0 B11R1.167 C=C(C)c1cc(=O)[nH]cc1F 271570a_100000694244_100009817642 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.167 C=C(C)c1cc(c[nH]c1=O)F 271570a_100000694244_100009817720 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.167 C=C(C)c1cc(ccc1Br)Br 271570a_100000694244_100011483371 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.167 C=C(C)c1cc(ccc1Br)Cl 271570a_100000694244_100012339723 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.167 C=C(C)c1cc(ccc1Br)F 271570a_100000694244_100011217576 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.167 C=C(C)c1cc(ccc1Br)N 271570a_100000694244_100000750459 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.167 C=C(C)c1cc(ccc1Cl)Br 271570a_100000694244_100011772130 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [0,0,0,0,0,0|2,0,0]=2 16 B11R1.167 C=C(C)c1cc(ccc1Cl)Cl 271570a_100000694244_100000707729 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.167 C=C(C)c1cc(ccc1Cl)F 271570a_100000694244_100011217299 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.167 C=C(C)c1cc(ccc1Cl)N 271570a_100000694244_100012360549 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.167 C=C(C)c1cc(ccc1F)Br 271570a_100000694244_100011217312 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [0,0,0,0,0,0|2,0,0]=2 22 B11R1.167 C=C(C)c1cc(ccc1F)Cl 271570a_100000694244_100011218116 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.167 C=C(C)c1cc(ccc1F)F 271570a_100000694244_100000750033 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.167 C=C(C)c1cc(ccc1F)N 271570a_100000694244_100000760356 [0,0,0,0,0,0|3,0,0]=3 25 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [0,0,0,0,0,0|2,0,0]=2 33 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,0,0,0,0,0|1,0,0]=1 34 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [0,0,0,0,0,0|2,0,0]=2 35 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [0,0,0,0,0,0|2,0,0]=2 37 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.167 C=C(C)c1cc(cnc1Br)N 271570a_100000694244_100010201102 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.167 C=C(C)c1cc(cnc1C)Br 271570a_100000694244_200010090566 [0,0,0,0,0,0|4,0,0]=4 40 B11R1.167 C=C(C)c1cc(cnc1C)C 271570a_100000694244_100009817436 [0,0,0,0,0,0|3,0,0]=3 41 B11R1.167 C=C(C)c1cc(cnc1C)F 271570a_100000694244_100009860710 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.167 C=C(C)c1cc(cnc1C)N 271570a_100000694244_100011998591 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.167 C=C(C)c1cc(cnc1C)O 271570a_100000694244_100009819603 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.167 C=C(C)c1cc(cnc1Cl)Br 271570a_100000694244_100009814771 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.167 C=C(C)c1cc(cnc1Cl)C 271570a_100000694244_100010210167 [0,0,0,0,0,0|3,0,0]=3 46 B11R1.167 C=C(C)c1cc(cnc1Cl)Cl 271570a_100000694244_200000062399 [0,0,0,0,0,0|4,0,0]=4 47 B11R1.167 C=C(C)c1cc(cnc1Cl)N 271570a_100000694244_100010253917 [0,0,0,0,0,0|4,0,0]=4 48 B11R1.167 C=C(C)c1cc(cnc1F)Br 271570a_100000694244_100010172738 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.167 C=C(C)c1cc(cnc1F)C 271570a_100000694244_100000049784 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.167 C=C(C)c1cc(cnc1F)Cl 271570a_100000694244_100010188783 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.167 C=C(C)c1cc(cnc1F)F 271570a_100000694244_100009820768 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.167 C=C(C)c1cc(cnc1F)N 271570a_100000694244_100009840397 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.167 C=C(C)c1cc(cnc1F)O 271570a_100000694244_100009817267 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.167 C=C(C)c1cc(cnc1N)Br 271570a_100000694244_100000760472 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.167 C=C(C)c1cc(cnc1N)C 271570a_100000694244_100000049664 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.167 C=C(C)c1cc(cnc1N)Cl 271570a_100000694244_100000050159 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.167 C=C(C)c1cc(cnc1N)F 271570a_100000694244_100009814671 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.167 C=C(C)c1cc(cnc1N)N 271570a_100000694244_200011934315 [0,0,0,0,0,0|4,0,0]=4 59 B11R1.167 C=C(C)c1cc(cnc1O)Br 271570a_100000694244_100010197142 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.167 C=C(C)c1cc(cnc1O)C 271570a_100000694244_100000049931 [0,0,0,0,0,0|2,0,0]=2 61 B11R1.167 C=C(C)c1cc(cnc1O)Cl 271570a_100000694244_100010188700 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.167 C=C(C)c1cc(n[nH]c1=O)C 271570a_100000694244_100009819039 [0,0,0,0,0,0|3,0,1]=4 63 B11R1.167 C=C(C)c1cc(ncc1Br)Br 271570a_100000694244_100010171693 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.167 C=C(C)c1cc(ncc1Br)Cl 271570a_100000694244_100009815598 [0,0,0,0,0,0|4,0,0]=4 65 B11R1.167 C=C(C)c1cc(ncc1C)Br 271570a_100000694244_100010067628 [0,0,0,0,0,0|4,0,0]=4 66 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.167 C=C(C)c1cc(ncc1C)Cl 271570a_100000694244_100010068021 [0,0,0,0,0,0|4,0,0]=4 68 B11R1.167 C=C(C)c1cc(ncc1C)F 271570a_100000694244_100000049870 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.167 C=C(C)c1cc(ncc1C)N 271570a_100000694244_100009819938 [0,0,0,0,0,0|4,0,0]=4 70 B11R1.167 C=C(C)c1cc(ncc1C)O 271570a_100000694244_100009831917 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.167 C=C(C)c1cc(ncc1Cl)Br 271570a_100000694244_100010223331 [0,0,0,0,0,0|4,0,0]=4 72 B11R1.167 C=C(C)c1cc(ncc1Cl)Cl 271570a_100000694244_100010172835 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.167 C=C(C)c1cc(ncc1Cl)F 271570a_100000694244_100009892587 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.167 C=C(C)c1cc(ncc1Cl)N 271570a_100000694244_100010134119 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.167 C=C(C)c1cc(ncc1F)Br 271570a_100000694244_100010193852 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [0,0,0,0,0,0|3,0,0]=3 77 B11R1.167 C=C(C)c1cc(ncc1F)Cl 271570a_100000694244_100000708277 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.167 C=C(C)c1cc(ncc1F)F 271570a_100000694244_100010233071 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.167 C=C(C)c1cc(ncc1F)N 271570a_100000694244_100015713587 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.167 C=C(C)c1cc(ncc1N)Cl 271570a_100000694244_100000050123 [0,0,0,0,0,0|4,0,0]=4 81 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.167 C=C(C)c1cc(ncc1O)Cl 271570a_100000694244_100000698892 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.167 C=C(C)c1cc(nnc1O)O 271570a_100000694244_100000759565 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.167 C=C(C)c1cn(ccc1=O)C 271570a_100000694244_100010750718 [0,0,0,0,0,0|2,0,1]=3 85 B11R1.167 C=C(C)c1nc(c[nH]c1=O)C 271570a_100000694244_100009858157 [0,0,0,0,0,0|3,0,1]=4 86 B11R1.167 C=C(C)c1nc(ccc1Br)N 271570a_100000694244_100010192275 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.167 C=C(C)c1nc(ccc1C)C 271570a_100000694244_100009854376 [0,0,0,0,0,0|3,0,0]=3 88 B11R1.167 C=C(C)c1nc(ccc1C)N 271570a_100000694244_100000126722 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.167 C=C(C)c1nc(ccc1F)C 271570a_100000694244_100009817602 [0,0,0,0,0,0|3,0,0]=3 90 B11R1.167 C=C(C)c1nc(ccc1F)Cl 271570a_100000694244_100010136221 [0,0,0,0,0,0|4,0,0]=4 91 B11R1.167 C=C(C)c1nc(ccc1F)F 271570a_100000694244_100010997973 [0,0,0,0,0,0|4,0,0]=4 92 B11R1.167 C=C(C)c1nc(ccc1F)N 271570a_100000694244_100010892222 [0,0,0,0,0,0|4,0,0]=4 93 B11R1.167 C=C(C)c1nc(ccc1N)Br 271570a_100000694244_100010168765 [0,0,0,0,0,0|4,0,0]=4 94 B11R1.167 C=C(C)c1nc(ccc1N)C 271570a_100000694244_100000685570 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.167 C=C(C)c1nc(ccc1N)Cl 271570a_100000694244_100010233647 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.167 C=C(C)c1nc(ccc1N)F 271570a_100000694244_100009879877 [0,0,0,0,0,0|4,0,0]=4 97 B11R1.167 C=C(C)c1nc(ccc1N)N 271570a_100000694244_200009884323 [0,0,0,0,0,0|4,0,0]=4 98 B11R1.167 C=C(C)c1nc(ccc1O)Br 271570a_100000694244_100010253912 [0,0,0,0,0,0|3,0,0]=3 99 B11R1.167 C=C(C)c1nc(ccc1O)C 271570a_100000694244_100000702858 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.167 C=C(C)c1nc(ccc1O)Cl 271570a_100000694244_100000696390 [0,0,0,0,0,0|3,0,0]=3 101 B11R1.167 C=C(C)c1nc(ccc1O)F 271570a_100000694244_100010382442 [0,0,0,0,0,0|3,0,0]=3 102 B11R1.167 C=C(C)c1nc(cnc1C)C 271570a_100000694244_100000211308 [0,0,0,0,0,0|4,0,0]=4 103 B11R1.167 C=C(C)c1nc(cnc1N)C 271570a_100000694244_100009819049 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.167 C=C(C)c1nc(ncc1F)C 271570a_100000694244_100000059819 [0,0,0,0,0,0|4,0,0]=4 105 B11R1.167 C=C(C)c1nc(ncc1N)C 271570a_100000694244_100009873743 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.167 CC(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200000210301 [0,0,0,0,0,0|3,0,1]=4 107 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,0,0,0,0,0|1,0,0]=1 109 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,0,0,0,0,0|2,0,0]=2 110 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,0,0,0,0,0|2,0,0]=2 111 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,0,0,0,0,0|2,0,0]=2 112 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,0,0,0,0,0|2,0,0]=2 114 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,0,0,0,0,0|1,0,0]=1 115 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,0,0,0,0,0|2,0,0]=2 117 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,0,0,0,0,0|2,0,0]=2 118 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,0,0,0,0,0|2,0,0]=2 119 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,0,0,0,0,0|2,0,0]=2 121 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,0,0,0,0,0|1,0,0]=1 122 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,0,0,0,0,0|2,0,0]=2 123 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,0,0,0,0,0|2,0,0]=2 126 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,0,0,0,0,0|2,0,0]=2 127 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,0,0,0,0,0|2,0,0]=2 128 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,0,0,0,0,0|1,0,0]=1 129 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,0,0,0,0,0|2,0,0]=2 130 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,0,0,0,0,0|2,0,0]=2 131 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,0,0,0,0,0|2,0,0]=2 132 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,0,0,0,0,0|2,0,0]=2 133 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,0,0,0,0,0|2,0,0]=2 134 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,0,0,0,0,0|2,0,0]=2 135 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,0,0,0,0,0|1,0,0]=1 136 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,0,0,0,0,0|2,0,0]=2 137 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,0,0,0,0,0|2,0,0]=2 138 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,0,0,0,0,0|2,0,0]=2 139 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,0,0,0,0,0|2,0,0]=2 140 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,0,0,0,0,0|2,0,0]=2 141 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,0,0,0,0,0|1,0,0]=1 142 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,0,0,0,0,0|1,0,0]=1 143 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,0,0,0,0,0|0,0,0]=0 144 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,0,0,0,0,0|0,0,0]=0 145 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,0,0,0,0,0|1,0,0]=1 146 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,0,0,0,0,0|1,0,0]=1 147 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,0,0,0,0,0|1,0,0]=1 148 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,0,0,0,0,0|1,0,0]=1 149 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,0,0,0,0,0|1,0,0]=1 150 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,0,0,0,0,0|1,0,0]=1 151 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,0,0,0,0,0|1,0,0]=1 152 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [0,0,0,0,0,0|3,0,0]=3 153 B11R1.167 CC(=O)c1cc(cnc1F)O 271570a_203496583355_100010254234 [0,0,0,0,0,0|3,0,0]=3 154 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [0,0,0,0,0,0|3,0,0]=3 155 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [0,0,0,0,0,0|2,0,0]=2 156 B11R1.167 CC(=O)c1cc(ncc1F)O 271570a_203496583355_100000697832 [0,0,0,0,0,0|3,0,0]=3 157 B11R1.167 CC(=O)c1nc(ccc1F)O 271570a_203496583355_100009887703 [0,0,0,0,0,0|3,0,0]=3 158 B11R1.167 CC(=O)c1nc(ncc1C)O 271570a_203496583355_100010687370 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.167 CC(C)c1cc(ccc1F)O 271570a_203496583355_200053017515 [0,0,0,0,0,0|3,0,1]=4 160 B11R1.167 CC(C)c1cc(ccc1N)O 271570a_203496583355_100000694223 [0,0,0,0,0,0|3,0,1]=4 161 B11R1.167 CC(C)c1cc(ccc1O)Br 271570a_203496583355_100010244561 [0,0,0,0,0,0|2,0,1]=3 162 B11R1.167 CC(C)c1cc(ccc1O)O 271570a_203496583355_100000691460 [0,0,0,0,0,0|2,0,1]=3 163 B11R1.167 CC(N)c1cc(ccc1O)F 271570a_203496583355_100012343209 [0,0,0,0,0,0|2,0,1]=3 164 B11R1.167 CC(O)c1cc(ccc1F)O 271570a_203496583355_100011943926 [0,0,0,0,0,0|2,0,2]=4 165 B11R1.167 CN(C)c1cc(ccc1Br)Cl 269982a_100020633006_200000210301 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.167 CN(C)c1cc(ccc1Br)Cl 34a_100020633006_200000210301 [0,0,0,0,0,0|4,0,0]=4 167 B11R1.167 CN(C)c1cc(ccc1Br)F 2230a_100020633008_200000210301 [0,0,0,0,0,0|4,0,0]=4 168 B11R1.167 CN(C)c1cc(ccc1Br)F 269982a_100020633008_200000210301 [0,0,0,0,0,0|4,0,0]=4 169 B11R1.167 CN(C)c1cc(ccc1Br)F 34a_100020633008_200000210301 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.167 CN(C)c1cc(ccc1Cl)Br 269982a_100011772073_200000210301 [0,0,0,0,0,0|4,0,0]=4 171 B11R1.167 CN(C)c1cc(ccc1Cl)Br 34a_100011772073_200000210301 [0,0,0,0,0,0|4,0,0]=4 172 B11R1.167 CN(C)c1cc(ccc1Cl)Cl 269982a_100000742562_200000210301 [0,0,0,0,0,0|4,0,0]=4 173 B11R1.167 CN(C)c1cc(ccc1Cl)Cl 34a_100000742562_200000210301 [0,0,0,0,0,0|4,0,0]=4 174 B11R1.167 CN(C)c1cc(ccc1F)Br 2230a_100011314990_200000210301 [0,0,0,0,0,0|4,0,0]=4 175 B11R1.167 CN(C)c1cc(ccc1F)Br 269982a_100011314990_200000210301 [0,0,0,0,0,0|4,0,0]=4 176 B11R1.167 CN(C)c1cc(ccc1F)Br 34a_100011314990_200000210301 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.167 CN(C)c1cc(ccc1F)Br 38a_100011314990_200000210301 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.167 CN(C)c1cc(ccc1F)O 271570a_203496583355_100010288836 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.167 CN(C)c1cc(ccc1O)O 271570a_203496583355_200010083878 [0,0,0,0,0,0|3,0,0]=3 180 B11R1.167 CN([13CH3])c1cc(ccc1Br)Cl 269982a_100020633006_200025704644 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.167 CN([13CH3])c1cc(ccc1Br)Cl 34a_100020633006_200025704644 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 2230a_100020633008_200025704644 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 269982a_100020633008_200025704644 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.167 CN([13CH3])c1cc(ccc1Br)F 34a_100020633008_200025704644 [0,0,0,0,0,0|4,0,0]=4 185 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Br 269982a_100011772073_200025704644 [0,0,0,0,0,0|4,0,0]=4 186 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Br 34a_100011772073_200025704644 [0,0,0,0,0,0|4,0,0]=4 187 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Cl 269982a_100000742562_200025704644 [0,0,0,0,0,0|4,0,0]=4 188 B11R1.167 CN([13CH3])c1cc(ccc1Cl)Cl 34a_100000742562_200025704644 [0,0,0,0,0,0|4,0,0]=4 189 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 2230a_100011314990_200025704644 [0,0,0,0,0,0|4,0,0]=4 190 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 269982a_100011314990_200025704644 [0,0,0,0,0,0|4,0,0]=4 191 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 34a_100011314990_200025704644 [0,0,0,0,0,0|4,0,0]=4 192 B11R1.167 CN([13CH3])c1cc(ccc1F)Br 38a_100011314990_200025704644 [0,0,0,0,0,0|4,0,0]=4 193 B11R1.167 C[C@H](O)c1cc(ccc1O)F 271570a_203496583355_100134768474 [0,0,0,0,0,0|1,0,2]=3 194 B11R1.167 Cc1cc(c(cn1)F)N(C)C 27a_100102631434_100009867690 [0,0,0,0,0,0|4,0,0]=4 195 B11R1.167 Cc1ccc(c(c1)B(O)O)O 271570a_203496583355_200010883979 [0,0,0,0,0,0|2,0,1]=3 196 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,0,0,0,0,0|1,0,0]=1 197 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,0,0,0,0,0|1,0,0]=1 198 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,0,0,0,0,0|1,0,0]=1 199 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,0,0,0,0,0|1,0,0]=1 200 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,0,0,0,0,0|1,0,0]=1 201 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,0,0,0,0,0|1,0,0]=1 202 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,0,0,0,0,0|0,0,0]=0 203 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,0,0,0,0,0|2,0,0]=2 205 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,0,0,0,0,0|2,0,0]=2 206 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,0,0,0,0,0|2,0,0]=2 207 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,0,0,0,0,0|2,0,0]=2 208 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,0,0,0,0,0|2,0,0]=2 209 B11R1.167 Cc1ccc(cc1N(C)C)Br 2230a_100020629602_200000210301 [0,0,0,0,0,0|4,0,0]=4 210 B11R1.167 Cc1ccc(cc1N(C)C)Br 269982a_100020629602_200000210301 [0,0,0,0,0,0|4,0,0]=4 211 B11R1.167 Cc1ccc(cc1N(C)C)Br 34a_100020629602_200000210301 [0,0,0,0,0,0|4,0,0]=4 212 B11R1.167 Cc1ccc(cc1N(C)C)Br 38a_100020629602_200000210301 [0,0,0,0,0,0|4,0,0]=4 213 B11R1.167 Cc1ccc(cc1N(C)C)Cl 2230a_100000221440_200000210301 [0,0,0,0,0,0|4,0,0]=4 214 B11R1.167 Cc1ccc(cc1N(C)C)Cl 269982a_100000221440_200000210301 [0,0,0,0,0,0|4,0,0]=4 215 B11R1.167 Cc1ccc(cc1N(C)C)Cl 34a_100000221440_200000210301 [0,0,0,0,0,0|4,0,0]=4 216 B11R1.167 Cc1ccc(cc1N(C)C)Cl 38a_100000221440_200000210301 [0,0,0,0,0,0|4,0,0]=4 217 B11R1.167 Cc1ccc(cc1N(C)C)F 2230a_114849113390_200000210301 [0,0,0,0,0,0|4,0,0]=4 218 B11R1.167 Cc1ccc(cc1N(C)C)F 269982a_114849113390_200000210301 [0,0,0,0,0,0|4,0,0]=4 219 B11R1.167 Cc1ccc(cc1N(C)C)F 34a_114849113390_200000210301 [0,0,0,0,0,0|4,0,0]=4 220 B11R1.167 Cc1ccc(cc1N(C)C)F 38a_114849113390_200000210301 [0,0,0,0,0,0|4,0,0]=4 221 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 2230a_100020629602_200025704644 [0,0,0,0,0,0|4,0,0]=4 222 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 269982a_100020629602_200025704644 [0,0,0,0,0,0|4,0,0]=4 223 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 34a_100020629602_200025704644 [0,0,0,0,0,0|4,0,0]=4 224 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Br 38a_100020629602_200025704644 [0,0,0,0,0,0|4,0,0]=4 225 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 2230a_100000221440_200025704644 [0,0,0,0,0,0|4,0,0]=4 226 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 269982a_100000221440_200025704644 [0,0,0,0,0,0|4,0,0]=4 227 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 34a_100000221440_200025704644 [0,0,0,0,0,0|4,0,0]=4 228 B11R1.167 Cc1ccc(cc1N(C)[13CH3])Cl 38a_100000221440_200025704644 [0,0,0,0,0,0|4,0,0]=4 229 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 2230a_114849113390_200025704644 [0,0,0,0,0,0|4,0,0]=4 230 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 269982a_114849113390_200025704644 [0,0,0,0,0,0|4,0,0]=4 231 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 34a_114849113390_200025704644 [0,0,0,0,0,0|4,0,0]=4 232 B11R1.167 Cc1ccc(cc1N(C)[13CH3])F 38a_114849113390_200025704644 [0,0,0,0,0,0|4,0,0]=4 233 B11R1.167 Cc1cnc(c(c1)B(O)O)O 271570a_203496583355_200000049436 [0,0,0,0,0,0|3,0,1]=4 234 B11R1.167 Cc1cnc(c(c1)N(C)C)F 27a_100102631434_100009820679 [0,0,0,0,0,0|4,0,0]=4 235 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [0,0,0,0,0,0|3,0,0]=3 236 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [0,0,0,0,0,0|3,0,0]=3 237 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [0,0,0,0,0,0|2,0,0]=2 238 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [0,0,0,0,0,0|2,0,0]=2 239 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [0,0,0,0,0,0|2,0,0]=2 240 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [0,0,0,0,0,0|2,0,0]=2 241 B11R1.167 NC(=O)c1cc(cnc1N)O 271570a_203496583355_100000701294 [0,0,0,0,0,0|4,0,0]=4 242 B11R1.167 NC(=O)c1cc(cnc1O)F 271570a_203496583355_100012183597 [0,0,0,0,0,0|3,0,0]=3 243 B11R1.167 NC(=O)c1cc(ncc1F)O 271570a_203496583355_100015943597 [0,0,0,0,0,0|4,0,0]=4 244 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [0,0,0,0,0,0|4,0,0]=4 245 B11R1.167 NC(=O)c1nc(ccc1N)O 271570a_203496583355_100000093116 [0,0,0,0,0,0|4,0,0]=4 246 B11R1.167 NC(=O)c1nc(cnc1O)O 271570a_203496583355_100010272261 [0,0,0,0,0,0|4,0,0]=4 247 B11R1.167 OB(O)c1cc(ccc1O)F 271570a_203496583355_200009816908 [0,0,0,0,0,0|3,0,1]=4 248 B11R1.167 OB(O)c1cc(ccc1O)O 271570a_203496583355_200009814749 [0,0,0,0,0,0|3,0,1]=4 249 B11R1.167 Oc1ccc(cc1C(F)F)F 271570a_203496583355_100010189890 [0,0,0,0,0,0|3,0,1]=4 250 B11R1.167 [13CH3]C(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200025704644 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,0,0,0,0,0|2,0,0]=2 252 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,0,0,0,0,0|2,0,0]=2 253 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,0,0,0,0,0|2,0,0]=2 254 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,0,0,0,0,0|2,0,0]=2 255 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,0,0,0,0,0|2,0,0]=2 256 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,0,0,0,0,0|2,0,0]=2 257 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,0,0,0,0,0|2,0,0]=2 258 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,0,0,0,0,0|2,0,0]=2 259 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,0,0,0,0,0|2,0,0]=2 260 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,0,0,0,0,0|2,0,0]=2 261 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,0,0,0,0,0|2,0,0]=2 262 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,0,0,0,0,0|2,0,0]=2 263 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,0,0,0,0,0|2,0,0]=2 264 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,0,0,0,0,0|2,0,0]=2 265 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,0,0,0,0,0|2,0,0]=2 266 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,0,0,0,0,0|2,0,0]=2 267 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,0,0,0,0,0|2,0,0]=2 268 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,0,0,0,0,0|2,0,0]=2 269 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,0,0,0,0,0|2,0,0]=2 270 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,0,0,0,0,0|2,0,0]=2 271 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,0,0,0,0,0|1,0,0]=1 272 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,0,0,0,0,0|1,0,0]=1 273 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,0,0,0,0,0|1,0,0]=1 274 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,0,0,0,0,0|1,0,0]=1 275 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,0,0,0,0,0|1,0,0]=1 276 B10R1.30 C=Cc1cc(ccc1Br)Br 271570a_100011290941_100011483371 [1,0,0,0,0,0|2,0,1]=4 277 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [1,0,0,0,0,0|1,0,1]=3 278 B10R1.30 C=Cc1cc(ccc1Br)Cl 271570a_100011290941_100012339723 [1,0,0,0,0,0|2,0,1]=4 279 B10R1.30 C=Cc1cc(ccc1Br)F 271570a_100011290941_100011217576 [1,0,0,0,0,0|2,0,1]=4 280 B10R1.30 C=Cc1cc(ccc1Br)N 271570a_100011290941_100000750459 [1,0,0,0,0,0|2,0,1]=4 281 B10R1.30 C=Cc1cc(ccc1Br)O 271570a_100011290941_100012339312 [1,0,0,0,0,0|2,0,1]=4 282 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [1,0,0,0,0,0|2,0,1]=4 283 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [1,0,0,0,0,0|1,0,1]=3 284 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [1,0,0,0,0,0|2,0,1]=4 285 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [1,0,0,0,0,0|2,0,1]=4 286 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [1,0,0,0,0,0|2,0,1]=4 287 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [1,0,0,0,0,0|2,0,1]=4 288 B10R1.30 C=Cc1cc(ccc1Cl)Br 271570a_100011290941_100011772130 [1,0,0,0,0,0|2,0,1]=4 289 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [1,0,0,0,0,0|1,0,1]=3 290 B10R1.30 C=Cc1cc(ccc1Cl)Cl 271570a_100011290941_100000707729 [1,0,0,0,0,0|2,0,1]=4 291 B10R1.30 C=Cc1cc(ccc1Cl)F 271570a_100011290941_100011217299 [1,0,0,0,0,0|2,0,1]=4 292 B10R1.30 C=Cc1cc(ccc1Cl)N 271570a_100011290941_100012360549 [1,0,0,0,0,0|2,0,1]=4 293 B10R1.30 C=Cc1cc(ccc1Cl)O 271570a_100011290941_100000049588 [1,0,0,0,0,0|2,0,1]=4 294 B10R1.30 C=Cc1cc(ccc1F)Br 271570a_100011290941_100011217312 [1,0,0,0,0,0|2,0,1]=4 295 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [1,0,0,0,0,0|1,0,1]=3 296 B10R1.30 C=Cc1cc(ccc1F)Cl 271570a_100011290941_100011218116 [1,0,0,0,0,0|2,0,1]=4 297 B10R1.30 C=Cc1cc(ccc1F)F 271570a_100011290941_100000750033 [1,0,0,0,0,0|2,0,1]=4 298 B10R1.30 C=Cc1cc(ccc1F)N 271570a_100011290941_100000760356 [1,0,0,0,0,0|2,0,1]=4 299 B10R1.30 C=Cc1cc(ccc1F)O 271570a_100011290941_100000693481 [1,0,0,0,0,0|2,0,1]=4 300 B10R1.30 C=Cc1cc(ccc1N)Br 271570a_100011290941_100000187925 [1,0,0,0,0,0|2,0,1]=4 301 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [1,0,0,0,0,0|1,0,1]=3 302 B10R1.30 C=Cc1cc(ccc1N)Cl 271570a_100011290941_100000761889 [1,0,0,0,0,0|2,0,1]=4 303 B10R1.30 C=Cc1cc(ccc1N)F 271570a_100011290941_100000760547 [1,0,0,0,0,0|2,0,1]=4 304 B10R1.30 C=Cc1cc(ccc1N)N 271570a_100011290941_100011534242 [1,0,0,0,0,0|2,0,1]=4 305 B10R1.30 C=Cc1cc(ccc1N)O 271570a_100011290941_100012001276 [1,0,0,0,0,0|2,0,1]=4 306 B10R1.30 C=Cc1cc(ccc1O)Br 271570a_100011290941_100012355227 [1,0,0,0,0,0|1,0,1]=3 307 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [1,0,0,0,0,0|0,0,1]=2 308 B10R1.30 C=Cc1cc(ccc1O)Cl 271570a_100011290941_100011356953 [1,0,0,0,0,0|1,0,1]=3 309 B10R1.30 C=Cc1cc(ccc1O)F 271570a_100011290941_100000211999 [1,0,0,0,0,0|1,0,1]=3 310 B10R1.30 C=Cc1cc(ccc1O)N 271570a_100011290941_100011534360 [1,0,0,0,0,0|1,0,1]=3 311 B10R1.30 C=Cc1cc(ccc1O)O 271570a_100011290941_100009813629 [1,0,0,0,0,0|1,0,1]=3 312 B10R1.30 C=Cc1cc(cnc1C)C 271570a_100011290941_100009817436 [1,0,0,0,0,0|2,0,1]=4 313 B10R1.30 C=Cc1cc(cnc1Cl)C 271570a_100011290941_100010210167 [1,0,0,0,0,0|2,0,1]=4 314 B10R1.30 C=Cc1cc(cnc1F)C 271570a_100011290941_100000049784 [1,0,0,0,0,0|2,0,1]=4 315 B10R1.30 C=Cc1cc(cnc1N)C 271570a_100011290941_100000049664 [1,0,0,0,0,0|2,0,1]=4 316 B10R1.30 C=Cc1cc(cnc1O)Br 271570a_100011290941_100010197142 [1,0,0,0,0,0|2,0,1]=4 317 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [1,0,0,0,0,0|1,0,1]=3 318 B10R1.30 C=Cc1cc(cnc1O)Cl 271570a_100011290941_100010188700 [1,0,0,0,0,0|2,0,1]=4 319 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [1,0,0,0,0,0|2,0,1]=4 320 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [1,0,0,0,0,0|2,0,1]=4 321 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [1,0,0,0,0,0|1,0,1]=3 322 B10R1.30 C=Cc1cc(ncc1O)Cl 271570a_100011290941_100000698892 [1,0,0,0,0,0|2,0,1]=4 323 B10R1.30 C=Cc1cn(ccc1=O)C 271570a_100011290941_100010750718 [1,0,0,0,0,0|1,0,2]=4 324 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [1,0,0,0,0,0|2,0,1]=4 325 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [1,0,0,0,0,0|2,0,1]=4 326 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [1,0,0,0,0,0|2,0,1]=4 327 B10R1.30 C=Cc1nc(ccc1O)Br 271570a_100011290941_100010253912 [1,0,0,0,0,0|2,0,1]=4 328 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [1,0,0,0,0,0|1,0,1]=3 329 B10R1.30 C=Cc1nc(ccc1O)Cl 271570a_100011290941_100000696390 [1,0,0,0,0,0|2,0,1]=4 330 B10R1.30 C=Cc1nc(ccc1O)F 271570a_100011290941_100010382442 [1,0,0,0,0,0|2,0,1]=4 331 B10R1.30 CCc1cc(ccc1Br)O 271570a_203496583355_100010244631 [1,0,0,0,0,0|2,0,1]=4 332 B10R1.30 CCc1cc(ccc1F)O 271570a_203496583355_100010244625 [1,0,0,0,0,0|2,0,1]=4 333 B10R1.30 CCc1cc(ccc1N)O 271570a_203496583355_100000686106 [1,0,0,0,0,0|2,0,1]=4 334 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [1,0,0,0,0,0|1,0,1]=3 335 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [1,0,0,0,0,0|1,0,1]=3 336 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [1,0,0,0,0,0|1,0,1]=3 337 B10R1.30 CNc1cc(ccc1Br)Br 34a_100000737762_200000210301 [1,0,0,0,0,0|3,0,0]=4 338 B10R1.30 CNc1cc(ccc1Br)C 34a_100000745044_200000210301 [1,0,0,0,0,0|2,0,0]=3 339 B10R1.30 CNc1cc(ccc1Br)Cl 34a_100000687073_200000210301 [1,0,0,0,0,0|3,0,0]=4 340 B10R1.30 CNc1cc(ccc1Br)F 34a_100000687223_200000210301 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.30 CNc1cc(ccc1Br)O 34a_100011999798_200000210301 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.30 CNc1cc(ccc1C)Br 34a_100000741167_200000210301 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.30 CNc1cc(ccc1C)Br 7a_100000741167_200000210301 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.30 CNc1cc(ccc1C)C 2230a_100000185781_200000210301 [1,0,0,0,0,0|2,0,0]=3 345 B10R1.30 CNc1cc(ccc1C)C 34a_100000185781_200000210301 [1,0,0,0,0,0|2,0,0]=3 346 B10R1.30 CNc1cc(ccc1C)C 7a_100000185781_200000210301 [1,0,0,0,0,0|2,0,0]=3 347 B10R1.30 CNc1cc(ccc1C)Cl 34a_100000211374_200000210301 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.30 CNc1cc(ccc1C)Cl 7a_100000211374_200000210301 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.30 CNc1cc(ccc1C)F 34a_100000211107_200000210301 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.30 CNc1cc(ccc1C)F 7a_100000211107_200000210301 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.30 CNc1cc(ccc1C)I 7a_100000761890_200000210301 [1,0,0,0,0,0|3,0,0]=4 352 B10R1.30 CNc1cc(ccc1C)O 271570a_203496583355_100020629602 [1,0,0,0,0,0|3,0,0]=4 353 B10R1.30 CNc1cc(ccc1C)O 34a_100011216113_200000210301 [1,0,0,0,0,0|3,0,0]=4 354 B10R1.30 CNc1cc(ccc1Cl)Br 34a_100000750497_200000210301 [1,0,0,0,0,0|3,0,0]=4 355 B10R1.30 CNc1cc(ccc1Cl)C 34a_100011215360_200000210301 [1,0,0,0,0,0|2,0,0]=3 356 B10R1.30 CNc1cc(ccc1Cl)Cl 34a_100000184485_200000210301 [1,0,0,0,0,0|3,0,0]=4 357 B10R1.30 CNc1cc(ccc1Cl)F 34a_100000751338_200000210301 [1,0,0,0,0,0|3,0,0]=4 358 B10R1.30 CNc1cc(ccc1Cl)I 34a_200000761891_200000210301 [1,0,0,0,0,0|3,0,0]=4 359 B10R1.30 CNc1cc(ccc1Cl)O 34a_100011934297_200000210301 [1,0,0,0,0,0|3,0,0]=4 360 B10R1.30 CNc1cc(ccc1F)Br 34a_100000740924_200000210301 [1,0,0,0,0,0|3,0,0]=4 361 B10R1.30 CNc1cc(ccc1F)C 34a_100000211285_200000210301 [1,0,0,0,0,0|2,0,0]=3 362 B10R1.30 CNc1cc(ccc1F)Cl 34a_100000212115_200000210301 [1,0,0,0,0,0|3,0,0]=4 363 B10R1.30 CNc1cc(ccc1F)F 34a_100000210742_200000210301 [1,0,0,0,0,0|3,0,0]=4 364 B10R1.30 CNc1cc(ccc1F)I 34a_100011464823_200000210301 [1,0,0,0,0,0|3,0,0]=4 365 B10R1.30 CNc1cc(ccc1F)O 271570a_203496583355_100011314990 [1,0,0,0,0,0|3,0,0]=4 366 B10R1.30 CNc1cc(ccc1F)O 34a_100012017239_200000210301 [1,0,0,0,0,0|3,0,0]=4 367 B10R1.30 CNc1cc(ccc1I)Br 34a_100000743836_200000210301 [1,0,0,0,0,0|3,0,0]=4 368 B10R1.30 CNc1cc(ccc1I)C 34a_100011216686_200000210301 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.30 CNc1cc(ccc1I)Cl 34a_100000761886_200000210301 [1,0,0,0,0,0|3,0,0]=4 370 B10R1.30 CNc1cc(ccc1I)F 34a_100011218093_200000210301 [1,0,0,0,0,0|3,0,0]=4 371 B10R1.30 CNc1cc(ccc1N)O 271570a_203496583355_100000694363 [1,0,0,0,0,0|3,0,0]=4 372 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [1,0,0,0,0,0|1,0,0]=2 374 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [1,0,0,0,0,0|2,0,0]=3 375 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [1,0,0,0,0,0|2,0,0]=3 376 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [1,0,0,0,0,0|2,0,0]=3 377 B10R1.30 CNc1cc(cnc1F)C 27a_100102657272_100009820679 [1,0,0,0,0,0|3,0,0]=4 378 B10R1.30 CNc1cc(ncc1F)C 27a_100102657272_100009867690 [1,0,0,0,0,0|3,0,0]=4 379 B10R1.30 COc1cc(ccc1Br)Br 34a_100011220040_200000210301 [1,0,0,0,0,0|3,0,0]=4 380 B10R1.30 COc1cc(ccc1Br)Br 7a_100011220040_200000210301 [1,0,0,0,0,0|3,0,0]=4 381 B10R1.30 COc1cc(ccc1Br)C 34a_100012002257_200000210301 [1,0,0,0,0,0|2,0,0]=3 382 B10R1.30 COc1cc(ccc1Br)C 7a_100012002257_200000210301 [1,0,0,0,0,0|2,0,0]=3 383 B10R1.30 COc1cc(ccc1Br)Cl 34a_100012339455_200000210301 [1,0,0,0,0,0|3,0,0]=4 384 B10R1.30 COc1cc(ccc1Br)Cl 7a_100012339455_200000210301 [1,0,0,0,0,0|3,0,0]=4 385 B10R1.30 COc1cc(ccc1Br)F 34a_100000690578_200000210301 [1,0,0,0,0,0|3,0,0]=4 386 B10R1.30 COc1cc(ccc1Br)F 7a_100000690578_200000210301 [1,0,0,0,0,0|3,0,0]=4 387 B10R1.30 COc1cc(ccc1Br)I 34a_100012356990_200000210301 [1,0,0,0,0,0|3,0,0]=4 388 B10R1.30 COc1cc(ccc1Br)I 7a_100012356990_200000210301 [1,0,0,0,0,0|3,0,0]=4 389 B10R1.30 COc1cc(ccc1Br)O 271570a_203496583355_100012353699 [1,0,0,0,0,0|3,0,0]=4 390 B10R1.30 COc1cc(ccc1C)Br 34a_100000685420_200000210301 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.30 COc1cc(ccc1C)Br 7a_100000685420_200000210301 [1,0,0,0,0,0|3,0,0]=4 392 B10R1.30 COc1cc(ccc1C)C 34a_100000210931_200000210301 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.30 COc1cc(ccc1C)C 7a_100000210931_200000210301 [1,0,0,0,0,0|2,0,0]=3 394 B10R1.30 COc1cc(ccc1C)Cl 34a_100000756515_200000210301 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.30 COc1cc(ccc1C)Cl 7a_100000756515_200000210301 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.30 COc1cc(ccc1C)F 34a_100000690566_200000210301 [1,0,0,0,0,0|3,0,0]=4 397 B10R1.30 COc1cc(ccc1C)F 7a_100000690566_200000210301 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.30 COc1cc(ccc1C)I 7a_100000766334_200000210301 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.30 COc1cc(ccc1C)N 34a_100000759471_200000210301 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.30 COc1cc(ccc1C)N 7a_100000759471_200000210301 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.30 COc1cc(ccc1C)O 271570a_203496583355_100011830276 [1,0,0,0,0,0|3,0,0]=4 402 B10R1.30 COc1cc(ccc1Cl)Br 34a_100000738945_200000210301 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.30 COc1cc(ccc1Cl)Br 7a_100000738945_200000210301 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.30 COc1cc(ccc1Cl)C 34a_100000211493_200000210301 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.30 COc1cc(ccc1Cl)C 7a_100000211493_200000210301 [1,0,0,0,0,0|2,0,0]=3 406 B10R1.30 COc1cc(ccc1Cl)Cl 34a_100000211422_200000210301 [1,0,0,0,0,0|3,0,0]=4 407 B10R1.30 COc1cc(ccc1Cl)Cl 7a_100000211422_200000210301 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.30 COc1cc(ccc1Cl)F 34a_100000692107_200000210301 [1,0,0,0,0,0|3,0,0]=4 409 B10R1.30 COc1cc(ccc1Cl)F 7a_100000692107_200000210301 [1,0,0,0,0,0|3,0,0]=4 410 B10R1.30 COc1cc(ccc1Cl)I 34a_100011356854_200000210301 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.30 COc1cc(ccc1Cl)I 7a_100011356854_200000210301 [1,0,0,0,0,0|3,0,0]=4 412 B10R1.30 COc1cc(ccc1Cl)N 34a_100011934209_200000210301 [1,0,0,0,0,0|3,0,0]=4 413 B10R1.30 COc1cc(ccc1Cl)O 271570a_203496583355_100011356853 [1,0,0,0,0,0|3,0,0]=4 414 B10R1.30 COc1cc(ccc1F)Br 34a_100000686035_200000210301 [1,0,0,0,0,0|3,0,0]=4 415 B10R1.30 COc1cc(ccc1F)Br 7a_100000686035_200000210301 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.30 COc1cc(ccc1F)C 34a_100000759540_200000210301 [1,0,0,0,0,0|2,0,0]=3 417 B10R1.30 COc1cc(ccc1F)C 7a_100000759540_200000210301 [1,0,0,0,0,0|2,0,0]=3 418 B10R1.30 COc1cc(ccc1F)Cl 34a_100000757397_200000210301 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.30 COc1cc(ccc1F)Cl 7a_100000757397_200000210301 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.30 COc1cc(ccc1F)F 34a_100000752141_200000210301 [1,0,0,0,0,0|3,0,0]=4 421 B10R1.30 COc1cc(ccc1F)F 7a_100000752141_200000210301 [1,0,0,0,0,0|3,0,0]=4 422 B10R1.30 COc1cc(ccc1F)I 34a_100009958187_200000210301 [1,0,0,0,0,0|3,0,0]=4 423 B10R1.30 COc1cc(ccc1F)I 7a_100009958187_200000210301 [1,0,0,0,0,0|3,0,0]=4 424 B10R1.30 COc1cc(ccc1F)N 34a_100012017398_200000210301 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.30 COc1cc(ccc1F)N 7a_100012017398_200000210301 [1,0,0,0,0,0|3,0,0]=4 426 B10R1.30 COc1cc(ccc1F)O 271570a_203496583355_100011934186 [1,0,0,0,0,0|3,0,0]=4 427 B10R1.30 COc1cc(ccc1I)Br 34a_100012344904_200000210301 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.30 COc1cc(ccc1I)Br 7a_100012344904_200000210301 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.30 COc1cc(ccc1I)Cl 34a_100000050036_200000210301 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.30 COc1cc(ccc1I)Cl 7a_100000050036_200000210301 [1,0,0,0,0,0|3,0,0]=4 431 B10R1.30 COc1cc(ccc1I)F 34a_100010084537_200000210301 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.30 COc1cc(ccc1I)F 7a_100010084537_200000210301 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.30 COc1cc(ccc1N)Br 34a_100000739049_200000210301 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.30 COc1cc(ccc1N)Br 7a_100000739049_200000210301 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.30 COc1cc(ccc1N)C 34a_100000211527_200000210301 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.30 COc1cc(ccc1N)C 7a_100000211527_200000210301 [1,0,0,0,0,0|2,0,0]=3 437 B10R1.30 COc1cc(ccc1N)Cl 34a_100000185728_200000210301 [1,0,0,0,0,0|3,0,0]=4 438 B10R1.30 COc1cc(ccc1N)Cl 7a_100000185728_200000210301 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.30 COc1cc(ccc1N)F 34a_100000753323_200000210301 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.30 COc1cc(ccc1N)F 7a_100000753323_200000210301 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.30 COc1cc(ccc1N)I 34a_100000057187_200000210301 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.30 COc1cc(ccc1N)I 7a_100000057187_200000210301 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.30 COc1cc(ccc1N)N 34a_100025717382_200000210301 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.30 COc1cc(ccc1N)O 271570a_203496583355_100011279103 [1,0,0,0,0,0|3,0,0]=4 445 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [1,0,0,0,0,0|2,0,0]=3 446 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [1,0,0,0,0,0|1,0,0]=2 447 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [1,0,0,0,0,0|2,0,0]=3 448 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [1,0,0,0,0,0|2,0,0]=3 449 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [1,0,0,0,0,0|2,0,0]=3 450 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [1,0,0,0,0,0|2,0,0]=3 451 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [1,0,0,0,0,0|2,0,0]=3 452 B10R1.30 COc1cc(cnc1Cl)C 34a_100012000487_200000210301 [1,0,0,0,0,0|3,0,0]=4 453 B10R1.30 COc1cc(cnc1Cl)C 7a_100012000487_200000210301 [1,0,0,0,0,0|3,0,0]=4 454 B10R1.30 COc1cc(cnc1F)C 34a_100009849810_200000210301 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.30 COc1cc(cnc1F)C 7a_100009849810_200000210301 [1,0,0,0,0,0|3,0,0]=4 456 B10R1.30 COc1cc(cnc1O)C 271570a_203496583355_200000118316 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.30 COc1cc(cnc1O)F 271570a_203496583355_100009867738 [1,0,0,0,0,0|3,0,0]=4 458 B10R1.30 COc1cc(cnc1O)N 271570a_203496583355_100000097218 [1,0,0,0,0,0|3,0,0]=4 459 B10R1.30 COc1cc(ncc1Br)C 34a_100011016184_200000210301 [1,0,0,0,0,0|3,0,0]=4 460 B10R1.30 COc1cc(ncc1O)C 271570a_203496583355_100000717771 [1,0,0,0,0,0|2,0,0]=3 461 B10R1.30 COc1cc(ncc1O)Cl 271570a_203496583355_100010154656 [1,0,0,0,0,0|3,0,0]=4 462 B10R1.30 COc1cc(ncc1O)F 271570a_203496583355_100010135560 [1,0,0,0,0,0|3,0,0]=4 463 B10R1.30 COc1cc(ncc1O)N 271570a_203496583355_100015506990 [1,0,0,0,0,0|3,0,0]=4 464 B10R1.30 COc1nc(ccc1Br)C 34a_100009817604_200000210301 [1,0,0,0,0,0|3,0,0]=4 465 B10R1.30 COc1nc(ccc1N)C 34a_100000687486_200000210301 [1,0,0,0,0,0|3,0,0]=4 466 B10R1.30 COc1nc(ccc1O)C 271570a_203496583355_100010138632 [1,0,0,0,0,0|2,0,0]=3 467 B10R1.30 COc1nc(ccc1O)N 271570a_203496583355_100010187630 [1,0,0,0,0,0|3,0,0]=4 468 B10R1.30 COc1nc(ccc1O)O 271570a_203496583355_100010893133 [1,0,0,0,0,0|3,0,0]=4 469 B10R1.30 CSc1cc(ccc1Br)Br 62a_100011483371_200000210301 [1,0,0,0,0,0|3,0,0]=4 470 B10R1.30 CSc1cc(ccc1Br)Br 62a_200000210301_100011483371 [1,0,0,0,0,0|3,0,0]=4 471 B10R1.30 CSc1cc(ccc1Br)C 62a_100012353751_200000210301 [1,0,0,0,0,0|2,0,0]=3 472 B10R1.30 CSc1cc(ccc1Br)C 62a_200000210301_100012353751 [1,0,0,0,0,0|2,0,0]=3 473 B10R1.30 CSc1cc(ccc1Br)Cl 62a_100012339723_200000210301 [1,0,0,0,0,0|3,0,0]=4 474 B10R1.30 CSc1cc(ccc1Br)Cl 62a_200000210301_100012339723 [1,0,0,0,0,0|3,0,0]=4 475 B10R1.30 CSc1cc(ccc1Br)F 62a_100011217576_200000210301 [1,0,0,0,0,0|3,0,0]=4 476 B10R1.30 CSc1cc(ccc1Br)F 62a_200000210301_100011217576 [1,0,0,0,0,0|3,0,0]=4 477 B10R1.30 CSc1cc(ccc1Br)N 62a_100000750459_200000210301 [1,0,0,0,0,0|3,0,0]=4 478 B10R1.30 CSc1cc(ccc1Br)N 62a_200000210301_100000750459 [1,0,0,0,0,0|3,0,0]=4 479 B10R1.30 CSc1cc(ccc1Br)O 62a_100012339312_200000210301 [1,0,0,0,0,0|3,0,0]=4 480 B10R1.30 CSc1cc(ccc1Br)O 62a_200000210301_100012339312 [1,0,0,0,0,0|3,0,0]=4 481 B10R1.30 CSc1cc(ccc1C)Br 62a_100011344865_200000210301 [1,0,0,0,0,0|3,0,0]=4 482 B10R1.30 CSc1cc(ccc1C)Br 62a_200000210301_100011344865 [1,0,0,0,0,0|3,0,0]=4 483 B10R1.30 CSc1cc(ccc1C)C 62a_100000210833_200000210301 [1,0,0,0,0,0|2,0,0]=3 484 B10R1.30 CSc1cc(ccc1C)C 62a_200000210301_100000210833 [1,0,0,0,0,0|2,0,0]=3 485 B10R1.30 CSc1cc(ccc1C)Cl 62a_100011263213_200000210301 [1,0,0,0,0,0|3,0,0]=4 486 B10R1.30 CSc1cc(ccc1C)Cl 62a_200000210301_100011263213 [1,0,0,0,0,0|3,0,0]=4 487 B10R1.30 CSc1cc(ccc1C)F 62a_100011218078_200000210301 [1,0,0,0,0,0|3,0,0]=4 488 B10R1.30 CSc1cc(ccc1C)F 62a_200000210301_100011218078 [1,0,0,0,0,0|3,0,0]=4 489 B10R1.30 CSc1cc(ccc1C)N 62a_100000736455_200000210301 [1,0,0,0,0,0|3,0,0]=4 490 B10R1.30 CSc1cc(ccc1C)N 62a_200000210301_100000736455 [1,0,0,0,0,0|3,0,0]=4 491 B10R1.30 CSc1cc(ccc1C)O 62a_100011380479_200000210301 [1,0,0,0,0,0|3,0,0]=4 492 B10R1.30 CSc1cc(ccc1C)O 62a_200000210301_100011380479 [1,0,0,0,0,0|3,0,0]=4 493 B10R1.30 CSc1cc(ccc1Cl)Br 62a_100011772130_200000210301 [1,0,0,0,0,0|3,0,0]=4 494 B10R1.30 CSc1cc(ccc1Cl)Br 62a_200000210301_100011772130 [1,0,0,0,0,0|3,0,0]=4 495 B10R1.30 CSc1cc(ccc1Cl)C 62a_100012356289_200000210301 [1,0,0,0,0,0|2,0,0]=3 496 B10R1.30 CSc1cc(ccc1Cl)C 62a_200000210301_100012356289 [1,0,0,0,0,0|2,0,0]=3 497 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_100000707729_200000210301 [1,0,0,0,0,0|3,0,0]=4 498 B10R1.30 CSc1cc(ccc1Cl)Cl 62a_200000210301_100000707729 [1,0,0,0,0,0|3,0,0]=4 499 B10R1.30 CSc1cc(ccc1Cl)F 62a_100011217299_200000210301 [1,0,0,0,0,0|3,0,0]=4 500 B10R1.30 CSc1cc(ccc1Cl)F 62a_200000210301_100011217299 [1,0,0,0,0,0|3,0,0]=4 501 B10R1.30 CSc1cc(ccc1Cl)N 62a_100012360549_200000210301 [1,0,0,0,0,0|3,0,0]=4 502 B10R1.30 CSc1cc(ccc1Cl)N 62a_200000210301_100012360549 [1,0,0,0,0,0|3,0,0]=4 503 B10R1.30 CSc1cc(ccc1Cl)O 62a_100000049588_200000210301 [1,0,0,0,0,0|3,0,0]=4 504 B10R1.30 CSc1cc(ccc1Cl)O 62a_200000210301_100000049588 [1,0,0,0,0,0|3,0,0]=4 505 B10R1.30 CSc1cc(ccc1F)Br 62a_100011217312_200000210301 [1,0,0,0,0,0|3,0,0]=4 506 B10R1.30 CSc1cc(ccc1F)Br 62a_200000210301_100011217312 [1,0,0,0,0,0|3,0,0]=4 507 B10R1.30 CSc1cc(ccc1F)C 62a_100000736223_200000210301 [1,0,0,0,0,0|2,0,0]=3 508 B10R1.30 CSc1cc(ccc1F)C 62a_200000210301_100000736223 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.30 CSc1cc(ccc1F)Cl 62a_100011218116_200000210301 [1,0,0,0,0,0|3,0,0]=4 510 B10R1.30 CSc1cc(ccc1F)Cl 62a_200000210301_100011218116 [1,0,0,0,0,0|3,0,0]=4 511 B10R1.30 CSc1cc(ccc1F)F 62a_100011219198_200000210301 [1,0,0,0,0,0|3,0,0]=4 512 B10R1.30 CSc1cc(ccc1F)F 62a_200000210301_100011219198 [1,0,0,0,0,0|3,0,0]=4 513 B10R1.30 CSc1cc(ccc1F)N 62a_100000760356_200000210301 [1,0,0,0,0,0|3,0,0]=4 514 B10R1.30 CSc1cc(ccc1F)N 62a_200000210301_100000760356 [1,0,0,0,0,0|3,0,0]=4 515 B10R1.30 CSc1cc(ccc1F)O 271570a_203496583355_100010341305 [1,0,0,0,0,0|3,0,0]=4 516 B10R1.30 CSc1cc(ccc1F)O 62a_100000693481_200000210301 [1,0,0,0,0,0|3,0,0]=4 517 B10R1.30 CSc1cc(ccc1F)O 62a_200000210301_100000693481 [1,0,0,0,0,0|3,0,0]=4 518 B10R1.30 CSc1cc(ccc1N)Br 62a_100000187925_200000210301 [1,0,0,0,0,0|3,0,0]=4 519 B10R1.30 CSc1cc(ccc1N)Br 62a_200000210301_100000187925 [1,0,0,0,0,0|3,0,0]=4 520 B10R1.30 CSc1cc(ccc1N)C 62a_100011356834_200000210301 [1,0,0,0,0,0|2,0,0]=3 521 B10R1.30 CSc1cc(ccc1N)C 62a_200000210301_100011356834 [1,0,0,0,0,0|2,0,0]=3 522 B10R1.30 CSc1cc(ccc1N)Cl 62a_100000761889_200000210301 [1,0,0,0,0,0|3,0,0]=4 523 B10R1.30 CSc1cc(ccc1N)Cl 62a_200000210301_100000761889 [1,0,0,0,0,0|3,0,0]=4 524 B10R1.30 CSc1cc(ccc1N)F 62a_100000760547_200000210301 [1,0,0,0,0,0|3,0,0]=4 525 B10R1.30 CSc1cc(ccc1N)F 62a_200000210301_100000760547 [1,0,0,0,0,0|3,0,0]=4 526 B10R1.30 CSc1cc(ccc1N)N 62a_100011534242_200000210301 [1,0,0,0,0,0|3,0,0]=4 527 B10R1.30 CSc1cc(ccc1N)N 62a_200000210301_100011534242 [1,0,0,0,0,0|3,0,0]=4 528 B10R1.30 CSc1cc(ccc1N)O 62a_100012001276_200000210301 [1,0,0,0,0,0|3,0,0]=4 529 B10R1.30 CSc1cc(ccc1N)O 62a_200000210301_100012001276 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [1,0,0,0,0,0|2,0,0]=3 531 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [1,0,0,0,0,0|2,0,0]=3 532 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [1,0,0,0,0,0|1,0,0]=2 533 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [1,0,0,0,0,0|1,0,0]=2 534 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [1,0,0,0,0,0|1,0,0]=2 535 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [1,0,0,0,0,0|2,0,0]=3 536 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [1,0,0,0,0,0|2,0,0]=3 537 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [1,0,0,0,0,0|2,0,0]=3 538 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [1,0,0,0,0,0|2,0,0]=3 539 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [1,0,0,0,0,0|2,0,0]=3 540 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [1,0,0,0,0,0|2,0,0]=3 541 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [1,0,0,0,0,0|2,0,0]=3 542 B10R1.30 CSc1cc(cnc1C)C 62a_100009817436_200000210301 [1,0,0,0,0,0|3,0,0]=4 543 B10R1.30 CSc1cc(cnc1C)C 62a_200000210301_100009817436 [1,0,0,0,0,0|3,0,0]=4 544 B10R1.30 CSc1cc(cnc1Cl)C 62a_100010210167_200000210301 [1,0,0,0,0,0|3,0,0]=4 545 B10R1.30 CSc1cc(cnc1Cl)C 62a_200000210301_100010210167 [1,0,0,0,0,0|3,0,0]=4 546 B10R1.30 CSc1cc(cnc1F)C 62a_100000049784_200000210301 [1,0,0,0,0,0|3,0,0]=4 547 B10R1.30 CSc1cc(cnc1F)C 62a_200000210301_100000049784 [1,0,0,0,0,0|3,0,0]=4 548 B10R1.30 CSc1cc(cnc1N)C 62a_100000049664_200000210301 [1,0,0,0,0,0|3,0,0]=4 549 B10R1.30 CSc1cc(cnc1N)C 62a_200000210301_100000049664 [1,0,0,0,0,0|3,0,0]=4 550 B10R1.30 CSc1cc(cnc1O)Br 62a_100010197142_200000210301 [1,0,0,0,0,0|3,0,0]=4 551 B10R1.30 CSc1cc(cnc1O)Br 62a_200000210301_100010197142 [1,0,0,0,0,0|3,0,0]=4 552 B10R1.30 CSc1cc(cnc1O)C 271570a_203496583355_100010884634 [1,0,0,0,0,0|2,0,0]=3 553 B10R1.30 CSc1cc(cnc1O)C 62a_100000719714_200000210301 [1,0,0,0,0,0|2,0,0]=3 554 B10R1.30 CSc1cc(cnc1O)C 62a_200000210301_100000719714 [1,0,0,0,0,0|2,0,0]=3 555 B10R1.30 CSc1cc(cnc1O)Cl 62a_100010188700_200000210301 [1,0,0,0,0,0|3,0,0]=4 556 B10R1.30 CSc1cc(cnc1O)Cl 62a_200000210301_100010188700 [1,0,0,0,0,0|3,0,0]=4 557 B10R1.30 CSc1cc(ncc1C)C 62a_100009862788_200000210301 [1,0,0,0,0,0|3,0,0]=4 558 B10R1.30 CSc1cc(ncc1C)C 62a_200000210301_100009862788 [1,0,0,0,0,0|3,0,0]=4 559 B10R1.30 CSc1cc(ncc1F)C 62a_100009867690_200000210301 [1,0,0,0,0,0|3,0,0]=4 560 B10R1.30 CSc1cc(ncc1F)C 62a_200000210301_100009867690 [1,0,0,0,0,0|3,0,0]=4 561 B10R1.30 CSc1cc(ncc1O)C 62a_100009843476_200000210301 [1,0,0,0,0,0|2,0,0]=3 562 B10R1.30 CSc1cc(ncc1O)C 62a_200000210301_100009843476 [1,0,0,0,0,0|2,0,0]=3 563 B10R1.30 CSc1cc(ncc1O)Cl 62a_100000698892_200000210301 [1,0,0,0,0,0|3,0,0]=4 564 B10R1.30 CSc1cc(ncc1O)Cl 62a_200000210301_100000698892 [1,0,0,0,0,0|3,0,0]=4 565 B10R1.30 CSc1cn(ccc1=O)C 62a_100010750718_200000210301 [1,0,0,0,0,0|2,0,1]=4 566 B10R1.30 CSc1cn(ccc1=O)C 62a_200000210301_100010750718 [1,0,0,0,0,0|2,0,1]=4 567 B10R1.30 CSc1nc(ccc1C)C 62a_100009854376_200000210301 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.30 CSc1nc(ccc1C)C 62a_200000210301_100009854376 [1,0,0,0,0,0|3,0,0]=4 569 B10R1.30 CSc1nc(ccc1F)C 62a_100009817602_200000210301 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.30 CSc1nc(ccc1F)C 62a_200000210301_100009817602 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.30 CSc1nc(ccc1N)C 62a_100000685570_200000210301 [1,0,0,0,0,0|3,0,0]=4 572 B10R1.30 CSc1nc(ccc1N)C 62a_200000210301_100000685570 [1,0,0,0,0,0|3,0,0]=4 573 B10R1.30 CSc1nc(ccc1O)Br 62a_100010253912_200000210301 [1,0,0,0,0,0|3,0,0]=4 574 B10R1.30 CSc1nc(ccc1O)Br 62a_200000210301_100010253912 [1,0,0,0,0,0|3,0,0]=4 575 B10R1.30 CSc1nc(ccc1O)C 62a_100000702858_200000210301 [1,0,0,0,0,0|2,0,0]=3 576 B10R1.30 CSc1nc(ccc1O)C 62a_200000210301_100000702858 [1,0,0,0,0,0|2,0,0]=3 577 B10R1.30 CSc1nc(ccc1O)Cl 62a_200000210301_100000696390 [1,0,0,0,0,0|3,0,0]=4 578 B10R1.30 CSc1nc(ccc1O)F 62a_100010382442_200000210301 [1,0,0,0,0,0|3,0,0]=4 579 B10R1.30 CSc1nc(ccc1O)F 62a_200000210301_100010382442 [1,0,0,0,0,0|3,0,0]=4 580 B10R1.30 Cc1cc(c(cn1)Br)O[13CH3] 34a_100011016184_200025704644 [1,0,0,0,0,0|3,0,0]=4 581 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_100009862788_200025704644 [1,0,0,0,0,0|3,0,0]=4 582 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100009862788 [1,0,0,0,0,0|3,0,0]=4 583 B10R1.30 Cc1cc(c(cn1)F)S[13CH3] 62a_100009867690_200025704644 [1,0,0,0,0,0|3,0,0]=4 584 B10R1.30 Cc1cc(c(cn1)F)S[13CH3] 62a_200025704644_100009867690 [1,0,0,0,0,0|3,0,0]=4 585 B10R1.30 Cc1cc(c(cn1)O)CO 271570a_203496583355_100015579599 [1,0,0,0,0,0|1,0,2]=4 586 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_100009843476_200025704644 [1,0,0,0,0,0|2,0,0]=3 587 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_200025704644_100009843476 [1,0,0,0,0,0|2,0,0]=3 588 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [1,0,0,0,0,0|1,0,1]=3 589 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [1,0,0,0,0,0|0,0,0]=1 590 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [1,0,0,0,0,0|0,0,2]=3 591 B10R1.30 Cc1ccc(c(c1)N[13CH3])Br 34a_100000745044_200025704644 [1,0,0,0,0,0|2,0,0]=3 592 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 2230a_100000185781_200025704644 [1,0,0,0,0,0|2,0,0]=3 593 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 34a_100000185781_200025704644 [1,0,0,0,0,0|2,0,0]=3 594 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 7a_100000185781_200025704644 [1,0,0,0,0,0|2,0,0]=3 595 B10R1.30 Cc1ccc(c(c1)N[13CH3])Cl 34a_100011215360_200025704644 [1,0,0,0,0,0|2,0,0]=3 596 B10R1.30 Cc1ccc(c(c1)N[13CH3])F 34a_100000211285_200025704644 [1,0,0,0,0,0|2,0,0]=3 597 B10R1.30 Cc1ccc(c(c1)N[13CH3])I 34a_100011216686_200025704644 [1,0,0,0,0,0|2,0,0]=3 598 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [1,0,0,0,0,0|1,0,0]=2 599 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 34a_100012002257_200025704644 [1,0,0,0,0,0|2,0,0]=3 600 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 7a_100012002257_200025704644 [1,0,0,0,0,0|2,0,0]=3 601 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 34a_100000210931_200025704644 [1,0,0,0,0,0|2,0,0]=3 602 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 7a_100000210931_200025704644 [1,0,0,0,0,0|2,0,0]=3 603 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 34a_100000211493_200025704644 [1,0,0,0,0,0|2,0,0]=3 604 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 7a_100000211493_200025704644 [1,0,0,0,0,0|2,0,0]=3 605 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 34a_100000759540_200025704644 [1,0,0,0,0,0|2,0,0]=3 606 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 7a_100000759540_200025704644 [1,0,0,0,0,0|2,0,0]=3 607 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 34a_100000211527_200025704644 [1,0,0,0,0,0|2,0,0]=3 608 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 7a_100000211527_200025704644 [1,0,0,0,0,0|2,0,0]=3 609 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_100012353751_200025704644 [1,0,0,0,0,0|2,0,0]=3 610 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012353751 [1,0,0,0,0,0|2,0,0]=3 611 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_100000210833_200025704644 [1,0,0,0,0,0|2,0,0]=3 612 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000210833 [1,0,0,0,0,0|2,0,0]=3 613 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_100012356289_200025704644 [1,0,0,0,0,0|2,0,0]=3 614 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100012356289 [1,0,0,0,0,0|2,0,0]=3 615 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_100000736223_200025704644 [1,0,0,0,0,0|2,0,0]=3 616 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000736223 [1,0,0,0,0,0|2,0,0]=3 617 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_100011356834_200025704644 [1,0,0,0,0,0|2,0,0]=3 618 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_200025704644_100011356834 [1,0,0,0,0,0|2,0,0]=3 619 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [1,0,0,0,0,0|1,0,0]=2 620 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [1,0,0,0,0,0|1,0,0]=2 621 B10R1.30 Cc1ccc(c(n1)C#N)O 271570a_203496583355_100009878477 [1,0,0,0,0,0|2,0,1]=4 622 B10R1.30 Cc1ccc(c(n1)C=O)O 271570a_203496583355_100010173661 [1,0,0,0,0,0|1,0,0]=2 623 B10R1.30 Cc1ccc(c(n1)CO)O 271570a_203496583355_100010074375 [1,0,0,0,0,0|1,0,2]=4 624 B10R1.30 Cc1ccc(c(n1)O[13CH3])Br 34a_100009817604_200025704644 [1,0,0,0,0,0|3,0,0]=4 625 B10R1.30 Cc1ccc(c(n1)O[13CH3])N 34a_100000687486_200025704644 [1,0,0,0,0,0|3,0,0]=4 626 B10R1.30 Cc1ccc(c(n1)S[13CH3])C 62a_100009854376_200025704644 [1,0,0,0,0,0|3,0,0]=4 627 B10R1.30 Cc1ccc(c(n1)S[13CH3])C 62a_200025704644_100009854376 [1,0,0,0,0,0|3,0,0]=4 628 B10R1.30 Cc1ccc(c(n1)S[13CH3])F 62a_100009817602_200025704644 [1,0,0,0,0,0|3,0,0]=4 629 B10R1.30 Cc1ccc(c(n1)S[13CH3])F 62a_200025704644_100009817602 [1,0,0,0,0,0|3,0,0]=4 630 B10R1.30 Cc1ccc(c(n1)S[13CH3])N 62a_100000685570_200025704644 [1,0,0,0,0,0|3,0,0]=4 631 B10R1.30 Cc1ccc(c(n1)S[13CH3])N 62a_200025704644_100000685570 [1,0,0,0,0,0|3,0,0]=4 632 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_100000702858_200025704644 [1,0,0,0,0,0|2,0,0]=3 633 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_200025704644_100000702858 [1,0,0,0,0,0|2,0,0]=3 634 B10R1.30 Cc1ccc(cc1C=O)O 271570a_203496583355_100011361606 [1,0,0,0,0,0|2,0,0]=3 635 B10R1.30 Cc1ccc(cc1N[13CH3])Br 34a_100000741167_200025704644 [1,0,0,0,0,0|3,0,0]=4 636 B10R1.30 Cc1ccc(cc1N[13CH3])Br 7a_100000741167_200025704644 [1,0,0,0,0,0|3,0,0]=4 637 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 34a_100000211374_200025704644 [1,0,0,0,0,0|3,0,0]=4 638 B10R1.30 Cc1ccc(cc1N[13CH3])Cl 7a_100000211374_200025704644 [1,0,0,0,0,0|3,0,0]=4 639 B10R1.30 Cc1ccc(cc1N[13CH3])F 34a_100000211107_200025704644 [1,0,0,0,0,0|3,0,0]=4 640 B10R1.30 Cc1ccc(cc1N[13CH3])F 7a_100000211107_200025704644 [1,0,0,0,0,0|3,0,0]=4 641 B10R1.30 Cc1ccc(cc1N[13CH3])I 7a_100000761890_200025704644 [1,0,0,0,0,0|3,0,0]=4 642 B10R1.30 Cc1ccc(cc1N[13CH3])O 34a_100011216113_200025704644 [1,0,0,0,0,0|3,0,0]=4 643 B10R1.30 Cc1ccc(cc1O[13CH3])Br 34a_100000685420_200025704644 [1,0,0,0,0,0|3,0,0]=4 644 B10R1.30 Cc1ccc(cc1O[13CH3])Br 7a_100000685420_200025704644 [1,0,0,0,0,0|3,0,0]=4 645 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 34a_100000756515_200025704644 [1,0,0,0,0,0|3,0,0]=4 646 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 7a_100000756515_200025704644 [1,0,0,0,0,0|3,0,0]=4 647 B10R1.30 Cc1ccc(cc1O[13CH3])F 34a_100000690566_200025704644 [1,0,0,0,0,0|3,0,0]=4 648 B10R1.30 Cc1ccc(cc1O[13CH3])F 7a_100000690566_200025704644 [1,0,0,0,0,0|3,0,0]=4 649 B10R1.30 Cc1ccc(cc1O[13CH3])I 7a_100000766334_200025704644 [1,0,0,0,0,0|3,0,0]=4 650 B10R1.30 Cc1ccc(cc1O[13CH3])N 34a_100000759471_200025704644 [1,0,0,0,0,0|3,0,0]=4 651 B10R1.30 Cc1ccc(cc1O[13CH3])N 7a_100000759471_200025704644 [1,0,0,0,0,0|3,0,0]=4 652 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_100011344865_200025704644 [1,0,0,0,0,0|3,0,0]=4 653 B10R1.30 Cc1ccc(cc1S[13CH3])Br 62a_200025704644_100011344865 [1,0,0,0,0,0|3,0,0]=4 654 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_100011263213_200025704644 [1,0,0,0,0,0|3,0,0]=4 655 B10R1.30 Cc1ccc(cc1S[13CH3])Cl 62a_200025704644_100011263213 [1,0,0,0,0,0|3,0,0]=4 656 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_100011218078_200025704644 [1,0,0,0,0,0|3,0,0]=4 657 B10R1.30 Cc1ccc(cc1S[13CH3])F 62a_200025704644_100011218078 [1,0,0,0,0,0|3,0,0]=4 658 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_100000736455_200025704644 [1,0,0,0,0,0|3,0,0]=4 659 B10R1.30 Cc1ccc(cc1S[13CH3])N 62a_200025704644_100000736455 [1,0,0,0,0,0|3,0,0]=4 660 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_100011380479_200025704644 [1,0,0,0,0,0|3,0,0]=4 661 B10R1.30 Cc1ccc(cc1S[13CH3])O 62a_200025704644_100011380479 [1,0,0,0,0,0|3,0,0]=4 662 B10R1.30 Cc1cnc(c(c1)C#N)O 271570a_203496583355_100012662280 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [1,0,0,0,0,0|1,0,0]=2 664 B10R1.30 Cc1cnc(c(c1)CO)O 271570a_203496583355_100000118064 [1,0,0,0,0,0|1,0,2]=4 665 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 34a_100012000487_200025704644 [1,0,0,0,0,0|3,0,0]=4 666 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 7a_100012000487_200025704644 [1,0,0,0,0,0|3,0,0]=4 667 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 34a_100009849810_200025704644 [1,0,0,0,0,0|3,0,0]=4 668 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 7a_100009849810_200025704644 [1,0,0,0,0,0|3,0,0]=4 669 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_100009817436_200025704644 [1,0,0,0,0,0|3,0,0]=4 670 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_200025704644_100009817436 [1,0,0,0,0,0|3,0,0]=4 671 B10R1.30 Cc1cnc(c(c1)S[13CH3])Cl 62a_100010210167_200025704644 [1,0,0,0,0,0|3,0,0]=4 672 B10R1.30 Cc1cnc(c(c1)S[13CH3])Cl 62a_200025704644_100010210167 [1,0,0,0,0,0|3,0,0]=4 673 B10R1.30 Cc1cnc(c(c1)S[13CH3])F 62a_100000049784_200025704644 [1,0,0,0,0,0|3,0,0]=4 674 B10R1.30 Cc1cnc(c(c1)S[13CH3])F 62a_200025704644_100000049784 [1,0,0,0,0,0|3,0,0]=4 675 B10R1.30 Cc1cnc(c(c1)S[13CH3])N 62a_100000049664_200025704644 [1,0,0,0,0,0|3,0,0]=4 676 B10R1.30 Cc1cnc(c(c1)S[13CH3])N 62a_200025704644_100000049664 [1,0,0,0,0,0|3,0,0]=4 677 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_100000719714_200025704644 [1,0,0,0,0,0|2,0,0]=3 678 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_200025704644_100000719714 [1,0,0,0,0,0|2,0,0]=3 679 B10R1.30 Cn1ccc(=O)c(c1)S[13CH3] 62a_100010750718_200025704644 [1,0,0,0,0,0|2,0,1]=4 680 B10R1.30 Cn1ccc(=O)c(c1)S[13CH3] 62a_200025704644_100010750718 [1,0,0,0,0,0|2,0,1]=4 681 B10R1.30 N#Cc1cc(ccc1O)Br 271570a_203496583355_100011219714 [1,0,0,0,0,0|2,0,1]=4 682 B10R1.30 N#Cc1cc(ccc1O)Cl 271570a_203496583355_200011356825 [1,0,0,0,0,0|2,0,1]=4 683 B10R1.30 N#Cc1cc(ccc1O)F 271570a_203496583355_100000747550 [1,0,0,0,0,0|2,0,1]=4 684 B10R1.30 N#Cc1cc(ccc1O)N 271570a_203496583355_100011934039 [1,0,0,0,0,0|2,0,1]=4 685 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100000687585 [1,0,0,0,0,0|2,0,1]=4 686 B10R1.30 N#Cc1cc(ccc1O)O 271570a_203496583355_100009818209 [1,0,0,0,0,0|2,0,1]=4 687 B10R1.30 NCc1cc(ccc1O)F 271570a_203496583355_100000742738 [1,0,0,0,0,0|2,0,1]=4 688 B10R1.30 NCc1cc(ccc1O)O 271570a_203496583355_100000730032 [1,0,0,0,0,0|2,0,1]=4 689 B10R1.30 NNc1cc(ccc1O)F 271570a_203496583355_100012362518 [1,0,0,0,0,0|3,0,0]=4 690 B10R1.30 Nc1ccc(c(c1)CO)O 271570a_203496583355_100012347228 [1,0,0,0,0,0|1,0,2]=4 691 B10R1.30 Nc1ccc(cc1C=O)O 271570a_203496583355_100011935258 [1,0,0,0,0,0|2,0,0]=3 692 B10R1.30 Nc1ncc(cc1C=O)O 271570a_203496583355_100009814808 [1,0,0,0,0,0|3,0,0]=4 693 B10R1.30 O=Cc1cc(ccc1Br)O 271570a_203496583355_100010185652 [1,0,0,0,0,0|2,0,0]=3 694 B10R1.30 O=Cc1cc(ccc1Cl)O 271570a_203496583355_100010254384 [1,0,0,0,0,0|2,0,0]=3 695 B10R1.30 O=Cc1cc(ccc1F)O 271570a_203496583355_100000211465 [1,0,0,0,0,0|2,0,0]=3 696 B10R1.30 O=Cc1cc(ccc1O)Br 271570a_203496583355_100010185651 [1,0,0,0,0,0|1,0,0]=2 697 B10R1.30 O=Cc1cc(ccc1O)Cl 271570a_203496583355_100010254386 [1,0,0,0,0,0|1,0,0]=2 698 B10R1.30 O=Cc1cc(ccc1O)F 271570a_203496583355_100011218309 [1,0,0,0,0,0|1,0,0]=2 699 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000186750 [1,0,0,0,0,0|1,0,0]=2 700 B10R1.30 O=Cc1cc(ccc1O)O 271570a_203496583355_100000690577 [1,0,0,0,0,0|1,0,0]=2 701 B10R1.30 O=Cc1cc(cnc1F)O 271570a_203496583355_100009814789 [1,0,0,0,0,0|3,0,0]=4 702 B10R1.30 O=Cc1cc(cnc1O)F 271570a_203496583355_100000079965 [1,0,0,0,0,0|2,0,0]=3 703 B10R1.30 O=Cc1cc(ncc1F)O 271570a_203496583355_100000707870 [1,0,0,0,0,0|3,0,0]=4 704 B10R1.30 O=Cc1nc(ccc1F)O 271570a_203496583355_100009814804 [1,0,0,0,0,0|3,0,0]=4 705 B10R1.30 OCc1cc(ccc1O)Br 271570a_203496583355_100011356890 [1,0,0,0,0,0|1,0,2]=4 706 B10R1.30 OCc1cc(ccc1O)F 271570a_203496583355_100011217561 [1,0,0,0,0,0|1,0,2]=4 707 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100000184703 [1,0,0,0,0,0|1,0,2]=4 708 B10R1.30 OCc1cc(ccc1O)O 271570a_203496583355_100012351483 [1,0,0,0,0,0|1,0,2]=4 709 B10R1.30 [13CH3]Nc1cc(ccc1Br)Br 34a_100000737762_200025704644 [1,0,0,0,0,0|3,0,0]=4 710 B10R1.30 [13CH3]Nc1cc(ccc1Br)Cl 34a_100000687073_200025704644 [1,0,0,0,0,0|3,0,0]=4 711 B10R1.30 [13CH3]Nc1cc(ccc1Br)F 34a_100000687223_200025704644 [1,0,0,0,0,0|3,0,0]=4 712 B10R1.30 [13CH3]Nc1cc(ccc1Br)O 34a_100011999798_200025704644 [1,0,0,0,0,0|3,0,0]=4 713 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Br 34a_100000750497_200025704644 [1,0,0,0,0,0|3,0,0]=4 714 B10R1.30 [13CH3]Nc1cc(ccc1Cl)Cl 34a_100000184485_200025704644 [1,0,0,0,0,0|3,0,0]=4 715 B10R1.30 [13CH3]Nc1cc(ccc1Cl)F 34a_100000751338_200025704644 [1,0,0,0,0,0|3,0,0]=4 716 B10R1.30 [13CH3]Nc1cc(ccc1Cl)I 34a_200000761891_200025704644 [1,0,0,0,0,0|3,0,0]=4 717 B10R1.30 [13CH3]Nc1cc(ccc1Cl)O 34a_100011934297_200025704644 [1,0,0,0,0,0|3,0,0]=4 718 B10R1.30 [13CH3]Nc1cc(ccc1F)Br 34a_100000740924_200025704644 [1,0,0,0,0,0|3,0,0]=4 719 B10R1.30 [13CH3]Nc1cc(ccc1F)Cl 34a_100000212115_200025704644 [1,0,0,0,0,0|3,0,0]=4 720 B10R1.30 [13CH3]Nc1cc(ccc1F)F 34a_100000210742_200025704644 [1,0,0,0,0,0|3,0,0]=4 721 B10R1.30 [13CH3]Nc1cc(ccc1F)I 34a_100011464823_200025704644 [1,0,0,0,0,0|3,0,0]=4 722 B10R1.30 [13CH3]Nc1cc(ccc1F)O 34a_100012017239_200025704644 [1,0,0,0,0,0|3,0,0]=4 723 B10R1.30 [13CH3]Nc1cc(ccc1I)Br 34a_100000743836_200025704644 [1,0,0,0,0,0|3,0,0]=4 724 B10R1.30 [13CH3]Nc1cc(ccc1I)Cl 34a_100000761886_200025704644 [1,0,0,0,0,0|3,0,0]=4 725 B10R1.30 [13CH3]Nc1cc(ccc1I)F 34a_100011218093_200025704644 [1,0,0,0,0,0|3,0,0]=4 726 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [1,0,0,0,0,0|2,0,0]=3 728 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [1,0,0,0,0,0|2,0,0]=3 729 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 34a_100011220040_200025704644 [1,0,0,0,0,0|3,0,0]=4 730 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 7a_100011220040_200025704644 [1,0,0,0,0,0|3,0,0]=4 731 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 34a_100012339455_200025704644 [1,0,0,0,0,0|3,0,0]=4 732 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 7a_100012339455_200025704644 [1,0,0,0,0,0|3,0,0]=4 733 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 34a_100000690578_200025704644 [1,0,0,0,0,0|3,0,0]=4 734 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 7a_100000690578_200025704644 [1,0,0,0,0,0|3,0,0]=4 735 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 34a_100012356990_200025704644 [1,0,0,0,0,0|3,0,0]=4 736 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 7a_100012356990_200025704644 [1,0,0,0,0,0|3,0,0]=4 737 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 34a_100000738945_200025704644 [1,0,0,0,0,0|3,0,0]=4 738 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 7a_100000738945_200025704644 [1,0,0,0,0,0|3,0,0]=4 739 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 34a_100000211422_200025704644 [1,0,0,0,0,0|3,0,0]=4 740 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 7a_100000211422_200025704644 [1,0,0,0,0,0|3,0,0]=4 741 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 34a_100000692107_200025704644 [1,0,0,0,0,0|3,0,0]=4 742 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 7a_100000692107_200025704644 [1,0,0,0,0,0|3,0,0]=4 743 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 34a_100011356854_200025704644 [1,0,0,0,0,0|3,0,0]=4 744 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 7a_100011356854_200025704644 [1,0,0,0,0,0|3,0,0]=4 745 B10R1.30 [13CH3]Oc1cc(ccc1Cl)N 34a_100011934209_200025704644 [1,0,0,0,0,0|3,0,0]=4 746 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 34a_100000686035_200025704644 [1,0,0,0,0,0|3,0,0]=4 747 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 7a_100000686035_200025704644 [1,0,0,0,0,0|3,0,0]=4 748 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 34a_100000757397_200025704644 [1,0,0,0,0,0|3,0,0]=4 749 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 7a_100000757397_200025704644 [1,0,0,0,0,0|3,0,0]=4 750 B10R1.30 [13CH3]Oc1cc(ccc1F)F 34a_100000752141_200025704644 [1,0,0,0,0,0|3,0,0]=4 751 B10R1.30 [13CH3]Oc1cc(ccc1F)F 7a_100000752141_200025704644 [1,0,0,0,0,0|3,0,0]=4 752 B10R1.30 [13CH3]Oc1cc(ccc1F)I 34a_100009958187_200025704644 [1,0,0,0,0,0|3,0,0]=4 753 B10R1.30 [13CH3]Oc1cc(ccc1F)I 7a_100009958187_200025704644 [1,0,0,0,0,0|3,0,0]=4 754 B10R1.30 [13CH3]Oc1cc(ccc1F)N 34a_100012017398_200025704644 [1,0,0,0,0,0|3,0,0]=4 755 B10R1.30 [13CH3]Oc1cc(ccc1F)N 7a_100012017398_200025704644 [1,0,0,0,0,0|3,0,0]=4 756 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 34a_100012344904_200025704644 [1,0,0,0,0,0|3,0,0]=4 757 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 7a_100012344904_200025704644 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 34a_100000050036_200025704644 [1,0,0,0,0,0|3,0,0]=4 759 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 7a_100000050036_200025704644 [1,0,0,0,0,0|3,0,0]=4 760 B10R1.30 [13CH3]Oc1cc(ccc1I)F 34a_100010084537_200025704644 [1,0,0,0,0,0|3,0,0]=4 761 B10R1.30 [13CH3]Oc1cc(ccc1I)F 7a_100010084537_200025704644 [1,0,0,0,0,0|3,0,0]=4 762 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 34a_100000739049_200025704644 [1,0,0,0,0,0|3,0,0]=4 763 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 7a_100000739049_200025704644 [1,0,0,0,0,0|3,0,0]=4 764 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 34a_100000185728_200025704644 [1,0,0,0,0,0|3,0,0]=4 765 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 7a_100000185728_200025704644 [1,0,0,0,0,0|3,0,0]=4 766 B10R1.30 [13CH3]Oc1cc(ccc1N)F 34a_100000753323_200025704644 [1,0,0,0,0,0|3,0,0]=4 767 B10R1.30 [13CH3]Oc1cc(ccc1N)F 7a_100000753323_200025704644 [1,0,0,0,0,0|3,0,0]=4 768 B10R1.30 [13CH3]Oc1cc(ccc1N)I 34a_100000057187_200025704644 [1,0,0,0,0,0|3,0,0]=4 769 B10R1.30 [13CH3]Oc1cc(ccc1N)I 7a_100000057187_200025704644 [1,0,0,0,0,0|3,0,0]=4 770 B10R1.30 [13CH3]Oc1cc(ccc1N)N 34a_100025717382_200025704644 [1,0,0,0,0,0|3,0,0]=4 771 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_100011483371_200025704644 [1,0,0,0,0,0|3,0,0]=4 772 B10R1.30 [13CH3]Sc1cc(ccc1Br)Br 62a_200025704644_100011483371 [1,0,0,0,0,0|3,0,0]=4 773 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_100012339723_200025704644 [1,0,0,0,0,0|3,0,0]=4 774 B10R1.30 [13CH3]Sc1cc(ccc1Br)Cl 62a_200025704644_100012339723 [1,0,0,0,0,0|3,0,0]=4 775 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_100011217576_200025704644 [1,0,0,0,0,0|3,0,0]=4 776 B10R1.30 [13CH3]Sc1cc(ccc1Br)F 62a_200025704644_100011217576 [1,0,0,0,0,0|3,0,0]=4 777 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_100000750459_200025704644 [1,0,0,0,0,0|3,0,0]=4 778 B10R1.30 [13CH3]Sc1cc(ccc1Br)N 62a_200025704644_100000750459 [1,0,0,0,0,0|3,0,0]=4 779 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_100012339312_200025704644 [1,0,0,0,0,0|3,0,0]=4 780 B10R1.30 [13CH3]Sc1cc(ccc1Br)O 62a_200025704644_100012339312 [1,0,0,0,0,0|3,0,0]=4 781 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_100011772130_200025704644 [1,0,0,0,0,0|3,0,0]=4 782 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Br 62a_200025704644_100011772130 [1,0,0,0,0,0|3,0,0]=4 783 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_100000707729_200025704644 [1,0,0,0,0,0|3,0,0]=4 784 B10R1.30 [13CH3]Sc1cc(ccc1Cl)Cl 62a_200025704644_100000707729 [1,0,0,0,0,0|3,0,0]=4 785 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_100011217299_200025704644 [1,0,0,0,0,0|3,0,0]=4 786 B10R1.30 [13CH3]Sc1cc(ccc1Cl)F 62a_200025704644_100011217299 [1,0,0,0,0,0|3,0,0]=4 787 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_100012360549_200025704644 [1,0,0,0,0,0|3,0,0]=4 788 B10R1.30 [13CH3]Sc1cc(ccc1Cl)N 62a_200025704644_100012360549 [1,0,0,0,0,0|3,0,0]=4 789 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_100000049588_200025704644 [1,0,0,0,0,0|3,0,0]=4 790 B10R1.30 [13CH3]Sc1cc(ccc1Cl)O 62a_200025704644_100000049588 [1,0,0,0,0,0|3,0,0]=4 791 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_100011217312_200025704644 [1,0,0,0,0,0|3,0,0]=4 792 B10R1.30 [13CH3]Sc1cc(ccc1F)Br 62a_200025704644_100011217312 [1,0,0,0,0,0|3,0,0]=4 793 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_100011218116_200025704644 [1,0,0,0,0,0|3,0,0]=4 794 B10R1.30 [13CH3]Sc1cc(ccc1F)Cl 62a_200025704644_100011218116 [1,0,0,0,0,0|3,0,0]=4 795 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_100011219198_200025704644 [1,0,0,0,0,0|3,0,0]=4 796 B10R1.30 [13CH3]Sc1cc(ccc1F)F 62a_200025704644_100011219198 [1,0,0,0,0,0|3,0,0]=4 797 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_100000760356_200025704644 [1,0,0,0,0,0|3,0,0]=4 798 B10R1.30 [13CH3]Sc1cc(ccc1F)N 62a_200025704644_100000760356 [1,0,0,0,0,0|3,0,0]=4 799 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_100000693481_200025704644 [1,0,0,0,0,0|3,0,0]=4 800 B10R1.30 [13CH3]Sc1cc(ccc1F)O 62a_200025704644_100000693481 [1,0,0,0,0,0|3,0,0]=4 801 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_100000187925_200025704644 [1,0,0,0,0,0|3,0,0]=4 802 B10R1.30 [13CH3]Sc1cc(ccc1N)Br 62a_200025704644_100000187925 [1,0,0,0,0,0|3,0,0]=4 803 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_100000761889_200025704644 [1,0,0,0,0,0|3,0,0]=4 804 B10R1.30 [13CH3]Sc1cc(ccc1N)Cl 62a_200025704644_100000761889 [1,0,0,0,0,0|3,0,0]=4 805 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_100000760547_200025704644 [1,0,0,0,0,0|3,0,0]=4 806 B10R1.30 [13CH3]Sc1cc(ccc1N)F 62a_200025704644_100000760547 [1,0,0,0,0,0|3,0,0]=4 807 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_100011534242_200025704644 [1,0,0,0,0,0|3,0,0]=4 808 B10R1.30 [13CH3]Sc1cc(ccc1N)N 62a_200025704644_100011534242 [1,0,0,0,0,0|3,0,0]=4 809 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_100012001276_200025704644 [1,0,0,0,0,0|3,0,0]=4 810 B10R1.30 [13CH3]Sc1cc(ccc1N)O 62a_200025704644_100012001276 [1,0,0,0,0,0|3,0,0]=4 811 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [1,0,0,0,0,0|2,0,0]=3 812 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [1,0,0,0,0,0|2,0,0]=3 813 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [1,0,0,0,0,0|2,0,0]=3 814 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [1,0,0,0,0,0|2,0,0]=3 815 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [1,0,0,0,0,0|2,0,0]=3 816 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [1,0,0,0,0,0|2,0,0]=3 817 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [1,0,0,0,0,0|2,0,0]=3 818 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [1,0,0,0,0,0|2,0,0]=3 819 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [1,0,0,0,0,0|2,0,0]=3 820 B10R1.30 [13CH3]Sc1cc(cnc1O)Br 62a_100010197142_200025704644 [1,0,0,0,0,0|3,0,0]=4 821 B10R1.30 [13CH3]Sc1cc(cnc1O)Br 62a_200025704644_100010197142 [1,0,0,0,0,0|3,0,0]=4 822 B10R1.30 [13CH3]Sc1cc(cnc1O)Cl 62a_100010188700_200025704644 [1,0,0,0,0,0|3,0,0]=4 823 B10R1.30 [13CH3]Sc1cc(cnc1O)Cl 62a_200025704644_100010188700 [1,0,0,0,0,0|3,0,0]=4 824 B10R1.30 [13CH3]Sc1cc(ncc1O)Cl 62a_100000698892_200025704644 [1,0,0,0,0,0|3,0,0]=4 825 B10R1.30 [13CH3]Sc1cc(ncc1O)Cl 62a_200025704644_100000698892 [1,0,0,0,0,0|3,0,0]=4 826 B10R1.30 [13CH3]Sc1nc(ccc1O)Br 62a_100010253912_200025704644 [1,0,0,0,0,0|3,0,0]=4 827 B10R1.30 [13CH3]Sc1nc(ccc1O)Br 62a_200025704644_100010253912 [1,0,0,0,0,0|3,0,0]=4 828 B10R1.30 [13CH3]Sc1nc(ccc1O)Cl 62a_200025704644_100000696390 [1,0,0,0,0,0|3,0,0]=4 829 B10R1.30 [13CH3]Sc1nc(ccc1O)F 62a_100010382442_200025704644 [1,0,0,0,0,0|3,0,0]=4 830 B10R1.30 [13CH3]Sc1nc(ccc1O)F 62a_200025704644_100010382442 [1,0,0,0,0,0|3,0,0]=4 831 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [1,0,0,0,0,0|2,0,1]=4 832 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [1,0,0,0,0,0|2,1,0]=4 833 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [1,0,0,0,0,0|2,0,1]=4 834 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [1,0,0,0,0,0|3,0,0]=4 835 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [1,0,0,0,0,0|2,0,1]=4 836 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,0,0,0,0,0|2,0,0]=3 837 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,0,0,0,0,0|2,0,0]=3 838 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,0,0,0,0,0|2,0,0]=3 839 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,0,0,0,0,0|2,0,0]=3 840 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,0,0,0,0,0|2,0,0]=3 841 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,0,0,0,0,0|1,0,0]=2 842 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,0,0,0,0,0|3,0,0]=4 843 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,0,0,0,0,0|3,0,0]=4 844 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,0,0,0,0,0|3,0,0]=4 845 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,0,0,0,0,0|3,0,0]=4 846 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,0,0,0,0,0|3,0,0]=4 847 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [1,0,0,0,0,0|3,0,0]=4 848 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [1,0,0,0,0,0|3,0,0]=4 849 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [1,0,0,0,0,0|3,0,0]=4 850 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [1,0,0,0,0,0|3,0,0]=4 851 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,0,0,0,0,0|3,0,0]=4 852 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,0,0,0,0,0|2,0,0]=3 853 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [1,0,0,0,0,0|3,0,0]=4 854 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [1,0,0,0,0,0|3,0,0]=4 855 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [1,0,0,0,0,0|3,0,0]=4 856 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [1,0,0,0,0,0|3,0,0]=4 857 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,0,0,0,0,0|3,0,0]=4 858 B10R1.61 C=C(C)c1cncnc1O 271570a_100000694244_100000751107 [1,0,0,0,0,0|3,0,0]=4 859 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,0,0,0,0,0|3,0,0]=4 860 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,0,0,0,0,0|3,0,0]=4 861 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,0,0,0,0,0|3,0,0]=4 862 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,0,0,0,0,0|3,0,0]=4 863 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,0,0,0,0,0|3,0,0]=4 864 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,0,0,0,0,0|2,0,0]=3 865 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,0,0,0,0,0|1,0,0]=2 866 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,0,0,0,0,0|1,0,0]=2 867 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,0,0,0,0,0|1,0,0]=2 868 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,0,0,0,0,0|1,0,0]=2 869 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,0,0,0,0,0|1,0,0]=2 870 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,0,0,0,0,0|0,0,0]=1 871 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,0,0,0,0,0|0,0,0]=1 872 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,0,0,0,0,0|0,0,1]=2 873 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,0,0,0,0,0|1,0,0]=2 874 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,0,0,0,0,0|1,0,0]=2 875 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,0,0,0,0,0|1,0,0]=2 876 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,0,0,0,0,0|1,0,0]=2 877 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,0,0,0,0,0|2,0,0]=3 878 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,0,0,0,0,0|1,0,1]=3 879 B10R1.61 CC(C)c1cccnc1O 271570a_203496583355_200010382935 [1,0,0,0,0,0|2,0,1]=4 880 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,0,0,0,0,0|1,0,1]=3 881 B10R1.61 CC(N)c1ncccc1O 271570a_203496583355_100159271932 [1,0,0,0,0,0|2,0,1]=4 882 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,0,0,0,0,0|0,0,2]=3 883 B10R1.61 CC(O)c1cccnc1O 271570a_203496583355_100009865335 [1,0,0,0,0,0|1,0,2]=4 884 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,0,0,0,0,0|3,0,0]=4 885 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,0,0,0,0,0|3,0,0]=4 886 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,0,0,0,0,0|3,0,0]=4 887 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,0,0,0,0,0|3,0,0]=4 888 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,0,0,0,0,0|3,0,0]=4 889 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,0,0,0,0,0|3,0,0]=4 890 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,0,0,0,0,0|3,0,0]=4 891 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,0,0,0,0,0|3,0,0]=4 892 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,0,0,0,0,0|3,0,0]=4 893 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,0,0,0,0,0|3,0,0]=4 894 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,0,0,0,0,0|2,0,0]=3 895 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,0,0,0,0,0|2,0,0]=3 896 B10R1.61 CN(C)c1ccncc1O 271570a_203496583355_100012355995 [1,0,0,0,0,0|3,0,0]=4 897 B10R1.61 CN(C)c1ncccc1O 271570a_203496583355_100011465059 [1,0,0,0,0,0|3,0,0]=4 898 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,0,0,0,0,0|3,0,0]=4 899 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,0,0,0,0,0|3,0,0]=4 900 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,0,0,0,0,0|3,0,0]=4 901 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,0,0,0,0,0|3,0,0]=4 902 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,0,0,0,0,0|3,0,0]=4 903 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,0,0,0,0,0|3,0,0]=4 904 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,0,0,0,0,0|3,0,0]=4 905 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,0,0,0,0,0|3,0,0]=4 906 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,0,0,0,0,0|3,0,0]=4 907 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,0,0,0,0,0|3,0,0]=4 908 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,0,0,0,0,0|2,0,0]=3 909 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,0,0,0,0,0|1,0,0]=2 910 B10R1.61 C[C@H](O)c1ncccc1O 271570a_203496583355_100013325542 [1,0,0,0,0,0|1,0,2]=4 911 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,0,0,0,0,0|1,0,0]=2 912 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,0,0,0,0,0|3,0,0]=4 913 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,0,0,0,0,0|3,0,0]=4 914 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,0,0,0,0,0|3,0,0]=4 915 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,0,0,0,0,0|3,0,0]=4 916 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,0,0,0,0,0|3,0,0]=4 917 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,0,0,0,0,0|3,0,0]=4 918 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,0,0,0,0,0|1,0,0]=2 919 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,0,0,0,0,0|2,0,0]=3 920 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,0,0,0,0,0|2,0,0]=3 921 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,0,0,0,0,0|2,0,0]=3 922 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,0,0,0,0,0|2,0,0]=3 923 B10R1.61 NC(=O)c1nccnc1O 271570a_203496583355_100000094861 [1,0,0,0,0,0|3,0,0]=4 924 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [1,0,0,0,0,0|2,0,1]=4 925 B10R1.61 Oc1ccccc1C(F)F 271570a_203496583355_100010169824 [1,0,0,0,0,0|2,0,1]=4 926 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,0,0,0,0,0|1,0,0]=2 927 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,0,0,0,0,0|1,0,0]=2 928 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,0,0,0,0,0|1,0,0]=2 929 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,0,0,0,0,0|1,0,0]=2 930 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,0,0,0,0,0|0,0,0]=1 931 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,0,0,0,0,0|0,0,1]=2 932 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [1,0,0,0,0,0|2,0,0]=3 933 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [1,0,0,0,0,0|3,0,0]=4 934 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [1,0,0,0,0,0|3,0,0]=4 935 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [1,0,0,0,0,0|3,0,0]=4 936 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [1,0,0,0,0,0|3,0,0]=4 937 B10R1.113 C=C(C)c1cc(cnn1)C 271570a_100000694244_100000070100 [1,0,0,0,0,0|3,0,0]=4 938 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [1,0,0,0,0,0|3,0,0]=4 939 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [1,0,0,0,0,0|3,0,0]=4 940 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [1,0,0,0,0,0|2,0,0]=3 941 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [1,0,0,0,0,0|3,0,0]=4 942 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [1,0,0,0,0,0|3,0,0]=4 943 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,0,0,0,0,0|2,0,0]=3 944 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,0,0,0,0,0|1,0,0]=2 945 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,0,0,0,0,0|2,0,0]=3 946 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,0,0,0,0,0|2,0,0]=3 947 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,0,0,0,0,0|2,0,0]=3 948 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,0,0,0,0,0|2,0,0]=3 949 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,0,0,0,0,0|2,0,0]=3 950 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,0,0,0,0,0|2,0,0]=3 951 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [1,0,0,0,0,0|3,0,0]=4 952 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [1,0,0,0,0,0|2,0,0]=3 953 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [1,0,0,0,0,0|3,0,0]=4 954 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [1,0,0,0,0,0|3,0,0]=4 955 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [1,0,0,0,0,0|3,0,0]=4 956 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [1,0,0,0,0,0|2,0,0]=3 957 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [1,0,0,0,0,0|3,0,0]=4 958 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [1,0,0,0,0,0|3,0,0]=4 959 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [1,0,0,0,0,0|3,0,0]=4 960 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [1,0,0,0,0,0|3,0,0]=4 961 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [1,0,0,0,0,0|3,0,0]=4 962 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [1,0,0,0,0,0|2,0,0]=3 963 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [1,0,0,0,0,0|3,0,0]=4 964 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [1,0,0,0,0,0|3,0,0]=4 965 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [1,0,0,0,0,0|3,0,0]=4 966 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [1,0,0,0,0,0|3,0,0]=4 967 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [1,0,0,0,0,0|3,0,0]=4 968 B10R1.113 C=C(C)c1cncc(n1)C 271570a_100000694244_100009842155 [1,0,0,0,0,0|3,0,0]=4 969 B10R1.113 C=C(C)c1nccc(n1)C 271570a_100000694244_100011243806 [1,0,0,0,0,0|3,0,0]=4 970 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [1,0,0,0,0,0|2,0,0]=3 971 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,0,0,0,0,0|1,0,0]=2 972 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,0,0,0,0,0|0,0,0]=1 973 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,0,0,0,0,0|1,0,0]=2 974 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,0,0,0,0,0|1,0,0]=2 975 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,0,0,0,0,0|1,0,0]=2 976 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,0,0,0,0,0|1,0,0]=2 977 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,0,0,0,0,0|1,0,0]=2 978 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [1,0,0,0,0,0|2,0,0]=3 979 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,0,0,0,0,0|2,0,0]=3 980 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [1,0,0,0,0,0|3,0,0]=4 981 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [1,0,0,0,0,0|2,0,0]=3 982 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,0,0,0,0,0|2,0,1]=4 983 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,0,0,0,0,0|2,0,1]=4 984 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,0,0,0,0,0|1,0,2]=4 