736_100000081511 [0,1,0,0,1,0|2,0,0]=4 3198 B17R2.12247 COc1coc(cc1=O)CSc2cscn2 62a_100000751502_100000081511 [0,1,0,0,1,0|2,0,0]=4 3199 B17R2.12247 COc1coc(cc1=O)CSc2ncc[nH]2 62a_100025796157_100000081511 [0,1,0,0,1,0|2,0,0]=4 3200 B17R2.12247 COc1coc(cc1=O)CSc2ncco2 62a_100011787736_100000081511 [0,1,0,0,1,0|2,0,0]=4 3201 B17R2.12247 COc1coc(cc1=O)CSc2nccs2 62a_100000211983_100000081511 [0,1,0,0,1,0|2,0,0]=4 3202 B17R2.18661 Cc1c[nH]c(n1)SCc2cc(=O)c(co2)O 62a_100161115468_100000010605 [0,1,0,0,1,0|2,0,0]=4 3203 B17R2.18661 Cc1cc(cs1)SCc2cc(=O)c(co2)O 62a_100000759034_100000010605 [0,1,0,0,1,0|1,0,0]=3 3204 B17R2.18661 Cc1cc(n[nH]1)SCc2cc(=O)c(co2)O 62a_100009819999_100000010605 [0,1,0,0,1,0|2,0,0]=4 3205 B17R2.18661 Cc1cc(no1)SCc2cc(=O)c(co2)O 62a_100000716708_100000010605 [0,1,0,0,1,0|2,0,0]=4 3206 B17R2.18661 Cc1cc(sn1)SCc2cc(=O)c(co2)O 62a_100009815735_100000010605 [0,1,0,0,1,0|2,0,0]=4 3207 B17R2.18661 Cc1ccc(s1)SCc2cc(=O)c(co2)O 62a_100000031368_100000010605 [0,1,0,0,1,0|1,0,0]=3 3208 B17R2.18661 Cc1cnc(s1)SCc2cc(=O)c(co2)O 62a_100000690809_100000010605 [0,1,0,0,1,0|2,0,0]=4 3209 B17R2.18661 Cc1csc(c1)SCc2cc(=O)c(co2)O 62a_100009876951_100000010605 [0,1,0,0,1,0|1,0,0]=3 3210 B17R2.18661 Cc1csc(n1)SCc2cc(=O)c(co2)O 62a_100011291629_100000010605 [0,1,0,0,1,0|2,0,0]=4 3211 B17R2.18661 Cc1nc(c[nH]1)SCc2cc(=O)c(co2)O 62a_100009814057_100000010605 [0,1,0,0,1,0|2,0,0]=4 3212 B17R2.18661 Cc1nc(cs1)SCc2cc(=O)c(co2)O 62a_100011934587_100000010605 [0,1,0,0,1,0|2,0,0]=4 3213 B17R2.18661 Cc1ncc(s1)SCc2cc(=O)c(co2)O 62a_100000764884_100000010605 [0,1,0,0,1,0|2,0,0]=4 3214 B17R2.18661 Cn1cc(cn1)SCc2cc(=O)c(co2)O 62a_100000745744_100000010605 [0,1,0,0,1,0|2,0,0]=4 3215 B17R2.18661 Cn1ccc(n1)SCc2cc(=O)c(co2)O 62a_100000752436_100000010605 [0,1,0,0,1,0|2,0,0]=4 3216 B17R2.18661 Cn1cnc(c1)SCc2cc(=O)c(co2)O 62a_100000040308_100000010605 [0,1,0,0,1,0|2,0,0]=4 3217 B17R2.18661 Nc1cc(n[nH]1)SCc2cc(=O)c(co2)O 62a_100009822546_100000010605 [0,1,0,0,1,0|2,0,0]=4 3218 B17R2.18661 Nc1csc(n1)SCc2cc(=O)c(co2)O 62a_200015188442_100000010605 [0,1,0,0,1,0|2,0,0]=4 3219 B17R2.18661 Nc1nc(cs1)SCc2cc(=O)c(co2)O 62a_100011998049_100000010605 [0,1,0,0,1,0|2,0,0]=4 3220 B17R2.18661 Nc1ncc(s1)SCc2cc(=O)c(co2)O 62a_100000718969_100000010605 [0,1,0,0,1,0|2,0,0]=4 3221 B17R2.18661 O=c1cc(occ1O)CSc2cc(n[nH]2)Br 62a_100160470719_100000010605 [0,1,0,0,1,0|2,0,0]=4 3222 B17R2.18661 O=c1cc(occ1O)CSc2ccc(s2)Br 62a_100010197418_100000010605 [0,1,0,0,1,0|1,0,0]=3 3223 B17R2.18661 O=c1cc(occ1O)CSc2cnc(s2)Br 62a_100012357534_100000010605 [0,1,0,0,1,0|2,0,0]=4 3224 B17R2.18661 O=c1cc(occ1O)CSc2nc(cs2)Br 62a_200016082925_100000010605 [0,1,0,0,1,0|2,0,0]=4 3225 B17R2.23923 Cc1[nH]cnc1SCc2cc(=O)c(co2)O 62a_100010186451_100000010605 [0,1,0,0,1,0|2,0,0]=4 3226 B17R2.23923 Cc1c[nH]nc1SCc2cc(=O)c(co2)O 62a_100009871783_100000010605 [0,1,0,0,1,0|2,0,0]=4 3227 B17R2.23923 Cc1ccsc1SCc2cc(=O)c(co2)O 62a_100010247149_100000010605 [0,1,0,0,1,0|1,0,0]=3 3228 B17R2.23923 Cc1cscc1SCc2cc(=O)c(co2)O 62a_100000759966_100000010605 [0,1,0,0,1,0|1,0,0]=3 3229 B17R2.23923 Cc1n[nH]cc1SCc2cc(=O)c(co2)O 62a_100000692133_100000010605 [0,1,0,0,1,0|2,0,0]=4 3230 B17R2.23923 Cc1ncsc1SCc2cc(=O)c(co2)O 62a_100009817116_100000010605 [0,1,0,0,1,0|2,0,0]=4 3231 B17R2.23923 Cc1oncc1SCc2cc(=O)c(co2)O 62a_100009872056_100000010605 [0,1,0,0,1,0|2,0,0]=4 3232 B17R2.23923 Cc1sccc1SCc2cc(=O)c(co2)O 62a_100000684487_100000010605 [0,1,0,0,1,0|1,0,0]=3 3233 B17R2.23923 Cc1scnc1SCc2cc(=O)c(co2)O 62a_100000732656_100000010605 [0,1,0,0,1,0|2,0,0]=4 3234 B17R2.23923 Cn1ccnc1SCc2cc(=O)c(co2)O 62a_100000707724_100000010605 [0,1,0,0,1,0|2,0,0]=4 3235 B17R2.23923 Cn1cncc1SCc2cc(=O)c(co2)O 62a_100009814087_100000010605 [0,1,0,0,1,0|2,0,0]=4 3236 B17R2.23923 Cn1nccc1SCc2cc(=O)c(co2)O 62a_100000688441_100000010605 [0,1,0,0,1,0|2,0,0]=4 3237 B17R2.23923 Nc1c[nH]nc1SCc2cc(=O)c(co2)O 62a_100010894806_100000010605 [0,1,0,0,1,0|2,0,0]=4 3238 B17R2.23923 Nc1n[nH]cc1SCc2cc(=O)c(co2)O 62a_100000717100_100000010605 [0,1,0,0,1,0|2,0,0]=4 3239 B17R2.23923 Nc1nocc1SCc2cc(=O)c(co2)O 62a_100012597345_100000010605 [0,1,0,0,1,0|2,0,0]=4 3240 B17R2.23923 O=c1cc(occ1O)CSc2[nH]cnc2Cl 62a_100010200774_100000010605 [0,1,0,0,1,0|2,0,0]=4 3241 B17R2.23923 O=c1cc(occ1O)CSc2c[nH]nc2Br 62a_100011012988_100000010605 [0,1,0,0,1,0|2,0,0]=4 3242 B17R2.23923 O=c1cc(occ1O)CSc2c[nH]nc2F 62a_100015597042_100000010605 [0,1,0,0,1,0|2,0,0]=4 3243 B17R2.23923 O=c1cc(occ1O)CSc2cscc2Br 62a_100010143727_100000010605 [0,1,0,0,1,0|1,0,0]=3 3244 B17R2.23923 O=c1cc(occ1O)CSc2n[nH]cc2Br 62a_100015839836_100000010605 [0,1,0,0,1,0|2,0,0]=4 3245 B17R2.23923 O=c1cc(occ1O)CSc2sccc2Br 62a_100012361411_100000010605 [0,1,0,0,1,0|1,0,0]=3 3246 B19R2.281 CN(Cc1ccccc1)Cc2cc(=O)c(co2)O 2230a_100000186898_100000010605 [0,1,0,0,0,1|1,0,0]=3 3247 B19R2.281 CN(Cc1ccccc1)Cc2cc(=O)c(co2)O 269982a_100000186898_100000010605 [0,1,0,0,0,1|1,0,0]=3 3248 B19R2.281 CN(Cc1ccccn1)Cc2cc(=O)c(co2)O 2230a_100000207498_100000010605 [0,1,0,0,0,1|2,0,0]=4 3249 B19R2.281 CN(Cc1ccccn1)Cc2cc(=O)c(co2)O 269982a_100000207498_100000010605 [0,1,0,0,0,1|2,0,0]=4 3250 B19R2.281 CN(Cc1cccnc1)Cc2cc(=O)c(co2)O 2230a_100000184577_100000010605 [0,1,0,0,0,1|2,0,0]=4 3251 B19R2.281 CN(Cc1cccnc1)Cc2cc(=O)c(co2)O 269982a_100000184577_100000010605 [0,1,0,0,0,1|2,0,0]=4 3252 B19R2.281 CN(Cc1ccncc1)Cc2cc(=O)c(co2)O 2230a_100000187231_100000010605 [0,1,0,0,0,1|2,0,0]=4 3253 B19R2.281 CN(Cc1ccncc1)Cc2cc(=O)c(co2)O 269982a_100000187231_100000010605 [0,1,0,0,0,1|2,0,0]=4 3254 B19R2.281 O=C(Cc1cc(=O)c(co1)O)C[n+]2ccccc2 1458a_200000086051_100000010605 [0,1,0,0,0,1|2,0,0]=4 3255 B19R2.281 O=C(Cc1ccccn1)Cc2cc(=O)c(co2)O 1458a_100000233486_100000010605 [0,1,0,0,0,1|2,0,0]=4 3256 B19R2.281 O=C(Cc1cccnc1)Cc2cc(=O)c(co2)O 1458a_100000737805_100000010605 [0,1,0,0,0,1|2,0,0]=4 3257 B19R2.2863 CCc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100012338938 [0,1,0,0,0,1|2,0,0]=4 3258 B19R2.2863 COc1cc(ccc1O)CCSc2ccccc2 62a_100000719477_100010741665 [0,1,0,0,0,1|1,0,1]=4 3259 B19R2.2863 COc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000694246 [0,1,0,0,0,1|1,0,1]=4 3260 B19R2.2863 Cc1ccc(cc1C=O)SCSc2ccccc2 62a_100011218342_100011361606 [0,1,0,0,0,1|2,0,0]=4 3261 B19R2.2863 Cc1ccc(cc1C=O)SCSc2ccccc2 62a_100011361606_100011218342 [0,1,0,0,0,1|2,0,0]=4 3262 B19R2.2863 N#Cc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000687585 [0,1,0,0,0,1|2,0,0]=4 3263 B19R2.2863 NCc1cc(ccc1O)SCSc2ccccc2 62a_100000730032_100011218342 [0,1,0,0,0,1|2,0,0]=4 3264 B19R2.2863 NCc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000730032 [0,1,0,0,0,1|2,0,0]=4 3265 B19R2.2863 Nc1ccc(cc1C=O)SCSc2ccccc2 62a_100011935258_100011218342 [0,1,0,0,0,1|2,0,0]=4 3266 B19R2.2863 O=Cc1cc(ccc1Br)SCSc2ccccc2 62a_100010185652_100011218342 [0,1,0,0,0,1|2,0,0]=4 3267 B19R2.2863 O=Cc1cc(ccc1Br)SCSc2ccccc2 62a_100011218342_100010185652 [0,1,0,0,0,1|2,0,0]=4 3268 B19R2.2863 O=Cc1cc(ccc1Cl)SCSc2ccccc2 62a_100010254384_100011218342 [0,1,0,0,0,1|2,0,0]=4 3269 B19R2.2863 O=Cc1cc(ccc1Cl)SCSc2ccccc2 62a_100011218342_100010254384 [0,1,0,0,0,1|2,0,0]=4 3270 B19R2.2863 O=Cc1cc(ccc1F)SCSc2ccccc2 62a_100000050626_100011218342 [0,1,0,0,0,1|2,0,0]=4 3271 B19R2.2863 O=Cc1cc(ccc1F)SCSc2ccccc2 62a_100011218342_100000050626 [0,1,0,0,0,1|2,0,0]=4 3272 B19R2.2863 O=Cc1cc(ccc1O)COCc2ccccc2 7a_100000210790_100000008128 [0,1,0,0,0,1|1,1,0]=4 3273 B19R2.2863 O=Cc1cc(ccc1O)CSCc2ccccc2 62a_100000211182_100000008128 [0,1,0,0,0,1|1,0,0]=3 3274 B19R2.2863 O=Cc1cc(ccc1O)CSCc2ccccn2 62a_100000721315_100000008128 [0,1,0,0,0,1|2,0,0]=4 3275 B19R2.2863 O=Cc1cc(ccc1O)CSCc2cccnc2 62a_100000741622_100000008128 [0,1,0,0,0,1|2,0,0]=4 3276 B19R2.2863 O=Cc1cc(ccc1O)CSCc2ccncc2 62a_100015193705_100000008128 [0,1,0,0,0,1|2,0,0]=4 3277 B19R2.2863 O=Cc1cc(ccc1O)SCCc2ccccc2 62a_100000765856_100000186750 [0,1,0,0,0,1|2,0,0]=4 3278 B19R2.2863 O=Cc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000186750 [0,1,0,0,0,1|1,0,0]=3 3279 B19R2.2863 O=Cc1cc(cnc1O)SCSc2ccccc2 62a_100010064889_100011218342 [0,1,0,0,0,1|2,0,0]=4 3280 B19R2.2863 O=Cc1cc(cnc1O)SCSc2ccccc2 62a_100011218342_100010064889 [0,1,0,0,0,1|2,0,0]=4 3281 B19R2.2863 O=Cc1cc(ncc1Br)SCSc2ccccc2 62a_100011218342_200135154921 [0,1,0,0,0,1|2,0,0]=4 3282 B19R2.2863 O=Cc1cc(ncc1Br)SCSc2ccccc2 62a_200135154921_100011218342 [0,1,0,0,0,1|2,0,0]=4 3283 B19R2.2863 O=Cc1cc(ncc1F)SCSc2ccccc2 62a_100000707870_100011218342 [0,1,0,0,0,1|2,0,0]=4 3284 B19R2.2863 O=Cc1cc(ncc1F)SCSc2ccccc2 62a_100011218342_100000707870 [0,1,0,0,0,1|2,0,0]=4 3285 B19R2.2863 O=Cc1cc(ncc1O)SCCc2ccccc2 62a_100000765856_100000048449 [0,1,0,0,0,1|2,0,0]=4 3286 B19R2.2863 O=Cc1cc(ncc1O)SCSc2ccccc2 62a_100011218342_100000048449 [0,1,0,0,0,1|1,0,0]=3 3287 B19R2.2863 OCc1cc(ccc1O)SCSc2ccccc2 62a_100000184703_100011218342 [0,1,0,0,0,1|1,0,1]=4 3288 B19R2.2863 OCc1cc(ccc1O)SCSc2ccccc2 62a_100011218342_100000184703 [0,1,0,0,0,1|1,0,1]=4 3289 B19R2.7722 Cc1cc(c(cc1O)C)SCSc2ccccc2 62a_100000698207_100011218342 [0,1,0,0,0,1|2,0,0]=4 3290 B19R2.7722 Cc1cc(c(cc1O)C)SCSc2ccccc2 62a_100011218342_100000698207 [0,1,0,0,0,1|2,0,0]=4 3291 B19R2.7722 Cc1cc(c(cc1SCSc2ccccc2)F)O 62a_100011218342_100012355673 [0,1,0,0,0,1|2,0,0]=4 3292 B19R2.7722 Cc1cc(c(cc1SCSc2ccccc2)F)O 62a_100012355673_100011218342 [0,1,0,0,0,1|2,0,0]=4 3293 B19R2.7722 Cc1cc(c(cc1SCSc2ccccc2)N)O 62a_100011218342_200010235796 [0,1,0,0,0,1|2,0,0]=4 3294 B19R2.7722 Cc1cc(c(cc1SCSc2ccccc2)N)O 62a_200010235796_100011218342 [0,1,0,0,0,1|2,0,0]=4 3295 B19R2.7722 Nc1cc(c(cc1O)Cl)SCSc2ccccc2 62a_100011011175_100011218342 [0,1,0,0,0,1|2,0,0]=4 3296 B19R2.7722 Nc1cc(c(cc1O)Cl)SCSc2ccccc2 62a_100011218342_100011011175 [0,1,0,0,0,1|2,0,0]=4 3297 B19R2.7722 Nc1cc(c(cc1O)F)SCSc2ccccc2 62a_100011218342_100012359894 [0,1,0,0,0,1|2,0,0]=4 3298 B19R2.7722 Nc1cc(c(cc1O)F)SCSc2ccccc2 62a_100012359894_100011218342 [0,1,0,0,0,1|2,0,0]=4 3299 B19R2.7722 Oc1cc(c(cc1F)SCSc2ccccc2)F 62a_100011218342_100011830439 [0,1,0,0,0,1|2,0,0]=4 3300 B19R2.7722 Oc1cc(c(cc1F)SCSc2ccccc2)F 62a_100011830439_100011218342 [0,1,0,0,0,1|2,0,0]=4 3301 B19R2.11833 O=C(CSc1ccccc1)c2ccc(c(c2)Cl)O 62a_100000719477_200010170092 [0,1,0,0,0,1|2,0,0]=4 3302 B19R2.11833 O=C(CSc1ccccc1)c2ccc(c(c2)Cl)O 62a_200010170092_100000041952 [0,1,0,0,0,1|2,0,0]=4 3303 B19R2.11833 O=C(CSc1ccccc1)c2ccc(c(c2)O)O 62a_100000719477_100000183813 [0,1,0,0,0,1|1,0,1]=4 3304 B19R2.11834 CC(NCc1cc(=O)c(co1)O)c2ccccn2 2230a_100000181244_100000010605 [0,1,0,0,0,1|2,0,0]=4 3305 B19R2.11834 CC(NCc1cc(=O)c(co1)O)c2cccnc2 2230a_100000195435_100000010605 [0,1,0,0,0,1|2,0,0]=4 3306 B19R2.11834 CC(NCc1cc(=O)c(co1)O)c2ccncc2 2230a_100000181269_100000010605 [0,1,0,0,0,1|2,0,0]=4 3307 B19R2.11834 CC(SCc1cc(=O)c(co1)O)c2ccccc2 62a_100000230085_100000010605 [0,1,0,0,0,1|0,0,0]=2 3308 B19R2.11834 CC(SCc1cc(=O)c(co1)O)c2cnccn2 62a_200000703233_100000010605 [0,1,0,0,0,1|2,0,0]=4 3309 B19R2.11834 C[C@@H](NCc1cc(=O)c(co1)O)c2ccccc2 2230a_100000751104_100000010605 [0,1,0,0,0,1|1,0,0]=3 3310 B19R2.11834 C[C@@H](OCc1cc(=O)c(co1)O)c2ccccc2 7a_100000761318_100000010605 [0,1,0,0,0,1|0,1,0]=3 3311 B19R2.12305 Cc1ccc(cc1)CNCc2cc(=O)c(co2)O 2230a_100000174908_100000010605 [0,1,0,0,0,1|1,0,0]=3 3312 B19R2.12305 Cc1ccc(cc1)COCc2cc(=O)c(co2)O 7a_100011215236_100000010605 [0,1,0,0,0,1|0,1,0]=3 3313 B19R2.12305 Cc1ccc(cc1)CSCc2cc(=O)c(co2)O 62a_100000210814_100000010605 [0,1,0,0,0,1|0,0,0]=2 3314 B19R2.12305 Cc1ccc(cc1)SCCc2ccc(c(c2)O)O 62a_100000186775_200010393615 [0,1,0,0,0,1|1,0,1]=4 3315 B19R2.12305 Cc1ccc(cn1)CSCc2cc(=O)c(co2)O 62a_100016987292_100000010605 [0,1,0,0,0,1|1,0,0]=3 3316 B19R2.12305 Cc1ccc(nc1)CSCc2cc(=O)c(co2)O 62a_100000691093_100000010605 [0,1,0,0,0,1|1,0,0]=3 3317 B19R2.12305 Cc1cnc(cn1)CSCc2cc(=O)c(co2)O 62a_100000752025_100000010605 [0,1,0,0,0,1|2,0,0]=4 3318 B19R2.12305 Cc1cnc(nc1)CSCc2cc(=O)c(co2)O 62a_100000685645_100000010605 [0,1,0,0,0,1|2,0,0]=4 3319 B19R2.12305 Nc1ccc(cc1)SCCc2ccc(c(c2)O)O 62a_100000185761_200010393615 [0,1,0,0,0,1|1,0,1]=4 3320 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(cc2)Br 2230a_100000174875_100000010605 [0,1,0,0,0,1|1,0,0]=3 3321 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(cc2)Cl 2230a_100000174871_100000010605 [0,1,0,0,0,1|1,0,0]=3 3322 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(cc2)F 2230a_100000174882_100000010605 [0,1,0,0,0,1|1,0,0]=3 3323 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(cc2)I 2230a_100016989417_100000010605 [0,1,0,0,0,1|1,0,0]=3 3324 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(nc2)Br 2230a_100009817727_100000010605 [0,1,0,0,0,1|2,0,0]=4 3325 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(nc2)Cl 2230a_100000735879_100000010605 [0,1,0,0,0,1|2,0,0]=4 3326 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(nc2)F 2230a_100000101913_100000010605 [0,1,0,0,0,1|2,0,0]=4 3327 B19R2.12305 O=c1cc(occ1O)CNCc2ccc(nc2)O 2230a_100000757128_100000010605 [0,1,0,0,0,1|2,0,0]=4 3328 B19R2.12305 O=c1cc(occ1O)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000010605 [0,1,0,0,0,1|1,1,0]=4 3329 B19R2.12305 O=c1cc(occ1O)COCc2ccc(cc2)Cl 7a_100000211118_100000010605 [0,1,0,0,0,1|0,1,0]=3 3330 B19R2.12305 O=c1cc(occ1O)COCc2ccc(cc2)F 7a_100000210977_100000010605 [0,1,0,0,0,1|0,1,0]=3 3331 B19R2.12305 O=c1cc(occ1O)COCc2ccc(cc2)I 7a_100000690907_100000010605 [0,1,0,0,0,1|0,1,0]=3 3332 B19R2.12305 O=c1cc(occ1O)COCc2ccc(nc2)Br 7a_100009816760_100000010605 [0,1,0,0,0,1|1,1,0]=4 3333 B19R2.12305 O=c1cc(occ1O)COCc2ccc(nc2)Cl 7a_100000755211_100000010605 [0,1,0,0,0,1|1,1,0]=4 3334 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cc2)Br 62a_100000189115_100000010605 [0,1,0,0,0,1|0,0,0]=2 3335 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cc2)Cl 62a_100000187161_100000010605 [0,1,0,0,0,1|0,0,0]=2 3336 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cc2)F 62a_100000198546_100000010605 [0,1,0,0,0,1|0,0,0]=2 3337 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cc2)I 62a_100000189116_100000010605 [0,1,0,0,0,1|0,0,0]=2 3338 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cn2)Br 62a_100000702658_100000010605 [0,1,0,0,0,1|1,0,0]=3 3339 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cn2)Cl 62a_100012066911_100000010605 [0,1,0,0,0,1|1,0,0]=3 3340 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(cn2)F 62a_100000703193_100000010605 [0,1,0,0,0,1|1,0,0]=3 3341 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(nc2)Br 62a_100009831999_100000010605 [0,1,0,0,0,1|1,0,0]=3 3342 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(nc2)Cl 62a_100000735431_100000010605 [0,1,0,0,0,1|1,0,0]=3 3343 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(nc2)F 62a_100009820150_100000010605 [0,1,0,0,0,1|1,0,0]=3 3344 B19R2.12305 O=c1cc(occ1O)CSCc2ccc(nn2)Cl 62a_100016992710_100000010605 [0,1,0,0,0,1|2,0,0]=4 3345 B19R2.12305 O=c1cc(occ1O)CSCc2ncc(cn2)Br 62a_100010064664_100000010605 [0,1,0,0,0,1|2,0,0]=4 3346 B19R2.12305 Oc1ccc(cc1O)CCSc2ccc(cc2)Br 62a_100000752885_200010393615 [0,1,0,0,0,1|1,0,1]=4 3347 B19R2.12305 Oc1ccc(cc1O)CCSc2ccc(cc2)Cl 62a_100000755918_200010393615 [0,1,0,0,0,1|1,0,1]=4 3348 B19R2.12305 Oc1ccc(cc1O)CCSc2ccc(cc2)F 62a_100000211213_200010393615 [0,1,0,0,0,1|1,0,1]=4 3349 B19R2.28208 COc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_200011397701 [0,1,0,0,0,1|2,0,0]=4 3350 B19R2.28208 COc1ccc(cc1Br)CSCc2ccccc2 62a_200011397701_100015291786 [0,1,0,0,0,1|2,0,0]=4 3351 B19R2.28208 COc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100011249507 [0,1,0,0,0,1|2,0,0]=4 3352 B19R2.28208 COc1ccc(cc1Br)SCSc2ccccc2 62a_100011249507_100011218342 [0,1,0,0,0,1|2,0,0]=4 3353 B19R2.28208 COc1ccc(cc1C)CSCc2ccccc2 62a_100000211182_200011290836 [0,1,0,0,0,1|2,0,0]=4 3354 B19R2.28208 COc1ccc(cc1C)CSCc2ccccc2 62a_200011290836_100015291786 [0,1,0,0,0,1|2,0,0]=4 3355 B19R2.28208 COc1ccc(cc1C)NCSc2ccccc2 2230a_100000743268_100011218342 [0,1,0,0,0,1|2,0,0]=4 3356 B19R2.28208 COc1ccc(cc1C)SCSc2ccccc2 62a_100011218342_100011219705 [0,1,0,0,0,1|2,0,0]=4 3357 B19R2.28208 COc1ccc(cc1C)SCSc2ccccc2 62a_100011219705_100011218342 [0,1,0,0,0,1|2,0,0]=4 3358 B19R2.28208 COc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100000693707 [0,1,0,0,0,1|2,0,0]=4 3359 B19R2.28208 COc1ccc(cc1Cl)CSCc2ccccc2 62a_100000693707_100015291786 [0,1,0,0,0,1|2,0,0]=4 3360 B19R2.28208 COc1ccc(cc1Cl)NCSc2ccccc2 2230a_100000211044_100011218342 [0,1,0,0,0,1|2,0,0]=4 3361 B19R2.28208 COc1ccc(cc1Cl)SCSc2ccccc2 62a_100011218342_100012355395 [0,1,0,0,0,1|2,0,0]=4 3362 B19R2.28208 COc1ccc(cc1Cl)SCSc2ccccc2 62a_100012355395_100011218342 [0,1,0,0,0,1|2,0,0]=4 3363 B19R2.28208 COc1ccc(cc1F)CSCc2ccccc2 62a_100000189595_100015291786 [0,1,0,0,0,1|2,0,0]=4 3364 B19R2.28208 COc1ccc(cc1F)CSCc2ccccc2 62a_100000211182_100000189595 [0,1,0,0,0,1|2,0,0]=4 3365 B19R2.28208 COc1ccc(cc1F)NCSc2ccccc2 2230a_100000740183_100011218342 [0,1,0,0,0,1|2,0,0]=4 3366 B19R2.28208 COc1ccc(cc1F)SCSc2ccccc2 62a_100000171752_100011218342 [0,1,0,0,0,1|2,0,0]=4 3367 B19R2.28208 COc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100000171752 [0,1,0,0,0,1|2,0,0]=4 3368 B19R2.28208 COc1ccc(cc1N)SCSc2ccccc2 62a_100011218342_100011249504 [0,1,0,0,0,1|2,0,0]=4 3369 B19R2.28208 COc1ccc(cc1N)SCSc2ccccc2 62a_100011249504_100011218342 [0,1,0,0,0,1|2,0,0]=4 3370 B19R2.28208 COc1ccc(cc1O)SCSc2ccccc2 62a_100011218342_100009816560 [0,1,0,0,0,1|1,0,1]=4 3371 B19R2.28208 COc1cnc(cc1N)SCSc2ccccc2 62a_100010896307_100011218342 [0,1,0,0,0,1|2,0,0]=4 3372 B19R2.28208 COc1cnc(cc1N)SCSc2ccccc2 62a_100011218342_100010896307 [0,1,0,0,0,1|2,0,0]=4 3373 B19R2.28208 COc1cnc(cc1O)SCSc2ccccc2 62a_100011218342_100010264082 [0,1,0,0,0,1|1,0,1]=4 3374 B19R2.28208 COc1coc(cc1=O)CNCc2ccccc2 2230a_100015324214_100000081511 [0,1,0,0,0,1|1,0,0]=3 3375 B19R2.28208 COc1coc(cc1=O)COCc2ccccc2 7a_100000210790_100000081511 [0,1,0,0,0,1|0,1,0]=3 3376 B19R2.28208 COc1coc(cc1=O)CSCc2ccccc2 62a_100000211182_100000081511 [0,1,0,0,0,1|0,0,0]=2 3377 B19R2.28208 COc1coc(cc1=O)CSCc2ccccn2 62a_100000721315_100000081511 [0,1,0,0,0,1|1,0,0]=3 3378 B19R2.28208 COc1coc(cc1=O)CSCc2cccnc2 62a_100000741622_100000081511 [0,1,0,0,0,1|1,0,0]=3 3379 B19R2.28208 COc1coc(cc1=O)CSCc2cccnn2 62a_100016990269_100000081511 [0,1,0,0,0,1|2,0,0]=4 3380 B19R2.28208 COc1coc(cc1=O)CSCc2ccncc2 62a_100015193705_100000081511 [0,1,0,0,0,1|1,0,0]=3 3381 B19R2.28208 COc1coc(cc1=O)CSCc2cnccn2 62a_100016995436_100000081511 [0,1,0,0,0,1|2,0,0]=4 3382 B19R2.28208 COc1coc(cc1=O)CSCc2cncnc2 62a_100015196519_100000081511 [0,1,0,0,0,1|2,0,0]=4 3383 B19R2.28208 COc1coc(cc1=O)CSCc2ncccn2 62a_100000703007_100000081511 [0,1,0,0,0,1|2,0,0]=4 3384 B19R2.28208 Cc1cc(ccc1CO)SCSc2ccccc2 62a_100000748258_100011218342 [0,1,0,0,0,1|2,0,0]=4 3385 B19R2.28208 Cc1cc(ccc1CO)SCSc2ccccc2 62a_100011218342_100000748258 [0,1,0,0,0,1|2,0,0]=4 3386 B19R2.28208 Cc1cc(ncc1CO)SCSc2ccccc2 62a_100010277336_100011218342 [0,1,0,0,0,1|2,0,0]=4 3387 B19R2.28208 Cc1cc(ncc1CO)SCSc2ccccc2 62a_100011218342_100010277336 [0,1,0,0,0,1|2,0,0]=4 3388 B19R2.28208 Nc1cc(ccc1CO)SCSc2ccccc2 62a_100000718831_100011218342 [0,1,0,0,0,1|2,0,0]=4 3389 B19R2.28208 Nc1cc(ccc1CO)SCSc2ccccc2 62a_100011218342_100000718831 [0,1,0,0,0,1|2,0,0]=4 3390 B19R2.28208 Nc1cc(ncc1CO)SCSc2ccccc2 62a_100009830438_100011218342 [0,1,0,0,0,1|2,0,0]=4 3391 B19R2.28208 Nc1cc(ncc1CO)SCSc2ccccc2 62a_100011218342_100009830438 [0,1,0,0,0,1|2,0,0]=4 3392 B19R2.28208 OCc1ccc(cc1Br)SCSc2ccccc2 62a_100010240206_100011218342 [0,1,0,0,0,1|2,0,0]=4 3393 B19R2.28208 OCc1ccc(cc1Br)SCSc2ccccc2 62a_100011218342_100010240206 [0,1,0,0,0,1|2,0,0]=4 3394 B19R2.28208 OCc1ccc(cc1F)SCSc2ccccc2 62a_100011191541_100011218342 [0,1,0,0,0,1|2,0,0]=4 3395 B19R2.28208 OCc1ccc(cc1F)SCSc2ccccc2 62a_100011218342_100011191541 [0,1,0,0,0,1|2,0,0]=4 3396 B19R2.28208 OCc1ccc(cc1O)SCSc2ccccc2 62a_100000071718_100011218342 [0,1,0,0,0,1|1,0,1]=4 3397 B19R2.28208 OCc1ccc(cc1O)SCSc2ccccc2 62a_100011218342_100000071718 [0,1,0,0,0,1|1,0,1]=4 3398 B19R2.50071 Cc1ccccc1COCc2cc(=O)c(co2)O 7a_100000698903_100000010605 [0,1,0,0,0,1|0,1,0]=3 3399 B19R2.50071 Cc1ccccc1CSCc2cc(=O)c(co2)O 62a_100000211839_100000010605 [0,1,0,0,0,1|0,0,0]=2 3400 B19R2.50071 Cc1ccccc1SCCc2ccc(c(c2)O)O 62a_100000210755_200010393615 [0,1,0,0,0,1|1,0,1]=4 3401 B19R2.50071 Cc1cccnc1CSCc2cc(=O)c(co2)O 62a_100000696600_100000010605 [0,1,0,0,0,1|1,0,0]=3 3402 B19R2.50071 Cc1ccncc1CSCc2cc(=O)c(co2)O 62a_100000690890_100000010605 [0,1,0,0,0,1|1,0,0]=3 3403 B19R2.50071 Cc1cnccc1CSCc2cc(=O)c(co2)O 62a_100020672808_100000010605 [0,1,0,0,0,1|1,0,0]=3 3404 B19R2.50071 Cc1ncccc1COCc2cc(=O)c(co2)O 7a_100000729262_100000010605 [0,1,0,0,0,1|1,1,0]=4 3405 B19R2.50071 Cc1ncccc1CSCc2cc(=O)c(co2)O 62a_100000732876_100000010605 [0,1,0,0,0,1|1,0,0]=3 3406 B19R2.50071 Nc1ccccc1SCCc2ccc(c(c2)O)O 62a_100000210017_200010393615 [0,1,0,0,0,1|1,0,1]=4 3407 B19R2.50071 O=c1cc(occ1O)CNCc2ccccc2Br 2230a_100000689332_100000010605 [0,1,0,0,0,1|1,0,0]=3 3408 B19R2.50071 O=c1cc(occ1O)CNCc2ccccc2Cl 2230a_100000174879_100000010605 [0,1,0,0,0,1|1,0,0]=3 3409 B19R2.50071 O=c1cc(occ1O)CNCc2cccnc2Br 2230a_100009818023_100000010605 [0,1,0,0,0,1|2,0,0]=4 3410 B19R2.50071 O=c1cc(occ1O)CNCc2cccnc2Cl 2230a_100015189234_100000010605 [0,1,0,0,0,1|2,0,0]=4 3411 B19R2.50071 O=c1cc(occ1O)CNCc2ncccc2Cl 2230a_100015189233_100000010605 [0,1,0,0,0,1|2,0,0]=4 3412 B19R2.50071 O=c1cc(occ1O)COCc2ccccc2Br 7a_100000756307_100000010605 [0,1,0,0,0,1|0,1,0]=3 3413 B19R2.50071 O=c1cc(occ1O)COCc2ccccc2Cl 7a_100000210847_100000010605 [0,1,0,0,0,1|0,1,0]=3 3414 B19R2.50071 O=c1cc(occ1O)COCc2ccccc2F 7a_100000211962_100000010605 [0,1,0,0,0,1|0,1,0]=3 3415 B19R2.50071 O=c1cc(occ1O)COCc2ccccc2I 7a_100000187465_100000010605 [0,1,0,0,0,1|0,1,0]=3 3416 B19R2.50071 O=c1cc(occ1O)COCc2cccnc2Br 7a_100000719692_100000010605 [0,1,0,0,0,1|1,1,0]=4 3417 B19R2.50071 O=c1cc(occ1O)COCc2cccnc2Cl 7a_100000748726_100000010605 [0,1,0,0,0,1|1,1,0]=4 3418 B19R2.50071 O=c1cc(occ1O)COCc2cccnc2F 7a_100000079888_100000010605 [0,1,0,0,0,1|1,1,0]=4 3419 B19R2.50071 O=c1cc(occ1O)CSCc2ccccc2Br 62a_100000184730_100000010605 [0,1,0,0,0,1|0,0,0]=2 3420 B19R2.50071 O=c1cc(occ1O)CSCc2ccccc2Cl 62a_100000187162_100000010605 [0,1,0,0,0,1|0,0,0]=2 3421 B19R2.50071 O=c1cc(occ1O)CSCc2ccccc2F 62a_100000211605_100000010605 [0,1,0,0,0,1|0,0,0]=2 3422 B19R2.50071 O=c1cc(occ1O)CSCc2ccccc2I 62a_100011216222_100000010605 [0,1,0,0,0,1|0,0,0]=2 3423 B19R2.50071 O=c1cc(occ1O)CSCc2cccnc2Br 62a_100010140945_100000010605 [0,1,0,0,0,1|1,0,0]=3 3424 B19R2.50071 O=c1cc(occ1O)CSCc2cccnc2Cl 62a_100000045678_100000010605 [0,1,0,0,0,1|1,0,0]=3 3425 B19R2.50071 O=c1cc(occ1O)CSCc2cccnc2F 62a_100000099810_100000010605 [0,1,0,0,0,1|1,0,0]=3 3426 B19R2.50071 O=c1cc(occ1O)CSCc2ccncc2Cl 62a_100000763264_100000010605 [0,1,0,0,0,1|1,0,0]=3 3427 B19R2.50071 O=c1cc(occ1O)CSCc2ncccc2Br 62a_100025702911_100000010605 [0,1,0,0,0,1|1,0,0]=3 3428 B19R2.50071 O=c1cc(occ1O)CSCc2ncccc2Cl 62a_100000099807_100000010605 [0,1,0,0,0,1|1,0,0]=3 3429 B19R2.50071 O=c1cc(occ1O)CSCc2ncccc2F 62a_100000104219_100000010605 [0,1,0,0,0,1|1,0,0]=3 3430 B19R2.50071 O=c1cc(occ1O)CSCc2ncccc2O 62a_200020655725_100000010605 [0,1,0,0,0,1|1,0,0]=3 3431 B19R2.50071 Oc1ccc(cc1O)CCSc2ccccc2Br 62a_100000695589_200010393615 [0,1,0,0,0,1|1,0,1]=4 3432 B19R2.50071 Oc1ccc(cc1O)CCSc2ccccc2Cl 62a_100000764095_200010393615 [0,1,0,0,0,1|1,0,1]=4 3433 B19R2.50071 Oc1ccc(cc1O)CCSc2ccccc2F 62a_100011215700_200010393615 [0,1,0,0,0,1|1,0,1]=4 3434 B19R2.50071 Oc1ccc(cc1O)CCSc2ccccc2O 62a_100000739446_200010393615 [0,1,0,0,0,1|1,0,1]=4 3435 B19R2.101617 Cc1cc(ccn1)CSCc2cc(=O)c(co2)O 62a_200020672517_100000010605 [0,1,0,0,0,1|1,0,0]=3 3436 B19R2.101617 Cc1cccc(c1)CNCc2cc(=O)c(co2)O 2230a_100000185548_100000010605 [0,1,0,0,0,1|1,0,0]=3 3437 B19R2.101617 Cc1cccc(c1)COCc2cc(=O)c(co2)O 7a_100011217746_100000010605 [0,1,0,0,0,1|0,1,0]=3 3438 B19R2.101617 Cc1cccc(c1)CSCc2cc(=O)c(co2)O 62a_100000211840_100000010605 [0,1,0,0,0,1|0,0,0]=2 3439 B19R2.101617 Cc1cccc(c1)SCCc2ccc(c(c2)O)O 62a_100011215228_200010393615 [0,1,0,0,0,1|1,0,1]=4 3440 B19R2.101617 Cc1cccc(n1)CSCc2cc(=O)c(co2)O 62a_100000757606_100000010605 [0,1,0,0,0,1|1,0,0]=3 3441 B19R2.101617 Cc1ccnc(c1)CSCc2cc(=O)c(co2)O 62a_100000718516_100000010605 [0,1,0,0,0,1|1,0,0]=3 3442 B19R2.101617 Cc1cncc(c1)CNCc2cc(=O)c(co2)O 2230a_100000692839_100000010605 [0,1,0,0,0,1|2,0,0]=4 3443 B19R2.101617 Cc1cncc(c1)COCc2cc(=O)c(co2)O 7a_100011998709_100000010605 [0,1,0,0,0,1|1,1,0]=4 3444 B19R2.101617 Cc1cncc(c1)CSCc2cc(=O)c(co2)O 62a_100000716715_100000010605 [0,1,0,0,0,1|1,0,0]=3 3445 B19R2.101617 Nc1cccc(c1)SCCc2ccc(c(c2)O)O 62a_100000210019_200010393615 [0,1,0,0,0,1|1,0,1]=4 3446 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(c2)Br 2230a_100000174977_100000010605 [0,1,0,0,0,1|1,0,0]=3 3447 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(c2)Cl 2230a_100000174878_100000010605 [0,1,0,0,0,1|1,0,0]=3 3448 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(c2)F 2230a_100000174948_100000010605 [0,1,0,0,0,1|1,0,0]=3 3449 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(c2)I 2230a_100000106179_100000010605 [0,1,0,0,0,1|1,0,0]=3 3450 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(c2)O 2230a_100000743036_100000010605 [0,1,0,0,0,1|1,0,0]=3 3451 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(n2)Br 2230a_100016987751_100000010605 [0,1,0,0,0,1|2,0,0]=4 3452 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(n2)Cl 2230a_100016990191_100000010605 [0,1,0,0,0,1|2,0,0]=4 3453 B19R2.101617 O=c1cc(occ1O)CNCc2cccc(n2)F 2230a_100015188798_100000010605 [0,1,0,0,0,1|2,0,0]=4 3454 B19R2.101617 O=c1cc(occ1O)CNCc2ccnc(c2)Br 2230a_100025757509_100000010605 [0,1,0,0,0,1|2,0,0]=4 3455 B19R2.101617 O=c1cc(occ1O)CNCc2ccnc(c2)Cl 2230a_100015205668_100000010605 [0,1,0,0,0,1|2,0,0]=4 3456 B19R2.101617 O=c1cc(occ1O)CNCc2ccnc(c2)F 2230a_100015188774_100000010605 [0,1,0,0,0,1|2,0,0]=4 3457 B19R2.101617 O=c1cc(occ1O)CNCc2cncc(c2)Cl 2230a_200020614424_100000010605 [0,1,0,0,0,1|2,0,0]=4 3458 B19R2.101617 O=c1cc(occ1O)CNCc2cncc(c2)F 2230a_100011962886_100000010605 [0,1,0,0,0,1|2,0,0]=4 3459 B19R2.101617 O=c1cc(occ1O)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000010605 [0,1,0,0,0,1|1,1,0]=4 3460 B19R2.101617 O=c1cc(occ1O)COCc2cccc(c2)Br 7a_100000687537_100000010605 [0,1,0,0,0,1|0,1,0]=3 3461 B19R2.101617 O=c1cc(occ1O)COCc2cccc(c2)Cl 7a_100000241301_100000010605 [0,1,0,0,0,1|0,1,0]=3 3462 B19R2.101617 O=c1cc(occ1O)COCc2cccc(c2)F 7a_100000210976_100000010605 [0,1,0,0,0,1|0,1,0]=3 3463 B19R2.101617 O=c1cc(occ1O)COCc2cccc(c2)I 7a_100011215336_100000010605 [0,1,0,0,0,1|0,1,0]=3 3464 B19R2.101617 O=c1cc(occ1O)COCc2ccnc(c2)Br 7a_100009814636_100000010605 [0,1,0,0,0,1|1,1,0]=4 3465 B19R2.101617 O=c1cc(occ1O)COCc2cncc(c2)Br 7a_100011259137_100000010605 [0,1,0,0,0,1|1,1,0]=4 3466 B19R2.101617 O=c1cc(occ1O)COCc2cncc(c2)Cl 7a_100000092867_100000010605 [0,1,0,0,0,1|1,1,0]=4 3467 B19R2.101617 O=c1cc(occ1O)COCc2cncc(c2)F 7a_100011962875_100000010605 [0,1,0,0,0,1|1,1,0]=4 3468 B19R2.101617 O=c1cc(occ1O)CSCc2cc(ccn2)Br 62a_100010173614_100000010605 [0,1,0,0,0,1|1,0,0]=3 3469 B19R2.101617 O=c1cc(occ1O)CSCc2cc(ccn2)Cl 62a_100016988179_100000010605 [0,1,0,0,0,1|1,0,0]=3 3470 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(c2)Br 62a_100000211773_100000010605 [0,1,0,0,0,1|0,0,0]=2 3471 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(c2)Cl 62a_100000187163_100000010605 [0,1,0,0,0,1|0,0,0]=2 3472 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(c2)F 62a_100000230114_100000010605 [0,1,0,0,0,1|0,0,0]=2 3473 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(c2)I 62a_100011218688_100000010605 [0,1,0,0,0,1|0,0,0]=2 3474 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(c2)O 62a_100011660834_100000010605 [0,1,0,0,0,1|0,0,0]=2 3475 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(n2)Br 62a_100009889011_100000010605 [0,1,0,0,0,1|1,0,0]=3 3476 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(n2)Cl 62a_100000086093_100000010605 [0,1,0,0,0,1|1,0,0]=3 3477 B19R2.101617 O=c1cc(occ1O)CSCc2cccc(n2)F 62a_100009819644_100000010605 [0,1,0,0,0,1|1,0,0]=3 3478 B19R2.101617 O=c1cc(occ1O)CSCc2ccnc(c2)Br 62a_100010254460_100000010605 [0,1,0,0,0,1|1,0,0]=3 3479 B19R2.101617 O=c1cc(occ1O)CSCc2ccnc(c2)Cl 62a_100000764220_100000010605 [0,1,0,0,0,1|1,0,0]=3 3480 B19R2.101617 O=c1cc(occ1O)CSCc2ccnc(n2)Cl 62a_100000099655_100000010605 [0,1,0,0,0,1|2,0,0]=4 3481 B19R2.101617 O=c1cc(occ1O)CSCc2cncc(c2)Br 62a_100000738771_100000010605 [0,1,0,0,0,1|1,0,0]=3 3482 B19R2.101617 O=c1cc(occ1O)CSCc2cncc(c2)Cl 62a_100016992070_100000010605 [0,1,0,0,0,1|1,0,0]=3 3483 B19R2.101617 O=c1cc(occ1O)CSCc2cncc(c2)F 62a_100000725299_100000010605 [0,1,0,0,0,1|1,0,0]=3 3484 B19R2.101617 O=c1cccc([nH]1)CNCc2cc(=O)c(co2)O 2230a_100000696482_100000010605 [0,1,0,0,0,1|2,0,0]=4 3485 B19R2.101617 Oc1ccc(cc1O)CCSc2cccc(c2)Br 62a_100000691529_200010393615 [0,1,0,0,0,1|1,0,1]=4 3486 B19R2.101617 Oc1ccc(cc1O)CCSc2cccc(c2)Cl 62a_100000699651_200010393615 [0,1,0,0,0,1|1,0,1]=4 3487 B19R2.101617 Oc1ccc(cc1O)CCSc2cccc(c2)F 62a_100000685547_200010393615 [0,1,0,0,0,1|1,0,1]=4 3488 B19R2.101617 Oc1ccc(cc1O)CCSc2cccc(c2)[S] 62a_114929384022_200010393615 [0,1,0,0,0,1|1,0,1]=4 3489 B19R2.103257 Cc1c(ccc(c1C)SCSc2ccccc2)O 62a_100011218342_100012353674 [0,1,0,0,0,1|2,0,0]=4 3490 B19R2.103257 Cc1c(ccc(c1C)SCSc2ccccc2)O 62a_100012353674_100011218342 [0,1,0,0,0,1|2,0,0]=4 3491 B19R2.103257 Cc1c(ccc(c1F)SCSc2ccccc2)O 62a_100010390934_100011218342 [0,1,0,0,0,1|2,0,0]=4 3492 B19R2.103257 Cc1c(ccc(c1F)SCSc2ccccc2)O 62a_100011218342_100010390934 [0,1,0,0,0,1|2,0,0]=4 3493 B19R2.103257 Cc1c(ccc(c1N)O)SCSc2ccccc2 62a_100011218342_100013039247 [0,1,0,0,0,1|2,0,0]=4 3494 B19R2.103257 Cc1c(ccc(c1N)O)SCSc2ccccc2 62a_100013039247_100011218342 [0,1,0,0,0,1|2,0,0]=4 3495 B19R2.103257 Oc1ccc(c(c1F)F)SCSc2ccccc2 62a_100011218342_100011830415 [0,1,0,0,0,1|2,0,0]=4 3496 B19R2.103257 Oc1ccc(c(c1F)F)SCSc2ccccc2 62a_100011830415_100011218342 [0,1,0,0,0,1|2,0,0]=4 3497 B19R2.867575 Cc1cc(cc(c1O)Br)SCSc2ccccc2 62a_100010982682_100011218342 [0,1,0,0,0,1|2,0,0]=4 3498 B19R2.867575 Cc1cc(cc(c1O)Br)SCSc2ccccc2 62a_100011218342_100010982682 [0,1,0,0,0,1|2,0,0]=4 3499 B19R2.867575 Cc1cc(cc(c1O)C)SCSc2ccccc2 62a_100011216129_100011218342 [0,1,0,0,0,1|2,0,0]=4 3500 B19R2.867575 Cc1cc(cc(c1O)C)SCSc2ccccc2 62a_100011218342_100011216129 [0,1,0,0,0,1|2,0,0]=4 3501 B19R2.867575 Cc1cc(cc(c1O)Cl)SCSc2ccccc2 62a_100011218342_200015900153 [0,1,0,0,0,1|2,0,0]=4 3502 B19R2.867575 Cc1cc(cc(c1O)Cl)SCSc2ccccc2 62a_200015900153_100011218342 [0,1,0,0,0,1|2,0,0]=4 3503 B19R2.867575 Cc1cc(cc(c1O)N)SCSc2ccccc2 62a_100011218342_100011825904 [0,1,0,0,0,1|2,0,0]=4 3504 B19R2.867575 Cc1cc(cc(c1O)N)SCSc2ccccc2 62a_100011825904_100011218342 [0,1,0,0,0,1|2,0,0]=4 3505 B19R2.867575 Nc1cc(cc(c1O)F)SCSc2ccccc2 62a_100011217383_100011218342 [0,1,0,0,0,1|2,0,0]=4 3506 B19R2.867575 Nc1cc(cc(c1O)F)SCSc2ccccc2 62a_100011218342_100011217383 [0,1,0,0,0,1|2,0,0]=4 3507 B19R2.867575 Oc1c(cc(cc1Cl)SCSc2ccccc2)Cl 62a_100011218342_100012339652 [0,1,0,0,0,1|2,0,0]=4 3508 B19R2.867575 Oc1c(cc(cc1Cl)SCSc2ccccc2)Cl 62a_100012339652_100011218342 [0,1,0,0,0,1|2,0,0]=4 3509 B19R2.867575 Oc1c(cc(cc1F)SCSc2ccccc2)F 62a_100011216917_100011218342 [0,1,0,0,0,1|2,0,0]=4 3510 B19R2.867575 Oc1c(cc(cc1F)SCSc2ccccc2)F 62a_100011218342_100011216917 [0,1,0,0,0,1|2,0,0]=4 3511 B19R2.867575 Oc1cc(cc(c1O)F)SCSc2ccccc2 62a_100011218342_100010114375 [0,1,0,0,0,1|1,0,1]=4 3512 B19R2.867575 Oc1cc(cc(c1O)O)SCSc2ccccc2 62a_100011218342_100010658518 [0,1,0,0,0,1|1,0,1]=4 3513 B19R2.63463 O=c1cc(occ1O)COc2cccccc2=O 7a_100000036025_100000010605 [0,1,0,0,0,1|0,1,0]=3 3514 B19R2.2682 COc1coc(cc1=O)CC(=O)c2ccccc2 1458a_100000185807_100000081511 [0,2,0,0,0,0|1,0,0]=3 3515 B19R2.2682 COc1coc(cc1=O)CN(C)c2ccccc2 2230a_100000210012_100000081511 [0,2,0,0,0,0|1,0,0]=3 3516 B19R2.2682 COc1coc(cc1=O)CN(C)c2ccccc2 269982a_100000210012_100000081511 [0,2,0,0,0,0|1,0,0]=3 3517 B19R2.2849 CC(Cc1ccc(c(c1)C=O)O)c2ccccc2 271570a_100000062452_100000186750 [0,2,0,0,0,0|2,0,0]=4 3518 B19R2.2849 CN(Cc1ccc(c(c1)C=O)O)c2ccccc2 269982a_100000210012_100000008128 [0,2,0,0,0,0|2,0,0]=4 3519 B19R2.9996 CCN(Cc1cc(=O)c(co1)O)c2ccccc2 2230a_100000210013_100000010605 [0,2,0,0,0,0|1,0,0]=3 3520 B19R2.9996 CCN(Cc1cc(=O)c(co1)O)c2ccccc2 269982a_100000210013_100000010605 [0,2,0,0,0,0|1,0,0]=3 3521 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)Br 2230a_100000219623_100000010605 [0,2,0,0,0,0|1,0,0]=3 3522 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)Br 269982a_100000219623_100000010605 [0,2,0,0,0,0|1,0,0]=3 3523 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)Cl 2230a_100020629279_100000010605 [0,2,0,0,0,0|1,0,0]=3 3524 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)Cl 269982a_100020629279_100000010605 [0,2,0,0,0,0|1,0,0]=3 3525 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)F 2230a_100000219829_100000010605 [0,2,0,0,0,0|1,0,0]=3 3526 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)F 269982a_100000219829_100000010605 [0,2,0,0,0,0|1,0,0]=3 3527 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)I 2230a_100000743151_100000010605 [0,2,0,0,0,0|1,0,0]=3 3528 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)I 269982a_100000743151_100000010605 [0,2,0,0,0,0|1,0,0]=3 3529 B19R2.12061 CN(Cc1cc(=O)c(co1)O)c2ccc(cc2)O 269982a_100000182112_100000010605 [0,2,0,0,0,0|1,0,0]=3 3530 B19R2.12061 Cc1ccc(cc1)C(=O)Cc2cc(=O)c(co2)O 1458a_100000188618_100000010605 [0,2,0,0,0,0|1,0,0]=3 3531 B19R2.12061 Cc1ccc(cc1)N(C)Cc2cc(=O)c(co2)O 2230a_100000219977_100000010605 [0,2,0,0,0,0|1,0,0]=3 3532 B19R2.12061 Cc1ccc(cc1)N(C)Cc2cc(=O)c(co2)O 269982a_100000219977_100000010605 [0,2,0,0,0,0|1,0,0]=3 3533 B19R2.12061 O=C(Cc1cc(=O)c(co1)O)c2ccc(cc2)Br 1458a_100000185839_100000010605 [0,2,0,0,0,0|1,0,0]=3 3534 B19R2.12061 O=C(Cc1cc(=O)c(co1)O)c2ccc(cc2)Cl 1458a_100000210187_100000010605 [0,2,0,0,0,0|1,0,0]=3 3535 B19R2.12061 O=C(Cc1cc(=O)c(co1)O)c2ccc(cc2)F 1458a_100000187176_100000010605 [0,2,0,0,0,0|1,0,0]=3 3536 B19R2.12061 O=C(Cc1cc(=O)c(co1)O)c2ccc(cc2)I 1458a_100000187904_100000010605 [0,2,0,0,0,0|1,0,0]=3 3537 B19R2.12061 O=C(Cc1cc(=O)c(co1)O)c2ccc(cc2)O 1458a_100000212099_100000010605 [0,2,0,0,0,0|1,0,0]=3 3538 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2Br 2230a_100020606079_100000010605 [0,2,0,0,0,0|1,0,0]=3 3539 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2Br 269982a_100020606079_100000010605 [0,2,0,0,0,0|1,0,0]=3 3540 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2Cl 2230a_100000219374_100000010605 [0,2,0,0,0,0|1,0,0]=3 3541 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2Cl 269982a_100000219374_100000010605 [0,2,0,0,0,0|1,0,0]=3 3542 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2F 2230a_100000220357_100000010605 [0,2,0,0,0,0|1,0,0]=3 3543 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2F 269982a_100000220357_100000010605 [0,2,0,0,0,0|1,0,0]=3 3544 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2F 38a_100000220357_100000010605 [0,2,0,0,0,0|1,0,0]=3 3545 B19R2.50263 CN(Cc1cc(=O)c(co1)O)c2ccccc2O 269982a_100000033821_100000010605 [0,2,0,0,0,0|1,0,0]=3 3546 B19R2.50263 Cc1ccccc1C(=O)Cc2cc(=O)c(co2)O 1458a_100000212026_100000010605 [0,2,0,0,0,0|1,0,0]=3 3547 B19R2.50263 Cc1ccccc1N(C)Cc2cc(=O)c(co2)O 2230a_100000219699_100000010605 [0,2,0,0,0,0|1,0,0]=3 3548 B19R2.50263 Cc1ccccc1N(C)Cc2cc(=O)c(co2)O 269982a_100000219699_100000010605 [0,2,0,0,0,0|1,0,0]=3 3549 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2Br 1458a_100000188424_100000010605 [0,2,0,0,0,0|1,0,0]=3 3550 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2Cl 1458a_100000185844_100000010605 [0,2,0,0,0,0|1,0,0]=3 3551 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2F 1458a_100000188656_100000010605 [0,2,0,0,0,0|1,0,0]=3 3552 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2I 1458a_100000187884_100000010605 [0,2,0,0,0,0|1,0,0]=3 3553 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2O 1458a_100015234032_100000010605 [0,2,0,0,0,0|1,0,0]=3 3554 B19R2.50263 O=C(Cc1cc(=O)c(co1)O)c2ccccc2[O-] 1458a_100009911694_100000010605 [0,2,0,0,0,0|1,0,0]=3 3555 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)Br 2230a_100000219648_100000010605 [0,2,0,0,0,0|1,0,0]=3 3556 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)Br 269982a_100000219648_100000010605 [0,2,0,0,0,0|1,0,0]=3 3557 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)Cl 2230a_100000220044_100000010605 [0,2,0,0,0,0|1,0,0]=3 3558 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)Cl 269982a_100000220044_100000010605 [0,2,0,0,0,0|1,0,0]=3 3559 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)F 2230a_100020633736_100000010605 [0,2,0,0,0,0|1,0,0]=3 3560 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)F 269982a_100020633736_100000010605 [0,2,0,0,0,0|1,0,0]=3 3561 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)I 2230a_100000221217_100000010605 [0,2,0,0,0,0|1,0,0]=3 3562 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)I 269982a_100000221217_100000010605 [0,2,0,0,0,0|1,0,0]=3 3563 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)O 2230a_100000756613_100000010605 [0,2,0,0,0,0|1,0,0]=3 3564 B19R2.101321 CN(Cc1cc(=O)c(co1)O)c2cccc(c2)O 269982a_100000756613_100000010605 [0,2,0,0,0,0|1,0,0]=3 3565 B19R2.101321 Cc1cccc(c1)C(=O)Cc2cc(=O)c(co2)O 1458a_100000189346_100000010605 [0,2,0,0,0,0|1,0,0]=3 3566 B19R2.101321 Cc1cccc(c1)N(C)Cc2cc(=O)c(co2)O 2230a_100000219674_100000010605 [0,2,0,0,0,0|1,0,0]=3 3567 B19R2.101321 Cc1cccc(c1)N(C)Cc2cc(=O)c(co2)O 269982a_100000219674_100000010605 [0,2,0,0,0,0|1,0,0]=3 3568 B19R2.101321 O=C(Cc1cc(=O)c(co1)O)c2cccc(c2)Br 1458a_100000210664_100000010605 [0,2,0,0,0,0|1,0,0]=3 3569 B19R2.101321 O=C(Cc1cc(=O)c(co1)O)c2cccc(c2)Cl 1458a_100000210390_100000010605 [0,2,0,0,0,0|1,0,0]=3 3570 B19R2.101321 O=C(Cc1cc(=O)c(co1)O)c2cccc(c2)F 1458a_100000210950_100000010605 [0,2,0,0,0,0|1,0,0]=3 3571 B19R2.101321 O=C(Cc1cc(=O)c(co1)O)c2cccc(c2)I 1458a_100000184098_100000010605 [0,2,0,0,0,0|1,0,0]=3 3572 B19R2.101321 O=C(Cc1cc(=O)c(co1)O)c2cccc(c2)O 1458a_100000183914_100000010605 [0,2,0,0,0,0|1,0,0]=3 3573 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_100000752885_200011397701 [0,2,0,0,0,0|2,0,0]=4 3574 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)Br 62a_200011397701_100000752885 [0,2,0,0,0,0|2,0,0]=4 3575 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)C 62a_100000186775_200011397701 [0,2,0,0,0,0|2,0,0]=4 3576 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)C 62a_200011397701_100000186775 [0,2,0,0,0,0|2,0,0]=4 3577 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_100000755918_200011397701 [0,2,0,0,0,0|2,0,0]=4 3578 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)Cl 62a_200011397701_100000755918 [0,2,0,0,0,0|2,0,0]=4 3579 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)F 62a_100000211213_200011397701 [0,2,0,0,0,0|2,0,0]=4 3580 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)F 62a_200011397701_100000211213 [0,2,0,0,0,0|2,0,0]=4 3581 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)N 62a_100000185761_200011397701 [0,2,0,0,0,0|2,0,0]=4 3582 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)N 62a_200011397701_100000185761 [0,2,0,0,0,0|2,0,0]=4 3583 B19R2.2679 COc1ccc(cc1Br)CSc2ccc(cc2)O 62a_200011397701_100000185759 [0,2,0,0,0,0|2,0,0]=4 3584 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)Br 62a_100000752885_200011290836 [0,2,0,0,0,0|2,0,0]=4 3585 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)Br 62a_200011290836_100000752885 [0,2,0,0,0,0|2,0,0]=4 3586 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)C 62a_100000186775_200011290836 [0,2,0,0,0,0|2,0,0]=4 3587 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)C 62a_200011290836_100000186775 [0,2,0,0,0,0|2,0,0]=4 3588 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)Cl 62a_100000755918_200011290836 [0,2,0,0,0,0|2,0,0]=4 3589 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)Cl 62a_200011290836_100000755918 [0,2,0,0,0,0|2,0,0]=4 3590 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)F 62a_100000211213_200011290836 [0,2,0,0,0,0|2,0,0]=4 3591 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)F 62a_200011290836_100000211213 [0,2,0,0,0,0|2,0,0]=4 3592 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)N 62a_100000185761_200011290836 [0,2,0,0,0,0|2,0,0]=4 3593 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)N 62a_200011290836_100000185761 [0,2,0,0,0,0|2,0,0]=4 3594 B19R2.2679 COc1ccc(cc1C)CSc2ccc(cc2)O 62a_200011290836_100000185759 [0,2,0,0,0,0|2,0,0]=4 3595 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100000693707_100000752885 [0,2,0,0,0,0|2,0,0]=4 3596 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)Br 62a_100000752885_100000693707 [0,2,0,0,0,0|2,0,0]=4 3597 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)C 62a_100000186775_100000693707 [0,2,0,0,0,0|2,0,0]=4 3598 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)C 62a_100000693707_100000186775 [0,2,0,0,0,0|2,0,0]=4 3599 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100000693707_100000755918 [0,2,0,0,0,0|2,0,0]=4 3600 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)Cl 62a_100000755918_100000693707 [0,2,0,0,0,0|2,0,0]=4 3601 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)F 62a_100000211213_100000693707 [0,2,0,0,0,0|2,0,0]=4 3602 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)F 62a_100000693707_100000211213 [0,2,0,0,0,0|2,0,0]=4 3603 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)N 62a_100000185761_100000693707 [0,2,0,0,0,0|2,0,0]=4 3604 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)N 62a_100000693707_100000185761 [0,2,0,0,0,0|2,0,0]=4 3605 B19R2.2679 COc1ccc(cc1Cl)CSc2ccc(cc2)O 62a_100000693707_100000185759 [0,2,0,0,0,0|2,0,0]=4 3606 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100000189595_100000752885 [0,2,0,0,0,0|2,0,0]=4 3607 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)Br 62a_100000752885_100000189595 [0,2,0,0,0,0|2,0,0]=4 3608 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)C 62a_100000186775_100000189595 [0,2,0,0,0,0|2,0,0]=4 3609 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)C 62a_100000189595_100000186775 [0,2,0,0,0,0|2,0,0]=4 3610 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100000189595_100000755918 [0,2,0,0,0,0|2,0,0]=4 3611 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)Cl 62a_100000755918_100000189595 [0,2,0,0,0,0|2,0,0]=4 3612 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)F 62a_100000189595_100000211213 [0,2,0,0,0,0|2,0,0]=4 3613 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)F 62a_100000211213_100000189595 [0,2,0,0,0,0|2,0,0]=4 3614 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)N 62a_100000185761_100000189595 [0,2,0,0,0,0|2,0,0]=4 3615 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)N 62a_100000189595_100000185761 [0,2,0,0,0,0|2,0,0]=4 3616 B19R2.2679 COc1ccc(cc1F)CSc2ccc(cc2)O 62a_100000189595_100000185759 [0,2,0,0,0,0|2,0,0]=4 3617 B19R2.2679 COc1coc(cc1=O)CNc2ccc(cc2)Br 2230a_100000210018_100000081511 [0,2,0,0,0,0|1,0,0]=3 3618 B19R2.2679 COc1coc(cc1=O)CNc2ccc(cc2)Cl 2230a_100000210052_100000081511 [0,2,0,0,0,0|1,0,0]=3 3619 B19R2.2679 COc1coc(cc1=O)COc2ccc(cc2)Br 7a_100000185759_100000081511 [0,2,0,0,0,0|0,1,0]=3 3620 B19R2.2679 COc1coc(cc1=O)COc2ccc(cc2)C 7a_100000210336_100000081511 [0,2,0,0,0,0|0,1,0]=3 3621 B19R2.2679 COc1coc(cc1=O)COc2ccc(cc2)Cl 7a_100000210216_100000081511 [0,2,0,0,0,0|0,1,0]=3 3622 B19R2.2679 COc1coc(cc1=O)COc2ccc(cc2)I 7a_100000212066_100000081511 [0,2,0,0,0,0|0,1,0]=3 3623 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)Br 7a_100000685995_100000081511 [0,2,0,0,0,0|1,1,0]=4 3624 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)C 7a_100000745506_100000081511 [0,2,0,0,0,0|1,1,0]=4 3625 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)Cl 7a_100000744096_100000081511 [0,2,0,0,0,0|1,1,0]=4 3626 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)F 7a_100000688820_100000081511 [0,2,0,0,0,0|1,1,0]=4 3627 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)I 7a_100000687607_100000081511 [0,2,0,0,0,0|1,1,0]=4 3628 B19R2.2679 COc1coc(cc1=O)COc2ccc(nc2)N 7a_100015188713_100000081511 [0,2,0,0,0,0|1,1,0]=4 3629 B19R2.2679 COc1coc(cc1=O)CSc2ccc(=O)[nH]c2 62a_100000212171_100000081511 [0,2,0,0,0,0|1,0,0]=3 3630 B19R2.2679 COc1coc(cc1=O)CSc2ccc(=O)[nH]n2 62a_100009820020_100000081511 [0,2,0,0,0,0|2,0,0]=4 3631 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cc2)Br 62a_100000752885_100000081511 [0,2,0,0,0,0|0,0,0]=2 3632 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cc2)C 62a_100000186775_100000081511 [0,2,0,0,0,0|0,0,0]=2 3633 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cc2)Cl 62a_100000755918_100000081511 [0,2,0,0,0,0|0,0,0]=2 3634 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cc2)F 62a_100000211213_100000081511 [0,2,0,0,0,0|0,0,0]=2 3635 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cc2)N 62a_100000185761_100000081511 [0,2,0,0,0,0|0,0,0]=2 3636 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)Br 62a_100000686858_100000081511 [0,2,0,0,0,0|1,0,0]=3 3637 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)C 62a_100011192072_100000081511 [0,2,0,0,0,0|1,0,0]=3 3638 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)Cl 62a_100011356976_100000081511 [0,2,0,0,0,0|1,0,0]=3 3639 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)F 62a_100000744514_100000081511 [0,2,0,0,0,0|1,0,0]=3 3640 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)N 62a_100000737798_100000081511 [0,2,0,0,0,0|1,0,0]=3 3641 B19R2.2679 COc1coc(cc1=O)CSc2ccc(cn2)O 62a_100000685995_100000081511 [0,2,0,0,0,0|1,0,0]=3 3642 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nc2)Br 62a_100009814638_100000081511 [0,2,0,0,0,0|1,0,0]=3 3643 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nc2)C 62a_100000751577_100000081511 [0,2,0,0,0,0|1,0,0]=3 3644 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nc2)Cl 62a_100000034144_100000081511 [0,2,0,0,0,0|1,0,0]=3 3645 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nc2)F 62a_100000042367_100000081511 [0,2,0,0,0,0|1,0,0]=3 3646 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nc2)N 62a_100000187370_100000081511 [0,2,0,0,0,0|1,0,0]=3 3647 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nn2)C 62a_100000744512_100000081511 [0,2,0,0,0,0|2,0,0]=4 3648 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nn2)Cl 62a_100000068654_100000081511 [0,2,0,0,0,0|2,0,0]=4 3649 B19R2.2679 COc1coc(cc1=O)CSc2ccc(nn2)N 62a_100010219413_100000081511 [0,2,0,0,0,0|2,0,0]=4 3650 B19R2.2679 COc1coc(cc1=O)CSc2cnc(=O)[nH]c2 62a_102495366499_100000081511 [0,2,0,0,0,0|2,0,0]=4 3651 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)Br 62a_100010187541_100000081511 [0,2,0,0,0,0|2,0,0]=4 3652 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)C 62a_100011999403_100000081511 [0,2,0,0,0,0|2,0,0]=4 3653 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)Cl 62a_100010214907_100000081511 [0,2,0,0,0,0|2,0,0]=4 3654 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)F 62a_100009856528_100000081511 [0,2,0,0,0,0|2,0,0]=4 3655 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)N 62a_100000744751_100000081511 [0,2,0,0,0,0|2,0,0]=4 3656 B19R2.2679 COc1coc(cc1=O)CSc2cnc(cn2)O 62a_100011934580_100000081511 [0,2,0,0,0,0|2,0,0]=4 3657 B19R2.2679 COc1coc(cc1=O)CSc2cnc(nc2)Br 62a_200012349914_100000081511 [0,2,0,0,0,0|2,0,0]=4 3658 B19R2.2679 COc1coc(cc1=O)CSc2cnc(nc2)C 62a_100000686985_100000081511 [0,2,0,0,0,0|2,0,0]=4 3659 B19R2.2679 COc1coc(cc1=O)CSc2cnc(nc2)Cl 62a_100000059775_100000081511 [0,2,0,0,0,0|2,0,0]=4 3660 B19R2.2679 COc1coc(cc1=O)CSc2cnc(nc2)F 62a_100000685262_100000081511 [0,2,0,0,0,0|2,0,0]=4 3661 B19R2.2679 COc1coc(cc1=O)CSc2cnc(nc2)N 62a_100000766020_100000081511 [0,2,0,0,0,0|2,0,0]=4 3662 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)Br 62a_100000690281_100000081511 [0,2,0,0,0,0|2,0,0]=4 3663 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)C 62a_100000061069_100000081511 [0,2,0,0,0,0|2,0,0]=4 3664 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)Cl 62a_100011356929_100000081511 [0,2,0,0,0,0|2,0,0]=4 3665 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)F 62a_100000685220_100000081511 [0,2,0,0,0,0|2,0,0]=4 3666 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)N 62a_100000068403_100000081511 [0,2,0,0,0,0|2,0,0]=4 3667 B19R2.2679 COc1coc(cc1=O)CSc2ncc(cn2)O 62a_100000730009_100000081511 [0,2,0,0,0,0|2,0,0]=4 3668 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2Br 62a_100000695589_200011397701 [0,2,0,0,0,0|2,0,0]=4 3669 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2Br 62a_200011397701_100000695589 [0,2,0,0,0,0|2,0,0]=4 3670 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2C 62a_100000210755_200011397701 [0,2,0,0,0,0|2,0,0]=4 3671 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2C 62a_200011397701_100000210755 [0,2,0,0,0,0|2,0,0]=4 3672 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2Cl 62a_100000764095_200011397701 [0,2,0,0,0,0|2,0,0]=4 3673 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2Cl 62a_200011397701_100000764095 [0,2,0,0,0,0|2,0,0]=4 3674 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2F 62a_100011215700_200011397701 [0,2,0,0,0,0|2,0,0]=4 3675 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2F 62a_200011397701_100011215700 [0,2,0,0,0,0|2,0,0]=4 3676 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2N 62a_100000210017_200011397701 [0,2,0,0,0,0|2,0,0]=4 3677 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2N 62a_200011397701_100000210017 [0,2,0,0,0,0|2,0,0]=4 3678 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2O 62a_100000739446_200011397701 [0,2,0,0,0,0|2,0,0]=4 3679 B19R2.18959 COc1ccc(cc1Br)CSc2ccccc2O 62a_200011397701_100000739446 [0,2,0,0,0,0|2,0,0]=4 3680 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2Br 62a_100000695589_200011290836 [0,2,0,0,0,0|2,0,0]=4 3681 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2Br 62a_200011290836_100000695589 [0,2,0,0,0,0|2,0,0]=4 3682 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2C 62a_100000210755_200011290836 [0,2,0,0,0,0|2,0,0]=4 3683 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2C 62a_200011290836_100000210755 [0,2,0,0,0,0|2,0,0]=4 3684 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2Cl 62a_100000764095_200011290836 [0,2,0,0,0,0|2,0,0]=4 3685 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2Cl 62a_200011290836_100000764095 [0,2,0,0,0,0|2,0,0]=4 3686 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2F 62a_100011215700_200011290836 [0,2,0,0,0,0|2,0,0]=4 3687 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2F 62a_200011290836_100011215700 [0,2,0,0,0,0|2,0,0]=4 3688 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2N 62a_100000210017_200011290836 [0,2,0,0,0,0|2,0,0]=4 3689 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2N 62a_200011290836_100000210017 [0,2,0,0,0,0|2,0,0]=4 3690 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2O 62a_100000739446_200011290836 [0,2,0,0,0,0|2,0,0]=4 3691 B19R2.18959 COc1ccc(cc1C)CSc2ccccc2O 62a_200011290836_100000739446 [0,2,0,0,0,0|2,0,0]=4 3692 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2Br 62a_100000693707_100000695589 [0,2,0,0,0,0|2,0,0]=4 3693 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2Br 62a_100000695589_100000693707 [0,2,0,0,0,0|2,0,0]=4 3694 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2C 62a_100000210755_100000693707 [0,2,0,0,0,0|2,0,0]=4 3695 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2C 62a_100000693707_100000210755 [0,2,0,0,0,0|2,0,0]=4 3696 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000693707_100000764095 [0,2,0,0,0,0|2,0,0]=4 3697 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2Cl 62a_100000764095_100000693707 [0,2,0,0,0,0|2,0,0]=4 3698 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2F 62a_100000693707_100011215700 [0,2,0,0,0,0|2,0,0]=4 3699 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2F 62a_100011215700_100000693707 [0,2,0,0,0,0|2,0,0]=4 3700 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2N 62a_100000210017_100000693707 [0,2,0,0,0,0|2,0,0]=4 3701 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2N 62a_100000693707_100000210017 [0,2,0,0,0,0|2,0,0]=4 3702 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2O 62a_100000693707_100000739446 [0,2,0,0,0,0|2,0,0]=4 3703 B19R2.18959 COc1ccc(cc1Cl)CSc2ccccc2O 62a_100000739446_100000693707 [0,2,0,0,0,0|2,0,0]=4 3704 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2Br 62a_100000189595_100000695589 [0,2,0,0,0,0|2,0,0]=4 3705 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2Br 62a_100000695589_100000189595 [0,2,0,0,0,0|2,0,0]=4 