985 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 986 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 987 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [1,0,0,0,0,0|3,0,0]=4 988 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 989 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 990 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [1,0,0,0,0,0|3,0,0]=4 991 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 992 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 993 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [1,0,0,0,0,0|3,0,0]=4 994 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 995 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 996 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [1,0,0,0,0,0|3,0,0]=4 997 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 998 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 999 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,0,0,0,0,0|3,0,0]=4 1000 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,0,0,0,0,0|3,0,0]=4 1001 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 1002 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 1003 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [1,0,0,0,0,0|3,0,0]=4 1004 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 1005 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 1006 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [1,0,0,0,0,0|3,0,0]=4 1007 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 1008 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 1009 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [1,0,0,0,0,0|3,0,0]=4 1010 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 1011 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 1012 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [1,0,0,0,0,0|3,0,0]=4 1013 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 1014 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 1015 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,0,0,0,0,0|3,0,0]=4 1016 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,0,0,0,0,0|2,0,0]=3 1017 B10R1.113 Cc1cc(ccn1)N(C)C 27a_100102631434_100000758586 [1,0,0,0,0,0|3,0,0]=4 1018 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,0,0,0,0,0|0,0,0]=1 1019 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [1,0,0,0,0,0|2,0,0]=3 1020 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [1,0,0,0,0,0|2,0,0]=3 1021 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [1,0,0,0,0,0|2,0,0]=3 1022 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [1,0,0,0,0,0|2,0,0]=3 1023 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [1,0,0,0,0,0|2,0,0]=3 1024 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [1,0,0,0,0,0|2,0,0]=3 1025 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [1,0,0,0,0,0|3,0,0]=4 1026 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,0,0,0,0,0|2,0,0]=3 1027 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [1,0,0,0,0,0|3,0,0]=4 1028 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,0,0,0,0,0|3,0,0]=4 1029 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [1,0,0,0,0,0|3,0,0]=4 1030 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,0,0,0,0,0|1,0,0]=2 1031 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,0,0,0,0,0|1,0,0]=2 1032 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,0,0,0,0,0|1,0,0]=2 1033 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,0,0,0,0,0|1,0,0]=2 1034 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,0,0,0,0,0|1,0,0]=2 1035 B12R1.46 C=C(C)c1cc(=O)[nH]cc1OC 271570a_100000694244_100121573661 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.46 C=C(C)c1cc(ccc1C#N)Br 271570a_100000694244_100010214477 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.46 C=C(C)c1cc(ccc1C#N)C 271570a_100000694244_100000693804 [0,1,0,0,0,0|2,0,0]=3 1038 B12R1.46 C=C(C)c1cc(ccc1C#N)Cl 271570a_100000694244_100012355178 [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.46 C=C(C)c1cc(ccc1C#N)F 271570a_100000694244_100000747196 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.46 C=C(C)c1cc(ccc1C#N)N 271570a_100000694244_100000689153 [0,1,0,0,0,0|3,0,0]=4 1041 B12R1.46 C=C(C)c1cc(ccc1C#N)O 271570a_100000694244_100012184851 [0,1,0,0,0,0|3,0,0]=4 1042 B12R1.46 C=C(C)c1cc(ccc1C=O)Br 271570a_100000694244_100010146562 [0,1,0,0,0,0|2,0,1]=4 1043 B12R1.46 C=C(C)c1cc(ccc1C=O)C 271570a_100000694244_100000692596 [0,1,0,0,0,0|1,0,1]=3 1044 B12R1.46 C=C(C)c1cc(ccc1C=O)F 271570a_100000694244_100000752949 [0,1,0,0,0,0|2,0,1]=4 1045 B12R1.46 C=C(C)c1cc(ccc1C=O)O 271570a_100000694244_100011236494 [0,1,0,0,0,0|2,0,1]=4 1046 B12R1.46 C=C(C)c1cc(ccc1CN)F 271570a_100000694244_100000708791 [0,1,0,0,0,0|3,0,0]=4 1047 B12R1.46 C=C(C)c1cc(ccc1CO)Br 271570a_100000694244_100010146605 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.46 C=C(C)c1cc(ccc1CO)Cl 271570a_100000694244_100000722340 [0,1,0,0,0,0|2,0,0]=3 1049 B12R1.46 C=C(C)c1cc(ccc1CO)F 271570a_100000694244_100000744086 [0,1,0,0,0,0|2,0,0]=3 1050 B12R1.46 C=C(C)c1cc(ccc1CO)O 271570a_100000694244_100010146404 [0,1,0,0,0,0|2,0,0]=3 1051 B12R1.46 C=C(C)c1cc(ccc1NC)C 271570a_100000694244_100000221369 [0,1,0,0,0,0|2,0,0]=3 1052 B12R1.46 C=C(C)c1cc(ccc1NC)F 271570a_100000694244_100011246292 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.46 C=C(C)c1cc(ccc1NC)F 34a_100009961556_200000210301 [0,1,0,0,0,0|3,0,0]=4 1054 B12R1.46 C=C(C)c1cc(ccc1NN)C 271570a_100000694244_100016996181 [0,1,0,0,0,0|2,0,0]=3 1055 B12R1.46 C=C(C)c1cc(ccc1N[13CH3])F 34a_100009961556_200025704644 [0,1,0,0,0,0|3,0,0]=4 1056 B12R1.46 C=C(C)c1cc(ccc1OC)Br 271570a_100000694244_100012351588 [0,1,0,0,0,0|2,0,0]=3 1057 B12R1.46 C=C(C)c1cc(ccc1OC)C 271570a_100000694244_100000186399 [0,1,0,0,0,0|1,0,0]=2 1058 B12R1.46 C=C(C)c1cc(ccc1OC)Cl 271570a_100000694244_100011215930 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.46 C=C(C)c1cc(ccc1OC)F 271570a_100000694244_100000171694 [0,1,0,0,0,0|2,0,0]=3 1060 B12R1.46 C=C(C)c1cc(ccc1OC)N 271570a_100000694244_100000187427 [0,1,0,0,0,0|2,0,0]=3 1061 B12R1.46 C=C(C)c1cc(ccc1OC)O 271570a_100000694244_100010084122 [0,1,0,0,0,0|2,0,0]=3 1062 B12R1.46 C=C(C)c1cc(ccc1SC)C 271570a_100000694244_200010201864 [0,1,0,0,0,0|1,1,0]=3 1063 B12R1.46 C=C(C)c1cc(ccc1SC)F 271570a_100000694244_100009817003 [0,1,0,0,0,0|2,1,0]=4 1064 B12R1.46 C=C(C)c1cc(cnc1C#N)C 271570a_100000694244_100009874213 [0,1,0,0,0,0|3,0,0]=4 1065 B12R1.46 C=C(C)c1cc(cnc1NN)C 271570a_100000694244_100012357580 [0,1,0,0,0,0|3,0,0]=4 1066 B12R1.46 C=C(C)c1cc(cnc1OC)Br 271570a_100000694244_100009814608 [0,1,0,0,0,0|3,0,0]=4 1067 B12R1.46 C=C(C)c1cc(cnc1OC)C 271570a_100000694244_100012353929 [0,1,0,0,0,0|2,0,0]=3 1068 B12R1.46 C=C(C)c1cc(cnc1OC)F 271570a_100000694244_100009828472 [0,1,0,0,0,0|3,0,0]=4 1069 B12R1.46 C=C(C)c1cc(cnc1OC)N 271570a_100000694244_100012351452 [0,1,0,0,0,0|3,0,0]=4 1070 B12R1.46 C=C(C)c1cc(ncc1CC)C 271570a_100000694244_100010291839 [0,1,0,0,0,0|3,0,0]=4 1071 B12R1.46 C=C(C)c1cc(ncc1OC)C 271570a_100000694244_100010109759 [0,1,0,0,0,0|2,0,0]=3 1072 B12R1.46 C=C(C)c1nc(ccc1C#N)C 271570a_100000694244_100000741175 [0,1,0,0,0,0|3,0,0]=4 1073 B12R1.46 C=C(C)c1nc(ccc1C=O)C 271570a_100000694244_100000085379 [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.46 C=C(C)c1nc(ccc1CO)C 271570a_100000694244_102495338573 [0,1,0,0,0,0|2,0,0]=3 1075 B12R1.46 C=C(C)c1nc(ccc1OC)C 271570a_100000694244_100009820875 [0,1,0,0,0,0|2,0,0]=3 1076 B12R1.46 C=C(C)c1nc(ccc1OC)N 271570a_100000694244_100010172607 [0,1,0,0,0,0|3,0,0]=4 1077 B12R1.46 C=Cc1ccc(cc1C(=O)C)Br 271570a_100011290941_100012349576 [0,1,0,0,0,0|2,0,0]=3 1078 B12R1.46 C=Cc1ccc(cc1C(=O)C)C 271570a_100011290941_100012361225 [0,1,0,0,0,0|1,0,0]=2 1079 B12R1.46 C=Cc1ccc(cc1C(=O)C)F 271570a_100011290941_100012353695 [0,1,0,0,0,0|2,0,0]=3 1080 B12R1.46 C=Cc1ccc(cc1C(=O)C)N 271570a_100011290941_100012349454 [0,1,0,0,0,0|2,0,0]=3 1081 B12R1.46 C=Cc1ccc(cc1C(=O)N)Br 271570a_100011290941_200000162314 [0,1,0,0,0,0|3,0,0]=4 1082 B12R1.46 C=Cc1ccc(cc1C(=O)N)C 271570a_100011290941_200012349609 [0,1,0,0,0,0|2,0,0]=3 1083 B12R1.46 C=Cc1ccc(cc1C(=O)N)F 271570a_100011290941_100000206434 [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.46 C=Cc1ccc(cc1C(=O)N)N 271570a_100011290941_100015186447 [0,1,0,0,0,0|3,0,0]=4 1085 B12R1.46 C=Cc1ncc(cc1C(=O)C)F 271570a_100011290941_100000118324 [0,1,0,0,0,0|3,0,0]=4 1086 B12R1.46 CC(=O)c1cc(ccc1C#N)F 1458a_100011217471_200000210301 [0,1,0,0,0,0|2,0,0]=3 1087 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 34a_100000212127_200025704644 [0,1,0,0,0,0|1,0,0]=2 1088 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Br 7a_100000212127_200025704644 [0,1,0,0,0,0|1,0,0]=2 1089 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 34a_100000195442_200025704644 [0,1,0,0,0,0|0,0,0]=1 1090 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])C 7a_100000195442_200025704644 [0,1,0,0,0,0|0,0,0]=1 1091 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 34a_100000185566_200025704644 [0,1,0,0,0,0|1,0,0]=2 1092 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000185566_200025704644 [0,1,0,0,0,0|1,0,0]=2 1093 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])F 7a_100000182812_200025704644 [0,1,0,0,0,0|1,0,0]=2 1094 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])I 7a_100010712555_200025704644 [0,1,0,0,0,0|1,0,0]=2 1095 B12R1.46 CC(=O)c1cc(ccc1O[13CH3])N 34a_100011218865_200025704644 [0,1,0,0,0,0|1,0,0]=2 1096 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])Br 62a_100012349576_200025704644 [0,1,0,0,0,0|1,1,0]=3 1097 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])C 62a_100012361225_200025704644 [0,1,0,0,0,0|0,1,0]=2 1098 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])C 62a_200025704644_100012361225 [0,1,0,0,0,0|0,1,0]=2 1099 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])F 62a_100012353695_200025704644 [0,1,0,0,0,0|1,1,0]=3 1100 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_100010200798 [0,1,0,0,0,0|1,1,0]=3 1101 B12R1.46 CC(=O)c1cc(ccc1S[13CH3])N 62a_100012349454_200025704644 [0,1,0,0,0,0|1,1,0]=3 1102 B12R1.46 CC(=O)c1cc(cnc1S[13CH3])F 62a_100000118324_200025704644 [0,1,0,0,0,0|2,1,0]=4 1103 B12R1.46 CC(=O)c1cc(cnc1S[13CH3])F 62a_200025704644_100000118324 [0,1,0,0,0,0|2,1,0]=4 1104 B12R1.46 CC(C)c1cc(ccc1O[13CH3])Br 34a_100000691460_200025704644 [0,1,0,0,0,0|2,0,1]=4 1105 B12R1.46 CC(C)c1cc(ccc1O[13CH3])Br 7a_100000691460_200025704644 [0,1,0,0,0,0|2,0,1]=4 1106 B12R1.46 CC(O)c1cc(ccc1O[13CH3])F 34a_200011305312_200025704644 [0,1,0,0,0,0|1,0,2]=4 1107 B12R1.46 CC(O)c1cc(ccc1O[13CH3])F 7a_200011305312_200025704644 [0,1,0,0,0,0|1,0,2]=4 1108 B12R1.46 CCc1ccc(cc1C(=O)C)Br 1458a_100012343961_200000210301 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.46 CCc1ccc(cc1C(=O)[13CH3])Br 1458a_100012343961_200025704644 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.46 CNc1ccc(cc1C(=O)N)Br 27a_100102657272_200000162314 [0,1,0,0,0,0|3,0,0]=4 1111 B12R1.46 CNc1ccc(cc1C(=O)N)Br 34a_100000740421_200000210301 [0,1,0,0,0,0|3,0,0]=4 1112 B12R1.46 CNc1ccc(cc1C(=O)N)Br 7a_100000740421_200000210301 [0,1,0,0,0,0|3,0,0]=4 1113 B12R1.46 CNc1ccc(cc1C(=O)N)C 34a_100011692829_200000210301 [0,1,0,0,0,0|2,0,0]=3 1114 B12R1.46 CNc1ccc(cc1C(=O)N)Cl 34a_100000743835_200000210301 [0,1,0,0,0,0|3,0,0]=4 1115 B12R1.46 CNc1ccc(cc1C(=O)N)Cl 7a_100000743835_200000210301 [0,1,0,0,0,0|3,0,0]=4 1116 B12R1.46 CNc1ccc(cc1C(=O)N)F 34a_100000741173_200000210301 [0,1,0,0,0,0|3,0,0]=4 1117 B12R1.46 CNc1ccc(cc1C(=O)N)F 7a_100000741173_200000210301 [0,1,0,0,0,0|3,0,0]=4 1118 B12R1.46 CNc1ccc(cc1C(=O)N)O 271570a_203496583355_200010114593 [0,1,0,0,0,0|3,0,0]=4 1119 B12R1.46 COc1ccc(cc1C(=O)C)Br 1458a_100000188853_200000210301 [0,1,0,0,0,0|1,0,0]=2 1120 B12R1.46 COc1ccc(cc1C(=O)C)Br 34a_100000212127_200000210301 [0,1,0,0,0,0|1,0,0]=2 1121 B12R1.46 COc1ccc(cc1C(=O)C)Br 7a_100000212127_200000210301 [0,1,0,0,0,0|1,0,0]=2 1122 B12R1.46 COc1ccc(cc1C(=O)C)C 1458a_100000204667_200000210301 [0,1,0,0,0,0|0,0,0]=1 1123 B12R1.46 COc1ccc(cc1C(=O)C)C 34a_100000195442_200000210301 [0,1,0,0,0,0|0,0,0]=1 1124 B12R1.46 COc1ccc(cc1C(=O)C)C 7a_100000195442_200000210301 [0,1,0,0,0,0|0,0,0]=1 1125 B12R1.46 COc1ccc(cc1C(=O)C)Cl 1458a_100000211409_200000210301 [0,1,0,0,0,0|1,0,0]=2 1126 B12R1.46 COc1ccc(cc1C(=O)C)Cl 34a_100000185566_200000210301 [0,1,0,0,0,0|1,0,0]=2 1127 B12R1.46 COc1ccc(cc1C(=O)C)Cl 7a_100000185566_200000210301 [0,1,0,0,0,0|1,0,0]=2 1128 B12R1.46 COc1ccc(cc1C(=O)C)F 1458a_100000735445_200000210301 [0,1,0,0,0,0|1,0,0]=2 1129 B12R1.46 COc1ccc(cc1C(=O)C)F 7a_100000182812_200000210301 [0,1,0,0,0,0|1,0,0]=2 1130 B12R1.46 COc1ccc(cc1C(=O)C)I 1458a_100000230898_200000210301 [0,1,0,0,0,0|1,0,0]=2 1131 B12R1.46 COc1ccc(cc1C(=O)C)I 7a_100010712555_200000210301 [0,1,0,0,0,0|1,0,0]=2 1132 B12R1.46 COc1ccc(cc1C(=O)C)N 34a_100011218865_200000210301 [0,1,0,0,0,0|1,0,0]=2 1133 B12R1.46 COc1ccc(cc1C(=O)C)O 1458a_200000100057_200000210301 [0,1,0,0,0,0|1,0,0]=2 1134 B12R1.46 COc1ccc(cc1C(=O)C)O 271570a_203496583355_100000173343 [0,1,0,0,0,0|1,0,0]=2 1135 B12R1.46 COc1ccc(cc1C(=O)N)Br 34a_100000192807_200000210301 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.46 COc1ccc(cc1C(=O)N)Br 7a_100000192807_200000210301 [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.46 COc1ccc(cc1C(=O)N)C 34a_200000192840_200000210301 [0,1,0,0,0,0|1,0,0]=2 1138 B12R1.46 COc1ccc(cc1C(=O)N)C 7a_200000192840_200000210301 [0,1,0,0,0,0|1,0,0]=2 1139 B12R1.46 COc1ccc(cc1C(=O)N)Cl 34a_100000185026_200000210301 [0,1,0,0,0,0|2,0,0]=3 1140 B12R1.46 COc1ccc(cc1C(=O)N)Cl 7a_100000185026_200000210301 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.46 COc1ccc(cc1C(=O)N)F 34a_100012186459_200000210301 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.46 COc1ccc(cc1C(=O)N)F 7a_100012186459_200000210301 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.46 COc1ccc(cc1C(=O)N)I 34a_100000192813_200000210301 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.46 COc1ccc(cc1C(=O)N)I 7a_100000192813_200000210301 [0,1,0,0,0,0|2,0,0]=3 1145 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Br 1458a_100000188853_200025704644 [0,1,0,0,0,0|1,0,0]=2 1146 B12R1.46 COc1ccc(cc1C(=O)[13CH3])C 1458a_100000204667_200025704644 [0,1,0,0,0,0|0,0,0]=1 1147 B12R1.46 COc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000211409_200025704644 [0,1,0,0,0,0|1,0,0]=2 1148 B12R1.46 COc1ccc(cc1C(=O)[13CH3])F 1458a_100000735445_200025704644 [0,1,0,0,0,0|1,0,0]=2 1149 B12R1.46 COc1ccc(cc1C(=O)[13CH3])I 1458a_100000230898_200025704644 [0,1,0,0,0,0|1,0,0]=2 1150 B12R1.46 COc1ccc(cc1C(=O)[13CH3])O 1458a_200000100057_200025704644 [0,1,0,0,0,0|1,0,0]=2 1151 B12R1.46 COc1ccc(cc1C(C)C)Br 34a_100000691460_200000210301 [0,1,0,0,0,0|2,0,1]=4 1152 B12R1.46 COc1ccc(cc1C(C)C)Br 7a_100000691460_200000210301 [0,1,0,0,0,0|2,0,1]=4 1153 B12R1.46 COc1ccc(cc1C(C)O)F 34a_200011305312_200000210301 [0,1,0,0,0,0|1,0,2]=4 1154 B12R1.46 COc1ccc(cc1C(C)O)F 7a_200011305312_200000210301 [0,1,0,0,0,0|1,0,2]=4 1155 B12R1.46 COc1ccc(cc1[C@@H](C)N)Cl 34a_100011853016_200000210301 [0,1,0,0,0,0|2,0,1]=4 1156 B12R1.46 COc1ccc(cc1[C@@H](C)N)Cl 7a_100011853016_200000210301 [0,1,0,0,0,0|2,0,1]=4 1157 B12R1.46 COc1ccc(cc1[C@H](C)N)F 34a_100160469477_200000210301 [0,1,0,0,0,0|2,0,1]=4 1158 B12R1.46 COc1ccc(cc1[C@H](C)N)F 7a_100160469477_200000210301 [0,1,0,0,0,0|2,0,1]=4 1159 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_200000210301 [0,1,0,0,0,0|3,0,0]=4 1160 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_200000210301 [0,1,0,0,0,0|3,0,0]=4 1161 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_200000210301 [0,1,0,0,0,0|2,0,0]=3 1162 B12R1.46 COc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_200000210301 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_200000210301 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.46 COc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_200000210301 [0,1,0,0,0,0|3,0,0]=4 1165 B12R1.46 COc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_200000210301 [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.46 COc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_200000210301 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.46 COc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200000210301 [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.46 COc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_200000210301 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.46 COc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_200000210301 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.46 COc1ccc(nc1[N+](=O)[O-])C 7a_100000211580_200000210301 [0,1,0,0,0,0|3,0,0]=4 1171 B12R1.46 COc1ncc(cc1C(=O)C)O 271570a_203496583355_100010135678 [0,1,0,0,0,0|2,0,0]=3 1172 B12R1.46 CSc1ccc(cc1C(=O)C)Br 62a_100012349576_200000210301 [0,1,0,0,0,0|1,1,0]=3 1173 B12R1.46 CSc1ccc(cc1C(=O)C)C 62a_100012361225_200000210301 [0,1,0,0,0,0|0,1,0]=2 1174 B12R1.46 CSc1ccc(cc1C(=O)C)C 62a_200000210301_100012361225 [0,1,0,0,0,0|0,1,0]=2 1175 B12R1.46 CSc1ccc(cc1C(=O)C)F 62a_100012353695_200000210301 [0,1,0,0,0,0|1,1,0]=3 1176 B12R1.46 CSc1ccc(cc1C(=O)C)F 62a_200000210301_100010200798 [0,1,0,0,0,0|1,1,0]=3 1177 B12R1.46 CSc1ccc(cc1C(=O)C)N 62a_100012349454_200000210301 [0,1,0,0,0,0|1,1,0]=3 1178 B12R1.46 CSc1ccc(cc1C(=O)N)Br 62a_200000162314_200000210301 [0,1,0,0,0,0|2,1,0]=4 1179 B12R1.46 CSc1ccc(cc1C(=O)N)C 62a_200000210301_200012349609 [0,1,0,0,0,0|1,1,0]=3 1180 B12R1.46 CSc1ccc(cc1C(=O)N)C 62a_200012349609_200000210301 [0,1,0,0,0,0|1,1,0]=3 1181 B12R1.46 CSc1ccc(cc1C(=O)N)F 62a_100000206434_200000210301 [0,1,0,0,0,0|2,1,0]=4 1182 B12R1.46 CSc1ccc(cc1C(=O)N)F 62a_200000210301_100000206434 [0,1,0,0,0,0|2,1,0]=4 1183 B12R1.46 CSc1ccc(cc1C(=O)N)N 62a_100015186447_200000210301 [0,1,0,0,0,0|2,1,0]=4 1184 B12R1.46 CSc1ccc(cc1C(=O)O)Br 62a_100011072988_200000210301 [0,1,0,0,0,0|2,1,0]=4 1185 B12R1.46 CSc1ncc(cc1C(=O)C)F 62a_100000118324_200000210301 [0,1,0,0,0,0|2,1,0]=4 1186 B12R1.46 CSc1ncc(cc1C(=O)C)F 62a_200000210301_100000118324 [0,1,0,0,0,0|2,1,0]=4 1187 B12R1.46 C[C@@H](N)c1cc(ccc1O[13CH3])Cl 34a_100011853016_200025704644 [0,1,0,0,0,0|2,0,1]=4 1188 B12R1.46 C[C@@H](N)c1cc(ccc1O[13CH3])Cl 7a_100011853016_200025704644 [0,1,0,0,0,0|2,0,1]=4 1189 B12R1.46 C[C@H](N)c1cc(ccc1O[13CH3])F 34a_100160469477_200025704644 [0,1,0,0,0,0|2,0,1]=4 1190 B12R1.46 C[C@H](N)c1cc(ccc1O[13CH3])F 7a_100160469477_200025704644 [0,1,0,0,0,0|2,0,1]=4 1191 B12R1.46 Cc1ccc(c(c1)C(=O)N)N[13CH3] 34a_100011692829_200025704644 [0,1,0,0,0,0|2,0,0]=3 1192 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 34a_200000192840_200025704644 [0,1,0,0,0,0|1,0,0]=2 1193 B12R1.46 Cc1ccc(c(c1)C(=O)N)O[13CH3] 7a_200000192840_200025704644 [0,1,0,0,0,0|1,0,0]=2 1194 B12R1.46 Cc1ccc(c(c1)C(=O)N)S[13CH3] 62a_200012349609_200025704644 [0,1,0,0,0,0|1,1,0]=3 1195 B12R1.46 Cc1ccc(c(c1)C(=O)N)S[13CH3] 62a_200025704644_200012349609 [0,1,0,0,0,0|1,1,0]=3 1196 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 34a_100000195567_200025704644 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 7a_100000195567_200025704644 [0,1,0,0,0,0|2,0,0]=3 1198 B12R1.46 Cc1ccc(c(n1)[N+](=O)[O-])O[13CH3] 7a_100000211580_200025704644 [0,1,0,0,0,0|3,0,0]=4 1199 B12R1.46 [13CH3]C(=O)c1cc(ccc1C#N)F 1458a_100011217471_200025704644 [0,1,0,0,0,0|2,0,0]=3 1200 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Br 34a_100000740421_200025704644 [0,1,0,0,0,0|3,0,0]=4 1201 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Br 7a_100000740421_200025704644 [0,1,0,0,0,0|3,0,0]=4 1202 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Cl 34a_100000743835_200025704644 [0,1,0,0,0,0|3,0,0]=4 1203 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)Cl 7a_100000743835_200025704644 [0,1,0,0,0,0|3,0,0]=4 1204 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)F 34a_100000741173_200025704644 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.46 [13CH3]Nc1ccc(cc1C(=O)N)F 7a_100000741173_200025704644 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 34a_100000192807_200025704644 [0,1,0,0,0,0|2,0,0]=3 1207 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Br 7a_100000192807_200025704644 [0,1,0,0,0,0|2,0,0]=3 1208 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 34a_100000185026_200025704644 [0,1,0,0,0,0|2,0,0]=3 1209 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)Cl 7a_100000185026_200025704644 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 34a_100012186459_200025704644 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)F 7a_100012186459_200025704644 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 34a_100000192813_200025704644 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.46 [13CH3]Oc1ccc(cc1C(=O)N)I 7a_100000192813_200025704644 [0,1,0,0,0,0|2,0,0]=3 1214 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])Br 34a_100000757407_200025704644 [0,1,0,0,0,0|3,0,0]=4 1215 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])Br 7a_100000757407_200025704644 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])Cl 34a_100000212152_200025704644 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])Cl 7a_100000212152_200025704644 [0,1,0,0,0,0|3,0,0]=4 1218 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])F 34a_100000748789_200025704644 [0,1,0,0,0,0|3,0,0]=4 1219 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])F 7a_100000748789_200025704644 [0,1,0,0,0,0|3,0,0]=4 1220 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])I 7a_100000698543_200025704644 [0,1,0,0,0,0|3,0,0]=4 1221 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])N 34a_100000032192_200025704644 [0,1,0,0,0,0|3,0,0]=4 1222 B12R1.46 [13CH3]Oc1ccc(cc1[N+](=O)[O-])N 7a_100000032192_200025704644 [0,1,0,0,0,0|3,0,0]=4 1223 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)Br 62a_200000162314_200025704644 [0,1,0,0,0,0|2,1,0]=4 1224 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)F 62a_100000206434_200025704644 [0,1,0,0,0,0|2,1,0]=4 1225 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)F 62a_200025704644_100000206434 [0,1,0,0,0,0|2,1,0]=4 1226 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)N)N 62a_100015186447_200025704644 [0,1,0,0,0,0|2,1,0]=4 1227 B12R1.46 [13CH3]Sc1ccc(cc1C(=O)O)Br 62a_100011072988_200025704644 [0,1,0,0,0,0|2,1,0]=4 1228 B12R1.128 CC(C)(C)c1cc(ccc1O)O 271570a_203496583355_100000704011 [0,1,0,0,0,0|2,0,1]=4 1229 B12R1.128 CC(C)(C)c1cc(ccc1O)O 271570a_203496583355_200010201835 [0,1,0,0,0,0|2,0,1]=4 1230 B12R1.128 CS(=O)(=O)c1cc(ccc1Br)O 271570a_203496583355_100011102953 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.128 CS(=O)(=O)c1cc(ccc1F)O 271570a_203496583355_100010195686 [0,1,0,0,0,0|3,0,0]=4 1232 B12R1.128 CS(=O)(=O)c1cc(ccc1N)O 271570a_203496583355_100000692581 [0,1,0,0,0,0|3,0,0]=4 1233 B12R1.128 CS(=O)(=O)c1cc(ccc1O)O 271570a_203496583355_200015712519 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.128 Cc1ccc(c(c1)C(F)(F)F)O 271570a_203496583355_100009813799 [0,1,0,0,0,0|2,0,1]=4 1235 B12R1.128 Cc1ccc(cc1S(=O)(=O)C)O 271570a_203496583355_100009814363 [0,1,0,0,0,0|3,0,0]=4 1236 B12R1.128 NS(=O)(=O)c1cc(ccc1O)F 271570a_203496583355_200011831050 [0,1,0,0,0,0|3,0,0]=4 1237 B12R1.232 C=C(C)c1cc(c([nH]c1=O)C)C 271570a_100000694244_100010064231 [0,1,0,0,0,0|2,0,1]=4 1238 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)Br 271570a_100000694244_100010151546 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)F 271570a_100000694244_200010212206 [0,1,0,0,0,0|3,0,0]=4 1240 B12R1.232 C=C(C)c1cc(c(cc1Br)C)Br 271570a_100000694244_100012929169 [0,1,0,0,0,0|3,0,0]=4 1241 B12R1.232 C=C(C)c1cc(c(cc1Br)C)F 271570a_100000694244_200009814774 [0,1,0,0,0,0|3,0,0]=4 1242 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)F 271570a_100000694244_100010254745 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)O 271570a_100000694244_100021297947 [0,1,0,0,0,0|3,0,0]=4 1244 B12R1.232 C=C(C)c1cc(c(cc1Br)F)C 271570a_100000694244_200009814773 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.232 C=C(C)c1cc(c(cc1Br)F)F 271570a_100000694244_100010259568 [0,1,0,0,0,0|3,0,0]=4 1246 B12R1.232 C=C(C)c1cc(c(cc1C)Br)C 271570a_100000694244_100011356911 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.232 C=C(C)c1cc(c(cc1C)Br)Cl 271570a_100000694244_200009814780 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.232 C=C(C)c1cc(c(cc1C)Br)F 271570a_100000694244_100011356895 [0,1,0,0,0,0|3,0,0]=4 1249 B12R1.232 C=C(C)c1cc(c(cc1C)C)C 271570a_100000694244_100000759388 [0,1,0,0,0,0|2,0,0]=3 1250 B12R1.232 C=C(C)c1cc(c(cc1C)C)N 271570a_100000694244_100000703630 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.232 C=C(C)c1cc(c(cc1C)Cl)C 271570a_100000694244_100012357408 [0,1,0,0,0,0|2,0,0]=3 1252 B12R1.232 C=C(C)c1cc(c(cc1C)F)Br 271570a_100000694244_100011216669 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.232 C=C(C)c1cc(c(cc1C)F)C 271570a_100000694244_100010212296 [0,1,0,0,0,0|2,0,0]=3 1254 B12R1.232 C=C(C)c1cc(c(cc1C)F)F 271570a_100000694244_100009815990 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.232 C=C(C)c1cc(c(cc1C)F)N 271570a_100000694244_100011014115 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.232 C=C(C)c1cc(c(cc1C)F)O 271570a_100000694244_100010068922 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.232 C=C(C)c1cc(c(cc1C)N)C 271570a_100000694244_100011934712 [0,1,0,0,0,0|2,0,0]=3 1258 B12R1.232 C=C(C)c1cc(c(cc1C)N)F 271570a_100000694244_100000691575 [0,1,0,0,0,0|3,0,0]=4 1259 B12R1.232 C=C(C)c1cc(c(cc1C)N)N 271570a_100000694244_100010080480 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.232 C=C(C)c1cc(c(cc1C)N)O 271570a_100000694244_200010107346 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.232 C=C(C)c1cc(c(cc1C)O)C 271570a_100000694244_100000698207 [0,1,0,0,0,0|2,0,0]=3 1262 B12R1.232 C=C(C)c1cc(c(cc1C)O)F 271570a_100000694244_100012355673 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.232 C=C(C)c1cc(c(cc1C)O)N 271570a_100000694244_200010235796 [0,1,0,0,0,0|3,0,0]=4 1264 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)C 271570a_100000694244_100010259621 [0,1,0,0,0,0|2,0,0]=3 1265 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)Cl 271570a_100000694244_200010244590 [0,1,0,0,0,0|3,0,0]=4 1266 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)F 271570a_100000694244_100010212230 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)Cl 271570a_100000694244_200011216203 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)N 271570a_100000694244_100016224655 [0,1,0,0,0,0|3,0,0]=4 1269 B12R1.232 C=C(C)c1cc(c(cc1Cl)F)F 271570a_100000694244_100012349977 [0,1,0,0,0,0|3,0,0]=4 1270 B12R1.232 C=C(C)c1cc(c(cc1Cl)O)N 271570a_100000694244_100011011175 [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.232 C=C(C)c1cc(c(cc1F)Br)Br 271570a_100000694244_200010212210 [0,1,0,0,0,0|3,0,0]=4 1272 B12R1.232 C=C(C)c1cc(c(cc1F)Br)C 271570a_100000694244_200009814772 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.232 C=C(C)c1cc(c(cc1F)Br)F 271570a_100000694244_100011356857 [0,1,0,0,0,0|3,0,0]=4 1274 B12R1.232 C=C(C)c1cc(c(cc1F)C)Br 271570a_100000694244_100011068846 [0,1,0,0,0,0|3,0,0]=4 1275 B12R1.232 C=C(C)c1cc(c(cc1F)C)C 271570a_100000694244_100010197417 [0,1,0,0,0,0|2,0,0]=3 1276 B12R1.232 C=C(C)c1cc(c(cc1F)C)F 271570a_100000694244_100011219510 [0,1,0,0,0,0|3,0,0]=4 1277 B12R1.232 C=C(C)c1cc(c(cc1F)C)N 271570a_100000694244_100000717900 [0,1,0,0,0,0|3,0,0]=4 1278 B12R1.232 C=C(C)c1cc(c(cc1F)C)O 271570a_100000694244_100014242602 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)F 271570a_100000694244_100010142863 [0,1,0,0,0,0|3,0,0]=4 1280 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)O 271570a_100000694244_100010735246 [0,1,0,0,0,0|3,0,0]=4 1281 B12R1.232 C=C(C)c1cc(c(cc1F)F)Br 271570a_100000694244_100011356914 [0,1,0,0,0,0|3,0,0]=4 1282 B12R1.232 C=C(C)c1cc(c(cc1F)F)C 271570a_100000694244_100000692463 [0,1,0,0,0,0|2,0,0]=3 1283 B12R1.232 C=C(C)c1cc(c(cc1F)F)F 271570a_100000694244_100000686897 [0,1,0,0,0,0|3,0,0]=4 1284 B12R1.232 C=C(C)c1cc(c(cc1F)F)N 271570a_100000694244_100000700208 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.232 C=C(C)c1cc(c(cc1F)F)O 271570a_100000694244_100012457948 [0,1,0,0,0,0|3,0,0]=4 1286 B12R1.232 C=C(C)c1cc(c(cc1F)N)C 271570a_100000694244_100000695870 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.232 C=C(C)c1cc(c(cc1F)N)F 271570a_100000694244_100000690247 [0,1,0,0,0,0|3,0,0]=4 1288 B12R1.232 C=C(C)c1cc(c(cc1F)N)N 271570a_100000694244_100000766667 [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.232 C=C(C)c1cc(c(cc1F)N)O 271570a_100000694244_100013038943 [0,1,0,0,0,0|3,0,0]=4 1290 B12R1.232 C=C(C)c1cc(c(cc1F)O)F 271570a_100000694244_100011830439 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.232 C=C(C)c1cc(c(cc1F)O)N 271570a_100000694244_100012359894 [0,1,0,0,0,0|3,0,0]=4 1292 B12R1.232 C=C(C)c1cc(c(cc1N)Br)C 271570a_100000694244_200015600912 [0,1,0,0,0,0|2,0,0]=3 1293 B12R1.232 C=C(C)c1cc(c(cc1N)Br)F 271570a_100000694244_200021016574 [0,1,0,0,0,0|3,0,0]=4 1294 B12R1.232 C=C(C)c1cc(c(cc1N)C)C 271570a_100000694244_100012337760 [0,1,0,0,0,0|2,0,0]=3 1295 B12R1.232 C=C(C)c1cc(c(cc1N)C)F 271570a_100000694244_100010233353 [0,1,0,0,0,0|3,0,0]=4 1296 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)Cl 271570a_100000694244_200011093942 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)F 271570a_100000694244_200010992381 [0,1,0,0,0,0|3,0,0]=4 1298 B12R1.232 C=C(C)c1cc(c(cc1N)F)Br 271570a_100000694244_100010888672 [0,1,0,0,0,0|3,0,0]=4 1299 B12R1.232 C=C(C)c1cc(c(cc1N)F)C 271570a_100000694244_100011218008 [0,1,0,0,0,0|2,0,0]=3 1300 B12R1.232 C=C(C)c1cc(c(cc1N)F)Cl 271570a_100000694244_100010892166 [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.232 C=C(C)c1cc(c(cc1N)F)F 271570a_100000694244_100000765032 [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.232 C=C(C)c1cc(c(cc1N)N)C 271570a_100000694244_200013038441 [0,1,0,0,0,0|2,0,0]=3 1303 B12R1.232 C=C(C)c1cc(c(cc1N)N)F 271570a_100000694244_200010115645 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.232 C=C(C)c1cc(c(cc1O)C)C 271570a_100000694244_100009814663 [0,1,0,0,0,0|1,0,0]=2 1305 B12R1.232 C=C(C)c1cc(c(cc1O)F)F 271570a_100000694244_100009813768 [0,1,0,0,0,0|2,0,0]=3 1306 B12R1.232 C=C(C)c1cc(c(nc1N)C)C 271570a_100000694244_100009990238 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.232 C=C(C)c1nc(c(nc1O)C)C 271570a_100000694244_100000717854 [0,1,0,0,0,0|3,0,0]=4 1308 B12R1.232 CC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_200000210301 [0,1,0,0,0,0|2,0,0]=3 1309 B12R1.232 CC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_200000210301 [0,1,0,0,0,0|1,0,0]=2 1310 B12R1.232 CC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200000210301 [0,1,0,0,0,0|2,0,0]=3 1311 B12R1.232 CC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200000210301 [0,1,0,0,0,0|2,0,0]=3 1312 B12R1.232 CC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_200000210301 [0,1,0,0,0,0|1,0,0]=2 1313 B12R1.232 CC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_200000210301 [0,1,0,0,0,0|2,0,0]=3 1314 B12R1.232 CC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_200000210301 [0,1,0,0,0,0|2,0,0]=3 1315 B12R1.232 CC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_200000210301 [0,1,0,0,0,0|1,0,0]=2 1316 B12R1.232 CC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_200000210301 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_200000210301 [0,1,0,0,0,0|2,0,0]=3 1318 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_200000210301 [0,1,0,0,0,0|2,0,0]=3 1319 B12R1.232 CC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_200000210301 [0,1,0,0,0,0|2,0,0]=3 1320 B12R1.232 CC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_200000210301 [0,1,0,0,0,0|2,0,0]=3 1321 B12R1.232 CC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_200000210301 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200000210301 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200000210301 [0,1,0,0,0,0|2,0,0]=3 1324 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_200000210301 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_200000210301 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200000210301 [0,1,0,0,0,0|2,0,0]=3 1327 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200000210301 [0,1,0,0,0,0|2,0,0]=3 1328 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_200000210301 [0,1,0,0,0,0|1,0,0]=2 1329 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200000210301 [0,1,0,0,0,0|2,0,0]=3 1330 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200000210301 [0,1,0,0,0,0|2,0,0]=3 1331 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200000210301 [0,1,0,0,0,0|2,0,0]=3 1332 B12R1.232 CC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_200000210301 [0,1,0,0,0,0|1,0,0]=2 1333 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200000210301 [0,1,0,0,0,0|2,0,0]=3 1334 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200000210301 [0,1,0,0,0,0|2,0,0]=3 1335 B12R1.232 CC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_200000210301 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.232 CC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_200000210301 [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.232 CC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_200000210301 [0,1,0,0,0,0|2,0,0]=3 1338 B12R1.232 CC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_200000210301 [0,1,0,0,0,0|2,0,0]=3 1339 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200000210301 [0,1,0,0,0,0|2,0,0]=3 1340 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200000210301 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200000210301 [0,1,0,0,0,0|2,0,0]=3 1342 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.232 CC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200000210301 [0,1,0,0,0,0|2,0,0]=3 1344 B12R1.232 CC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_200000210301 [0,1,0,0,0,0|1,0,0]=2 1345 B12R1.232 CC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200000210301 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.232 CC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200000210301 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.232 CC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200000210301 [0,1,0,0,0,0|2,0,0]=3 1348 B12R1.232 CC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100009817148 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.232 CC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200000210301 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.232 CC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100012024335 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.232 CC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_200000210301 [0,1,0,0,0,0|1,0,0]=2 1352 B12R1.232 CC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200000210301 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.232 CC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200000210301 [0,1,0,0,0,0|1,0,0]=2 1354 B12R1.232 CC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_200000210301 [0,1,0,0,0,0|1,0,0]=2 1355 B12R1.232 CC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_200000210301 [0,1,0,0,0,0|0,0,0]=1 1356 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [0,1,0,0,0,0|1,0,0]=2 1357 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [0,1,0,0,0,0|1,0,0]=2 1358 B12R1.232 CC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200000210301 [0,1,0,0,0,0|1,0,0]=2 1359 B12R1.232 CC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200000210301 [0,1,0,0,0,0|1,0,0]=2 1360 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200000210301 [0,1,0,0,0,0|1,0,0]=2 1361 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100013243444 [0,1,0,0,0,0|1,0,0]=2 1362 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [0,1,0,0,0,0|1,0,0]=2 1363 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [0,1,0,0,0,0|1,0,0]=2 1364 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [0,1,0,0,0,0|0,0,0]=1 1365 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [0,1,0,0,0,0|1,0,0]=2 1366 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])C 1458a_100012920494_200025704644 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])F 1458a_100012920545_200025704644 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100010233826_200025704644 [0,1,0,0,0,0|1,0,0]=2 1369 B12R1.232 Cc1cc(c(cc1Br)C)C(=O)[13CH3] 1458a_100000695896_200025704644 [0,1,0,0,0,0|1,0,0]=2 1370 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)[13CH3] 1458a_100012354683_200025704644 [0,1,0,0,0,0|1,0,0]=2 1371 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Br)F 1458a_100000724332_200025704644 [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100010439669_200025704644 [0,1,0,0,0,0|2,0,0]=3 1373 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Br 1458a_100012344525_200025704644 [0,1,0,0,0,0|2,0,0]=3 1374 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Cl 1458a_200010768543_200025704644 [0,1,0,0,0,0|2,0,0]=3 1375 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)F 1458a_100000062099_200025704644 [0,1,0,0,0,0|2,0,0]=3 1376 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])I)F 1458a_100013328184_200025704644 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.232 Cc1cc(c(cc1C)B(O)O)O 271570a_203496583355_200134766076 [0,1,0,0,0,0|2,0,1]=4 1378 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])C 1458a_100011216168_200025704644 [0,1,0,0,0,0|1,0,0]=2 1379 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])I 1458a_100010184404_200025704644 [0,1,0,0,0,0|1,0,0]=2 1380 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])O 1458a_100009831561_200025704644 [0,1,0,0,0,0|0,0,0]=1 1381 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])Cl 1458a_100013033594_200025704644 [0,1,0,0,0,0|2,0,0]=3 1382 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])F 1458a_100012180961_200025704644 [0,1,0,0,0,0|2,0,0]=3 1383 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)[13CH3] 1458a_100010204433_200025704644 [0,1,0,0,0,0|1,0,0]=2 1384 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Br 1458a_200012355688_200025704644 [0,1,0,0,0,0|2,0,0]=3 1385 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Cl 1458a_100009857485_200025704644 [0,1,0,0,0,0|2,0,0]=3 1386 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])F 1458a_100000686409_200025704644 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.232 Cc1cc(c(cc1F)Cl)C(=O)[13CH3] 1458a_100000687843_200025704644 [0,1,0,0,0,0|1,0,0]=2 1388 B12R1.232 Cc1cc(c(cc1F)F)C(=O)[13CH3] 1458a_100000767126_200025704644 [0,1,0,0,0,0|1,0,0]=2 1389 B12R1.232 Cc1cc(c(cc1I)C(=O)[13CH3])C 1458a_100000723791_200025704644 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.232 Cc1cc(c(cc1O)C(=O)[13CH3])F 1458a_100009839767_200025704644 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.232 NC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100015235948 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.232 NC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010244962 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.232 NC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100015444839 [0,1,0,0,0,0|3,0,0]=4 1394 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200025704644 [0,1,0,0,0,0|2,0,0]=3 1395 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200025704644 [0,1,0,0,0,0|2,0,0]=3 1396 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200025704644 [0,1,0,0,0,0|2,0,0]=3 1397 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200025704644 [0,1,0,0,0,0|2,0,0]=3 1398 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200025704644 [0,1,0,0,0,0|2,0,0]=3 1399 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200025704644 [0,1,0,0,0,0|2,0,0]=3 1400 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200025704644 [0,1,0,0,0,0|2,0,0]=3 1401 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200025704644 [0,1,0,0,0,0|2,0,0]=3 1402 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200025704644 [0,1,0,0,0,0|2,0,0]=3 1403 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200025704644 [0,1,0,0,0,0|2,0,0]=3 1404 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200025704644 [0,1,0,0,0,0|2,0,0]=3 1405 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200025704644 [0,1,0,0,0,0|2,0,0]=3 1406 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200025704644 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200025704644 [0,1,0,0,0,0|2,0,0]=3 1408 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [0,1,0,0,0,0|2,0,0]=3 1409 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200025704644 [0,1,0,0,0,0|2,0,0]=3 1410 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200025704644 [0,1,0,0,0,0|2,0,0]=3 1411 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200025704644 [0,1,0,0,0,0|2,0,0]=3 1412 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200025704644 [0,1,0,0,0,0|2,0,0]=3 1413 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200025704644 [0,1,0,0,0,0|2,0,0]=3 1414 B12R1.232 [13CH3]C(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200025704644 [0,1,0,0,0,0|2,0,0]=3 1415 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200025704644 [0,1,0,0,0,0|1,0,0]=2 1416 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [0,1,0,0,0,0|1,0,0]=2 1417 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200025704644 [0,1,0,0,0,0|1,0,0]=2 1418 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200025704644 [0,1,0,0,0,0|1,0,0]=2 1419 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200025704644 [0,1,0,0,0,0|1,0,0]=2 1420 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [0,1,0,0,0,0|1,0,0]=2 1421 B12R1.354 CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210202 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.354 CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210202 [0,1,0,0,0,0|1,0,0]=2 1423 B12R1.354 CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210202 [0,1,0,0,0,0|2,0,0]=3 1424 B12R1.354 CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210202 [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.354 CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210202 [0,1,0,0,0,0|2,0,0]=3 1426 B12R1.354 CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210202 [0,1,0,0,0,0|2,0,0]=3 1427 B12R1.354 CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210202 [0,1,0,0,0,0|2,0,0]=3 1428 B12R1.354 CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210202 [0,1,0,0,0,0|1,0,0]=2 1429 B12R1.354 CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210202 [0,1,0,0,0,0|2,0,0]=3 1430 B12R1.354 CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210202 [0,1,0,0,0,0|2,0,0]=3 1431 B12R1.354 CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210202 [0,1,0,0,0,0|2,0,0]=3 1432 B12R1.354 CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210202 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.354 CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210202 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.354 CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210202 [0,1,0,0,0,0|1,0,0]=2 1435 B12R1.354 CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210202 [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.354 CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210202 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.354 CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210202 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.354 CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210202 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.354 CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210202 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.354 CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210202 [0,1,0,0,0,0|1,0,0]=2 1441 B12R1.354 CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210202 [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.354 CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210202 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.354 CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210202 [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.354 CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210202 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.354 CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210202 [0,1,0,0,0,0|2,0,0]=3 1446 B12R1.354 CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210202 [0,1,0,0,0,0|1,0,0]=2 1447 B12R1.354 CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210202 [0,1,0,0,0,0|2,0,0]=3 1448 B12R1.354 CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210202 [0,1,0,0,0,0|2,0,0]=3 1449 B12R1.354 CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210202 [0,1,0,0,0,0|2,0,0]=3 1450 B12R1.354 CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210202 [0,1,0,0,0,0|2,0,0]=3 1451 B12R1.354 CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210202 [0,1,0,0,0,0|1,0,0]=2 1452 B12R1.354 CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210202 [0,1,0,0,0,0|0,0,0]=1 1453 B12R1.354 CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210202 [0,1,0,0,0,0|1,0,0]=2 1454 B12R1.354 CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210202 [0,1,0,0,0,0|1,0,0]=2 1455 B12R1.354 CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210202 [0,1,0,0,0,0|1,0,0]=2 1456 B12R1.354 CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210202 [0,1,0,0,0,0|1,0,0]=2 1457 B12R1.354 CCC(=O)c1cc(ccc1O)O 271570a_203496583355_100000183607 [0,1,0,0,0,0|1,0,0]=2 1458 B12R1.354 CCN(C)c1cc(ccc1C)C 2230a_100000743043_200000210301 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.354 CCN(C)c1cc(ccc1C)C 269982a_100000743043_200000210301 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.354 CCN(C)c1cc(ccc1C)C 34a_100000743043_200000210301 [0,1,0,0,0,0|3,0,0]=4 1461 B12R1.354 CCN(C)c1cc(ccc1C)C 7a_100000743043_200000210301 [0,1,0,0,0,0|3,0,0]=4 1462 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 2230a_100000743043_200025704644 [0,1,0,0,0,0|3,0,0]=4 1463 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 269982a_100000743043_200025704644 [0,1,0,0,0,0|3,0,0]=4 1464 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 34a_100000743043_200025704644 [0,1,0,0,0,0|3,0,0]=4 1465 B12R1.354 CCN([13CH3])c1cc(ccc1C)C 7a_100000743043_200025704644 [0,1,0,0,0,0|3,0,0]=4 1466 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 11a_106832991635_100000690610 [0,1,0,0,0,0|2,0,0]=3 1467 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 1626a_100102657272_100000690610 [0,1,0,0,0,0|2,0,0]=3 1468 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 240690a_100102657272_100000690610 [0,1,0,0,0,0|2,0,0]=3 1469 B12R1.354 CNC(=O)c1cc(ccc1Br)Br 527a_100102657272_100000690610 [0,1,0,0,0,0|2,0,0]=3 1470 B12R1.354 CNC(=O)c1cc(ccc1Br)C 11a_106832991635_100000689033 [0,1,0,0,0,0|1,0,0]=2 1471 B12R1.354 CNC(=O)c1cc(ccc1Br)C 1626a_100102657272_100000689033 [0,1,0,0,0,0|1,0,0]=2 1472 B12R1.354 CNC(=O)c1cc(ccc1Br)C 240690a_100102657272_100000689033 [0,1,0,0,0,0|1,0,0]=2 1473 B12R1.354 CNC(=O)c1cc(ccc1Br)C 527a_100102657272_100000689033 [0,1,0,0,0,0|1,0,0]=2 1474 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 11a_106832991635_100000736951 [0,1,0,0,0,0|2,0,0]=3 1475 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 1626a_100102657272_100000736951 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 240690a_100102657272_100000736951 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.354 CNC(=O)c1cc(ccc1Br)Cl 527a_100102657272_100000736951 [0,1,0,0,0,0|2,0,0]=3 1478 B12R1.354 CNC(=O)c1cc(ccc1Br)F 11a_106832991635_100000212315 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.354 CNC(=O)c1cc(ccc1Br)F 1626a_100102657272_100000212315 [0,1,0,0,0,0|2,0,0]=3 1480 B12R1.354 CNC(=O)c1cc(ccc1Br)F 240690a_100102657272_100000212315 [0,1,0,0,0,0|2,0,0]=3 1481 B12R1.354 CNC(=O)c1cc(ccc1Br)F 527a_100102657272_100000212315 [0,1,0,0,0,0|2,0,0]=3 1482 B12R1.354 CNC(=O)c1cc(ccc1Br)I 11a_106832991635_100000698340 [0,1,0,0,0,0|2,0,0]=3 1483 B12R1.354 CNC(=O)c1cc(ccc1Br)I 1626a_100102657272_100000698340 [0,1,0,0,0,0|2,0,0]=3 1484 B12R1.354 CNC(=O)c1cc(ccc1Br)I 240690a_100102657272_100000698340 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.354 CNC(=O)c1cc(ccc1Br)I 527a_100102657272_100000698340 [0,1,0,0,0,0|2,0,0]=3 1486 B12R1.354 CNC(=O)c1cc(ccc1Br)O 240690a_100102657272_100012352043 [0,1,0,0,0,0|2,0,0]=3 1487 B12R1.354 CNC(=O)c1cc(ccc1Br)O 527a_100102657272_100012352043 [0,1,0,0,0,0|2,0,0]=3 1488 B12R1.354 CNC(=O)c1cc(ccc1C)Br 11a_106832991635_100000759961 [0,1,0,0,0,0|2,0,0]=3 1489 B12R1.354 CNC(=O)c1cc(ccc1C)Br 1626a_100102657272_100000759961 [0,1,0,0,0,0|2,0,0]=3 1490 B12R1.354 CNC(=O)c1cc(ccc1C)Br 240690a_100102657272_100000759961 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.354 CNC(=O)c1cc(ccc1C)Br 527a_100102657272_100000759961 [0,1,0,0,0,0|2,0,0]=3 1492 B12R1.354 CNC(=O)c1cc(ccc1C)C 11a_106832991635_100000195421 [0,1,0,0,0,0|1,0,0]=2 1493 B12R1.354 CNC(=O)c1cc(ccc1C)C 1626a_100102657272_100000195421 [0,1,0,0,0,0|1,0,0]=2 1494 B12R1.354 CNC(=O)c1cc(ccc1C)C 240690a_100102657272_100000195421 [0,1,0,0,0,0|1,0,0]=2 1495 B12R1.354 CNC(=O)c1cc(ccc1C)C 527a_100102657272_100000195421 [0,1,0,0,0,0|1,0,0]=2 1496 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 11a_106832991635_100000692595 [0,1,0,0,0,0|2,0,0]=3 1497 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 1626a_100102657272_100000692595 [0,1,0,0,0,0|2,0,0]=3 1498 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 240690a_100102657272_100000692595 [0,1,0,0,0,0|2,0,0]=3 1499 B12R1.354 CNC(=O)c1cc(ccc1C)Cl 527a_100102657272_100000692595 [0,1,0,0,0,0|2,0,0]=3 1500 B12R1.354 CNC(=O)c1cc(ccc1C)F 11a_106832991635_100000240043 [0,1,0,0,0,0|2,0,0]=3 1501 B12R1.354 CNC(=O)c1cc(ccc1C)F 1626a_100102657272_100000240043 [0,1,0,0,0,0|2,0,0]=3 1502 B12R1.354 CNC(=O)c1cc(ccc1C)F 240690a_100102657272_100000240043 [0,1,0,0,0,0|2,0,0]=3 1503 B12R1.354 CNC(=O)c1cc(ccc1C)F 527a_100102657272_100000240043 [0,1,0,0,0,0|2,0,0]=3 1504 B12R1.354 CNC(=O)c1cc(ccc1C)I 11a_106832991635_100000688012 [0,1,0,0,0,0|2,0,0]=3 1505 B12R1.354 CNC(=O)c1cc(ccc1C)I 1626a_100102657272_100000688012 [0,1,0,0,0,0|2,0,0]=3 1506 B12R1.354 CNC(=O)c1cc(ccc1C)I 240690a_100102657272_100000688012 [0,1,0,0,0,0|2,0,0]=3 1507 B12R1.354 CNC(=O)c1cc(ccc1C)I 527a_100102657272_100000688012 [0,1,0,0,0,0|2,0,0]=3 1508 B12R1.354 CNC(=O)c1cc(ccc1C)O 240690a_100102657272_100000687834 [0,1,0,0,0,0|2,0,0]=3 1509 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 11a_106832991635_100000211212 [0,1,0,0,0,0|2,0,0]=3 1510 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 1626a_100102657272_100000211212 [0,1,0,0,0,0|2,0,0]=3 1511 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 240690a_100102657272_100000211212 [0,1,0,0,0,0|2,0,0]=3 1512 B12R1.354 CNC(=O)c1cc(ccc1Cl)Br 527a_100102657272_100000211212 [0,1,0,0,0,0|2,0,0]=3 1513 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 11a_106832991635_100011290873 [0,1,0,0,0,0|1,0,0]=2 1514 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 1626a_100102657272_100011290873 [0,1,0,0,0,0|1,0,0]=2 1515 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 240690a_100102657272_100011290873 [0,1,0,0,0,0|1,0,0]=2 1516 B12R1.354 CNC(=O)c1cc(ccc1Cl)C 527a_100102657272_100011290873 [0,1,0,0,0,0|1,0,0]=2 1517 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 11a_106832991635_100000210642 [0,1,0,0,0,0|2,0,0]=3 1518 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 1626a_100102657272_100000210642 [0,1,0,0,0,0|2,0,0]=3 1519 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 240690a_100102657272_100000210642 [0,1,0,0,0,0|2,0,0]=3 1520 B12R1.354 CNC(=O)c1cc(ccc1Cl)Cl 527a_100102657272_100000210642 [0,1,0,0,0,0|2,0,0]=3 1521 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 11a_106832991635_100011219680 [0,1,0,0,0,0|2,0,0]=3 1522 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 1626a_100102657272_100011219680 [0,1,0,0,0,0|2,0,0]=3 1523 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 240690a_100102657272_100011219680 [0,1,0,0,0,0|2,0,0]=3 1524 B12R1.354 CNC(=O)c1cc(ccc1Cl)F 527a_100102657272_100011219680 [0,1,0,0,0,0|2,0,0]=3 1525 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 11a_106832991635_100000688013 [0,1,0,0,0,0|2,0,0]=3 1526 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 1626a_100102657272_100000688013 [0,1,0,0,0,0|2,0,0]=3 1527 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 240690a_100102657272_100000688013 [0,1,0,0,0,0|2,0,0]=3 1528 B12R1.354 CNC(=O)c1cc(ccc1Cl)I 527a_100102657272_100000688013 [0,1,0,0,0,0|2,0,0]=3 1529 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 240690a_100102657272_100000719527 [0,1,0,0,0,0|2,0,0]=3 1530 B12R1.354 CNC(=O)c1cc(ccc1Cl)O 527a_100102657272_100000719527 [0,1,0,0,0,0|2,0,0]=3 1531 B12R1.354 CNC(=O)c1cc(ccc1F)Br 11a_106832991635_100000212322 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.354 CNC(=O)c1cc(ccc1F)Br 1626a_100102657272_100000212322 [0,1,0,0,0,0|2,0,0]=3 1533 B12R1.354 CNC(=O)c1cc(ccc1F)Br 240690a_100102657272_100000212322 [0,1,0,0,0,0|2,0,0]=3 1534 B12R1.354 CNC(=O)c1cc(ccc1F)Br 527a_100102657272_100000212322 [0,1,0,0,0,0|2,0,0]=3 1535 B12R1.354 CNC(=O)c1cc(ccc1F)C 11a_106832991635_100000749327 [0,1,0,0,0,0|1,0,0]=2 1536 B12R1.354 CNC(=O)c1cc(ccc1F)C 1626a_100102657272_100000749327 [0,1,0,0,0,0|1,0,0]=2 1537 B12R1.354 CNC(=O)c1cc(ccc1F)C 240690a_100102657272_100000749327 [0,1,0,0,0,0|1,0,0]=2 1538 B12R1.354 CNC(=O)c1cc(ccc1F)C 527a_100102657272_100000749327 [0,1,0,0,0,0|1,0,0]=2 1539 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 11a_106832991635_100000214954 [0,1,0,0,0,0|2,0,0]=3 1540 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 1626a_100102657272_100000214954 [0,1,0,0,0,0|2,0,0]=3 1541 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 240690a_100102657272_100000214954 [0,1,0,0,0,0|2,0,0]=3 1542 B12R1.354 CNC(=O)c1cc(ccc1F)Cl 527a_100102657272_100000214954 [0,1,0,0,0,0|2,0,0]=3 1543 B12R1.354 CNC(=O)c1cc(ccc1F)F 11a_106832991635_100000198512 [0,1,0,0,0,0|2,0,0]=3 1544 B12R1.354 CNC(=O)c1cc(ccc1F)F 1626a_100102657272_100000198512 [0,1,0,0,0,0|2,0,0]=3 1545 B12R1.354 CNC(=O)c1cc(ccc1F)F 240690a_100102657272_100000198512 [0,1,0,0,0,0|2,0,0]=3 1546 B12R1.354 CNC(=O)c1cc(ccc1F)F 527a_100102657272_100000198512 [0,1,0,0,0,0|2,0,0]=3 1547 B12R1.354 CNC(=O)c1cc(ccc1F)I 11a_106832991635_100000688014 [0,1,0,0,0,0|2,0,0]=3 1548 B12R1.354 CNC(=O)c1cc(ccc1F)I 1626a_100102657272_100000688014 [0,1,0,0,0,0|2,0,0]=3 1549 B12R1.354 CNC(=O)c1cc(ccc1F)I 240690a_100102657272_100000688014 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.354 CNC(=O)c1cc(ccc1F)I 527a_100102657272_100000688014 [0,1,0,0,0,0|2,0,0]=3 1551 B12R1.354 CNC(=O)c1cc(ccc1F)O 240690a_100102657272_100000037260 [0,1,0,0,0,0|2,0,0]=3 1552 B12R1.354 CNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155058 [0,1,0,0,0,0|2,0,0]=3 1553 B12R1.354 CNC(=O)c1cc(ccc1F)O 527a_100102657272_100000037260 [0,1,0,0,0,0|2,0,0]=3 1554 B12R1.354 CNC(=O)c1cc(ccc1I)Br 11a_106832991635_100000183945 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.354 CNC(=O)c1cc(ccc1I)Br 1626a_100102657272_100000183945 [0,1,0,0,0,0|2,0,0]=3 1556 B12R1.354 CNC(=O)c1cc(ccc1I)Br 240690a_100102657272_100000183945 [0,1,0,0,0,0|2,0,0]=3 1557 B12R1.354 CNC(=O)c1cc(ccc1I)C 11a_106832991635_100000057929 [0,1,0,0,0,0|1,0,0]=2 1558 B12R1.354 CNC(=O)c1cc(ccc1I)C 1626a_100102657272_100000057929 [0,1,0,0,0,0|1,0,0]=2 1559 B12R1.354 CNC(=O)c1cc(ccc1I)C 240690a_100102657272_100000057929 [0,1,0,0,0,0|1,0,0]=2 1560 B12R1.354 CNC(=O)c1cc(ccc1I)C 527a_100102657272_100000057929 [0,1,0,0,0,0|1,0,0]=2 1561 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 11a_106832991635_100000739379 [0,1,0,0,0,0|2,0,0]=3 1562 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 1626a_100102657272_100000739379 [0,1,0,0,0,0|2,0,0]=3 1563 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 240690a_100102657272_100000739379 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.354 CNC(=O)c1cc(ccc1I)Cl 527a_100102657272_100000739379 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.354 CNC(=O)c1cc(ccc1I)F 11a_106832991635_100000748905 [0,1,0,0,0,0|2,0,0]=3 1566 B12R1.354 CNC(=O)c1cc(ccc1I)F 1626a_100102657272_100000748905 [0,1,0,0,0,0|2,0,0]=3 1567 B12R1.354 CNC(=O)c1cc(ccc1I)F 240690a_100102657272_100000748905 [0,1,0,0,0,0|2,0,0]=3 1568 B12R1.354 CNC(=O)c1cc(ccc1I)F 527a_100102657272_100000748905 [0,1,0,0,0,0|2,0,0]=3 1569 B12R1.354 CNC(=O)c1cc(ccc1I)I 11a_106832991635_100000750460 [0,1,0,0,0,0|2,0,0]=3 1570 B12R1.354 CNC(=O)c1cc(ccc1I)I 1626a_100102657272_100000750460 [0,1,0,0,0,0|2,0,0]=3 1571 B12R1.354 CNC(=O)c1cc(ccc1I)I 240690a_100102657272_100000750460 [0,1,0,0,0,0|2,0,0]=3 1572 B12R1.354 CNC(=O)c1cc(ccc1I)I 527a_100102657272_100000750460 [0,1,0,0,0,0|2,0,0]=3 1573 B12R1.354 CNC(=O)c1cc(ccc1I)O 1626a_100102657272_200009995701 [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.354 CNC(=O)c1cc(ccc1I)O 240690a_100102657272_200009995701 [0,1,0,0,0,0|2,0,0]=3 1575 B12R1.354 CNC(=O)c1cc(ccc1I)O 527a_100102657272_200009995701 [0,1,0,0,0,0|2,0,0]=3 1576 B12R1.354 CNC(=O)c1cc(ccc1N)O 271570a_203496583355_100000690504 [0,1,0,0,0,0|2,0,0]=3 1577 B12R1.354 CNC(=O)c1cc(ccc1O)Br 1626a_100102657272_100000212140 [0,1,0,0,0,0|1,0,0]=2 1578 B12R1.354 CNC(=O)c1cc(ccc1O)Br 240690a_100102657272_100000212140 [0,1,0,0,0,0|1,0,0]=2 1579 B12R1.354 CNC(=O)c1cc(ccc1O)Br 527a_100102657272_100000212140 [0,1,0,0,0,0|1,0,0]=2 1580 B12R1.354 CNC(=O)c1cc(ccc1O)C 240690a_100102657272_100000229998 [0,1,0,0,0,0|0,0,0]=1 1581 B12R1.354 CNC(=O)c1cc(ccc1O)C 527a_100102657272_100000229998 [0,1,0,0,0,0|0,0,0]=1 1582 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 11a_106832991635_100000212143 [0,1,0,0,0,0|1,0,0]=2 1583 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 1626a_100102657272_100000212143 [0,1,0,0,0,0|1,0,0]=2 1584 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 240690a_100102657272_100000212143 [0,1,0,0,0,0|1,0,0]=2 1585 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 271570a_203496583355_200011279454 [0,1,0,0,0,0|1,0,0]=2 1586 B12R1.354 CNC(=O)c1cc(ccc1O)Cl 527a_100102657272_100000212143 [0,1,0,0,0,0|1,0,0]=2 1587 B12R1.354 CNC(=O)c1cc(ccc1O)F 240690a_100102657272_100000742286 [0,1,0,0,0,0|1,0,0]=2 1588 B12R1.354 CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000206232 [0,1,0,0,0,0|1,0,0]=2 1589 B12R1.354 CNC(=O)c1cc(ccc1O)F 527a_100102657272_100000742286 [0,1,0,0,0,0|1,0,0]=2 1590 B12R1.354 CNC(=O)c1cc(ccc1O)I 240690a_100102657272_100000212111 [0,1,0,0,0,0|1,0,0]=2 1591 B12R1.354 CNC(=O)c1cc(ccc1O)I 527a_100102657272_100000212111 [0,1,0,0,0,0|1,0,0]=2 1592 B12R1.354 CNC(C)c1cc(ccc1Br)C 269862a_106832991636_100012361225 [0,1,0,0,0,0|2,0,1]=4 1593 B12R1.354 CNC(C)c1cc(ccc1C)C 269862a_106832991636_100000211711 [0,1,0,0,0,0|2,0,1]=4 1594 B12R1.354 CNC(C)c1cc(ccc1F)C 269862a_106832991636_100000760338 [0,1,0,0,0,0|2,0,1]=4 1595 B12R1.354 CNC(C)c1cc(ccc1O)Br 269862a_106832991636_100000212127 [0,1,0,0,0,0|2,0,1]=4 1596 B12R1.354 CNC(C)c1cc(ccc1O)C 269862a_106832991636_100000195442 [0,1,0,0,0,0|1,0,1]=3 1597 B12R1.354 CNC(C)c1cc(ccc1O)Cl 269862a_106832991636_100000185566 [0,1,0,0,0,0|2,0,1]=4 1598 B12R1.354 CNC(C)c1cc(ccc1O)F 269862a_106832991636_100000182812 [0,1,0,0,0,0|2,0,1]=4 1599 B12R1.354 CNC(C)c1cc(ccc1O)I 269862a_106832991636_100010712555 [0,1,0,0,0,0|2,0,1]=4 1600 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 2230a_100000695983_200000210301 [0,1,0,0,0,0|2,0,1]=4 1601 B12R1.354 CN[C@@H](C)c1cc(ccc1C)C 34a_100000695983_200000210301 [0,1,0,0,0,0|2,0,1]=4 1602 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 2230a_100160469477_200000210301 [0,1,0,0,0,0|2,0,1]=4 1603 B12R1.354 CN[C@@H](C)c1cc(ccc1O)F 34a_100160469477_200000210301 [0,1,0,0,0,0|2,0,1]=4 1604 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 2230a_100011853016_200000210301 [0,1,0,0,0,0|2,0,1]=4 1605 B12R1.354 CN[C@H](C)c1cc(ccc1O)Cl 34a_100011853016_200000210301 [0,1,0,0,0,0|2,0,1]=4 1606 B12R1.354 COC(=O)c1cc(c[nH]c1=O)O 271570a_203496583355_100009816710 [0,1,0,0,0,0|2,0,1]=4 1607 B12R1.354 COC(=O)c1cc(ccc1Br)O 271570a_203496583355_100012340073 [0,1,0,0,0,0|2,0,0]=3 1608 B12R1.354 COC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360116 [0,1,0,0,0,0|2,0,0]=3 1609 B12R1.354 COC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100012353682 [0,1,0,0,0,0|2,0,0]=3 1610 B12R1.354 COC(=O)c1cc(ccc1F)O 271570a_203496583355_100000154357 [0,1,0,0,0,0|2,0,0]=3 1611 B12R1.354 COC(=O)c1cc(ccc1N)O 271570a_203496583355_100000212070 [0,1,0,0,0,0|2,0,0]=3 1612 B12R1.354 COC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000148213 [0,1,0,0,0,0|1,0,0]=2 1613 B12R1.354 COC(=O)c1cc(ccc1O)C 271570a_203496583355_100012339458 [0,1,0,0,0,0|0,0,0]=1 1614 B12R1.354 COC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294804 [0,1,0,0,0,0|1,0,0]=2 1615 B12R1.354 COC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205820 [0,1,0,0,0,0|1,0,0]=2 1616 B12R1.354 COC(=O)c1cc(ccc1O)N 271570a_203496583355_100000696289 [0,1,0,0,0,0|1,0,0]=2 1617 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100000149868 [0,1,0,0,0,0|1,0,0]=2 1618 B12R1.354 COC(=O)c1cc(ccc1O)O 271570a_203496583355_100010230369 [0,1,0,0,0,0|1,0,0]=2 1619 B12R1.354 COC(=O)c1cc(cnc1C)O 271570a_203496583355_100010180201 [0,1,0,0,0,0|3,0,0]=4 1620 B12R1.354 COC(=O)c1cc(cnc1F)O 271570a_203496583355_100010243567 [0,1,0,0,0,0|3,0,0]=4 1621 B12R1.354 COC(=O)c1cc(cnc1N)O 271570a_203496583355_100009816750 [0,1,0,0,0,0|3,0,0]=4 1622 B12R1.354 COC(=O)c1cc(cnc1O)C 271570a_203496583355_100000085774 [0,1,0,0,0,0|1,0,0]=2 1623 B12R1.354 COC(=O)c1cc(cnc1O)F 271570a_203496583355_100012000215 [0,1,0,0,0,0|2,0,0]=3 1624 B12R1.354 COC(=O)c1cc(cnc1O)N 271570a_203496583355_200012182668 [0,1,0,0,0,0|2,0,0]=3 1625 B12R1.354 COC(=O)c1cc(ncc1C)O 271570a_203496583355_100009858526 [0,1,0,0,0,0|3,0,0]=4 1626 B12R1.354 COC(=O)c1cc(ncc1F)O 271570a_203496583355_100010218257 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.354 COC(=O)c1cc(ncc1N)O 271570a_203496583355_100012180746 [0,1,0,0,0,0|3,0,0]=4 1628 B12R1.354 COC(=O)c1cc(ncc1O)N 271570a_203496583355_100011934820 [0,1,0,0,0,0|2,0,0]=3 1629 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100009816900 [0,1,0,0,0,0|2,0,0]=3 1630 B12R1.354 COC(=O)c1cc(ncc1O)O 271570a_203496583355_100010136202 [0,1,0,0,0,0|2,0,0]=3 1631 B12R1.354 COC(=O)c1nc(=O)[nH]cc1O 271570a_203496583355_100000093369 [0,1,0,0,0,0|3,0,0]=4 1632 B12R1.354 COC(=O)c1nc(ccc1C)O 271570a_203496583355_100000117997 [0,1,0,0,0,0|3,0,0]=4 1633 B12R1.354 COC(=O)c1nc(ccc1F)O 271570a_203496583355_100000697719 [0,1,0,0,0,0|3,0,0]=4 1634 B12R1.354 COC(=O)c1nc(ccc1N)O 271570a_203496583355_100009860768 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.354 COC(=O)c1nc(ccc1O)N 271570a_203496583355_100009816986 [0,1,0,0,0,0|2,0,0]=3 1636 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100000697862 [0,1,0,0,0,0|2,0,0]=3 1637 B12R1.354 COC(=O)c1nc(ccc1O)O 271570a_203496583355_100010189638 [0,1,0,0,0,0|2,0,0]=3 1638 B12R1.354 COC(=O)c1nc(ncc1O)N 271570a_203496583355_100010219261 [0,1,0,0,0,0|3,0,0]=4 1639 B12R1.354 COC(C)c1cc(ccc1C)C 34a_200000246511_200000210301 [0,1,0,0,0,0|1,0,2]=4 1640 B12R1.354 COC(C)c1cc(ccc1C)C 7a_200000246511_200000210301 [0,1,0,0,0,0|1,0,2]=4 1641 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 2230a_100011853016_200025704644 [0,1,0,0,0,0|2,0,1]=4 1642 B12R1.354 C[C@@H](N[13CH3])c1cc(ccc1O)Cl 34a_100011853016_200025704644 [0,1,0,0,0,0|2,0,1]=4 1643 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 2230a_100160469477_200025704644 [0,1,0,0,0,0|2,0,1]=4 1644 B12R1.354 C[C@H](N[13CH3])c1cc(ccc1O)F 34a_100160469477_200025704644 [0,1,0,0,0,0|2,0,1]=4 1645 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Br 1458a_100000689033_100015361967 [0,1,0,0,0,0|1,0,0]=2 1646 B12R1.354 Cc1ccc(c(c1)C(=O)CF)C 1458a_100000195421_100015361967 [0,1,0,0,0,0|1,0,0]=2 1647 B12R1.354 Cc1ccc(c(c1)C(=O)CF)Cl 1458a_100011290873_100015361967 [0,1,0,0,0,0|1,0,0]=2 1648 B12R1.354 Cc1ccc(c(c1)C(=O)CF)F 1458a_100000749327_100015361967 [0,1,0,0,0,0|1,0,0]=2 1649 B12R1.354 Cc1ccc(c(c1)C(=O)CF)I 1458a_100000057929_100015361967 [0,1,0,0,0,0|1,0,0]=2 1650 B12R1.354 Cc1ccc(c(c1)C(=O)CF)O 1458a_100000229998_100015361967 [0,1,0,0,0,0|0,0,0]=1 1651 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 34a_200000246511_200025704644 [0,1,0,0,0,0|1,0,2]=4 1652 B12R1.354 Cc1ccc(c(c1)C(C)O[13CH3])C 7a_200000246511_200025704644 [0,1,0,0,0,0|1,0,2]=4 1653 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 2230a_100000695983_200025704644 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.354 Cc1ccc(c(c1)[C@H](C)N[13CH3])C 34a_100000695983_200025704644 [0,1,0,0,0,0|2,0,1]=4 1655 B12R1.354 Cc1ccc(cc1C(=O)CF)Br 1458a_100000759961_100015361967 [0,1,0,0,0,0|2,0,0]=3 1656 B12R1.354 Cc1ccc(cc1C(=O)CF)Cl 1458a_100000692595_100015361967 [0,1,0,0,0,0|2,0,0]=3 1657 B12R1.354 Cc1ccc(cc1C(=O)CF)F 1458a_100000240043_100015361967 [0,1,0,0,0,0|2,0,0]=3 1658 B12R1.354 Cc1ccc(cc1C(=O)CF)I 1458a_100000688012_100015361967 [0,1,0,0,0,0|2,0,0]=3 1659 B12R1.354 Cc1ccc(cc1C(=O)CF)O 1458a_100000687834_100015361967 [0,1,0,0,0,0|2,0,0]=3 1660 B12R1.354 NNC(=O)c1cc(ccc1Br)O 271570a_203496583355_200011356971 [0,1,0,0,0,0|3,0,0]=4 1661 B12R1.354 NNC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200000049959 [0,1,0,0,0,0|3,0,0]=4 1662 B12R1.354 NNC(=O)c1cc(ccc1O)F 271570a_203496583355_100000205862 [0,1,0,0,0,0|2,0,0]=3 1663 B12R1.354 NNC(=O)c1cc(ccc1O)O 271570a_203496583355_100000193350 [0,1,0,0,0,0|2,0,0]=3 1664 B12R1.354 O=C(CF)c1cc(ccc1Br)Br 1458a_100000690610_100015361967 [0,1,0,0,0,0|2,0,0]=3 1665 B12R1.354 O=C(CF)c1cc(ccc1Br)Cl 1458a_100000736951_100015361967 [0,1,0,0,0,0|2,0,0]=3 1666 B12R1.354 O=C(CF)c1cc(ccc1Br)F 1458a_100000212315_100015361967 [0,1,0,0,0,0|2,0,0]=3 1667 B12R1.354 O=C(CF)c1cc(ccc1Br)I 1458a_100000698340_100015361967 [0,1,0,0,0,0|2,0,0]=3 1668 B12R1.354 O=C(CF)c1cc(ccc1Br)O 1458a_100012352043_100015361967 [0,1,0,0,0,0|2,0,0]=3 1669 B12R1.354 O=C(CF)c1cc(ccc1Cl)Br 1458a_100000211212_100015361967 [0,1,0,0,0,0|2,0,0]=3 1670 B12R1.354 O=C(CF)c1cc(ccc1Cl)Cl 1458a_100000210642_100015361967 [0,1,0,0,0,0|2,0,0]=3 1671 B12R1.354 O=C(CF)c1cc(ccc1Cl)F 1458a_100011219680_100015361967 [0,1,0,0,0,0|2,0,0]=3 1672 B12R1.354 O=C(CF)c1cc(ccc1Cl)I 1458a_100000688013_100015361967 [0,1,0,0,0,0|2,0,0]=3 1673 B12R1.354 O=C(CF)c1cc(ccc1Cl)O 1458a_100000719527_100015361967 [0,1,0,0,0,0|2,0,0]=3 1674 B12R1.354 O=C(CF)c1cc(ccc1F)Br 1458a_100000212322_100015361967 [0,1,0,0,0,0|2,0,0]=3 1675 B12R1.354 O=C(CF)c1cc(ccc1F)Cl 1458a_100000214954_100015361967 [0,1,0,0,0,0|2,0,0]=3 1676 B12R1.354 O=C(CF)c1cc(ccc1F)F 1458a_100000198512_100015361967 [0,1,0,0,0,0|2,0,0]=3 1677 B12R1.354 O=C(CF)c1cc(ccc1F)I 1458a_100000688014_100015361967 [0,1,0,0,0,0|2,0,0]=3 1678 B12R1.354 O=C(CF)c1cc(ccc1F)O 1458a_100000037260_100015361967 [0,1,0,0,0,0|2,0,0]=3 1679 B12R1.354 O=C(CF)c1cc(ccc1I)Br 1458a_100000183945_100015361967 [0,1,0,0,0,0|2,0,0]=3 1680 B12R1.354 O=C(CF)c1cc(ccc1I)Cl 1458a_100000739379_100015361967 [0,1,0,0,0,0|2,0,0]=3 1681 B12R1.354 O=C(CF)c1cc(ccc1I)F 1458a_100000748905_100015361967 [0,1,0,0,0,0|2,0,0]=3 1682 B12R1.354 O=C(CF)c1cc(ccc1I)I 1458a_100000750460_100015361967 [0,1,0,0,0,0|2,0,0]=3 1683 B12R1.354 O=C(CF)c1cc(ccc1I)O 1458a_200009995701_100015361967 [0,1,0,0,0,0|2,0,0]=3 1684 B12R1.354 O=C(CF)c1cc(ccc1O)Br 1458a_100000212140_100015361967 [0,1,0,0,0,0|1,0,0]=2 1685 B12R1.354 O=C(CF)c1cc(ccc1O)Cl 1458a_100000212143_100015361967 [0,1,0,0,0,0|1,0,0]=2 1686 B12R1.354 O=C(CF)c1cc(ccc1O)F 1458a_100000742286_100015361967 [0,1,0,0,0,0|1,0,0]=2 1687 B12R1.354 O=C(CF)c1cc(ccc1O)I 1458a_100000212111_100015361967 [0,1,0,0,0,0|1,0,0]=2 1688 B12R1.354 O=C(CF)c1cc(ccc1O)O 1458a_100000758025_100015361967 [0,1,0,0,0,0|1,0,0]=2 1689 B12R1.453 C=C(C)c1cc(ccc1Br)C#N 271570a_100000694244_100012349583 [0,1,0,0,0,0|2,0,1]=4 1690 B12R1.453 C=C(C)c1cc(ccc1Br)C=O 271570a_100000694244_100010146563 [0,1,0,0,0,0|2,0,1]=4 1691 B12R1.453 C=C(C)c1cc(ccc1Br)OC 271570a_100000694244_100009992028 [0,1,0,0,0,0|2,0,0]=3 1692 B12R1.453 C=C(C)c1cc(ccc1C)C#N 271570a_100000694244_100000690169 [0,1,0,0,0,0|2,0,1]=4 1693 B12R1.453 C=C(C)c1cc(ccc1C)C=O 271570a_100000694244_100000695567 [0,1,0,0,0,0|2,0,1]=4 1694 B12R1.453 C=C(C)c1cc(ccc1C)CO 271570a_100000694244_100000050133 [0,1,0,0,0,0|2,0,0]=3 1695 B12R1.453 C=C(C)c1cc(ccc1C)NC 271570a_100000694244_100000707694 [0,1,0,0,0,0|2,0,0]=3 1696 B12R1.453 C=C(C)c1cc(ccc1C)NN 271570a_100000694244_100016991967 [0,1,0,0,0,0|3,0,0]=4 1697 B12R1.453 C=C(C)c1cc(ccc1C)OC 271570a_100000694244_100012349166 [0,1,0,0,0,0|2,0,0]=3 1698 B12R1.453 C=C(C)c1cc(ccc1Cl)C#N 271570a_100000694244_100010199462 [0,1,0,0,0,0|2,0,1]=4 1699 B12R1.453 C=C(C)c1cc(ccc1Cl)C=O 271570a_100000694244_100010209939 [0,1,0,0,0,0|2,0,1]=4 1700 B12R1.453 C=C(C)c1cc(ccc1Cl)OC 271570a_100000694244_100011356938 [0,1,0,0,0,0|2,0,0]=3 1701 B12R1.453 C=C(C)c1cc(ccc1F)C#N 271570a_100000694244_100000188605 [0,1,0,0,0,0|2,0,1]=4 1702 B12R1.453 C=C(C)c1cc(ccc1F)C=O 271570a_100000694244_100000211747 [0,1,0,0,0,0|2,0,1]=4 1703 B12R1.453 C=C(C)c1cc(ccc1F)CC 271570a_100000694244_200010244628 [0,1,0,0,0,0|2,0,0]=3 1704 B12R1.453 C=C(C)c1cc(ccc1F)CN 271570a_100000694244_100015193890 [0,1,0,0,0,0|2,0,0]=3 1705 B12R1.453 C=C(C)c1cc(ccc1F)CO 271570a_100000694244_100000246287 [0,1,0,0,0,0|2,0,0]=3 1706 B12R1.453 C=C(C)c1cc(ccc1F)NN 271570a_100000694244_200025705588 [0,1,0,0,0,0|3,0,0]=4 1707 B12R1.453 C=C(C)c1cc(ccc1F)OC 271570a_100000694244_100000699733 [0,1,0,0,0,0|2,0,0]=3 1708 B12R1.453 C=C(C)c1cc(ccc1F)SC 271570a_100000694244_200010708804 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.453 C=C(C)c1cc(ccc1N)C#N 271570a_100000694244_100000736769 [0,1,0,0,0,0|2,0,1]=4 1710 B12R1.453 C=C(C)c1cc(ccc1N)CC 271570a_100000694244_100012339725 [0,1,0,0,0,0|2,0,0]=3 1711 B12R1.453 C=C(C)c1cc(ccc1N)OC 271570a_100000694244_100015195136 [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.453 C=C(C)c1cc(ccc1O)C#N 271570a_100000694244_100000725478 [0,1,0,0,0,0|1,0,1]=3 1713 B12R1.453 C=C(C)c1cc(ccc1O)C=O 271570a_100000694244_100000184552 [0,1,0,0,0,0|1,0,1]=3 1714 B12R1.453 C=C(C)c1cc(ccc1O)CC 271570a_100000694244_100012339963 [0,1,0,0,0,0|1,0,0]=2 1715 B12R1.453 C=C(C)c1cc(ccc1O)CO 271570a_100000694244_100011191544 [0,1,0,0,0,0|1,0,0]=2 1716 B12R1.453 C=C(C)c1cc(ccc1O)OC 271570a_100000694244_100000685887 [0,1,0,0,0,0|1,0,0]=2 1717 B12R1.453 C=C(C)c1cc(cnc1Cl)CO 271570a_100000694244_200015217190 [0,1,0,0,0,0|3,0,0]=4 1718 B12R1.453 C=C(C)c1cc(cnc1F)OC 271570a_100000694244_100010068374 [0,1,0,0,0,0|3,0,0]=4 1719 B12R1.453 C=C(C)c1cc(cnc1N)CO 271570a_100000694244_100012343677 [0,1,0,0,0,0|3,0,0]=4 1720 B12R1.453 C=C(C)c1cc(cnc1O)C#N 271570a_100000694244_100009819929 [0,1,0,0,0,0|2,0,1]=4 1721 B12R1.453 C=C(C)c1cc(cnc1O)C=O 271570a_100000694244_100010064886 [0,1,0,0,0,0|2,0,1]=4 1722 B12R1.453 C=C(C)c1cc(ncc1C)CO 271570a_100000694244_100010113723 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.453 C=C(C)c1cc(ncc1C)OC 271570a_100000694244_100010068546 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.453 C=C(C)c1cc(ncc1Cl)OC 271570a_100000694244_100010068019 [0,1,0,0,0,0|3,0,0]=4 1725 B12R1.453 C=C(C)c1cc(ncc1F)OC 271570a_100000694244_100010160775 [0,1,0,0,0,0|3,0,0]=4 1726 B12R1.453 C=C(C)c1nc(ccc1N)OC 271570a_100000694244_100000069805 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.453 C=C(C)c1nc(ccc1O)CO 271570a_100000694244_200000118097 [0,1,0,0,0,0|2,0,0]=3 1728 B12R1.453 C=Cc1cc(c(cn1)F)C(=O)C 271570a_100011290941_100000697832 [0,1,0,0,0,0|2,0,1]=4 1729 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)C 271570a_100011290941_100012706819 [0,1,0,0,0,0|1,0,1]=3 1730 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)Cl 271570a_100011290941_100010712560 [0,1,0,0,0,0|1,0,1]=3 1731 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)F 271570a_100011290941_100000689017 [0,1,0,0,0,0|1,0,1]=3 1732 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)N 271570a_100011290941_100000695420 [0,1,0,0,0,0|1,0,1]=3 1733 B12R1.453 C=Cc1ccc(c(c1)C(=O)C)O 271570a_100011290941_100000212127 [0,1,0,0,0,0|0,0,1]=2 1734 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)C 271570a_100011290941_100012257281 [0,1,0,0,0,0|2,0,1]=4 1735 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)F 271570a_100011290941_100000162119 [0,1,0,0,0,0|2,0,1]=4 1736 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)N 271570a_100011290941_100000740421 [0,1,0,0,0,0|2,0,1]=4 1737 B12R1.453 C=Cc1ccc(c(c1)C(=O)N)O 271570a_100011290941_100000192807 [0,1,0,0,0,0|1,0,1]=3 1738 B12R1.453 C=Cc1ccc(c(c1)C(C)C)O 271570a_100011290941_100000691460 [0,1,0,0,0,0|1,0,2]=4 1739 B12R1.453 C=Cc1ccc(c(n1)C(=O)C)F 271570a_100011290941_100009887703 [0,1,0,0,0,0|2,0,1]=4 1740 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)C 271570a_100011290941_100138557192 [0,1,0,0,0,0|2,0,1]=4 1741 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)F 271570a_100011290941_100010254234 [0,1,0,0,0,0|2,0,1]=4 1742 B12R1.453 C=Cc1cnc(c(c1)C(=O)C)N 271570a_100011290941_100010173950 [0,1,0,0,0,0|2,0,1]=4 1743 B12R1.453 CC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_200000210301 [0,1,0,0,0,0|1,0,1]=3 1744 B12R1.453 CC(=O)c1cc(ccc1Br)CO 1458a_100010259715_200000210301 [0,1,0,0,0,0|1,0,0]=2 1745 B12R1.453 CC(=O)c1cc(ccc1C)C#N 1458a_200012187059_200000210301 [0,1,0,0,0,0|1,0,1]=3 1746 B12R1.453 CC(=O)c1cc(ccc1C)S[13CH3] 62a_100012706819_200025704644 [0,1,0,0,0,0|1,0,0]=2 1747 B12R1.453 CC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_200000210301 [0,1,0,0,0,0|1,0,1]=3 1748 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100009867868_200025704644 [0,1,0,0,0,0|1,0,0]=2 1749 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100009867868_200025704644 [0,1,0,0,0,0|1,0,0]=2 1750 B12R1.453 CC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100010712560_200025704644 [0,1,0,0,0,0|1,0,0]=2 1751 B12R1.453 CC(=O)c1cc(ccc1F)C#N 1458a_100011218479_200000210301 [0,1,0,0,0,0|1,0,1]=3 1752 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 34a_100000091700_200025704644 [0,1,0,0,0,0|1,0,0]=2 1753 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 7a_100000091700_200025704644 [0,1,0,0,0,0|1,0,0]=2 1754 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_100000689017_200025704644 [0,1,0,0,0,0|1,0,0]=2 1755 B12R1.453 CC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010254839 [0,1,0,0,0,0|1,0,0]=2 1756 B12R1.453 CC(=O)c1cc(ccc1I)C#N 1458a_200010191847_200000210301 [0,1,0,0,0,0|1,0,1]=3 1757 B12R1.453 CC(=O)c1cc(ccc1N)S[13CH3] 62a_100000695420_200025704644 [0,1,0,0,0,0|1,0,0]=2 1758 B12R1.453 CC(=O)c1cc(ccc1O)C#N 1458a_100000719980_200000210301 [0,1,0,0,0,0|0,0,1]=2 1759 B12R1.453 CC(=O)c1cc(ccc1O)CO 1458a_200000045694_200000210301 [0,1,0,0,0,0|0,0,0]=1 1760 B12R1.453 CC(=O)c1cc(cnc1C)S[13CH3] 62a_100138557192_200025704644 [0,1,0,0,0,0|2,0,0]=3 1761 B12R1.453 CC(=O)c1cc(cnc1C)S[13CH3] 62a_200025704644_100138557192 [0,1,0,0,0,0|2,0,0]=3 1762 B12R1.453 CC(=O)c1cc(cnc1F)S[13CH3] 62a_100010254234_200025704644 [0,1,0,0,0,0|2,0,0]=3 1763 B12R1.453 CC(=O)c1cc(cnc1F)S[13CH3] 62a_200025704644_100010254234 [0,1,0,0,0,0|2,0,0]=3 1764 B12R1.453 CC(=O)c1cc(cnc1N)S[13CH3] 62a_100010173950_200025704644 [0,1,0,0,0,0|2,0,0]=3 1765 B12R1.453 CC(=O)c1cc(cnc1N)S[13CH3] 62a_200025704644_100010173950 [0,1,0,0,0,0|2,0,0]=3 1766 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_100000697832_200025704644 [0,1,0,0,0,0|2,0,0]=3 1767 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_200025704644_100000697832 [0,1,0,0,0,0|2,0,0]=3 1768 B12R1.453 CC(=O)c1nc(ccc1F)S[13CH3] 62a_100009887703_200025704644 [0,1,0,0,0,0|2,0,0]=3 1769 B12R1.453 CC(=O)c1nc(ccc1F)S[13CH3] 62a_200025704644_100009887703 [0,1,0,0,0,0|2,0,0]=3 1770 B12R1.453 CC(=O)c1nc(ncc1C)S[13CH3] 62a_100010687370_200025704644 [0,1,0,0,0,0|3,0,0]=4 1771 B12R1.453 CC(=O)c1nc(ncc1C)S[13CH3] 62a_200025704644_100010687370 [0,1,0,0,0,0|3,0,0]=4 1772 B12R1.453 CC(C)c1cc(ccc1F)S[13CH3] 62a_200025704644_200053017515 [0,1,0,0,0,0|2,0,1]=4 1773 B12R1.453 CC(C)c1cc(ccc1F)S[13CH3] 62a_200053017515_200025704644 [0,1,0,0,0,0|2,0,1]=4 1774 B12R1.453 CC(C)c1cc(ccc1N)S[13CH3] 62a_100000694223_200025704644 [0,1,0,0,0,0|2,0,1]=4 1775 B12R1.453 CC(C)c1cc(ccc1N)S[13CH3] 62a_200025704644_100000694223 [0,1,0,0,0,0|2,0,1]=4 1776 B12R1.453 CC(C)c1cc(ccc1O)C#N 271570a_203496583355_100021510006 [0,1,0,0,0,0|1,0,2]=4 1777 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_100000691460_200025704644 [0,1,0,0,0,0|1,0,1]=3 1778 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000691460 [0,1,0,0,0,0|1,0,1]=3 1779 B12R1.453 CC(O)c1cc(ccc1F)S[13CH3] 62a_100011943926_200025704644 [0,1,0,0,0,0|1,0,2]=4 1780 B12R1.453 CC(O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100011943926 [0,1,0,0,0,0|1,0,2]=4 1781 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [0,1,0,0,0,0|0,0,0]=1 1782 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [0,1,0,0,0,0|0,0,0]=1 1783 B12R1.453 CN(C)c1cc(ccc1F)S[13CH3] 62a_100010288836_200025704644 [0,1,0,0,0,0|3,0,0]=4 1784 B12R1.453 CN(C)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010288836 [0,1,0,0,0,0|3,0,0]=4 1785 B12R1.453 CN(C)c1cc(ccc1I)O[13CH3] 34a_200010083878_200025704644 [0,1,0,0,0,0|3,0,0]=4 1786 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200000210301 [0,1,0,0,0,0|2,0,0]=3 1787 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200000210301 [0,1,0,0,0,0|2,0,0]=3 1788 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 34a_100000750465_200000210301 [0,1,0,0,0,0|2,0,0]=3 1789 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 7a_100000750465_200000210301 [0,1,0,0,0,0|2,0,0]=3 1790 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200000210301 [0,1,0,0,0,0|2,0,0]=3 1791 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200000210301 [0,1,0,0,0,0|2,0,0]=3 1792 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 34a_100000738046_200000210301 [0,1,0,0,0,0|2,0,0]=3 1793 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 7a_100000738046_200000210301 [0,1,0,0,0,0|2,0,0]=3 1794 B12R1.453 CNc1ccc(c(c1)N(C)C)C 34a_100011708272_200000210301 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.453 CNc1ccc(c(c1)[N+](=O)[O-])C 34a_100000210030_200000210301 [0,1,0,0,0,0|3,0,0]=4 1796 B12R1.453 CNc1ccc(c(c1)[N+](=O)[O-])F 34a_100000185763_200000210301 [0,1,0,0,0,0|3,0,0]=4 1797 B12R1.453 CNc1ncc(c(n1)C(=O)C)C 27a_100102657272_100010687370 [0,1,0,0,0,0|3,0,0]=4 1798 B12R1.453 COc1ccc(c(c1)B(O)O)O 271570a_203496583355_100009814730 [0,1,0,0,0,0|2,0,1]=4 1799 B12R1.453 COc1ccc(c(c1)C(=O)C)Br 1458a_100000211723_200000210301 [0,1,0,0,0,0|1,0,0]=2 1800 B12R1.453 COc1ccc(c(c1)C(=O)C)C 1458a_100011399813_200000210301 [0,1,0,0,0,0|1,0,0]=2 1801 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 1458a_100000763818_200000210301 [0,1,0,0,0,0|1,0,0]=2 1802 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_200000210301 [0,1,0,0,0,0|1,0,0]=2 1803 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_200000210301 [0,1,0,0,0,0|1,0,0]=2 1804 B12R1.453 COc1ccc(c(c1)C(=O)C)F 1458a_100011217016_200000210301 [0,1,0,0,0,0|1,0,0]=2 1805 B12R1.453 COc1ccc(c(c1)C(=O)C)F 34a_100000091700_200000210301 [0,1,0,0,0,0|1,0,0]=2 1806 B12R1.453 COc1ccc(c(c1)C(=O)C)F 7a_100000091700_200000210301 [0,1,0,0,0,0|1,0,0]=2 1807 B12R1.453 COc1ccc(c(c1)C(=O)C)I 1458a_100012339533_200000210301 [0,1,0,0,0,0|1,0,0]=2 1808 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [0,1,0,0,0,0|0,0,0]=1 1809 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [0,1,0,0,0,0|0,0,0]=1 1810 B12R1.453 COc1ccc(c(c1)C(=O)N)O 271570a_203496583355_100000162014 [0,1,0,0,0,0|1,0,0]=2 1811 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000211723_200025704644 [0,1,0,0,0,0|1,0,0]=2 1812 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])C 1458a_100011399813_200025704644 [0,1,0,0,0,0|1,0,0]=2 1813 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000763818_200025704644 [0,1,0,0,0,0|1,0,0]=2 1814 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])F 1458a_100011217016_200025704644 [0,1,0,0,0,0|1,0,0]=2 1815 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])I 1458a_100012339533_200025704644 [0,1,0,0,0,0|1,0,0]=2 1816 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [0,1,0,0,0,0|0,0,0]=1 1817 B12R1.453 COc1ccc(c(c1)C(F)F)O 271570a_203496583355_100010189949 [0,1,0,0,0,0|2,0,1]=4 1818 B12R1.453 COc1ccc(c(c1)N(C)C)C 34a_200000087912_200000210301 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.453 COc1ccc(c(c1)N(C)C)I 34a_200010083878_200000210301 [0,1,0,0,0,0|3,0,0]=4 1820 B12R1.453 COc1ccc(c(c1)[C@H](C)N)O 271570a_203496583355_200015425320 [0,1,0,0,0,0|1,0,1]=3 1821 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Br 34a_100012232398_200000210301 [0,1,0,0,0,0|3,0,0]=4 1822 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Br 7a_100012232398_200000210301 [0,1,0,0,0,0|3,0,0]=4 1823 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])C 34a_100000742313_200000210301 [0,1,0,0,0,0|3,0,0]=4 1824 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])C 7a_100000742313_200000210301 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Cl 34a_100000718020_200000210301 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000718020_200000210301 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])F 34a_100011294462_200000210301 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])F 7a_100011294462_200000210301 [0,1,0,0,0,0|3,0,0]=4 1829 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])I 7a_100000031453_200000210301 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])N 34a_100000740891_200000210301 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.453 COc1ccc(c(c1)[N+](=O)[O-])N 7a_100000740891_200000210301 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_100000697832_200000210301 [0,1,0,0,0,0|2,0,0]=3 1833 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_200000210301_100000697832 [0,1,0,0,0,0|2,0,0]=3 1834 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_100015943597_200000210301 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_200000210301_100015943597 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_100012003536_200000210301 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_200000210301_100012003536 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.453 CSc1ccc(c(c1)C(=O)C)C 62a_100012706819_200000210301 [0,1,0,0,0,0|1,0,0]=2 1839 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 1458a_100000212015_200000210301 [0,1,0,0,0,0|1,0,0]=2 1840 B12R1.453 CSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_200000210301 [0,1,0,0,0,0|1,0,0]=2 1841 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 1458a_200012183283_200000210301 [0,1,0,0,0,0|1,0,0]=2 1842 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_100000689017_200000210301 [0,1,0,0,0,0|1,0,0]=2 1843 B12R1.453 CSc1ccc(c(c1)C(=O)C)F 62a_200000210301_100010254839 [0,1,0,0,0,0|1,0,0]=2 1844 B12R1.453 CSc1ccc(c(c1)C(=O)C)N 62a_100000695420_200000210301 [0,1,0,0,0,0|1,0,0]=2 1845 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_100012257281_200000210301 [0,1,0,0,0,0|2,0,0]=3 1846 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_200000210301_100012257281 [0,1,0,0,0,0|2,0,0]=3 1847 B12R1.453 CSc1ccc(c(c1)C(=O)N)F 62a_100000162119_200000210301 [0,1,0,0,0,0|2,0,0]=3 1848 B12R1.453 CSc1ccc(c(c1)C(=O)N)N 62a_100000740421_200000210301 [0,1,0,0,0,0|2,0,0]=3 1849 B12R1.453 CSc1ccc(c(c1)C(=O)N)O 62a_100000192807_200000210301 [0,1,0,0,0,0|1,0,0]=2 1850 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000212015_200025704644 [0,1,0,0,0,0|1,0,0]=2 1851 B12R1.453 CSc1ccc(c(c1)C(=O)[13CH3])F 1458a_200012183283_200025704644 [0,1,0,0,0,0|1,0,0]=2 1852 B12R1.453 CSc1ccc(c(c1)C(C)C)F 62a_200000210301_200053017515 [0,1,0,0,0,0|2,0,1]=4 1853 