3706 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2C 62a_100000189595_100000210755 [0,2,0,0,0,0|2,0,0]=4 3707 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2C 62a_100000210755_100000189595 [0,2,0,0,0,0|2,0,0]=4 3708 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2Cl 62a_100000189595_100000764095 [0,2,0,0,0,0|2,0,0]=4 3709 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2Cl 62a_100000764095_100000189595 [0,2,0,0,0,0|2,0,0]=4 3710 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2F 62a_100000189595_100011215700 [0,2,0,0,0,0|2,0,0]=4 3711 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2F 62a_100011215700_100000189595 [0,2,0,0,0,0|2,0,0]=4 3712 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2N 62a_100000189595_100000210017 [0,2,0,0,0,0|2,0,0]=4 3713 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2N 62a_100000210017_100000189595 [0,2,0,0,0,0|2,0,0]=4 3714 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2O 62a_100000189595_100000739446 [0,2,0,0,0,0|2,0,0]=4 3715 B19R2.18959 COc1ccc(cc1F)CSc2ccccc2O 62a_100000739446_100000189595 [0,2,0,0,0,0|2,0,0]=4 3716 B19R2.18959 COc1coc(cc1=O)COc2cccc[n+]2[O-] 7a_100000211761_100000081511 [0,2,0,0,0,0|1,1,0]=4 3717 B19R2.18959 COc1coc(cc1=O)COc2ccccc2Br 7a_100000181306_100000081511 [0,2,0,0,0,0|0,1,0]=3 3718 B19R2.18959 COc1coc(cc1=O)COc2ccccc2C 7a_100000210338_100000081511 [0,2,0,0,0,0|0,1,0]=3 3719 B19R2.18959 COc1coc(cc1=O)COc2ccccc2Cl 7a_100000210172_100000081511 [0,2,0,0,0,0|0,1,0]=3 3720 B19R2.18959 COc1coc(cc1=O)COc2ccccc2F 7a_100000210171_100000081511 [0,2,0,0,0,0|0,1,0]=3 3721 B19R2.18959 COc1coc(cc1=O)COc2ccccc2I 7a_100000739446_100000081511 [0,2,0,0,0,0|0,1,0]=3 3722 B19R2.18959 COc1coc(cc1=O)COc2ccccc2N 7a_100000185747_100000081511 [0,2,0,0,0,0|0,1,0]=3 3723 B19R2.18959 COc1coc(cc1=O)COc2cccnc2Br 7a_100000744436_100000081511 [0,2,0,0,0,0|1,1,0]=4 3724 B19R2.18959 COc1coc(cc1=O)COc2cccnc2C 7a_100000745507_100000081511 [0,2,0,0,0,0|1,1,0]=4 3725 B19R2.18959 COc1coc(cc1=O)COc2cccnc2Cl 7a_100000757616_100000081511 [0,2,0,0,0,0|1,1,0]=4 3726 B19R2.18959 COc1coc(cc1=O)COc2cccnc2F 7a_100000061740_100000081511 [0,2,0,0,0,0|1,1,0]=4 3727 B19R2.18959 COc1coc(cc1=O)COc2cccnc2I 7a_100000034122_100000081511 [0,2,0,0,0,0|1,1,0]=4 3728 B19R2.18959 COc1coc(cc1=O)COc2cccnc2N 7a_100000211975_100000081511 [0,2,0,0,0,0|1,1,0]=4 3729 B19R2.18959 COc1coc(cc1=O)COc2cccoc2=O 7a_100000077404_100000081511 [0,2,0,0,0,0|1,1,0]=4 3730 B19R2.18959 COc1coc(cc1=O)COc2cnccc2C 7a_100011997053_100000081511 [0,2,0,0,0,0|1,1,0]=4 3731 B19R2.18959 COc1coc(cc1=O)CSc2c[nH]ccc2=O 62a_100009998708_100000081511 [0,2,0,0,0,0|1,0,0]=3 3732 B19R2.18959 COc1coc(cc1=O)CSc2c[nH]ccc2=S 62a_200012280681_100000081511 [0,2,0,0,0,0|1,0,0]=3 3733 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2Br 62a_100000695589_100000081511 [0,2,0,0,0,0|0,0,0]=2 3734 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2C 62a_100000210755_100000081511 [0,2,0,0,0,0|0,0,0]=2 3735 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2Cl 62a_100000764095_100000081511 [0,2,0,0,0,0|0,0,0]=2 3736 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2F 62a_100011215700_100000081511 [0,2,0,0,0,0|0,0,0]=2 3737 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2N 62a_100000210017_100000081511 [0,2,0,0,0,0|0,0,0]=2 3738 B19R2.18959 COc1coc(cc1=O)CSc2ccccc2O 62a_100000739446_100000081511 [0,2,0,0,0,0|0,0,0]=2 3739 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2Br 62a_100010202626_100000081511 [0,2,0,0,0,0|1,0,0]=3 3740 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2C 62a_100000751574_100000081511 [0,2,0,0,0,0|1,0,0]=3 3741 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2Cl 62a_100000036424_100000081511 [0,2,0,0,0,0|1,0,0]=3 3742 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2F 62a_100009816115_100000081511 [0,2,0,0,0,0|1,0,0]=3 3743 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2N 62a_100000045569_100000081511 [0,2,0,0,0,0|1,0,0]=3 3744 B19R2.18959 COc1coc(cc1=O)CSc2cccnc2O 62a_100000760158_100000081511 [0,2,0,0,0,0|1,0,0]=3 3745 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2Br 62a_100000726257_100000081511 [0,2,0,0,0,0|1,0,0]=3 3746 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2C 62a_100000765111_100000081511 [0,2,0,0,0,0|1,0,0]=3 3747 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2Cl 62a_100000708259_100000081511 [0,2,0,0,0,0|1,0,0]=3 3748 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2F 62a_100000047030_100000081511 [0,2,0,0,0,0|1,0,0]=3 3749 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2N 62a_100000756074_100000081511 [0,2,0,0,0,0|1,0,0]=3 3750 B19R2.18959 COc1coc(cc1=O)CSc2ccncc2O 62a_100009817591_100000081511 [0,2,0,0,0,0|1,0,0]=3 3751 B19R2.18959 COc1coc(cc1=O)CSc2cnccc2Br 62a_100010138639_100000081511 [0,2,0,0,0,0|1,0,0]=3 3752 B19R2.18959 COc1coc(cc1=O)CSc2cnccc2C 62a_100000761580_100000081511 [0,2,0,0,0,0|1,0,0]=3 3753 B19R2.18959 COc1coc(cc1=O)CSc2cnccc2Cl 62a_100009995489_100000081511 [0,2,0,0,0,0|1,0,0]=3 3754 B19R2.18959 COc1coc(cc1=O)CSc2cnccc2F 62a_100009820683_100000081511 [0,2,0,0,0,0|1,0,0]=3 3755 B19R2.18959 COc1coc(cc1=O)CSc2cnccc2N 62a_100000047001_100000081511 [0,2,0,0,0,0|1,0,0]=3 3756 B19R2.18959 COc1coc(cc1=O)CSc2cncnc2Br 62a_200012461658_100000081511 [0,2,0,0,0,0|2,0,0]=4 3757 B19R2.18959 COc1coc(cc1=O)CSc2cncnc2C 62a_100009819671_100000081511 [0,2,0,0,0,0|2,0,0]=4 3758 B19R2.18959 COc1coc(cc1=O)CSc2cncnc2Cl 62a_100000758962_100000081511 [0,2,0,0,0,0|2,0,0]=4 3759 B19R2.18959 COc1coc(cc1=O)CSc2cncnc2N 62a_100011996079_100000081511 [0,2,0,0,0,0|2,0,0]=4 3760 B19R2.18959 COc1coc(cc1=O)CSc2cncnc2O 62a_100000751107_100000081511 [0,2,0,0,0,0|2,0,0]=4 3761 B19R2.18959 COc1coc(cc1=O)CSc2cnncc2N 62a_100009829405_100000081511 [0,2,0,0,0,0|2,0,0]=4 3762 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2Br 62a_100000696092_100000081511 [0,2,0,0,0,0|1,0,0]=3 3763 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2C 62a_100000751373_100000081511 [0,2,0,0,0,0|1,0,0]=3 3764 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2Cl 62a_100011356963_100000081511 [0,2,0,0,0,0|1,0,0]=3 3765 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2F 62a_100000685392_100000081511 [0,2,0,0,0,0|1,0,0]=3 3766 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2N 62a_100000688686_100000081511 [0,2,0,0,0,0|1,0,0]=3 3767 B19R2.18959 COc1coc(cc1=O)CSc2ncccc2O 62a_100000034122_100000081511 [0,2,0,0,0,0|1,0,0]=3 3768 B19R2.18959 COc1coc(cc1=O)CSc2nccnc2C 62a_100011999405_100000081511 [0,2,0,0,0,0|2,0,0]=4 3769 B19R2.18959 COc1coc(cc1=O)CSc2nccnc2Cl 62a_100010886584_100000081511 [0,2,0,0,0,0|2,0,0]=4 3770 B19R2.18959 COc1coc(cc1=O)CSc2nccnc2F 62a_200010125657_100000081511 [0,2,0,0,0,0|2,0,0]=4 3771 B19R2.18959 COc1coc(cc1=O)CSc2nccnc2N 62a_100000747729_100000081511 [0,2,0,0,0,0|2,0,0]=4 3772 B19R2.18959 COc1coc(cc1=O)CSc2ncncc2C 62a_100011998708_100000081511 [0,2,0,0,0,0|2,0,0]=4 3773 B19R2.18959 COc1coc(cc1=O)CSc2ncncc2F 62a_100000069762_100000081511 [0,2,0,0,0,0|2,0,0]=4 3774 B19R2.18959 COc1coc(cc1=O)CSc2ncncc2N 62a_100000709731_100000081511 [0,2,0,0,0,0|2,0,0]=4 3775 B19R2.28183 COc1ccc(cc1OC)CSc2ccccc2 62a_100000719477_100011233839 [0,2,0,0,0,0|1,0,1]=4 3776 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)Br 62a_100000691529_200011397701 [0,2,0,0,0,0|2,0,0]=4 3777 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)Br 62a_200011397701_100000691529 [0,2,0,0,0,0|2,0,0]=4 3778 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)C 62a_100011215228_200011397701 [0,2,0,0,0,0|2,0,0]=4 3779 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)C 62a_200011397701_100011215228 [0,2,0,0,0,0|2,0,0]=4 3780 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_100000699651_200011397701 [0,2,0,0,0,0|2,0,0]=4 3781 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)Cl 62a_200011397701_100000699651 [0,2,0,0,0,0|2,0,0]=4 3782 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)F 62a_100000685547_200011397701 [0,2,0,0,0,0|2,0,0]=4 3783 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)F 62a_200011397701_100000685547 [0,2,0,0,0,0|2,0,0]=4 3784 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)N 62a_100000210019_200011397701 [0,2,0,0,0,0|2,0,0]=4 3785 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)N 62a_200011397701_100000210019 [0,2,0,0,0,0|2,0,0]=4 3786 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)O 62a_200011397701_100000211634 [0,2,0,0,0,0|2,0,0]=4 3787 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_114929384022_200011397701 [0,2,0,0,0,0|2,0,0]=4 3788 B19R2.28207 COc1ccc(cc1Br)CSc2cccc(c2)[S] 62a_200011397701_114929384022 [0,2,0,0,0,0|2,0,0]=4 3789 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)Br 62a_100000691529_200011290836 [0,2,0,0,0,0|2,0,0]=4 3790 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)Br 62a_200011290836_100000691529 [0,2,0,0,0,0|2,0,0]=4 3791 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)C 62a_100011215228_200011290836 [0,2,0,0,0,0|2,0,0]=4 3792 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)C 62a_200011290836_100011215228 [0,2,0,0,0,0|2,0,0]=4 3793 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)Cl 62a_100000699651_200011290836 [0,2,0,0,0,0|2,0,0]=4 3794 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)Cl 62a_200011290836_100000699651 [0,2,0,0,0,0|2,0,0]=4 3795 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)F 62a_100000685547_200011290836 [0,2,0,0,0,0|2,0,0]=4 3796 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)F 62a_200011290836_100000685547 [0,2,0,0,0,0|2,0,0]=4 3797 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)N 62a_100000210019_200011290836 [0,2,0,0,0,0|2,0,0]=4 3798 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)N 62a_200011290836_100000210019 [0,2,0,0,0,0|2,0,0]=4 3799 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)O 62a_200011290836_100000211634 [0,2,0,0,0,0|2,0,0]=4 3800 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)[S] 62a_114929384022_200011290836 [0,2,0,0,0,0|2,0,0]=4 3801 B19R2.28207 COc1ccc(cc1C)CSc2cccc(c2)[S] 62a_200011290836_114929384022 [0,2,0,0,0,0|2,0,0]=4 3802 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100000691529_100000693707 [0,2,0,0,0,0|2,0,0]=4 3803 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)Br 62a_100000693707_100000691529 [0,2,0,0,0,0|2,0,0]=4 3804 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)C 62a_100000693707_100011215228 [0,2,0,0,0,0|2,0,0]=4 3805 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)C 62a_100011215228_100000693707 [0,2,0,0,0,0|2,0,0]=4 3806 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100000693707_100000699651 [0,2,0,0,0,0|2,0,0]=4 3807 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)Cl 62a_100000699651_100000693707 [0,2,0,0,0,0|2,0,0]=4 3808 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)F 62a_100000685547_100000693707 [0,2,0,0,0,0|2,0,0]=4 3809 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)F 62a_100000693707_100000685547 [0,2,0,0,0,0|2,0,0]=4 3810 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)N 62a_100000210019_100000693707 [0,2,0,0,0,0|2,0,0]=4 3811 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)N 62a_100000693707_100000210019 [0,2,0,0,0,0|2,0,0]=4 3812 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)O 62a_100000693707_100000211634 [0,2,0,0,0,0|2,0,0]=4 3813 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_100000693707_114929384022 [0,2,0,0,0,0|2,0,0]=4 3814 B19R2.28207 COc1ccc(cc1Cl)CSc2cccc(c2)[S] 62a_114929384022_100000693707 [0,2,0,0,0,0|2,0,0]=4 3815 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)Br 62a_100000189595_100000691529 [0,2,0,0,0,0|2,0,0]=4 3816 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)Br 62a_100000691529_100000189595 [0,2,0,0,0,0|2,0,0]=4 3817 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)C 62a_100000189595_100011215228 [0,2,0,0,0,0|2,0,0]=4 3818 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)C 62a_100011215228_100000189595 [0,2,0,0,0,0|2,0,0]=4 3819 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100000189595_100000699651 [0,2,0,0,0,0|2,0,0]=4 3820 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)Cl 62a_100000699651_100000189595 [0,2,0,0,0,0|2,0,0]=4 3821 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)F 62a_100000189595_100000685547 [0,2,0,0,0,0|2,0,0]=4 3822 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)F 62a_100000685547_100000189595 [0,2,0,0,0,0|2,0,0]=4 3823 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)N 62a_100000189595_100000210019 [0,2,0,0,0,0|2,0,0]=4 3824 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)N 62a_100000210019_100000189595 [0,2,0,0,0,0|2,0,0]=4 3825 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)O 62a_100000189595_100000211634 [0,2,0,0,0,0|2,0,0]=4 3826 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)[S] 62a_100000189595_114929384022 [0,2,0,0,0,0|2,0,0]=4 3827 B19R2.28207 COc1ccc(cc1F)CSc2cccc(c2)[S] 62a_114929384022_100000189595 [0,2,0,0,0,0|2,0,0]=4 3828 B19R2.28207 COc1coc(cc1=O)CNc2cccc(c2)C 2230a_100000188690_100000081511 [0,2,0,0,0,0|1,0,0]=3 3829 B19R2.28207 COc1coc(cc1=O)COc2ccc[n+](c2)[O-] 7a_100000039713_100000081511 [0,2,0,0,0,0|1,1,0]=4 3830 B19R2.28207 COc1coc(cc1=O)COc2cccc(c2)Br 7a_100000210342_100000081511 [0,2,0,0,0,0|0,1,0]=3 3831 B19R2.28207 COc1coc(cc1=O)COc2cccc(c2)C 7a_100000210337_100000081511 [0,2,0,0,0,0|0,1,0]=3 3832 B19R2.28207 COc1coc(cc1=O)COc2cccc(c2)Cl 7a_100000210295_100000081511 [0,2,0,0,0,0|0,1,0]=3 3833 B19R2.28207 COc1coc(cc1=O)COc2cccc(c2)F 7a_100000210426_100000081511 [0,2,0,0,0,0|0,1,0]=3 3834 B19R2.28207 COc1coc(cc1=O)COc2cccc(c2)I 7a_100000211634_100000081511 [0,2,0,0,0,0|0,1,0]=3 3835 B19R2.28207 COc1coc(cc1=O)COc2cncc(c2)Br 7a_100000754920_100000081511 [0,2,0,0,0,0|1,1,0]=4 3836 B19R2.28207 COc1coc(cc1=O)COc2cncc(c2)C 7a_100011830280_100000081511 [0,2,0,0,0,0|1,1,0]=4 3837 B19R2.28207 COc1coc(cc1=O)COc2cncc(c2)Cl 7a_100000032511_100000081511 [0,2,0,0,0,0|1,1,0]=4 3838 B19R2.28207 COc1coc(cc1=O)COc2cncc(c2)F 7a_100011830296_100000081511 [0,2,0,0,0,0|1,1,0]=4 3839 B19R2.28207 COc1coc(cc1=O)CSc2cc(=O)[nH]cn2 62a_100012002517_100000081511 [0,2,0,0,0,0|2,0,0]=4 3840 B19R2.28207 COc1coc(cc1=O)CSc2cc(=O)cc[nH]2 62a_100009817434_100000081511 [0,2,0,0,0,0|1,0,0]=3 3841 B19R2.28207 COc1coc(cc1=O)CSc2cc(ccn2)C 62a_100000750283_100000081511 [0,2,0,0,0,0|1,0,0]=3 3842 B19R2.28207 COc1coc(cc1=O)CSc2cc(ccn2)Cl 62a_100010167805_100000081511 [0,2,0,0,0,0|1,0,0]=3 3843 B19R2.28207 COc1coc(cc1=O)CSc2cc(ccn2)F 62a_100000764206_100000081511 [0,2,0,0,0,0|1,0,0]=3 3844 B19R2.28207 COc1coc(cc1=O)CSc2cc(ccn2)N 62a_100009814236_100000081511 [0,2,0,0,0,0|1,0,0]=3 3845 B19R2.28207 COc1coc(cc1=O)CSc2cc(cnn2)C 62a_100000070100_100000081511 [0,2,0,0,0,0|2,0,0]=4 3846 B19R2.28207 COc1coc(cc1=O)CSc2cc(cnn2)N 62a_100011996757_100000081511 [0,2,0,0,0,0|2,0,0]=4 3847 B19R2.28207 COc1coc(cc1=O)CSc2cc(ncn2)C 62a_100000744208_100000081511 [0,2,0,0,0,0|2,0,0]=4 3848 B19R2.28207 COc1coc(cc1=O)CSc2cc(ncn2)Cl 62a_100010161198_100000081511 [0,2,0,0,0,0|2,0,0]=4 3849 B19R2.28207 COc1coc(cc1=O)CSc2cc(ncn2)F 62a_200009880791_100000081511 [0,2,0,0,0,0|2,0,0]=4 3850 B19R2.28207 COc1coc(cc1=O)CSc2cc(ncn2)N 62a_100000701291_100000081511 [0,2,0,0,0,0|2,0,0]=4 3851 B19R2.28207 COc1coc(cc1=O)CSc2cc[nH]c(=O)c2 62a_100009816521_100000081511 [0,2,0,0,0,0|1,0,0]=3 3852 B19R2.28207 COc1coc(cc1=O)CSc2ccc[n+](c2)C 62a_100009996589_100000081511 [0,2,0,0,0,0|1,0,0]=3 3853 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)Br 62a_100000691529_100000081511 [0,2,0,0,0,0|0,0,0]=2 3854 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)C 62a_100011215228_100000081511 [0,2,0,0,0,0|0,0,0]=2 3855 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)Cl 62a_100000699651_100000081511 [0,2,0,0,0,0|0,0,0]=2 3856 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)F 62a_100000685547_100000081511 [0,2,0,0,0,0|0,0,0]=2 3857 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)N 62a_100000210019_100000081511 [0,2,0,0,0,0|0,0,0]=2 3858 B19R2.28207 COc1coc(cc1=O)CSc2cccc(c2)[S] 62a_114929384022_100000081511 [0,2,0,0,0,0|0,0,0]=2 3859 B19R2.28207 COc1coc(cc1=O)CSc2cccc(n2)Br 62a_100000684672_100000081511 [0,2,0,0,0,0|1,0,0]=3 3860 B19R2.28207 COc1coc(cc1=O)CSc2cccc(n2)C 62a_100000742759_100000081511 [0,2,0,0,0,0|1,0,0]=3 3861 B19R2.28207 COc1coc(cc1=O)CSc2cccc(n2)Cl 62a_100000051397_100000081511 [0,2,0,0,0,0|1,0,0]=3 3862 B19R2.28207 COc1coc(cc1=O)CSc2cccc(n2)F 62a_100009815982_100000081511 [0,2,0,0,0,0|1,0,0]=3 3863 B19R2.28207 COc1coc(cc1=O)CSc2cccc(n2)N 62a_100000740741_100000081511 [0,2,0,0,0,0|1,0,0]=3 3864 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(c2)Br 62a_100009814637_100000081511 [0,2,0,0,0,0|1,0,0]=3 3865 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(c2)C 62a_100000758586_100000081511 [0,2,0,0,0,0|1,0,0]=3 3866 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(c2)Cl 62a_100000035001_100000081511 [0,2,0,0,0,0|1,0,0]=3 3867 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(c2)F 62a_100009816116_100000081511 [0,2,0,0,0,0|1,0,0]=3 3868 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(c2)N 62a_100000049665_100000081511 [0,2,0,0,0,0|1,0,0]=3 3869 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(n2)C 62a_100000749937_100000081511 [0,2,0,0,0,0|2,0,0]=4 3870 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(n2)Cl 62a_100010154678_100000081511 [0,2,0,0,0,0|2,0,0]=4 3871 B19R2.28207 COc1coc(cc1=O)CSc2ccnc(n2)N 62a_100000055538_100000081511 [0,2,0,0,0,0|2,0,0]=4 3872 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)Br 62a_100000728054_100000081511 [0,2,0,0,0,0|1,0,0]=3 3873 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)C 62a_100000760492_100000081511 [0,2,0,0,0,0|1,0,0]=3 3874 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)Cl 62a_100000049639_100000081511 [0,2,0,0,0,0|1,0,0]=3 3875 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)F 62a_100000744099_100000081511 [0,2,0,0,0,0|1,0,0]=3 3876 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)N 62a_100000687067_100000081511 [0,2,0,0,0,0|1,0,0]=3 3877 B19R2.28207 COc1coc(cc1=O)CSc2cncc(c2)O 62a_100000754920_100000081511 [0,2,0,0,0,0|1,0,0]=3 3878 B19R2.28207 COc1coc(cc1=O)CSc2cncc(n2)C 62a_100000754123_100000081511 [0,2,0,0,0,0|2,0,0]=4 3879 B19R2.28207 COc1coc(cc1=O)CSc2cncc(n2)Cl 62a_100010892449_100000081511 [0,2,0,0,0,0|2,0,0]=4 3880 B19R2.28207 COc1coc(cc1=O)CSc2cncc(n2)F 62a_200009863489_100000081511 [0,2,0,0,0,0|2,0,0]=4 3881 B19R2.28207 COc1coc(cc1=O)CSc2cncc(n2)N 62a_100000747728_100000081511 [0,2,0,0,0,0|2,0,0]=4 3882 B19R2.28207 COc1coc(cc1=O)CSc2cnnc(c2)N 62a_100000130277_100000081511 [0,2,0,0,0,0|2,0,0]=4 3883 B19R2.28207 COc1coc(cc1=O)CSc2nccc(n2)C 62a_100011243806_100000081511 [0,2,0,0,0,0|2,0,0]=4 3884 B19R2.28207 COc1coc(cc1=O)CSc2nccc(n2)N 62a_100000757536_100000081511 [0,2,0,0,0,0|2,0,0]=4 3885 B19R2.28434 COc1ccc(c(c1F)F)CSc2ccccc2 62a_100000719477_100009814551 [0,2,0,0,0,0|2,0,0]=4 3886 B19R2.28434 COc1ccc(c(c1F)F)CSc2ccccc2 62a_100009814551_100000041952 [0,2,0,0,0,0|2,0,0]=4 3887 B19R2.43094 COc1c(cc(cc1Cl)CSc2ccccc2)F 62a_100000719477_100009815999 [0,2,0,0,0,0|2,0,0]=4 3888 B19R2.43094 COc1c(cc(cc1Cl)CSc2ccccc2)F 62a_100009815999_100000041952 [0,2,0,0,0,0|2,0,0]=4 3889 B19R2.43094 COc1c(cc(cc1F)CSc2ccccc2)F 62a_100000719477_100011830405 [0,2,0,0,0,0|2,0,0]=4 3890 B19R2.43094 COc1c(cc(cc1F)CSc2ccccc2)F 62a_100011830405_100000041952 [0,2,0,0,0,0|2,0,0]=4 3891 B19R2.2847 Cc1ccc(cc1)OCc2ccc(c(c2)C=O)O 7a_100000210336_100000008128 [0,2,0,0,0,0|1,1,0]=4 3892 B19R2.2847 Cc1ccc(cc1)SCc2ccc(c(c2)C=O)O 62a_100000186775_100000008128 [0,2,0,0,0,0|1,0,0]=3 3893 B19R2.2847 Cc1ccc(cn1)SCc2ccc(c(c2)C=O)O 62a_100000751577_100000008128 [0,2,0,0,0,0|2,0,0]=4 3894 B19R2.2847 Cc1ccc(nc1)SCc2ccc(c(c2)C=O)O 62a_100011192072_100000008128 [0,2,0,0,0,0|2,0,0]=4 3895 B19R2.2847 Nc1ccc(cc1)SCc2ccc(c(c2)C=O)O 62a_100000185761_100000008128 [0,2,0,0,0,0|1,0,0]=3 3896 B19R2.2847 Nc1ccc(cn1)SCc2ccc(c(c2)C=O)O 62a_100000187370_100000008128 [0,2,0,0,0,0|2,0,0]=4 3897 B19R2.2847 Nc1ccc(nc1)SCc2ccc(c(c2)C=O)O 62a_100000737798_100000008128 [0,2,0,0,0,0|2,0,0]=4 3898 B19R2.2847 O=Cc1cc(ccc1O)COc2ccc(cc2)Br 7a_100000185759_100000008128 [0,2,0,0,0,0|1,1,0]=4 3899 B19R2.2847 O=Cc1cc(ccc1O)COc2ccc(cc2)Cl 7a_100000210216_100000008128 [0,2,0,0,0,0|1,1,0]=4 3900 B19R2.2847 O=Cc1cc(ccc1O)COc2ccc(cc2)I 7a_100000212066_100000008128 [0,2,0,0,0,0|1,1,0]=4 3901 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(=O)[nH]c2 62a_100000212171_100000008128 [0,2,0,0,0,0|2,0,0]=4 3902 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cc2)Br 62a_100000752885_100000008128 [0,2,0,0,0,0|1,0,0]=3 3903 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cc2)Cl 62a_100000755918_100000008128 [0,2,0,0,0,0|1,0,0]=3 3904 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cc2)F 62a_100000211213_100000008128 [0,2,0,0,0,0|1,0,0]=3 3905 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cn2)Br 62a_100000686858_100000008128 [0,2,0,0,0,0|2,0,0]=4 3906 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cn2)Cl 62a_100011356976_100000008128 [0,2,0,0,0,0|2,0,0]=4 3907 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cn2)F 62a_100000744514_100000008128 [0,2,0,0,0,0|2,0,0]=4 3908 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(cn2)O 62a_100000685995_100000008128 [0,2,0,0,0,0|2,0,0]=4 3909 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(nc2)Br 62a_100009814638_100000008128 [0,2,0,0,0,0|2,0,0]=4 3910 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(nc2)Cl 62a_100000034144_100000008128 [0,2,0,0,0,0|2,0,0]=4 3911 B19R2.2847 O=Cc1cc(ccc1O)CSc2ccc(nc2)F 62a_100000042367_100000008128 [0,2,0,0,0,0|2,0,0]=4 3912 B19R2.2862 C[n+]1cccc(c1)SCc2ccc(c(c2)C=O)O 62a_100009996589_100000008128 [0,2,0,0,0,0|2,0,0]=4 3913 B19R2.2862 Cc1cc(ccn1)SCc2ccc(c(c2)C=O)O 62a_100000758586_100000008128 [0,2,0,0,0,0|2,0,0]=4 3914 B19R2.2862 Cc1cccc(c1)OCc2ccc(c(c2)C=O)O 7a_100000210337_100000008128 [0,2,0,0,0,0|1,1,0]=4 3915 B19R2.2862 Cc1cccc(c1)SCc2ccc(c(c2)C=O)O 62a_100011215228_100000008128 [0,2,0,0,0,0|1,0,0]=3 3916 B19R2.2862 Cc1cccc(n1)SCc2ccc(c(c2)C=O)O 62a_100000742759_100000008128 [0,2,0,0,0,0|2,0,0]=4 3917 B19R2.2862 Cc1ccnc(c1)SCc2ccc(c(c2)C=O)O 62a_100000750283_100000008128 [0,2,0,0,0,0|2,0,0]=4 3918 B19R2.2862 Cc1cncc(c1)SCc2ccc(c(c2)C=O)O 62a_100000760492_100000008128 [0,2,0,0,0,0|2,0,0]=4 3919 B19R2.2862 Nc1cc(ccn1)SCc2ccc(c(c2)C=O)O 62a_100000049665_100000008128 [0,2,0,0,0,0|2,0,0]=4 3920 B19R2.2862 Nc1cccc(c1)SCc2ccc(c(c2)C=O)O 62a_100000210019_100000008128 [0,2,0,0,0,0|1,0,0]=3 3921 B19R2.2862 Nc1cccc(n1)SCc2ccc(c(c2)C=O)O 62a_100000740741_100000008128 [0,2,0,0,0,0|2,0,0]=4 3922 B19R2.2862 Nc1ccnc(c1)SCc2ccc(c(c2)C=O)O 62a_100009814236_100000008128 [0,2,0,0,0,0|2,0,0]=4 3923 B19R2.2862 Nc1cncc(c1)SCc2ccc(c(c2)C=O)O 62a_100000687067_100000008128 [0,2,0,0,0,0|2,0,0]=4 3924 B19R2.2862 O=Cc1cc(ccc1O)COc2cccc(c2)Br 7a_100000210342_100000008128 [0,2,0,0,0,0|1,1,0]=4 3925 B19R2.2862 O=Cc1cc(ccc1O)COc2cccc(c2)Cl 7a_100000210295_100000008128 [0,2,0,0,0,0|1,1,0]=4 3926 B19R2.2862 O=Cc1cc(ccc1O)COc2cccc(c2)F 7a_100000210426_100000008128 [0,2,0,0,0,0|1,1,0]=4 3927 B19R2.2862 O=Cc1cc(ccc1O)COc2cccc(c2)I 7a_100000211634_100000008128 [0,2,0,0,0,0|1,1,0]=4 3928 B19R2.2862 O=Cc1cc(ccc1O)CSc2cc(=O)cc[nH]2 62a_100009817434_100000008128 [0,2,0,0,0,0|2,0,0]=4 3929 B19R2.2862 O=Cc1cc(ccc1O)CSc2cc(ccn2)Cl 62a_100010167805_100000008128 [0,2,0,0,0,0|2,0,0]=4 3930 B19R2.2862 O=Cc1cc(ccc1O)CSc2cc(ccn2)F 62a_100000764206_100000008128 [0,2,0,0,0,0|2,0,0]=4 3931 B19R2.2862 O=Cc1cc(ccc1O)CSc2cc[nH]c(=O)c2 62a_100009816521_100000008128 [0,2,0,0,0,0|2,0,0]=4 3932 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(c2)Br 62a_100000691529_100000008128 [0,2,0,0,0,0|1,0,0]=3 3933 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(c2)Cl 62a_100000699651_100000008128 [0,2,0,0,0,0|1,0,0]=3 3934 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(c2)F 62a_100000685547_100000008128 [0,2,0,0,0,0|1,0,0]=3 3935 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(c2)[S] 62a_114929384022_100000008128 [0,2,0,0,0,0|1,0,0]=3 3936 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(n2)Br 62a_100000684672_100000008128 [0,2,0,0,0,0|2,0,0]=4 3937 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(n2)Cl 62a_100000051397_100000008128 [0,2,0,0,0,0|2,0,0]=4 3938 B19R2.2862 O=Cc1cc(ccc1O)CSc2cccc(n2)F 62a_100009815982_100000008128 [0,2,0,0,0,0|2,0,0]=4 3939 B19R2.2862 O=Cc1cc(ccc1O)CSc2ccnc(c2)Br 62a_100009814637_100000008128 [0,2,0,0,0,0|2,0,0]=4 3940 B19R2.2862 O=Cc1cc(ccc1O)CSc2ccnc(c2)Cl 62a_100000035001_100000008128 [0,2,0,0,0,0|2,0,0]=4 3941 B19R2.2862 O=Cc1cc(ccc1O)CSc2ccnc(c2)F 62a_100009816116_100000008128 [0,2,0,0,0,0|2,0,0]=4 3942 B19R2.2862 O=Cc1cc(ccc1O)CSc2cncc(c2)Br 62a_100000728054_100000008128 [0,2,0,0,0,0|2,0,0]=4 3943 B19R2.2862 O=Cc1cc(ccc1O)CSc2cncc(c2)Cl 62a_100000049639_100000008128 [0,2,0,0,0,0|2,0,0]=4 3944 B19R2.2862 O=Cc1cc(ccc1O)CSc2cncc(c2)F 62a_100000744099_100000008128 [0,2,0,0,0,0|2,0,0]=4 3945 B19R2.2862 O=Cc1cc(ccc1O)CSc2cncc(c2)O 62a_100000754920_100000008128 [0,2,0,0,0,0|2,0,0]=4 3946 B19R2.12418 O=[N+]([O-])c1cc(ccc1Br)CSc2ccccc2 62a_100000693152_100000041952 [0,2,0,0,0,0|2,0,0]=4 3947 B19R2.12418 O=[N+]([O-])c1cc(ccc1F)CSc2ccccc2 62a_100009816672_100000041952 [0,2,0,0,0,0|2,0,0]=4 3948 B19R2.12418 O=[N+]([O-])c1cc(ccc1O)COc2ccccc2 7a_100000210340_100010149780 [0,2,0,0,0,0|1,1,0]=4 3949 B19R2.22071 Cc1ccccc1OCc2ccc(c(c2)C=O)O 7a_100000210338_100000008128 [0,2,0,0,0,0|1,1,0]=4 3950 B19R2.22071 Cc1ccccc1SCc2ccc(c(c2)C=O)O 62a_100000210755_100000008128 [0,2,0,0,0,0|1,0,0]=3 3951 B19R2.22071 Cc1cccnc1SCc2ccc(c(c2)C=O)O 62a_100000751373_100000008128 [0,2,0,0,0,0|2,0,0]=4 3952 B19R2.22071 Cc1ccncc1SCc2ccc(c(c2)C=O)O 62a_100000761580_100000008128 [0,2,0,0,0,0|2,0,0]=4 3953 B19R2.22071 Cc1cnccc1SCc2ccc(c(c2)C=O)O 62a_100000765111_100000008128 [0,2,0,0,0,0|2,0,0]=4 3954 B19R2.22071 Cc1ncccc1SCc2ccc(c(c2)C=O)O 62a_100000751574_100000008128 [0,2,0,0,0,0|2,0,0]=4 3955 B19R2.22071 Nc1ccccc1OCc2ccc(c(c2)C=O)O 7a_100000185747_100000008128 [0,2,0,0,0,0|1,1,0]=4 3956 B19R2.22071 Nc1ccccc1SCc2ccc(c(c2)C=O)O 62a_100000210017_100000008128 [0,2,0,0,0,0|1,0,0]=3 3957 B19R2.22071 Nc1cccnc1SCc2ccc(c(c2)C=O)O 