B12R1.453 CSc1ccc(c(c1)C(C)C)F 62a_200053017515_200000210301 [0,1,0,0,0,0|2,0,1]=4 1854 B12R1.453 CSc1ccc(c(c1)C(C)C)N 62a_100000694223_200000210301 [0,1,0,0,0,0|2,0,1]=4 1855 B12R1.453 CSc1ccc(c(c1)C(C)C)N 62a_200000210301_100000694223 [0,1,0,0,0,0|2,0,1]=4 1856 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_100000691460_200000210301 [0,1,0,0,0,0|1,0,1]=3 1857 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_200000210301_100000691460 [0,1,0,0,0,0|1,0,1]=3 1858 B12R1.453 CSc1ccc(c(c1)C(C)O)F 62a_100011943926_200000210301 [0,1,0,0,0,0|1,0,2]=4 1859 B12R1.453 CSc1ccc(c(c1)C(C)O)F 62a_200000210301_100011943926 [0,1,0,0,0,0|1,0,2]=4 1860 B12R1.453 CSc1ccc(c(c1)N(C)C)F 62a_100010288836_200000210301 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.453 CSc1ccc(c(c1)N(C)C)F 62a_200000210301_100010288836 [0,1,0,0,0,0|3,0,0]=4 1862 B12R1.453 CSc1ccc(c(n1)C(=O)C)F 62a_100009887703_200000210301 [0,1,0,0,0,0|2,0,0]=3 1863 B12R1.453 CSc1ccc(c(n1)C(=O)C)F 62a_200000210301_100009887703 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.453 CSc1ccc(c(n1)C(=O)N)N 62a_100000093116_200000210301 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.453 CSc1cnc(c(c1)C(=O)C)C 62a_100138557192_200000210301 [0,1,0,0,0,0|2,0,0]=3 1866 B12R1.453 CSc1cnc(c(c1)C(=O)C)C 62a_200000210301_100138557192 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.453 CSc1cnc(c(c1)C(=O)C)F 62a_100010254234_200000210301 [0,1,0,0,0,0|2,0,0]=3 1868 B12R1.453 CSc1cnc(c(c1)C(=O)C)F 62a_200000210301_100010254234 [0,1,0,0,0,0|2,0,0]=3 1869 B12R1.453 CSc1cnc(c(c1)C(=O)C)N 62a_100010173950_200000210301 [0,1,0,0,0,0|2,0,0]=3 1870 B12R1.453 CSc1cnc(c(c1)C(=O)C)N 62a_200000210301_100010173950 [0,1,0,0,0,0|2,0,0]=3 1871 B12R1.453 CSc1cnc(c(c1)C(=O)N)N 62a_100000701294_200000210301 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.453 CSc1cnc(c(c1)C(=O)N)N 62a_200000210301_100000701294 [0,1,0,0,0,0|3,0,0]=4 1873 B12R1.453 CSc1cnc(c(n1)C(=O)N)O 62a_100010272261_200000210301 [0,1,0,0,0,0|3,0,0]=4 1874 B12R1.453 CSc1cnc(c(n1)C(=O)N)O 62a_200000210301_100010272261 [0,1,0,0,0,0|3,0,0]=4 1875 B12R1.453 CSc1ncc(c(n1)C(=O)C)C 62a_100010687370_200000210301 [0,1,0,0,0,0|3,0,0]=4 1876 B12R1.453 CSc1ncc(c(n1)C(=O)C)C 62a_200000210301_100010687370 [0,1,0,0,0,0|3,0,0]=4 1877 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 34a_100000750465_200025704644 [0,1,0,0,0,0|2,0,0]=3 1878 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 7a_100000750465_200025704644 [0,1,0,0,0,0|2,0,0]=3 1879 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_100012257281_200025704644 [0,1,0,0,0,0|2,0,0]=3 1880 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_200025704644_100012257281 [0,1,0,0,0,0|2,0,0]=3 1881 B12R1.453 Cc1ccc(cc1C(=O)[13CH3])C#N 1458a_200012187059_200025704644 [0,1,0,0,0,0|1,0,1]=3 1882 B12R1.453 Cc1ccc(cc1N(C)C)N[13CH3] 34a_100011708272_200025704644 [0,1,0,0,0,0|3,0,0]=4 1883 B12R1.453 Cc1ccc(cc1N(C)C)O[13CH3] 34a_200000087912_200025704644 [0,1,0,0,0,0|3,0,0]=4 1884 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])N[13CH3] 34a_100000210030_200025704644 [0,1,0,0,0,0|3,0,0]=4 1885 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])O[13CH3] 34a_100000742313_200025704644 [0,1,0,0,0,0|3,0,0]=4 1886 B12R1.453 Cc1ccc(cc1[N+](=O)[O-])O[13CH3] 7a_100000742313_200025704644 [0,1,0,0,0,0|3,0,0]=4 1887 B12R1.453 [13CH3]C(=O)c1cc(ccc1Br)C#N 1458a_100012361338_200025704644 [0,1,0,0,0,0|1,0,1]=3 1888 B12R1.453 [13CH3]C(=O)c1cc(ccc1Br)CO 1458a_100010259715_200025704644 [0,1,0,0,0,0|1,0,0]=2 1889 B12R1.453 [13CH3]C(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_200025704644 [0,1,0,0,0,0|1,0,1]=3 1890 B12R1.453 [13CH3]C(=O)c1cc(ccc1F)C#N 1458a_100011218479_200025704644 [0,1,0,0,0,0|1,0,1]=3 1891 B12R1.453 [13CH3]C(=O)c1cc(ccc1I)C#N 1458a_200010191847_200025704644 [0,1,0,0,0,0|1,0,1]=3 1892 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)C#N 1458a_100000719980_200025704644 [0,1,0,0,0,0|0,0,1]=2 1893 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)CO 1458a_200000045694_200025704644 [0,1,0,0,0,0|0,0,0]=1 1894 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200025704644 [0,1,0,0,0,0|2,0,0]=3 1895 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200025704644 [0,1,0,0,0,0|2,0,0]=3 1896 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200025704644 [0,1,0,0,0,0|2,0,0]=3 1897 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200025704644 [0,1,0,0,0,0|2,0,0]=3 1898 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 34a_100000738046_200025704644 [0,1,0,0,0,0|2,0,0]=3 1899 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 7a_100000738046_200025704644 [0,1,0,0,0,0|2,0,0]=3 1900 B12R1.453 [13CH3]Nc1ccc(c(c1)[N+](=O)[O-])F 34a_100000185763_200025704644 [0,1,0,0,0,0|3,0,0]=4 1901 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Br 34a_100012232398_200025704644 [0,1,0,0,0,0|3,0,0]=4 1902 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Br 7a_100012232398_200025704644 [0,1,0,0,0,0|3,0,0]=4 1903 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Cl 34a_100000718020_200025704644 [0,1,0,0,0,0|3,0,0]=4 1904 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])Cl 7a_100000718020_200025704644 [0,1,0,0,0,0|3,0,0]=4 1905 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])F 34a_100011294462_200025704644 [0,1,0,0,0,0|3,0,0]=4 1906 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])F 7a_100011294462_200025704644 [0,1,0,0,0,0|3,0,0]=4 1907 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])I 7a_100000031453_200025704644 [0,1,0,0,0,0|3,0,0]=4 1908 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])N 34a_100000740891_200025704644 [0,1,0,0,0,0|3,0,0]=4 1909 B12R1.453 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])N 7a_100000740891_200025704644 [0,1,0,0,0,0|3,0,0]=4 1910 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_100015943597_200025704644 [0,1,0,0,0,0|3,0,0]=4 1911 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_200025704644_100015943597 [0,1,0,0,0,0|3,0,0]=4 1912 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_100012003536_200025704644 [0,1,0,0,0,0|3,0,0]=4 1913 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_200025704644_100012003536 [0,1,0,0,0,0|3,0,0]=4 1914 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)F 62a_100000162119_200025704644 [0,1,0,0,0,0|2,0,0]=3 1915 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)N 62a_100000740421_200025704644 [0,1,0,0,0,0|2,0,0]=3 1916 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)O 62a_100000192807_200025704644 [0,1,0,0,0,0|1,0,0]=2 1917 B12R1.453 [13CH3]Sc1ccc(c(n1)C(=O)N)N 62a_100000093116_200025704644 [0,1,0,0,0,0|3,0,0]=4 1918 B12R1.453 [13CH3]Sc1cnc(c(c1)C(=O)N)N 62a_100000701294_200025704644 [0,1,0,0,0,0|3,0,0]=4 1919 B12R1.453 [13CH3]Sc1cnc(c(c1)C(=O)N)N 62a_200025704644_100000701294 [0,1,0,0,0,0|3,0,0]=4 1920 B12R1.453 [13CH3]Sc1cnc(c(n1)C(=O)N)O 62a_100010272261_200025704644 [0,1,0,0,0,0|3,0,0]=4 1921 B12R1.453 [13CH3]Sc1cnc(c(n1)C(=O)N)O 62a_200025704644_100010272261 [0,1,0,0,0,0|3,0,0]=4 1922 B12R1.511 C=C(C)c1cc(cc(c1Br)F)F 271570a_100000694244_100010256416 [0,1,0,0,0,0|3,0,0]=4 1923 B12R1.511 C=C(C)c1cc(cc(c1C)C)N 271570a_100000694244_100010368239 [0,1,0,0,0,0|3,0,0]=4 1924 B12R1.511 C=C(C)c1cc(cc(c1C)C)O 271570a_100000694244_100010068915 [0,1,0,0,0,0|3,0,0]=4 1925 B12R1.511 C=C(C)c1cc(cc(c1C)F)C 271570a_100000694244_100015473476 [0,1,0,0,0,0|2,0,0]=3 1926 B12R1.511 C=C(C)c1cc(cc(c1C)F)F 271570a_100000694244_100015579730 [0,1,0,0,0,0|3,0,0]=4 1927 B12R1.511 C=C(C)c1cc(cc(c1C)F)N 271570a_100000694244_100010254531 [0,1,0,0,0,0|3,0,0]=4 1928 B12R1.511 C=C(C)c1cc(cc(c1C)N)C 271570a_100000694244_102495365385 [0,1,0,0,0,0|2,0,0]=3 1929 B12R1.511 C=C(C)c1cc(cc(c1C)N)Cl 271570a_100000694244_200000050010 [0,1,0,0,0,0|3,0,0]=4 1930 B12R1.511 C=C(C)c1cc(cc(c1C)N)F 271570a_100000694244_100009814351 [0,1,0,0,0,0|3,0,0]=4 1931 B12R1.511 C=C(C)c1cc(cc(c1Cl)Cl)Cl 271570a_100000694244_200000042848 [0,1,0,0,0,0|3,0,0]=4 1932 B12R1.511 C=C(C)c1cc(cc(c1F)C)C 271570a_100000694244_200010204574 [0,1,0,0,0,0|2,0,0]=3 1933 B12R1.511 C=C(C)c1cc(cc(c1F)C)F 271570a_100000694244_100010291795 [0,1,0,0,0,0|3,0,0]=4 1934 B12R1.511 C=C(C)c1cc(cc(c1F)Cl)Br 271570a_100000694244_100010270166 [0,1,0,0,0,0|3,0,0]=4 1935 B12R1.511 C=C(C)c1cc(cc(c1F)F)C 271570a_100000694244_100010141297 [0,1,0,0,0,0|2,0,0]=3 1936 B12R1.511 C=C(C)c1cc(cc(c1F)F)F 271570a_100000694244_100000724850 [0,1,0,0,0,0|3,0,0]=4 1937 B12R1.511 C=C(C)c1cc(cc(c1F)F)N 271570a_100000694244_100009816004 [0,1,0,0,0,0|3,0,0]=4 1938 B12R1.511 C=C(C)c1cc(cc(c1F)N)C 271570a_100000694244_100010589139 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.511 C=C(C)c1cc(cc(c1F)N)F 271570a_100000694244_100000722353 [0,1,0,0,0,0|3,0,0]=4 1940 B12R1.511 C=C(C)c1cc(cc(c1N)Br)Cl 271570a_100000694244_200012970264 [0,1,0,0,0,0|3,0,0]=4 1941 B12R1.511 C=C(C)c1cc(cc(c1N)C)Br 271570a_100000694244_200000690823 [0,1,0,0,0,0|3,0,0]=4 1942 B12R1.511 C=C(C)c1cc(cc(c1N)C)C 271570a_100000694244_100000688863 [0,1,0,0,0,0|2,0,0]=3 1943 B12R1.511 C=C(C)c1cc(cc(c1N)C)Cl 271570a_100000694244_100012344046 [0,1,0,0,0,0|3,0,0]=4 1944 B12R1.511 C=C(C)c1cc(cc(c1N)C)F 271570a_100000694244_100011216670 [0,1,0,0,0,0|3,0,0]=4 1945 B12R1.511 C=C(C)c1cc(cc(c1N)Cl)Cl 271570a_100000694244_100011216899 [0,1,0,0,0,0|3,0,0]=4 1946 B12R1.511 C=C(C)c1cc(cc(c1N)F)Br 271570a_100000694244_100012970276 [0,1,0,0,0,0|3,0,0]=4 1947 B12R1.511 C=C(C)c1cc(cc(c1N)F)C 271570a_100000694244_100012353694 [0,1,0,0,0,0|2,0,0]=3 1948 B12R1.511 C=C(C)c1cc(cc(c1N)F)Cl 271570a_100000694244_100011214900 [0,1,0,0,0,0|3,0,0]=4 1949 B12R1.511 C=C(C)c1cc(cc(c1N)F)F 271570a_100000694244_100000211602 [0,1,0,0,0,0|3,0,0]=4 1950 B12R1.511 C=C(C)c1cc(cc(c1N)N)C 271570a_100000694244_100012348275 [0,1,0,0,0,0|2,0,0]=3 1951 B12R1.511 C=C(C)c1cc(cc(c1N)N)F 271570a_100000694244_100011934818 [0,1,0,0,0,0|3,0,0]=4 1952 B12R1.511 C=C(C)c1cc(cc(c1O)Br)F 271570a_100000694244_200013085147 [0,1,0,0,0,0|2,0,0]=3 1953 B12R1.511 C=C(C)c1cc(cc(c1O)C)C 271570a_100000694244_100011934984 [0,1,0,0,0,0|1,0,0]=2 1954 B12R1.511 C=C(C)c1cc(cc(c1O)C)Cl 271570a_100000694244_100012343667 [0,1,0,0,0,0|2,0,0]=3 1955 B12R1.511 C=C(C)c1cc(cc(c1O)C)N 271570a_100000694244_100010064301 [0,1,0,0,0,0|2,0,0]=3 1956 B12R1.511 C=C(C)c1cc(cc(c1O)Cl)Cl 271570a_100000694244_200012339341 [0,1,0,0,0,0|2,0,0]=3 1957 B12R1.511 C=C(C)c1cc(cc(c1O)F)Br 271570a_100000694244_100013354677 [0,1,0,0,0,0|2,0,0]=3 1958 B12R1.511 C=C(C)c1cc(cc(c1O)F)C 271570a_100000694244_200135191068 [0,1,0,0,0,0|1,0,0]=2 1959 B12R1.511 C=C(C)c1cc(cc(c1O)F)F 271570a_100000694244_100000688693 [0,1,0,0,0,0|2,0,0]=3 1960 B12R1.511 C=C(C)c1cc(cc(c1O)N)F 271570a_100000694244_200011217456 [0,1,0,0,0,0|2,0,0]=3 1961 B12R1.511 C=C(C)c1cc(cn(c1=O)C)C 271570a_100000694244_100011068373 [0,1,0,0,0,0|2,0,1]=4 1962 B12R1.511 C=C(C)c1nc(cc(c1N)C)C 271570a_100000694244_100009816701 [0,1,0,0,0,0|3,0,0]=4 1963 B12R1.511 CC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_200000210301 [0,1,0,0,0,0|1,0,0]=2 1964 B12R1.511 CC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_200000210301 [0,1,0,0,0,0|1,0,0]=2 1965 B12R1.511 CC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200000210301 [0,1,0,0,0,0|2,0,0]=3 1966 B12R1.511 CC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_200000210301 [0,1,0,0,0,0|2,0,0]=3 1967 B12R1.511 CC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_200000210301 [0,1,0,0,0,0|2,0,0]=3 1968 B12R1.511 CC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_200000210301 [0,1,0,0,0,0|2,0,0]=3 1969 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_200000210301 [0,1,0,0,0,0|2,0,0]=3 1970 B12R1.511 CC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_200000210301 [0,1,0,0,0,0|2,0,0]=3 1971 B12R1.511 CC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_200000210301 [0,1,0,0,0,0|2,0,0]=3 1972 B12R1.511 CC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_200000210301 [0,1,0,0,0,0|2,0,0]=3 1973 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200000210301 [0,1,0,0,0,0|2,0,0]=3 1974 B12R1.511 CC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200000210301 [0,1,0,0,0,0|2,0,0]=3 1975 B12R1.511 CC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_200000210301 [0,1,0,0,0,0|2,0,0]=3 1976 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200000210301 [0,1,0,0,0,0|2,0,0]=3 1977 B12R1.511 CC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200000210301 [0,1,0,0,0,0|2,0,0]=3 1978 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200000210301 [0,1,0,0,0,0|2,0,0]=3 1979 B12R1.511 CC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200000210301 [0,1,0,0,0,0|2,0,0]=3 1980 B12R1.511 CC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_200000210301 [0,1,0,0,0,0|1,0,0]=2 1981 B12R1.511 CC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200000210301 [0,1,0,0,0,0|2,0,0]=3 1982 B12R1.511 CC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200000210301 [0,1,0,0,0,0|2,0,0]=3 1983 B12R1.511 CC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_200000210301 [0,1,0,0,0,0|2,0,0]=3 1984 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200000210301 [0,1,0,0,0,0|2,0,0]=3 1985 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200000210301 [0,1,0,0,0,0|2,0,0]=3 1986 B12R1.511 CC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200000210301 [0,1,0,0,0,0|2,0,0]=3 1987 B12R1.511 CC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_200000210301 [0,1,0,0,0,0|1,0,0]=2 1988 B12R1.511 CC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200000210301 [0,1,0,0,0,0|2,0,0]=3 1989 B12R1.511 CC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200000210301 [0,1,0,0,0,0|2,0,0]=3 1990 B12R1.511 CC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200000210301 [0,1,0,0,0,0|2,0,0]=3 1991 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200000210301 [0,1,0,0,0,0|1,0,0]=2 1992 B12R1.511 CC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200000210301 [0,1,0,0,0,0|1,0,0]=2 1993 B12R1.511 CC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_200000210301 [0,1,0,0,0,0|1,0,0]=2 1994 B12R1.511 CC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_200000210301 [0,1,0,0,0,0|1,0,0]=2 1995 B12R1.511 CC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200000210301 [0,1,0,0,0,0|1,0,0]=2 1996 B12R1.511 CC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200000210301 [0,1,0,0,0,0|1,0,0]=2 1997 B12R1.511 CC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200000210301 [0,1,0,0,0,0|1,0,0]=2 1998 B12R1.511 CC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200000210301 [0,1,0,0,0,0|1,0,0]=2 1999 B12R1.511 CC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200000210301 [0,1,0,0,0,0|1,0,0]=2 2000 B12R1.511 CC(=O)c1cc(cc(c1O)O)C 271570a_203496583355_100011659362 [0,1,0,0,0,0|0,0,0]=1 2001 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100012356187_200025704644 [0,1,0,0,0,0|2,0,0]=3 2002 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)Cl 1458a_100012921640_200025704644 [0,1,0,0,0,0|2,0,0]=3 2003 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)F 1458a_100010768523_200025704644 [0,1,0,0,0,0|2,0,0]=3 2004 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])Br)O 1458a_100011101721_200025704644 [0,1,0,0,0,0|2,0,0]=3 2005 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Br 1458a_100012347597_200025704644 [0,1,0,0,0,0|2,0,0]=3 2006 B12R1.511 Cc1c(cc(cc1C(=O)[13CH3])F)Cl 1458a_100012177191_200025704644 [0,1,0,0,0,0|2,0,0]=3 2007 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)Br 1458a_200012920551_200025704644 [0,1,0,0,0,0|1,0,0]=2 2008 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])Br)C 1458a_200000701928_200025704644 [0,1,0,0,0,0|1,0,0]=2 2009 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)Br 1458a_100009996753_200025704644 [0,1,0,0,0,0|1,0,0]=2 2010 B12R1.511 Cc1cc(c(c(c1)C(=O)[13CH3])F)F 1458a_100000094381_200025704644 [0,1,0,0,0,0|1,0,0]=2 2011 B12R1.511 Cc1cc(cc(c1C)C(=O)[13CH3])Br 1458a_100012920495_200025704644 [0,1,0,0,0,0|2,0,0]=3 2012 B12R1.511 Cc1cc(cc(c1Cl)C(=O)[13CH3])F 1458a_200010768536_200025704644 [0,1,0,0,0,0|2,0,0]=3 2013 B12R1.511 Cc1cc(cc(c1F)C(=O)[13CH3])Br 1458a_100012928937_200025704644 [0,1,0,0,0,0|2,0,0]=3 2014 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100011825902_200025704644 [0,1,0,0,0,0|1,0,0]=2 2015 B12R1.511 Cc1cc(cc(c1O)C(=O)[13CH3])Cl 1458a_100011255218_200025704644 [0,1,0,0,0,0|1,0,0]=2 2016 B12R1.511 NC(=O)c1cc(cc(c1O)O)F 271570a_203496583355_200135271384 [0,1,0,0,0,0|2,0,0]=3 2017 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_200025704644 [0,1,0,0,0,0|2,0,0]=3 2018 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_200025704644 [0,1,0,0,0,0|2,0,0]=3 2019 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_200025704644 [0,1,0,0,0,0|2,0,0]=3 2020 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_200025704644 [0,1,0,0,0,0|2,0,0]=3 2021 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_200025704644 [0,1,0,0,0,0|2,0,0]=3 2022 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_200025704644 [0,1,0,0,0,0|2,0,0]=3 2023 B12R1.511 [13CH3]C(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_200025704644 [0,1,0,0,0,0|2,0,0]=3 2024 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_200025704644 [0,1,0,0,0,0|2,0,0]=3 2025 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_200025704644 [0,1,0,0,0,0|2,0,0]=3 2026 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_200025704644 [0,1,0,0,0,0|2,0,0]=3 2027 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_200025704644 [0,1,0,0,0,0|2,0,0]=3 2028 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_200025704644 [0,1,0,0,0,0|2,0,0]=3 2029 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)F 1458a_100011217470_200025704644 [0,1,0,0,0,0|2,0,0]=3 2030 B12R1.511 [13CH3]C(=O)c1cc(cc(c1F)F)I 1458a_100012344719_200025704644 [0,1,0,0,0,0|2,0,0]=3 2031 B12R1.511 [13CH3]C(=O)c1cc(cc(c1I)I)I 1458a_100000211575_200025704644 [0,1,0,0,0,0|2,0,0]=3 2032 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_200025704644 [0,1,0,0,0,0|1,0,0]=2 2033 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_200025704644 [0,1,0,0,0,0|1,0,0]=2 2034 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_200025704644 [0,1,0,0,0,0|1,0,0]=2 2035 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_200025704644 [0,1,0,0,0,0|1,0,0]=2 2036 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)F)F 1458a_100011255242_200025704644 [0,1,0,0,0,0|1,0,0]=2 2037 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)I)I 1458a_100000748652_200025704644 [0,1,0,0,0,0|1,0,0]=2 2038 B12R1.511 [13CH3]C(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_200025704644 [0,1,0,0,0,0|1,0,0]=2 2039 B12R1.894 C=C(C)c1c(ccc(c1C)F)C 271570a_100000694244_100011068659 [0,1,0,0,0,0|3,0,0]=4 2040 B12R1.894 C=C(C)c1c(ccc(c1C)F)F 271570a_100000694244_100010167959 [0,1,0,0,0,0|3,0,0]=4 2041 B12R1.894 C=C(C)c1c(ccc(c1C)N)C 271570a_100000694244_106354213274 [0,1,0,0,0,0|3,0,0]=4 2042 B12R1.894 C=C(C)c1c(ccc(c1C)O)C 271570a_100000694244_100010659238 [0,1,0,0,0,0|3,0,0]=4 2043 B12R1.894 C=C(C)c1c(ccc(c1Cl)Br)N 271570a_100000694244_200010779962 [0,1,0,0,0,0|3,0,0]=4 2044 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)Cl 271570a_100000694244_200010170825 [0,1,0,0,0,0|3,0,0]=4 2045 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)F 271570a_100000694244_200015697950 [0,1,0,0,0,0|3,0,0]=4 2046 B12R1.894 C=C(C)c1c(ccc(c1Cl)Cl)N 271570a_100000694244_200011093878 [0,1,0,0,0,0|3,0,0]=4 2047 B12R1.894 C=C(C)c1c(ccc(c1Cl)F)Br 271570a_100000694244_200037249116 [0,1,0,0,0,0|3,0,0]=4 2048 B12R1.894 C=C(C)c1c(ccc(c1Cl)F)F 271570a_100000694244_100010167948 [0,1,0,0,0,0|3,0,0]=4 2049 B12R1.894 C=C(C)c1c(ccc(c1F)Br)Cl 271570a_100000694244_100011092007 [0,1,0,0,0,0|3,0,0]=4 2050 B12R1.894 C=C(C)c1c(ccc(c1F)Br)F 271570a_100000694244_100000722365 [0,1,0,0,0,0|3,0,0]=4 2051 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)Br 271570a_100000694244_100011084128 [0,1,0,0,0,0|3,0,0]=4 2052 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)F 271570a_100000694244_200010167938 [0,1,0,0,0,0|3,0,0]=4 2053 B12R1.894 C=C(C)c1c(ccc(c1F)Cl)N 271570a_100000694244_100010134325 [0,1,0,0,0,0|3,0,0]=4 2054 B12R1.894 C=C(C)c1c(ccc(c1F)F)F 271570a_100000694244_100009814005 [0,1,0,0,0,0|3,0,0]=4 2055 B12R1.894 C=C(C)c1c(ccc(c1F)F)N 271570a_100000694244_100010232473 [0,1,0,0,0,0|3,0,0]=4 2056 B12R1.894 C=C(C)c1c(ccc(c1F)N)F 271570a_100000694244_100010070858 [0,1,0,0,0,0|3,0,0]=4 2057 B12R1.894 C=C(C)c1c(ccc(c1N)F)F 271570a_100000694244_100014094178 [0,1,0,0,0,0|3,0,0]=4 2058 B12R1.894 C=C(C)c1c(ccc(c1N)N)F 271570a_100000694244_100010128261 [0,1,0,0,0,0|3,0,0]=4 2059 B12R1.894 C=C(C)c1c(ccc(c1O)F)C 271570a_100000694244_200010223207 [0,1,0,0,0,0|3,0,0]=4 2060 B12R1.894 C=C(C)c1c(ccc(c1O)F)F 271570a_100000694244_100010170822 [0,1,0,0,0,0|3,0,0]=4 2061 B12R1.894 CC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_200000210301 [0,1,0,0,0,0|1,0,0]=2 2062 B12R1.894 CC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200000210301 [0,1,0,0,0,0|2,0,0]=3 2063 B12R1.894 CC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_200000210301 [0,1,0,0,0,0|2,0,0]=3 2064 B12R1.894 CC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_200000210301 [0,1,0,0,0,0|2,0,0]=3 2065 B12R1.894 CC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_200000210301 [0,1,0,0,0,0|2,0,0]=3 2066 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200000210301 [0,1,0,0,0,0|2,0,0]=3 2067 B12R1.894 CC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200000210301 [0,1,0,0,0,0|2,0,0]=3 2068 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_200000210301 [0,1,0,0,0,0|1,0,0]=2 2069 B12R1.894 CC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_200000210301 [0,1,0,0,0,0|1,0,0]=2 2070 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200000210301 [0,1,0,0,0,0|2,0,0]=3 2071 B12R1.894 CC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200000210301 [0,1,0,0,0,0|2,0,0]=3 2072 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200000210301 [0,1,0,0,0,0|2,0,0]=3 2073 B12R1.894 CC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200000210301 [0,1,0,0,0,0|2,0,0]=3 2074 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200000210301 [0,1,0,0,0,0|2,0,0]=3 2075 B12R1.894 CC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200000210301 [0,1,0,0,0,0|2,0,0]=3 2076 B12R1.894 CC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200000210301 [0,1,0,0,0,0|2,0,0]=3 2077 B12R1.894 CC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_200000210301 [0,1,0,0,0,0|1,0,0]=2 2078 B12R1.894 CC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_200000210301 [0,1,0,0,0,0|1,0,0]=2 2079 B12R1.894 CC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_200000210301 [0,1,0,0,0,0|1,0,0]=2 2080 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200000210301 [0,1,0,0,0,0|2,0,0]=3 2081 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200000210301 [0,1,0,0,0,0|2,0,0]=3 2082 B12R1.894 CC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200000210301 [0,1,0,0,0,0|2,0,0]=3 2083 B12R1.894 CC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200000210301 [0,1,0,0,0,0|2,0,0]=3 2084 B12R1.894 CC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200000210301 [0,1,0,0,0,0|2,0,0]=3 2085 B12R1.894 CC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200000210301 [0,1,0,0,0,0|2,0,0]=3 2086 B12R1.894 CC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200000210301 [0,1,0,0,0,0|2,0,0]=3 2087 B12R1.894 CC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200000210301 [0,1,0,0,0,0|1,0,0]=2 2088 B12R1.894 CC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200000210301 [0,1,0,0,0,0|2,0,0]=3 2089 B12R1.894 CC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200000210301 [0,1,0,0,0,0|2,0,0]=3 2090 B12R1.894 CC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200000210301 [0,1,0,0,0,0|2,0,0]=3 2091 B12R1.894 CC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200000210301 [0,1,0,0,0,0|2,0,0]=3 2092 B12R1.894 CC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200000210301 [0,1,0,0,0,0|1,0,0]=2 2093 B12R1.894 CC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_200000210301 [0,1,0,0,0,0|1,0,0]=2 2094 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200000210301 [0,1,0,0,0,0|2,0,0]=3 2095 B12R1.894 CC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200000210301 [0,1,0,0,0,0|1,0,0]=2 2096 B12R1.894 CC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200000210301 [0,1,0,0,0,0|2,0,0]=3 2097 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])Br)F 1458a_100010768524_200025704644 [0,1,0,0,0,0|2,0,0]=3 2098 B12R1.894 Cc1c(ccc(c1C(=O)[13CH3])F)Br 1458a_100010768519_200025704644 [0,1,0,0,0,0|2,0,0]=3 2099 B12R1.894 Cc1ccc(c(c1Br)C(=O)[13CH3])F 1458a_100000720849_200025704644 [0,1,0,0,0,0|1,0,0]=2 2100 B12R1.894 Cc1ccc(c(c1C(=O)[13CH3])C)Br 1458a_100012355652_200025704644 [0,1,0,0,0,0|2,0,0]=3 2101 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])Br 1458a_200010769262_200025704644 [0,1,0,0,0,0|1,0,0]=2 2102 B12R1.894 Cc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000036856_200025704644 [0,1,0,0,0,0|1,0,0]=2 2103 B12R1.894 Cc1ccc(c(c1F)B(O)O)O 271570a_203496583355_100009814727 [0,1,0,0,0,0|2,0,1]=4 2104 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010271678_200025704644 [0,1,0,0,0,0|1,0,0]=2 2105 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000039063_200025704644 [0,1,0,0,0,0|1,0,0]=2 2106 B12R1.894 Cc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000692215_200025704644 [0,1,0,0,0,0|1,0,0]=2 2107 B12R1.894 Cc1ccc(c(c1O)C(=O)[13CH3])C 1458a_100011255215_200025704644 [0,1,0,0,0,0|1,0,0]=2 2108 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_200025704644 [0,1,0,0,0,0|2,0,0]=3 2109 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_200025704644 [0,1,0,0,0,0|2,0,0]=3 2110 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_200025704644 [0,1,0,0,0,0|2,0,0]=3 2111 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_200025704644 [0,1,0,0,0,0|2,0,0]=3 2112 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_200025704644 [0,1,0,0,0,0|2,0,0]=3 2113 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_200025704644 [0,1,0,0,0,0|2,0,0]=3 2114 B12R1.894 [13CH3]C(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_200025704644 [0,1,0,0,0,0|2,0,0]=3 2115 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_200025704644 [0,1,0,0,0,0|2,0,0]=3 2116 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_200025704644 [0,1,0,0,0,0|2,0,0]=3 2117 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_200025704644 [0,1,0,0,0,0|2,0,0]=3 2118 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_200025704644 [0,1,0,0,0,0|2,0,0]=3 2119 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_200025704644 [0,1,0,0,0,0|2,0,0]=3 2120 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_200025704644 [0,1,0,0,0,0|2,0,0]=3 2121 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_200025704644 [0,1,0,0,0,0|2,0,0]=3 2122 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_200025704644 [0,1,0,0,0,0|2,0,0]=3 2123 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)F 1458a_100000031524_200025704644 [0,1,0,0,0,0|2,0,0]=3 2124 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)I 1458a_100010177766_200025704644 [0,1,0,0,0,0|2,0,0]=3 2125 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)F)O 1458a_100000062415_200025704644 [0,1,0,0,0,0|1,0,0]=2 2126 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_200025704644 [0,1,0,0,0,0|2,0,0]=3 2127 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_200025704644 [0,1,0,0,0,0|2,0,0]=3 2128 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)I)F 1458a_100012359589_200025704644 [0,1,0,0,0,0|2,0,0]=3 2129 B12R1.894 [13CH3]C(=O)c1c(ccc(c1F)O)F 1458a_100000068660_200025704644 [0,1,0,0,0,0|2,0,0]=3 2130 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_200025704644 [0,1,0,0,0,0|1,0,0]=2 2131 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_200025704644 [0,1,0,0,0,0|2,0,0]=3 2132 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_200025704644 [0,1,0,0,0,0|1,0,0]=2 2133 B12R1.894 [13CH3]C(=O)c1c(ccc(c1O)F)F 1458a_100011830443_200025704644 [0,1,0,0,0,0|2,0,0]=3 2134 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,0,0,1,0,0|3,0,0]=4 2135 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,0,0,1,0,0|2,0,1]=4 2136 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,0,0,1,0,0|2,0,0]=3 2137 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,0,0,1,0,0|2,1,0]=4 2138 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,0,0,1,0,0|3,0,0]=4 2139 B12R2.132 Cc1noc2c1cc(cc2)O 271570a_203496583355_100010196875 [0,0,0,1,0,0|2,0,0]=3 2140 B12R2.132 Nc1noc2c1cc(cc2)O 271570a_203496583355_100012356444 [0,0,0,1,0,0|3,0,0]=4 2141 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,0,0,1,0,0|2,0,0]=3 2142 B12R2.132 O=C1CCc2c1cc(cn2)O 271570a_203496583355_100010174022 [0,0,0,1,0,0|3,0,0]=4 2143 B12R2.132 O=C1CCc2c1nc(cc2)O 271570a_203496583355_100000701527 [0,0,0,1,0,0|3,0,0]=4 2144 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,0,0,1,0,0|1,0,0]=2 2145 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,0,0,1,0,0|3,0,0]=4 2146 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,0,0,1,0,0|3,0,0]=4 2147 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,0,0,1,0,0|3,0,0]=4 2148 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,0,0,1,0,0|2,0,0]=3 2149 B12R2.1316 Cc1cc(c(cn1)O)C2CC2 271570a_100011220607_100009843476 [0,0,0,1,0,0|2,0,1]=4 2150 B12R2.1316 Cc1ccc(c(c1)C2CC2)Br 271570a_100011220607_100012353751 [0,0,0,1,0,0|2,0,1]=4 2151 B12R2.1316 Cc1ccc(c(c1)C2CC2)C 271570a_100011220607_100000210833 [0,0,0,1,0,0|2,0,1]=4 2152 B12R2.1316 Cc1ccc(c(c1)C2CC2)Cl 271570a_100011220607_100012356289 [0,0,0,1,0,0|2,0,1]=4 2153 B12R2.1316 Cc1ccc(c(c1)C2CC2)F 271570a_100011220607_100000736223 [0,0,0,1,0,0|2,0,1]=4 2154 B12R2.1316 Cc1ccc(c(c1)C2CC2)N 271570a_100011220607_100000210942 [0,0,0,1,0,0|2,0,1]=4 2155 B12R2.1316 Cc1ccc(c(c1)C2CC2)O 271570a_100011220607_100000765521 [0,0,0,1,0,0|1,0,1]=3 2156 B12R2.1316 Cc1ccc(c(n1)C2CC2)O 271570a_100011220607_100000702858 [0,0,0,1,0,0|2,0,1]=4 2157 B12R2.1316 Cc1cnc(c(c1)C2CC2)O 271570a_100011220607_100000049931 [0,0,0,1,0,0|2,0,1]=4 2158 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_100011220607_100011534360 [0,0,0,1,0,0|2,0,1]=4 2159 B12R2.1316 Nc1ccc(c(c1)C2CC2)O 271570a_203496583355_100010281208 [0,0,0,1,0,0|2,0,1]=4 2160 B12R2.1316 Oc1ccc(c(c1)C2CC2)O 271570a_100011220607_100009813629 [0,0,0,1,0,0|2,0,1]=4 2161 B12R2.1316 Oc1ccc(cc1C2CC2)Br 271570a_100011220607_100012355227 [0,0,0,1,0,0|2,0,1]=4 2162 B12R2.1316 Oc1ccc(cc1C2CC2)Cl 271570a_100011220607_100011356953 [0,0,0,1,0,0|2,0,1]=4 2163 B12R2.1316 Oc1ccc(cc1C2CC2)F 271570a_100011220607_100000211999 [0,0,0,1,0,0|2,0,1]=4 2164 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,0,0,0,1,0|3,0,0]=4 2165 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,0,0,0,1,0|3,0,0]=4 2166 B10R1.192 C=C(C)c1c(noc1C)O 271570a_100000694244_100010730664 [0,0,0,0,1,0|3,0,0]=4 2167 B10R1.192 CC(=O)c1c(cnn1C)O 271570a_203496583355_100012349272 [0,0,0,0,1,0|2,0,0]=3 2168 B10R1.192 Cn1ncc(c1C(=O)N)O 271570a_203496583355_100010776205 [0,0,0,0,1,0|3,0,0]=4 2169 B12R1.127 CC(=Cc1cc(ccc1Br)Br)C 271570a_100102525489_100011483371 [0,0,0,0,0,1|3,0,0]=4 2170 B12R1.127 CC(=Cc1cc(ccc1Br)C)C 271570a_100102525489_100012353751 [0,0,0,0,0,1|2,0,0]=3 2171 B12R1.127 CC(=Cc1cc(ccc1Br)Cl)C 271570a_100102525489_100012339723 [0,0,0,0,0,1|3,0,0]=4 2172 B12R1.127 CC(=Cc1cc(ccc1Br)F)C 271570a_100102525489_100011217576 [0,0,0,0,0,1|3,0,0]=4 2173 B12R1.127 CC(=Cc1cc(ccc1Br)N)C 271570a_100102525489_100000750459 [0,0,0,0,0,1|3,0,0]=4 2174 B12R1.127 CC(=Cc1cc(ccc1Br)O)C 271570a_100102525489_100012339312 [0,0,0,0,0,1|3,0,0]=4 2175 B12R1.127 CC(=Cc1cc(ccc1C)Br)C 271570a_100102525489_100011344865 [0,0,0,0,0,1|3,0,0]=4 2176 B12R1.127 CC(=Cc1cc(ccc1C)C)C 271570a_100102525489_100000210833 [0,0,0,0,0,1|2,0,0]=3 2177 B12R1.127 CC(=Cc1cc(ccc1C)Cl)C 271570a_100102525489_100011263213 [0,0,0,0,0,1|3,0,0]=4 2178 B12R1.127 CC(=Cc1cc(ccc1C)F)C 271570a_100102525489_100011218078 [0,0,0,0,0,1|3,0,0]=4 2179 B12R1.127 CC(=Cc1cc(ccc1C)N)C 271570a_100102525489_100000736455 [0,0,0,0,0,1|3,0,0]=4 2180 B12R1.127 CC(=Cc1cc(ccc1C)O)C 271570a_100102525489_100011380479 [0,0,0,0,0,1|3,0,0]=4 2181 B12R1.127 CC(=Cc1cc(ccc1Cl)Br)C 271570a_100102525489_100011772130 [0,0,0,0,0,1|3,0,0]=4 2182 B12R1.127 CC(=Cc1cc(ccc1Cl)C)C 271570a_100102525489_100012356289 [0,0,0,0,0,1|2,0,0]=3 2183 B12R1.127 CC(=Cc1cc(ccc1Cl)Cl)C 271570a_100102525489_100000707729 [0,0,0,0,0,1|3,0,0]=4 2184 B12R1.127 CC(=Cc1cc(ccc1Cl)F)C 271570a_100102525489_100011217299 [0,0,0,0,0,1|3,0,0]=4 2185 B12R1.127 CC(=Cc1cc(ccc1Cl)N)C 271570a_100102525489_100012360549 [0,0,0,0,0,1|3,0,0]=4 2186 B12R1.127 CC(=Cc1cc(ccc1Cl)O)C 271570a_100102525489_100000049588 [0,0,0,0,0,1|3,0,0]=4 2187 B12R1.127 CC(=Cc1cc(ccc1F)Br)C 271570a_100102525489_100011217312 [0,0,0,0,0,1|3,0,0]=4 2188 B12R1.127 CC(=Cc1cc(ccc1F)C)C 271570a_100102525489_100000736223 [0,0,0,0,0,1|2,0,0]=3 2189 B12R1.127 CC(=Cc1cc(ccc1F)Cl)C 271570a_100102525489_100011218116 [0,0,0,0,0,1|3,0,0]=4 2190 B12R1.127 CC(=Cc1cc(ccc1F)F)C 271570a_100102525489_100000750033 [0,0,0,0,0,1|3,0,0]=4 2191 B12R1.127 CC(=Cc1cc(ccc1F)N)C 271570a_100102525489_100000760356 [0,0,0,0,0,1|3,0,0]=4 2192 B12R1.127 CC(=Cc1cc(ccc1F)O)C 271570a_100102525489_100000693481 [0,0,0,0,0,1|3,0,0]=4 2193 B12R1.127 CC(=Cc1cc(ccc1N)Br)C 271570a_100102525489_100000187925 [0,0,0,0,0,1|3,0,0]=4 2194 B12R1.127 CC(=Cc1cc(ccc1N)C)C 271570a_100102525489_100000210942 [0,0,0,0,0,1|2,0,0]=3 2195 B12R1.127 CC(=Cc1cc(ccc1N)Cl)C 271570a_100102525489_100000761889 [0,0,0,0,0,1|3,0,0]=4 2196 B12R1.127 CC(=Cc1cc(ccc1N)F)C 271570a_100102525489_100000760547 [0,0,0,0,0,1|3,0,0]=4 2197 B12R1.127 CC(=Cc1cc(ccc1N)N)C 271570a_100102525489_100011534242 [0,0,0,0,0,1|3,0,0]=4 2198 B12R1.127 CC(=Cc1cc(ccc1N)O)C 271570a_100102525489_100012001276 [0,0,0,0,0,1|3,0,0]=4 2199 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,0,0,0,0,1|2,0,0]=3 2200 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,0,0,0,0,1|1,0,0]=2 2201 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,0,0,0,0,1|2,0,0]=3 2202 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,0,0,0,0,1|2,0,0]=3 2203 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,0,0,0,0,1|2,0,0]=3 2204 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,0,0,0,0,1|2,0,0]=3 2205 B12R1.127 CC(=Cc1cc(cnc1C)C)C 271570a_100102525489_100009817436 [0,0,0,0,0,1|3,0,0]=4 2206 B12R1.127 CC(=Cc1cc(cnc1Cl)C)C 271570a_100102525489_100010210167 [0,0,0,0,0,1|3,0,0]=4 2207 B12R1.127 CC(=Cc1cc(cnc1F)C)C 271570a_100102525489_100000049784 [0,0,0,0,0,1|3,0,0]=4 2208 B12R1.127 CC(=Cc1cc(cnc1N)C)C 271570a_100102525489_100000049664 [0,0,0,0,0,1|3,0,0]=4 2209 B12R1.127 CC(=Cc1cc(cnc1O)Br)C 271570a_100102525489_100010197142 [0,0,0,0,0,1|3,0,0]=4 2210 B12R1.127 CC(=Cc1cc(cnc1O)C)C 271570a_100102525489_100000049931 [0,0,0,0,0,1|2,0,0]=3 2211 B12R1.127 CC(=Cc1cc(cnc1O)Cl)C 271570a_100102525489_100010188700 [0,0,0,0,0,1|3,0,0]=4 2212 B12R1.127 CC(=Cc1cc(ncc1C)C)C 271570a_100102525489_100009862788 [0,0,0,0,0,1|3,0,0]=4 2213 B12R1.127 CC(=Cc1cc(ncc1F)C)C 271570a_100102525489_100009867690 [0,0,0,0,0,1|3,0,0]=4 2214 B12R1.127 CC(=Cc1cc(ncc1O)C)C 271570a_100102525489_100009843476 [0,0,0,0,0,1|2,0,0]=3 2215 B12R1.127 CC(=Cc1cc(ncc1O)Cl)C 271570a_100102525489_100000698892 [0,0,0,0,0,1|3,0,0]=4 2216 B12R1.127 CC(=Cc1cn(ccc1=O)C)C 271570a_100102525489_100010750718 [0,0,0,0,0,1|2,0,1]=4 2217 B12R1.127 CC(=Cc1nc(ccc1C)C)C 271570a_100102525489_100009854376 [0,0,0,0,0,1|3,0,0]=4 2218 B12R1.127 CC(=Cc1nc(ccc1F)C)C 271570a_100102525489_100009817602 [0,0,0,0,0,1|3,0,0]=4 2219 B12R1.127 CC(=Cc1nc(ccc1N)C)C 271570a_100102525489_100000685570 [0,0,0,0,0,1|3,0,0]=4 2220 B12R1.127 CC(=Cc1nc(ccc1O)Br)C 271570a_100102525489_100010253912 [0,0,0,0,0,1|3,0,0]=4 2221 B12R1.127 CC(=Cc1nc(ccc1O)C)C 271570a_100102525489_100000702858 [0,0,0,0,0,1|2,0,0]=3 2222 B12R1.127 CC(=Cc1nc(ccc1O)Cl)C 271570a_100102525489_100000696390 [0,0,0,0,0,1|3,0,0]=4 2223 B12R1.127 CC(=Cc1nc(ccc1O)F)C 271570a_100102525489_100010382442 [0,0,0,0,0,1|3,0,0]=4 2224 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,0,0,0,0,1|2,0,0]=3 2225 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,0,0,0,0,1|2,0,0]=3 2226 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,0,0,0,0,1|1,0,0]=2 2227 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,0,0,0,0,1|2,0,0]=3 2228 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,0,0,0,0,1|2,0,0]=3 2229 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,0,0,0,0,1|2,0,0]=3 2230 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,0,0,0,0,1|2,0,0]=3 2231 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,0,0,0,0,1|2,0,0]=3 2232 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,0,0,0,0,1|2,0,0]=3 2233 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,0,0,0,0,1|1,0,0]=2 2234 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,0,0,0,0,1|1,0,0]=2 2235 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,0,0,0,0,1|2,0,0]=3 2236 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,0,0,0,0,1|2,0,0]=3 2237 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,0,0,0,0,1|2,0,0]=3 2238 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,0,0,0,0,1|2,0,0]=3 2239 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,0,0,0,0,1|2,0,0]=3 2240 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,0,0,0,0,1|1,0,0]=2 2241 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,0,0,0,0,1|2,0,0]=3 2242 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,0,0,0,0,1|2,0,0]=3 2243 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,0,0,0,0,1|2,0,0]=3 2244 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,0,0,0,0,1|2,0,0]=3 2245 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,0,0,0,0,1|2,0,0]=3 2246 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,0,0,0,0,1|2,0,0]=3 2247 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,0,0,0,0,1|2,0,0]=3 2248 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,0,0,0,0,1|1,0,0]=2 2249 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,0,0,0,0,1|1,0,0]=2 2250 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,0,0,0,0,1|2,0,0]=3 2251 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,0,0,0,0,1|2,0,0]=3 2252 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,0,0,0,0,1|2,0,0]=3 2253 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,0,0,0,0,1|2,0,0]=3 2254 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,0,0,0,0,1|2,0,0]=3 2255 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,0,0,0,0,1|2,0,0]=3 2256 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,0,0,0,0,1|2,0,0]=3 2257 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,0,0,0,0,1|2,0,0]=3 2258 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,0,0,0,0,1|1,0,0]=2 2259 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,0,0,0,0,1|1,0,0]=2 2260 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,0,0,0,0,1|1,0,0]=2 2261 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,0,0,0,0,1|1,0,0]=2 2262 B12R1.127 CC(=O)Cc1cc(cnc1Br)Br 1458a_100000070787_100010253922 [0,0,0,0,0,1|3,0,0]=4 2263 B12R1.127 CC(=O)Cc1cc(cnc1Cl)Br 1458a_100000070787_100009816982 [0,0,0,0,0,1|3,0,0]=4 2264 B12R1.127 CC(=O)Cc1nc(ccc1Cl)C 1458a_100000070787_200009852033 [0,0,0,0,0,1|2,0,0]=3 2265 B12R1.127 CC(=O)Cc1nc(ccc1Cl)Cl 1458a_100000070787_100000059412 [0,0,0,0,0,1|3,0,0]=4 2266 B12R1.127 CC(=O)Cc1nc(ccc1F)Br 1458a_100000070787_100010065826 [0,0,0,0,0,1|3,0,0]=4 2267 B12R1.127 CC(=O)Cc1nc(ccc1F)Cl 1458a_100000070787_100009881012 [0,0,0,0,0,1|3,0,0]=4 2268 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,0,0,0,0,1|1,0,0]=2 2269 B12R1.127 CC(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200000210301 [0,0,0,0,0,1|2,0,1]=4 2270 B12R1.127 CC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_200000210301 [0,0,0,0,0,1|1,0,1]=3 2271 B12R1.127 CC(=O)Cn1nc(ccc1=O)C 1458a_100000752069_200000210301 [0,0,0,0,0,1|2,0,1]=4 2272 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [0,0,0,0,0,1|2,0,0]=3 2273 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [0,0,0,0,0,1|2,0,0]=3 2274 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [0,0,0,0,0,1|1,0,0]=2 2275 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [0,0,0,0,0,1|1,0,0]=2 2276 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [0,0,0,0,0,1|2,0,0]=3 2277 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [0,0,0,0,0,1|2,0,0]=3 2278 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [0,0,0,0,0,1|2,0,0]=3 2279 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [0,0,0,0,0,1|2,0,0]=3 2280 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [0,0,0,0,0,1|2,0,0]=3 2281 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [0,0,0,0,0,1|2,0,0]=3 2282 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [0,0,0,0,0,1|2,0,0]=3 2283 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [0,0,0,0,0,1|2,0,0]=3 2284 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [0,0,0,0,0,1|2,0,0]=3 2285 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [0,0,0,0,0,1|2,0,0]=3 2286 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [0,0,0,0,0,1|2,0,0]=3 2287 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [0,0,0,0,0,1|2,0,0]=3 2288 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [0,0,0,0,0,1|1,0,0]=2 2289 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [0,0,0,0,0,1|1,0,0]=2 2290 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [0,0,0,0,0,1|1,0,0]=2 2291 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [0,0,0,0,0,1|2,0,0]=3 2292 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [0,0,0,0,0,1|2,0,0]=3 2293 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [0,0,0,0,0,1|2,0,0]=3 2294 