62a_100000688686_100000008128 [0,2,0,0,0,0|2,0,0]=4 3958 B19R2.22071 Nc1ccncc1SCc2ccc(c(c2)C=O)O 62a_100000047001_100000008128 [0,2,0,0,0,0|2,0,0]=4 3959 B19R2.22071 Nc1cnccc1SCc2ccc(c(c2)C=O)O 62a_100000756074_100000008128 [0,2,0,0,0,0|2,0,0]=4 3960 B19R2.22071 Nc1ncccc1SCc2ccc(c(c2)C=O)O 62a_100000045569_100000008128 [0,2,0,0,0,0|2,0,0]=4 3961 B19R2.22071 O=Cc1cc(ccc1O)COc2ccccc2Br 7a_100000181306_100000008128 [0,2,0,0,0,0|1,1,0]=4 3962 B19R2.22071 O=Cc1cc(ccc1O)COc2ccccc2Cl 7a_100000210172_100000008128 [0,2,0,0,0,0|1,1,0]=4 3963 B19R2.22071 O=Cc1cc(ccc1O)COc2ccccc2F 7a_100000210171_100000008128 [0,2,0,0,0,0|1,1,0]=4 3964 B19R2.22071 O=Cc1cc(ccc1O)COc2ccccc2I 7a_100000739446_100000008128 [0,2,0,0,0,0|1,1,0]=4 3965 B19R2.22071 O=Cc1cc(ccc1O)CSc2c[nH]ccc2=O 62a_100009998708_100000008128 [0,2,0,0,0,0|2,0,0]=4 3966 B19R2.22071 O=Cc1cc(ccc1O)CSc2c[nH]ccc2=S 62a_200012280681_100000008128 [0,2,0,0,0,0|2,0,0]=4 3967 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccccc2Br 62a_100000695589_100000008128 [0,2,0,0,0,0|1,0,0]=3 3968 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccccc2Cl 62a_100000764095_100000008128 [0,2,0,0,0,0|1,0,0]=3 3969 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccccc2F 62a_100011215700_100000008128 [0,2,0,0,0,0|1,0,0]=3 3970 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccccc2O 62a_100000739446_100000008128 [0,2,0,0,0,0|1,0,0]=3 3971 B19R2.22071 O=Cc1cc(ccc1O)CSc2cccnc2Br 62a_100010202626_100000008128 [0,2,0,0,0,0|2,0,0]=4 3972 B19R2.22071 O=Cc1cc(ccc1O)CSc2cccnc2Cl 62a_100000036424_100000008128 [0,2,0,0,0,0|2,0,0]=4 3973 B19R2.22071 O=Cc1cc(ccc1O)CSc2cccnc2F 62a_100009816115_100000008128 [0,2,0,0,0,0|2,0,0]=4 3974 B19R2.22071 O=Cc1cc(ccc1O)CSc2cccnc2O 62a_100000760158_100000008128 [0,2,0,0,0,0|2,0,0]=4 3975 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccncc2Br 62a_100000726257_100000008128 [0,2,0,0,0,0|2,0,0]=4 3976 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccncc2Cl 62a_100000708259_100000008128 [0,2,0,0,0,0|2,0,0]=4 3977 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccncc2F 62a_100000047030_100000008128 [0,2,0,0,0,0|2,0,0]=4 3978 B19R2.22071 O=Cc1cc(ccc1O)CSc2ccncc2O 62a_100009817591_100000008128 [0,2,0,0,0,0|2,0,0]=4 3979 B19R2.22071 O=Cc1cc(ccc1O)CSc2cnccc2Br 62a_100010138639_100000008128 [0,2,0,0,0,0|2,0,0]=4 3980 B19R2.22071 O=Cc1cc(ccc1O)CSc2cnccc2Cl 62a_100009995489_100000008128 [0,2,0,0,0,0|2,0,0]=4 3981 B19R2.22071 O=Cc1cc(ccc1O)CSc2cnccc2F 62a_100009820683_100000008128 [0,2,0,0,0,0|2,0,0]=4 3982 B19R2.22071 O=Cc1cc(ccc1O)CSc2ncccc2Br 62a_100000696092_100000008128 [0,2,0,0,0,0|2,0,0]=4 3983 B19R2.22071 O=Cc1cc(ccc1O)CSc2ncccc2Cl 62a_100011356963_100000008128 [0,2,0,0,0,0|2,0,0]=4 3984 B19R2.22071 O=Cc1cc(ccc1O)CSc2ncccc2F 62a_100000685392_100000008128 [0,2,0,0,0,0|2,0,0]=4 3985 B19R2.22071 O=Cc1cc(ccc1O)CSc2ncccc2O 62a_100000034122_100000008128 [0,2,0,0,0,0|2,0,0]=4 3986 B19R2.4993 C=Cc1ccc(cc1)OCc2cc(=O)c(co2)O 7a_100000189437_100000010605 [0,2,0,0,0,0|0,1,0]=3 3987 B19R2.4993 C=Cc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100000748128_100000010605 [0,2,0,0,0,0|0,0,0]=2 3988 B19R2.4993 C=Cc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_103436540071_100000010605 [0,2,0,0,0,0|1,0,0]=3 3989 B19R2.4993 C=Cc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_200000143982_100000010605 [0,2,0,0,0,0|2,0,0]=4 3990 B19R2.4993 C=Cc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100010269754_100000010605 [0,2,0,0,0,0|2,0,0]=4 3991 B19R2.4993 CCc1ccc(cc1)NCc2cc(=O)c(co2)O 2230a_100000211069_100000010605 [0,2,0,0,0,0|1,0,0]=3 3992 B19R2.4993 CCc1ccc(cc1)OCc2cc(=O)c(co2)O 7a_100000211359_100000010605 [0,2,0,0,0,0|0,1,0]=3 3993 B19R2.4993 CCc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100011215824_100000010605 [0,2,0,0,0,0|0,0,0]=2 3994 B19R2.4993 CCc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100009820025_100000010605 [0,2,0,0,0,0|1,0,0]=3 3995 B19R2.4993 CCc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100009843584_100000010605 [0,2,0,0,0,0|1,0,0]=3 3996 B19R2.4993 CCc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000033099_100000010605 [0,2,0,0,0,0|2,0,0]=4 3997 B19R2.4993 CNc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100000743151_100000010605 [0,2,0,0,0,0|0,0,0]=2 3998 B19R2.4993 CNc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000741341_100000010605 [0,2,0,0,0,0|1,0,0]=3 3999 B19R2.4993 CNc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000764248_100000010605 [0,2,0,0,0,0|1,0,0]=3 4000 B19R2.4993 CNc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100000215272_100000010605 [0,2,0,0,0,0|2,0,0]=4 4001 B19R2.4993 CNc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100012000640_100000010605 [0,2,0,0,0,0|2,0,0]=4 4002 B19R2.4993 CNc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100000697329_100000010605 [0,2,0,0,0,0|2,0,0]=4 4003 B19R2.4993 COc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000047065_100000010605 [0,2,0,0,0,0|1,0,0]=3 4004 B19R2.4993 COc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000755202_100000010605 [0,2,0,0,0,0|1,0,0]=3 4005 B19R2.4993 COc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100009819040_100000010605 [0,2,0,0,0,0|2,0,0]=4 4006 B19R2.4993 COc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100011998698_100000010605 [0,2,0,0,0,0|2,0,0]=4 4007 B19R2.4993 COc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000069167_100000010605 [0,2,0,0,0,0|2,0,0]=4 4008 B19R2.4993 COc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100000686852_100000010605 [0,2,0,0,0,0|2,0,0]=4 4009 B19R2.4993 CSc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100011263217_100000010605 [0,2,0,0,0,0|0,0,0]=2 4010 B19R2.4993 CSc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100011408404_100000010605 [0,2,0,0,0,0|1,0,0]=3 4011 B19R2.4993 CSc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100009820866_100000010605 [0,2,0,0,0,0|1,0,0]=3 4012 B19R2.4993 CSc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_200012356277_100000010605 [0,2,0,0,0,0|2,0,0]=4 4013 B19R2.4993 CSc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000718988_100000010605 [0,2,0,0,0,0|2,0,0]=4 4014 B19R2.4993 CSc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100000722549_100000010605 [0,2,0,0,0,0|2,0,0]=4 4015 B19R2.4993 N#Cc1ccc(cc1)OCc2cc(=O)c(co2)O 7a_100000210344_100000010605 [0,2,0,0,0,0|0,1,0]=3 4016 B19R2.4993 N#Cc1ccc(cn1)OCc2cc(=O)c(co2)O 7a_100011934750_100000010605 [0,2,0,0,0,0|1,1,0]=4 4017 B19R2.4993 NCc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100016989417_100000010605 [0,2,0,0,0,0|0,0,0]=2 4018 B19R2.4993 NCc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100015188789_100000010605 [0,2,0,0,0,0|1,0,0]=3 4019 B19R2.4993 NCc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000735879_100000010605 [0,2,0,0,0,0|1,0,0]=3 4020 B19R2.4993 NCc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_200016993442_100000010605 [0,2,0,0,0,0|2,0,0]=4 4021 B19R2.4993 NNc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100016988836_100000010605 [0,2,0,0,0,0|0,0,0]=2 4022 B19R2.4993 NNc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000750576_100000010605 [0,2,0,0,0,0|1,0,0]=3 4023 B19R2.4993 NNc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000755011_100000010605 [0,2,0,0,0,0|1,0,0]=3 4024 B19R2.4993 NNc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100000182438_100000010605 [0,2,0,0,0,0|2,0,0]=4 4025 B19R2.4993 NNc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100000121042_100000010605 [0,2,0,0,0,0|2,0,0]=4 4026 B19R2.4993 NNc1ncc(cn1)SCc2cc(=O)c(co2)O 62a_100011203108_100000010605 [0,2,0,0,0,0|2,0,0]=4 4027 B19R2.4993 O=Cc1ccc(cc1)SCc2cc(=O)c(co2)O 62a_100000188517_100000010605 [0,2,0,0,0,0|0,0,0]=2 4028 B19R2.4993 O=Cc1ccc(cn1)SCc2cc(=O)c(co2)O 62a_100000754260_100000010605 [0,2,0,0,0,0|1,0,0]=3 4029 B19R2.4993 O=Cc1ccc(nc1)SCc2cc(=O)c(co2)O 62a_100000766901_100000010605 [0,2,0,0,0,0|1,0,0]=3 4030 B19R2.4993 O=Cc1ccc(nn1)SCc2cc(=O)c(co2)O 62a_100000044651_100000010605 [0,2,0,0,0,0|2,0,0]=4 4031 B19R2.4993 O=Cc1cnc(cn1)SCc2cc(=O)c(co2)O 62a_100012001714_100000010605 [0,2,0,0,0,0|2,0,0]=4 4032 B19R2.4993 O=Cc1cnc(nc1)SCc2cc(=O)c(co2)O 62a_100000070856_100000010605 [0,2,0,0,0,0|2,0,0]=4 4033 B19R2.4993 O=c1cc(occ1O)CNc2ccc(cc2)CO 2230a_100011215238_100000010605 [0,2,0,0,0,0|1,0,0]=3 4034 B19R2.4993 O=c1cc(occ1O)CSc2ccc(cc2)CF 62a_100010268989_100000010605 [0,2,0,0,0,0|0,0,0]=2 4035 B19R2.4993 O=c1cc(occ1O)CSc2ccc(cc2)CO 62a_100000690907_100000010605 [0,2,0,0,0,0|0,0,0]=2 4036 B19R2.4993 O=c1cc(occ1O)CSc2ccc(cn2)CO 62a_100009816760_100000010605 [0,2,0,0,0,0|1,0,0]=3 4037 B19R2.4993 O=c1cc(occ1O)CSc2ccc(nc2)CO 62a_100000754261_100000010605 [0,2,0,0,0,0|1,0,0]=3 4038 B19R2.4993 O=c1cc(occ1O)CSc2cnc(cn2)CO 62a_100012002382_100000010605 [0,2,0,0,0,0|2,0,0]=4 4039 B19R2.4993 O=c1cc(occ1O)CSc2cnc(nc2)CO 62a_100009867226_100000010605 [0,2,0,0,0,0|2,0,0]=4 4040 B19R2.4993 O=c1cc(occ1O)CSc2ncc(cn2)CO 62a_100009855073_100000010605 [0,2,0,0,0,0|2,0,0]=4 4041 B19R2.51035 Cc1cc(c(cn1)OCc2cc(=O)c(co2)O)Br 7a_100009843476_100000010605 [0,2,0,0,0,0|1,1,0]=4 4042 B19R2.51035 Cc1cc(c(cn1)OCc2cc(=O)c(co2)O)C 7a_200000068632_100000010605 [0,2,0,0,0,0|1,1,0]=4 4043 B19R2.51035 Cc1cc(c(cn1)SCc2cc(=O)c(co2)O)C 62a_100009819613_100000010605 [0,2,0,0,0,0|1,0,0]=3 4044 B19R2.51035 Cc1cc(c(cn1)SCc2cc(=O)c(co2)O)N 62a_100009817891_100000010605 [0,2,0,0,0,0|1,0,0]=3 4045 B19R2.51035 Cc1cc(c(cn1)SCc2cc(=O)c(co2)O)O 62a_100011016184_100000010605 [0,2,0,0,0,0|1,0,0]=3 4046 B19R2.51035 Cc1cc(ccc1NCc2cc(=O)c(co2)O)Br 7a_100000211769_100000010605 [0,2,0,0,0,0|1,0,0]=3 4047 B19R2.51035 Cc1cc(ccc1NCc2cc(=O)c(co2)O)Cl 7a_100000210418_100000010605 [0,2,0,0,0,0|1,0,0]=3 4048 B19R2.51035 Cc1cc(ccc1NCc2cc(=O)c(co2)O)F 7a_100000211637_100000010605 [0,2,0,0,0,0|1,0,0]=3 4049 B19R2.51035 Cc1cc(ccc1NCc2cc(=O)c(co2)O)I 7a_100000184554_100000010605 [0,2,0,0,0,0|1,0,0]=3 4050 B19R2.51035 Cc1cc(ccc1OCc2cc(=O)c(co2)O)Br 7a_100000186361_100000010605 [0,2,0,0,0,0|0,1,0]=3 4051 B19R2.51035 Cc1cc(ccc1OCc2cc(=O)c(co2)O)Cl 7a_100000211091_100000010605 [0,2,0,0,0,0|0,1,0]=3 4052 B19R2.51035 Cc1cc(ccc1OCc2cc(=O)c(co2)O)F 7a_100000764316_100000010605 [0,2,0,0,0,0|0,1,0]=3 4053 B19R2.51035 Cc1cc(ccc1OCc2cc(=O)c(co2)O)I 7a_100011218673_100000010605 [0,2,0,0,0,0|0,1,0]=3 4054 B19R2.51035 Cc1cc(ccc1OCc2cc(=O)c(co2)O)N 7a_100011218179_100000010605 [0,2,0,0,0,0|0,1,0]=3 4055 B19R2.51035 Cc1cc(ccc1SCc2cc(=O)c(co2)O)Br 62a_100000701812_100000010605 [0,2,0,0,0,0|0,0,0]=2 4056 B19R2.51035 Cc1cc(ccc1SCc2cc(=O)c(co2)O)Cl 62a_100011219607_100000010605 [0,2,0,0,0,0|0,0,0]=2 4057 B19R2.51035 Cc1cc(ccc1SCc2cc(=O)c(co2)O)F 62a_100011205405_100000010605 [0,2,0,0,0,0|0,0,0]=2 4058 B19R2.51035 Cc1cc(ccc1SCc2cc(=O)c(co2)O)N 62a_100000210723_100000010605 [0,2,0,0,0,0|0,0,0]=2 4059 B19R2.51035 Cc1cc(cnc1SCc2cc(=O)c(co2)O)Br 62a_100012353652_100000010605 [0,2,0,0,0,0|1,0,0]=3 4060 B19R2.51035 Cc1cc(cnc1SCc2cc(=O)c(co2)O)F 62a_100009817009_100000010605 [0,2,0,0,0,0|1,0,0]=3 4061 B19R2.51035 Cc1cc(cnc1SCc2cc(=O)c(co2)O)N 62a_100000761747_100000010605 [0,2,0,0,0,0|1,0,0]=3 4062 B19R2.51035 Cc1cc(cnc1SCc2cc(=O)c(co2)O)O 62a_100012000486_100000010605 [0,2,0,0,0,0|1,0,0]=3 4063 B19R2.51035 Cc1cc(ncc1OCc2cc(=O)c(co2)O)Cl 7a_100000692680_100000010605 [0,2,0,0,0,0|1,1,0]=4 4064 B19R2.51035 Cc1cc(ncc1OCc2cc(=O)c(co2)O)F 7a_100009856773_100000010605 [0,2,0,0,0,0|1,1,0]=4 4065 B19R2.51035 Cc1cc(ncc1SCc2cc(=O)c(co2)O)Br 62a_100009816104_100000010605 [0,2,0,0,0,0|1,0,0]=3 4066 B19R2.51035 Cc1cc(ncc1SCc2cc(=O)c(co2)O)Cl 62a_100010172789_100000010605 [0,2,0,0,0,0|1,0,0]=3 4067 B19R2.51035 Cc1cc(ncc1SCc2cc(=O)c(co2)O)F 62a_100009820716_100000010605 [0,2,0,0,0,0|1,0,0]=3 4068 B19R2.51035 Cc1cc(ncc1SCc2cc(=O)c(co2)O)N 62a_100000050067_100000010605 [0,2,0,0,0,0|1,0,0]=3 4069 B19R2.51035 Cc1cc(ncc1SCc2cc(=O)c(co2)O)O 62a_100000766222_100000010605 [0,2,0,0,0,0|1,0,0]=3 4070 B19R2.51035 Cc1cc(nnc1SCc2cc(=O)c(co2)O)N 62a_100000123434_100000010605 [0,2,0,0,0,0|2,0,0]=4 4071 B19R2.51035 Cc1ccc(c(c1)Br)OCc2cc(=O)c(co2)O 7a_100000210800_100000010605 [0,2,0,0,0,0|0,1,0]=3 4072 B19R2.51035 Cc1ccc(c(c1)Br)SCc2cc(=O)c(co2)O 62a_100009813563_100000010605 [0,2,0,0,0,0|0,0,0]=2 4073 B19R2.51035 Cc1ccc(c(c1)C)NCc2cc(=O)c(co2)O 7a_100000736561_100000010605 [0,2,0,0,0,0|1,0,0]=3 4074 B19R2.51035 Cc1ccc(c(c1)C)OCc2cc(=O)c(co2)O 7a_100000211776_100000010605 [0,2,0,0,0,0|0,1,0]=3 4075 B19R2.51035 Cc1ccc(c(c1)C)SCc2cc(=O)c(co2)O 62a_100011217332_100000010605 [0,2,0,0,0,0|0,0,0]=2 4076 B19R2.51035 Cc1ccc(c(c1)Cl)OCc2cc(=O)c(co2)O 7a_100000749699_100000010605 [0,2,0,0,0,0|0,1,0]=3 4077 B19R2.51035 Cc1ccc(c(c1)Cl)SCc2cc(=O)c(co2)O 62a_100011263221_100000010605 [0,2,0,0,0,0|0,0,0]=2 4078 B19R2.51035 Cc1ccc(c(c1)F)OCc2cc(=O)c(co2)O 7a_100011216688_100000010605 [0,2,0,0,0,0|0,1,0]=3 4079 B19R2.51035 Cc1ccc(c(c1)F)SCc2cc(=O)c(co2)O 62a_100011216119_100000010605 [0,2,0,0,0,0|0,0,0]=2 4080 B19R2.51035 Cc1ccc(c(c1)I)OCc2cc(=O)c(co2)O 7a_100000765521_100000010605 [0,2,0,0,0,0|0,1,0]=3 4081 B19R2.51035 Cc1ccc(c(c1)N)OCc2cc(=O)c(co2)O 7a_100011215204_100000010605 [0,2,0,0,0,0|0,1,0]=3 4082 B19R2.51035 Cc1ccc(c(c1)N)SCc2cc(=O)c(co2)O 62a_100011216686_100000010605 [0,2,0,0,0,0|0,0,0]=2 4083 B19R2.51035 Cc1ccc(c(c1)O)SCc2cc(=O)c(co2)O 62a_100012002257_100000010605 [0,2,0,0,0,0|0,0,0]=2 4084 B19R2.51035 Cc1ccc(c(n1)Br)OCc2cc(=O)c(co2)O 7a_100000702858_100000010605 [0,2,0,0,0,0|1,1,0]=4 4085 B19R2.51035 Cc1ccc(c(n1)C)OCc2cc(=O)c(co2)O 7a_100011218912_100000010605 [0,2,0,0,0,0|1,1,0]=4 4086 B19R2.51035 Cc1ccc(c(n1)C)SCc2cc(=O)c(co2)O 62a_100009813853_100000010605 [0,2,0,0,0,0|1,0,0]=3 4087 B19R2.51035 Cc1ccc(c(n1)Cl)OCc2cc(=O)c(co2)O 7a_100000086286_100000010605 [0,2,0,0,0,0|1,1,0]=4 4088 B19R2.51035 Cc1ccc(c(n1)F)OCc2cc(=O)c(co2)O 7a_100000079963_100000010605 [0,2,0,0,0,0|1,1,0]=4 4089 B19R2.51035 Cc1ccc(c(n1)F)SCc2cc(=O)c(co2)O 62a_100010006597_100000010605 [0,2,0,0,0,0|1,0,0]=3 4090 B19R2.51035 Cc1ccc(c(n1)I)OCc2cc(=O)c(co2)O 7a_100000023897_100000010605 [0,2,0,0,0,0|1,1,0]=4 4091 B19R2.51035 Cc1ccc(c(n1)N)OCc2cc(=O)c(co2)O 7a_100000694039_100000010605 [0,2,0,0,0,0|1,1,0]=4 4092 B19R2.51035 Cc1ccc(c(n1)N)SCc2cc(=O)c(co2)O 62a_100009816662_100000010605 [0,2,0,0,0,0|1,0,0]=3 4093 B19R2.51035 Cc1ccc(c(n1)O)SCc2cc(=O)c(co2)O 62a_100009817604_100000010605 [0,2,0,0,0,0|1,0,0]=3 4094 B19R2.51035 Cc1cnc(c(c1)C)SCc2cc(=O)c(co2)O 62a_100009864548_100000010605 [0,2,0,0,0,0|1,0,0]=3 4095 B19R2.51035 Cc1cnc(c(c1)F)SCc2cc(=O)c(co2)O 62a_100009819633_100000010605 [0,2,0,0,0,0|1,0,0]=3 4096 B19R2.51035 Cc1cnc(c(c1)N)SCc2cc(=O)c(co2)O 62a_100000733613_100000010605 [0,2,0,0,0,0|1,0,0]=3 4097 B19R2.51035 Cc1cnc(c(n1)C)SCc2cc(=O)c(co2)O 62a_100000065684_100000010605 [0,2,0,0,0,0|2,0,0]=4 4098 B19R2.51035 Cc1nc(ccc1OCc2cc(=O)c(co2)O)Br 7a_100012002022_100000010605 [0,2,0,0,0,0|1,1,0]=4 4099 B19R2.51035 Cc1nc(ccc1OCc2cc(=O)c(co2)O)Cl 7a_100012184626_100000010605 [0,2,0,0,0,0|1,1,0]=4 4100 B19R2.51035 Cc1nc(ccc1OCc2cc(=O)c(co2)O)F 7a_100009881036_100000010605 [0,2,0,0,0,0|1,1,0]=4 4101 B19R2.51035 Cc1nc(ccc1OCc2cc(=O)c(co2)O)I 7a_100010233687_100000010605 [0,2,0,0,0,0|1,1,0]=4 4102 B19R2.51035 Cc1nc(ccc1SCc2cc(=O)c(co2)O)Cl 62a_100000062408_100000010605 [0,2,0,0,0,0|1,0,0]=3 4103 B19R2.51035 Cc1nc(ccc1SCc2cc(=O)c(co2)O)F 62a_100000688911_100000010605 [0,2,0,0,0,0|1,0,0]=3 4104 B19R2.51035 Cc1nc(ccc1SCc2cc(=O)c(co2)O)N 62a_100000187202_100000010605 [0,2,0,0,0,0|1,0,0]=3 4105 B19R2.51035 Cc1nc(ccc1SCc2cc(=O)c(co2)O)O 62a_100000691680_100000010605 [0,2,0,0,0,0|1,0,0]=3 4106 B19R2.51035 Cc1nc(cnc1SCc2cc(=O)c(co2)O)N 62a_100009818570_100000010605 [0,2,0,0,0,0|2,0,0]=4 4107 B19R2.51035 Cc1nc(ncc1SCc2cc(=O)c(co2)O)N 62a_100000725598_100000010605 [0,2,0,0,0,0|2,0,0]=4 4108 B19R2.51035 Cc1ncc(c(=O)[nH]1)SCc2cc(=O)c(co2)O 62a_100011999157_100000010605 [0,2,0,0,0,0|2,0,0]=4 4109 B19R2.51035 Cc1ncc(c(n1)N)SCc2cc(=O)c(co2)O 62a_100000684960_100000010605 [0,2,0,0,0,0|2,0,0]=4 4110 B19R2.51035 Nc1[nH]c(=O)ccc1SCc2cc(=O)c(co2)O 62a_100009884077_100000010605 [0,2,0,0,0,0|1,0,0]=3 4111 B19R2.51035 Nc1[nH]c(=O)ncc1SCc2cc(=O)c(co2)O 62a_100000708077_100000010605 [0,2,0,0,0,0|2,0,0]=4 4112 B19R2.51035 Nc1cc(c(cn1)SCc2cc(=O)c(co2)O)Br 62a_100010074611_100000010605 [0,2,0,0,0,0|1,0,0]=3 4113 B19R2.51035 Nc1cc(c(cn1)SCc2cc(=O)c(co2)O)Cl 62a_100000694920_100000010605 [0,2,0,0,0,0|1,0,0]=3 4114 B19R2.51035 Nc1cc(c(cn1)SCc2cc(=O)c(co2)O)F 62a_100009844730_100000010605 [0,2,0,0,0,0|1,0,0]=3 4115 B19R2.51035 Nc1cc(c(cn1)SCc2cc(=O)c(co2)O)N 62a_200009857908_100000010605 [0,2,0,0,0,0|1,0,0]=3 4116 B19R2.51035 Nc1cc(ccc1OCc2cc(=O)c(co2)O)Br 7a_100000752626_100000010605 [0,2,0,0,0,0|0,1,0]=3 4117 B19R2.51035 Nc1cc(ccc1OCc2cc(=O)c(co2)O)Cl 7a_100000210500_100000010605 [0,2,0,0,0,0|0,1,0]=3 4118 B19R2.51035 Nc1cc(ccc1OCc2cc(=O)c(co2)O)F 7a_100000759472_100000010605 [0,2,0,0,0,0|0,1,0]=3 4119 B19R2.51035 Nc1cc(ccc1OCc2cc(=O)c(co2)O)I 7a_100000753495_100000010605 [0,2,0,0,0,0|0,1,0]=3 4120 B19R2.51035 Nc1cc(ccc1SCc2cc(=O)c(co2)O)Br 62a_100000743836_100000010605 [0,2,0,0,0,0|0,0,0]=2 4121 B19R2.51035 Nc1cc(ccc1SCc2cc(=O)c(co2)O)Cl 62a_100000761886_100000010605 [0,2,0,0,0,0|0,0,0]=2 4122 B19R2.51035 Nc1cc(ccc1SCc2cc(=O)c(co2)O)F 62a_100000687223_100000010605 [0,2,0,0,0,0|0,0,0]=2 4123 B19R2.51035 Nc1cc(ccc1SCc2cc(=O)c(co2)O)O 62a_100011999798_100000010605 [0,2,0,0,0,0|0,0,0]=2 4124 B19R2.51035 Nc1cc(cnc1SCc2cc(=O)c(co2)O)Br 62a_100010090555_100000010605 [0,2,0,0,0,0|1,0,0]=3 4125 B19R2.51035 Nc1cc(cnc1SCc2cc(=O)c(co2)O)F 62a_100009817643_100000010605 [0,2,0,0,0,0|1,0,0]=3 4126 B19R2.51035 Nc1cc(ncc1OCc2cc(=O)c(co2)O)Br 7a_100009819941_100000010605 [0,2,0,0,0,0|1,1,0]=4 4127 B19R2.51035 Nc1cc(ncc1SCc2cc(=O)c(co2)O)Cl 62a_100010209552_100000010605 [0,2,0,0,0,0|1,0,0]=3 4128 B19R2.51035 Nc1ccc(c(c1)Br)OCc2cc(=O)c(co2)O 7a_100011534360_100000010605 [0,2,0,0,0,0|0,1,0]=3 4129 B19R2.51035 Nc1ccc(c(c1)Br)SCc2cc(=O)c(co2)O 62a_100000750458_100000010605 [0,2,0,0,0,0|0,0,0]=2 4130 B19R2.51035 Nc1ccc(c(c1)Cl)OCc2cc(=O)c(co2)O 7a_100000744943_100000010605 [0,2,0,0,0,0|0,1,0]=3 4131 B19R2.51035 Nc1ccc(c(c1)Cl)SCc2cc(=O)c(co2)O 62a_100000761885_100000010605 [0,2,0,0,0,0|0,0,0]=2 4132 B19R2.51035 Nc1ccc(c(c1)F)OCc2cc(=O)c(co2)O 7a_100011220035_100000010605 [0,2,0,0,0,0|0,1,0]=3 4133 B19R2.51035 Nc1ccc(c(c1)F)SCc2cc(=O)c(co2)O 62a_100011356925_100000010605 [0,2,0,0,0,0|0,0,0]=2 4134 B19R2.51035 Nc1ccc(c(c1)N)SCc2cc(=O)c(co2)O 62a_200012175722_100000010605 [0,2,0,0,0,0|0,0,0]=2 4135 B19R2.51035 Nc1ccc(c(n1)Br)SCc2cc(=O)c(co2)O 62a_100010734177_100000010605 [0,2,0,0,0,0|1,0,0]=3 4136 B19R2.51035 Nc1ccc(c(n1)Cl)SCc2cc(=O)c(co2)O 62a_100010270343_100000010605 [0,2,0,0,0,0|1,0,0]=3 4137 B19R2.51035 Nc1ccc(c(n1)F)SCc2cc(=O)c(co2)O 62a_100009882772_100000010605 [0,2,0,0,0,0|1,0,0]=3 4138 B19R2.51035 Nc1ccc(c(n1)N)SCc2cc(=O)c(co2)O 62a_100011356871_100000010605 [0,2,0,0,0,0|1,0,0]=3 4139 B19R2.51035 Nc1cnc(c(c1)F)SCc2cc(=O)c(co2)O 62a_100010280766_100000010605 [0,2,0,0,0,0|1,0,0]=3 4140 B19R2.51035 Nc1cnc(c(c1)N)SCc2cc(=O)c(co2)O 62a_200000093520_100000010605 [0,2,0,0,0,0|1,0,0]=3 4141 B19R2.51035 Nc1cnc(c(n1)Cl)SCc2cc(=O)c(co2)O 62a_100010116657_100000010605 [0,2,0,0,0,0|2,0,0]=4 4142 B19R2.51035 Nc1nc(ccc1OCc2cc(=O)c(co2)O)Br 7a_100000685527_100000010605 [0,2,0,0,0,0|1,1,0]=4 4143 B19R2.51035 Nc1nc(ccc1OCc2cc(=O)c(co2)O)Cl 7a_100000717809_100000010605 [0,2,0,0,0,0|1,1,0]=4 4144 B19R2.51035 Nc1nc(ccc1SCc2cc(=O)c(co2)O)Cl 62a_100010171640_100000010605 [0,2,0,0,0,0|1,0,0]=3 4145 B19R2.51035 Nc1nc(ccc1SCc2cc(=O)c(co2)O)F 62a_100009854977_100000010605 [0,2,0,0,0,0|1,0,0]=3 4146 B19R2.51035 Nc1nc(ncc1SCc2cc(=O)c(co2)O)Cl 62a_100010196077_100000010605 [0,2,0,0,0,0|2,0,0]=4 4147 B19R2.51035 Nc1ncc(c(=O)[nH]1)SCc2cc(=O)c(co2)O 62a_100012456729_100000010605 [0,2,0,0,0,0|2,0,0]=4 4148 B19R2.51035 Nc1ncc(c(n1)N)SCc2cc(=O)c(co2)O 62a_200010734216_100000010605 [0,2,0,0,0,0|2,0,0]=4 4149 B19R2.51035 O=c1cc(c(c[nH]1)SCc2cc(=O)c(co2)O)F 62a_100015631685_100000010605 [0,2,0,0,0,0|1,0,0]=3 4150 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Br)Br 7a_100000188717_100000010605 [0,2,0,0,0,0|0,1,0]=3 4151 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Br)Cl 7a_100000211998_100000010605 [0,2,0,0,0,0|0,1,0]=3 4152 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Br)F 7a_100000211999_100000010605 [0,2,0,0,0,0|0,1,0]=3 4153 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Br)I 7a_100012361655_100000010605 [0,2,0,0,0,0|0,1,0]=3 4154 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Cl)Br 7a_100000186472_100000010605 [0,2,0,0,0,0|0,1,0]=3 4155 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Cl)Cl 7a_100015191787_100000010605 [0,2,0,0,0,0|0,1,0]=3 4156 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Cl)F 7a_100000212004_100000010605 [0,2,0,0,0,0|0,1,0]=3 4157 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2Cl)I 7a_100012360047_100000010605 [0,2,0,0,0,0|0,1,0]=3 4158 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2F)Br 7a_100000185481_100000010605 [0,2,0,0,0,0|0,1,0]=3 4159 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2F)Cl 7a_100000230166_100000010605 [0,2,0,0,0,0|0,1,0]=3 4160 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2F)F 7a_100000230127_100000010605 [0,2,0,0,0,0|0,1,0]=3 4161 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2F)I 7a_100011356965_100000010605 [0,2,0,0,0,0|0,1,0]=3 4162 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2I)Br 7a_100012355227_100000010605 [0,2,0,0,0,0|0,1,0]=3 4163 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2I)Cl 7a_100011356953_100000010605 [0,2,0,0,0,0|0,1,0]=3 4164 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2I)F 7a_100012355409_100000010605 [0,2,0,0,0,0|0,1,0]=3 4165 B19R2.51035 O=c1cc(occ1O)COc2ccc(cc2I)I 7a_100010001573_100000010605 [0,2,0,0,0,0|0,1,0]=3 4166 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Br)Br 7a_100009999766_100000010605 [0,2,0,0,0,0|1,1,0]=4 4167 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Br)Cl 7a_100010219353_100000010605 [0,2,0,0,0,0|1,1,0]=4 4168 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Br)F 7a_100009887730_100000010605 [0,2,0,0,0,0|1,1,0]=4 4169 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Br)I 7a_100000725334_100000010605 [0,2,0,0,0,0|1,1,0]=4 4170 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Cl)Br 7a_100010246206_100000010605 [0,2,0,0,0,0|1,1,0]=4 4171 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Cl)Cl 7a_100000101165_100000010605 [0,2,0,0,0,0|1,1,0]=4 4172 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2Cl)I 7a_100000721234_100000010605 [0,2,0,0,0,0|1,1,0]=4 4173 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2F)Br 7a_100009819667_100000010605 [0,2,0,0,0,0|1,1,0]=4 4174 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2F)Cl 7a_100009880201_100000010605 [0,2,0,0,0,0|1,1,0]=4 4175 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2F)F 7a_100000101184_100000010605 [0,2,0,0,0,0|1,1,0]=4 4176 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2I)Br 7a_100010253912_100000010605 [0,2,0,0,0,0|1,1,0]=4 4177 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2I)Cl 7a_100000696390_100000010605 [0,2,0,0,0,0|1,1,0]=4 4178 B19R2.51035 O=c1cc(occ1O)COc2ccc(nc2I)F 7a_100010382442_100000010605 [0,2,0,0,0,0|1,1,0]=4 4179 B19R2.51035 O=c1cc(occ1O)COc2cnc(cc2Cl)Cl 7a_100009868576_100000010605 [0,2,0,0,0,0|1,1,0]=4 4180 B19R2.51035 O=c1cc(occ1O)COc2cnc(cc2F)F 7a_100009885687_100000010605 [0,2,0,0,0,0|1,1,0]=4 4181 B19R2.51035 O=c1cc(occ1O)COc2cnc(cc2I)Cl 7a_100000698892_100000010605 [0,2,0,0,0,0|1,1,0]=4 4182 B19R2.51035 O=c1cc(occ1O)CSc2ccc(c[n+]2[O-])F 62a_100009817261_100000010605 [0,2,0,0,0,0|1,0,0]=3 4183 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Br)Br 62a_100011484698_100000010605 [0,2,0,0,0,0|0,0,0]=2 4184 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Br)Cl 62a_100011219703_100000010605 [0,2,0,0,0,0|0,0,0]=2 4185 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Br)F 62a_100011217111_100000010605 [0,2,0,0,0,0|0,0,0]=2 4186 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Br)O 62a_100000701344_100000010605 [0,2,0,0,0,0|0,0,0]=2 4187 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Cl)Br 62a_100011216062_100000010605 [0,2,0,0,0,0|0,0,0]=2 4188 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Cl)Cl 62a_100000699841_100000010605 [0,2,0,0,0,0|0,0,0]=2 4189 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Cl)F 62a_100000733362_100000010605 [0,2,0,0,0,0|0,0,0]=2 4190 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2Cl)O 62a_100000047559_100000010605 [0,2,0,0,0,0|0,0,0]=2 4191 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2F)Br 62a_100009814013_100000010605 [0,2,0,0,0,0|0,0,0]=2 4192 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2F)Cl 62a_100011216042_100000010605 [0,2,0,0,0,0|0,0,0]=2 4193 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2F)F 62a_100000750030_100000010605 [0,2,0,0,0,0|0,0,0]=2 4194 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2F)O 62a_100000755031_100000010605 [0,2,0,0,0,0|0,0,0]=2 4195 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2O)Br 62a_100012344904_100000010605 [0,2,0,0,0,0|0,0,0]=2 4196 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2O)Cl 62a_100000050036_100000010605 [0,2,0,0,0,0|0,0,0]=2 4197 B19R2.51035 O=c1cc(occ1O)CSc2ccc(cc2O)F 62a_100000690578_100000010605 [0,2,0,0,0,0|0,0,0]=2 4198 B19R2.51035 O=c1cc(occ1O)CSc2ccc(nc2Cl)Br 62a_100010246183_100000010605 [0,2,0,0,0,0|1,0,0]=3 4199 B19R2.51035 O=c1cc(occ1O)CSc2ccc(nc2F)Cl 62a_100010168078_100000010605 [0,2,0,0,0,0|1,0,0]=3 4200 B19R2.51035 O=c1cc(occ1O)CSc2ccc(nc2F)F 62a_100000070099_100000010605 [0,2,0,0,0,0|1,0,0]=3 4201 B19R2.51035 O=c1cc(occ1O)CSc2ccc(nc2F)O 62a_100009879308_100000010605 [0,2,0,0,0,0|1,0,0]=3 4202 B19R2.51035 O=c1cc(occ1O)CSc2cnc(cc2Br)F 62a_100015451857_100000010605 [0,2,0,0,0,0|1,0,0]=3 4203 B19R2.51035 O=c1cc(occ1O)CSc2cnc(cc2Cl)Br 62a_100010381092_100000010605 [0,2,0,0,0,0|1,0,0]=3 4204 B19R2.51035 O=c1cc(occ1O)CSc2cnc(cc2Cl)Cl 62a_100010200927_100000010605 [0,2,0,0,0,0|1,0,0]=3 4205 B19R2.51035 O=c1cc(occ1O)CSc2cnc(cc2F)Cl 62a_100010128100_100000010605 [0,2,0,0,0,0|1,0,0]=3 4206 B19R2.51035 O=c1cc(occ1O)CSc2cnc(nc2F)F 62a_100009820707_100000010605 [0,2,0,0,0,0|2,0,0]=4 4207 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2Br)Cl 62a_100012154958_100000010605 [0,2,0,0,0,0|1,0,0]=3 4208 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2F)Br 62a_100012348576_100000010605 [0,2,0,0,0,0|1,0,0]=3 4209 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2F)Cl 62a_100012348686_100000010605 [0,2,0,0,0,0|1,0,0]=3 4210 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2F)F 62a_100011219543_100000010605 [0,2,0,0,0,0|1,0,0]=3 4211 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2O)Br 62a_100010210634_100000010605 [0,2,0,0,0,0|1,0,0]=3 4212 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2O)Cl 62a_100010233512_100000010605 [0,2,0,0,0,0|1,0,0]=3 4213 B19R2.51035 O=c1cc(occ1O)CSc2ncc(cc2O)F 62a_100009820119_100000010605 [0,2,0,0,0,0|1,0,0]=3 4214 B19R2.51035 O=c1cc(occ1O)CSc2ncc(nc2Br)Br 62a_100010235571_100000010605 [0,2,0,0,0,0|2,0,0]=4 4215 B19R2.149413 Cc1cc(ccc1Br)NCc2cc(=O)c(co2)O 2230a_100000210723_100000010605 [0,2,0,0,0,0|1,0,0]=3 4216 B19R2.149413 Cc1cc(ccc1Br)NCc2cc(=O)c(co2)O 7a_100000210723_100000010605 [0,2,0,0,0,0|1,0,0]=3 4217 B19R2.149413 Cc1cc(ccc1Br)OCc2cc(=O)c(co2)O 7a_100000690111_100000010605 [0,2,0,0,0,0|0,1,0]=3 4218 B19R2.149413 Cc1cc(ccc1Br)SCc2cc(=O)c(co2)O 62a_100009813585_100000010605 [0,2,0,0,0,0|0,0,0]=2 4219 B19R2.149413 Cc1cc(ccc1Cl)NCc2cc(=O)c(co2)O 2230a_100000187808_100000010605 [0,2,0,0,0,0|1,0,0]=3 4220 B19R2.149413 Cc1cc(ccc1Cl)NCc2cc(=O)c(co2)O 7a_100000187808_100000010605 [0,2,0,0,0,0|1,0,0]=3 4221 B19R2.149413 Cc1cc(ccc1Cl)OCc2cc(=O)c(co2)O 7a_100000211092_100000010605 [0,2,0,0,0,0|0,1,0]=3 4222 B19R2.149413 Cc1cc(ccc1Cl)SCc2cc(=O)c(co2)O 62a_100000049509_100000010605 [0,2,0,0,0,0|0,0,0]=2 4223 B19R2.149413 Cc1cc(ccc1F)NCc2cc(=O)c(co2)O 2230a_100000750164_100000010605 [0,2,0,0,0,0|1,0,0]=3 4224 B19R2.149413 Cc1cc(ccc1F)NCc2cc(=O)c(co2)O 7a_100000750164_100000010605 [0,2,0,0,0,0|1,0,0]=3 4225 B19R2.149413 Cc1cc(ccc1F)OCc2cc(=O)c(co2)O 7a_100000751312_100000010605 [0,2,0,0,0,0|0,1,0]=3 4226 B19R2.149413 Cc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100011218330_100000010605 [0,2,0,0,0,0|0,0,0]=2 4227 B19R2.149413 Cc1cc(ccc1I)NCc2cc(=O)c(co2)O 7a_100000198070_100000010605 [0,2,0,0,0,0|1,0,0]=3 4228 B19R2.149413 Cc1cc(ccc1I)OCc2cc(=O)c(co2)O 7a_100000729255_100000010605 [0,2,0,0,0,0|0,1,0]=3 4229 B19R2.149413 Cc1cc(ccc1N)OCc2cc(=O)c(co2)O 7a_100000756630_100000010605 [0,2,0,0,0,0|0,1,0]=3 4230 B19R2.149413 Cc1cc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000211769_100000010605 [0,2,0,0,0,0|0,0,0]=2 4231 B19R2.149413 Cc1cc(ccc1O)NCc2cc(=O)c(co2)O 7a_100011218179_100000010605 [0,2,0,0,0,0|1,0,0]=3 4232 B19R2.149413 Cc1cc(cnc1Br)OCc2cc(=O)c(co2)O 7a_100012000486_100000010605 [0,2,0,0,0,0|1,1,0]=4 4233 B19R2.149413 Cc1cc(cnc1Br)SCc2cc(=O)c(co2)O 62a_100009816107_100000010605 [0,2,0,0,0,0|1,0,0]=3 4234 B19R2.149413 Cc1cc(cnc1C)OCc2cc(=O)c(co2)O 7a_100009854398_100000010605 [0,2,0,0,0,0|1,1,0]=4 4235 B19R2.149413 Cc1cc(cnc1C)SCc2cc(=O)c(co2)O 62a_100000697892_100000010605 [0,2,0,0,0,0|1,0,0]=3 4236 B19R2.149413 Cc1cc(cnc1Cl)OCc2cc(=O)c(co2)O 7a_100012002680_100000010605 [0,2,0,0,0,0|1,1,0]=4 4237 B19R2.149413 Cc1cc(cnc1Cl)SCc2cc(=O)c(co2)O 62a_100009922867_100000010605 [0,2,0,0,0,0|1,0,0]=3 4238 B19R2.149413 Cc1cc(cnc1F)OCc2cc(=O)c(co2)O 7a_100000094615_100000010605 [0,2,0,0,0,0|1,1,0]=4 4239 B19R2.149413 Cc1cc(cnc1F)SCc2cc(=O)c(co2)O 62a_100000709442_100000010605 [0,2,0,0,0,0|1,0,0]=3 4240 B19R2.149413 Cc1cc(cnc1N)SCc2cc(=O)c(co2)O 62a_100000684428_100000010605 [0,2,0,0,0,0|1,0,0]=3 4241 B19R2.149413 Cc1cc(cnc1O)SCc2cc(=O)c(co2)O 62a_100000685391_100000010605 [0,2,0,0,0,0|1,0,0]=3 4242 B19R2.149413 Cc1cc(ncc1Br)SCc2cc(=O)c(co2)O 62a_100012356354_100000010605 [0,2,0,0,0,0|1,0,0]=3 4243 B19R2.149413 Cc1cc(ncc1F)SCc2cc(=O)c(co2)O 62a_100009818257_100000010605 [0,2,0,0,0,0|1,0,0]=3 4244 B19R2.149413 Cc1cc(ncc1N)SCc2cc(=O)c(co2)O 62a_100000067204_100000010605 [0,2,0,0,0,0|1,0,0]=3 4245 B19R2.149413 Cc1cc(nnc1N)SCc2cc(=O)c(co2)O 62a_100153394926_100000010605 [0,2,0,0,0,0|2,0,0]=4 4246 B19R2.149413 Cc1ccc(cc1Br)NCc2cc(=O)c(co2)O 2230a_100000736455_100000010605 [0,2,0,0,0,0|1,0,0]=3 4247 B19R2.149413 Cc1ccc(cc1Br)NCc2cc(=O)c(co2)O 7a_100000736455_100000010605 [0,2,0,0,0,0|1,0,0]=3 4248 B19R2.149413 Cc1ccc(cc1Br)OCc2cc(=O)c(co2)O 7a_100011380479_100000010605 [0,2,0,0,0,0|0,1,0]=3 4249 B19R2.149413 Cc1ccc(cc1Br)SCc2cc(=O)c(co2)O 62a_100011847877_100000010605 [0,2,0,0,0,0|0,0,0]=2 4250 B19R2.149413 Cc1ccc(cc1C)NCc2cc(=O)c(co2)O 2230a_100000724040_100000010605 [0,2,0,0,0,0|1,0,0]=3 4251 B19R2.149413 Cc1ccc(cc1C)NCc2cc(=O)c(co2)O 7a_100000724040_100000010605 [0,2,0,0,0,0|1,0,0]=3 4252 B19R2.149413 Cc1ccc(cc1C)OCc2cc(=O)c(co2)O 7a_100000210932_100000010605 [0,2,0,0,0,0|0,1,0]=3 4253 B19R2.149413 Cc1ccc(cc1C)SCc2cc(=O)c(co2)O 62a_100011215607_100000010605 [0,2,0,0,0,0|0,0,0]=2 4254 B19R2.149413 Cc1ccc(cc1Cl)NCc2cc(=O)c(co2)O 2230a_100000188892_100000010605 [0,2,0,0,0,0|1,0,0]=3 4255 B19R2.149413 Cc1ccc(cc1Cl)NCc2cc(=O)c(co2)O 7a_100000188892_100000010605 [0,2,0,0,0,0|1,0,0]=3 4256 B19R2.149413 Cc1ccc(cc1Cl)OCc2cc(=O)c(co2)O 7a_100011265682_100000010605 [0,2,0,0,0,0|0,1,0]=3 4257 B19R2.149413 Cc1ccc(cc1Cl)SCc2cc(=O)c(co2)O 62a_100011216363_100000010605 [0,2,0,0,0,0|0,0,0]=2 4258 B19R2.149413 Cc1ccc(cc1F)NCc2cc(=O)c(co2)O 2230a_100000210958_100000010605 [0,2,0,0,0,0|1,0,0]=3 4259 B19R2.149413 Cc1ccc(cc1F)NCc2cc(=O)c(co2)O 7a_100000210958_100000010605 [0,2,0,0,0,0|1,0,0]=3 4260 B19R2.149413 Cc1ccc(cc1F)OCc2cc(=O)c(co2)O 7a_100000722560_100000010605 [0,2,0,0,0,0|0,1,0]=3 4261 B19R2.149413 Cc1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100000720648_100000010605 [0,2,0,0,0,0|0,0,0]=2 4262 B19R2.149413 Cc1ccc(cc1I)NCc2cc(=O)c(co2)O 7a_100000184131_100000010605 [0,2,0,0,0,0|1,0,0]=3 4263 B19R2.149413 Cc1ccc(cc1N)OCc2cc(=O)c(co2)O 7a_100011216113_100000010605 [0,2,0,0,0,0|0,1,0]=3 4264 B19R2.149413 Cc1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100000761890_100000010605 [0,2,0,0,0,0|0,0,0]=2 4265 B19R2.149413 Cc1ccc(cc1O)NCc2cc(=O)c(co2)O 7a_100000759471_100000010605 [0,2,0,0,0,0|1,0,0]=3 4266 B19R2.149413 Cc1ccc(cc1O)SCc2cc(=O)c(co2)O 62a_100000685420_100000010605 [0,2,0,0,0,0|0,0,0]=2 4267 B19R2.149413 Cc1ccc(nc1C)SCc2cc(=O)c(co2)O 62a_100000103781_100000010605 [0,2,0,0,0,0|1,0,0]=3 4268 B19R2.149413 Cc1ccc(nc1N)SCc2cc(=O)c(co2)O 62a_100009857032_100000010605 [0,2,0,0,0,0|1,0,0]=3 4269 B19R2.149413 Cc1cnc(cc1C)SCc2cc(=O)c(co2)O 62a_100009850809_100000010605 [0,2,0,0,0,0|1,0,0]=3 4270 B19R2.149413 Cc1cnc(cc1F)SCc2cc(=O)c(co2)O 62a_100009841206_100000010605 [0,2,0,0,0,0|1,0,0]=3 4271 B19R2.149413 Cc1cnc(cc1N)SCc2cc(=O)c(co2)O 62a_100000126663_100000010605 [0,2,0,0,0,0|1,0,0]=3 4272 B19R2.149413 Cc1cnc(cc1O)SCc2cc(=O)c(co2)O 62a_100000704368_100000010605 [0,2,0,0,0,0|1,0,0]=3 4273 B19R2.149413 Cc1cnc(nc1N)SCc2cc(=O)c(co2)O 62a_100011996698_100000010605 [0,2,0,0,0,0|2,0,0]=4 4274 B19R2.149413 Cc1nc(c[nH]c1=O)SCc2cc(=O)c(co2)O 62a_100010363809_100000010605 [0,2,0,0,0,0|2,0,0]=4 4275 B19R2.149413 Cc1nc(ccc1Br)SCc2cc(=O)c(co2)O 62a_100012360386_100000010605 [0,2,0,0,0,0|1,0,0]=3 4276 B19R2.149413 Cc1nc(ccc1F)SCc2cc(=O)c(co2)O 62a_100009814307_100000010605 [0,2,0,0,0,0|1,0,0]=3 4277 B19R2.149413 Cc1nc(ccc1N)SCc2cc(=O)c(co2)O 62a_100000720120_100000010605 [0,2,0,0,0,0|1,0,0]=3 4278 B19R2.149413 Cc1nc(ccc1O)SCc2cc(=O)c(co2)O 62a_100010233687_100000010605 [0,2,0,0,0,0|1,0,0]=3 4279 B19R2.149413 Cc1nc(cnc1N)SCc2cc(=O)c(co2)O 62a_100009818571_100000010605 [0,2,0,0,0,0|2,0,0]=4 4280 B19R2.149413 Cc1nc(ncc1Cl)SCc2cc(=O)c(co2)O 62a_100010174973_100000010605 [0,2,0,0,0,0|2,0,0]=4 4281 B19R2.149413 Cc1nc(ncc1F)SCc2cc(=O)c(co2)O 62a_100015641512_100000010605 [0,2,0,0,0,0|2,0,0]=4 4282 B19R2.149413 Cc1nc(ncc1N)SCc2cc(=O)c(co2)O 62a_100000123670_100000010605 [0,2,0,0,0,0|2,0,0]=4 4283 B19R2.149413 Cc1ncc(cc1Br)OCc2cc(=O)c(co2)O 7a_100009819603_100000010605 [0,2,0,0,0,0|1,1,0]=4 4284 B19R2.149413 Cc1ncc(cc1F)SCc2cc(=O)c(co2)O 62a_100009845756_100000010605 [0,2,0,0,0,0|1,0,0]=3 4285 B19R2.149413 Cc1ncc(cc1N)SCc2cc(=O)c(co2)O 62a_100011999542_100000010605 [0,2,0,0,0,0|1,0,0]=3 4286 B19R2.149413 Cc1ncc(cc1O)SCc2cc(=O)c(co2)O 62a_100009864810_100000010605 [0,2,0,0,0,0|1,0,0]=3 4287 B19R2.149413 Cc1ncc(nc1C)SCc2cc(=O)c(co2)O 62a_100009878948_100000010605 [0,2,0,0,0,0|2,0,0]=4 4288 B19R2.149413 Cn1cc(ccc1=O)SCc2cc(=O)c(co2)O 62a_100011245003_100000010605 [0,2,0,0,0,0|1,0,0]=3 4289 B19R2.149413 Cn1cc(cnc1=O)SCc2cc(=O)c(co2)O 62a_100009819886_100000010605 [0,2,0,0,0,0|2,0,0]=4 4290 B19R2.149413 Cn1cc(ncc1=O)SCc2cc(=O)c(co2)O 62a_100009843036_100000010605 [0,2,0,0,0,0|2,0,0]=4 4291 B19R2.149413 Cn1ccc(cc1=O)SCc2cc(=O)c(co2)O 62a_100009820031_100000010605 [0,2,0,0,0,0|1,0,0]=3 4292 B19R2.149413 Cn1cnc(cc1=O)SCc2cc(=O)c(co2)O 62a_100012179353_100000010605 [0,2,0,0,0,0|2,0,0]=4 4293 B19R2.149413 Cn1nc(ccc1=O)SCc2cc(=O)c(co2)O 62a_100009820752_100000010605 [0,2,0,0,0,0|2,0,0]=4 4294 B19R2.149413 Cn1ncc(cc1=O)SCc2cc(=O)c(co2)O 62a_200010986246_100000010605 [0,2,0,0,0,0|2,0,0]=4 4295 B19R2.149413 Nc1cc(ccc1Br)OCc2cc(=O)c(co2)O 7a_100011999798_100000010605 [0,2,0,0,0,0|0,1,0]=3 4296 B19R2.149413 Nc1cc(ccc1Br)SCc2cc(=O)c(co2)O 62a_100000750456_100000010605 [0,2,0,0,0,0|0,0,0]=2 4297 B19R2.149413 Nc1cc(ccc1Cl)SCc2cc(=O)c(co2)O 62a_200000761891_100000010605 [0,2,0,0,0,0|0,0,0]=2 4298 B19R2.149413 Nc1cc(ccc1F)OCc2cc(=O)c(co2)O 7a_100012017239_100000010605 [0,2,0,0,0,0|0,1,0]=3 4299 B19R2.149413 Nc1cc(ccc1F)SCc2cc(=O)c(co2)O 62a_100000740924_100000010605 [0,2,0,0,0,0|0,0,0]=2 4300 B19R2.149413 Nc1cc(ccc1O)SCc2cc(=O)c(co2)O 62a_100000752626_100000010605 [0,2,0,0,0,0|0,0,0]=2 4301 B19R2.149413 Nc1cc(cnc1Cl)SCc2cc(=O)c(co2)O 62a_100009828400_100000010605 [0,2,0,0,0,0|1,0,0]=3 4302 B19R2.149413 Nc1cc(cnc1F)SCc2cc(=O)c(co2)O 62a_100009816798_100000010605 [0,2,0,0,0,0|1,0,0]=3 4303 B19R2.149413 Nc1cc(cnc1N)SCc2cc(=O)c(co2)O 62a_100000184470_100000010605 [0,2,0,0,0,0|1,0,0]=3 4304 B19R2.149413 Nc1cc(cnc1O)SCc2cc(=O)c(co2)O 62a_100000743729_100000010605 [0,2,0,0,0,0|1,0,0]=3 4305 B19R2.149413 Nc1cc(ncc1F)SCc2cc(=O)c(co2)O 62a_100000126464_100000010605 [0,2,0,0,0,0|1,0,0]=3 4306 B19R2.149413 Nc1cc(ncc1O)SCc2cc(=O)c(co2)O 62a_100009819941_100000010605 [0,2,0,0,0,0|1,0,0]=3 4307 B19R2.149413 Nc1ccc(cc1Br)OCc2cc(=O)c(co2)O 7a_100012001276_100000010605 [0,2,0,0,0,0|0,1,0]=3 4308 B19R2.149413 Nc1ccc(cc1Br)SCc2cc(=O)c(co2)O 62a_100000750455_100000010605 [0,2,0,0,0,0|0,0,0]=2 4309 B19R2.149413 Nc1ccc(cc1Cl)OCc2cc(=O)c(co2)O 7a_100011215599_100000010605 [0,2,0,0,0,0|0,1,0]=3 4310 B19R2.149413 Nc1ccc(cc1Cl)SCc2cc(=O)c(co2)O 62a_100011218065_100000010605 [0,2,0,0,0,0|0,0,0]=2 4311 B19R2.149413 Nc1ccc(cc1F)OCc2cc(=O)c(co2)O 7a_100000759473_100000010605 [0,2,0,0,0,0|0,1,0]=3 4312 B19R2.149413 Nc1ccc(cc1F)SCc2cc(=O)c(co2)O 62a_100011215594_100000010605 [0,2,0,0,0,0|0,0,0]=2 4313 B19R2.149413 Nc1ccc(cc1I)OCc2cc(=O)c(co2)O 7a_100010084370_100000010605 [0,2,0,0,0,0|0,1,0]=3 4314 B19R2.149413 Nc1ccc(cc1N)SCc2cc(=O)c(co2)O 62a_100000741789_100000010605 [0,2,0,0,0,0|0,0,0]=2 4315 B19R2.149413 Nc1ccc(cc1O)SCc2cc(=O)c(co2)O 62a_100000739049_100000010605 [0,2,0,0,0,0|0,0,0]=2 4316 B19R2.149413 Nc1ccc(nc1Cl)SCc2cc(=O)c(co2)O 62a_200010233646_100000010605 [0,2,0,0,0,0|1,0,0]=3 4317 B19R2.149413 Nc1ccc(nc1F)SCc2cc(=O)c(co2)O 62a_100009856439_100000010605 [0,2,0,0,0,0|1,0,0]=3 4318 B19R2.149413 Nc1ccc(nc1N)SCc2cc(=O)c(co2)O 62a_100000747239_100000010605 [0,2,0,0,0,0|1,0,0]=3 4319 B19R2.149413 Nc1ccc(nc1O)SCc2cc(=O)c(co2)O 62a_100000718904_100000010605 [0,2,0,0,0,0|1,0,0]=3 4320 B19R2.149413 Nc1cnc(cc1N)SCc2cc(=O)c(co2)O 62a_100000067514_100000010605 [0,2,0,0,0,0|1,0,0]=3 4321 B19R2.149413 Nc1cnc(nc1N)SCc2cc(=O)c(co2)O 62a_100011933915_100000010605 [0,2,0,0,0,0|2,0,0]=4 4322 B19R2.149413 Nc1nc(ccc1F)SCc2cc(=O)c(co2)O 62a_100016091773_100000010605 [0,2,0,0,0,0|1,0,0]=3 4323 B19R2.149413 Nc1nc(ccc1O)SCc2cc(=O)c(co2)O 62a_100000685527_100000010605 [0,2,0,0,0,0|1,0,0]=3 4324 B19R2.149413 Nc1nc(ncc1F)SCc2cc(=O)c(co2)O 62a_100000185498_100000010605 [0,2,0,0,0,0|2,0,0]=4 4325 B19R2.149413 Nc1ncc([nH]c1=O)SCc2cc(=O)c(co2)O 62a_100009840296_100000010605 [0,2,0,0,0,0|2,0,0]=4 4326 B19R2.149413 Nc1ncc(cc1Br)SCc2cc(=O)c(co2)O 62a_100012353989_100000010605 [0,2,0,0,0,0|1,0,0]=3 4327 B19R2.149413 Nc1ncc(cc1Cl)SCc2cc(=O)c(co2)O 62a_100012356299_100000010605 [0,2,0,0,0,0|1,0,0]=3 4328 B19R2.149413 Nc1ncc(cc1F)SCc2cc(=O)c(co2)O 62a_100000693161_100000010605 [0,2,0,0,0,0|1,0,0]=3 4329 B19R2.149413 Nc1ncc(cc1O)SCc2cc(=O)c(co2)O 62a_100009819042_100000010605 [0,2,0,0,0,0|1,0,0]=3 4330 B19R2.149413 Nc1ncc(nc1Br)SCc2cc(=O)c(co2)O 62a_100010982571_100000010605 [0,2,0,0,0,0|2,0,0]=4 4331 B19R2.149413 Nc1ncc(nc1Cl)SCc2cc(=O)c(co2)O 62a_100010733632_100000010605 [0,2,0,0,0,0|2,0,0]=4 4332 B19R2.149413 Nc1ncc(nc1N)SCc2cc(=O)c(co2)O 62a_100009816827_100000010605 [0,2,0,0,0,0|2,0,0]=4 4333 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Br)Br 2230a_100011306057_100000010605 [0,2,0,0,0,0|1,0,0]=3 4334 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Br)Br 7a_100011306057_100000010605 [0,2,0,0,0,0|1,0,0]=3 4335 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Br)Cl 2230a_100000686031_100000010605 [0,2,0,0,0,0|1,0,0]=3 4336 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Br)F 2230a_100000760356_100000010605 [0,2,0,0,0,0|1,0,0]=3 4337 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Br)F 7a_100000760356_100000010605 [0,2,0,0,0,0|1,0,0]=3 4338 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Cl)Br 2230a_100000687081_100000010605 [0,2,0,0,0,0|1,0,0]=3 4339 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Cl)Br 7a_100000687081_100000010605 [0,2,0,0,0,0|1,0,0]=3 4340 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Cl)Cl 2230a_100000184108_100000010605 [0,2,0,0,0,0|1,0,0]=3 4341 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Cl)F 2230a_100000211060_100000010605 [0,2,0,0,0,0|1,0,0]=3 4342 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)Cl)F 7a_100000211060_100000010605 [0,2,0,0,0,0|1,0,0]=3 4343 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)Br 2230a_100000759894_100000010605 [0,2,0,0,0,0|1,0,0]=3 4344 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)Br 7a_100000759894_100000010605 [0,2,0,0,0,0|1,0,0]=3 4345 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)Cl 2230a_100000739366_100000010605 [0,2,0,0,0,0|1,0,0]=3 4346 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)Cl 7a_100000739366_100000010605 [0,2,0,0,0,0|1,0,0]=3 4347 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)F 2230a_100000210724_100000010605 [0,2,0,0,0,0|1,0,0]=3 4348 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)F 7a_100000210724_100000010605 [0,2,0,0,0,0|1,0,0]=3 4349 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)I 7a_100011356925_100000010605 [0,2,0,0,0,0|1,0,0]=3 4350 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)F)O 7a_100011220035_100000010605 [0,2,0,0,0,0|1,0,0]=3 4351 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)I)F 7a_114828291077_100000010605 [0,2,0,0,0,0|1,0,0]=3 4352 B19R2.149413 O=c1cc(occ1O)CNc2ccc(c(c2)O)F 7a_100012017398_100000010605 [0,2,0,0,0,0|1,0,0]=3 4353 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Br)Cl 7a_100011933957_100000010605 [0,2,0,0,0,0|0,1,0]=3 4354 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Br)F 7a_100000693481_100000010605 [0,2,0,0,0,0|0,1,0]=3 4355 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Br)I 7a_100000701344_100000010605 [0,2,0,0,0,0|0,1,0]=3 4356 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Cl)Br 7a_100011215161_100000010605 [0,2,0,0,0,0|0,1,0]=3 4357 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Cl)Cl 7a_100000211054_100000010605 [0,2,0,0,0,0|0,1,0]=3 4358 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Cl)F 7a_100000211030_100000010605 [0,2,0,0,0,0|0,1,0]=3 4359 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)Cl)I 7a_100000047559_100000010605 [0,2,0,0,0,0|0,1,0]=3 4360 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)F)Br 7a_100000755031_100000010605 [0,2,0,0,0,0|0,1,0]=3 4361 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)F)Cl 7a_100000691581_100000010605 [0,2,0,0,0,0|0,1,0]=3 4362 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)F)F 7a_100000181275_100000010605 [0,2,0,0,0,0|0,1,0]=3 4363 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)F)I 7a_100009990212_100000010605 [0,2,0,0,0,0|0,1,0]=3 4364 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)I)Br 7a_100012339312_100000010605 [0,2,0,0,0,0|0,1,0]=3 4365 B19R2.149413 O=c1cc(occ1O)COc2ccc(c(c2)I)Cl 7a_100000049588_100000010605 [0,2,0,0,0,0|0,1,0]=3 4366 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)Br)Cl 7a_100012356455_100000010605 [0,2,0,0,0,0|1,1,0]=4 4367 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)Br)F 7a_100009817267_100000010605 [0,2,0,0,0,0|1,1,0]=4 4368 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)Cl)Br 7a_100010209684_100000010605 [0,2,0,0,0,0|1,1,0]=4 4369 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)Cl)Cl 7a_100000094354_100000010605 [0,2,0,0,0,0|1,1,0]=4 4370 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)Cl)F 7a_100000087088_100000010605 [0,2,0,0,0,0|1,1,0]=4 4371 B19R2.149413 O=c1cc(occ1O)COc2cnc(c(c2)F)Cl 7a_100000063512_100000010605 [0,2,0,0,0,0|1,1,0]=4 4372 B19R2.149413 O=c1cc(occ1O)CSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100000010605 [0,2,0,0,0,0|1,0,0]=3 4373 B19R2.149413 O=c1cc(occ1O)CSc2c[nH]c(=O)c(c2)F 62a_100000723523_100000010605 [0,2,0,0,0,0|1,0,0]=3 4374 B19R2.149413 O=c1cc(occ1O)CSc2cc(c(cn2)F)O 62a_100009854642_100000010605 [0,2,0,0,0,0|1,0,0]=3 4375 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Br)Br 62a_100012356285_100000010605 [0,2,0,0,0,0|0,0,0]=2 4376 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Br)Cl 62a_100012353702_100000010605 [0,2,0,0,0,0|0,0,0]=2 4377 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Br)F 62a_100012047266_100000010605 [0,2,0,0,0,0|0,0,0]=2 4378 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Br)O 62a_100012361655_100000010605 [0,2,0,0,0,0|0,0,0]=2 4379 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Cl)Br 62a_100012047281_100000010605 [0,2,0,0,0,0|0,0,0]=2 4380 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Cl)Cl 62a_100011214914_100000010605 [0,2,0,0,0,0|0,0,0]=2 4381 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Cl)F 62a_100011215976_100000010605 [0,2,0,0,0,0|0,0,0]=2 4382 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)Cl)O 62a_100012360047_100000010605 [0,2,0,0,0,0|0,0,0]=2 4383 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)F)Br 62a_100000685389_100000010605 [0,2,0,0,0,0|0,0,0]=2 4384 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)F)Cl 62a_100011216805_100000010605 [0,2,0,0,0,0|0,0,0]=2 4385 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)F)F 62a_100000703953_100000010605 [0,2,0,0,0,0|0,0,0]=2 4386 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)F)O 62a_100000185481_100000010605 [0,2,0,0,0,0|0,0,0]=2 4387 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)O)Br 62a_100012356990_100000010605 [0,2,0,0,0,0|0,0,0]=2 4388 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)O)Cl 62a_100011356854_100000010605 [0,2,0,0,0,0|0,0,0]=2 4389 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(c2)O)F 62a_100000686035_100000010605 [0,2,0,0,0,0|0,0,0]=2 4390 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(n2)Br)O 62a_100000725334_100000010605 [0,2,0,0,0,0|1,0,0]=3 4391 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(n2)F)Br 62a_100010134343_100000010605 [0,2,0,0,0,0|1,0,0]=3 4392 B19R2.149413 O=c1cc(occ1O)CSc2ccc(c(n2)F)O 62a_100009819667_100000010605 [0,2,0,0,0,0|1,0,0]=3 4393 B19R2.149413 O=c1cc(occ1O)CSc2cnc(c(c2)Br)Cl 62a_100010172733_100000010605 [0,2,0,0,0,0|1,0,0]=3 4394 B19R2.149413 O=c1cc(occ1O)CSc2cnc(c(c2)Cl)O 62a_100010238531_100000010605 [0,2,0,0,0,0|1,0,0]=3 4395 B19R2.149413 O=c1cc(occ1O)CSc2cnc(c(c2)F)F 62a_100009817721_100000010605 [0,2,0,0,0,0|1,0,0]=3 4396 B19R2.149413 O=c1cc(occ1O)CSc2cnc(c(c2)O)F 62a_100009819871_100000010605 [0,2,0,0,0,0|1,0,0]=3 4397 B19R2.48214 Cc1c(cccc1NCc2cc(=O)c(co2)O)Cl 2230a_100000210441_100000010605 [0,2,0,0,0,0|1,0,0]=3 4398 B19R2.48214 Cc1c(cccc1NCc2cc(=O)c(co2)O)Cl 7a_100000210441_100000010605 [0,2,0,0,0,0|1,0,0]=3 4399 B19R2.48214 Cc1c(cccc1NCc2cc(=O)c(co2)O)F 7a_100000745574_100000010605 [0,2,0,0,0,0|1,0,0]=3 4400 B19R2.48214 Cc1c(cccc1NCc2cc(=O)c(co2)O)O 7a_100011216573_100000010605 [0,2,0,0,0,0|1,0,0]=3 4401 B19R2.48214 Cc1c(cccc1OCc2cc(=O)c(co2)O)Br 7a_100012002258_100000010605 [0,2,0,0,0,0|0,1,0]=3 4402 B19R2.48214 Cc1c(cccc1OCc2cc(=O)c(co2)O)Cl 7a_100011265684_100000010605 [0,2,0,0,0,0|0,1,0]=3 4403 B19R2.48214 Cc1c(cccc1OCc2cc(=O)c(co2)O)F 7a_100011217231_100000010605 [0,2,0,0,0,0|0,1,0]=3 4404 B19R2.48214 Cc1c(cccc1OCc2cc(=O)c(co2)O)N 7a_100011216573_100000010605 [0,2,0,0,0,0|0,1,0]=3 4405 B19R2.48214 Cc1c(cccc1SCc2cc(=O)c(co2)O)Br 62a_100012353703_100000010605 [0,2,0,0,0,0|0,0,0]=2 4406 B19R2.48214 Cc1c(cccc1SCc2cc(=O)c(co2)O)Cl 62a_100000726075_100000010605 [0,2,0,0,0,0|0,0,0]=2 4407 B19R2.48214 Cc1c(cccc1SCc2cc(=O)c(co2)O)F 62a_100011216893_100000010605 [0,2,0,0,0,0|0,0,0]=2 4408 B19R2.48214 Cc1c(cccc1SCc2cc(=O)c(co2)O)N 62a_100000761887_100000010605 [0,2,0,0,0,0|0,0,0]=2 4409 B19R2.48214 Cc1c(cccc1SCc2cc(=O)c(co2)O)O 62a_100012002258_100000010605 [0,2,0,0,0,0|0,0,0]=2 4410 B19R2.48214 Cc1c(ccnc1Cl)SCc2cc(=O)c(co2)O 62a_100000047055_100000010605 [0,2,0,0,0,0|1,0,0]=3 4411 B19R2.48214 Cc1c(ccnc1F)SCc2cc(=O)c(co2)O 62a_100010006593_100000010605 [0,2,0,0,0,0|1,0,0]=3 4412 B19R2.48214 Cc1c(ccnc1N)SCc2cc(=O)c(co2)O 62a_100009865460_100000010605 [0,2,0,0,0,0|1,0,0]=3 4413 B19R2.48214 Cc1c(ccnc1O)SCc2cc(=O)c(co2)O 62a_100009858498_100000010605 [0,2,0,0,0,0|1,0,0]=3 4414 B19R2.48214 Cc1c(ccnc1SCc2cc(=O)c(co2)O)F 62a_100009846374_100000010605 [0,2,0,0,0,0|1,0,0]=3 4415 B19R2.48214 Cc1c(ccnc1SCc2cc(=O)c(co2)O)N 62a_100000690622_100000010605 [0,2,0,0,0,0|1,0,0]=3 4416 B19R2.48214 Cc1c(cncc1SCc2cc(=O)c(co2)O)Br 62a_100010109657_100000010605 [0,2,0,0,0,0|1,0,0]=3 4417 B19R2.48214 Cc1c(cncc1SCc2cc(=O)c(co2)O)F 62a_100009881546_100000010605 [0,2,0,0,0,0|1,0,0]=3 4418 B19R2.48214 Cc1c(cncc1SCc2cc(=O)c(co2)O)N 62a_100011998293_100000010605 [0,2,0,0,0,0|1,0,0]=3 4419 B19R2.48214 Cc1c(cnnc1N)SCc2cc(=O)c(co2)O 62a_200011012967_100000010605 [0,2,0,0,0,0|2,0,0]=4 4420 B19R2.48214 Cc1c(cnnc1SCc2cc(=O)c(co2)O)N 62a_200011012966_100000010605 [0,2,0,0,0,0|2,0,0]=4 4421 B19R2.48214 Cc1c(ncnc1SCc2cc(=O)c(co2)O)N 62a_100011913465_100000010605 [0,2,0,0,0,0|2,0,0]=4 4422 B19R2.48214 Cc1cccc(c1Br)OCc2cc(=O)c(co2)O 7a_100000686692_100000010605 [0,2,0,0,0,0|0,1,0]=3 4423 B19R2.48214 Cc1cccc(c1Br)SCc2cc(=O)c(co2)O 62a_100012362457_100000010605 [0,2,0,0,0,0|0,0,0]=2 4424 B19R2.48214 Cc1cccc(c1C)NCc2cc(=O)c(co2)O 2230a_100000210026_100000010605 [0,2,0,0,0,0|1,0,0]=3 4425 B19R2.48214 Cc1cccc(c1C)NCc2cc(=O)c(co2)O 7a_100000210026_100000010605 [0,2,0,0,0,0|1,0,0]=3 4426 B19R2.48214 Cc1cccc(c1C)OCc2cc(=O)c(co2)O 7a_100000185855_100000010605 [0,2,0,0,0,0|0,1,0]=3 4427 B19R2.48214 Cc1cccc(c1C)SCc2cc(=O)c(co2)O 62a_100011214922_100000010605 [0,2,0,0,0,0|0,0,0]=2 4428 B19R2.48214 Cc1cccc(c1Cl)NCc2cc(=O)c(co2)O 7a_100000765562_100000010605 [0,2,0,0,0,0|1,0,0]=3 4429 B19R2.48214 Cc1cccc(c1Cl)OCc2cc(=O)c(co2)O 7a_100000695629_100000010605 [0,2,0,0,0,0|0,1,0]=3 4430 B19R2.48214 Cc1cccc(c1Cl)SCc2cc(=O)c(co2)O 62a_200012352035_100000010605 [0,2,0,0,0,0|0,0,0]=2 4431 B19R2.48214 Cc1cccc(c1F)NCc2cc(=O)c(co2)O 2230a_100000697159_100000010605 [0,2,0,0,0,0|1,0,0]=3 4432 B19R2.48214 Cc1cccc(c1F)NCc2cc(=O)c(co2)O 7a_100000697159_100000010605 [0,2,0,0,0,0|1,0,0]=3 4433 B19R2.48214 Cc1cccc(c1F)OCc2cc(=O)c(co2)O 7a_100000751311_100000010605 [0,2,0,0,0,0|0,1,0]=3 4434 B19R2.48214 Cc1cccc(c1F)SCc2cc(=O)c(co2)O 62a_100000717567_100000010605 [0,2,0,0,0,0|0,0,0]=2 4435 B19R2.48214 Cc1cccc(c1I)OCc2cc(=O)c(co2)O 7a_100010083724_100000010605 [0,2,0,0,0,0|0,1,0]=3 4436 B19R2.48214 Cc1cccc(c1N)OCc2cc(=O)c(co2)O 7a_100000743429_100000010605 [0,2,0,0,0,0|0,1,0]=3 4437 B19R2.48214 Cc1cccc(c1N)SCc2cc(=O)c(co2)O 62a_100011834072_100000010605 [0,2,0,0,0,0|0,0,0]=2 4438 B19R2.48214 Cc1cccc(c1O)SCc2cc(=O)c(co2)O 62a_100009817157_100000010605 [0,2,0,0,0,0|0,0,0]=2 4439 B19R2.48214 Cc1ccnc(c1C)SCc2cc(=O)c(co2)O 62a_100009847204_100000010605 [0,2,0,0,0,0|1,0,0]=3 4440 B19R2.48214 Cc1ccnc(c1F)SCc2cc(=O)c(co2)O 62a_100009817629_100000010605 [0,2,0,0,0,0|1,0,0]=3 4441 B19R2.48214 Cc1ccnc(c1N)SCc2cc(=O)c(co2)O 62a_100000763560_100000010605 [0,2,0,0,0,0|1,0,0]=3 4442 B19R2.48214 Cc1cncc(c1C)SCc2cc(=O)c(co2)O 62a_100009864703_100000010605 [0,2,0,0,0,0|1,0,0]=3 4443 B19R2.48214 Cc1cncc(c1N)SCc2cc(=O)c(co2)O 62a_100009818025_100000010605 [0,2,0,0,0,0|1,0,0]=3 4444 B19R2.48214 Cc1nccc(c1C)SCc2cc(=O)c(co2)O 62a_100009846815_100000010605 [0,2,0,0,0,0|1,0,0]=3 4445 B19R2.48214 Cc1nccc(c1Cl)SCc2cc(=O)c(co2)O 62a_100000698670_100000010605 [0,2,0,0,0,0|1,0,0]=3 4446 B19R2.48214 Cc1nccc(c1F)SCc2cc(=O)c(co2)O 62a_100009849794_100000010605 [0,2,0,0,0,0|1,0,0]=3 4447 B19R2.48214 Cc1nccc(c1N)SCc2cc(=O)c(co2)O 62a_100009885578_100000010605 [0,2,0,0,0,0|1,0,0]=3 4448 B19R2.48214 Cc1ncnc(c1C)SCc2cc(=O)c(co2)O 62a_100011438038_100000010605 [0,2,0,0,0,0|2,0,0]=4 4449 B19R2.48214 Cc1ncnc(c1F)SCc2cc(=O)c(co2)O 62a_100011671633_100000010605 [0,2,0,0,0,0|2,0,0]=4 4450 B19R2.48214 Cn1c(cccc1=O)SCc2cc(=O)c(co2)O 62a_100000726605_100000010605 [0,2,0,0,0,0|1,0,0]=3 4451 B19R2.48214 Cn1cccc(c1=O)OCc2cc(=O)c(co2)O 7a_100000117616_100000010605 [0,2,0,0,0,0|1,1,0]=4 4452 B19R2.48214 Cn1cccc(c1=O)SCc2cc(=O)c(co2)O 62a_100000687173_100000010605 [0,2,0,0,0,0|1,0,0]=3 4453 B19R2.48214 Nc1c(cccc1OCc2cc(=O)c(co2)O)Br 7a_100011934926_100000010605 [0,2,0,0,0,0|0,1,0]=3 4454 B19R2.48214 Nc1c(cccc1OCc2cc(=O)c(co2)O)Cl 7a_100012022510_100000010605 [0,2,0,0,0,0|0,1,0]=3 4455 B19R2.48214 Nc1c(cccc1OCc2cc(=O)c(co2)O)F 7a_100020591140_100000010605 [0,2,0,0,0,0|0,1,0]=3 4456 B19R2.48214 Nc1c(cccc1OCc2cc(=O)c(co2)O)I 7a_200000049512_100000010605 [0,2,0,0,0,0|0,1,0]=3 4457 B19R2.48214 Nc1c(cccc1SCc2cc(=O)c(co2)O)Br 62a_100010146558_100000010605 [0,2,0,0,0,0|0,0,0]=2 4458 B19R2.48214 Nc1c(cccc1SCc2cc(=O)c(co2)O)Cl 62a_100010190421_100000010605 [0,2,0,0,0,0|0,0,0]=2 4459 B19R2.48214 