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [0,0,0,0,0,1|2,0,0]=3 2295 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [0,0,0,0,0,1|2,0,0]=3 2296 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [0,0,0,0,0,1|2,0,0]=3 2297 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [0,0,0,0,0,1|2,0,0]=3 2298 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [0,0,0,0,0,1|2,0,0]=3 2299 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [0,0,0,0,0,1|2,0,0]=3 2300 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [0,0,0,0,0,1|2,0,0]=3 2301 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [0,0,0,0,0,1|2,0,0]=3 2302 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [0,0,0,0,0,1|2,0,0]=3 2303 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [0,0,0,0,0,1|2,0,0]=3 2304 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [0,0,0,0,0,1|2,0,0]=3 2305 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [0,0,0,0,0,1|2,0,0]=3 2306 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [0,0,0,0,0,1|2,0,0]=3 2307 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [0,0,0,0,0,1|1,0,0]=2 2308 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [0,0,0,0,0,1|1,0,0]=2 2309 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [0,0,0,0,0,1|1,0,0]=2 2310 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [0,0,0,0,0,1|2,0,0]=3 2311 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [0,0,0,0,0,1|2,0,0]=3 2312 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [0,0,0,0,0,1|2,0,0]=3 2313 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [0,0,0,0,0,1|2,0,0]=3 2314 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [0,0,0,0,0,1|2,0,0]=3 2315 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [0,0,0,0,0,1|2,0,0]=3 2316 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [0,0,0,0,0,1|2,0,0]=3 2317 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [0,0,0,0,0,1|2,0,0]=3 2318 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [0,0,0,0,0,1|2,0,0]=3 2319 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [0,0,0,0,0,1|2,0,0]=3 2320 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [0,0,0,0,0,1|1,0,0]=2 2321 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [0,0,0,0,0,1|1,0,0]=2 2322 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [0,0,0,0,0,1|1,0,0]=2 2323 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [0,0,0,0,0,1|1,0,0]=2 2324 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [0,0,0,0,0,1|2,0,0]=3 2325 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [0,0,0,0,0,1|2,0,0]=3 2326 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [0,0,0,0,0,1|2,0,0]=3 2327 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [0,0,0,0,0,1|2,0,0]=3 2328 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [0,0,0,0,0,1|2,0,0]=3 2329 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [0,0,0,0,0,1|2,0,0]=3 2330 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [0,0,0,0,0,1|2,0,0]=3 2331 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [0,0,0,0,0,1|2,0,0]=3 2332 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [0,0,0,0,0,1|2,0,0]=3 2333 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [0,0,0,0,0,1|2,0,0]=3 2334 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [0,0,0,0,0,1|2,0,0]=3 2335 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [0,0,0,0,0,1|2,0,0]=3 2336 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [0,0,0,0,0,1|2,0,0]=3 2337 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [0,0,0,0,0,1|1,0,0]=2 2338 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [0,0,0,0,0,1|1,0,0]=2 2339 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [0,0,0,0,0,1|2,0,0]=3 2340 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [0,0,0,0,0,1|2,0,0]=3 2341 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [0,0,0,0,0,1|2,0,0]=3 2342 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [0,0,0,0,0,1|2,0,0]=3 2343 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [0,0,0,0,0,1|2,0,0]=3 2344 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,0,0,0,0,1|1,0,0]=2 2345 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,0,0,0,0,1|1,0,0]=2 2346 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,0,0,0,0,1|0,0,0]=1 2347 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,0,0,0,0,1|0,0,0]=1 2348 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,0,0,0,0,1|0,0,0]=1 2349 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,0,0,0,0,1|1,0,0]=2 2350 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,0,0,0,0,1|1,0,0]=2 2351 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,0,0,0,0,1|1,0,0]=2 2352 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,0,0,0,0,1|1,0,0]=2 2353 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,0,0,0,0,1|1,0,0]=2 2354 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,0,0,0,0,1|1,0,0]=2 2355 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,0,0,0,0,1|1,0,0]=2 2356 B12R1.127 CC(=O)Nc1cc(cnc1C)O 271570a_203496583355_100010117071 [0,0,0,0,0,1|3,0,0]=4 2357 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [0,0,0,0,0,1|2,0,0]=3 2358 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,0,0,0,0,1|1,0,0]=2 2359 B12R1.127 CC(C)Nc1cc(ccc1O)Br 34a_100000752626_100000210206 [0,0,0,0,0,1|2,0,1]=4 2360 B12R1.127 CC(C)Nc1cc(ccc1O)Cl 34a_100000210500_100000210206 [0,0,0,0,0,1|2,0,1]=4 2361 B12R1.127 CC(C)Nc1cc(ccc1O)F 34a_100000759472_100000210206 [0,0,0,0,0,1|2,0,1]=4 2362 B12R1.127 CC(C)Oc1cc(ccc1O)F 271570a_203496583355_200012359391 [0,0,0,0,0,1|2,0,1]=4 2363 B12R1.127 CC(C)Sc1cc(ccc1O)Br 62a_100000210206_100012355227 [0,0,0,0,0,1|2,0,1]=4 2364 B12R1.127 CC(C)Sc1cc(ccc1O)Br 62a_100012355227_100000210206 [0,0,0,0,0,1|2,0,1]=4 2365 B12R1.127 CC(C)Sc1cc(ccc1O)Cl 62a_100000210206_100011356953 [0,0,0,0,0,1|2,0,1]=4 2366 B12R1.127 CC(C)Sc1cc(ccc1O)Cl 62a_100011356953_100000210206 [0,0,0,0,0,1|2,0,1]=4 2367 B12R1.127 CC(C)Sc1cc(ccc1O)F 62a_100000210206_100000211999 [0,0,0,0,0,1|2,0,1]=4 2368 B12R1.127 CC(C)Sc1cc(ccc1O)F 62a_100000211999_100000210206 [0,0,0,0,0,1|2,0,1]=4 2369 B12R1.127 CC(C)Sc1cc(ccc1O)N 62a_100000210206_100011534360 [0,0,0,0,0,1|2,0,1]=4 2370 B12R1.127 CC(C)Sc1cc(ccc1O)N 62a_100011534360_100000210206 [0,0,0,0,0,1|2,0,1]=4 2371 B12R1.127 CC(C)Sc1cc(ccc1O)O 62a_100000210206_100009813629 [0,0,0,0,0,1|2,0,1]=4 2372 B12R1.127 CN(C)Cc1cc(ccc1O)Br 2230a_100011602694_200000210301 [0,0,0,0,0,1|3,0,0]=4 2373 B12R1.127 CN(C)Cc1cc(ccc1O)Br 269982a_100011602694_200000210301 [0,0,0,0,0,1|3,0,0]=4 2374 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 2230a_100000712467_200000210301 [0,0,0,0,0,1|3,0,0]=4 2375 B12R1.127 CN(C)Cc1cc(ccc1O)Cl 269982a_100000712467_200000210301 [0,0,0,0,0,1|3,0,0]=4 2376 B12R1.127 CN(C)Cc1cc(ccc1O)F 2230a_114855342409_200000210301 [0,0,0,0,0,1|3,0,0]=4 2377 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_100102631434_100010161318 [0,0,0,0,0,1|3,0,0]=4 2378 B12R1.127 CN(C)Cc1cc(ccc1O)F 269982a_114855342409_200000210301 [0,0,0,0,0,1|3,0,0]=4 2379 B12R1.127 CN(C)Cc1cc(ccc1O)F 34a_114855342409_200000210301 [0,0,0,0,0,1|3,0,0]=4 2380 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [0,0,0,0,0,1|3,0,0]=4 2381 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 2230a_100011602694_200025704644 [0,0,0,0,0,1|3,0,0]=4 2382 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Br 269982a_100011602694_200025704644 [0,0,0,0,0,1|3,0,0]=4 2383 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 2230a_100000712467_200025704644 [0,0,0,0,0,1|3,0,0]=4 2384 B12R1.127 CN([13CH3])Cc1cc(ccc1O)Cl 269982a_100000712467_200025704644 [0,0,0,0,0,1|3,0,0]=4 2385 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 2230a_114855342409_200025704644 [0,0,0,0,0,1|3,0,0]=4 2386 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 269982a_114855342409_200025704644 [0,0,0,0,0,1|3,0,0]=4 2387 B12R1.127 CN([13CH3])Cc1cc(ccc1O)F 34a_114855342409_200025704644 [0,0,0,0,0,1|3,0,0]=4 2388 B12R1.127 Cc1cc(c(cn1)O)SC(C)C 62a_100000210206_100009843476 [0,0,0,0,0,1|2,0,1]=4 2389 B12R1.127 Cc1cc(c(cn1)O)SC(C)C 62a_100009843476_100000210206 [0,0,0,0,0,1|2,0,1]=4 2390 B12R1.127 Cc1ccc(=O)n(c1)CC(=O)[13CH3] 1458a_100009850670_200025704644 [0,0,0,0,0,1|1,0,1]=3 2391 B12R1.127 Cc1ccc(=O)n(n1)CC(=O)[13CH3] 1458a_100000752069_200025704644 [0,0,0,0,0,1|2,0,1]=4 2392 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,0,0,0,0,1|1,0,0]=2 2393 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,0,0,0,0,1|1,0,0]=2 2394 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,0,0,0,0,1|1,0,0]=2 2395 B12R1.127 Cc1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100011551863 [0,0,0,0,0,1|3,0,0]=4 2396 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 2230a_100102631434_100000184699 [0,0,0,0,0,1|3,0,0]=4 2397 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 269982a_100102631434_100000184699 [0,0,0,0,0,1|3,0,0]=4 2398 B12R1.127 Cc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100000211343 [0,0,0,0,0,1|3,0,0]=4 2399 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100009871730 [0,0,0,0,0,1|3,0,0]=4 2400 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100009871730 [0,0,0,0,0,1|3,0,0]=4 2401 B12R1.127 Cc1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100011551332 [0,0,0,0,0,1|3,0,0]=4 2402 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_100102631434_100011260760 [0,0,0,0,0,1|3,0,0]=4 2403 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 2230a_102515433075_200000210301 [0,0,0,0,0,1|3,0,0]=4 2404 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_100102631434_100011260760 [0,0,0,0,0,1|3,0,0]=4 2405 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 269982a_102515433075_200000210301 [0,0,0,0,0,1|3,0,0]=4 2406 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 270004a_100102631434_100000756917 [0,0,0,0,0,1|3,0,0]=4 2407 B12R1.127 Cc1ccc(c(c1)CN(C)C)F 34a_102515433075_200000210301 [0,0,0,0,0,1|3,0,0]=4 2408 B12R1.127 Cc1ccc(c(c1)CN(C)C)I 270004a_100102631434_100010150105 [0,0,0,0,0,1|3,0,0]=4 2409 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 2230a_102515433075_200025704644 [0,0,0,0,0,1|3,0,0]=4 2410 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 269982a_102515433075_200025704644 [0,0,0,0,0,1|3,0,0]=4 2411 B12R1.127 Cc1ccc(c(c1)CN(C)[13CH3])F 34a_102515433075_200025704644 [0,0,0,0,0,1|3,0,0]=4 2412 B12R1.127 Cc1ccc(c(c1)NC(C)C)Br 34a_100000745044_100000210206 [0,0,0,0,0,1|2,0,1]=4 2413 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 2230a_100000185781_100000210206 [0,0,0,0,0,1|2,0,1]=4 2414 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 34a_100000185781_100000210206 [0,0,0,0,0,1|2,0,1]=4 2415 B12R1.127 Cc1ccc(c(c1)NC(C)C)C 7a_100000185781_100000210206 [0,0,0,0,0,1|2,0,1]=4 2416 B12R1.127 Cc1ccc(c(c1)NC(C)C)Cl 34a_100011215360_100000210206 [0,0,0,0,0,1|2,0,1]=4 2417 B12R1.127 Cc1ccc(c(c1)NC(C)C)F 34a_100000211285_100000210206 [0,0,0,0,0,1|2,0,1]=4 2418 B12R1.127 Cc1ccc(c(c1)NC(C)C)I 34a_100011216686_100000210206 [0,0,0,0,0,1|2,0,1]=4 2419 B12R1.127 Cc1ccc(c(c1)NC(C)C)O 34a_100011215204_100000210206 [0,0,0,0,0,1|1,0,1]=3 2420 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 34a_100012002257_100000210206 [0,0,0,0,0,1|2,0,1]=4 2421 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 7a_100012002257_100000210206 [0,0,0,0,0,1|2,0,1]=4 2422 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 34a_100000210931_100000210206 [0,0,0,0,0,1|2,0,1]=4 2423 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 7a_100000210931_100000210206 [0,0,0,0,0,1|2,0,1]=4 2424 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 34a_100000211493_100000210206 [0,0,0,0,0,1|2,0,1]=4 2425 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 7a_100000211493_100000210206 [0,0,0,0,0,1|2,0,1]=4 2426 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 34a_100000759540_100000210206 [0,0,0,0,0,1|2,0,1]=4 2427 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 7a_100000759540_100000210206 [0,0,0,0,0,1|2,0,1]=4 2428 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 34a_100000211527_100000210206 [0,0,0,0,0,1|2,0,1]=4 2429 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 7a_100000211527_100000210206 [0,0,0,0,0,1|2,0,1]=4 2430 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100000210206_100012353751 [0,0,0,0,0,1|2,0,1]=4 2431 B12R1.127 Cc1ccc(c(c1)SC(C)C)Br 62a_100012353751_100000210206 [0,0,0,0,0,1|2,0,1]=4 2432 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210206_100000210833 [0,0,0,0,0,1|2,0,1]=4 2433 B12R1.127 Cc1ccc(c(c1)SC(C)C)C 62a_100000210833_100000210206 [0,0,0,0,0,1|2,0,1]=4 2434 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100000210206_100012356289 [0,0,0,0,0,1|2,0,1]=4 2435 B12R1.127 Cc1ccc(c(c1)SC(C)C)Cl 62a_100012356289_100000210206 [0,0,0,0,0,1|2,0,1]=4 2436 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000210206_100000736223 [0,0,0,0,0,1|2,0,1]=4 2437 B12R1.127 Cc1ccc(c(c1)SC(C)C)F 62a_100000736223_100000210206 [0,0,0,0,0,1|2,0,1]=4 2438 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100000210206_100011356834 [0,0,0,0,0,1|2,0,1]=4 2439 B12R1.127 Cc1ccc(c(c1)SC(C)C)N 62a_100011356834_100000210206 [0,0,0,0,0,1|2,0,1]=4 2440 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000765521 [0,0,0,0,0,1|1,0,1]=3 2441 B12R1.127 Cc1ccc(c(c1)SC(C)C)O 62a_100000765521_100000210206 [0,0,0,0,0,1|1,0,1]=3 2442 B12R1.127 Cc1ccc(c(n1)CN(C)C)O 2230a_100102631434_100020630696 [0,0,0,0,0,1|3,0,0]=4 2443 B12R1.127 Cc1ccc(c(n1)CN(C)C)O 269982a_100102631434_100020630696 [0,0,0,0,0,1|3,0,0]=4 2444 B12R1.127 Cc1ccc(c(n1)SC(C)C)O 62a_100000210206_100000702858 [0,0,0,0,0,1|2,0,1]=4 2445 B12R1.127 Cc1ccc(c(n1)SC(C)C)O 62a_100000702858_100000210206 [0,0,0,0,0,1|2,0,1]=4 2446 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,0,0,0,0,1|2,0,0]=3 2447 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,0,0,0,0,1|2,0,0]=3 2448 B12R1.127 Cc1cnc(c(c1)SC(C)C)O 62a_100000210206_100000719714 [0,0,0,0,0,1|2,0,1]=4 2449 B12R1.127 Cc1cnc(c(c1)SC(C)C)O 62a_100000719714_100000210206 [0,0,0,0,0,1|2,0,1]=4 2450 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,0,0,0,0,1|2,0,0]=3 2451 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,0,0,0,0,1|2,0,0]=3 2452 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,0,0,0,0,1|2,0,0]=3 2453 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,0,0,0,0,1|2,0,0]=3 2454 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,0,0,0,0,1|2,0,0]=3 2455 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,0,0,0,0,1|2,0,0]=3 2456 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,0,0,0,0,1|2,0,0]=3 2457 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,0,0,0,0,1|2,0,0]=3 2458 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,0,0,0,0,1|2,0,0]=3 2459 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,0,0,0,0,1|1,0,0]=2 2460 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,0,0,0,0,1|1,0,0]=2 2461 B12R1.127 [13CH3]C(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200025704644 [0,0,0,0,0,1|2,0,1]=4 2462 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [2,0,0,0,0,0|1,0,1]=4 2463 B9R1.2 C=Cc1ccc[n+](c1)C 271570a_100011290941_100009996589 [2,0,0,0,0,0|1,0,1]=4 2464 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,0,0,0,0,0|1,0,1]=4 2465 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|0,0,1]=3 2466 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,0,0,0,0,0|1,0,1]=4 2467 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,0,0,0,0,0|1,0,1]=4 2468 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,0,0,0,0,0|1,0,1]=4 2469 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|1,0,1]=4 2470 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,0,0,0,0,0|1,0,1]=4 2471 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [2,0,0,0,0,0|1,0,1]=4 2472 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [2,0,0,0,0,0|1,0,1]=4 2473 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [2,0,0,0,0,0|1,0,1]=4 2474 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|1,0,1]=4 2475 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 2476 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,0,0,0,0,0|1,0,0]=3 2477 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,0,0,0,0,0|1,0,0]=3 2478 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,0,0,0,0,0|2,0,0]=4 2479 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,0,0,0,0,0|2,0,0]=4 2480 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,0,0,0,0,0|2,0,0]=4 2481 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,0,0,0,0,0|2,0,0]=4 2482 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,0,0,0,0,0|2,0,0]=4 2483 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [2,0,0,0,0,0|2,0,0]=4 2484 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,0,0,0,0,0|2,0,0]=4 2485 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,0,0,0,0,0|2,0,0]=4 2486 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,0,0,0,0,0|1,0,0]=3 2487 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,0,0,0,0,0|1,0,0]=3 2488 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,0,0,0,0,0|2,0,0]=4 2489 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,0,0,0,0,0|2,0,0]=4 2490 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,0,0,0,0,0|2,0,0]=4 2491 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,0,0,0,0,0|2,0,0]=4 2492 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,0,0,0,0,0|2,0,0]=4 2493 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,0,0,0,0,0|2,0,0]=4 2494 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,0,0,0,0,0|2,0,0]=4 2495 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,0,0,0,0,0|2,0,0]=4 2496 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [2,0,0,0,0,0|2,0,0]=4 2497 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [2,0,0,0,0,0|2,0,0]=4 2498 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [2,0,0,0,0,0|2,0,0]=4 2499 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [2,0,0,0,0,0|2,0,0]=4 2500 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [2,0,0,0,0,0|2,0,0]=4 2501 B9R1.2 CSc1ccc[n+](c1)C 62a_100009996589_200000210301 [2,0,0,0,0,0|2,0,0]=4 2502 B9R1.2 CSc1ccc[n+](c1)C 62a_200000210301_100009996589 [2,0,0,0,0,0|2,0,0]=4 2503 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,0,0,0,0,0|2,0,0]=4 2504 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,0,0,0,0,0|2,0,0]=4 2505 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,0,0,0,0,0|1,0,0]=3 2506 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,0,0,0,0,0|1,0,0]=3 2507 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,0,0,0,0,0|2,0,0]=4 2508 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,0,0,0,0,0|2,0,0]=4 2509 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,0,0,0,0,0|2,0,0]=4 2510 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,0,0,0,0,0|2,0,0]=4 2511 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 2512 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,0,0,0,0,0|2,0,0]=4 2513 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,0,0,0,0,0|2,0,0]=4 2514 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,0,0,0,0,0|2,0,0]=4 2515 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,0,0,0,0,0|2,0,0]=4 2516 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,0,0,0,0,0|2,0,0]=4 2517 B9R1.2 CSc1cccc(n1)C 62a_100000742759_200000210301 [2,0,0,0,0,0|2,0,0]=4 2518 B9R1.2 CSc1cccc(n1)C 62a_200000210301_100000742759 [2,0,0,0,0,0|2,0,0]=4 2519 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [2,0,0,0,0,0|2,0,0]=4 2520 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [2,0,0,0,0,0|2,0,0]=4 2521 B9R1.2 CSc1cncc(c1)C 62a_100000760492_200000210301 [2,0,0,0,0,0|2,0,0]=4 2522 B9R1.2 CSc1cncc(c1)C 62a_200000210301_100000760492 [2,0,0,0,0,0|2,0,0]=4 2523 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_100009996589_200025704644 [2,0,0,0,0,0|2,0,0]=4 2524 B9R1.2 C[n+]1cccc(c1)S[13CH3] 62a_200025704644_100009996589 [2,0,0,0,0,0|2,0,0]=4 2525 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [2,0,0,0,0,0|2,0,0]=4 2526 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [2,0,0,0,0,0|2,0,0]=4 2527 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [2,0,0,0,0,0|2,0,0]=4 2528 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,0,0,0,0,0|1,0,0]=3 2529 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,0,0,0,0,0|1,0,0]=3 2530 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,0,0,0,0,0|1,0,0]=3 2531 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,0,0,0,0,0|1,0,0]=3 2532 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,0,0,0,0,0|1,0,0]=3 2533 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,0,0,0,0,0|1,0,0]=3 2534 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_100000742759_200025704644 [2,0,0,0,0,0|2,0,0]=4 2535 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_200025704644_100000742759 [2,0,0,0,0,0|2,0,0]=4 2536 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [2,0,0,0,0,0|2,0,0]=4 2537 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [2,0,0,0,0,0|2,0,0]=4 2538 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [2,0,0,0,0,0|2,0,0]=4 2539 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [2,0,0,0,0,0|2,0,0]=4 2540 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_100000760492_200025704644 [2,0,0,0,0,0|2,0,0]=4 2541 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_200025704644_100000760492 [2,0,0,0,0,0|2,0,0]=4 2542 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [2,0,0,0,0,0|2,0,0]=4 2543 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|1,0,0]=3 2544 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [2,0,0,0,0,0|2,0,0]=4 2545 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [2,0,0,0,0,0|2,0,0]=4 2546 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [2,0,0,0,0,0|2,0,0]=4 2547 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 2548 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,0,0,0,0,0|2,0,0]=4 2549 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,0,0,0,0,0|2,0,0]=4 2550 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,0,0,0,0,0|2,0,0]=4 2551 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,0,0,0,0,0|2,0,0]=4 2552 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,0,0,0,0,0|2,0,0]=4 2553 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,0,0,0,0,0|2,0,0]=4 2554 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,0,0,0,0,0|2,0,0]=4 2555 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,0,0,0,0,0|2,0,0]=4 2556 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,0,0,0,0,0|2,0,0]=4 2557 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,0,0,0,0,0|2,0,0]=4 2558 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,0,0,0,0,0|2,0,0]=4 2559 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,0,0,0,0,0|2,0,0]=4 2560 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,0,0,0,0,0|2,0,0]=4 2561 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,0,0,0,0,0|2,0,0]=4 2562 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,0,0,0,0,0|2,0,0]=4 2563 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,0,0,0,0,0|2,0,0]=4 2564 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,0,0,0,0,0|2,0,0]=4 2565 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,0,0,0,0,0|2,0,0]=4 2566 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,0,0,0,0,0|2,0,0]=4 2567 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 2568 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,0,0,0,0,0|2,0,0]=4 2569 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,0,0,0,0,0|2,0,0]=4 2570 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,0,0,0,0,0|2,0,0]=4 2571 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,0,0,0,0,0|2,0,0]=4 2572 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [2,0,0,0,0,0|1,0,1]=4 2573 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [2,0,0,0,0,0|1,0,1]=4 2574 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [2,0,0,0,0,0|1,0,1]=4 2575 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [2,0,0,0,0,0|1,0,1]=4 2576 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [2,0,0,0,0,0|1,0,1]=4 2577 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,0,0,0,0,0|0,0,1]=3 2578 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [2,0,0,0,0,0|1,0,1]=4 2579 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [2,0,0,0,0,0|1,0,1]=4 2580 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [2,0,0,0,0,0|0,0,1]=3 2581 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [2,0,0,0,0,0|1,0,1]=4 2582 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [2,0,0,0,0,0|1,0,1]=4 2583 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [2,0,0,0,0,0|1,0,1]=4 2584 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [2,0,0,0,0,0|2,0,0]=4 2585 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [2,0,0,0,0,0|2,0,0]=4 2586 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [2,0,0,0,0,0|2,0,0]=4 2587 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [2,0,0,0,0,0|2,0,0]=4 2588 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [2,0,0,0,0,0|2,0,0]=4 2589 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [2,0,0,0,0,0|1,0,0]=3 2590 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [2,0,0,0,0,0|1,0,0]=3 2591 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [2,0,0,0,0,0|2,0,0]=4 2592 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [2,0,0,0,0,0|2,0,0]=4 2593 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [2,0,0,0,0,0|2,0,0]=4 2594 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [2,0,0,0,0,0|2,0,0]=4 2595 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [2,0,0,0,0,0|2,0,0]=4 2596 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [2,0,0,0,0,0|2,0,0]=4 2597 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [2,0,0,0,0,0|2,0,0]=4 2598 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [2,0,0,0,0,0|2,0,0]=4 2599 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [2,0,0,0,0,0|2,0,0]=4 2600 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [2,0,0,0,0,0|2,0,0]=4 2601 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [2,0,0,0,0,0|2,0,0]=4 2602 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [2,0,0,0,0,0|2,0,0]=4 2603 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [2,0,0,0,0,0|2,0,0]=4 2604 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [2,0,0,0,0,0|2,0,0]=4 2605 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [2,0,0,0,0,0|2,0,0]=4 2606 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [2,0,0,0,0,0|1,0,0]=3 2607 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [2,0,0,0,0,0|2,0,0]=4 2608 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [2,0,0,0,0,0|2,0,0]=4 2609 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [2,0,0,0,0,0|2,0,0]=4 2610 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [2,0,0,0,0,0|2,0,0]=4 2611 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [2,0,0,0,0,0|2,0,0]=4 2612 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [2,0,0,0,0,0|2,0,0]=4 2613 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [2,0,0,0,0,0|2,0,0]=4 2614 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [2,0,0,0,0,0|2,0,0]=4 2615 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [2,0,0,0,0,0|2,0,0]=4 2616 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [2,0,0,0,0,0|2,0,0]=4 2617 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [2,0,0,0,0,0|2,0,0]=4 2618 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [2,0,0,0,0,0|2,0,0]=4 2619 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [2,0,0,0,0,0|2,0,0]=4 2620 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [2,0,0,0,0,0|2,0,0]=4 2621 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [2,0,0,0,0,0|1,0,0]=3 2622 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [2,0,0,0,0,0|1,0,0]=3 2623 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [2,0,0,0,0,0|1,0,0]=3 2624 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [2,0,0,0,0,0|2,0,0]=4 2625 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [2,0,0,0,0,0|2,0,0]=4 2626 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [2,0,0,0,0,0|2,0,0]=4 2627 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [2,0,0,0,0,0|2,0,0]=4 2628 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [2,0,0,0,0,0|2,0,0]=4 2629 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [2,0,0,0,0,0|2,0,0]=4 2630 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [2,0,0,0,0,0|2,0,0]=4 2631 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [2,0,0,0,0,0|2,0,0]=4 2632 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [2,0,0,0,0,0|2,0,0]=4 2633 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [2,0,0,0,0,0|2,0,0]=4 2634 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [2,0,0,0,0,0|2,0,0]=4 2635 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [2,0,0,0,0,0|2,0,0]=4 2636 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [2,0,0,0,0,0|1,0,1]=4 2637 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [2,0,0,0,0,0|1,0,1]=4 2638 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [2,0,0,0,0,0|2,0,0]=4 2639 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,0,0,0,0,0|0,0,0]=2 2640 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [2,0,0,0,0,0|1,0,0]=3 2641 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [2,0,0,0,0,0|1,0,0]=3 2642 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [2,0,0,0,0,0|1,0,0]=3 2643 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [2,0,0,0,0,0|1,0,0]=3 2644 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [2,0,0,0,0,0|0,0,2]=4 2645 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [2,0,0,0,0,0|2,0,0]=4 2646 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [2,0,0,0,0,0|2,0,0]=4 2647 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [2,0,0,0,0,0|2,0,0]=4 2648 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [2,0,0,0,0,0|2,0,0]=4 2649 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [2,0,0,0,0,0|1,0,0]=3 2650 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [2,0,0,0,0,0|2,0,0]=4 2651 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [2,0,0,0,0,0|2,0,0]=4 2652 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [2,0,0,0,0,0|2,0,0]=4 2653 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [2,0,0,0,0,0|2,0,0]=4 2654 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [2,0,0,0,0,0|2,0,0]=4 2655 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [2,0,0,0,0,0|2,0,0]=4 2656 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [2,0,0,0,0,0|2,0,0]=4 2657 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [2,0,0,0,0,0|2,0,0]=4 2658 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [2,0,0,0,0,0|2,0,0]=4 2659 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [2,0,0,0,0,0|2,0,0]=4 2660 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [2,0,0,0,0,0|2,0,0]=4 2661 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [2,0,0,0,0,0|2,0,0]=4 2662 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [2,0,0,0,0,0|2,0,0]=4 2663 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [2,0,0,0,0,0|2,0,0]=4 2664 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [2,0,0,0,0,0|2,0,0]=4 2665 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [2,0,0,0,0,0|2,0,0]=4 2666 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [2,0,0,0,0,0|2,0,0]=4 2667 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [2,0,0,0,0,0|2,0,0]=4 2668 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [2,0,0,0,0,0|1,0,0]=3 2669 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [2,0,0,0,0,0|1,0,0]=3 2670 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [2,0,0,0,0,0|2,0,0]=4 2671 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [2,0,0,0,0,0|2,0,0]=4 2672 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [2,0,0,0,0,0|2,0,0]=4 2673 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [2,0,0,0,0,0|2,0,0]=4 2674 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [2,0,0,0,0,0|2,0,0]=4 2675 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [2,0,0,0,0,0|2,0,0]=4 2676 B9R1.69 Cc1c[n+](ccc1O)[O-] 271570a_203496583355_100000074940 [2,0,0,0,0,0|2,0,0]=4 2677 B9R1.69 Cc1cc(c(cn1)O)C 271570a_203496583355_100009819613 [2,0,0,0,0,0|1,0,0]=3 2678 B9R1.69 Cc1cc(c(cn1)O)N 271570a_203496583355_100009817891 [2,0,0,0,0,0|2,0,0]=4 2679 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100009843476 [2,0,0,0,0,0|1,0,1]=4 2680 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100011016184 [2,0,0,0,0,0|1,0,1]=4 2681 B9R1.69 Cc1cc(ccc1Br)O 271570a_203496583355_100009813585 [2,0,0,0,0,0|2,0,0]=4 2682 B9R1.69 Cc1cc(ccc1Cl)O 271570a_203496583355_100000049509 [2,0,0,0,0,0|2,0,0]=4 2683 B9R1.69 Cc1cc(ccc1F)O 271570a_203496583355_100011218330 [2,0,0,0,0,0|2,0,0]=4 2684 B9R1.69 Cc1cc(ccc1N)O 271570a_203496583355_100000211769 [2,0,0,0,0,0|2,0,0]=4 2685 B9R1.69 Cc1cc(ccc1O)Br 271570a_203496583355_100000701812 [2,0,0,0,0,0|1,0,0]=3 2686 B9R1.69 Cc1cc(ccc1O)Cl 271570a_203496583355_100011219607 [2,0,0,0,0,0|1,0,0]=3 2687 B9R1.69 Cc1cc(ccc1O)F 271570a_203496583355_100011205405 [2,0,0,0,0,0|1,0,0]=3 2688 B9R1.69 Cc1cc(ccc1O)N 271570a_203496583355_100000210723 [2,0,0,0,0,0|1,0,0]=3 2689 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000186361 [2,0,0,0,0,0|1,0,0]=3 2690 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000729255 [2,0,0,0,0,0|1,0,0]=3 2691 B9R1.69 Cc1cc(cnc1O)Br 271570a_203496583355_100012353652 [2,0,0,0,0,0|2,0,0]=4 2692 B9R1.69 Cc1cc(cnc1O)F 271570a_203496583355_100009817009 [2,0,0,0,0,0|2,0,0]=4 2693 B9R1.69 Cc1cc(cnc1O)N 271570a_203496583355_100000761747 [2,0,0,0,0,0|2,0,0]=4 2694 B9R1.69 Cc1cc(cnc1O)O 271570a_203496583355_100000685391 [2,0,0,0,0,0|2,0,0]=4 2695 B9R1.69 Cc1cc(cnc1O)O 271570a_203496583355_100012000486 [2,0,0,0,0,0|2,0,0]=4 2696 B9R1.69 Cc1cc(ncc1O)Br 271570a_203496583355_100009816104 [2,0,0,0,0,0|2,0,0]=4 2697 B9R1.69 Cc1cc(ncc1O)Cl 271570a_203496583355_100010172789 [2,0,0,0,0,0|2,0,0]=4 2698 B9R1.69 Cc1cc(ncc1O)F 271570a_203496583355_100009820716 [2,0,0,0,0,0|2,0,0]=4 2699 B9R1.69 Cc1cc(ncc1O)N 271570a_203496583355_100000050067 [2,0,0,0,0,0|2,0,0]=4 2700 B9R1.69 Cc1cc(ncc1O)O 271570a_203496583355_100000692680 [2,0,0,0,0,0|2,0,0]=4 2701 B9R1.69 Cc1cc(ncc1O)O 271570a_203496583355_100010114363 [2,0,0,0,0,0|2,0,0]=4 2702 B9R1.69 Cc1ccc([n+](c1)[O-])O 271570a_203496583355_100009819918 [2,0,0,0,0,0|1,0,1]=4 2703 B9R1.69 Cc1ccc(c(c1)Br)O 271570a_203496583355_100009813563 [2,0,0,0,0,0|1,0,0]=3 2704 B9R1.69 Cc1ccc(c(c1)C)O 271570a_203496583355_100011217332 [2,0,0,0,0,0|0,0,0]=2 2705 B9R1.69 Cc1ccc(c(c1)Cl)O 271570a_203496583355_100011263221 [2,0,0,0,0,0|1,0,0]=3 2706 B9R1.69 Cc1ccc(c(c1)F)O 271570a_203496583355_100011216119 [2,0,0,0,0,0|1,0,0]=3 2707 B9R1.69 Cc1ccc(c(c1)N)O 271570a_203496583355_100011216686 [2,0,0,0,0,0|1,0,0]=3 2708 B9R1.69 Cc1ccc(c(c1)O)Br 271570a_203496583355_100012353751 [2,0,0,0,0,0|1,0,1]=4 2709 B9R1.69 Cc1ccc(c(c1)O)C 271570a_203496583355_100000210833 [2,0,0,0,0,0|1,0,1]=4 2710 B9R1.69 Cc1ccc(c(c1)O)Cl 271570a_203496583355_100012356289 [2,0,0,0,0,0|1,0,1]=4 2711 B9R1.69 Cc1ccc(c(c1)O)F 271570a_203496583355_100000736223 [2,0,0,0,0,0|1,0,1]=4 2712 B9R1.69 Cc1ccc(c(c1)O)N 271570a_203496583355_100000210942 [2,0,0,0,0,0|1,0,1]=4 2713 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100000765521 [2,0,0,0,0,0|0,0,1]=3 2714 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100012002257 [2,0,0,0,0,0|0,0,1]=3 2715 B9R1.69 Cc1ccc(c(n1)C)O 271570a_203496583355_100009813853 [2,0,0,0,0,0|1,0,0]=3 2716 B9R1.69 Cc1ccc(c(n1)F)O 271570a_203496583355_100010006597 [2,0,0,0,0,0|2,0,0]=4 2717 B9R1.69 Cc1ccc(c(n1)N)O 271570a_203496583355_100009816662 [2,0,0,0,0,0|2,0,0]=4 2718 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100000702858 [2,0,0,0,0,0|1,0,1]=4 2719 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100009817604 [2,0,0,0,0,0|1,0,1]=4 2720 B9R1.69 Cc1ccc(cc1C)O 271570a_203496583355_100011215607 [2,0,0,0,0,0|2,0,0]=4 2721 B9R1.69 Cc1cnc(c(c1)C)O 271570a_203496583355_100009864548 [2,0,0,0,0,0|1,0,0]=3 2722 B9R1.69 Cc1cnc(c(c1)F)O 271570a_203496583355_100009819633 [2,0,0,0,0,0|2,0,0]=4 2723 B9R1.69 Cc1cnc(c(c1)N)O 271570a_203496583355_100000733613 [2,0,0,0,0,0|2,0,0]=4 2724 B9R1.69 Cc1cnc(c(c1)O)O 271570a_203496583355_100000049931 [2,0,0,0,0,0|1,0,1]=4 2725 B9R1.69 Cc1cnc(c(c1)O)O 271570a_203496583355_100012000487 [2,0,0,0,0,0|1,0,1]=4 2726 B9R1.69 Cc1cnc(c(n1)C)O 271570a_203496583355_100000065684 [2,0,0,0,0,0|2,0,0]=4 2727 B9R1.69 Cc1nc(ccc1O)Cl 271570a_203496583355_100000062408 [2,0,0,0,0,0|2,0,0]=4 2728 B9R1.69 Cc1nc(ccc1O)F 271570a_203496583355_100000688911 [2,0,0,0,0,0|2,0,0]=4 2729 B9R1.69 Cc1nc(ccc1O)N 271570a_203496583355_100000013003 [2,0,0,0,0,0|2,0,0]=4 2730 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100000691680 [2,0,0,0,0,0|2,0,0]=4 2731 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100010233687 [2,0,0,0,0,0|2,0,0]=4 2732 B9R1.69 Cc1ncc(c(=O)[nH]1)O 271570a_203496583355_100011999157 [2,0,0,0,0,0|2,0,0]=4 2733 B9R1.69 Nc1cc(ccc1O)Br 271570a_203496583355_100000743836 [2,0,0,0,0,0|2,0,0]=4 2734 B9R1.69 Nc1cc(ccc1O)Cl 271570a_203496583355_100000761886 [2,0,0,0,0,0|2,0,0]=4 2735 B9R1.69 Nc1cc(ccc1O)F 271570a_203496583355_100011218093 [2,0,0,0,0,0|2,0,0]=4 2736 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100000752626 [2,0,0,0,0,0|2,0,0]=4 2737 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100011999798 [2,0,0,0,0,0|2,0,0]=4 2738 B9R1.69 Nc1ccc(c(c1)Br)O 271570a_203496583355_100000750458 [2,0,0,0,0,0|2,0,0]=4 2739 B9R1.69 Nc1ccc(c(c1)Cl)O 271570a_203496583355_100000761885 [2,0,0,0,0,0|2,0,0]=4 2740 B9R1.69 Nc1ccc(c(c1)F)O 271570a_203496583355_100011356925 [2,0,0,0,0,0|2,0,0]=4 2741 B9R1.69 Nc1ccc(c(c1)N)O 271570a_203496583355_200012175722 [2,0,0,0,0,0|2,0,0]=4 2742 B9R1.69 Nc1ccc(c(c1)O)O 271570a_203496583355_100011534360 [2,0,0,0,0,0|1,0,1]=4 2743 B9R1.69 Oc1ccc(c(c1)Br)O 271570a_203496583355_100000701344 [2,0,0,0,0,0|2,0,0]=4 2744 B9R1.69 Oc1ccc(c(c1)Br)O 271570a_203496583355_100012361655 [2,0,0,0,0,0|2,0,0]=4 2745 B9R1.69 Oc1ccc(c(c1)Cl)O 271570a_203496583355_100000047559 [2,0,0,0,0,0|2,0,0]=4 2746 B9R1.69 Oc1ccc(c(c1)Cl)O 271570a_203496583355_100012360047 [2,0,0,0,0,0|2,0,0]=4 2747 B9R1.69 Oc1ccc(c(c1)F)O 271570a_203496583355_100000185481 [2,0,0,0,0,0|2,0,0]=4 2748 B9R1.69 Oc1ccc(c(c1)F)O 271570a_203496583355_100000755031 [2,0,0,0,0,0|2,0,0]=4 2749 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813601 [2,0,0,0,0,0|1,0,1]=4 2750 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813629 [2,0,0,0,0,0|1,0,1]=4 2751 B9R1.69 Oc1ccc(c(c1)O)O 271570a_203496583355_100009813921 [2,0,0,0,0,0|1,0,1]=4 2752 B9R1.69 Oc1ccc(cc1Br)Br 271570a_203496583355_100011484698 [2,0,0,0,0,0|2,0,0]=4 2753 B9R1.69 Oc1ccc(cc1Br)Cl 271570a_203496583355_100011219703 [2,0,0,0,0,0|2,0,0]=4 2754 B9R1.69 Oc1ccc(cc1Br)F 271570a_203496583355_100011217111 [2,0,0,0,0,0|2,0,0]=4 2755 B9R1.69 Oc1ccc(cc1Cl)Br 271570a_203496583355_100011216062 [2,0,0,0,0,0|2,0,0]=4 2756 B9R1.69 Oc1ccc(cc1Cl)Cl 271570a_203496583355_100000699841 [2,0,0,0,0,0|2,0,0]=4 2757 B9R1.69 Oc1ccc(cc1Cl)F 271570a_203496583355_100000733362 [2,0,0,0,0,0|2,0,0]=4 2758 B9R1.69 Oc1ccc(cc1F)Br 271570a_203496583355_100009814013 [2,0,0,0,0,0|2,0,0]=4 2759 B9R1.69 Oc1ccc(cc1F)Cl 271570a_203496583355_100011216042 [2,0,0,0,0,0|2,0,0]=4 2760 B9R1.69 Oc1ccc(cc1F)F 271570a_203496583355_100000750030 [2,0,0,0,0,0|2,0,0]=4 2761 B9R1.69 Oc1ccc(cc1O)Br 271570a_203496583355_100012344904 [2,0,0,0,0,0|1,0,1]=4 2762 B9R1.69 Oc1ccc(cc1O)Br 271570a_203496583355_100012355227 [2,0,0,0,0,0|1,0,1]=4 2763 B9R1.69 Oc1ccc(cc1O)Cl 271570a_203496583355_100000050036 [2,0,0,0,0,0|1,0,1]=4 2764 B9R1.69 Oc1ccc(cc1O)Cl 271570a_203496583355_100011356953 [2,0,0,0,0,0|1,0,1]=4 2765 B9R1.69 Oc1ccc(cc1O)F 271570a_203496583355_100000211999 [2,0,0,0,0,0|1,0,1]=4 2766 B9R1.69 Oc1ccc(cc1O)F 271570a_203496583355_100000690578 [2,0,0,0,0,0|1,0,1]=4 2767 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [2,0,0,0,0,0|1,0,0]=3 2768 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [2,0,0,0,0,0|2,0,0]=4 2769 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [2,0,0,0,0,0|2,0,0]=4 2770 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [2,0,0,0,0,0|2,0,0]=4 2771 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [2,0,0,0,0,0|0,0,0]=2 2772 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 2773 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 2774 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [2,0,0,0,0,0|2,0,0]=4 2775 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 2776 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 2777 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [2,0,0,0,0,0|2,0,0]=4 2778 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [2,0,0,0,0,0|0,0,0]=2 2779 B11R1.8 C=Cc1cc(cc(c1C)F)C 271570a_100011290941_100015473476 [1,1,0,0,0,0|1,0,1]=4 2780 B11R1.8 C=Cc1cc(cc(c1C)N)C 271570a_100011290941_102495365385 [1,1,0,0,0,0|1,0,1]=4 2781 B11R1.8 C=Cc1cc(cc(c1F)C)C 271570a_100011290941_200010204574 [1,1,0,0,0,0|1,0,1]=4 2782 B11R1.8 C=Cc1cc(cc(c1F)F)C 271570a_100011290941_100010141297 [1,1,0,0,0,0|1,0,1]=4 2783 B11R1.8 C=Cc1cc(cc(c1F)N)C 271570a_100011290941_100010589139 [1,1,0,0,0,0|1,0,1]=4 2784 B11R1.8 C=Cc1cc(cc(c1N)C)C 271570a_100011290941_100000688863 [1,1,0,0,0,0|1,0,1]=4 2785 B11R1.8 C=Cc1cc(cc(c1N)F)C 271570a_100011290941_100012353694 [1,1,0,0,0,0|1,0,1]=4 2786 B11R1.8 C=Cc1cc(cc(c1N)N)C 271570a_100011290941_100012348275 [1,1,0,0,0,0|1,0,1]=4 2787 B11R1.8 C=Cc1cc(cc(c1O)Br)F 271570a_100011290941_200013085147 [1,1,0,0,0,0|1,0,1]=4 2788 B11R1.8 C=Cc1cc(cc(c1O)C)C 271570a_100011290941_100011934984 [1,1,0,0,0,0|0,0,1]=3 2789 B11R1.8 C=Cc1cc(cc(c1O)C)Cl 271570a_100011290941_100012343667 [1,1,0,0,0,0|1,0,1]=4 2790 B11R1.8 C=Cc1cc(cc(c1O)C)N 271570a_100011290941_100010064301 [1,1,0,0,0,0|1,0,1]=4 2791 B11R1.8 C=Cc1cc(cc(c1O)Cl)Cl 271570a_100011290941_200012339341 [1,1,0,0,0,0|1,0,1]=4 2792 B11R1.8 C=Cc1cc(cc(c1O)F)Br 271570a_100011290941_100013354677 [1,1,0,0,0,0|1,0,1]=4 2793 B11R1.8 