Nc1c(cccc1SCc2cc(=O)c(co2)O)F 62a_100000042321_100000010605 [0,2,0,0,0,0|0,0,0]=2 4460 B19R2.48214 Nc1c(cncc1SCc2cc(=O)c(co2)O)Br 62a_100011290786_100000010605 [0,2,0,0,0,0|1,0,0]=3 4461 B19R2.48214 Nc1c(cncc1SCc2cc(=O)c(co2)O)Cl 62a_100000684942_100000010605 [0,2,0,0,0,0|1,0,0]=3 4462 B19R2.48214 Nc1c(cncc1SCc2cc(=O)c(co2)O)F 62a_100009880649_100000010605 [0,2,0,0,0,0|1,0,0]=3 4463 B19R2.48214 Nc1cccc(c1Br)OCc2cc(=O)c(co2)O 7a_100012183704_100000010605 [0,2,0,0,0,0|0,1,0]=3 4464 B19R2.48214 Nc1cccc(c1Cl)OCc2cc(=O)c(co2)O 7a_100012002038_100000010605 [0,2,0,0,0,0|0,1,0]=3 4465 B19R2.48214 Nc1cccc(c1F)SCc2cc(=O)c(co2)O 62a_100011935091_100000010605 [0,2,0,0,0,0|0,0,0]=2 4466 B19R2.48214 Nc1cccc(c1N)SCc2cc(=O)c(co2)O 62a_100015191791_100000010605 [0,2,0,0,0,0|0,0,0]=2 4467 B19R2.48214 Nc1cccc(c1O)SCc2cc(=O)c(co2)O 62a_100011934915_100000010605 [0,2,0,0,0,0|0,0,0]=2 4468 B19R2.48214 Nc1ccnc(c1F)SCc2cc(=O)c(co2)O 62a_100015205195_100000010605 [0,2,0,0,0,0|1,0,0]=3 4469 B19R2.48214 Nc1ccnc(c1N)SCc2cc(=O)c(co2)O 62a_100000085203_100000010605 [0,2,0,0,0,0|1,0,0]=3 4470 B19R2.48214 Nc1cncc(c1N)SCc2cc(=O)c(co2)O 62a_100000694774_100000010605 [0,2,0,0,0,0|1,0,0]=3 4471 B19R2.48214 Nc1cncc(c1O)SCc2cc(=O)c(co2)O 62a_100000694263_100000010605 [0,2,0,0,0,0|1,0,0]=3 4472 B19R2.48214 Nc1nccc(c1Cl)SCc2cc(=O)c(co2)O 62a_100010735111_100000010605 [0,2,0,0,0,0|1,0,0]=3 4473 B19R2.48214 Nc1nccc(c1F)SCc2cc(=O)c(co2)O 62a_100010077785_100000010605 [0,2,0,0,0,0|1,0,0]=3 4474 B19R2.48214 Nc1nccc(c1N)SCc2cc(=O)c(co2)O 62a_100000124095_100000010605 [0,2,0,0,0,0|1,0,0]=3 4475 B19R2.48214 Nc1ncnc(c1F)SCc2cc(=O)c(co2)O 62a_100000126652_100000010605 [0,2,0,0,0,0|2,0,0]=4 4476 B19R2.48214 Nc1ncnc(c1N)SCc2cc(=O)c(co2)O 62a_100000766367_100000010605 [0,2,0,0,0,0|2,0,0]=4 4477 B19R2.48214 O=c1cc(occ1O)CNc2cccc(c2Br)O 7a_100012183704_100000010605 [0,2,0,0,0,0|1,0,0]=3 4478 B19R2.48214 O=c1cc(occ1O)CNc2cccc(c2Cl)O 7a_100012002038_100000010605 [0,2,0,0,0,0|1,0,0]=3 4479 B19R2.48214 O=c1cc(occ1O)CNc2cccc(c2F)Br 2230a_100011935091_100000010605 [0,2,0,0,0,0|1,0,0]=3 4480 B19R2.48214 O=c1cc(occ1O)CNc2cccc(c2F)Cl 2230a_100000199060_100000010605 [0,2,0,0,0,0|1,0,0]=3 4481 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Br)Br 7a_100010187966_100000010605 [0,2,0,0,0,0|0,1,0]=3 4482 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Br)Cl 7a_100012348804_100000010605 [0,2,0,0,0,0|0,1,0]=3 4483 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Br)F 7a_100009820682_100000010605 [0,2,0,0,0,0|0,1,0]=3 4484 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Br)I 7a_100010187914_100000010605 [0,2,0,0,0,0|0,1,0]=3 4485 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Cl)Br 7a_100010187913_100000010605 [0,2,0,0,0,0|0,1,0]=3 4486 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Cl)Cl 7a_100000211076_100000010605 [0,2,0,0,0,0|0,1,0]=3 4487 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Cl)F 7a_100000087408_100000010605 [0,2,0,0,0,0|0,1,0]=3 4488 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2Cl)I 7a_100000049636_100000010605 [0,2,0,0,0,0|0,1,0]=3 4489 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2F)Br 7a_100009817021_100000010605 [0,2,0,0,0,0|0,1,0]=3 4490 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2F)Cl 7a_100000687438_100000010605 [0,2,0,0,0,0|0,1,0]=3 4491 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2F)F 7a_100000751161_100000010605 [0,2,0,0,0,0|0,1,0]=3 4492 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2I)Br 7a_100010187912_100000010605 [0,2,0,0,0,0|0,1,0]=3 4493 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2I)Cl 7a_100000050174_100000010605 [0,2,0,0,0,0|0,1,0]=3 4494 B19R2.48214 O=c1cc(occ1O)COc2cccc(c2I)F 7a_100000690913_100000010605 [0,2,0,0,0,0|0,1,0]=3 4495 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Br)Br 62a_100010175083_100000010605 [0,2,0,0,0,0|0,0,0]=2 4496 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Br)Cl 62a_100014021842_100000010605 [0,2,0,0,0,0|0,0,0]=2 4497 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Br)F 62a_100010202630_100000010605 [0,2,0,0,0,0|0,0,0]=2 4498 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Br)O 62a_100010187914_100000010605 [0,2,0,0,0,0|0,0,0]=2 4499 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Cl)Br 62a_100010142854_100000010605 [0,2,0,0,0,0|0,0,0]=2 4500 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Cl)Cl 62a_100011215384_100000010605 [0,2,0,0,0,0|0,0,0]=2 4501 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2Cl)F 62a_200010234923_100000010605 [0,2,0,0,0,0|0,0,0]=2 4502 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2F)Br 62a_100000702267_100000010605 [0,2,0,0,0,0|0,0,0]=2 4503 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2F)Cl 62a_100011217346_100000010605 [0,2,0,0,0,0|0,0,0]=2 4504 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2F)F 62a_100000694657_100000010605 [0,2,0,0,0,0|0,0,0]=2 4505 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2F)O 62a_100009817021_100000010605 [0,2,0,0,0,0|0,0,0]=2 4506 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2O)Br 62a_100010084509_100000010605 [0,2,0,0,0,0|0,0,0]=2 4507 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2O)Cl 62a_100010202889_100000010605 [0,2,0,0,0,0|0,0,0]=2 4508 B19R2.48214 O=c1cc(occ1O)CSc2cccc(c2O)F 62a_100009813666_100000010605 [0,2,0,0,0,0|0,0,0]=2 4509 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2Br)F 62a_100010006599_100000010605 [0,2,0,0,0,0|1,0,0]=3 4510 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2Cl)Cl 62a_100010246212_100000010605 [0,2,0,0,0,0|1,0,0]=3 4511 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2Cl)F 62a_100010067886_100000010605 [0,2,0,0,0,0|1,0,0]=3 4512 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2F)Br 62a_200015269031_100000010605 [0,2,0,0,0,0|1,0,0]=3 4513 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2F)Cl 62a_100010150473_100000010605 [0,2,0,0,0,0|1,0,0]=3 4514 B19R2.48214 O=c1cc(occ1O)CSc2ccnc(c2F)F 62a_100010214882_100000010605 [0,2,0,0,0,0|1,0,0]=3 4515 B19R2.48214 O=c1cc(occ1O)CSc2nccc(c2F)O 62a_100009876375_100000010605 [0,2,0,0,0,0|1,0,0]=3 4516 B19R2.62015 Cc1cccc(c1OCc2cc(=O)c(co2)O)Br 7a_100009817157_100000010605 [0,2,0,0,0,0|0,1,0]=3 4517 B19R2.62015 Cc1cccc(c1OCc2cc(=O)c(co2)O)C 7a_100000210341_100000010605 [0,2,0,0,0,0|0,1,0]=3 4518 B19R2.62015 Cc1cccc(c1OCc2cc(=O)c(co2)O)Cl 7a_100000033731_100000010605 [0,2,0,0,0,0|0,1,0]=3 4519 B19R2.62015 Cc1cccc(c1OCc2cc(=O)c(co2)O)F 7a_100011659162_100000010605 [0,2,0,0,0,0|0,1,0]=3 4520 B19R2.62015 Cc1cccc(c1OCc2cc(=O)c(co2)O)N 7a_100000756359_100000010605 [0,2,0,0,0,0|0,1,0]=3 4521 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)Br 62a_100010141302_100000010605 [0,2,0,0,0,0|0,0,0]=2 4522 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)C 62a_100000033847_100000010605 [0,2,0,0,0,0|0,0,0]=2 4523 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)Cl 62a_100000043165_100000010605 [0,2,0,0,0,0|0,0,0]=2 4524 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)F 62a_100011218421_100000010605 [0,2,0,0,0,0|0,0,0]=2 4525 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)N 62a_100000684715_100000010605 [0,2,0,0,0,0|0,0,0]=2 4526 B19R2.62015 Cc1cccc(c1SCc2cc(=O)c(co2)O)O 62a_100000686692_100000010605 [0,2,0,0,0,0|0,0,0]=2 4527 B19R2.62015 Cc1ccnc(c1OCc2cc(=O)c(co2)O)C 7a_100011934651_100000010605 [0,2,0,0,0,0|1,1,0]=4 4528 B19R2.62015 Cc1ccnc(c1OCc2cc(=O)c(co2)O)Cl 7a_100000696282_100000010605 [0,2,0,0,0,0|1,1,0]=4 4529 B19R2.62015 Cc1ccnc(c1SCc2cc(=O)c(co2)O)C 62a_100012000501_100000010605 [0,2,0,0,0,0|1,0,0]=3 4530 B19R2.62015 Cc1ccnc(c1SCc2cc(=O)c(co2)O)Cl 62a_100010248874_100000010605 [0,2,0,0,0,0|1,0,0]=3 4531 B19R2.62015 Cc1ccnc(c1SCc2cc(=O)c(co2)O)F 62a_100009818256_100000010605 [0,2,0,0,0,0|1,0,0]=3 4532 B19R2.62015 Cc1ccnc(c1SCc2cc(=O)c(co2)O)N 62a_100011998619_100000010605 [0,2,0,0,0,0|1,0,0]=3 4533 B19R2.62015 Cc1ccnc(c1SCc2cc(=O)c(co2)O)O 62a_100012000493_100000010605 [0,2,0,0,0,0|1,0,0]=3 4534 B19R2.62015 Cc1cncc(c1SCc2cc(=O)c(co2)O)C 62a_100009817138_100000010605 [0,2,0,0,0,0|1,0,0]=3 4535 B19R2.62015 Cc1nc[nH]c(=O)c1SCc2cc(=O)c(co2)O 62a_100011356812_100000010605 [0,2,0,0,0,0|2,0,0]=4 4536 B19R2.62015 Cc1nccc(c1SCc2cc(=O)c(co2)O)N 62a_100010243816_100000010605 [0,2,0,0,0,0|1,0,0]=3 4537 B19R2.62015 Cc1ncnc(c1SCc2cc(=O)c(co2)O)C 62a_100009820708_100000010605 [0,2,0,0,0,0|2,0,0]=4 4538 B19R2.62015 Cc1ncnc(c1SCc2cc(=O)c(co2)O)Cl 62a_100012356128_100000010605 [0,2,0,0,0,0|2,0,0]=4 4539 B19R2.62015 Cc1ncnc(c1SCc2cc(=O)c(co2)O)N 62a_100011996190_100000010605 [0,2,0,0,0,0|2,0,0]=4 4540 B19R2.62015 Nc1cccc(c1SCc2cc(=O)c(co2)O)Br 62a_100020590159_100000010605 [0,2,0,0,0,0|0,0,0]=2 4541 B19R2.62015 Nc1cccc(c1SCc2cc(=O)c(co2)O)Cl 62a_100000049713_100000010605 [0,2,0,0,0,0|0,0,0]=2 4542 B19R2.62015 Nc1cccc(c1SCc2cc(=O)c(co2)O)F 62a_100000690935_100000010605 [0,2,0,0,0,0|0,0,0]=2 4543 B19R2.62015 Nc1cccc(c1SCc2cc(=O)c(co2)O)O 62a_100012183704_100000010605 [0,2,0,0,0,0|0,0,0]=2 4544 B19R2.62015 Nc1ccnc(c1OCc2cc(=O)c(co2)O)Cl 7a_100009844647_100000010605 [0,2,0,0,0,0|1,1,0]=4 4545 B19R2.62015 Nc1ccnc(c1SCc2cc(=O)c(co2)O)Cl 62a_100010208016_100000010605 [0,2,0,0,0,0|1,0,0]=3 4546 B19R2.62015 Nc1ccnc(c1SCc2cc(=O)c(co2)O)F 62a_100010381272_100000010605 [0,2,0,0,0,0|1,0,0]=3 4547 B19R2.62015 Nc1nc[nH]c(=O)c1SCc2cc(=O)c(co2)O 62a_200011345422_100000010605 [0,2,0,0,0,0|2,0,0]=4 4548 B19R2.62015 Nc1nccc(c1SCc2cc(=O)c(co2)O)Cl 62a_100010199028_100000010605 [0,2,0,0,0,0|1,0,0]=3 4549 B19R2.62015 Nc1ncnc(c1SCc2cc(=O)c(co2)O)Cl 62a_100010371481_100000010605 [0,2,0,0,0,0|2,0,0]=4 4550 B19R2.62015 Nc1ncnc(c1SCc2cc(=O)c(co2)O)N 62a_100010128106_100000010605 [0,2,0,0,0,0|2,0,0]=4 4551 B19R2.62015 O=c1cc(occ1O)CNc2c(cccc2F)F 2230a_100000210704_100000010605 [0,2,0,0,0,0|1,0,0]=3 4552 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2Br)Br 7a_100000736428_100000010605 [0,2,0,0,0,0|0,1,0]=3 4553 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2Br)Cl 7a_100010214474_100000010605 [0,2,0,0,0,0|0,1,0]=3 4554 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2Br)F 7a_100009813666_100000010605 [0,2,0,0,0,0|0,1,0]=3 4555 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2Cl)Cl 7a_100000211709_100000010605 [0,2,0,0,0,0|0,1,0]=3 4556 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2Cl)F 7a_100000694953_100000010605 [0,2,0,0,0,0|0,1,0]=3 4557 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2F)F 7a_100000230165_100000010605 [0,2,0,0,0,0|0,1,0]=3 4558 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2I)Br 7a_100010084509_100000010605 [0,2,0,0,0,0|0,1,0]=3 4559 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2I)Cl 7a_100010202889_100000010605 [0,2,0,0,0,0|0,1,0]=3 4560 B19R2.62015 O=c1cc(occ1O)COc2c(cccc2I)F 7a_100010186298_100000010605 [0,2,0,0,0,0|0,1,0]=3 4561 B19R2.62015 O=c1cc(occ1O)COc2c(ccnc2Cl)Cl 7a_100000118450_100000010605 [0,2,0,0,0,0|1,1,0]=4 4562 B19R2.62015 O=c1cc(occ1O)COc2c(ccnc2Cl)F 7a_100009867227_100000010605 [0,2,0,0,0,0|1,1,0]=4 4563 B19R2.62015 O=c1cc(occ1O)COc2c(ccnc2Cl)I 7a_100010067911_100000010605 [0,2,0,0,0,0|1,1,0]=4 4564 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Br)Br 62a_100009994525_100000010605 [0,2,0,0,0,0|0,0,0]=2 4565 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Br)Cl 62a_100010214488_100000010605 [0,2,0,0,0,0|0,0,0]=2 4566 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Br)F 62a_100011219512_100000010605 [0,2,0,0,0,0|0,0,0]=2 4567 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Br)O 62a_100010187912_100000010605 [0,2,0,0,0,0|0,0,0]=2 4568 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Cl)Cl 62a_100000034237_100000010605 [0,2,0,0,0,0|0,0,0]=2 4569 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2Cl)F 62a_100000050007_100000010605 [0,2,0,0,0,0|0,0,0]=2 4570 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2F)F 62a_100000693133_100000010605 [0,2,0,0,0,0|0,0,0]=2 4571 B19R2.62015 O=c1cc(occ1O)CSc2c(cccc2F)O 62a_100009820682_100000010605 [0,2,0,0,0,0|0,0,0]=2 4572 B19R2.62015 O=c1cc(occ1O)CSc2c(ccnc2Cl)Br 62a_100009814607_100000010605 [0,2,0,0,0,0|1,0,0]=3 4573 B19R2.62015 O=c1cc(occ1O)CSc2c(ccnc2Cl)Cl 62a_100000050019_100000010605 [0,2,0,0,0,0|1,0,0]=3 4574 B19R2.62015 O=c1cc(occ1O)CSc2c(ccnc2Cl)F 62a_100000716511_100000010605 [0,2,0,0,0,0|1,0,0]=3 4575 B19R2.62015 O=c1cc(occ1O)CSc2c(ccnc2F)F 62a_100009874084_100000010605 [0,2,0,0,0,0|1,0,0]=3 4576 B19R2.62015 O=c1cc(occ1O)CSc2c(cncc2Br)Br 62a_100010172828_100000010605 [0,2,0,0,0,0|1,0,0]=3 4577 B19R2.62015 O=c1cc(occ1O)CSc2c(cncc2Cl)Cl 62a_100000036193_100000010605 [0,2,0,0,0,0|1,0,0]=3 4578 B19R2.62015 O=c1cc(occ1O)CSc2c(cncc2F)F 62a_100000760538_100000010605 [0,2,0,0,0,0|1,0,0]=3 4579 B19R2.62015 O=c1cc(occ1O)CSc2c(ncnc2F)F 62a_100009816962_100000010605 [0,2,0,0,0,0|2,0,0]=4 4580 B19R2.103470 Cc1c[nH]c(=O)c(n1)SCc2cc(=O)c(co2)O 62a_100009858157_100000010605 [0,2,0,0,0,0|2,0,0]=4 4581 B19R2.103470 Cc1cc(c(=O)[nH]n1)SCc2cc(=O)c(co2)O 62a_100009819039_100000010605 [0,2,0,0,0,0|2,0,0]=4 4582 B19R2.103470 Cc1cc(c(cn1)C)SCc2cc(=O)c(co2)O 62a_100009862788_100000010605 [0,2,0,0,0,0|1,0,0]=3 4583 B19R2.103470 Cc1cc(c(cn1)F)SCc2cc(=O)c(co2)O 62a_100009867690_100000010605 [0,2,0,0,0,0|1,0,0]=3 4584 B19R2.103470 Cc1cc(c(cn1)O)SCc2cc(=O)c(co2)O 62a_100009843476_100000010605 [0,2,0,0,0,0|1,0,0]=3 4585 B19R2.103470 Cc1ccc(c(c1)NCc2cc(=O)c(co2)O)C 2230a_100000185781_100000010605 [0,2,0,0,0,0|1,0,0]=3 4586 B19R2.103470 Cc1ccc(c(c1)NCc2cc(=O)c(co2)O)C 7a_100000185781_100000010605 [0,2,0,0,0,0|1,0,0]=3 4587 B19R2.103470 Cc1ccc(c(c1)OCc2cc(=O)c(co2)O)Br 7a_100012002257_100000010605 [0,2,0,0,0,0|0,1,0]=3 4588 B19R2.103470 Cc1ccc(c(c1)OCc2cc(=O)c(co2)O)C 7a_100000210931_100000010605 [0,2,0,0,0,0|0,1,0]=3 4589 B19R2.103470 Cc1ccc(c(c1)OCc2cc(=O)c(co2)O)Cl 7a_100000211493_100000010605 [0,2,0,0,0,0|0,1,0]=3 4590 B19R2.103470 Cc1ccc(c(c1)OCc2cc(=O)c(co2)O)F 7a_100000759540_100000010605 [0,2,0,0,0,0|0,1,0]=3 4591 B19R2.103470 Cc1ccc(c(c1)OCc2cc(=O)c(co2)O)N 7a_100000211527_100000010605 [0,2,0,0,0,0|0,1,0]=3 4592 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)Br 62a_100012353751_100000010605 [0,2,0,0,0,0|0,0,0]=2 4593 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)C 62a_100000210833_100000010605 [0,2,0,0,0,0|0,0,0]=2 4594 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)Cl 62a_100012356289_100000010605 [0,2,0,0,0,0|0,0,0]=2 4595 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)F 62a_100000736223_100000010605 [0,2,0,0,0,0|0,0,0]=2 4596 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)N 62a_100011356834_100000010605 [0,2,0,0,0,0|0,0,0]=2 4597 B19R2.103470 Cc1ccc(c(c1)SCc2cc(=O)c(co2)O)O 62a_100000765521_100000010605 [0,2,0,0,0,0|0,0,0]=2 4598 B19R2.103470 Cc1ccc(c(n1)SCc2cc(=O)c(co2)O)C 62a_100009854376_100000010605 [0,2,0,0,0,0|1,0,0]=3 4599 B19R2.103470 Cc1ccc(c(n1)SCc2cc(=O)c(co2)O)F 62a_100009817602_100000010605 [0,2,0,0,0,0|1,0,0]=3 4600 B19R2.103470 Cc1ccc(c(n1)SCc2cc(=O)c(co2)O)N 62a_100000685570_100000010605 [0,2,0,0,0,0|1,0,0]=3 4601 B19R2.103470 Cc1ccc(c(n1)SCc2cc(=O)c(co2)O)O 62a_100000702858_100000010605 [0,2,0,0,0,0|1,0,0]=3 4602 B19R2.103470 Cc1ccc(cc1NCc2cc(=O)c(co2)O)Br 7a_100000741167_100000010605 [0,2,0,0,0,0|1,0,0]=3 4603 B19R2.103470 Cc1ccc(cc1NCc2cc(=O)c(co2)O)Cl 7a_100000211374_100000010605 [0,2,0,0,0,0|1,0,0]=3 4604 B19R2.103470 Cc1ccc(cc1NCc2cc(=O)c(co2)O)F 7a_100000211107_100000010605 [0,2,0,0,0,0|1,0,0]=3 4605 B19R2.103470 Cc1ccc(cc1NCc2cc(=O)c(co2)O)I 7a_100000761890_100000010605 [0,2,0,0,0,0|1,0,0]=3 4606 B19R2.103470 Cc1ccc(cc1OCc2cc(=O)c(co2)O)Br 7a_100000685420_100000010605 [0,2,0,0,0,0|0,1,0]=3 4607 B19R2.103470 Cc1ccc(cc1OCc2cc(=O)c(co2)O)Cl 7a_100000756515_100000010605 [0,2,0,0,0,0|0,1,0]=3 4608 B19R2.103470 Cc1ccc(cc1OCc2cc(=O)c(co2)O)F 7a_100000690566_100000010605 [0,2,0,0,0,0|0,1,0]=3 4609 B19R2.103470 Cc1ccc(cc1OCc2cc(=O)c(co2)O)I 7a_100000766334_100000010605 [0,2,0,0,0,0|0,1,0]=3 4610 B19R2.103470 Cc1ccc(cc1OCc2cc(=O)c(co2)O)N 7a_100000759471_100000010605 [0,2,0,0,0,0|0,1,0]=3 4611 B19R2.103470 Cc1ccc(cc1SCc2cc(=O)c(co2)O)Br 62a_100011344865_100000010605 [0,2,0,0,0,0|0,0,0]=2 4612 B19R2.103470 Cc1ccc(cc1SCc2cc(=O)c(co2)O)Cl 62a_100011263213_100000010605 [0,2,0,0,0,0|0,0,0]=2 4613 B19R2.103470 Cc1ccc(cc1SCc2cc(=O)c(co2)O)F 62a_100011218078_100000010605 [0,2,0,0,0,0|0,0,0]=2 4614 B19R2.103470 Cc1ccc(cc1SCc2cc(=O)c(co2)O)N 62a_100000736455_100000010605 [0,2,0,0,0,0|0,0,0]=2 4615 B19R2.103470 Cc1ccc(cc1SCc2cc(=O)c(co2)O)O 62a_100011380479_100000010605 [0,2,0,0,0,0|0,0,0]=2 4616 B19R2.103470 Cc1ccc(nc1SCc2cc(=O)c(co2)O)N 62a_100000126722_100000010605 [0,2,0,0,0,0|1,0,0]=3 4617 B19R2.103470 Cc1cnc(c(c1)OCc2cc(=O)c(co2)O)Cl 7a_100012000487_100000010605 [0,2,0,0,0,0|1,1,0]=4 4618 B19R2.103470 Cc1cnc(c(c1)OCc2cc(=O)c(co2)O)F 7a_100009849810_100000010605 [0,2,0,0,0,0|1,1,0]=4 4619 B19R2.103470 Cc1cnc(c(c1)SCc2cc(=O)c(co2)O)C 62a_100009817436_100000010605 [0,2,0,0,0,0|1,0,0]=3 4620 B19R2.103470 Cc1cnc(c(c1)SCc2cc(=O)c(co2)O)Cl 62a_100010210167_100000010605 [0,2,0,0,0,0|1,0,0]=3 4621 B19R2.103470 Cc1cnc(c(c1)SCc2cc(=O)c(co2)O)F 62a_100000049784_100000010605 [0,2,0,0,0,0|1,0,0]=3 4622 B19R2.103470 Cc1cnc(c(c1)SCc2cc(=O)c(co2)O)N 62a_100000049664_100000010605 [0,2,0,0,0,0|1,0,0]=3 4623 B19R2.103470 Cc1cnc(c(c1)SCc2cc(=O)c(co2)O)O 62a_100000719714_100000010605 [0,2,0,0,0,0|1,0,0]=3 4624 B19R2.103470 Cc1cnc(c(n1)SCc2cc(=O)c(co2)O)C 62a_100000211308_100000010605 [0,2,0,0,0,0|2,0,0]=4 4625 B19R2.103470 Cc1cnc(c(n1)SCc2cc(=O)c(co2)O)N 62a_100009819049_100000010605 [0,2,0,0,0,0|2,0,0]=4 4626 B19R2.103470 Cc1cnc(cc1OCc2cc(=O)c(co2)O)Br 7a_100000704368_100000010605 [0,2,0,0,0,0|1,1,0]=4 4627 B19R2.103470 Cc1cnc(cc1SCc2cc(=O)c(co2)O)Br 62a_100010067628_100000010605 [0,2,0,0,0,0|1,0,0]=3 4628 B19R2.103470 Cc1cnc(cc1SCc2cc(=O)c(co2)O)Cl 62a_100010068021_100000010605 [0,2,0,0,0,0|1,0,0]=3 4629 B19R2.103470 Cc1cnc(cc1SCc2cc(=O)c(co2)O)F 62a_100000049870_100000010605 [0,2,0,0,0,0|1,0,0]=3 4630 B19R2.103470 Cc1cnc(cc1SCc2cc(=O)c(co2)O)N 62a_100009819938_100000010605 [0,2,0,0,0,0|1,0,0]=3 4631 B19R2.103470 Cc1cnc(cc1SCc2cc(=O)c(co2)O)O 62a_100009831917_100000010605 [0,2,0,0,0,0|1,0,0]=3 4632 B19R2.103470 Cc1cnc(nc1SCc2cc(=O)c(co2)O)N 62a_100000016107_100000010605 [0,2,0,0,0,0|2,0,0]=4 4633 B19R2.103470 Cc1ncc(c(n1)SCc2cc(=O)c(co2)O)F 62a_100000059819_100000010605 [0,2,0,0,0,0|2,0,0]=4 4634 B19R2.103470 Cc1ncc(c(n1)SCc2cc(=O)c(co2)O)N 62a_100009873743_100000010605 [0,2,0,0,0,0|2,0,0]=4 4635 B19R2.103470 Cc1ncc(cc1OCc2cc(=O)c(co2)O)Br 7a_100009864810_100000010605 [0,2,0,0,0,0|1,1,0]=4 4636 B19R2.103470 Cc1ncc(cc1SCc2cc(=O)c(co2)O)Br 62a_200010090566_100000010605 [0,2,0,0,0,0|1,0,0]=3 4637 B19R2.103470 Cc1ncc(cc1SCc2cc(=O)c(co2)O)F 62a_100009860710_100000010605 [0,2,0,0,0,0|1,0,0]=3 4638 B19R2.103470 Cc1ncc(cc1SCc2cc(=O)c(co2)O)N 62a_100011998591_100000010605 [0,2,0,0,0,0|1,0,0]=3 4639 B19R2.103470 Cc1ncc(cc1SCc2cc(=O)c(co2)O)O 62a_100009819603_100000010605 [0,2,0,0,0,0|1,0,0]=3 4640 B19R2.103470 Cc1ncc(nc1SCc2cc(=O)c(co2)O)N 62a_100009877824_100000010605 [0,2,0,0,0,0|2,0,0]=4 4641 B19R2.103470 Cn1ccc(=O)c(c1)SCc2cc(=O)c(co2)O 62a_100010750718_100000010605 [0,2,0,0,0,0|1,0,0]=3 4642 B19R2.103470 Nc1cc(c(cn1)Cl)SCc2cc(=O)c(co2)O 62a_100010134119_100000010605 [0,2,0,0,0,0|1,0,0]=3 4643 B19R2.103470 Nc1cc(c(cn1)F)SCc2cc(=O)c(co2)O 62a_100015713587_100000010605 [0,2,0,0,0,0|1,0,0]=3 4644 B19R2.103470 Nc1ccc(c(c1)OCc2cc(=O)c(co2)O)F 7a_100012017398_100000010605 [0,2,0,0,0,0|0,1,0]=3 4645 B19R2.103470 Nc1ccc(c(c1)SCc2cc(=O)c(co2)O)Br 62a_100000750459_100000010605 [0,2,0,0,0,0|0,0,0]=2 4646 B19R2.103470 Nc1ccc(c(c1)SCc2cc(=O)c(co2)O)Cl 62a_100012360549_100000010605 [0,2,0,0,0,0|0,0,0]=2 4647 B19R2.103470 Nc1ccc(c(c1)SCc2cc(=O)c(co2)O)F 62a_100000760356_100000010605 [0,2,0,0,0,0|0,0,0]=2 4648 B19R2.103470 Nc1ccc(c(c1)SCc2cc(=O)c(co2)O)N 62a_100011534242_100000010605 [0,2,0,0,0,0|0,0,0]=2 4649 B19R2.103470 Nc1ccc(c(c1)SCc2cc(=O)c(co2)O)O 62a_100011534360_100000010605 [0,2,0,0,0,0|0,0,0]=2 4650 B19R2.103470 Nc1ccc(c(n1)SCc2cc(=O)c(co2)O)Br 62a_100010192275_100000010605 [0,2,0,0,0,0|1,0,0]=3 4651 B19R2.103470 Nc1ccc(c(n1)SCc2cc(=O)c(co2)O)F 62a_100010892222_100000010605 [0,2,0,0,0,0|1,0,0]=3 4652 B19R2.103470 Nc1ccc(c(n1)SCc2cc(=O)c(co2)O)N 62a_200009884323_100000010605 [0,2,0,0,0,0|1,0,0]=3 4653 B19R2.103470 Nc1ccc(cc1OCc2cc(=O)c(co2)O)Br 7a_100000739049_100000010605 [0,2,0,0,0,0|0,1,0]=3 4654 B19R2.103470 Nc1ccc(cc1OCc2cc(=O)c(co2)O)Cl 7a_100000185728_100000010605 [0,2,0,0,0,0|0,1,0]=3 4655 B19R2.103470 Nc1ccc(cc1OCc2cc(=O)c(co2)O)F 7a_100000753323_100000010605 [0,2,0,0,0,0|0,1,0]=3 4656 B19R2.103470 Nc1ccc(cc1OCc2cc(=O)c(co2)O)I 7a_100000057187_100000010605 [0,2,0,0,0,0|0,1,0]=3 4657 B19R2.103470 Nc1ccc(cc1SCc2cc(=O)c(co2)O)Br 62a_100000187925_100000010605 [0,2,0,0,0,0|0,0,0]=2 4658 B19R2.103470 Nc1ccc(cc1SCc2cc(=O)c(co2)O)Cl 62a_100000761889_100000010605 [0,2,0,0,0,0|0,0,0]=2 4659 B19R2.103470 Nc1ccc(cc1SCc2cc(=O)c(co2)O)F 62a_100000760547_100000010605 [0,2,0,0,0,0|0,0,0]=2 4660 B19R2.103470 Nc1ccc(cc1SCc2cc(=O)c(co2)O)O 62a_100012001276_100000010605 [0,2,0,0,0,0|0,0,0]=2 4661 B19R2.103470 Nc1ccc(nc1SCc2cc(=O)c(co2)O)Br 62a_100010168765_100000010605 [0,2,0,0,0,0|1,0,0]=3 4662 B19R2.103470 Nc1ccc(nc1SCc2cc(=O)c(co2)O)Cl 62a_100010233647_100000010605 [0,2,0,0,0,0|1,0,0]=3 4663 B19R2.103470 Nc1ccc(nc1SCc2cc(=O)c(co2)O)F 62a_100009879877_100000010605 [0,2,0,0,0,0|1,0,0]=3 4664 B19R2.103470 Nc1cnc(c(c1)SCc2cc(=O)c(co2)O)Br 62a_100010201102_100000010605 [0,2,0,0,0,0|1,0,0]=3 4665 B19R2.103470 Nc1cnc(c(c1)SCc2cc(=O)c(co2)O)Cl 62a_100010253917_100000010605 [0,2,0,0,0,0|1,0,0]=3 4666 B19R2.103470 Nc1cnc(c(c1)SCc2cc(=O)c(co2)O)F 62a_100009840397_100000010605 [0,2,0,0,0,0|1,0,0]=3 4667 B19R2.103470 Nc1cnc(c(c1)SCc2cc(=O)c(co2)O)N 62a_200011934315_100000010605 [0,2,0,0,0,0|1,0,0]=3 4668 B19R2.103470 Nc1cnc(cc1SCc2cc(=O)c(co2)O)Cl 62a_100000050123_100000010605 [0,2,0,0,0,0|1,0,0]=3 4669 B19R2.103470 Nc1ncc(c(n1)SCc2cc(=O)c(co2)O)F 62a_200000093006_100000010605 [0,2,0,0,0,0|2,0,0]=4 4670 B19R2.103470 Nc1ncc(cc1OCc2cc(=O)c(co2)O)Br 7a_100009819042_100000010605 [0,2,0,0,0,0|1,1,0]=4 4671 B19R2.103470 Nc1ncc(cc1OCc2cc(=O)c(co2)O)Cl 7a_100000123674_100000010605 [0,2,0,0,0,0|1,1,0]=4 4672 B19R2.103470 Nc1ncc(cc1OCc2cc(=O)c(co2)O)F 7a_100000094369_100000010605 [0,2,0,0,0,0|1,1,0]=4 4673 B19R2.103470 Nc1ncc(cc1SCc2cc(=O)c(co2)O)Br 62a_100000760472_100000010605 [0,2,0,0,0,0|1,0,0]=3 4674 B19R2.103470 Nc1ncc(cc1SCc2cc(=O)c(co2)O)Cl 62a_100000050159_100000010605 [0,2,0,0,0,0|1,0,0]=3 4675 B19R2.103470 Nc1ncc(cc1SCc2cc(=O)c(co2)O)F 62a_100009814671_100000010605 [0,2,0,0,0,0|1,0,0]=3 4676 B19R2.103470 Nc1ncc(nc1SCc2cc(=O)c(co2)O)Br 62a_100010988662_100000010605 [0,2,0,0,0,0|2,0,0]=4 4677 B19R2.103470 O=c1cc(c(c[nH]1)F)SCc2cc(=O)c(co2)O 62a_100009817642_100000010605 [0,2,0,0,0,0|1,0,0]=3 4678 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Br)Br 7a_100011220040_100000010605 [0,2,0,0,0,0|0,1,0]=3 4679 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Br)Cl 7a_100012339455_100000010605 [0,2,0,0,0,0|0,1,0]=3 4680 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Br)F 7a_100000690578_100000010605 [0,2,0,0,0,0|0,1,0]=3 4681 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Br)I 7a_100012356990_100000010605 [0,2,0,0,0,0|0,1,0]=3 4682 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Cl)Br 7a_100000738945_100000010605 [0,2,0,0,0,0|0,1,0]=3 4683 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Cl)Cl 7a_100000211422_100000010605 [0,2,0,0,0,0|0,1,0]=3 4684 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Cl)F 7a_100000692107_100000010605 [0,2,0,0,0,0|0,1,0]=3 4685 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2Cl)I 7a_100011356854_100000010605 [0,2,0,0,0,0|0,1,0]=3 4686 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2F)Br 7a_100000686035_100000010605 [0,2,0,0,0,0|0,1,0]=3 4687 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2F)Cl 7a_100000757397_100000010605 [0,2,0,0,0,0|0,1,0]=3 4688 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2F)F 7a_100000752141_100000010605 [0,2,0,0,0,0|0,1,0]=3 4689 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2F)I 7a_100009958187_100000010605 [0,2,0,0,0,0|0,1,0]=3 4690 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2I)Br 7a_100012344904_100000010605 [0,2,0,0,0,0|0,1,0]=3 4691 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2I)Cl 7a_100000050036_100000010605 [0,2,0,0,0,0|0,1,0]=3 4692 B19R2.103470 O=c1cc(occ1O)COc2cc(ccc2I)F 7a_100010084537_100000010605 [0,2,0,0,0,0|0,1,0]=3 4693 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2Br)Cl 7a_100000697010_100000010605 [0,2,0,0,0,0|1,1,0]=4 4694 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2Br)F 7a_100009820119_100000010605 [0,2,0,0,0,0|1,1,0]=4 4695 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2Cl)Br 7a_100012354860_100000010605 [0,2,0,0,0,0|1,1,0]=4 4696 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2Cl)F 7a_100000079967_100000010605 [0,2,0,0,0,0|1,1,0]=4 4697 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2F)Br 7a_100009819871_100000010605 [0,2,0,0,0,0|1,1,0]=4 4698 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2F)Cl 7a_100000094372_100000010605 [0,2,0,0,0,0|1,1,0]=4 4699 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2I)Br 7a_100010210634_100000010605 [0,2,0,0,0,0|1,1,0]=4 4700 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2I)Cl 7a_100010233512_100000010605 [0,2,0,0,0,0|1,1,0]=4 4701 B19R2.103470 O=c1cc(occ1O)COc2cc(cnc2I)F 7a_100015624800_100000010605 [0,2,0,0,0,0|1,1,0]=4 4702 B19R2.103470 O=c1cc(occ1O)CSc2cc(c[nH]c2=O)F 62a_100009817720_100000010605 [0,2,0,0,0,0|1,0,0]=3 4703 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Br)Br 62a_100011483371_100000010605 [0,2,0,0,0,0|0,0,0]=2 4704 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Br)Cl 62a_100012339723_100000010605 [0,2,0,0,0,0|0,0,0]=2 4705 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Br)F 62a_100011217576_100000010605 [0,2,0,0,0,0|0,0,0]=2 4706 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Br)O 62a_100012339312_100000010605 [0,2,0,0,0,0|0,0,0]=2 4707 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Cl)Br 62a_100011772130_100000010605 [0,2,0,0,0,0|0,0,0]=2 4708 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Cl)Cl 62a_100000707729_100000010605 [0,2,0,0,0,0|0,0,0]=2 4709 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Cl)F 62a_100011217299_100000010605 [0,2,0,0,0,0|0,0,0]=2 4710 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2Cl)O 62a_100000049588_100000010605 [0,2,0,0,0,0|0,0,0]=2 4711 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2F)Br 62a_100011217312_100000010605 [0,2,0,0,0,0|0,0,0]=2 4712 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2F)Cl 62a_100011218116_100000010605 [0,2,0,0,0,0|0,0,0]=2 4713 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2F)F 62a_100011219198_100000010605 [0,2,0,0,0,0|0,0,0]=2 4714 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2F)O 62a_100000693481_100000010605 [0,2,0,0,0,0|0,0,0]=2 4715 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2O)Br 62a_100012355227_100000010605 [0,2,0,0,0,0|0,0,0]=2 4716 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2O)Cl 62a_100011356953_100000010605 [0,2,0,0,0,0|0,0,0]=2 4717 B19R2.103470 O=c1cc(occ1O)CSc2cc(ccc2O)F 62a_100000211999_100000010605 [0,2,0,0,0,0|0,0,0]=2 4718 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2Cl)Br 62a_100009814771_100000010605 [0,2,0,0,0,0|1,0,0]=3 4719 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2Cl)Cl 62a_200000062399_100000010605 [0,2,0,0,0,0|1,0,0]=3 4720 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2F)Br 62a_100010172738_100000010605 [0,2,0,0,0,0|1,0,0]=3 4721 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2F)Cl 62a_100010188783_100000010605 [0,2,0,0,0,0|1,0,0]=3 4722 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2F)F 62a_100009820768_100000010605 [0,2,0,0,0,0|1,0,0]=3 4723 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2F)O 62a_100009817267_100000010605 [0,2,0,0,0,0|1,0,0]=3 4724 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2O)Br 62a_100010197142_100000010605 [0,2,0,0,0,0|1,0,0]=3 4725 B19R2.103470 O=c1cc(occ1O)CSc2cc(cnc2O)Cl 62a_100010188700_100000010605 [0,2,0,0,0,0|1,0,0]=3 4726 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2Br)Br 62a_100010171693_100000010605 [0,2,0,0,0,0|1,0,0]=3 4727 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2Br)Cl 62a_100009815598_100000010605 [0,2,0,0,0,0|1,0,0]=3 4728 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2Cl)Br 62a_100010223331_100000010605 [0,2,0,0,0,0|1,0,0]=3 4729 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2Cl)Cl 62a_100010172835_100000010605 [0,2,0,0,0,0|1,0,0]=3 4730 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2Cl)F 62a_100009892587_100000010605 [0,2,0,0,0,0|1,0,0]=3 4731 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2F)Br 62a_100010193852_100000010605 [0,2,0,0,0,0|1,0,0]=3 4732 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2F)Cl 62a_100000708277_100000010605 [0,2,0,0,0,0|1,0,0]=3 4733 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2F)F 62a_100010233071_100000010605 [0,2,0,0,0,0|1,0,0]=3 4734 B19R2.103470 O=c1cc(occ1O)CSc2cc(ncc2O)Cl 62a_100000698892_100000010605 [0,2,0,0,0,0|1,0,0]=3 4735 B19R2.103470 O=c1cc(occ1O)CSc2nc(ccc2F)Cl 62a_100010136221_100000010605 [0,2,0,0,0,0|1,0,0]=3 4736 B19R2.103470 O=c1cc(occ1O)CSc2nc(ccc2F)F 62a_100010997973_100000010605 [0,2,0,0,0,0|1,0,0]=3 4737 B19R2.103470 O=c1cc(occ1O)CSc2nc(ccc2O)Br 62a_100010253912_100000010605 [0,2,0,0,0,0|1,0,0]=3 4738 B19R2.103470 O=c1cc(occ1O)CSc2nc(ccc2O)F 62a_100010382442_100000010605 [0,2,0,0,0,0|1,0,0]=3 4739 B19R2.170257 C#Cc1ccccc1OCc2cc(=O)c(co2)O 7a_200011470546_100000010605 [0,2,0,0,0,0|0,1,0]=3 4740 B19R2.170257 C=Cc1ccccc1SCc2cc(=O)c(co2)O 62a_100011218376_100000010605 [0,2,0,0,0,0|0,0,0]=2 4741 B19R2.170257 CCc1ccccc1NCc2cc(=O)c(co2)O 2230a_100000212081_100000010605 [0,2,0,0,0,0|1,0,0]=3 4742 B19R2.170257 CCc1ccccc1NCc2cc(=O)c(co2)O 7a_100000212081_100000010605 [0,2,0,0,0,0|1,0,0]=3 4743 B19R2.170257 CCc1ccccc1OCc2cc(=O)c(co2)O 7a_100000210936_100000010605 [0,2,0,0,0,0|0,1,0]=3 4744 B19R2.170257 CCc1ccccc1SCc2cc(=O)c(co2)O 62a_100011215823_100000010605 [0,2,0,0,0,0|0,0,0]=2 4745 B19R2.170257 CCc1ccncc1SCc2cc(=O)c(co2)O 62a_100009819861_100000010605 [0,2,0,0,0,0|1,0,0]=3 4746 B19R2.170257 CCc1cnccc1SCc2cc(=O)c(co2)O 62a_100025704421_100000010605 [0,2,0,0,0,0|1,0,0]=3 4747 B19R2.170257 CCc1cncnc1SCc2cc(=O)c(co2)O 62a_200000100055_100000010605 [0,2,0,0,0,0|2,0,0]=4 4748 B19R2.170257 CCc1ncccc1SCc2cc(=O)c(co2)O 62a_100009877225_100000010605 [0,2,0,0,0,0|1,0,0]=3 4749 B19R2.170257 CCc1nccnc1SCc2cc(=O)c(co2)O 62a_100011995844_100000010605 [0,2,0,0,0,0|2,0,0]=4 4750 B19R2.170257 CCc1ncncc1SCc2cc(=O)c(co2)O 62a_100009816992_100000010605 [0,2,0,0,0,0|2,0,0]=4 4751 B19R2.170257 CNc1ccccc1SCc2cc(=O)c(co2)O 62a_100020606079_100000010605 [0,2,0,0,0,0|0,0,0]=2 4752 B19R2.170257 CNc1ccncc1SCc2cc(=O)c(co2)O 62a_100010069531_100000010605 [0,2,0,0,0,0|1,0,0]=3 4753 B19R2.170257 CNc1ncccc1SCc2cc(=O)c(co2)O 62a_100000700899_100000010605 [0,2,0,0,0,0|1,0,0]=3 4754 B19R2.170257 CNc1ncncc1SCc2cc(=O)c(co2)O 62a_200012180720_100000010605 [0,2,0,0,0,0|2,0,0]=4 4755 B19R2.170257 COc1ccccc1SCc2cc(=O)c(co2)O 62a_100000210334_100000010605 [0,2,0,0,0,0|0,0,0]=2 4756 B19R2.170257 COc1cccnc1SCc2cc(=O)c(co2)O 62a_100000767102_100000010605 [0,2,0,0,0,0|1,0,0]=3 4757 B19R2.170257 COc1ccncc1SCc2cc(=O)c(co2)O 62a_100011997281_100000010605 [0,2,0,0,0,0|1,0,0]=3 4758 B19R2.170257 COc1cnccc1SCc2cc(=O)c(co2)O 62a_100016988167_100000010605 [0,2,0,0,0,0|1,0,0]=3 4759 B19R2.170257 COc1cncnc1SCc2cc(=O)c(co2)O 62a_100012001275_100000010605 [0,2,0,0,0,0|2,0,0]=4 4760 B19R2.170257 COc1ncccc1OCc2cc(=O)c(co2)O 7a_100000698397_100000010605 [0,2,0,0,0,0|1,1,0]=4 4761 B19R2.170257 COc1ncccc1SCc2cc(=O)c(co2)O 62a_100000047025_100000010605 [0,2,0,0,0,0|1,0,0]=3 4762 B19R2.170257 COc1nccnc1SCc2cc(=O)c(co2)O 62a_100009858322_100000010605 [0,2,0,0,0,0|2,0,0]=4 4763 B19R2.170257 COc1ncncc1SCc2cc(=O)c(co2)O 62a_100000719902_100000010605 [0,2,0,0,0,0|2,0,0]=4 4764 B19R2.170257 CSc1ccccc1SCc2cc(=O)c(co2)O 62a_100011217816_100000010605 [0,2,0,0,0,0|0,0,0]=2 4765 B19R2.170257 CSc1ncccc1SCc2cc(=O)c(co2)O 62a_100011465278_100000010605 [0,2,0,0,0,0|1,0,0]=3 4766 B19R2.170257 N#Cc1ccccc1OCc2cc(=O)c(co2)O 7a_100000211048_100000010605 [0,2,0,0,0,0|0,1,0]=3 4767 B19R2.170257 N#Cc1ccncc1OCc2cc(=O)c(co2)O 7a_100012181322_100000010605 [0,2,0,0,0,0|1,1,0]=4 4768 B19R2.170257 N#Cc1ncccc1OCc2cc(=O)c(co2)O 7a_100000722750_100000010605 [0,2,0,0,0,0|1,1,0]=4 4769 B19R2.170257 NCc1ccccc1SCc2cc(=O)c(co2)O 62a_100000689332_100000010605 [0,2,0,0,0,0|0,0,0]=2 4770 B19R2.170257 NCc1cccnc1SCc2cc(=O)c(co2)O 62a_100015189234_100000010605 [0,2,0,0,0,0|1,0,0]=3 4771 B19R2.170257 NCc1ccncc1SCc2cc(=O)c(co2)O 62a_100020640021_100000010605 [0,2,0,0,0,0|1,0,0]=3 4772 B19R2.170257 NCc1ncccc1SCc2cc(=O)c(co2)O 62a_100020591323_100000010605 [0,2,0,0,0,0|1,0,0]=3 4773 B19R2.170257 NCc1nccnc1SCc2cc(=O)c(co2)O 62a_100000729963_100000010605 [0,2,0,0,0,0|2,0,0]=4 4774 B19R2.170257 NNc1ccccc1SCc2cc(=O)c(co2)O 62a_100000241748_100000010605 [0,2,0,0,0,0|0,0,0]=2 4775 B19R2.170257 NNc1ccncc1SCc2cc(=O)c(co2)O 62a_100013404636_100000010605 [0,2,0,0,0,0|1,0,0]=3 4776 B19R2.170257 NNc1ncccc1SCc2cc(=O)c(co2)O 62a_100011464834_100000010605 [0,2,0,0,0,0|1,0,0]=3 4777 B19R2.170257 O=Cc1ccccc1SCc2cc(=O)c(co2)O 62a_100000210073_100000010605 [0,2,0,0,0,0|0,0,0]=2 4778 B19R2.170257 O=Cc1cccnc1SCc2cc(=O)c(co2)O 62a_100009816751_100000010605 [0,2,0,0,0,0|1,0,0]=3 4779 B19R2.170257 O=Cc1ccncc1SCc2cc(=O)c(co2)O 62a_100011934409_100000010605 [0,2,0,0,0,0|1,0,0]=3 4780 B19R2.170257 O=Cc1cnccc1SCc2cc(=O)c(co2)O 62a_100000050567_100000010605 [0,2,0,0,0,0|1,0,0]=3 4781 B19R2.170257 O=Cc1ncccc1SCc2cc(=O)c(co2)O 62a_100011934733_100000010605 [0,2,0,0,0,0|1,0,0]=3 4782 B19R2.170257 O=Cc1nccnc1SCc2cc(=O)c(co2)O 62a_100000051000_100000010605 [0,2,0,0,0,0|2,0,0]=4 4783 B19R2.170257 O=c1cc(occ1O)COc2cccnc2CBr 7a_200020655725_100000010605 [0,2,0,0,0,0|1,1,0]=4 4784 B19R2.170257 O=c1cc(occ1O)CSc2ccccc2CO 62a_100000187465_100000010605 [0,2,0,0,0,0|0,0,0]=2 4785 B19R2.170257 O=c1cc(occ1O)CSc2cccnc2CO 62a_100011996772_100000010605 [0,2,0,0,0,0|1,0,0]=3 4786 B19R2.170257 O=c1cc(occ1O)CSc2ccncc2CO 62a_100000117392_100000010605 [0,2,0,0,0,0|1,0,0]=3 4787 B19R2.170257 O=c1cc(occ1O)CSc2cnccc2CO 62a_100009873359_100000010605 [0,2,0,0,0,0|1,0,0]=3 4788 B19R2.170257 O=c1cc(occ1O)CSc2ncccc2CO 62a_100000748726_100000010605 [0,2,0,0,0,0|1,0,0]=3 4789 B19R2.170257 O=c1cc(occ1O)CSc2nccnc2CO 62a_100000057004_100000010605 [0,2,0,0,0,0|2,0,0]=4 4790 B19R2.191497 C#Cc1cccc(c1)NCc2cc(=O)c(co2)O 2230a_100000735509_100000010605 [0,2,0,0,0,0|1,0,0]=3 4791 B19R2.191497 C#Cc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100011216014_100000010605 [0,2,0,0,0,0|0,1,0]=3 4792 B19R2.191497 C=Cc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100009845566_100000010605 [0,2,0,0,0,0|1,0,0]=3 4793 B19R2.191497 C=Cc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100011309434_100000010605 [0,2,0,0,0,0|0,1,0]=3 4794 B19R2.191497 C=Cc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100011215241_100000010605 [0,2,0,0,0,0|0,0,0]=2 4795 B19R2.191497 C=Cc1cncc(c1)SCc2cc(=O)c(co2)O 62a_200012180632_100000010605 [0,2,0,0,0,0|1,0,0]=3 4796 B19R2.191497 CC[n+]1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000731997_100000010605 [0,2,0,0,0,0|1,1,0]=4 4797 B19R2.191497 CCc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100009820011_100000010605 [0,2,0,0,0,0|1,0,0]=3 4798 B19R2.191497 CCc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000744278_100000010605 [0,2,0,0,0,0|2,0,0]=4 4799 B19R2.191497 CCc1cccc(c1)NCc2cc(=O)c(co2)O 2230a_100000211250_100000010605 [0,2,0,0,0,0|1,0,0]=3 4800 B19R2.191497 CCc1cccc(c1)NCc2cc(=O)c(co2)O 7a_100000211250_100000010605 [0,2,0,0,0,0|1,0,0]=3 4801 B19R2.191497 CCc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000211550_100000010605 [0,2,0,0,0,0|0,1,0]=3 4802 B19R2.191497 CCc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100011263222_100000010605 [0,2,0,0,0,0|0,0,0]=2 4803 B19R2.191497 CCc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100009856026_100000010605 [0,2,0,0,0,0|1,0,0]=3 4804 B19R2.191497 CCc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100009817561_100000010605 [0,2,0,0,0,0|1,0,0]=3 4805 B19R2.191497 CCc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100000100215_100000010605 [0,2,0,0,0,0|2,0,0]=4 4806 B19R2.191497 CCc1cncc(c1)OCc2cc(=O)c(co2)O 7a_200009861530_100000010605 [0,2,0,0,0,0|1,1,0]=4 4807 B19R2.191497 CCc1cncc(c1)SCc2cc(=O)c(co2)O 62a_200009819073_100000010605 [0,2,0,0,0,0|1,0,0]=3 4808 B19R2.191497 CNc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100009819592_100000010605 [0,2,0,0,0,0|1,0,0]=3 4809 B19R2.191497 CNc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000756605_100000010605 [0,2,0,0,0,0|2,0,0]=4 4810 B19R2.191497 CNc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000756613_100000010605 [0,2,0,0,0,0|0,1,0]=3 4811 B19R2.191497 CNc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100000219648_100000010605 [0,2,0,0,0,0|0,0,0]=2 4812 B19R2.191497 CNc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100000703281_100000010605 [0,2,0,0,0,0|1,0,0]=3 4813 B19R2.191497 CNc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100009869472_100000010605 [0,2,0,0,0,0|1,0,0]=3 4814 B19R2.191497 CNc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100011649947_100000010605 [0,2,0,0,0,0|2,0,0]=4 4815 B19R2.191497 CNc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100012184536_100000010605 [0,2,0,0,0,0|1,0,0]=3 4816 B19R2.191497 CNc1cncc(n1)SCc2cc(=O)c(co2)O 62a_100011529438_100000010605 [0,2,0,0,0,0|2,0,0]=4 4817 B19R2.191497 CNc1nccc(n1)SCc2cc(=O)c(co2)O 62a_100012000420_100000010605 [0,2,0,0,0,0|2,0,0]=4 4818 B19R2.191497 COc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100000117307_100000010605 [0,2,0,0,0,0|1,0,0]=3 4819 B19R2.191497 COc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000049997_100000010605 [0,2,0,0,0,0|2,0,0]=4 4820 B19R2.191497 COc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000211255_100000010605 [0,2,0,0,0,0|0,1,0]=3 4821 B19R2.191497 COc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100000760917_100000010605 [0,2,0,0,0,0|1,0,0]=3 4822 B19R2.191497 COc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100009817693_100000010605 [0,2,0,0,0,0|1,0,0]=3 4823 B19R2.191497 COc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100000182009_100000010605 [0,2,0,0,0,0|2,0,0]=4 4824 B19R2.191497 COc1cncc(c1)OCc2cc(=O)c(co2)O 7a_100000084572_100000010605 [0,2,0,0,0,0|1,1,0]=4 4825 B19R2.191497 COc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100000050176_100000010605 [0,2,0,0,0,0|1,0,0]=3 4826 B19R2.191497 COc1cncc(n1)SCc2cc(=O)c(co2)O 62a_100000756030_100000010605 [0,2,0,0,0,0|2,0,0]=4 4827 B19R2.191497 COc1nccc(n1)SCc2cc(=O)c(co2)O 62a_100000069072_100000010605 [0,2,0,0,0,0|2,0,0]=4 4828 B19R2.191497 CSc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100011443430_100000010605 [0,2,0,0,0,0|2,0,0]=4 4829 B19R2.191497 CSc1cccc(c1)NCc2cc(=O)c(co2)O 2230a_100000210049_100000010605 [0,2,0,0,0,0|1,0,0]=3 4830 B19R2.191497 CSc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100011265683_100000010605 [0,2,0,0,0,0|0,1,0]=3 4831 B19R2.191497 CSc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100011215954_100000010605 [0,2,0,0,0,0|0,0,0]=2 4832 B19R2.191497 CSc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100011960944_100000010605 [0,2,0,0,0,0|1,0,0]=3 4833 B19R2.191497 CSc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100010883326_100000010605 [0,2,0,0,0,0|1,0,0]=3 4834 B19R2.191497 CSc1ccnc(n1)SCc2cc(=O)c(co2)O 62a_100011650323_100000010605 [0,2,0,0,0,0|2,0,0]=4 4835 B19R2.191497 CSc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100009816972_100000010605 [0,2,0,0,0,0|1,0,0]=3 4836 B19R2.191497 CSc1nccc(n1)SCc2cc(=O)c(co2)O 62a_100000032126_100000010605 [0,2,0,0,0,0|2,0,0]=4 4837 B19R2.191497 N#Cc1cc(ccn1)OCc2cc(=O)c(co2)O 7a_100011777083_100000010605 [0,2,0,0,0,0|1,1,0]=4 4838 B19R2.191497 N#Cc1cccc(c1)NCc2cc(=O)c(co2)O 7a_100000210922_100000010605 [0,2,0,0,0,0|1,0,0]=3 4839 B19R2.191497 N#Cc1cccc(c1)OCc2cc(=O)c(co2)O 7a_100000184713_100000010605 [0,2,0,0,0,0|0,1,0]=3 4840 B19R2.191497 N#Cc1cncc(c1)OCc2cc(=O)c(co2)O 7a_100012002025_100000010605 [0,2,0,0,0,0|1,1,0]=4 4841 B19R2.191497 NCc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100000085674_100000010605 [0,2,0,0,0,0|1,0,0]=3 4842 B19R2.191497 NCc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100000106179_100000010605 [0,2,0,0,0,0|0,0,0]=2 4843 B19R2.191497 NCc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100016990191_100000010605 [0,2,0,0,0,0|1,0,0]=3 4844 B19R2.191497 NCc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100025757509_100000010605 [0,2,0,0,0,0|1,0,0]=3 4845 B19R2.191497 NCc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100011249555_100000010605 [0,2,0,0,0,0|1,0,0]=3 4846 B19R2.191497 NNc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100000764631_100000010605 [0,2,0,0,0,0|1,0,0]=3 4847 B19R2.191497 NNc1cc(ncn1)SCc2cc(=O)c(co2)O 62a_100000242035_100000010605 [0,2,0,0,0,0|2,0,0]=4 4848 B19R2.191497 NNc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100000217339_100000010605 [0,2,0,0,0,0|0,0,0]=2 4849 B19R2.191497 NNc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100009817029_100000010605 [0,2,0,0,0,0|1,0,0]=3 4850 B19R2.191497 NNc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100000089018_100000010605 [0,2,0,0,0,0|1,0,0]=3 4851 B19R2.191497 NNc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100000727789_100000010605 [0,2,0,0,0,0|1,0,0]=3 4852 B19R2.191497 NNc1cncc(n1)SCc2cc(=O)c(co2)O 62a_100102525095_100000010605 [0,2,0,0,0,0|2,0,0]=4 4853 B19R2.191497 O=Cc1cc(ccn1)SCc2cc(=O)c(co2)O 62a_100011998288_100000010605 [0,2,0,0,0,0|1,0,0]=3 4854 B19R2.191497 O=Cc1cccc(c1)SCc2cc(=O)c(co2)O 62a_100000014684_100000010605 [0,2,0,0,0,0|0,0,0]=2 4855 B19R2.191497 O=Cc1cccc(n1)SCc2cc(=O)c(co2)O 62a_100000688028_100000010605 [0,2,0,0,0,0|1,0,0]=3 4856 B19R2.191497 O=Cc1ccnc(c1)SCc2cc(=O)c(co2)O 62a_100011290808_100000010605 [0,2,0,0,0,0|1,0,0]=3 4857 B19R2.191497 O=Cc1cncc(c1)SCc2cc(=O)c(co2)O 62a_100000687066_100000010605 [0,2,0,0,0,0|1,0,0]=3 4858 B19R2.191497 O=c1cc(occ1O)CNc2cccc(c2)CF 2230a_100000126320_100000010605 [0,2,0,0,0,0|1,0,0]=3 4859 B19R2.191497 O=c1cc(occ1O)CNc2cccc(c2)CF 7a_100000126320_100000010605 [0,2,0,0,0,0|1,0,0]=3 4860 B19R2.191497 O=c1cc(occ1O)CNc2cccc(c2)CO 2230a_100000211919_100000010605 [0,2,0,0,0,0|1,0,0]=3 4861 B19R2.191497 O=c1cc(occ1O)COc2cccc(c2)CBr 7a_100011660834_100000010605 [0,2,0,0,0,0|0,1,0]=3 4862 B19R2.191497 O=c1cc(occ1O)COc2cccc(c2)CCl 7a_100000084143_100000010605 [0,2,0,0,0,0|0,1,0]=3 4863 B19R2.191497 O=c1cc(occ1O)COc2cccc(c2)CO 7a_100011214949_100000010605 [0,2,0,0,0,0|0,1,0]=3 4864 B19R2.191497 O=c1cc(occ1O)CSc2cc(ccn2)CO 62a_100009814636_100000010605 [0,2,0,0,0,0|1,0,0]=3 4865 B19R2.191497 O=c1cc(occ1O)CSc2cc(ncn2)CO 62a_100000731546_100000010605 [0,2,0,0,0,0|2,0,0]=4 4866 B19R2.191497 O=c1cc(occ1O)CSc2cccc(c2)CF 62a_100010878472_100000010605 [0,2,0,0,0,0|0,0,0]=2 4867 B19R2.191497 O=c1cc(occ1O)CSc2cccc(c2)CO 62a_100000687537_100000010605 [0,2,0,0,0,0|0,0,0]=2 4868 B19R2.191497 O=c1cc(occ1O)CSc2cccc(n2)CO 62a_100000694195_100000010605 [0,2,0,0,0,0|1,0,0]=3 4869 B19R2.191497 O=c1cc(occ1O)CSc2ccnc(c2)CO 62a_100000748867_100000010605 [0,2,0,0,0,0|1,0,0]=3 4870 B19R2.191497 O=c1cc(occ1O)CSc2cncc(c2)CO 62a_100011259137_100000010605 [0,2,0,0,0,0|1,0,0]=3 4871 B19R2.191497 O=c1cc(occ1O)CSc2cncc(n2)CO 62a_100009853123_100000010605 [0,2,0,0,0,0|2,0,0]=4 4872 B19R2.1291297 Cc1cc(cc(=O)[nH]1)SCc2cc(=O)c(co2)O 62a_100009861981_100000010605 [0,2,0,0,0,0|1,0,0]=3 4873 B19R2.1291297 Cc1cc(cc(=O)o1)OCc2cc(=O)c(co2)O 7a_100000210952_100000010605 [0,2,0,0,0,0|1,1,0]=4 4874 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)Br 7a_100000695972_100000010605 [0,2,0,0,0,0|1,0,0]=3 4875 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)C 2230a_100000210930_100000010605 [0,2,0,0,0,0|1,0,0]=3 4876 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)C 7a_100000210930_100000010605 [0,2,0,0,0,0|1,0,0]=3 4877 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)Cl 2230a_100012022512_100000010605 [0,2,0,0,0,0|1,0,0]=3 4878 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)Cl 7a_100012022512_100000010605 [0,2,0,0,0,0|1,0,0]=3 4879 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)F 2230a_100000742734_100000010605 [0,2,0,0,0,0|1,0,0]=3 4880 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)F 7a_100000742734_100000010605 [0,2,0,0,0,0|1,0,0]=3 4881 B19R2.1291297 Cc1cc(cc(c1)NCc2cc(=O)c(co2)O)O 7a_100011995906_100000010605 [0,2,0,0,0,0|1,0,0]=3 4882 B19R2.1291297 Cc1cc(cc(c1)OCc2cc(=O)c(co2)O)Br 7a_100011999630_100000010605 [0,2,0,0,0,0|0,1,0]=3 4883 B19R2.1291297 Cc1cc(cc(c1)OCc2cc(=O)c(co2)O)C 7a_100000210933_100000010605 [0,2,0,0,0,0|0,1,0]=3 4884 B19R2.1291297 Cc1cc(cc(c1)OCc2cc(=O)c(co2)O)Cl 7a_100000087485_100000010605 [0,2,0,0,0,0|0,1,0]=3 4885 B19R2.1291297 Cc1cc(cc(c1)OCc2cc(=O)c(co2)O)F 7a_100011830401_100000010605 [0,2,0,0,0,0|0,1,0]=3 4886 B19R2.1291297 Cc1cc(cc(c1)OCc2cc(=O)c(co2)O)N 7a_100011995906_100000010605 [0,2,0,0,0,0|0,1,0]=3 4887 B19R2.1291297 Cc1cc(cc(c1)SCc2cc(=O)c(co2)O)C 62a_100011215608_100000010605 [0,2,0,0,0,0|0,0,0]=2 4888 B19R2.1291297 Cc1cc(cc(c1)SCc2cc(=O)c(co2)O)Cl 62a_100010172791_100000010605 [0,2,0,0,0,0|0,0,0]=2 4889 B19R2.1291297 Cc1cc(cc(c1)SCc2cc(=O)c(co2)O)F 62a_100011356977_100000010605 [0,2,0,0,0,0|0,0,0]=2 4890 B19R2.1291297 Cc1cc(cc(c1)SCc2cc(=O)c(co2)O)N 62a_100000695972_100000010605 [0,2,0,0,0,0|0,0,0]=2 4891 B19R2.1291297 Cc1cc(cc(n1)C)SCc2cc(=O)c(co2)O 62a_100000066820_100000010605 [0,2,0,0,0,0|1,0,0]=3 4892 B19R2.1291297 Cc1cc(cc(n1)Cl)SCc2cc(=O)c(co2)O 62a_100010068023_100000010605 [0,2,0,0,0,0|1,0,0]=3 4893 B19R2.1291297 Cc1cc(cc(n1)F)SCc2cc(=O)c(co2)O 62a_100010006595_100000010605 [0,2,0,0,0,0|1,0,0]=3 4894 B19R2.1291297 Cc1cc(cc(n1)N)SCc2cc(=O)c(co2)O 62a_100000076705_100000010605 [0,2,0,0,0,0|1,0,0]=3 4895 B19R2.1291297 Cc1cc(cc(n1)SCc2cc(=O)c(co2)O)N 62a_100000071261_100000010605 [0,2,0,0,0,0|1,0,0]=3 4896 B19R2.1291297 Cc1cc(nc(c1)SCc2cc(=O)c(co2)O)C 62a_100000069240_100000010605 [0,2,0,0,0,0|1,0,0]=3 4897 B19R2.1291297 Cc1cc(nc(c1)SCc2cc(=O)c(co2)O)F 62a_100009819601_100000010605 [0,2,0,0,0,0|1,0,0]=3 4898 B19R2.1291297 Cc1cc(nc(c1)SCc2cc(=O)c(co2)O)N 62a_100009819863_100000010605 [0,2,0,0,0,0|1,0,0]=3 4899 B19R2.1291297 Cc1cc(nc(n1)C)SCc2cc(=O)c(co2)O 62a_100000736142_100000010605 [0,2,0,0,0,0|2,0,0]=4 4900 B19R2.1291297 Cc1cc(nc(n1)N)SCc2cc(=O)c(co2)O 62a_100000183061_100000010605 [0,2,0,0,0,0|2,0,0]=4 4901 B19R2.1291297 Cc1cc(nc(n1)SCc2cc(=O)c(co2)O)C 62a_100000736147_100000010605 [0,2,0,0,0,0|2,0,0]=4 4902 B19R2.1291297 Cc1cc(nc(n1)SCc2cc(=O)c(co2)O)N 62a_100000687285_100000010605 [0,2,0,0,0,0|2,0,0]=4 4903 B19R2.1291297 Cc1nc(cc(n1)SCc2cc(=O)c(co2)O)N 62a_100000761517_100000010605 [0,2,0,0,0,0|2,0,0]=4 4904 B19R2.1291297 Nc1cc(=O)nc([nH]1)SCc2cc(=O)c(co2)O 62a_100000101444_100000010605 [0,2,0,0,0,0|2,0,0]=4 4905 B19R2.1291297 Nc1cc(cc(c1)OCc2cc(=O)c(co2)O)Cl 7a_100000123917_100000010605 [0,2,0,0,0,0|0,1,0]=3 4906 B19R2.1291297 Nc1cc(cc(c1)SCc2cc(=O)c(co2)O)Br 62a_100009814763_100000010605 [0,2,0,0,0,0|0,0,0]=2 4907 B19R2.1291297 Nc1cc(cc(c1)SCc2cc(=O)c(co2)O)Cl 62a_100010147676_100000010605 [0,2,0,0,0,0|0,0,0]=2 4908 B19R2.1291297 Nc1cc(cc(c1)SCc2cc(=O)c(co2)O)F 62a_100011356972_100000010605 [0,2,0,0,0,0|0,0,0]=2 4909 B19R2.1291297 Nc1cc(cc(c1)SCc2cc(=O)c(co2)O)N 62a_100011999608_100000010605 [0,2,0,0,0,0|0,0,0]=2 4910 B19R2.1291297 Nc1cc(cc(n1)Cl)SCc2cc(=O)c(co2)O 62a_200011084131_100000010605 [0,2,0,0,0,0|1,0,0]=3 4911 B19R2.1291297 Nc1cc(cc(n1)N)SCc2cc(=O)c(co2)O 62a_100009816676_100000010605 [0,2,0,0,0,0|1,0,0]=3 4912 B19R2.1291297 Nc1cc(nc(n1)N)SCc2cc(=O)c(co2)O 62a_100000212091_100000010605 [0,2,0,0,0,0|2,0,0]=4 4913 B19R2.1291297 Nc1nc(cc(n1)SCc2cc(=O)c(co2)O)O 62a_100000694715_100000010605 [0,2,0,0,0,0|2,0,0]=4 4914 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Br)Br 7a_100012047176_100000010605 [0,2,0,0,0,0|1,0,0]=3 4915 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Br)Cl 7a_100011934539_100000010605 [0,2,0,0,0,0|1,0,0]=3 4916 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Br)F 7a_100000705686_100000010605 [0,2,0,0,0,0|1,0,0]=3 4917 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Cl)Cl 7a_100000210456_100000010605 [0,2,0,0,0,0|1,0,0]=3 4918 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Cl)F 7a_100000686136_100000010605 [0,2,0,0,0,0|1,0,0]=3 4919 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)Cl)O 7a_100000123917_100000010605 [0,2,0,0,0,0|1,0,0]=3 4920 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)F)F 7a_100000233717_100000010605 [0,2,0,0,0,0|1,0,0]=3 4921 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)I)Br 7a_100009814763_100000010605 [0,2,0,0,0,0|1,0,0]=3 4922 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)I)Cl 7a_100010147676_100000010605 [0,2,0,0,0,0|1,0,0]=3 4923 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)I)F 7a_100011356972_100000010605 [0,2,0,0,0,0|1,0,0]=3 4924 B19R2.1291297 O=c1cc(occ1O)CNc2cc(cc(c2)I)I 7a_200000696836_100000010605 [0,2,0,0,0,0|1,0,0]=3 4925 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)Br)Br 7a_100010167048_100000010605 [0,2,0,0,0,0|0,1,0]=3 4926 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)Br)Cl 7a_100010185897_100000010605 [0,2,0,0,0,0|0,1,0]=3 4927 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)Br)F 7a_100000688818_100000010605 [0,2,0,0,0,0|0,1,0]=3 4928 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)Cl)Cl 7a_100000181315_100000010605 [0,2,0,0,0,0|0,1,0]=3 4929 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)Cl)F 7a_100011219751_100000010605 [0,2,0,0,0,0|0,1,0]=3 4930 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)F)F 7a_100000747503_100000010605 [0,2,0,0,0,0|0,1,0]=3 4931 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)I)Br 7a_100010068917_100000010605 [0,2,0,0,0,0|0,1,0]=3 4932 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)I)Cl 7a_100010068924_100000010605 [0,2,0,0,0,0|0,1,0]=3 4933 B19R2.1291297 O=c1cc(occ1O)COc2cc(cc(c2)I)F 7a_100000717995_100000010605 [0,2,0,0,0,0|0,1,0]=3 4934 B19R2.1291297 O=c1cc(occ1O)COc2cc(nc(c2)Br)Br 7a_100010172823_100000010605 [0,2,0,0,0,0|1,1,0]=4 4935 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Br)Br 62a_100009814770_100000010605 [0,2,0,0,0,0|0,0,0]=2 4936 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Br)Cl 62a_100009814755_100000010605 [0,2,0,0,0,0|0,0,0]=2 4937 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Br)F 62a_100009814764_100000010605 [0,2,0,0,0,0|0,0,0]=2 4938 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Br)O 62a_100010068917_100000010605 [0,2,0,0,0,0|0,0,0]=2 4939 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Cl)Cl 62a_100000747138_100000010605 [0,2,0,0,0,0|0,0,0]=2 4940 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Cl)F 62a_100013859453_100000010605 [0,2,0,0,0,0|0,0,0]=2 4941 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)Cl)O 62a_100010068924_100000010605 [0,2,0,0,0,0|0,0,0]=2 4942 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)F)F 62a_100000233788_100000010605 [0,2,0,0,0,0|0,0,0]=2 4943 B19R2.1291297 O=c1cc(occ1O)CSc2cc(cc(c2)F)O 62a_100000688818_100000010605 [0,2,0,0,0,0|0,0,0]=2 4944 B19R2.1291297 O=c1cc(occ1O)CSc2cc(nc(c2)Cl)Cl 62a_100000062418_100000010605 [0,2,0,0,0,0|1,0,0]=3 4945 B19R2.1291297 O=c1cc(occ1O)CSc2cc(nc(c2)Cl)F 62a_100011069727_100000010605 [0,2,0,0,0,0|1,0,0]=3 4946 B19R2.1291297 O=c1cc(occ1O)CSc2cc(nc(c2)F)F 62a_100000049587_100000010605 [0,2,0,0,0,0|1,0,0]=3 4947 B19R2.1291297 O=c1cc(occ1O)CSc2nc(cc(n2)Cl)Cl 62a_100010365624_100000010605 [0,2,0,0,0,0|2,0,0]=4 4948 B17R2.262 O=Cc1ccccc1CSc2ccccc2 62a_100000719477_200009853537 [0,0,1,1,0,0|2,0,0]=4 4949 B17R2.262 O=Cc1ccccc1CSc2ccccc2 62a_200009853537_100000041952 [0,0,1,1,0,0|2,0,0]=4 4950 B17R2.339 O=c1cc(occ1O)CSCc2ccsc2 62a_100011261437_100000010605 [0,0,1,1,0,0|1,0,1]=4 4951 B19R3.19268 c1ccc(cc1)SCc2ccc3nonc3c2 62a_100000719477_100000733437 [0,1,0,1,0,0|2,0,0]=4 4952 B19R3.19268 c1ccc(cc1)SCc2ccc3nonc3c2 62a_100000733437_100000041952 [0,1,0,1,0,0|2,0,0]=4 4953 B19R3.19268 c1ccc(cc1)SCc2ccc3ocnc3c2 