C=Cc1cc(cc(c1O)F)C 271570a_100011290941_200135191068 [1,1,0,0,0,0|0,0,1]=3 2794 B11R1.8 C=Cc1cc(cc(c1O)F)F 271570a_100011290941_100000688693 [1,1,0,0,0,0|1,0,1]=4 2795 B11R1.8 C=Cc1cc(cc(c1O)N)F 271570a_100011290941_200011217456 [1,1,0,0,0,0|1,0,1]=4 2796 B11R1.8 CCc1cc(cc(c1O)C)O 271570a_203496583355_100010659108 [1,1,0,0,0,0|1,0,1]=4 2797 B11R1.8 CNc1cc(cc(c1C)Br)C 2230a_102495365385_200000210301 [1,1,0,0,0,0|2,0,0]=4 2798 B11R1.8 CNc1cc(cc(c1C)Br)C 34a_102495365385_200000210301 [1,1,0,0,0,0|2,0,0]=4 2799 B11R1.8 CNc1cc(cc(c1C)Br)C 7a_102495365385_200000210301 [1,1,0,0,0,0|2,0,0]=4 2800 B11R1.8 CNc1cc(cc(c1C)C)C 2230a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2801 B11R1.8 CNc1cc(cc(c1C)C)C 34a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2802 B11R1.8 CNc1cc(cc(c1C)C)C 7a_100000035412_200000210301 [1,1,0,0,0,0|2,0,0]=4 2803 B11R1.8 CNc1cc(cc(c1F)Br)C 2230a_100010589139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2804 B11R1.8 CNc1cc(cc(c1F)Br)C 34a_100010589139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2805 B11R1.8 CNc1cc(cc(c1F)Br)C 7a_100010589139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2806 B11R1.8 CNc1cc(cc(c1I)F)C 34a_100021129147_200000210301 [1,1,0,0,0,0|2,0,0]=4 2807 B11R1.8 CNc1cc(cc(c1I)F)C 7a_100021129147_200000210301 [1,1,0,0,0,0|2,0,0]=4 2808 B11R1.8 CNc1cc(cc(c1O)Br)Br 34a_100010781877_200000210301 [1,1,0,0,0,0|2,0,0]=4 2809 B11R1.8 CNc1cc(cc(c1O)Br)Cl 34a_106741647128_200000210301 [1,1,0,0,0,0|2,0,0]=4 2810 B11R1.8 CNc1cc(cc(c1O)Br)F 34a_200011217456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2811 B11R1.8 CNc1cc(cc(c1O)C)Br 34a_100011825904_200000210301 [1,1,0,0,0,0|2,0,0]=4 2812 B11R1.8 CNc1cc(cc(c1O)C)Br 7a_100011825904_200000210301 [1,1,0,0,0,0|2,0,0]=4 2813 B11R1.8 CNc1cc(cc(c1O)C)C 34a_100011216242_200000210301 [1,1,0,0,0,0|1,0,0]=3 2814 B11R1.8 CNc1cc(cc(c1O)C)C 7a_100011216242_200000210301 [1,1,0,0,0,0|1,0,0]=3 2815 B11R1.8 CNc1cc(cc(c1O)C)F 34a_100000130126_200000210301 [1,1,0,0,0,0|2,0,0]=4 2816 B11R1.8 CNc1cc(cc(c1O)C)F 7a_100000130126_200000210301 [1,1,0,0,0,0|2,0,0]=4 2817 B11R1.8 CNc1cc(cc(c1O)Cl)Br 34a_100000694353_200000210301 [1,1,0,0,0,0|2,0,0]=4 2818 B11R1.8 CNc1cc(cc(c1O)Cl)Cl 34a_100000695819_200000210301 [1,1,0,0,0,0|2,0,0]=4 2819 B11R1.8 CNc1cc(cc(c1O)F)Br 34a_100011217383_200000210301 [1,1,0,0,0,0|2,0,0]=4 2820 B11R1.8 CNc1cc(cc(c1O)F)Br 7a_100011217383_200000210301 [1,1,0,0,0,0|2,0,0]=4 2821 B11R1.8 CNc1cc(cc(c1O)F)F 34a_100015205836_200000210301 [1,1,0,0,0,0|2,0,0]=4 2822 B11R1.8 COc1cc(cc(c1Br)C)C 34a_100010342985_200000210301 [1,1,0,0,0,0|2,0,0]=4 2823 B11R1.8 COc1cc(cc(c1Br)C)C 7a_100010342985_200000210301 [1,1,0,0,0,0|2,0,0]=4 2824 B11R1.8 COc1cc(cc(c1C)C)C 34a_100000230004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2825 B11R1.8 COc1cc(cc(c1C)C)C 7a_100000230004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2826 B11R1.8 COc1cc(cc(c1Cl)C)C 34a_100000094344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2827 B11R1.8 COc1cc(cc(c1Cl)C)C 7a_100000094344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2828 B11R1.8 COc1cc(cc(c1N)Cl)C 34a_100015906060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2829 B11R1.8 COc1cc(cc(c1N)Cl)C 7a_100015906060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2830 B11R1.8 COc1cc(cc(c1O)Br)Cl 271570a_203496583355_100025705407 [1,1,0,0,0,0|2,0,0]=4 2831 B11R1.8 COc1cc(cc(c1O)Cl)Cl 271570a_203496583355_100010292537 [1,1,0,0,0,0|2,0,0]=4 2832 B11R1.8 COc1cc(cc(c1O)F)Br 271570a_203496583355_100010713143 [1,1,0,0,0,0|2,0,0]=4 2833 B11R1.8 COc1cc(cc(c1O)O)F 271570a_203496583355_200010391102 [1,1,0,0,0,0|2,0,0]=4 2834 B11R1.8 CSc1cc(cc(c1C)F)C 62a_100015473476_200000210301 [1,1,0,0,0,0|2,0,0]=4 2835 B11R1.8 CSc1cc(cc(c1C)F)C 62a_200000210301_100015473476 [1,1,0,0,0,0|2,0,0]=4 2836 B11R1.8 CSc1cc(cc(c1C)N)C 62a_102495365385_200000210301 [1,1,0,0,0,0|2,0,0]=4 2837 B11R1.8 CSc1cc(cc(c1C)N)C 62a_200000210301_102495365385 [1,1,0,0,0,0|2,0,0]=4 2838 B11R1.8 CSc1cc(cc(c1F)C)C 62a_200000210301_200010204574 [1,1,0,0,0,0|2,0,0]=4 2839 B11R1.8 CSc1cc(cc(c1F)C)C 62a_200010204574_200000210301 [1,1,0,0,0,0|2,0,0]=4 2840 B11R1.8 CSc1cc(cc(c1F)F)C 62a_100010141297_200000210301 [1,1,0,0,0,0|2,0,0]=4 2841 B11R1.8 CSc1cc(cc(c1F)F)C 62a_200000210301_100010141297 [1,1,0,0,0,0|2,0,0]=4 2842 B11R1.8 CSc1cc(cc(c1F)N)C 62a_100010589139_200000210301 [1,1,0,0,0,0|2,0,0]=4 2843 B11R1.8 CSc1cc(cc(c1F)N)C 62a_200000210301_100010589139 [1,1,0,0,0,0|2,0,0]=4 2844 B11R1.8 CSc1cc(cc(c1N)C)C 62a_100000688863_200000210301 [1,1,0,0,0,0|2,0,0]=4 2845 B11R1.8 CSc1cc(cc(c1N)C)C 62a_200000210301_100000688863 [1,1,0,0,0,0|2,0,0]=4 2846 B11R1.8 CSc1cc(cc(c1N)F)C 62a_100012353694_200000210301 [1,1,0,0,0,0|2,0,0]=4 2847 B11R1.8 CSc1cc(cc(c1N)F)C 62a_200000210301_100012353694 [1,1,0,0,0,0|2,0,0]=4 2848 B11R1.8 CSc1cc(cc(c1N)N)C 62a_100012348275_200000210301 [1,1,0,0,0,0|2,0,0]=4 2849 B11R1.8 CSc1cc(cc(c1N)N)C 62a_200000210301_100012348275 [1,1,0,0,0,0|2,0,0]=4 2850 B11R1.8 CSc1cc(cc(c1O)Br)F 62a_200000210301_200013085147 [1,1,0,0,0,0|2,0,0]=4 2851 B11R1.8 CSc1cc(cc(c1O)Br)F 62a_200013085147_200000210301 [1,1,0,0,0,0|2,0,0]=4 2852 B11R1.8 CSc1cc(cc(c1O)C)C 62a_100011934984_200000210301 [1,1,0,0,0,0|1,0,0]=3 2853 B11R1.8 CSc1cc(cc(c1O)C)C 62a_200000210301_100011934984 [1,1,0,0,0,0|1,0,0]=3 2854 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_100012343667_200000210301 [1,1,0,0,0,0|2,0,0]=4 2855 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_200000210301_100012343667 [1,1,0,0,0,0|2,0,0]=4 2856 B11R1.8 CSc1cc(cc(c1O)C)N 62a_100010064301_200000210301 [1,1,0,0,0,0|2,0,0]=4 2857 B11R1.8 CSc1cc(cc(c1O)C)N 62a_200000210301_100010064301 [1,1,0,0,0,0|2,0,0]=4 2858 B11R1.8 CSc1cc(cc(c1O)Cl)Cl 62a_200000210301_200012339341 [1,1,0,0,0,0|2,0,0]=4 2859 B11R1.8 CSc1cc(cc(c1O)Cl)Cl 62a_200012339341_200000210301 [1,1,0,0,0,0|2,0,0]=4 2860 B11R1.8 CSc1cc(cc(c1O)F)Br 62a_100013354677_200000210301 [1,1,0,0,0,0|2,0,0]=4 2861 B11R1.8 CSc1cc(cc(c1O)F)Br 62a_200000210301_100013354677 [1,1,0,0,0,0|2,0,0]=4 2862 B11R1.8 CSc1cc(cc(c1O)F)C 62a_200000210301_200135191068 [1,1,0,0,0,0|1,0,0]=3 2863 B11R1.8 CSc1cc(cc(c1O)F)C 62a_200135191068_200000210301 [1,1,0,0,0,0|1,0,0]=3 2864 B11R1.8 CSc1cc(cc(c1O)F)F 62a_100000688693_200000210301 [1,1,0,0,0,0|2,0,0]=4 2865 B11R1.8 CSc1cc(cc(c1O)F)F 62a_200000210301_100000688693 [1,1,0,0,0,0|2,0,0]=4 2866 B11R1.8 CSc1cc(cc(c1O)N)Br 62a_100016071998_200000210301 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.8 CSc1cc(cc(c1O)N)Br 62a_200000210301_100016071998 [1,1,0,0,0,0|2,0,0]=4 2868 B11R1.8 CSc1cc(cc(c1O)N)F 62a_200000210301_200011217456 [1,1,0,0,0,0|2,0,0]=4 2869 B11R1.8 CSc1cc(cc(c1O)N)F 62a_200011217456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2870 B11R1.8 Cc1cc(c(c(c1)C=O)F)O 271570a_203496583355_100010161323 [1,1,0,0,0,0|1,0,0]=3 2871 B11R1.8 Cc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000698970 [1,1,0,0,0,0|0,0,0]=2 2872 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)Br 2230a_102495365385_200025704644 [1,1,0,0,0,0|2,0,0]=4 2873 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)Br 34a_102495365385_200025704644 [1,1,0,0,0,0|2,0,0]=4 2874 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)Br 7a_102495365385_200025704644 [1,1,0,0,0,0|2,0,0]=4 2875 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 2230a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2876 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 34a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2877 B11R1.8 Cc1cc(c(c(c1)N[13CH3])C)C 7a_100000035412_200025704644 [1,1,0,0,0,0|2,0,0]=4 2878 B11R1.8 Cc1cc(c(c(c1)N[13CH3])F)Br 2230a_100010589139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2879 B11R1.8 Cc1cc(c(c(c1)N[13CH3])F)Br 34a_100010589139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2880 B11R1.8 Cc1cc(c(c(c1)N[13CH3])F)Br 7a_100010589139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2881 B11R1.8 Cc1cc(c(c(c1)N[13CH3])I)F 34a_100021129147_200025704644 [1,1,0,0,0,0|2,0,0]=4 2882 B11R1.8 Cc1cc(c(c(c1)N[13CH3])I)F 7a_100021129147_200025704644 [1,1,0,0,0,0|2,0,0]=4 2883 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 34a_100011216242_200025704644 [1,1,0,0,0,0|1,0,0]=3 2884 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 7a_100011216242_200025704644 [1,1,0,0,0,0|1,0,0]=3 2885 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Br)C 34a_100010342985_200025704644 [1,1,0,0,0,0|2,0,0]=4 2886 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Br)C 7a_100010342985_200025704644 [1,1,0,0,0,0|2,0,0]=4 2887 B11R1.8 Cc1cc(c(c(c1)O[13CH3])C)C 34a_100000230004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2888 B11R1.8 Cc1cc(c(c(c1)O[13CH3])C)C 7a_100000230004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2889 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Cl)C 34a_100000094344_200025704644 [1,1,0,0,0,0|2,0,0]=4 2890 B11R1.8 Cc1cc(c(c(c1)O[13CH3])Cl)C 7a_100000094344_200025704644 [1,1,0,0,0,0|2,0,0]=4 2891 B11R1.8 Cc1cc(c(c(c1)O[13CH3])N)Cl 34a_100015906060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2892 B11R1.8 Cc1cc(c(c(c1)O[13CH3])N)Cl 7a_100015906060_200025704644 [1,1,0,0,0,0|2,0,0]=4 2893 B11R1.8 Cc1cc(c(c(c1)S[13CH3])C)F 62a_100015473476_200025704644 [1,1,0,0,0,0|2,0,0]=4 2894 B11R1.8 Cc1cc(c(c(c1)S[13CH3])C)F 62a_200025704644_100015473476 [1,1,0,0,0,0|2,0,0]=4 2895 B11R1.8 Cc1cc(c(c(c1)S[13CH3])C)N 62a_102495365385_200025704644 [1,1,0,0,0,0|2,0,0]=4 2896 B11R1.8 Cc1cc(c(c(c1)S[13CH3])C)N 62a_200025704644_102495365385 [1,1,0,0,0,0|2,0,0]=4 2897 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)C 62a_200010204574_200025704644 [1,1,0,0,0,0|2,0,0]=4 2898 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)C 62a_200025704644_200010204574 [1,1,0,0,0,0|2,0,0]=4 2899 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)F 62a_100010141297_200025704644 [1,1,0,0,0,0|2,0,0]=4 2900 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)F 62a_200025704644_100010141297 [1,1,0,0,0,0|2,0,0]=4 2901 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)N 62a_100010589139_200025704644 [1,1,0,0,0,0|2,0,0]=4 2902 B11R1.8 Cc1cc(c(c(c1)S[13CH3])F)N 62a_200025704644_100010589139 [1,1,0,0,0,0|2,0,0]=4 2903 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)C 62a_100000688863_200025704644 [1,1,0,0,0,0|2,0,0]=4 2904 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)C 62a_200025704644_100000688863 [1,1,0,0,0,0|2,0,0]=4 2905 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)F 62a_100012353694_200025704644 [1,1,0,0,0,0|2,0,0]=4 2906 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)F 62a_200025704644_100012353694 [1,1,0,0,0,0|2,0,0]=4 2907 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)N 62a_100012348275_200025704644 [1,1,0,0,0,0|2,0,0]=4 2908 B11R1.8 Cc1cc(c(c(c1)S[13CH3])N)N 62a_200025704644_100012348275 [1,1,0,0,0,0|2,0,0]=4 2909 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_100011934984_200025704644 [1,1,0,0,0,0|1,0,0]=3 2910 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_200025704644_100011934984 [1,1,0,0,0,0|1,0,0]=3 2911 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)F 62a_200025704644_200135191068 [1,1,0,0,0,0|1,0,0]=3 2912 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)F 62a_200135191068_200025704644 [1,1,0,0,0,0|1,0,0]=3 2913 B11R1.8 Cc1cc(cc(c1F)C=O)O 271570a_203496583355_100010235757 [1,1,0,0,0,0|2,0,0]=4 2914 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 34a_100011825904_200025704644 [1,1,0,0,0,0|2,0,0]=4 2915 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 7a_100011825904_200025704644 [1,1,0,0,0,0|2,0,0]=4 2916 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 34a_100000130126_200025704644 [1,1,0,0,0,0|2,0,0]=4 2917 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 7a_100000130126_200025704644 [1,1,0,0,0,0|2,0,0]=4 2918 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_100012343667_200025704644 [1,1,0,0,0,0|2,0,0]=4 2919 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_200025704644_100012343667 [1,1,0,0,0,0|2,0,0]=4 2920 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_100010064301_200025704644 [1,1,0,0,0,0|2,0,0]=4 2921 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_200025704644_100010064301 [1,1,0,0,0,0|2,0,0]=4 2922 B11R1.8 O=Cc1cc(cc(c1F)F)O 271570a_203496583355_100009814787 [1,1,0,0,0,0|2,0,0]=4 2923 B11R1.8 O=Cc1cc(cc(c1F)O)F 271570a_203496583355_100010890130 [1,1,0,0,0,0|2,0,0]=4 2924 B11R1.8 O=Cc1cc(cc(c1O)F)O 271570a_203496583355_100011217654 [1,1,0,0,0,0|1,0,0]=3 2925 B11R1.8 O=Cc1cc(cc(c1O)O)F 271570a_203496583355_100011659637 [1,1,0,0,0,0|1,0,0]=3 2926 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)Br 34a_100010781877_200025704644 [1,1,0,0,0,0|2,0,0]=4 2927 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)Cl 34a_106741647128_200025704644 [1,1,0,0,0,0|2,0,0]=4 2928 B11R1.8 [13CH3]Nc1cc(cc(c1O)Br)F 34a_200011217456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2929 B11R1.8 [13CH3]Nc1cc(cc(c1O)Cl)Br 34a_100000694353_200025704644 [1,1,0,0,0,0|2,0,0]=4 2930 B11R1.8 [13CH3]Nc1cc(cc(c1O)Cl)Cl 34a_100000695819_200025704644 [1,1,0,0,0,0|2,0,0]=4 2931 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)Br 34a_100011217383_200025704644 [1,1,0,0,0,0|2,0,0]=4 2932 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)Br 7a_100011217383_200025704644 [1,1,0,0,0,0|2,0,0]=4 2933 B11R1.8 [13CH3]Nc1cc(cc(c1O)F)F 34a_100015205836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2934 B11R1.8 [13CH3]Sc1cc(cc(c1O)Br)F 62a_200013085147_200025704644 [1,1,0,0,0,0|2,0,0]=4 2935 B11R1.8 [13CH3]Sc1cc(cc(c1O)Br)F 62a_200025704644_200013085147 [1,1,0,0,0,0|2,0,0]=4 2936 B11R1.8 [13CH3]Sc1cc(cc(c1O)Cl)Cl 62a_200012339341_200025704644 [1,1,0,0,0,0|2,0,0]=4 2937 B11R1.8 [13CH3]Sc1cc(cc(c1O)Cl)Cl 62a_200025704644_200012339341 [1,1,0,0,0,0|2,0,0]=4 2938 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)Br 62a_100013354677_200025704644 [1,1,0,0,0,0|2,0,0]=4 2939 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)Br 62a_200025704644_100013354677 [1,1,0,0,0,0|2,0,0]=4 2940 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)F 62a_100000688693_200025704644 [1,1,0,0,0,0|2,0,0]=4 2941 B11R1.8 [13CH3]Sc1cc(cc(c1O)F)F 62a_200025704644_100000688693 [1,1,0,0,0,0|2,0,0]=4 2942 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)Br 62a_100016071998_200025704644 [1,1,0,0,0,0|2,0,0]=4 2943 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)Br 62a_200025704644_100016071998 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)F 62a_200011217456_200025704644 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.8 [13CH3]Sc1cc(cc(c1O)N)F 62a_200025704644_200011217456 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.37 C=Cc1cc(ccc1C#N)C 271570a_100011290941_100000693804 [1,1,0,0,0,0|1,0,1]=4 2947 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [1,1,0,0,0,0|0,0,2]=4 2948 B11R1.37 C=Cc1cc(ccc1CO)Br 271570a_100011290941_100010146605 [1,1,0,0,0,0|1,0,1]=4 2949 B11R1.37 C=Cc1cc(ccc1CO)Cl 271570a_100011290941_100000722340 [1,1,0,0,0,0|1,0,1]=4 2950 B11R1.37 C=Cc1cc(ccc1CO)F 271570a_100011290941_100000744086 [1,1,0,0,0,0|1,0,1]=4 2951 B11R1.37 C=Cc1cc(ccc1CO)O 271570a_100011290941_100010146404 [1,1,0,0,0,0|1,0,1]=4 2952 B11R1.37 C=Cc1cc(ccc1NC)C 271570a_100011290941_100000221369 [1,1,0,0,0,0|1,0,1]=4 2953 B11R1.37 C=Cc1cc(ccc1NN)C 271570a_100011290941_100016996181 [1,1,0,0,0,0|1,0,1]=4 2954 B11R1.37 C=Cc1cc(ccc1OC)Br 271570a_100011290941_100012351588 [1,1,0,0,0,0|1,0,1]=4 2955 B11R1.37 C=Cc1cc(ccc1OC)C 271570a_100011290941_100000186399 [1,1,0,0,0,0|0,0,1]=3 2956 B11R1.37 C=Cc1cc(ccc1OC)Cl 271570a_100011290941_100011215930 [1,1,0,0,0,0|1,0,1]=4 2957 B11R1.37 C=Cc1cc(ccc1OC)F 271570a_100011290941_100000171694 [1,1,0,0,0,0|1,0,1]=4 2958 B11R1.37 C=Cc1cc(ccc1OC)N 271570a_100011290941_100000187427 [1,1,0,0,0,0|1,0,1]=4 2959 B11R1.37 C=Cc1cc(ccc1OC)O 271570a_100011290941_100010084122 [1,1,0,0,0,0|1,0,1]=4 2960 B11R1.37 C=Cc1cc(ccc1SC)C 271570a_100011290941_200010201864 [1,1,0,0,0,0|0,1,1]=4 2961 B11R1.37 C=Cc1cc(cnc1OC)C 271570a_100011290941_100012353929 [1,1,0,0,0,0|1,0,1]=4 2962 B11R1.37 C=Cc1cc(ncc1OC)C 271570a_100011290941_100010109759 [1,1,0,0,0,0|1,0,1]=4 2963 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [1,1,0,0,0,0|2,0,0]=4 2964 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [1,1,0,0,0,0|1,0,0]=3 2965 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [1,1,0,0,0,0|2,0,0]=4 2966 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [1,1,0,0,0,0|2,0,0]=4 2967 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [1,1,0,0,0,0|2,0,0]=4 2968 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [1,1,0,0,0,0|2,0,0]=4 2969 B11R1.37 C=Cc1ccc(cc1SC)C 271570a_100011290941_200010709736 [1,1,0,0,0,0|2,0,0]=4 2970 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [1,1,0,0,0,0|2,0,0]=4 2971 B11R1.37 C=Cc1nc(ccc1CO)C 271570a_100011290941_102495338573 [1,1,0,0,0,0|1,0,1]=4 2972 B11R1.37 C=Cc1nc(ccc1OC)C 271570a_100011290941_100009820875 [1,1,0,0,0,0|1,0,1]=4 2973 B11R1.37 C=Cc1ncc(cc1C=O)C 271570a_100011290941_100000050350 [1,1,0,0,0,0|2,0,0]=4 2974 B11R1.37 CCc1cc(ccc1OC)Br 34a_100012338938_200000210301 [1,1,0,0,0,0|1,0,1]=4 2975 B11R1.37 CCc1cc(ccc1OC)Br 7a_100012338938_200000210301 [1,1,0,0,0,0|1,0,1]=4 2976 B11R1.37 CCc1cc(ccc1OC)C 34a_100009844793_200000210301 [1,1,0,0,0,0|0,0,1]=3 2977 B11R1.37 CCc1cc(ccc1OC)C 7a_100009844793_200000210301 [1,1,0,0,0,0|0,0,1]=3 2978 B11R1.37 CCc1cc(ccc1OC)F 34a_200000035566_200000210301 [1,1,0,0,0,0|1,0,1]=4 2979 B11R1.37 CCc1cc(ccc1OC)F 7a_200000035566_200000210301 [1,1,0,0,0,0|1,0,1]=4 2980 B11R1.37 CCc1cc(ccc1OC)O 271570a_203496583355_200010179862 [1,1,0,0,0,0|1,0,1]=4 2981 B11R1.37 CCc1cc(ccc1O[13CH3])Br 34a_100012338938_200025704644 [1,1,0,0,0,0|1,0,1]=4 2982 B11R1.37 CCc1cc(ccc1O[13CH3])Br 7a_100012338938_200025704644 [1,1,0,0,0,0|1,0,1]=4 2983 B11R1.37 CCc1cc(ccc1O[13CH3])C 34a_100009844793_200025704644 [1,1,0,0,0,0|0,0,1]=3 2984 B11R1.37 CCc1cc(ccc1O[13CH3])C 7a_100009844793_200025704644 [1,1,0,0,0,0|0,0,1]=3 2985 B11R1.37 CCc1cc(ccc1O[13CH3])F 34a_200000035566_200025704644 [1,1,0,0,0,0|1,0,1]=4 2986 B11R1.37 CCc1cc(ccc1O[13CH3])F 7a_200000035566_200025704644 [1,1,0,0,0,0|1,0,1]=4 2987 B11R1.37 CCc1nc(ccc1OC)C 34a_100000718140_200000210301 [1,1,0,0,0,0|1,0,1]=4 2988 B11R1.37 CCc1nc(ccc1OC)C 7a_100000718140_200000210301 [1,1,0,0,0,0|1,0,1]=4 2989 B11R1.37 CCc1nc(ccc1O[13CH3])C 34a_100000718140_200025704644 [1,1,0,0,0,0|1,0,1]=4 2990 B11R1.37 CCc1nc(ccc1O[13CH3])C 7a_100000718140_200025704644 [1,1,0,0,0,0|1,0,1]=4 2991 B11R1.37 CNc1cc(ccc1C#N)C 34a_100011218341_200000210301 [1,1,0,0,0,0|2,0,0]=4 2992 B11R1.37 CNc1cc(ccc1C#N)C 7a_100011218341_200000210301 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.37 CNc1cc(ccc1CO)Br 34a_100000718831_200000210301 [1,1,0,0,0,0|2,0,0]=4 2994 B11R1.37 CNc1cc(ccc1CO)C 34a_100000087799_200000210301 [1,1,0,0,0,0|1,0,0]=3 2995 B11R1.37 CNc1cc(ccc1CO)Cl 34a_100000238622_200000210301 [1,1,0,0,0,0|2,0,0]=4 2996 B11R1.37 CNc1cc(ccc1CO)F 34a_100011996588_200000210301 [1,1,0,0,0,0|2,0,0]=4 2997 B11R1.37 CNc1cc(ccc1OC)Br 34a_100000743470_200000210301 [1,1,0,0,0,0|2,0,0]=4 2998 B11R1.37 CNc1cc(ccc1OC)C 2230a_100000210980_200000210301 [1,1,0,0,0,0|1,0,0]=3 2999 B11R1.37 CNc1cc(ccc1OC)C 34a_100000210980_200000210301 [1,1,0,0,0,0|1,0,0]=3 3000 B11R1.37 CNc1cc(ccc1OC)Cl 34a_100000182114_200000210301 [1,1,0,0,0,0|2,0,0]=4 3001 B11R1.37 CNc1cc(ccc1OC)F 34a_100000757179_200000210301 [1,1,0,0,0,0|2,0,0]=4 3002 B11R1.37 CNc1ccc(cc1OC)C 2230a_100000746441_200000210301 [1,1,0,0,0,0|2,0,0]=4 3003 B11R1.37 CNc1ccc(cc1OC)C 34a_100000746441_200000210301 [1,1,0,0,0,0|2,0,0]=4 3004 B11R1.37 CNc1ccc(cc1SC)C 62a_100000221369_200000210301 [1,1,0,0,0,0|2,0,0]=4 3005 B11R1.37 CNc1ccc(cc1SC)C 62a_200000210301_100000221369 [1,1,0,0,0,0|2,0,0]=4 3006 B11R1.37 CNc1ccc(cc1S[13CH3])C 62a_100000221369_200025704644 [1,1,0,0,0,0|2,0,0]=4 3007 B11R1.37 CNc1ccc(cc1S[13CH3])C 62a_200025704644_100000221369 [1,1,0,0,0,0|2,0,0]=4 3008 B11R1.37 COc1cc(ccc1C#N)C 34a_100011640519_200000210301 [1,1,0,0,0,0|2,0,0]=4 3009 B11R1.37 COc1cc(ccc1C#N)C 7a_100011640519_200000210301 [1,1,0,0,0,0|2,0,0]=4 3010 B11R1.37 COc1cc(ccc1CO)Br 34a_100000071718_200000210301 [1,1,0,0,0,0|2,0,0]=4 3011 B11R1.37 COc1cc(ccc1CO)Br 7a_100000071718_200000210301 [1,1,0,0,0,0|2,0,0]=4 3012 B11R1.37 COc1cc(ccc1CO)O 271570a_203496583355_100011277633 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.37 COc1cc(ccc1N[13CH3])C 2230a_100000746441_200025704644 [1,1,0,0,0,0|2,0,0]=4 3014 B11R1.37 COc1cc(ccc1N[13CH3])C 34a_100000746441_200025704644 [1,1,0,0,0,0|2,0,0]=4 3015 B11R1.37 COc1cc(ccc1O[13CH3])Br 34a_100000694246_200025704644 [1,1,0,0,0,0|2,0,0]=4 3016 B11R1.37 COc1cc(ccc1O[13CH3])Br 7a_100000694246_200025704644 [1,1,0,0,0,0|2,0,0]=4 3017 B11R1.37 COc1cc(ccc1O[13CH3])C 34a_100000186466_200025704644 [1,1,0,0,0,0|1,0,0]=3 3018 B11R1.37 COc1cc(ccc1O[13CH3])Cl 34a_100000033002_200025704644 [1,1,0,0,0,0|2,0,0]=4 3019 B11R1.37 COc1cc(ccc1O[13CH3])F 34a_100000036057_200025704644 [1,1,0,0,0,0|2,0,0]=4 3020 B11R1.37 COc1cc(ccc1O[13CH3])F 7a_100000036057_200025704644 [1,1,0,0,0,0|2,0,0]=4 3021 B11R1.37 COc1cc(ccc1O[13CH3])I 34a_100000049635_200025704644 [1,1,0,0,0,0|2,0,0]=4 3022 B11R1.37 COc1cc(ccc1O[13CH3])N 34a_100000726020_200025704644 [1,1,0,0,0,0|2,0,0]=4 3023 B11R1.37 COc1cc(ccc1SC)C 62a_100010200004_200000210301 [1,1,0,0,0,0|1,1,0]=4 3024 B11R1.37 COc1cc(ccc1SC)C 62a_200000210301_100010200004 [1,1,0,0,0,0|1,1,0]=4 3025 B11R1.37 COc1cc(ccc1S[13CH3])C 62a_100010200004_200025704644 [1,1,0,0,0,0|1,1,0]=4 3026 B11R1.37 COc1cc(ccc1S[13CH3])C 62a_200025704644_100010200004 [1,1,0,0,0,0|1,1,0]=4 3027 B11R1.37 COc1ccc(cc1C#N)C 34a_200012180384_200000210301 [1,1,0,0,0,0|1,0,1]=4 3028 B11R1.37 COc1ccc(cc1C#N)C 7a_200012180384_200000210301 [1,1,0,0,0,0|1,0,1]=4 3029 B11R1.37 COc1ccc(cc1C=O)O 271570a_203496583355_100000170026 [1,1,0,0,0,0|1,0,0]=3 3030 B11R1.37 COc1ccc(cc1CO)C 34a_200011846009_200000210301 [1,1,0,0,0,0|0,0,2]=4 3031 B11R1.37 COc1ccc(cc1CO)C 7a_200011846009_200000210301 [1,1,0,0,0,0|0,0,2]=4 3032 B11R1.37 COc1ccc(cc1N[13CH3])Br 34a_100000743470_200025704644 [1,1,0,0,0,0|2,0,0]=4 3033 B11R1.37 COc1ccc(cc1N[13CH3])C 2230a_100000210980_200025704644 [1,1,0,0,0,0|1,0,0]=3 3034 B11R1.37 COc1ccc(cc1N[13CH3])C 34a_100000210980_200025704644 [1,1,0,0,0,0|1,0,0]=3 3035 B11R1.37 COc1ccc(cc1N[13CH3])Cl 34a_100000182114_200025704644 [1,1,0,0,0,0|2,0,0]=4 3036 B11R1.37 COc1ccc(cc1N[13CH3])F 34a_100000757179_200025704644 [1,1,0,0,0,0|2,0,0]=4 3037 B11R1.37 COc1ccc(cc1OC)Br 34a_100000694246_200000210301 [1,1,0,0,0,0|2,0,0]=4 3038 B11R1.37 COc1ccc(cc1OC)Br 34a_100009816560_200000210301 [1,1,0,0,0,0|2,0,0]=4 3039 B11R1.37 COc1ccc(cc1OC)Br 7a_100000694246_200000210301 [1,1,0,0,0,0|2,0,0]=4 3040 B11R1.37 COc1ccc(cc1OC)Br 7a_100009816560_200000210301 [1,1,0,0,0,0|2,0,0]=4 3041 B11R1.37 COc1ccc(cc1OC)C 34a_100000186466_200000210301 [1,1,0,0,0,0|1,0,0]=3 3042 B11R1.37 COc1ccc(cc1OC)C 34a_100011216497_200000210301 [1,1,0,0,0,0|1,0,0]=3 3043 B11R1.37 COc1ccc(cc1OC)C 7a_100011216497_200000210301 [1,1,0,0,0,0|1,0,0]=3 3044 B11R1.37 COc1ccc(cc1OC)Cl 34a_100000033002_200000210301 [1,1,0,0,0,0|2,0,0]=4 3045 B11R1.37 COc1ccc(cc1OC)Cl 34a_100000101779_200000210301 [1,1,0,0,0,0|2,0,0]=4 3046 B11R1.37 COc1ccc(cc1OC)Cl 7a_100000101779_200000210301 [1,1,0,0,0,0|2,0,0]=4 3047 B11R1.37 COc1ccc(cc1OC)F 34a_100000034962_200000210301 [1,1,0,0,0,0|2,0,0]=4 3048 B11R1.37 COc1ccc(cc1OC)F 34a_100000036057_200000210301 [1,1,0,0,0,0|2,0,0]=4 3049 B11R1.37 COc1ccc(cc1OC)F 7a_100000034962_200000210301 [1,1,0,0,0,0|2,0,0]=4 3050 B11R1.37 COc1ccc(cc1OC)F 7a_100000036057_200000210301 [1,1,0,0,0,0|2,0,0]=4 3051 B11R1.37 COc1ccc(cc1OC)I 34a_100000049635_200000210301 [1,1,0,0,0,0|2,0,0]=4 3052 B11R1.37 COc1ccc(cc1OC)N 34a_100000211920_200000210301 [1,1,0,0,0,0|2,0,0]=4 3053 B11R1.37 COc1ccc(cc1OC)N 34a_100000726020_200000210301 [1,1,0,0,0,0|2,0,0]=4 3054 B11R1.37 COc1ccc(cc1OC)O 271570a_203496583355_100000187503 [1,1,0,0,0,0|2,0,0]=4 3055 B11R1.37 COc1ccc(cc1O[13CH3])Br 34a_100009816560_200025704644 [1,1,0,0,0,0|2,0,0]=4 3056 B11R1.37 COc1ccc(cc1O[13CH3])Br 7a_100009816560_200025704644 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.37 COc1ccc(cc1O[13CH3])C 34a_100011216497_200025704644 [1,1,0,0,0,0|1,0,0]=3 3058 B11R1.37 COc1ccc(cc1O[13CH3])C 7a_100011216497_200025704644 [1,1,0,0,0,0|1,0,0]=3 3059 B11R1.37 COc1ccc(cc1O[13CH3])Cl 34a_100000101779_200025704644 [1,1,0,0,0,0|2,0,0]=4 3060 B11R1.37 COc1ccc(cc1O[13CH3])Cl 7a_100000101779_200025704644 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.37 COc1ccc(cc1O[13CH3])F 34a_100000034962_200025704644 [1,1,0,0,0,0|2,0,0]=4 3062 B11R1.37 COc1ccc(cc1O[13CH3])F 7a_100000034962_200025704644 [1,1,0,0,0,0|2,0,0]=4 3063 B11R1.37 COc1ccc(cc1O[13CH3])N 34a_100000211920_200025704644 [1,1,0,0,0,0|2,0,0]=4 3064 B11R1.37 COc1ccc(cc1SC)Br 62a_100012351588_200000210301 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.37 COc1ccc(cc1SC)Br 62a_200000210301_100012351588 [1,1,0,0,0,0|2,0,0]=4 3066 B11R1.37 COc1ccc(cc1SC)C 62a_100000186399_200000210301 [1,1,0,0,0,0|1,0,0]=3 3067 B11R1.37 COc1ccc(cc1SC)C 62a_200000210301_100000186399 [1,1,0,0,0,0|1,0,0]=3 3068 B11R1.37 COc1ccc(cc1SC)Cl 62a_100011215930_200000210301 [1,1,0,0,0,0|2,0,0]=4 3069 B11R1.37 COc1ccc(cc1SC)Cl 62a_200000210301_100011215930 [1,1,0,0,0,0|2,0,0]=4 3070 B11R1.37 COc1ccc(cc1SC)F 62a_100000171694_200000210301 [1,1,0,0,0,0|2,0,0]=4 3071 B11R1.37 COc1ccc(cc1SC)F 62a_200000210301_100000171694 [1,1,0,0,0,0|2,0,0]=4 3072 B11R1.37 COc1ccc(cc1SC)N 62a_100011356947_200000210301 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.37 COc1ccc(cc1SC)N 62a_200000210301_100011356947 [1,1,0,0,0,0|2,0,0]=4 3074 B11R1.37 COc1ccc(cc1SC)O 271570a_203496583355_200009892704 [1,1,0,0,0,0|2,0,0]=4 3075 B11R1.37 COc1ccc(cc1SC)O 62a_100010234764_200000210301 [1,1,0,0,0,0|2,0,0]=4 3076 B11R1.37 COc1ccc(cc1SC)O 62a_200000210301_100010234764 [1,1,0,0,0,0|2,0,0]=4 3077 B11R1.37 COc1ccc(cc1S[13CH3])Br 62a_100012351588_200025704644 [1,1,0,0,0,0|2,0,0]=4 3078 B11R1.37 COc1ccc(cc1S[13CH3])Br 62a_200025704644_100012351588 [1,1,0,0,0,0|2,0,0]=4 3079 B11R1.37 COc1ccc(cc1S[13CH3])C 62a_100000186399_200025704644 [1,1,0,0,0,0|1,0,0]=3 3080 B11R1.37 COc1ccc(cc1S[13CH3])C 62a_200025704644_100000186399 [1,1,0,0,0,0|1,0,0]=3 3081 B11R1.37 COc1ccc(cc1S[13CH3])Cl 62a_100011215930_200025704644 [1,1,0,0,0,0|2,0,0]=4 3082 B11R1.37 COc1ccc(cc1S[13CH3])Cl 62a_200025704644_100011215930 [1,1,0,0,0,0|2,0,0]=4 3083 B11R1.37 COc1ccc(cc1S[13CH3])F 62a_100000171694_200025704644 [1,1,0,0,0,0|2,0,0]=4 3084 B11R1.37 COc1ccc(cc1S[13CH3])F 62a_200025704644_100000171694 [1,1,0,0,0,0|2,0,0]=4 3085 B11R1.37 COc1ccc(cc1S[13CH3])N 62a_100011356947_200025704644 [1,1,0,0,0,0|2,0,0]=4 3086 B11R1.37 COc1ccc(cc1S[13CH3])N 62a_200025704644_100011356947 [1,1,0,0,0,0|2,0,0]=4 3087 B11R1.37 COc1ccc(cc1S[13CH3])O 62a_100010234764_200025704644 [1,1,0,0,0,0|2,0,0]=4 3088 B11R1.37 COc1ccc(cc1S[13CH3])O 62a_200025704644_100010234764 [1,1,0,0,0,0|2,0,0]=4 3089 B11R1.37 COc1ccc(nc1SC)C 62a_100009820875_200000210301 [1,1,0,0,0,0|2,0,0]=4 3090 B11R1.37 COc1ccc(nc1SC)C 62a_200000210301_100009820875 [1,1,0,0,0,0|2,0,0]=4 3091 B11R1.37 COc1ccc(nc1S[13CH3])C 62a_100009820875_200025704644 [1,1,0,0,0,0|2,0,0]=4 3092 B11R1.37 COc1ccc(nc1S[13CH3])C 62a_200025704644_100009820875 [1,1,0,0,0,0|2,0,0]=4 3093 B11R1.37 COc1cnc(cc1SC)C 62a_100010109759_200000210301 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.37 COc1cnc(cc1SC)C 62a_200000210301_100010109759 [1,1,0,0,0,0|2,0,0]=4 3095 B11R1.37 COc1cnc(cc1S[13CH3])C 62a_100010109759_200025704644 [1,1,0,0,0,0|2,0,0]=4 3096 B11R1.37 COc1cnc(cc1S[13CH3])C 62a_200025704644_100010109759 [1,1,0,0,0,0|2,0,0]=4 3097 B11R1.37 COc1ncc(cc1C=O)O 271570a_203496583355_100009814609 [1,1,0,0,0,0|2,0,0]=4 3098 B11R1.37 COc1ncc(cc1SC)C 62a_100012353929_200000210301 [1,1,0,0,0,0|2,0,0]=4 3099 B11R1.37 COc1ncc(cc1SC)C 62a_200000210301_100012353929 [1,1,0,0,0,0|2,0,0]=4 3100 B11R1.37 COc1ncc(cc1S[13CH3])C 62a_100012353929_200025704644 [1,1,0,0,0,0|2,0,0]=4 3101 B11R1.37 COc1ncc(cc1S[13CH3])C 62a_200025704644_100012353929 [1,1,0,0,0,0|2,0,0]=4 3102 B11R1.37 CSc1cc(ccc1C#N)C 62a_200000210301_100000693804 [1,1,0,0,0,0|2,0,0]=4 3103 B11R1.37 CSc1cc(ccc1C=O)C 62a_100011935181_200000210301 [1,1,0,0,0,0|1,0,1]=4 3104 B11R1.37 CSc1cc(ccc1C=O)C 62a_200000210301_100011935181 [1,1,0,0,0,0|1,0,1]=4 3105 B11R1.37 CSc1cc(ccc1CO)Br 62a_100010146605_200000210301 [1,1,0,0,0,0|2,0,0]=4 3106 B11R1.37 CSc1cc(ccc1CO)Br 62a_200000210301_100010146605 [1,1,0,0,0,0|2,0,0]=4 3107 B11R1.37 CSc1cc(ccc1CO)Cl 62a_100000722340_200000210301 [1,1,0,0,0,0|2,0,0]=4 3108 B11R1.37 CSc1cc(ccc1CO)Cl 62a_200000210301_100000722340 [1,1,0,0,0,0|2,0,0]=4 3109 B11R1.37 CSc1cc(ccc1CO)F 62a_100000744086_200000210301 [1,1,0,0,0,0|2,0,0]=4 3110 B11R1.37 CSc1cc(ccc1CO)F 62a_200000210301_100000744086 [1,1,0,0,0,0|2,0,0]=4 3111 B11R1.37 CSc1cc(ccc1CO)O 62a_100010146404_200000210301 [1,1,0,0,0,0|2,0,0]=4 3112 B11R1.37 CSc1cc(ccc1CO)O 62a_200000210301_100010146404 [1,1,0,0,0,0|2,0,0]=4 3113 B11R1.37 CSc1cc(ccc1NN)C 62a_100016996181_200000210301 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.37 CSc1cc(ccc1NN)C 62a_200000210301_100016996181 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.37 CSc1cc(ccc1S[13CH3])C 62a_200010709736_200025704644 [1,1,0,0,0,0|1,1,0]=4 3116 B11R1.37 CSc1cc(ccc1S[13CH3])C 62a_200025704644_200010709736 [1,1,0,0,0,0|1,1,0]=4 3117 B11R1.37 CSc1ccc(cc1C=O)Br 62a_100010185651_200000210301 [1,1,0,0,0,0|1,1,0]=4 3118 B11R1.37 CSc1ccc(cc1C=O)Br 62a_200000210301_100010185651 [1,1,0,0,0,0|1,1,0]=4 3119 B11R1.37 CSc1ccc(cc1C=O)C 62a_100011551863_200000210301 [1,1,0,0,0,0|0,1,0]=3 3120 B11R1.37 CSc1ccc(cc1C=O)C 62a_200000210301_100011551863 [1,1,0,0,0,0|0,1,0]=3 3121 B11R1.37 CSc1ccc(cc1C=O)Cl 62a_100010254386_200000210301 [1,1,0,0,0,0|1,1,0]=4 3122 B11R1.37 CSc1ccc(cc1C=O)Cl 62a_200000210301_100010254386 [1,1,0,0,0,0|1,1,0]=4 3123 B11R1.37 CSc1ccc(cc1C=O)F 62a_100011218309_200000210301 [1,1,0,0,0,0|1,1,0]=4 3124 B11R1.37 CSc1ccc(cc1C=O)F 62a_200000210301_100011218309 [1,1,0,0,0,0|1,1,0]=4 3125 B11R1.37 CSc1ccc(cc1C=O)O 62a_100000690577_200000210301 [1,1,0,0,0,0|1,1,0]=4 3126 B11R1.37 CSc1ccc(cc1C=O)O 62a_200000210301_100000690577 [1,1,0,0,0,0|1,1,0]=4 3127 B11R1.37 CSc1ccc(cc1SC)C 62a_200000210301_200010201864 [1,1,0,0,0,0|1,1,0]=4 3128 B11R1.37 CSc1ccc(cc1SC)C 62a_200000210301_200010709736 [1,1,0,0,0,0|1,1,0]=4 3129 B11R1.37 CSc1ccc(cc1SC)C 62a_200010201864_200000210301 [1,1,0,0,0,0|1,1,0]=4 3130 B11R1.37 CSc1ccc(cc1SC)C 62a_200010709736_200000210301 [1,1,0,0,0,0|1,1,0]=4 3131 B11R1.37 CSc1ccc(cc1S[13CH3])C 62a_200010201864_200025704644 [1,1,0,0,0,0|1,1,0]=4 3132 B11R1.37 CSc1ccc(cc1S[13CH3])C 62a_200025704644_200010201864 [1,1,0,0,0,0|1,1,0]=4 3133 B11R1.37 CSc1ccc(nc1C=O)C 62a_100010173661_200000210301 [1,1,0,0,0,0|1,1,0]=4 3134 B11R1.37 CSc1ccc(nc1C=O)C 62a_200000210301_100010173661 [1,1,0,0,0,0|1,1,0]=4 3135 B11R1.37 CSc1nc(ccc1CO)C 62a_102495338573_200000210301 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.37 CSc1nc(ccc1CO)C 62a_200000210301_102495338573 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.37 CSc1ncc(cc1C=O)C 62a_200000210301_100000050350 [1,1,0,0,0,0|1,1,0]=4 3138 B11R1.37 Cc1ccc(c(c1)C#N)O[13CH3] 34a_200012180384_200025704644 [1,1,0,0,0,0|1,0,1]=4 3139 B11R1.37 Cc1ccc(c(c1)C#N)O[13CH3] 7a_200012180384_200025704644 [1,1,0,0,0,0|1,0,1]=4 3140 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_100011551863_200025704644 [1,1,0,0,0,0|0,1,0]=3 3141 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100011551863 [1,1,0,0,0,0|0,1,0]=3 3142 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 34a_200011846009_200025704644 [1,1,0,0,0,0|0,0,2]=4 3143 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 7a_200011846009_200025704644 [1,1,0,0,0,0|0,0,2]=4 3144 B11R1.37 Cc1ccc(c(c1)N[13CH3])C#N 34a_100011218341_200025704644 [1,1,0,0,0,0|2,0,0]=4 3145 B11R1.37 Cc1ccc(c(c1)N[13CH3])C#N 7a_100011218341_200025704644 [1,1,0,0,0,0|2,0,0]=4 3146 B11R1.37 Cc1ccc(c(c1)N[13CH3])CO 34a_100000087799_200025704644 [1,1,0,0,0,0|1,0,0]=3 3147 B11R1.37 Cc1ccc(c(c1)O[13CH3])C#N 34a_100011640519_200025704644 [1,1,0,0,0,0|2,0,0]=4 3148 B11R1.37 Cc1ccc(c(c1)O[13CH3])C#N 7a_100011640519_200025704644 [1,1,0,0,0,0|2,0,0]=4 3149 B11R1.37 Cc1ccc(c(c1)S[13CH3])C#N 62a_200025704644_100000693804 [1,1,0,0,0,0|2,0,0]=4 3150 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_100011935181_200025704644 [1,1,0,0,0,0|1,0,1]=4 3151 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100011935181 [1,1,0,0,0,0|1,0,1]=4 3152 B11R1.37 Cc1ccc(c(c1)S[13CH3])NN 62a_100016996181_200025704644 [1,1,0,0,0,0|2,0,0]=4 3153 B11R1.37 Cc1ccc(c(c1)S[13CH3])NN 62a_200025704644_100016996181 [1,1,0,0,0,0|2,0,0]=4 3154 B11R1.37 Cc1ccc(c(n1)C=O)S[13CH3] 62a_100010173661_200025704644 [1,1,0,0,0,0|1,1,0]=4 3155 B11R1.37 Cc1ccc(c(n1)C=O)S[13CH3] 62a_200025704644_100010173661 [1,1,0,0,0,0|1,1,0]=4 3156 B11R1.37 Cc1ccc(c(n1)S[13CH3])CO 62a_102495338573_200025704644 [1,1,0,0,0,0|2,0,0]=4 3157 B11R1.37 Cc1ccc(c(n1)S[13CH3])CO 62a_200025704644_102495338573 [1,1,0,0,0,0|2,0,0]=4 3158 B11R1.37 Cc1cnc(c(c1)C=O)S[13CH3] 62a_200025704644_100000050350 [1,1,0,0,0,0|1,1,0]=4 3159 B11R1.37 N#Cc1ccc(cc1C=O)O 271570a_203496583355_100010194279 [1,1,0,0,0,0|2,0,0]=4 3160 B11R1.37 O=Cc1ccc(cc1C=O)O 271570a_203496583355_200010077131 [1,1,0,0,0,0|1,0,1]=4 3161 B11R1.37 [13CH3]Nc1cc(ccc1CO)Br 34a_100000718831_200025704644 [1,1,0,0,0,0|2,0,0]=4 3162 B11R1.37 [13CH3]Nc1cc(ccc1CO)Cl 34a_100000238622_200025704644 [1,1,0,0,0,0|2,0,0]=4 3163 B11R1.37 [13CH3]Nc1cc(ccc1CO)F 34a_100011996588_200025704644 [1,1,0,0,0,0|2,0,0]=4 3164 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 34a_100000071718_200025704644 [1,1,0,0,0,0|2,0,0]=4 3165 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 7a_100000071718_200025704644 [1,1,0,0,0,0|2,0,0]=4 3166 B11R1.37 [13CH3]Sc1cc(ccc1CO)Br 62a_100010146605_200025704644 [1,1,0,0,0,0|2,0,0]=4 3167 B11R1.37 [13CH3]Sc1cc(ccc1CO)Br 62a_200025704644_100010146605 [1,1,0,0,0,0|2,0,0]=4 3168 B11R1.37 [13CH3]Sc1cc(ccc1CO)Cl 62a_100000722340_200025704644 [1,1,0,0,0,0|2,0,0]=4 3169 B11R1.37 [13CH3]Sc1cc(ccc1CO)Cl 62a_200025704644_100000722340 [1,1,0,0,0,0|2,0,0]=4 3170 B11R1.37 [13CH3]Sc1cc(ccc1CO)F 62a_100000744086_200025704644 [1,1,0,0,0,0|2,0,0]=4 3171 B11R1.37 [13CH3]Sc1cc(ccc1CO)F 62a_200025704644_100000744086 [1,1,0,0,0,0|2,0,0]=4 3172 B11R1.37 [13CH3]Sc1cc(ccc1CO)O 62a_100010146404_200025704644 [1,1,0,0,0,0|2,0,0]=4 3173 B11R1.37 [13CH3]Sc1cc(ccc1CO)O 62a_200025704644_100010146404 [1,1,0,0,0,0|2,0,0]=4 3174 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Br 62a_100010185651_200025704644 [1,1,0,0,0,0|1,1,0]=4 3175 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Br 62a_200025704644_100010185651 [1,1,0,0,0,0|1,1,0]=4 3176 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Cl 62a_100010254386_200025704644 [1,1,0,0,0,0|1,1,0]=4 3177 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Cl 62a_200025704644_100010254386 [1,1,0,0,0,0|1,1,0]=4 3178 B11R1.37 [13CH3]Sc1ccc(cc1C=O)F 62a_100011218309_200025704644 [1,1,0,0,0,0|1,1,0]=4 3179 B11R1.37 [13CH3]Sc1ccc(cc1C=O)F 62a_200025704644_100011218309 [1,1,0,0,0,0|1,1,0]=4 3180 B11R1.37 [13CH3]Sc1ccc(cc1C=O)O 62a_100000690577_200025704644 [1,1,0,0,0,0|1,1,0]=4 3181 B11R1.37 [13CH3]Sc1ccc(cc1C=O)O 62a_200025704644_100000690577 [1,1,0,0,0,0|1,1,0]=4 3182 B11R1.72 CNc1c(ccc(c1C)Br)O 34a_100013039247_200000210301 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.72 CNc1c(ccc(c1C)C)C 2230a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.72 CNc1c(ccc(c1C)C)C 34a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.72 CNc1c(ccc(c1C)C)C 7a_100000117417_200000210301 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.72 CNc1c(ccc(c1Cl)C)Cl 34a_100000210993_200000210301 [1,1,0,0,0,0|2,0,0]=4 3187 B11R1.72 CNc1c(ccc(c1Cl)C)F 34a_106744479701_200000210301 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.72 CNc1c(ccc(c1F)C)Cl 34a_100000062009_200000210301 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.72 CNc1c(ccc(c1F)C)F 2230a_102495364760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.72 CNc1c(ccc(c1F)C)F 34a_102495364760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.72 COc1c(ccc(c1Br)C)F 34a_200010223207_200000210301 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.72 COc1c(ccc(c1Br)C)F 7a_200010223207_200000210301 [1,1,0,0,0,0|2,0,0]=4 3193 B11R1.72 COc1c(ccc(c1C)C)C 34a_100000211305_200000210301 [1,1,0,0,0,0|2,0,0]=4 3194 B11R1.72 COc1c(ccc(c1C)C)C 7a_100000211305_200000210301 [1,1,0,0,0,0|2,0,0]=4 3195 B11R1.72 COc1c(ccc(c1Cl)C)Cl 34a_200000087117_200000210301 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.72 COc1c(ccc(c1Cl)C)Cl 7a_200000087117_200000210301 [1,1,0,0,0,0|2,0,0]=4 3197 B11R1.72 COc1c(ccc(c1Cl)C)F 34a_100000035349_200000210301 [1,1,0,0,0,0|2,0,0]=4 3198 B11R1.72 COc1c(ccc(c1Cl)C)F 7a_100000035349_200000210301 [1,1,0,0,0,0|2,0,0]=4 3199 B11R1.72 COc1c(ccc(c1F)C)Br 34a_100000722096_200000210301 [1,1,0,0,0,0|2,0,0]=4 3200 B11R1.72 COc1c(ccc(c1F)C)Br 7a_100000722096_200000210301 [1,1,0,0,0,0|2,0,0]=4 3201 B11R1.72 COc1c(ccc(c1F)C)Cl 34a_200000034537_200000210301 [1,1,0,0,0,0|2,0,0]=4 3202 B11R1.72 COc1c(ccc(c1F)C)Cl 7a_200000034537_200000210301 [1,1,0,0,0,0|2,0,0]=4 3203 B11R1.72 COc1c(ccc(c1F)C)F 34a_100011216644_200000210301 [1,1,0,0,0,0|2,0,0]=4 3204 B11R1.72 COc1c(ccc(c1F)C)F 7a_100011216644_200000210301 [1,1,0,0,0,0|2,0,0]=4 3205 B11R1.72 COc1c(ccc(c1F)C)O 271570a_203496583355_100010081143 [1,1,0,0,0,0|1,0,0]=3 3206 B11R1.72 COc1c(ccc(c1F)F)O 271570a_203496583355_100010223324 [1,1,0,0,0,0|2,0,0]=4 3207 B11R1.72 COc1c(ccc(c1O)F)O 271570a_203496583355_200010167157 [1,1,0,0,0,0|2,0,0]=4 3208 B11R1.72 CSc1c(ccc(c1F)C)O 271570a_203496583355_200134762213 [1,1,0,0,0,0|1,0,0]=3 3209 B11R1.72 Cc1c(ccc(c1N[13CH3])O)Br 34a_100013039247_200025704644 [1,1,0,0,0,0|2,0,0]=4 3210 B11R1.72 Cc1ccc(c(c1Br)O[13CH3])F 34a_200010223207_200025704644 [1,1,0,0,0,0|2,0,0]=4 3211 B11R1.72 Cc1ccc(c(c1Br)O[13CH3])F 7a_200010223207_200025704644 [1,1,0,0,0,0|2,0,0]=4 3212 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 2230a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 3213 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 34a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 3214 B11R1.72 Cc1ccc(c(c1C)N[13CH3])C 7a_100000117417_200025704644 [1,1,0,0,0,0|2,0,0]=4 3215 B11R1.72 Cc1ccc(c(c1C)O[13CH3])C 34a_100000211305_200025704644 [1,1,0,0,0,0|2,0,0]=4 3216 B11R1.72 Cc1ccc(c(c1C)O[13CH3])C 7a_100000211305_200025704644 [1,1,0,0,0,0|2,0,0]=4 3217 B11R1.72 Cc1ccc(c(c1Cl)N[13CH3])Cl 34a_100000210993_200025704644 [1,1,0,0,0,0|2,0,0]=4 3218 B11R1.72 Cc1ccc(c(c1Cl)N[13CH3])F 34a_106744479701_200025704644 [1,1,0,0,0,0|2,0,0]=4 3219 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])Cl 34a_200000087117_200025704644 [1,1,0,0,0,0|2,0,0]=4 3220 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])Cl 7a_200000087117_200025704644 [1,1,0,0,0,0|2,0,0]=4 3221 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])F 34a_100000035349_200025704644 [1,1,0,0,0,0|2,0,0]=4 3222 B11R1.72 Cc1ccc(c(c1Cl)O[13CH3])F 7a_100000035349_200025704644 [1,1,0,0,0,0|2,0,0]=4 3223 B11R1.72 Cc1ccc(c(c1F)C#N)O 271570a_203496583355_100000062008 [1,1,0,0,0,0|1,0,1]=4 3224 B11R1.72 Cc1ccc(c(c1F)C=O)O 271570a_203496583355_100000039034 [1,1,0,0,0,0|0,0,0]=2 3225 B11R1.72 Cc1ccc(c(c1F)N[13CH3])Cl 34a_100000062009_200025704644 [1,1,0,0,0,0|2,0,0]=4 3226 B11R1.72 Cc1ccc(c(c1F)N[13CH3])F 2230a_102495364760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3227 B11R1.72 Cc1ccc(c(c1F)N[13CH3])F 34a_102495364760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3228 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Br 34a_100000722096_200025704644 [1,1,0,0,0,0|2,0,0]=4 3229 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Br 7a_100000722096_200025704644 [1,1,0,0,0,0|2,0,0]=4 3230 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Cl 34a_200000034537_200025704644 [1,1,0,0,0,0|2,0,0]=4 3231 B11R1.72 Cc1ccc(c(c1F)O[13CH3])Cl 7a_200000034537_200025704644 [1,1,0,0,0,0|2,0,0]=4 3232 B11R1.72 Cc1ccc(c(c1F)O[13CH3])F 34a_100011216644_200025704644 [1,1,0,0,0,0|2,0,0]=4 3233 B11R1.72 Cc1ccc(c(c1F)O[13CH3])F 7a_100011216644_200025704644 [1,1,0,0,0,0|2,0,0]=4 3234 B11R1.72 Cc1ccc(c(c1O)C=O)F 271570a_203496583355_100000033498 [1,1,0,0,0,0|1,0,0]=3 3235 B11R1.72 O=Cc1c(ccc(c1F)F)O 271570a_203496583355_100009814791 [1,1,0,0,0,0|1,0,0]=3 3236 B11R1.72 O=Cc1c(ccc(c1F)O)Br 271570a_203496583355_100010769263 [1,1,0,0,0,0|2,0,0]=4 3237 B11R1.72 O=Cc1c(ccc(c1F)O)Cl 271570a_203496583355_100010782290 [1,1,0,0,0,0|2,0,0]=4 3238 B11R1.72 O=Cc1c(ccc(c1F)O)F 271570a_203496583355_100000725362 [1,1,0,0,0,0|2,0,0]=4 3239 B11R1.72 O=Cc1c(ccc(c1O)F)F 271570a_203496583355_100000034233 [1,1,0,0,0,0|2,0,0]=4 3240 B11R1.72 O=Cc1c(ccc(c1O)F)O 271570a_203496583355_100010762561 [1,1,0,0,0,0|1,0,0]=3 3241 B11R1.72 O=Cc1c(ccc(c1O)O)O 271570a_203496583355_100010184888 [1,1,0,0,0,0|1,0,0]=3 3242 B11R1.72 O=Cc1c(cnc(c1F)F)O 271570a_203496583355_100009829415 [1,1,0,0,0,0|2,0,0]=4 3243 B11R1.182 C=C=Cc1cc(ccc1Br)C 271570a_100015277604_100012353751 [1,1,0,0,0,0|1,0,1]=4 3244 B11R1.182 C=C=Cc1cc(ccc1C)C 271570a_100015277604_100000210833 [1,1,0,0,0,0|1,0,1]=4 3245 B11R1.182 C=C=Cc1cc(ccc1Cl)C 271570a_100015277604_100012356289 [1,1,0,0,0,0|1,0,1]=4 3246 B11R1.182 C=C=Cc1cc(ccc1F)C 271570a_100015277604_100000736223 [1,1,0,0,0,0|1,0,1]=4 3247 B11R1.182 C=C=Cc1cc(ccc1N)C 271570a_100015277604_100000210942 [1,1,0,0,0,0|1,0,1]=4 3248 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [1,1,0,0,0,0|1,0,1]=4 3249 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [1,1,0,0,0,0|0,0,1]=3 3250 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [1,1,0,0,0,0|1,0,1]=4 3251 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [1,1,0,0,0,0|1,0,1]=4 3252 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [1,1,0,0,0,0|1,0,1]=4 3253 