62a_100000719477_200010203175 [0,1,0,1,0,0|2,0,0]=4 4954 B15R1.3908 C=CC=CC(=O)Cc1cc(=O)c(co1)O 1458a_100016291481_100000010605 [0,0,1,0,1,0|1,0,0]=3 4955 B15R2.29 Brc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000752885 [1,0,0,0,1,0|2,0,0]=4 4956 B15R2.29 Brc1ccc(cc1)Sc2ccccc2 62a_100000752885_100000041952 [1,0,0,0,1,0|2,0,0]=4 4957 B15R2.29 Brc1ccc(nc1)Sc2ccccc2 62a_100000686858_100000041952 [1,0,0,0,1,0|2,0,0]=4 4958 B15R2.29 Brc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000686858 [1,0,0,0,1,0|2,0,0]=4 4959 B15R2.29 Cc1ccc(cc1)Sc2ccccc2 62a_100000186775_100000041952 [1,0,0,0,1,0|2,0,0]=4 4960 B15R2.29 Cc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000186775 [1,0,0,0,1,0|2,0,0]=4 4961 B15R2.29 Cc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000754016 [1,0,0,0,1,0|2,0,0]=4 4962 B15R2.29 Cc1ccc(nc1)Sc2ccccc2 62a_100011192072_100000041952 [1,0,0,0,1,0|2,0,0]=4 4963 B15R2.29 Clc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000755918 [1,0,0,0,1,0|2,0,0]=4 4964 B15R2.29 Clc1ccc(cc1)Sc2ccccc2 62a_100000755918_100000041952 [1,0,0,0,1,0|2,0,0]=4 4965 B15R2.29 Clc1ccc(nc1)Sc2ccccc2 62a_100000719477_100011356976 [1,0,0,0,1,0|2,0,0]=4 4966 B15R2.29 Clc1ccc(nc1)Sc2ccccc2 62a_100011356976_100000041952 [1,0,0,0,1,0|2,0,0]=4 4967 B15R2.29 Fc1ccc(cc1)Sc2ccccc2 62a_100000211213_100000041952 [1,0,0,0,1,0|2,0,0]=4 4968 B15R2.29 Fc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000211213 [1,0,0,0,1,0|2,0,0]=4 4969 B15R2.29 Fc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000744514 [1,0,0,0,1,0|2,0,0]=4 4970 B15R2.29 Fc1ccc(nc1)Sc2ccccc2 62a_100000744514_100000041952 [1,0,0,0,1,0|2,0,0]=4 4971 B15R2.29 Nc1ccc(cc1)Sc2ccccc2 62a_100000185761_100000041952 [1,0,0,0,1,0|2,0,0]=4 4972 B15R2.29 Nc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000185761 [1,0,0,0,1,0|2,0,0]=4 4973 B15R2.29 Nc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000737798 [1,0,0,0,1,0|2,0,0]=4 4974 B15R2.29 Nc1ccc(nc1)Sc2ccccc2 62a_100000737798_100000041952 [1,0,0,0,1,0|2,0,0]=4 4975 B15R2.29 Oc1cc[n+](cc1)Cc2ccccc2 271570a_203496583355_200011068538 [1,0,0,0,1,0|2,0,0]=4 4976 B15R2.29 Oc1ccc(cc1)Cc2ccccc2 271570a_203496583355_100011356940 [1,0,0,0,1,0|1,0,0]=3 4977 B15R2.29 Oc1ccc(cc1)Nc2ccccc2 271570a_203496583355_100009815781 [1,0,0,0,1,0|2,0,0]=4 4978 B15R2.29 Oc1ccc(cc1)Oc2ccccc2 271570a_203496583355_100011215699 [1,0,0,0,1,0|1,1,0]=4 4979 B15R2.29 Oc1ccc(cc1)Sc2ccccc2 62a_100000719477_100000185759 [1,0,0,0,1,0|1,0,0]=3 4980 B15R2.29 Oc1ccc(cc1)Sc2ccccn2 62a_100011216584_100000185759 [1,0,0,0,1,0|2,0,0]=4 4981 B15R2.29 Oc1ccc(cc1)Sc2cccnc2 62a_100000210063_100000185759 [1,0,0,0,1,0|2,0,0]=4 4982 B15R2.29 Oc1ccc(cc1)Sc2ccncc2 62a_100000728582_100000185759 [1,0,0,0,1,0|2,0,0]=4 4983 B15R2.29 Oc1ccc(nc1)Oc2ccccc2 271570a_203496583355_200011465514 [1,0,0,0,1,0|1,1,0]=4 4984 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 271570a_203496583355_100011465531 [1,0,0,0,1,0|1,0,0]=3 4985 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 62a_100000685995_100000041952 [1,0,0,0,1,0|1,0,0]=3 4986 B15R2.29 Oc1ccc(nc1)Sc2ccccc2 62a_100000719477_100000744096 [1,0,0,0,1,0|1,0,0]=3 4987 B15R2.29 Oc1ccc(nc1)Sc2ccccn2 62a_100000685995_100011216584 [1,0,0,0,1,0|2,0,0]=4 4988 B15R2.29 Oc1ccc(nc1)Sc2ccccn2 62a_100011216584_100000744096 [1,0,0,0,1,0|2,0,0]=4 4989 B15R2.29 Oc1ccc(nc1)Sc2cccnc2 62a_100000210063_100000744096 [1,0,0,0,1,0|2,0,0]=4 4990 B15R2.29 Oc1ccc(nc1)Sc2cccnc2 62a_100000685995_100000210063 [1,0,0,0,1,0|2,0,0]=4 4991 B15R2.29 Oc1ccc(nc1)Sc2ccncc2 62a_100000685995_100000728582 [1,0,0,0,1,0|2,0,0]=4 4992 B15R2.29 Oc1ccc(nc1)Sc2ccncc2 62a_100000728582_100000744096 [1,0,0,0,1,0|2,0,0]=4 4993 B15R2.29 Oc1cnc(cn1)Sc2ccccc2 62a_100000719477_100015839800 [1,0,0,0,1,0|2,0,0]=4 4994 B15R2.29 Oc1cnc(cn1)Sc2ccccc2 62a_100011934580_100000041952 [1,0,0,0,1,0|2,0,0]=4 4995 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000719477_100000092845 [1,0,0,0,1,0|2,0,0]=4 4996 B15R2.29 Oc1cnc(nc1)Sc2ccccc2 62a_100000730009_100000041952 [1,0,0,0,1,0|2,0,0]=4 4997 B15R2.283 Brc1cc(on1)CSc2ccccc2 62a_100000709089_100000041952 [1,0,0,0,1,0|2,0,0]=4 4998 B15R2.283 Brc1cc(on1)CSc2ccccc2 62a_100000719477_100000709089 [1,0,0,0,1,0|2,0,0]=4 4999 B15R2.283 Brc1ccc(o1)CNc2ccccc2 207a_100000106764_100000185145 [1,0,0,0,1,0|2,0,0]=4 5000 B15R2.283 Brc1ccc(s1)CSc2ccccc2 62a_100000708592_100000041952 [1,0,0,0,1,0|1,1,0]=4 5001 B15R2.283 Brc1ccc(s1)CSc2ccccc2 62a_100000719477_100000708592 [1,0,0,0,1,0|1,1,0]=4 5002 B15R2.283 Brc1coc(c1)CNc2ccccc2 270302a_100000106764_100000747035 [1,0,0,0,1,0|2,0,0]=4 5003 B15R2.283 Brc1csc(c1)CSc2ccccc2 62a_100000719477_100000746031 [1,0,0,0,1,0|1,1,0]=4 5004 B15R2.283 Brc1csc(c1)CSc2ccccc2 62a_100000746031_100000041952 [1,0,0,0,1,0|1,1,0]=4 5005 B15R2.283 Cc1cc(on1)CSc2ccccc2 62a_100000707947_100000041952 [1,0,0,0,1,0|2,0,0]=4 5006 B15R2.283 Cc1cc(on1)CSc2ccccc2 62a_100000719477_100000707947 [1,0,0,0,1,0|2,0,0]=4 5007 B15R2.283 Cc1ccc(o1)CNc2ccccc2 207a_100000106764_100000183696 [1,0,0,0,1,0|2,0,0]=4 5008 B15R2.283 Cc1ccc(o1)CNc2ccccc2 270302a_100000106764_100000183696 [1,0,0,0,1,0|2,0,0]=4 5009 B15R2.283 Clc1ccc(o1)CNc2ccccc2 207a_100000106764_100000188459 [1,0,0,0,1,0|2,0,0]=4 5010 B15R2.283 Clc1ccc(s1)CSc2ccccc2 62a_100000185097_100000041952 [1,0,0,0,1,0|1,1,0]=4 5011 B15R2.283 Clc1ccc(s1)CSc2ccccc2 62a_100000719477_100000185097 [1,0,0,0,1,0|1,1,0]=4 5012 B15R2.283 Ic1ccc(o1)CNc2ccccc2 207a_100000106764_100000186757 [1,0,0,0,1,0|2,0,0]=4 5013 B15R2.31 Brc1cccc(c1)Sc2ccccc2 62a_100000691529_100000041952 [1,0,0,0,1,0|2,0,0]=4 5014 B15R2.31 Brc1cccc(c1)Sc2ccccc2 62a_100000719477_100000691529 [1,0,0,0,1,0|2,0,0]=4 5015 B15R2.31 Cc1cccc(c1)Sc2ccccc2 62a_100000719477_100011215228 [1,0,0,0,1,0|2,0,0]=4 5016 B15R2.31 Cc1cccc(c1)Sc2ccccc2 62a_100011215228_100000041952 [1,0,0,0,1,0|2,0,0]=4 5017 B15R2.31 Cc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000750283 [1,0,0,0,1,0|2,0,0]=4 5018 B15R2.31 Cc1ccnc(c1)Sc2ccccc2 62a_100000750283_100000041952 [1,0,0,0,1,0|2,0,0]=4 5019 B15R2.31 Clc1cccc(c1)Sc2ccccc2 62a_100000699651_100000041952 [1,0,0,0,1,0|2,0,0]=4 5020 B15R2.31 Clc1cccc(c1)Sc2ccccc2 62a_100000719477_100000699651 [1,0,0,0,1,0|2,0,0]=4 5021 B15R2.31 Clc1ccnc(c1)Sc2ccccc2 62a_100000719477_100010167805 [1,0,0,0,1,0|2,0,0]=4 5022 B15R2.31 Clc1ccnc(c1)Sc2ccccc2 62a_100010167805_100000041952 [1,0,0,0,1,0|2,0,0]=4 5023 B15R2.31 Fc1cccc(c1)Sc2ccccc2 62a_100000685547_100000041952 [1,0,0,0,1,0|2,0,0]=4 5024 B15R2.31 Fc1cccc(c1)Sc2ccccc2 62a_100000719477_100000685547 [1,0,0,0,1,0|2,0,0]=4 5025 B15R2.31 Fc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000764206 [1,0,0,0,1,0|2,0,0]=4 5026 B15R2.31 Fc1ccnc(c1)Sc2ccccc2 62a_100000764206_100000041952 [1,0,0,0,1,0|2,0,0]=4 5027 B15R2.31 Nc1cccc(c1)Sc2ccccc2 62a_100000210019_100000041952 [1,0,0,0,1,0|2,0,0]=4 5028 B15R2.31 Nc1cccc(c1)Sc2ccccc2 62a_100000719477_100000210019 [1,0,0,0,1,0|2,0,0]=4 5029 B15R2.31 Nc1ccnc(c1)Sc2ccccc2 62a_100000719477_100009814236 [1,0,0,0,1,0|2,0,0]=4 5030 B15R2.31 Nc1ccnc(c1)Sc2ccccc2 62a_100009814236_100000041952 [1,0,0,0,1,0|2,0,0]=4 5031 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccc2 62a_100000719477_100009816521 [1,0,0,0,1,0|2,0,0]=4 5032 B15R2.31 O=c1cc(cc[nH]1)Sc2ccccc2 62a_100009816521_100000041952 [1,0,0,0,1,0|2,0,0]=4 5033 B15R2.31 O=c1cc(nc[nH]1)Sc2ccccc2 62a_100012002517_100000041952 [1,0,0,0,1,0|2,0,0]=4 5034 B15R2.31 O=c1cc[nH]c(c1)Sc2ccccc2 62a_100009817434_100000041952 [1,0,0,0,1,0|1,0,0]=3 5035 B15R2.31 O=c1cc[nH]c(c1)Sc2ccccn2 62a_100009817434_100011216584 [1,0,0,0,1,0|2,0,0]=4 5036 B15R2.31 O=c1cc[nH]c(c1)Sc2cccnc2 62a_100009817434_100000210063 [1,0,0,0,1,0|2,0,0]=4 5037 B15R2.31 O=c1cc[nH]c(c1)Sc2ccncc2 62a_100009817434_100000728582 [1,0,0,0,1,0|2,0,0]=4 5038 B15R2.31 O=c1cccc([nH]1)Sc2ccccc2 62a_100000719477_100000752884 [1,0,0,0,1,0|2,0,0]=4 5039 B15R2.31 Oc1cccc(c1)Sc2ccccc2 62a_100000719477_100000211634 [1,0,0,0,1,0|1,0,1]=4 5040 B15R2.31 Oc1ccnc(c1)Sc2ccccc2 62a_100000719477_100000762945 [1,0,0,0,1,0|1,0,1]=4 5041 B15R2.31 [S]c1cccc(c1)Sc2ccccc2 62a_100000719477_114929384022 [1,0,0,0,1,0|1,1,0]=4 5042 B15R2.31 [S]c1cccc(c1)Sc2ccccc2 62a_114929384022_100000041952 [1,0,0,0,1,0|1,1,0]=4 5043 B15R2.55 Cc1ccoc1CNc2ccccc2 207a_100000106764_100000763527 [1,0,0,0,1,0|2,0,0]=4 5044 B15R2.55 Cc1ccoc1CNc2ccccc2 270302a_100000106764_100000763527 [1,0,0,0,1,0|2,0,0]=4 5045 B15R2.94 Cc1cc(ccc1O)c2ccccc2 271570a_100010081521_100000210277 [0,0,0,0,2,0|2,0,0]=4 5046 B15R2.94 Cc1cc(ccc1O)c2ccccc2 271570a_100011218836_100000186361 [0,0,0,0,2,0|2,0,0]=4 5047 B15R2.94 Cc1cc(ccc1O)c2ccccc2 271570a_203496583355_100009992443 [0,0,0,0,2,0|2,0,0]=4 5048 B15R2.94 Cc1cc(ncc1O)c2ccccc2 271570a_100011218836_100000692680 [0,0,0,0,2,0|2,0,0]=4 5049 B15R2.94 Nc1cc(ccc1O)c2ccccc2 271570a_100011218836_100000752626 [0,0,0,0,2,0|2,0,0]=4 5050 B15R2.94 Nc1cc(ccc1O)c2ccccc2 271570a_106726388170_100000210277 [0,0,0,0,2,0|2,0,0]=4 5051 B15R2.94 Nc1cc(ncc1O)c2ccccc2 271570a_100011218836_100009819941 [0,0,0,0,2,0|2,0,0]=4 5052 B15R2.94 Oc1ccc(cc1Br)c2ccccc2 271570a_100011218836_100012361655 [0,0,0,0,2,0|2,0,0]=4 5053 B15R2.94 Oc1ccc(cc1Br)c2ccccc2 271570a_203496583355_100016115252 [0,0,0,0,2,0|2,0,0]=4 5054 B15R2.94 Oc1ccc(cc1Cl)c2ccccc2 271570a_100010204135_100000210277 [0,0,0,0,2,0|2,0,0]=4 5055 B15R2.94 Oc1ccc(cc1Cl)c2ccccc2 271570a_100011218836_100012360047 [0,0,0,0,2,0|2,0,0]=4 5056 B15R2.94 Oc1ccc(cc1F)c2ccccc2 271570a_100010239616_100000210277 [0,0,0,0,2,0|2,0,0]=4 5057 B15R2.94 Oc1ccc(cc1F)c2ccccc2 271570a_100011218836_100000185481 [0,0,0,0,2,0|2,0,0]=4 5058 B15R2.94 Oc1ccc(cc1O)c2ccccc2 271570a_100011218836_100009813601 [0,0,0,0,2,0|1,0,1]=4 5059 B15R2.94 Oc1ccc(cc1O)c2ccccc2 271570a_203496583355_100000199855 [0,0,0,0,2,0|1,0,1]=4 5060 B17R2.216 Brc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011740612 [1,0,0,0,0,1|2,0,0]=4 5061 B17R2.216 Brc1ccc(cc1)CCSc2ccccc2 62a_100011740612_100000041952 [1,0,0,0,0,1|2,0,0]=4 5062 B17R2.216 Brc1ccc(cc1)CSCc2ccccc2 62a_100000189115_100015291786 [1,0,0,0,0,1|2,0,0]=4 5063 B17R2.216 Brc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000189115 [1,0,0,0,0,1|2,0,0]=4 5064 B17R2.216 Brc1ccc(cc1)NCSc2ccccc2 2230a_100000210018_100011218342 [1,0,0,0,0,1|2,0,0]=4 5065 B17R2.216 Brc1ccc(cc1)SCSc2ccccc2 62a_100000752885_100011218342 [1,0,0,0,0,1|2,0,0]=4 5066 B17R2.216 Brc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000752885 [1,0,0,0,0,1|2,0,0]=4 5067 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000702658 [1,0,0,0,0,1|2,0,0]=4 5068 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000702658_100015291786 [1,0,0,0,0,1|2,0,0]=4 5069 B17R2.216 Brc1ccc(nc1)SCSc2ccccc2 62a_100000686858_100011218342 [1,0,0,0,0,1|2,0,0]=4 5070 B17R2.216 Brc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100000686858 [1,0,0,0,0,1|2,0,0]=4 5071 B17R2.216 Cc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011713686 [1,0,0,0,0,1|2,0,0]=4 5072 B17R2.216 Cc1ccc(cc1)CCSc2ccccc2 62a_100011713686_100000041952 [1,0,0,0,0,1|2,0,0]=4 5073 B17R2.216 Cc1ccc(cc1)CSCc2ccccc2 62a_100000210814_100015291786 [1,0,0,0,0,1|2,0,0]=4 5074 B17R2.216 Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000210814 [1,0,0,0,0,1|2,0,0]=4 5075 B17R2.216 Cc1ccc(cc1)SCSc2ccccc2 62a_100000186775_100011218342 [1,0,0,0,0,1|2,0,0]=4 5076 B17R2.216 Cc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000186775 [1,0,0,0,0,1|2,0,0]=4 5077 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000691093 [1,0,0,0,0,1|2,0,0]=4 5078 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000691093_100015291786 [1,0,0,0,0,1|2,0,0]=4 5079 B17R2.216 Cc1ccc(nc1)SCSc2ccccc2 62a_100011192072_100011218342 [1,0,0,0,0,1|2,0,0]=4 5080 B17R2.216 Cc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100000754016 [1,0,0,0,0,1|2,0,0]=4 5081 B17R2.216 Clc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011713675 [1,0,0,0,0,1|2,0,0]=4 5082 B17R2.216 Clc1ccc(cc1)CCSc2ccccc2 62a_100011713675_100000041952 [1,0,0,0,0,1|2,0,0]=4 5083 B17R2.216 Clc1ccc(cc1)CSCc2ccccc2 62a_100000187161_100015291786 [1,0,0,0,0,1|2,0,0]=4 5084 B17R2.216 Clc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000187161 [1,0,0,0,0,1|2,0,0]=4 5085 B17R2.216 Clc1ccc(cc1)NCSc2ccccc2 2230a_100000210052_100011218342 [1,0,0,0,0,1|2,0,0]=4 5086 B17R2.216 Clc1ccc(cc1)SCSc2ccccc2 62a_100000755918_100011218342 [1,0,0,0,0,1|2,0,0]=4 5087 B17R2.216 Clc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000755918 [1,0,0,0,0,1|2,0,0]=4 5088 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000697101 [1,0,0,0,0,1|2,0,0]=4 5089 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100012066911_100015291786 [1,0,0,0,0,1|2,0,0]=4 5090 B17R2.216 Clc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100011356976 [1,0,0,0,0,1|2,0,0]=4 5091 B17R2.216 Clc1ccc(nc1)SCSc2ccccc2 62a_100011356976_100011218342 [1,0,0,0,0,1|2,0,0]=4 5092 B17R2.216 Fc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011217392 [1,0,0,0,0,1|2,0,0]=4 5093 B17R2.216 Fc1ccc(cc1)CCSc2ccccc2 62a_100011217392_100000041952 [1,0,0,0,0,1|2,0,0]=4 5094 B17R2.216 Fc1ccc(cc1)CSCc2ccccc2 62a_100000198546_100015291786 [1,0,0,0,0,1|2,0,0]=4 5095 B17R2.216 Fc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000187164 [1,0,0,0,0,1|2,0,0]=4 5096 B17R2.216 Fc1ccc(cc1)SCSc2ccccc2 62a_100000211213_100011218342 [1,0,0,0,0,1|2,0,0]=4 5097 B17R2.216 Fc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000211213 [1,0,0,0,0,1|2,0,0]=4 5098 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000703193 [1,0,0,0,0,1|2,0,0]=4 5099 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000703193_100015291786 [1,0,0,0,0,1|2,0,0]=4 5100 B17R2.216 Fc1ccc(nc1)SCSc2ccccc2 62a_100000744514_100011218342 [1,0,0,0,0,1|2,0,0]=4 5101 B17R2.216 Fc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100000744514 [1,0,0,0,0,1|2,0,0]=4 5102 B17R2.216 Ic1ccc(cc1)CSCc2ccccc2 62a_100000189116_100015291786 [1,0,0,0,0,1|2,0,0]=4 5103 B17R2.216 Ic1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000189116 [1,0,0,0,0,1|2,0,0]=4 5104 B17R2.216 Nc1ccc(cc1)SCSc2ccccc2 62a_100000185761_100011218342 [1,0,0,0,0,1|2,0,0]=4 5105 B17R2.216 Nc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000185761 [1,0,0,0,0,1|2,0,0]=4 5106 B17R2.216 Nc1ccc(nc1)SCSc2ccccc2 62a_100000737798_100011218342 [1,0,0,0,0,1|2,0,0]=4 5107 B17R2.216 Nc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100000737798 [1,0,0,0,0,1|2,0,0]=4 5108 B17R2.216 Oc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100009816426 [1,0,0,0,0,1|1,1,0]=4 5109 B17R2.216 Oc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100009816426 [1,0,0,0,0,1|1,0,0]=3 5110 B17R2.216 Oc1ccc(cc1)CCSc2ccccc2 62a_100009816426_100000041952 [1,0,0,0,0,1|1,0,0]=3 5111 B17R2.216 Oc1ccc(cc1)CCSc2ccccn2 62a_100009816426_100011216584 [1,0,0,0,0,1|2,0,0]=4 5112 B17R2.216 Oc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100009816426 [1,0,0,0,0,1|2,0,0]=4 5113 B17R2.216 Oc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100009816426 [1,0,0,0,0,1|2,0,0]=4 5114 B17R2.216 Oc1ccc(cc1)CCSc2cccnc2 62a_100009816426_100000210063 [1,0,0,0,0,1|2,0,0]=4 5115 B17R2.216 Oc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100009816426 [1,0,0,0,0,1|2,0,0]=4 5116 B17R2.216 Oc1ccc(cc1)CCSc2ccncc2 62a_100009816426_100000728582 [1,0,0,0,0,1|2,0,0]=4 5117 B17R2.216 Oc1ccc(cc1)CNCc2ccccc2 271570a_203496583355_100000195849 [1,0,0,0,0,1|2,0,0]=4 5118 B17R2.216 Oc1ccc(cc1)CNCc2ccccc2 34a_100000185549_100015291786 [1,0,0,0,0,1|2,0,0]=4 5119 B17R2.216 Oc1ccc(cc1)NCCc2ccccc2 34a_100000185829_100000765856 [1,0,0,0,0,1|2,0,0]=4 5120 B17R2.216 Oc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000185759 [1,0,0,0,0,1|2,0,0]=4 5121 B17R2.216 Oc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000185759 [1,0,0,0,0,1|1,0,0]=3 5122 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000685995_100011218657 [1,0,0,0,0,1|2,0,0]=4 5123 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000744096 [1,0,0,0,0,1|2,0,0]=4 5124 B17R2.216 Oc1ccc(nc1)SCSc2ccccc2 62a_100000685995_100011218342 [1,0,0,0,0,1|1,0,0]=3 5125 B17R2.216 Oc1ccc(nc1)SCSc2ccccc2 62a_100011218342_100000744096 [1,0,0,0,0,1|1,0,0]=3 5126 B17R2.216 Oc1cnc(cn1)SCSc2ccccc2 62a_100011218342_100015839800 [1,0,0,0,0,1|2,0,0]=4 5127 B17R2.216 Oc1cnc(cn1)SCSc2ccccc2 62a_100011934580_100011218342 [1,0,0,0,0,1|2,0,0]=4 5128 B17R2.216 Oc1cnc(nc1)SCSc2ccccc2 62a_100000730009_100011218342 [1,0,0,0,0,1|2,0,0]=4 5129 B17R2.216 Oc1cnc(nc1)SCSc2ccccc2 62a_100011218342_100000092845 [1,0,0,0,0,1|2,0,0]=4 5130 B17R2.5301 Brc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011740638 [1,0,0,0,0,1|2,0,0]=4 5131 B17R2.5301 Brc1cccc(c1)CCSc2ccccc2 62a_100011740638_100000041952 [1,0,0,0,0,1|2,0,0]=4 5132 B17R2.5301 Brc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000211773 [1,0,0,0,0,1|2,0,0]=4 5133 B17R2.5301 Brc1cccc(c1)CSCc2ccccc2 62a_100000211773_100015291786 [1,0,0,0,0,1|2,0,0]=4 5134 B17R2.5301 Brc1cccc(c1)SCSc2ccccc2 62a_100000691529_100011218342 [1,0,0,0,0,1|2,0,0]=4 5135 B17R2.5301 Brc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000691529 [1,0,0,0,0,1|2,0,0]=4 5136 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100010173614 [1,0,0,0,0,1|2,0,0]=4 5137 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100010173614_100015291786 [1,0,0,0,0,1|2,0,0]=4 5138 B17R2.5301 Cc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011713685 [1,0,0,0,0,1|2,0,0]=4 5139 B17R2.5301 Cc1cccc(c1)CCSc2ccccc2 62a_100011713685_100000041952 [1,0,0,0,0,1|2,0,0]=4 5140 B17R2.5301 Cc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000211840 [1,0,0,0,0,1|2,0,0]=4 5141 B17R2.5301 Cc1cccc(c1)CSCc2ccccc2 62a_100000211840_100015291786 [1,0,0,0,0,1|2,0,0]=4 5142 B17R2.5301 Cc1cccc(c1)NCSc2ccccc2 2230a_100000188690_100011218342 [1,0,0,0,0,1|2,0,0]=4 5143 B17R2.5301 Cc1cccc(c1)SCSc2ccccc2 62a_100011215228_100011218342 [1,0,0,0,0,1|2,0,0]=4 5144 B17R2.5301 Cc1cccc(c1)SCSc2ccccc2 62a_100011218342_100011215228 [1,0,0,0,0,1|2,0,0]=4 5145 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100000718516 [1,0,0,0,0,1|2,0,0]=4 5146 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000718516_100015291786 [1,0,0,0,0,1|2,0,0]=4 5147 B17R2.5301 Cc1ccnc(c1)SCSc2ccccc2 62a_100000750283_100011218342 [1,0,0,0,0,1|2,0,0]=4 5148 B17R2.5301 Cc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100000750283 [1,0,0,0,0,1|2,0,0]=4 5149 B17R2.5301 Clc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011713710 [1,0,0,0,0,1|2,0,0]=4 5150 B17R2.5301 Clc1cccc(c1)CCSc2ccccc2 62a_100011713710_100000041952 [1,0,0,0,0,1|2,0,0]=4 5151 B17R2.5301 Clc1cccc(c1)CSCc2ccccc2 62a_100000187163_100015291786 [1,0,0,0,0,1|2,0,0]=4 5152 B17R2.5301 Clc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000187163 [1,0,0,0,0,1|2,0,0]=4 5153 B17R2.5301 Clc1cccc(c1)SCSc2ccccc2 62a_100000699651_100011218342 [1,0,0,0,0,1|2,0,0]=4 5154 B17R2.5301 Clc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000699651 [1,0,0,0,0,1|2,0,0]=4 5155 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100016988179 [1,0,0,0,0,1|2,0,0]=4 5156 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100016988179_100015291786 [1,0,0,0,0,1|2,0,0]=4 5157 B17R2.5301 Clc1ccnc(c1)SCSc2ccccc2 62a_100010167805_100011218342 [1,0,0,0,0,1|2,0,0]=4 5158 B17R2.5301 Clc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100010167805 [1,0,0,0,0,1|2,0,0]=4 5159 B17R2.5301 Fc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011217235 [1,0,0,0,0,1|2,0,0]=4 5160 B17R2.5301 Fc1cccc(c1)CCSc2ccccc2 62a_100011217235_100000041952 [1,0,0,0,0,1|2,0,0]=4 5161 B17R2.5301 Fc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000230114 [1,0,0,0,0,1|2,0,0]=4 5162 B17R2.5301 Fc1cccc(c1)CSCc2ccccc2 62a_100000230114_100015291786 [1,0,0,0,0,1|2,0,0]=4 5163 B17R2.5301 Fc1cccc(c1)SCSc2ccccc2 62a_100000685547_100011218342 [1,0,0,0,0,1|2,0,0]=4 5164 B17R2.5301 Fc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000685547 [1,0,0,0,0,1|2,0,0]=4 5165 B17R2.5301 Fc1ccnc(c1)SCSc2ccccc2 62a_100000764206_100011218342 [1,0,0,0,0,1|2,0,0]=4 5166 B17R2.5301 Fc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100000764206 [1,0,0,0,0,1|2,0,0]=4 5167 B17R2.5301 Ic1cccc(c1)CSCc2ccccc2 62a_100000211182_100011218688 [1,0,0,0,0,1|2,0,0]=4 5168 B17R2.5301 Ic1cccc(c1)CSCc2ccccc2 62a_100011218688_100015291786 [1,0,0,0,0,1|2,0,0]=4 5169 B17R2.5301 Nc1cccc(c1)SCSc2ccccc2 62a_100000210019_100011218342 [1,0,0,0,0,1|2,0,0]=4 5170 B17R2.5301 Nc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000210019 [1,0,0,0,0,1|2,0,0]=4 5171 B17R2.5301 Nc1ccnc(c1)SCSc2ccccc2 62a_100009814236_100011218342 [1,0,0,0,0,1|2,0,0]=4 5172 B17R2.5301 Nc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100009814236 [1,0,0,0,0,1|2,0,0]=4 5173 B17R2.5301 O=c1cc(cc[nH]1)SCSc2ccccc2 62a_100009816521_100011218342 [1,0,0,0,0,1|2,0,0]=4 5174 B17R2.5301 O=c1cc(cc[nH]1)SCSc2ccccc2 62a_100011218342_100009816521 [1,0,0,0,0,1|2,0,0]=4 5175 B17R2.5301 O=c1cc(nc[nH]1)SCSc2ccccc2 62a_100012002517_100011218342 [1,0,0,0,0,1|2,0,0]=4 5176 B17R2.5301 O=c1cc[nH]c(c1)SCCc2ccccc2 62a_100009817434_100011218657 [1,0,0,0,0,1|2,0,0]=4 5177 B17R2.5301 O=c1cc[nH]c(c1)SCSc2ccccc2 62a_100009817434_100011218342 [1,0,0,0,0,1|1,0,0]=3 5178 B17R2.5301 O=c1cccc([nH]1)SCSc2ccccc2 62a_100011218342_100000752884 [1,0,0,0,0,1|2,0,0]=4 5179 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100000211182_100011660834 [1,0,0,0,0,1|1,0,1]=4 5180 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100011660834_100015291786 [1,0,0,0,0,1|1,0,1]=4 5181 B17R2.5301 Oc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000211634 [1,0,0,0,0,1|1,0,1]=4 5182 B17R2.5301 Oc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100000762945 [1,0,0,0,0,1|1,0,1]=4 5183 B17R2.5301 [S]c1cccc(c1)SCSc2ccccc2 62a_100011218342_114929384022 [1,0,0,0,0,1|1,1,0]=4 5184 B17R2.5301 [S]c1cccc(c1)SCSc2ccccc2 62a_114929384022_100011218342 [1,0,0,0,0,1|1,1,0]=4 5185 B19R2.11839 Cc1cc(ccc1O)NCCSc2ccccc2 34a_100011218179_100000246102 [0,0,0,0,0,2|2,0,0]=4 5186 B19R2.11839 Cc1cc(ccc1O)NCCSc2ccccc2 7a_100011218179_100000246102 [0,0,0,0,0,2|2,0,0]=4 5187 B19R2.11839 Cc1cc(ccc1O)NCSCc2ccccc2 34a_100011218179_200011217039 [0,0,0,0,0,2|2,0,0]=4 5188 B19R2.11839 Cc1cc(ccc1O)SCCSc2ccccc2 62a_100000246102_100000186361 [0,0,0,0,0,2|2,0,0]=4 5189 B19R2.11839 Cc1cc(ccc1O)SCSCc2ccccc2 62a_200011217039_100000186361 [0,0,0,0,0,2|2,0,0]=4 5190 B19R2.11839 Cc1cc(ncc1O)SCCSc2ccccc2 62a_100000246102_100000692680 [0,0,0,0,0,2|2,0,0]=4 5191 B19R2.11839 Cc1cc(ncc1O)SCSCc2ccccc2 62a_200011217039_100000692680 [0,0,0,0,0,2|2,0,0]=4 5192 B19R2.11839 Nc1cc(ccc1O)SCCSc2ccccc2 62a_100000246102_100000752626 [0,0,0,0,0,2|2,0,0]=4 5193 B19R2.11839 Nc1cc(ccc1O)SCCSc2ccccc2 62a_100000752626_100000246102 [0,0,0,0,0,2|2,0,0]=4 5194 B19R2.11839 Nc1cc(ccc1O)SCSCc2ccccc2 62a_100000752626_200011217039 [0,0,0,0,0,2|2,0,0]=4 5195 B19R2.11839 Nc1cc(ccc1O)SCSCc2ccccc2 62a_200011217039_100000752626 [0,0,0,0,0,2|2,0,0]=4 5196 B19R2.11839 Nc1cc(ncc1O)SCCSc2ccccc2 62a_100000246102_100009819941 [0,0,0,0,0,2|2,0,0]=4 5197 B19R2.11839 Nc1cc(ncc1O)SCCSc2ccccc2 62a_100009819941_100000246102 [0,0,0,0,0,2|2,0,0]=4 5198 B19R2.11839 Nc1cc(ncc1O)SCSCc2ccccc2 62a_100009819941_200011217039 [0,0,0,0,0,2|2,0,0]=4 5199 B19R2.11839 Nc1cc(ncc1O)SCSCc2ccccc2 62a_200011217039_100009819941 [0,0,0,0,0,2|2,0,0]=4 5200 B19R2.11839 O=c1cc(occ1O)CNCCc2ccccc2 2230a_100000106460_100000010605 [0,0,0,0,0,2|1,0,0]=3 5201 B19R2.11839 O=c1cc(occ1O)CNCCc2cccnc2 2230a_100000736294_100000010605 [0,0,0,0,0,2|2,0,0]=4 5202 B19R2.11839 O=c1cc(occ1O)COCCc2ccccc2 7a_100000210268_100000010605 [0,0,0,0,0,2|0,1,0]=3 5203 B19R2.11839 O=c1cc(occ1O)CSCCc2ccccc2 62a_100000765856_100000010605 [0,0,0,0,0,2|0,0,0]=2 5204 B19R2.11839 O=c1cc(occ1O)CSCCc2ccccn2 62a_100015183660_100000010605 [0,0,0,0,0,2|1,0,0]=3 5205 B19R2.11839 O=c1cc(occ1O)CSCCc2cccnc2 62a_200011713674_100000010605 [0,0,0,0,0,2|1,0,0]=3 5206 B19R2.11839 O=c1cc(occ1O)CSCCc2ccncc2 62a_100000723409_100000010605 [0,0,0,0,0,2|1,0,0]=3 5207 B19R2.11839 O=c1cc(occ1O)CSCSc2ccccc2 62a_100011218342_100000010605 [0,0,0,0,0,2|0,0,0]=2 5208 B19R2.11839 Oc1ccc(cc1Br)NCCSc2ccccc2 34a_100011534360_100000246102 [0,0,0,0,0,2|2,0,0]=4 5209 B19R2.11839 Oc1ccc(cc1Br)NCSCc2ccccc2 34a_100011534360_200011217039 [0,0,0,0,0,2|2,0,0]=4 5210 B19R2.11839 Oc1ccc(cc1Br)SCCSc2ccccc2 62a_100000246102_100012361655 [0,0,0,0,0,2|2,0,0]=4 5211 B19R2.11839 Oc1ccc(cc1Br)SCCSc2ccccc2 62a_100012361655_100000246102 [0,0,0,0,0,2|2,0,0]=4 5212 B19R2.11839 Oc1ccc(cc1Br)SCSCc2ccccc2 62a_100012361655_200011217039 [0,0,0,0,0,2|2,0,0]=4 5213 B19R2.11839 Oc1ccc(cc1Br)SCSCc2ccccc2 62a_200011217039_100012361655 [0,0,0,0,0,2|2,0,0]=4 5214 B19R2.11839 Oc1ccc(cc1Cl)NCCSc2ccccc2 34a_100000744943_100000246102 [0,0,0,0,0,2|2,0,0]=4 5215 B19R2.11839 Oc1ccc(cc1Cl)NCSCc2ccccc2 34a_100000744943_200011217039 [0,0,0,0,0,2|2,0,0]=4 5216 B19R2.11839 Oc1ccc(cc1Cl)SCCSc2ccccc2 62a_100000246102_100012360047 [0,0,0,0,0,2|2,0,0]=4 5217 B19R2.11839 Oc1ccc(cc1Cl)SCCSc2ccccc2 62a_100012360047_100000246102 [0,0,0,0,0,2|2,0,0]=4 5218 B19R2.11839 Oc1ccc(cc1Cl)SCSCc2ccccc2 62a_100012360047_200011217039 [0,0,0,0,0,2|2,0,0]=4 5219 B19R2.11839 Oc1ccc(cc1Cl)SCSCc2ccccc2 62a_200011217039_100012360047 [0,0,0,0,0,2|2,0,0]=4 5220 B19R2.11839 Oc1ccc(cc1F)NCCSc2ccccc2 34a_100011220035_100000246102 [0,0,0,0,0,2|2,0,0]=4 5221 B19R2.11839 Oc1ccc(cc1F)NCCSc2ccccc2 7a_100011220035_100000246102 [0,0,0,0,0,2|2,0,0]=4 5222 B19R2.11839 Oc1ccc(cc1F)NCSCc2ccccc2 34a_100011220035_200011217039 [0,0,0,0,0,2|2,0,0]=4 5223 B19R2.11839 Oc1ccc(cc1F)SCCSc2ccccc2 62a_100000185481_100000246102 [0,0,0,0,0,2|2,0,0]=4 5224 B19R2.11839 Oc1ccc(cc1F)SCCSc2ccccc2 62a_100000246102_100000185481 [0,0,0,0,0,2|2,0,0]=4 5225 B19R2.11839 Oc1ccc(cc1F)SCSCc2ccccc2 62a_100000185481_200011217039 [0,0,0,0,0,2|2,0,0]=4 5226 B19R2.11839 Oc1ccc(cc1F)SCSCc2ccccc2 62a_200011217039_100000185481 [0,0,0,0,0,2|2,0,0]=4 5227 B19R2.11839 Oc1ccc(cc1O)CCSCc2ccccc2 62a_100000211182_200010393615 [0,0,0,0,0,2|1,0,1]=4 5228 B19R2.11839 Oc1ccc(cc1O)NCCSc2ccccc2 34a_100102946323_100000246102 [0,0,0,0,0,2|1,0,1]=4 5229 B19R2.11839 Oc1ccc(cc1O)NCSCc2ccccc2 34a_100102946323_200011217039 [0,0,0,0,0,2|1,0,1]=4 5230 B19R2.11839 Oc1ccc(cc1O)SCCSc2ccccc2 62a_100000246102_100009813601 [0,0,0,0,0,2|1,0,1]=4 5231 B19R2.11839 Oc1ccc(cc1O)SCSCc2ccccc2 62a_200011217039_100009813601 [0,0,0,0,0,2|1,0,1]=4