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [1,1,0,0,0,0|1,0,1]=4 3254 B11R1.182 C=C=Cc1cc(cnc1O)C 271570a_100015277604_100000049931 [1,1,0,0,0,0|1,0,1]=4 3255 B11R1.182 C=C=Cc1cc(ncc1O)C 271570a_100015277604_100009843476 [1,1,0,0,0,0|1,0,1]=4 3256 B11R1.182 C=C=Cc1nc(ccc1O)C 271570a_100015277604_100000702858 [1,1,0,0,0,0|1,0,1]=4 3257 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [1,1,0,0,0,0|2,0,0]=4 3258 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [1,1,0,0,0,0|1,0,0]=3 3259 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [1,1,0,0,0,0|2,0,0]=4 3260 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [1,1,0,0,0,0|2,0,0]=4 3261 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [1,1,0,0,0,0|2,0,0]=4 3262 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [1,1,0,0,0,0|2,0,0]=4 3263 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [1,1,0,0,0,0|2,0,0]=4 3264 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [1,1,0,0,0,0|1,0,0]=3 3265 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [1,1,0,0,0,0|2,0,0]=4 3266 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [1,1,0,0,0,0|2,0,0]=4 3267 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [1,1,0,0,0,0|2,0,0]=4 3268 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [1,1,0,0,0,0|2,0,0]=4 3269 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [1,1,0,0,0,0|2,0,0]=4 3270 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [1,1,0,0,0,0|1,0,0]=3 3271 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [1,1,0,0,0,0|2,0,0]=4 3272 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [1,1,0,0,0,0|2,0,0]=4 3273 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [1,1,0,0,0,0|2,0,0]=4 3274 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [1,1,0,0,0,0|1,0,0]=3 3277 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [1,1,0,0,0,0|2,0,0]=4 3278 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [1,1,0,0,0,0|2,0,0]=4 3280 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [1,1,0,0,0,0|2,0,0]=4 3281 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [1,1,0,0,0,0|2,0,0]=4 3282 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [1,1,0,0,0,0|1,0,0]=3 3283 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [1,1,0,0,0,0|2,0,0]=4 3284 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [1,1,0,0,0,0|2,0,0]=4 3285 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [1,1,0,0,0,0|2,0,0]=4 3286 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [1,1,0,0,0,0|1,0,0]=3 3288 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [1,1,0,0,0,0|0,0,0]=2 3289 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [1,1,0,0,0,0|1,0,0]=3 3290 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [1,1,0,0,0,0|1,0,0]=3 3291 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [1,1,0,0,0,0|1,0,0]=3 3292 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,1,0,0,0,0|1,0,0]=3 3293 B11R1.182 CC=Cc1cc(cnc1C)C 271570a_100016259895_100009817436 [1,1,0,0,0,0|2,0,0]=4 3294 B11R1.182 CC=Cc1cc(cnc1Cl)C 271570a_100016259895_100010210167 [1,1,0,0,0,0|2,0,0]=4 3295 B11R1.182 CC=Cc1cc(cnc1F)C 271570a_100016259895_100000049784 [1,1,0,0,0,0|2,0,0]=4 3296 B11R1.182 CC=Cc1cc(cnc1N)C 271570a_100016259895_100000049664 [1,1,0,0,0,0|2,0,0]=4 3297 B11R1.182 CC=Cc1cc(cnc1O)Br 271570a_100016259895_100010197142 [1,1,0,0,0,0|2,0,0]=4 3298 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [1,1,0,0,0,0|1,0,0]=3 3299 B11R1.182 CC=Cc1cc(cnc1O)Cl 271570a_100016259895_100010188700 [1,1,0,0,0,0|2,0,0]=4 3300 B11R1.182 CC=Cc1cc(ncc1C)C 271570a_100016259895_100009862788 [1,1,0,0,0,0|2,0,0]=4 3301 B11R1.182 CC=Cc1cc(ncc1F)C 271570a_100016259895_100009867690 [1,1,0,0,0,0|2,0,0]=4 3302 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [1,1,0,0,0,0|1,0,0]=3 3303 B11R1.182 CC=Cc1cc(ncc1O)Cl 271570a_100016259895_100000698892 [1,1,0,0,0,0|2,0,0]=4 3304 B11R1.182 CC=Cc1cn(ccc1=O)C 271570a_100016259895_100010750718 [1,1,0,0,0,0|1,0,1]=4 3305 B11R1.182 CC=Cc1nc(ccc1C)C 271570a_100016259895_100009854376 [1,1,0,0,0,0|2,0,0]=4 3306 B11R1.182 CC=Cc1nc(ccc1F)C 271570a_100016259895_100009817602 [1,1,0,0,0,0|2,0,0]=4 3307 B11R1.182 CC=Cc1nc(ccc1N)C 271570a_100016259895_100000685570 [1,1,0,0,0,0|2,0,0]=4 3308 B11R1.182 CC=Cc1nc(ccc1O)Br 271570a_100016259895_100010253912 [1,1,0,0,0,0|2,0,0]=4 3309 B11R1.182 CC=Cc1nc(ccc1O)C 271570a_100016259895_100000702858 [1,1,0,0,0,0|1,0,0]=3 3310 B11R1.182 CC=Cc1nc(ccc1O)Cl 271570a_100016259895_100000696390 [1,1,0,0,0,0|2,0,0]=4 3311 B11R1.182 CC=Cc1nc(ccc1O)F 271570a_100016259895_100010382442 [1,1,0,0,0,0|2,0,0]=4 3312 B11R1.182 CCNc1cc(ccc1Br)C 34a_100000745044_100000210202 [1,1,0,0,0,0|1,0,1]=4 3313 B11R1.182 CCNc1cc(ccc1C)C 2230a_100000185781_100000210202 [1,1,0,0,0,0|1,0,1]=4 3314 B11R1.182 CCNc1cc(ccc1C)C 34a_100000185781_100000210202 [1,1,0,0,0,0|1,0,1]=4 3315 B11R1.182 CCNc1cc(ccc1C)C 7a_100000185781_100000210202 [1,1,0,0,0,0|1,0,1]=4 3316 B11R1.182 CCNc1cc(ccc1Cl)C 34a_100011215360_100000210202 [1,1,0,0,0,0|1,0,1]=4 3317 B11R1.182 CCNc1cc(ccc1F)C 34a_100000211285_100000210202 [1,1,0,0,0,0|1,0,1]=4 3318 B11R1.182 CCNc1cc(ccc1I)C 34a_100011216686_100000210202 [1,1,0,0,0,0|1,0,1]=4 3319 B11R1.182 CCNc1cc(ccc1O)Br 34a_100000752626_100000210202 [1,1,0,0,0,0|1,0,1]=4 3320 B11R1.182 CCNc1cc(ccc1O)C 34a_100011215204_100000210202 [1,1,0,0,0,0|0,0,1]=3 3321 B11R1.182 CCNc1cc(ccc1O)Cl 34a_100000210500_100000210202 [1,1,0,0,0,0|1,0,1]=4 3322 B11R1.182 CCNc1cc(ccc1O)F 34a_100000759472_100000210202 [1,1,0,0,0,0|1,0,1]=4 3323 B11R1.182 CCOc1cc(ccc1Br)C 34a_100012002257_100000210202 [1,1,0,0,0,0|1,0,1]=4 3324 B11R1.182 CCOc1cc(ccc1Br)C 7a_100012002257_100000210202 [1,1,0,0,0,0|1,0,1]=4 3325 B11R1.182 CCOc1cc(ccc1C)C 34a_100000210931_100000210202 [1,1,0,0,0,0|1,0,1]=4 3326 B11R1.182 CCOc1cc(ccc1C)C 7a_100000210931_100000210202 [1,1,0,0,0,0|1,0,1]=4 3327 B11R1.182 CCOc1cc(ccc1Cl)C 34a_100000211493_100000210202 [1,1,0,0,0,0|1,0,1]=4 3328 B11R1.182 CCOc1cc(ccc1Cl)C 7a_100000211493_100000210202 [1,1,0,0,0,0|1,0,1]=4 3329 B11R1.182 CCOc1cc(ccc1F)C 34a_100000759540_100000210202 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.182 CCOc1cc(ccc1F)C 7a_100000759540_100000210202 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.182 CCOc1cc(ccc1N)C 34a_100000211527_100000210202 [1,1,0,0,0,0|1,0,1]=4 3332 B11R1.182 CCOc1cc(ccc1N)C 7a_100000211527_100000210202 [1,1,0,0,0,0|1,0,1]=4 3333 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [1,1,0,0,0,0|0,0,1]=3 3334 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [1,1,0,0,0,0|1,0,1]=4 3335 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [1,1,0,0,0,0|1,0,1]=4 3336 B11R1.182 CCSc1cc(ccc1Br)C 62a_100000210202_100012353751 [1,1,0,0,0,0|1,0,1]=4 3337 B11R1.182 CCSc1cc(ccc1Br)C 62a_100012353751_100000210202 [1,1,0,0,0,0|1,0,1]=4 3338 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210202_100000210833 [1,1,0,0,0,0|1,0,1]=4 3339 B11R1.182 CCSc1cc(ccc1C)C 62a_100000210833_100000210202 [1,1,0,0,0,0|1,0,1]=4 3340 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100000210202_100012356289 [1,1,0,0,0,0|1,0,1]=4 3341 B11R1.182 CCSc1cc(ccc1Cl)C 62a_100012356289_100000210202 [1,1,0,0,0,0|1,0,1]=4 3342 B11R1.182 CCSc1cc(ccc1F)C 62a_100000210202_100000736223 [1,1,0,0,0,0|1,0,1]=4 3343 B11R1.182 CCSc1cc(ccc1F)C 62a_100000736223_100000210202 [1,1,0,0,0,0|1,0,1]=4 3344 B11R1.182 CCSc1cc(ccc1N)C 62a_100000210202_100011356834 [1,1,0,0,0,0|1,0,1]=4 3345 B11R1.182 CCSc1cc(ccc1N)C 62a_100011356834_100000210202 [1,1,0,0,0,0|1,0,1]=4 3346 B11R1.182 CCSc1cc(ccc1O)Br 62a_100000210202_100012355227 [1,1,0,0,0,0|1,0,1]=4 3347 B11R1.182 CCSc1cc(ccc1O)Br 62a_100012355227_100000210202 [1,1,0,0,0,0|1,0,1]=4 3348 B11R1.182 CCSc1cc(ccc1O)C 62a_100000210202_100000765521 [1,1,0,0,0,0|0,0,1]=3 3349 B11R1.182 CCSc1cc(ccc1O)C 62a_100000765521_100000210202 [1,1,0,0,0,0|0,0,1]=3 3350 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100000210202_100011356953 [1,1,0,0,0,0|1,0,1]=4 3351 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100011356953_100000210202 [1,1,0,0,0,0|1,0,1]=4 3352 B11R1.182 CCSc1cc(ccc1O)F 62a_100000210202_100000211999 [1,1,0,0,0,0|1,0,1]=4 3353 B11R1.182 CCSc1cc(ccc1O)F 62a_100000211999_100000210202 [1,1,0,0,0,0|1,0,1]=4 3354 B11R1.182 CCSc1cc(ccc1O)N 62a_100000210202_100011534360 [1,1,0,0,0,0|1,0,1]=4 3355 B11R1.182 CCSc1cc(ccc1O)N 62a_100011534360_100000210202 [1,1,0,0,0,0|1,0,1]=4 3356 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [1,1,0,0,0,0|1,0,1]=4 3357 B11R1.182 CCSc1cc(cnc1O)C 62a_100000210202_100000719714 [1,1,0,0,0,0|1,0,1]=4 3358 B11R1.182 CCSc1cc(cnc1O)C 62a_100000719714_100000210202 [1,1,0,0,0,0|1,0,1]=4 3359 B11R1.182 CCSc1cc(ncc1O)C 62a_100000210202_100009843476 [1,1,0,0,0,0|1,0,1]=4 3360 B11R1.182 CCSc1cc(ncc1O)C 62a_100009843476_100000210202 [1,1,0,0,0,0|1,0,1]=4 3361 B11R1.182 CCSc1nc(ccc1O)C 62a_100000210202_100000702858 [1,1,0,0,0,0|1,0,1]=4 3362 B11R1.182 CCSc1nc(ccc1O)C 62a_100000702858_100000210202 [1,1,0,0,0,0|1,0,1]=4 3363 B11R1.182 CNCc1cc(ccc1Br)C 207a_100102657272_100011551863 [1,1,0,0,0,0|1,0,1]=4 3364 B11R1.182 CNCc1cc(ccc1Br)C 26a_100102657272_100012002257 [1,1,0,0,0,0|1,0,1]=4 3365 B11R1.182 CNCc1cc(ccc1Br)C 270004a_106832991635_100011551863 [1,1,0,0,0,0|1,0,1]=4 3366 B11R1.182 CNCc1cc(ccc1C)C 207a_100102657272_100000211343 [1,1,0,0,0,0|1,0,1]=4 3367 B11R1.182 CNCc1cc(ccc1C)C 2230a_106832991635_100000184699 [1,1,0,0,0,0|1,0,1]=4 3368 B11R1.182 CNCc1cc(ccc1C)C 270004a_106832991635_100000211343 [1,1,0,0,0,0|1,0,1]=4 3369 B11R1.182 CNCc1cc(ccc1C)C 34a_100000174964_200000210301 [1,1,0,0,0,0|1,0,1]=4 3370 B11R1.182 CNCc1cc(ccc1C)C 34a_100102657272_100000184699 [1,1,0,0,0,0|1,0,1]=4 3371 B11R1.182 CNCc1cc(ccc1C)C 7a_106832991635_100000184699 [1,1,0,0,0,0|1,0,1]=4 3372 B11R1.182 CNCc1cc(ccc1Cl)C 207a_100102657272_100011551332 [1,1,0,0,0,0|1,0,1]=4 3373 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_100025705715_200000210301 [1,1,0,0,0,0|1,0,1]=4 3374 B11R1.182 CNCc1cc(ccc1Cl)C 2230a_106832991635_100009871730 [1,1,0,0,0,0|1,0,1]=4 3375 B11R1.182 CNCc1cc(ccc1Cl)C 26a_100102657272_100000211493 [1,1,0,0,0,0|1,0,1]=4 3376 B11R1.182 CNCc1cc(ccc1Cl)C 270004a_106832991635_100011551332 [1,1,0,0,0,0|1,0,1]=4 3377 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100025705715_200000210301 [1,1,0,0,0,0|1,0,1]=4 3378 B11R1.182 CNCc1cc(ccc1Cl)C 34a_100102657272_100009871730 [1,1,0,0,0,0|1,0,1]=4 3379 B11R1.182 CNCc1cc(ccc1Cl)C 7a_106832991635_100009871730 [1,1,0,0,0,0|1,0,1]=4 3380 B11R1.182 CNCc1cc(ccc1F)C 207a_100102657272_100000756917 [1,1,0,0,0,0|1,0,1]=4 3381 B11R1.182 CNCc1cc(ccc1F)C 2230a_106832991635_100011260760 [1,1,0,0,0,0|1,0,1]=4 3382 B11R1.182 CNCc1cc(ccc1F)C 270004a_106832991635_100000756917 [1,1,0,0,0,0|1,0,1]=4 3383 B11R1.182 CNCc1cc(ccc1F)C 34a_100102657272_100011260760 [1,1,0,0,0,0|1,0,1]=4 3384 B11R1.182 CNCc1cc(ccc1F)C 34a_100102693586_200000210301 [1,1,0,0,0,0|1,0,1]=4 3385 B11R1.182 CNCc1cc(ccc1F)C 7a_106832991635_100011260760 [1,1,0,0,0,0|1,0,1]=4 3386 B11R1.182 CNCc1cc(ccc1I)C 207a_100102657272_100010150105 [1,1,0,0,0,0|1,0,1]=4 3387 B11R1.182 CNCc1cc(ccc1I)C 270004a_106832991635_100010150105 [1,1,0,0,0,0|1,0,1]=4 3388 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [1,1,0,0,0,0|1,0,1]=4 3389 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [1,1,0,0,0,0|1,0,1]=4 3390 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [1,1,0,0,0,0|1,0,1]=4 3391 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [1,1,0,0,0,0|1,0,1]=4 3392 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,1,0,0,0,0|1,0,1]=4 3393 B11R1.182 CNCc1nc(ccc1O)C 2230a_106832991635_100020630696 [1,1,0,0,0,0|1,0,1]=4 3394 B11R1.182 CNCc1nc(ccc1O)C 34a_100102657272_100020630696 [1,1,0,0,0,0|1,0,1]=4 3395 B11R1.182 CNCc1nc(ccc1O)C 7a_106832991635_100020630696 [1,1,0,0,0,0|1,0,1]=4 3396 B11R1.182 COCc1cc(ccc1Br)C 34a_100012361352_200000210301 [1,1,0,0,0,0|1,0,1]=4 3397 B11R1.182 COCc1cc(ccc1Br)C 7a_100012361352_200000210301 [1,1,0,0,0,0|1,0,1]=4 3398 B11R1.182 COCc1cc(ccc1C)C 34a_100138415774_100000184699 [1,1,0,0,0,0|1,0,1]=4 3399 B11R1.182 COCc1cc(ccc1C)C 34a_200011215349_200000210301 [1,1,0,0,0,0|1,0,1]=4 3400 B11R1.182 COCc1cc(ccc1C)C 7a_200011215349_200000210301 [1,1,0,0,0,0|1,0,1]=4 3401 B11R1.182 COCc1cc(ccc1Cl)C 34a_100009878994_200000210301 [1,1,0,0,0,0|1,0,1]=4 3402 B11R1.182 COCc1cc(ccc1Cl)C 34a_100138415774_100009871730 [1,1,0,0,0,0|1,0,1]=4 3403 B11R1.182 COCc1cc(ccc1Cl)C 7a_100009878994_200000210301 [1,1,0,0,0,0|1,0,1]=4 3404 B11R1.182 COCc1cc(ccc1F)C 34a_100011692775_200000210301 [1,1,0,0,0,0|1,0,1]=4 3405 B11R1.182 COCc1cc(ccc1F)C 34a_100138415774_100011260760 [1,1,0,0,0,0|1,0,1]=4 3406 B11R1.182 COCc1cc(ccc1F)C 7a_100011692775_200000210301 [1,1,0,0,0,0|1,0,1]=4 3407 B11R1.182 COCc1cc(ccc1N)C 34a_100011215565_200000210301 [1,1,0,0,0,0|1,0,1]=4 3408 B11R1.182 COCc1cc(ccc1N)C 7a_100011215565_200000210301 [1,1,0,0,0,0|1,0,1]=4 3409 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [1,1,0,0,0,0|1,0,1]=4 3410 B11R1.182 COCc1nc(ccc1O)C 34a_100138415774_100020630696 [1,1,0,0,0,0|1,0,1]=4 3411 B11R1.182 CSCc1cc(ccc1C)C 62a_100000184699_200000210301 [1,1,0,0,0,0|1,0,1]=4 3412 B11R1.182 CSCc1cc(ccc1C)C 62a_200000210301_100000184699 [1,1,0,0,0,0|1,0,1]=4 3413 B11R1.182 CSCc1cc(ccc1Cl)C 62a_100009871730_200000210301 [1,1,0,0,0,0|1,0,1]=4 3414 B11R1.182 CSCc1cc(ccc1Cl)C 62a_200000210301_100009871730 [1,1,0,0,0,0|1,0,1]=4 3415 B11R1.182 CSCc1cc(ccc1F)C 62a_100011260760_200000210301 [1,1,0,0,0,0|1,0,1]=4 3416 B11R1.182 CSCc1cc(ccc1F)C 62a_200000210301_100011260760 [1,1,0,0,0,0|1,0,1]=4 3417 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [1,1,0,0,0,0|1,0,1]=4 3418 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [1,1,0,0,0,0|1,0,1]=4 3419 B11R1.182 CSCc1nc(ccc1O)C 62a_100020630696_200000210301 [1,1,0,0,0,0|1,0,1]=4 3420 B11R1.182 CSCc1nc(ccc1O)C 62a_200000210301_100020630696 [1,1,0,0,0,0|1,0,1]=4 3421 B11R1.182 Cc1cc(c(cn1)O)SCF 62a_100009843476_100015361967 [1,1,0,0,0,0|2,0,0]=4 3422 B11R1.182 Cc1cc(c(cn1)O)SCF 62a_100015361967_100009843476 [1,1,0,0,0,0|2,0,0]=4 3423 B11R1.182 Cc1ccc(c(c1)CC#N)O 271570a_203496583355_100010147026 [1,1,0,0,0,0|0,0,2]=4 3424 B11R1.182 Cc1ccc(c(c1)CN[13CH3])C 34a_100000174964_200025704644 [1,1,0,0,0,0|1,0,1]=4 3425 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 2230a_100025705715_200025704644 [1,1,0,0,0,0|1,0,1]=4 3426 B11R1.182 Cc1ccc(c(c1)CN[13CH3])Cl 34a_100025705715_200025704644 [1,1,0,0,0,0|1,0,1]=4 3427 B11R1.182 Cc1ccc(c(c1)CN[13CH3])F 34a_100102693586_200025704644 [1,1,0,0,0,0|1,0,1]=4 3428 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 34a_100012361352_200025704644 [1,1,0,0,0,0|1,0,1]=4 3429 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Br 7a_100012361352_200025704644 [1,1,0,0,0,0|1,0,1]=4 3430 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 34a_200011215349_200025704644 [1,1,0,0,0,0|1,0,1]=4 3431 B11R1.182 Cc1ccc(c(c1)CO[13CH3])C 7a_200011215349_200025704644 [1,1,0,0,0,0|1,0,1]=4 3432 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 34a_100009878994_200025704644 [1,1,0,0,0,0|1,0,1]=4 3433 B11R1.182 Cc1ccc(c(c1)CO[13CH3])Cl 7a_100009878994_200025704644 [1,1,0,0,0,0|1,0,1]=4 3434 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 34a_100011692775_200025704644 [1,1,0,0,0,0|1,0,1]=4 3435 B11R1.182 Cc1ccc(c(c1)CO[13CH3])F 7a_100011692775_200025704644 [1,1,0,0,0,0|1,0,1]=4 3436 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 34a_100011215565_200025704644 [1,1,0,0,0,0|1,0,1]=4 3437 B11R1.182 Cc1ccc(c(c1)CO[13CH3])N 7a_100011215565_200025704644 [1,1,0,0,0,0|1,0,1]=4 3438 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_100000184699_200025704644 [1,1,0,0,0,0|1,0,1]=4 3439 B11R1.182 Cc1ccc(c(c1)CS[13CH3])C 62a_200025704644_100000184699 [1,1,0,0,0,0|1,0,1]=4 3440 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_100009871730_200025704644 [1,1,0,0,0,0|1,0,1]=4 3441 B11R1.182 Cc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100009871730 [1,1,0,0,0,0|1,0,1]=4 3442 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_100011260760_200025704644 [1,1,0,0,0,0|1,0,1]=4 3443 B11R1.182 Cc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100011260760 [1,1,0,0,0,0|1,0,1]=4 3444 B11R1.182 Cc1ccc(c(c1)NCF)Br 34a_100000745044_100015361967 [1,1,0,0,0,0|2,0,0]=4 3445 B11R1.182 Cc1ccc(c(c1)NCF)C 34a_100000185781_100015361967 [1,1,0,0,0,0|2,0,0]=4 3446 B11R1.182 Cc1ccc(c(c1)NCF)C 7a_100000185781_100015361967 [1,1,0,0,0,0|2,0,0]=4 3447 B11R1.182 Cc1ccc(c(c1)NCF)Cl 34a_100011215360_100015361967 [1,1,0,0,0,0|2,0,0]=4 3448 B11R1.182 Cc1ccc(c(c1)NCF)F 34a_100000211285_100015361967 [1,1,0,0,0,0|2,0,0]=4 3449 B11R1.182 Cc1ccc(c(c1)NCF)I 34a_100011216686_100015361967 [1,1,0,0,0,0|2,0,0]=4 3450 B11R1.182 Cc1ccc(c(c1)NCF)O 34a_100011215204_100015361967 [1,1,0,0,0,0|1,0,0]=3 3451 B11R1.182 Cc1ccc(c(c1)OCF)Br 34a_100012002257_100015361967 [1,1,0,0,0,0|2,0,0]=4 3452 B11R1.182 Cc1ccc(c(c1)OCF)Br 7a_100012002257_100015361967 [1,1,0,0,0,0|2,0,0]=4 3453 B11R1.182 Cc1ccc(c(c1)OCF)C 34a_100000210931_100015361967 [1,1,0,0,0,0|2,0,0]=4 3454 B11R1.182 Cc1ccc(c(c1)OCF)C 7a_100000210931_100015361967 [1,1,0,0,0,0|2,0,0]=4 3455 B11R1.182 Cc1ccc(c(c1)OCF)Cl 34a_100000211493_100015361967 [1,1,0,0,0,0|2,0,0]=4 3456 B11R1.182 Cc1ccc(c(c1)OCF)Cl 7a_100000211493_100015361967 [1,1,0,0,0,0|2,0,0]=4 3457 B11R1.182 Cc1ccc(c(c1)OCF)F 34a_100000759540_100015361967 [1,1,0,0,0,0|2,0,0]=4 3458 B11R1.182 Cc1ccc(c(c1)OCF)F 7a_100000759540_100015361967 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.182 Cc1ccc(c(c1)OCF)N 34a_100000211527_100015361967 [1,1,0,0,0,0|2,0,0]=4 3460 B11R1.182 Cc1ccc(c(c1)OCF)N 7a_100000211527_100015361967 [1,1,0,0,0,0|2,0,0]=4 3461 B11R1.182 Cc1ccc(c(c1)SCF)Br 62a_100012353751_100015361967 [1,1,0,0,0,0|2,0,0]=4 3462 B11R1.182 Cc1ccc(c(c1)SCF)Br 62a_100015361967_100012353751 [1,1,0,0,0,0|2,0,0]=4 3463 B11R1.182 Cc1ccc(c(c1)SCF)C 62a_100000210833_100015361967 [1,1,0,0,0,0|2,0,0]=4 3464 B11R1.182 Cc1ccc(c(c1)SCF)C 62a_100015361967_100000210833 [1,1,0,0,0,0|2,0,0]=4 3465 B11R1.182 Cc1ccc(c(c1)SCF)Cl 62a_100012356289_100015361967 [1,1,0,0,0,0|2,0,0]=4 3466 B11R1.182 Cc1ccc(c(c1)SCF)Cl 62a_100015361967_100012356289 [1,1,0,0,0,0|2,0,0]=4 3467 B11R1.182 Cc1ccc(c(c1)SCF)F 62a_100000736223_100015361967 [1,1,0,0,0,0|2,0,0]=4 3468 B11R1.182 Cc1ccc(c(c1)SCF)F 62a_100015361967_100000736223 [1,1,0,0,0,0|2,0,0]=4 3469 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100011356834_100015361967 [1,1,0,0,0,0|2,0,0]=4 3470 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100015361967_100011356834 [1,1,0,0,0,0|2,0,0]=4 3471 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100000765521_100015361967 [1,1,0,0,0,0|1,0,0]=3 3472 B11R1.182 Cc1ccc(c(c1)SCF)O 62a_100015361967_100000765521 [1,1,0,0,0,0|1,0,0]=3 3473 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_100020630696_200025704644 [1,1,0,0,0,0|1,0,1]=4 3474 B11R1.182 Cc1ccc(c(n1)CS[13CH3])O 62a_200025704644_100020630696 [1,1,0,0,0,0|1,0,1]=4 3475 B11R1.182 Cc1ccc(c(n1)SCF)O 62a_100000702858_100015361967 [1,1,0,0,0,0|2,0,0]=4 3476 B11R1.182 Cc1ccc(c(n1)SCF)O 62a_100015361967_100000702858 [1,1,0,0,0,0|2,0,0]=4 3477 B11R1.182 Cc1cnc(c(c1)SCF)O 62a_100000719714_100015361967 [1,1,0,0,0,0|2,0,0]=4 3478 B11R1.182 Cc1cnc(c(c1)SCF)O 62a_100015361967_100000719714 [1,1,0,0,0,0|2,0,0]=4 3479 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100011534360_100015361967 [1,1,0,0,0,0|2,0,0]=4 3480 B11R1.182 Nc1ccc(c(c1)SCF)O 62a_100015361967_100011534360 [1,1,0,0,0,0|2,0,0]=4 3481 B11R1.182 Oc1ccc(c(c1)SCF)O 62a_100015361967_100009813629 [1,1,0,0,0,0|2,0,0]=4 3482 B11R1.182 Oc1ccc(cc1NCF)Br 34a_100000752626_100015361967 [1,1,0,0,0,0|2,0,0]=4 3483 B11R1.182 Oc1ccc(cc1NCF)Cl 34a_100000210500_100015361967 [1,1,0,0,0,0|2,0,0]=4 3484 B11R1.182 Oc1ccc(cc1NCF)F 34a_100000759472_100015361967 [1,1,0,0,0,0|2,0,0]=4 3485 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100012355227_100015361967 [1,1,0,0,0,0|2,0,0]=4 3486 B11R1.182 Oc1ccc(cc1SCF)Br 62a_100015361967_100012355227 [1,1,0,0,0,0|2,0,0]=4 3487 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100011356953_100015361967 [1,1,0,0,0,0|2,0,0]=4 3488 B11R1.182 Oc1ccc(cc1SCF)Cl 62a_100015361967_100011356953 [1,1,0,0,0,0|2,0,0]=4 3489 B11R1.182 Oc1ccc(cc1SCF)F 62a_100000211999_100015361967 [1,1,0,0,0,0|2,0,0]=4 3490 B11R1.182 Oc1ccc(cc1SCF)F 62a_100015361967_100000211999 [1,1,0,0,0,0|2,0,0]=4 3491 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [1,1,0,0,0,0|1,0,1]=4 3492 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [1,1,0,0,0,0|1,0,1]=4 3493 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [1,1,0,0,0,0|1,0,1]=4 3494 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [1,1,0,0,0,0|1,0,1]=4 3495 B11R1.277 C=Cc1cc(c(cc1Br)F)C 271570a_100011290941_200009814773 [1,1,0,0,0,0|1,0,1]=4 3496 B11R1.277 C=Cc1cc(c(cc1C)Br)C 271570a_100011290941_100011356911 [1,1,0,0,0,0|1,0,1]=4 3497 B11R1.277 C=Cc1cc(c(cc1C)C)C 271570a_100011290941_100000759388 [1,1,0,0,0,0|1,0,1]=4 3498 B11R1.277 C=Cc1cc(c(cc1C)Cl)C 271570a_100011290941_100012357408 [1,1,0,0,0,0|1,0,1]=4 3499 B11R1.277 C=Cc1cc(c(cc1C)F)C 271570a_100011290941_100010212296 [1,1,0,0,0,0|1,0,1]=4 3500 B11R1.277 C=Cc1cc(c(cc1C)N)C 271570a_100011290941_100011934712 [1,1,0,0,0,0|1,0,1]=4 3501 B11R1.277 C=Cc1cc(c(cc1C)O)C 271570a_100011290941_100000698207 [1,1,0,0,0,0|1,0,1]=4 3502 B11R1.277 C=Cc1cc(c(cc1Cl)Br)C 271570a_100011290941_100010259621 [1,1,0,0,0,0|1,0,1]=4 3503 B11R1.277 C=Cc1cc(c(cc1F)Br)C 271570a_100011290941_200009814772 [1,1,0,0,0,0|1,0,1]=4 3504 B11R1.277 C=Cc1cc(c(cc1F)C)C 271570a_100011290941_100010197417 [1,1,0,0,0,0|1,0,1]=4 3505 B11R1.277 C=Cc1cc(c(cc1F)F)C 271570a_100011290941_100000692463 [1,1,0,0,0,0|1,0,1]=4 3506 B11R1.277 C=Cc1cc(c(cc1F)N)C 271570a_100011290941_100000695870 [1,1,0,0,0,0|1,0,1]=4 3507 B11R1.277 C=Cc1cc(c(cc1N)Br)C 271570a_100011290941_200015600912 [1,1,0,0,0,0|1,0,1]=4 3508 B11R1.277 C=Cc1cc(c(cc1N)C)C 271570a_100011290941_100012337760 [1,1,0,0,0,0|1,0,1]=4 3509 B11R1.277 C=Cc1cc(c(cc1N)F)C 271570a_100011290941_100011218008 [1,1,0,0,0,0|1,0,1]=4 3510 B11R1.277 C=Cc1cc(c(cc1N)N)C 271570a_100011290941_200013038441 [1,1,0,0,0,0|1,0,1]=4 3511 B11R1.277 C=Cc1cc(c(cc1O)C)C 271570a_100011290941_100009814663 [1,1,0,0,0,0|0,0,1]=3 3512 B11R1.277 C=Cc1cc(c(cc1O)F)F 271570a_100011290941_100009813768 [1,1,0,0,0,0|1,0,1]=4 3513 B11R1.277 CCc1cc(c(cc1O)F)O 271570a_203496583355_100011156610 [1,1,0,0,0,0|1,0,1]=4 3514 B11R1.277 CNc1cc(c(cc1Br)Br)C 34a_100009995518_200000210301 [1,1,0,0,0,0|2,0,0]=4 3515 B11R1.277 CNc1cc(c(cc1Br)Br)C 7a_100009995518_200000210301 [1,1,0,0,0,0|2,0,0]=4 3516 B11R1.277 CNc1cc(c(cc1Br)C)C 34a_100012337760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3517 B11R1.277 CNc1cc(c(cc1Br)C)C 7a_100012337760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3518 B11R1.277 CNc1cc(c(cc1Br)F)C 34a_100010233353_200000210301 [1,1,0,0,0,0|2,0,0]=4 3519 B11R1.277 CNc1cc(c(cc1Br)F)C 7a_100010233353_200000210301 [1,1,0,0,0,0|2,0,0]=4 3520 B11R1.277 CNc1cc(c(cc1C)Br)C 2230a_100011934712_200000210301 [1,1,0,0,0,0|2,0,0]=4 3521 B11R1.277 CNc1cc(c(cc1C)Br)C 34a_100011934712_200000210301 [1,1,0,0,0,0|2,0,0]=4 3522 B11R1.277 CNc1cc(c(cc1C)Br)C 7a_100011934712_200000210301 [1,1,0,0,0,0|2,0,0]=4 3523 B11R1.277 CNc1cc(c(cc1C)C)C 2230a_100011217141_200000210301 [1,1,0,0,0,0|2,0,0]=4 3524 B11R1.277 CNc1cc(c(cc1C)C)C 34a_100011217141_200000210301 [1,1,0,0,0,0|2,0,0]=4 3525 B11R1.277 CNc1cc(c(cc1C)C)C 7a_100011217141_200000210301 [1,1,0,0,0,0|2,0,0]=4 3526 B11R1.277 CNc1cc(c(cc1C)Cl)C 2230a_100011830454_200000210301 [1,1,0,0,0,0|2,0,0]=4 3527 B11R1.277 CNc1cc(c(cc1C)Cl)C 34a_100011830454_200000210301 [1,1,0,0,0,0|2,0,0]=4 3528 B11R1.277 CNc1cc(c(cc1C)Cl)C 7a_100011830454_200000210301 [1,1,0,0,0,0|2,0,0]=4 3529 B11R1.277 CNc1cc(c(cc1C)O)C 34a_100000720036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3530 B11R1.277 CNc1cc(c(cc1C)O)C 7a_100000720036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3531 B11R1.277 CNc1cc(c(cc1Cl)C)C 34a_100012183282_200000210301 [1,1,0,0,0,0|2,0,0]=4 3532 B11R1.277 CNc1cc(c(cc1Cl)C)C 7a_100012183282_200000210301 [1,1,0,0,0,0|2,0,0]=4 3533 B11R1.277 CNc1cc(c(cc1Cl)Cl)C 34a_100012000392_200000210301 [1,1,0,0,0,0|2,0,0]=4 3534 B11R1.277 CNc1cc(c(cc1Cl)Cl)C 7a_100012000392_200000210301 [1,1,0,0,0,0|2,0,0]=4 3535 B11R1.277 CNc1cc(c(cc1Cl)F)C 34a_100000729549_200000210301 [1,1,0,0,0,0|2,0,0]=4 3536 B11R1.277 CNc1cc(c(cc1Cl)F)C 7a_100000729549_200000210301 [1,1,0,0,0,0|2,0,0]=4 3537 B11R1.277 CNc1cc(c(cc1F)Br)C 2230a_100000691575_200000210301 [1,1,0,0,0,0|2,0,0]=4 3538 B11R1.277 CNc1cc(c(cc1F)Br)C 34a_100000691575_200000210301 [1,1,0,0,0,0|2,0,0]=4 3539 B11R1.277 CNc1cc(c(cc1F)Br)C 7a_100000691575_200000210301 [1,1,0,0,0,0|2,0,0]=4 3540 B11R1.277 CNc1cc(c(cc1F)Cl)C 34a_100000091823_200000210301 [1,1,0,0,0,0|2,0,0]=4 3541 B11R1.277 CNc1cc(c(cc1F)Cl)C 7a_100000091823_200000210301 [1,1,0,0,0,0|2,0,0]=4 3542 B11R1.277 CNc1cc(c(cc1I)C)C 34a_100012353678_200000210301 [1,1,0,0,0,0|2,0,0]=4 3543 B11R1.277 CNc1cc(c(cc1I)C)C 7a_100012353678_200000210301 [1,1,0,0,0,0|2,0,0]=4 3544 B11R1.277 CNc1cc(c(cc1I)F)C 34a_100010238302_200000210301 [1,1,0,0,0,0|2,0,0]=4 3545 B11R1.277 CNc1cc(c(cc1I)F)C 7a_100010238302_200000210301 [1,1,0,0,0,0|2,0,0]=4 3546 B11R1.277 CNc1cc(c(cc1O)Br)Br 7a_200010781931_200000210301 [1,1,0,0,0,0|2,0,0]=4 3547 B11R1.277 CNc1cc(c(cc1O)Br)C 34a_200010107346_200000210301 [1,1,0,0,0,0|1,0,0]=3 3548 B11R1.277 CNc1cc(c(cc1O)Br)F 34a_100013038943_200000210301 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.277 CNc1cc(c(cc1O)Br)F 7a_100013038943_200000210301 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.277 CNc1cc(c(cc1O)C)Br 34a_200010235796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.277 CNc1cc(c(cc1O)C)Br 7a_200010235796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.277 CNc1cc(c(cc1O)C)C 34a_100133014134_200000210301 [1,1,0,0,0,0|1,0,0]=3 3553 B11R1.277 CNc1cc(c(cc1O)C)C 7a_100133014134_200000210301 [1,1,0,0,0,0|1,0,0]=3 3554 B11R1.277 CNc1cc(c(cc1O)C)Cl 34a_100000091707_200000210301 [1,1,0,0,0,0|2,0,0]=4 3555 B11R1.277 CNc1cc(c(cc1O)Cl)Br 34a_100013488937_200000210301 [1,1,0,0,0,0|2,0,0]=4 3556 B11R1.277 CNc1cc(c(cc1O)Cl)Br 7a_100013488937_200000210301 [1,1,0,0,0,0|2,0,0]=4 3557 B11R1.277 CNc1cc(c(cc1O)Cl)Cl 34a_100000696747_200000210301 [1,1,0,0,0,0|2,0,0]=4 3558 B11R1.277 CNc1cc(c(cc1O)Cl)Cl 7a_100000696747_200000210301 [1,1,0,0,0,0|2,0,0]=4 3559 B11R1.277 CNc1cc(c(cc1O)F)Br 34a_100012359894_200000210301 [1,1,0,0,0,0|2,0,0]=4 3560 B11R1.277 CNc1cc(c(cc1O)F)Br 7a_100012359894_200000210301 [1,1,0,0,0,0|2,0,0]=4 3561 B11R1.277 CNc1cc(c(cc1O)F)C 34a_100012022779_200000210301 [1,1,0,0,0,0|1,0,0]=3 3562 B11R1.277 CNc1cc(c(cc1O)F)C 7a_100012022779_200000210301 [1,1,0,0,0,0|1,0,0]=3 3563 B11R1.277 CNc1cc(c(cc1O)F)F 2230a_106722365970_200000210301 [1,1,0,0,0,0|2,0,0]=4 3564 B11R1.277 CNc1cc(c(cc1O)F)F 34a_106722365970_200000210301 [1,1,0,0,0,0|2,0,0]=4 3565 B11R1.277 CNc1cc(c(cc1O)F)F 7a_106722365970_200000210301 [1,1,0,0,0,0|2,0,0]=4 3566 B11R1.277 COc1cc(c(cc1Br)C)C 34a_100009814663_200000210301 [1,1,0,0,0,0|2,0,0]=4 3567 B11R1.277 COc1cc(c(cc1Br)C)C 7a_100009814663_200000210301 [1,1,0,0,0,0|2,0,0]=4 3568 B11R1.277 COc1cc(c(cc1Br)Cl)C 34a_100022700756_200000210301 [1,1,0,0,0,0|2,0,0]=4 3569 B11R1.277 COc1cc(c(cc1Br)Cl)C 7a_100022700756_200000210301 [1,1,0,0,0,0|2,0,0]=4 3570 B11R1.277 COc1cc(c(cc1C)Br)C 34a_100000698207_200000210301 [1,1,0,0,0,0|2,0,0]=4 3571 B11R1.277 COc1cc(c(cc1C)Br)C 7a_100000698207_200000210301 [1,1,0,0,0,0|2,0,0]=4 3572 B11R1.277 COc1cc(c(cc1C)C)C 34a_200000047129_200000210301 [1,1,0,0,0,0|2,0,0]=4 3573 B11R1.277 COc1cc(c(cc1C)C)C 7a_200000047129_200000210301 [1,1,0,0,0,0|2,0,0]=4 3574 B11R1.277 COc1cc(c(cc1C)F)C 34a_100010674473_200000210301 [1,1,0,0,0,0|2,0,0]=4 3575 B11R1.277 COc1cc(c(cc1C)F)C 7a_100010674473_200000210301 [1,1,0,0,0,0|2,0,0]=4 3576 B11R1.277 COc1cc(c(cc1C)I)C 34a_200011215153_200000210301 [1,1,0,0,0,0|2,0,0]=4 3577 B11R1.277 COc1cc(c(cc1C)I)C 7a_200011215153_200000210301 [1,1,0,0,0,0|2,0,0]=4 3578 B11R1.277 COc1cc(c(cc1C)N)C 34a_100000720036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3579 B11R1.277 COc1cc(c(cc1C)N)C 7a_100000720036_200000210301 [1,1,0,0,0,0|2,0,0]=4 3580 B11R1.277 COc1cc(c(cc1C)O)C 271570a_203496583355_100000698960 [1,1,0,0,0,0|2,0,0]=4 3581 B11R1.277 COc1cc(c(cc1Cl)Br)C 34a_200012350488_200000210301 [1,1,0,0,0,0|2,0,0]=4 3582 B11R1.277 COc1cc(c(cc1Cl)Br)C 7a_200012350488_200000210301 [1,1,0,0,0,0|2,0,0]=4 3583 B11R1.277 COc1cc(c(cc1Cl)C)C 34a_100000031796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3584 B11R1.277 COc1cc(c(cc1Cl)C)C 7a_100000031796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3585 B11R1.277 COc1cc(c(cc1Cl)Cl)C 34a_100012002691_200000210301 [1,1,0,0,0,0|2,0,0]=4 3586 B11R1.277 COc1cc(c(cc1Cl)Cl)C 7a_100012002691_200000210301 [1,1,0,0,0,0|2,0,0]=4 3587 B11R1.277 COc1cc(c(cc1F)Br)C 34a_100012355673_200000210301 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.277 COc1cc(c(cc1F)Br)C 7a_100012355673_200000210301 [1,1,0,0,0,0|2,0,0]=4 3589 B11R1.277 COc1cc(c(cc1F)O)C 271570a_203496583355_100010074640 [1,1,0,0,0,0|2,0,0]=4 3590 B11R1.277 COc1cc(c(cc1N)Br)C 34a_200010235796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3591 B11R1.277 COc1cc(c(cc1N)Br)C 7a_200010235796_200000210301 [1,1,0,0,0,0|2,0,0]=4 3592 B11R1.277 COc1cc(c(cc1N)C)C 34a_100133014134_200000210301 [1,1,0,0,0,0|2,0,0]=4 3593 B11R1.277 COc1cc(c(cc1N)C)C 7a_100133014134_200000210301 [1,1,0,0,0,0|2,0,0]=4 3594 B11R1.277 COc1cc(c(cc1N)Cl)C 34a_100000091707_200000210301 [1,1,0,0,0,0|2,0,0]=4 3595 B11R1.277 COc1cc(c(cc1N)Cl)C 7a_100000091707_200000210301 [1,1,0,0,0,0|2,0,0]=4 3596 B11R1.277 COc1cc(c(cc1O)C)F 271570a_203496583355_100010201977 [1,1,0,0,0,0|2,0,0]=4 3597 B11R1.277 COc1cc(c(cc1O)C)N 271570a_203496583355_100010232211 [1,1,0,0,0,0|2,0,0]=4 3598 B11R1.277 COc1cc(c(cc1O)F)F 271570a_203496583355_100009813744 [1,1,0,0,0,0|2,0,0]=4 3599 B11R1.277 COc1cc(c(cc1O)F)O 271570a_203496583355_100010189133 [1,1,0,0,0,0|2,0,0]=4 3600 B11R1.277 COc1cc(c(cc1O)N)C 271570a_203496583355_106657271712 [1,1,0,0,0,0|1,0,0]=3 3601 B11R1.277 COc1cc(c(cc1O)N)N 271570a_203496583355_100012769537 [1,1,0,0,0,0|2,0,0]=4 3602 B11R1.277 CSc1cc(c(cc1Br)F)C 62a_200000210301_200009814773 [1,1,0,0,0,0|2,0,0]=4 3603 B11R1.277 CSc1cc(c(cc1Br)F)C 62a_200009814773_200000210301 [1,1,0,0,0,0|2,0,0]=4 3604 B11R1.277 CSc1cc(c(cc1C)Br)C 62a_100011356911_200000210301 [1,1,0,0,0,0|2,0,0]=4 3605 B11R1.277 CSc1cc(c(cc1C)Br)C 62a_200000210301_100011356911 [1,1,0,0,0,0|2,0,0]=4 3606 B11R1.277 CSc1cc(c(cc1C)C)C 62a_100000759388_200000210301 [1,1,0,0,0,0|2,0,0]=4 3607 B11R1.277 CSc1cc(c(cc1C)C)C 62a_200000210301_100000759388 [1,1,0,0,0,0|2,0,0]=4 3608 B11R1.277 CSc1cc(c(cc1C)Cl)C 62a_100012357408_200000210301 [1,1,0,0,0,0|2,0,0]=4 3609 B11R1.277 CSc1cc(c(cc1C)Cl)C 62a_200000210301_100012357408 [1,1,0,0,0,0|2,0,0]=4 3610 B11R1.277 CSc1cc(c(cc1C)F)C 62a_100010212296_200000210301 [1,1,0,0,0,0|2,0,0]=4 3611 B11R1.277 CSc1cc(c(cc1C)F)C 62a_200000210301_100010212296 [1,1,0,0,0,0|2,0,0]=4 3612 B11R1.277 CSc1cc(c(cc1C)N)C 62a_100011934712_200000210301 [1,1,0,0,0,0|2,0,0]=4 3613 B11R1.277 CSc1cc(c(cc1C)N)C 62a_200000210301_100011934712 [1,1,0,0,0,0|2,0,0]=4 3614 B11R1.277 CSc1cc(c(cc1C)O)C 62a_100000698207_200000210301 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.277 CSc1cc(c(cc1C)O)C 62a_200000210301_100000698207 [1,1,0,0,0,0|2,0,0]=4 3616 B11R1.277 CSc1cc(c(cc1Cl)Br)C 62a_100010259621_200000210301 [1,1,0,0,0,0|2,0,0]=4 3617 B11R1.277 CSc1cc(c(cc1Cl)Br)C 62a_200000210301_100010259621 [1,1,0,0,0,0|2,0,0]=4 3618 B11R1.277 CSc1cc(c(cc1F)Br)C 62a_200000210301_200009814772 [1,1,0,0,0,0|2,0,0]=4 3619 B11R1.277 CSc1cc(c(cc1F)Br)C 62a_200009814772_200000210301 [1,1,0,0,0,0|2,0,0]=4 3620 B11R1.277 CSc1cc(c(cc1F)C)C 62a_100010197417_200000210301 [1,1,0,0,0,0|2,0,0]=4 3621 B11R1.277 CSc1cc(c(cc1F)C)C 62a_200000210301_100010197417 [1,1,0,0,0,0|2,0,0]=4 3622 B11R1.277 CSc1cc(c(cc1F)F)C 62a_100000692463_200000210301 [1,1,0,0,0,0|2,0,0]=4 3623 B11R1.277 CSc1cc(c(cc1F)F)C 62a_200000210301_100000692463 [1,1,0,0,0,0|2,0,0]=4 3624 B11R1.277 CSc1cc(c(cc1F)N)C 62a_100000695870_200000210301 [1,1,0,0,0,0|2,0,0]=4 3625 B11R1.277 CSc1cc(c(cc1F)N)C 62a_200000210301_100000695870 [1,1,0,0,0,0|2,0,0]=4 3626 B11R1.277 CSc1cc(c(cc1N)Br)C 62a_200000210301_200015600912 [1,1,0,0,0,0|2,0,0]=4 3627 B11R1.277 CSc1cc(c(cc1N)Br)C 62a_200015600912_200000210301 [1,1,0,0,0,0|2,0,0]=4 3628 B11R1.277 CSc1cc(c(cc1N)C)C 62a_100012337760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3629 B11R1.277 CSc1cc(c(cc1N)C)C 62a_200000210301_100012337760 [1,1,0,0,0,0|2,0,0]=4 3630 B11R1.277 CSc1cc(c(cc1N)F)C 62a_100011218008_200000210301 [1,1,0,0,0,0|2,0,0]=4 3631 B11R1.277 CSc1cc(c(cc1N)F)C 62a_200000210301_100011218008 [1,1,0,0,0,0|2,0,0]=4 3632 B11R1.277 CSc1cc(c(cc1N)N)C 62a_200000210301_200013038441 [1,1,0,0,0,0|2,0,0]=4 3633 B11R1.277 CSc1cc(c(cc1N)N)C 62a_200013038441_200000210301 [1,1,0,0,0,0|2,0,0]=4 3634 B11R1.277 CSc1cc(c(cc1O)C)C 62a_100009814663_200000210301 [1,1,0,0,0,0|1,0,0]=3 3635 B11R1.277 CSc1cc(c(cc1O)C)C 62a_200000210301_100009814663 [1,1,0,0,0,0|1,0,0]=3 3636 B11R1.277 CSc1cc(c(cc1O)F)F 62a_100009813768_200000210301 [1,1,0,0,0,0|2,0,0]=4 3637 B11R1.277 CSc1cc(c(cc1O)F)F 62a_200000210301_100009813768 [1,1,0,0,0,0|2,0,0]=4 3638 B11R1.277 Cc1cc(c(cc1Br)Br)N[13CH3] 34a_100009995518_200025704644 [1,1,0,0,0,0|2,0,0]=4 3639 B11R1.277 Cc1cc(c(cc1Br)Br)N[13CH3] 7a_100009995518_200025704644 [1,1,0,0,0,0|2,0,0]=4 3640 B11R1.277 Cc1cc(c(cc1Br)C)N[13CH3] 2230a_100011934712_200025704644 [1,1,0,0,0,0|2,0,0]=4 3641 B11R1.277 Cc1cc(c(cc1Br)C)N[13CH3] 34a_100011934712_200025704644 [1,1,0,0,0,0|2,0,0]=4 3642 B11R1.277 Cc1cc(c(cc1Br)C)N[13CH3] 7a_100011934712_200025704644 [1,1,0,0,0,0|2,0,0]=4 3643 B11R1.277 Cc1cc(c(cc1Br)C)O[13CH3] 34a_100000698207_200025704644 [1,1,0,0,0,0|2,0,0]=4 3644 B11R1.277 Cc1cc(c(cc1Br)C)O[13CH3] 7a_100000698207_200025704644 [1,1,0,0,0,0|2,0,0]=4 3645 B11R1.277 Cc1cc(c(cc1Br)C)S[13CH3] 62a_100011356911_200025704644 [1,1,0,0,0,0|2,0,0]=4 3646 B11R1.277 Cc1cc(c(cc1Br)C)S[13CH3] 62a_200025704644_100011356911 [1,1,0,0,0,0|2,0,0]=4 3647 B11R1.277 Cc1cc(c(cc1Br)Cl)O[13CH3] 34a_200012350488_200025704644 [1,1,0,0,0,0|2,0,0]=4 3648 B11R1.277 Cc1cc(c(cc1Br)Cl)O[13CH3] 7a_200012350488_200025704644 [1,1,0,0,0,0|2,0,0]=4 3649 B11R1.277 Cc1cc(c(cc1Br)Cl)S[13CH3] 62a_100010259621_200025704644 [1,1,0,0,0,0|2,0,0]=4 3650 B11R1.277 Cc1cc(c(cc1Br)Cl)S[13CH3] 62a_200025704644_100010259621 [1,1,0,0,0,0|2,0,0]=4 3651 B11R1.277 Cc1cc(c(cc1Br)F)N[13CH3] 2230a_100000691575_200025704644 [1,1,0,0,0,0|2,0,0]=4 3652 B11R1.277 Cc1cc(c(cc1Br)F)N[13CH3] 34a_100000691575_200025704644 [1,1,0,0,0,0|2,0,0]=4 3653 B11R1.277 Cc1cc(c(cc1Br)F)N[13CH3] 7a_100000691575_200025704644 [1,1,0,0,0,0|2,0,0]=4 3654 B11R1.277 Cc1cc(c(cc1Br)F)O[13CH3] 34a_100012355673_200025704644 [1,1,0,0,0,0|2,0,0]=4 3655 B11R1.277 Cc1cc(c(cc1Br)F)O[13CH3] 7a_100012355673_200025704644 [1,1,0,0,0,0|2,0,0]=4 3656 B11R1.277 Cc1cc(c(cc1Br)F)S[13CH3] 62a_200009814772_200025704644 [1,1,0,0,0,0|2,0,0]=4 3657 B11R1.277 Cc1cc(c(cc1Br)F)S[13CH3] 62a_200025704644_200009814772 [1,1,0,0,0,0|2,0,0]=4 3658 B11R1.277 Cc1cc(c(cc1Br)N)O[13CH3] 34a_200010235796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3659 B11R1.277 Cc1cc(c(cc1Br)N)O[13CH3] 7a_200010235796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3660 B11R1.277 Cc1cc(c(cc1Br)N)S[13CH3] 62a_200015600912_200025704644 [1,1,0,0,0,0|2,0,0]=4 3661 B11R1.277 Cc1cc(c(cc1Br)N)S[13CH3] 62a_200025704644_200015600912 [1,1,0,0,0,0|2,0,0]=4 3662 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])O 34a_200010235796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3663 B11R1.277 Cc1cc(c(cc1Br)N[13CH3])O 7a_200010235796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3664 B11R1.277 Cc1cc(c(cc1Br)O)N[13CH3] 34a_200010107346_200025704644 [1,1,0,0,0,0|1,0,0]=3 3665 B11R1.277 Cc1cc(c(cc1C)C=O)O 271570a_203496583355_100010184403 [1,1,0,0,0,0|0,0,0]=2 3666 B11R1.277 Cc1cc(c(cc1C)CO)O 271570a_203496583355_100010184405 [1,1,0,0,0,0|0,0,2]=4 3667 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Br 34a_100012337760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3668 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Br 7a_100012337760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3669 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 2230a_100011217141_200025704644 [1,1,0,0,0,0|2,0,0]=4 3670 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 34a_100011217141_200025704644 [1,1,0,0,0,0|2,0,0]=4 3671 B11R1.277 Cc1cc(c(cc1C)N[13CH3])C 7a_100011217141_200025704644 [1,1,0,0,0,0|2,0,0]=4 3672 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Cl 34a_100012183282_200025704644 [1,1,0,0,0,0|2,0,0]=4 3673 B11R1.277 Cc1cc(c(cc1C)N[13CH3])Cl 7a_100012183282_200025704644 [1,1,0,0,0,0|2,0,0]=4 3674 B11R1.277 Cc1cc(c(cc1C)N[13CH3])I 34a_100012353678_200025704644 [1,1,0,0,0,0|2,0,0]=4 3675 B11R1.277 Cc1cc(c(cc1C)N[13CH3])I 7a_100012353678_200025704644 [1,1,0,0,0,0|2,0,0]=4 3676 B11R1.277 Cc1cc(c(cc1C)N[13CH3])O 34a_100133014134_200025704644 [1,1,0,0,0,0|1,0,0]=3 3677 B11R1.277 Cc1cc(c(cc1C)N[13CH3])O 7a_100133014134_200025704644 [1,1,0,0,0,0|1,0,0]=3 3678 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Br 34a_100009814663_200025704644 [1,1,0,0,0,0|2,0,0]=4 3679 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Br 7a_100009814663_200025704644 [1,1,0,0,0,0|2,0,0]=4 3680 B11R1.277 Cc1cc(c(cc1C)O[13CH3])C 34a_200000047129_200025704644 [1,1,0,0,0,0|2,0,0]=4 3681 B11R1.277 Cc1cc(c(cc1C)O[13CH3])C 7a_200000047129_200025704644 [1,1,0,0,0,0|2,0,0]=4 3682 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Cl 34a_100000031796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3683 B11R1.277 Cc1cc(c(cc1C)O[13CH3])Cl 7a_100000031796_200025704644 [1,1,0,0,0,0|2,0,0]=4 3684 B11R1.277 Cc1cc(c(cc1C)O[13CH3])N 34a_100133014134_200025704644 [1,1,0,0,0,0|2,0,0]=4 3685 B11R1.277 Cc1cc(c(cc1C)O[13CH3])N 7a_100133014134_200025704644 [1,1,0,0,0,0|2,0,0]=4 3686 B11R1.277 Cc1cc(c(cc1C)S[13CH3])C 62a_100000759388_200025704644 [1,1,0,0,0,0|2,0,0]=4 3687 B11R1.277 Cc1cc(c(cc1C)S[13CH3])C 62a_200025704644_100000759388 [1,1,0,0,0,0|2,0,0]=4 3688 B11R1.277 Cc1cc(c(cc1C)S[13CH3])F 62a_100010197417_200025704644 [1,1,0,0,0,0|2,0,0]=4 3689 B11R1.277 Cc1cc(c(cc1C)S[13CH3])F 62a_200025704644_100010197417 [1,1,0,0,0,0|2,0,0]=4 3690 B11R1.277 Cc1cc(c(cc1C)S[13CH3])N 62a_100012337760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3691 B11R1.277 Cc1cc(c(cc1C)S[13CH3])N 62a_200025704644_100012337760 [1,1,0,0,0,0|2,0,0]=4 3692 B11R1.277 Cc1cc(c(cc1C)S[13CH3])O 62a_100009814663_200025704644 [1,1,0,0,0,0|1,0,0]=3 3693 B11R1.277 Cc1cc(c(cc1C)S[13CH3])O 62a_200025704644_100009814663 [1,1,0,0,0,0|1,0,0]=3 3694 B11R1.277 Cc1cc(c(cc1C=O)F)O 271570a_203496583355_100010186292 [1,1,0,0,0,0|2,0,0]=4 3695 B11R1.277 Cc1cc(c(cc1Cl)Br)O[13CH3] 34a_100022700756_200025704644 [1,1,0,0,0,0|2,0,0]=4 3696 B11R1.277 Cc1cc(c(cc1Cl)Br)O[13CH3] 7a_100022700756_200025704644 [1,1,0,0,0,0|2,0,0]=4 3697 B11R1.277 Cc1cc(c(cc1Cl)C)N[13CH3] 2230a_100011830454_200025704644 [1,1,0,0,0,0|2,0,0]=4 3698 B11R1.277 Cc1cc(c(cc1Cl)C)N[13CH3] 34a_100011830454_200025704644 [1,1,0,0,0,0|2,0,0]=4 3699 B11R1.277 Cc1cc(c(cc1Cl)C)N[13CH3] 7a_100011830454_200025704644 [1,1,0,0,0,0|2,0,0]=4 3700 B11R1.277 Cc1cc(c(cc1Cl)C)S[13CH3] 62a_100012357408_200025704644 [1,1,0,0,0,0|2,0,0]=4 3701 B11R1.277 Cc1cc(c(cc1Cl)C)S[13CH3] 62a_200025704644_100012357408 [1,1,0,0,0,0|2,0,0]=4 3702 B11R1.277 Cc1cc(c(cc1Cl)Cl)N[13CH3] 34a_100012000392_200025704644 [1,1,0,0,0,0|2,0,0]=4 3703 B11R1.277 Cc1cc(c(cc1Cl)Cl)N[13CH3] 7a_100012000392_200025704644 [1,1,0,0,0,0|2,0,0]=4 3704 B11R1.277 Cc1cc(c(cc1Cl)Cl)O[13CH3] 34a_100012002691_200025704644 [1,1,0,0,0,0|2,0,0]=4 3705 B11R1.277 Cc1cc(c(cc1Cl)Cl)O[13CH3] 7a_100012002691_200025704644 [1,1,0,0,0,0|2,0,0]=4 3706 B11R1.277 Cc1cc(c(cc1Cl)F)N[13CH3] 34a_100000091823_200025704644 [1,1,0,0,0,0|2,0,0]=4 3707 B11R1.277 Cc1cc(c(cc1Cl)F)N[13CH3] 7a_100000091823_200025704644 [1,1,0,0,0,0|2,0,0]=4 3708 B11R1.277 Cc1cc(c(cc1Cl)N)O[13CH3] 34a_100000091707_200025704644 [1,1,0,0,0,0|2,0,0]=4 3709 B11R1.277 Cc1cc(c(cc1Cl)N)O[13CH3] 7a_100000091707_200025704644 [1,1,0,0,0,0|2,0,0]=4 3710 B11R1.277 Cc1cc(c(cc1Cl)N[13CH3])O 34a_100000091707_200025704644 [1,1,0,0,0,0|2,0,0]=4 3711 B11R1.277 Cc1cc(c(cc1F)Br)N[13CH3] 34a_100010233353_200025704644 [1,1,0,0,0,0|2,0,0]=4 3712 B11R1.277 Cc1cc(c(cc1F)Br)N[13CH3] 7a_100010233353_200025704644 [1,1,0,0,0,0|2,0,0]=4 3713 B11R1.277 Cc1cc(c(cc1F)Br)S[13CH3] 62a_200009814773_200025704644 [1,1,0,0,0,0|2,0,0]=4 3714 B11R1.277 Cc1cc(c(cc1F)Br)S[13CH3] 62a_200025704644_200009814773 [1,1,0,0,0,0|2,0,0]=4 3715 B11R1.277 Cc1cc(c(cc1F)C)O[13CH3] 34a_100010674473_200025704644 [1,1,0,0,0,0|2,0,0]=4 3716 B11R1.277 Cc1cc(c(cc1F)C)O[13CH3] 7a_100010674473_200025704644 [1,1,0,0,0,0|2,0,0]=4 3717 B11R1.277 Cc1cc(c(cc1F)C)S[13CH3] 62a_100010212296_200025704644 [1,1,0,0,0,0|2,0,0]=4 3718 B11R1.277 Cc1cc(c(cc1F)C)S[13CH3] 62a_200025704644_100010212296 [1,1,0,0,0,0|2,0,0]=4 3719 B11R1.277 Cc1cc(c(cc1F)C=O)O 271570a_203496583355_100010186290 [1,1,0,0,0,0|1,0,0]=3 3720 B11R1.277 Cc1cc(c(cc1F)Cl)N[13CH3] 34a_100000729549_200025704644 [1,1,0,0,0,0|2,0,0]=4 3721 B11R1.277 Cc1cc(c(cc1F)Cl)N[13CH3] 7a_100000729549_200025704644 [1,1,0,0,0,0|2,0,0]=4 3722 B11R1.277 Cc1cc(c(cc1F)F)S[13CH3] 62a_100000692463_200025704644 [1,1,0,0,0,0|2,0,0]=4 3723 B11R1.277 Cc1cc(c(cc1F)F)S[13CH3] 62a_200025704644_100000692463 [1,1,0,0,0,0|2,0,0]=4 3724 B11R1.277 Cc1cc(c(cc1F)I)N[13CH3] 34a_100010238302_200025704644 [1,1,0,0,0,0|2,0,0]=4 3725 B11R1.277 Cc1cc(c(cc1F)I)N[13CH3] 7a_100010238302_200025704644 [1,1,0,0,0,0|2,0,0]=4 3726 B11R1.277 Cc1cc(c(cc1F)N)S[13CH3] 62a_100011218008_200025704644 [1,1,0,0,0,0|2,0,0]=4 3727 B11R1.277 Cc1cc(c(cc1F)N)S[13CH3] 62a_200025704644_100011218008 [1,1,0,0,0,0|2,0,0]=4 3728 B11R1.277 Cc1cc(c(cc1F)O)C#N 271570a_203496583355_100009816884 [1,1,0,0,0,0|1,0,1]=4 3729 B11R1.277 Cc1cc(c(cc1F)O)C=O 271570a_203496583355_100009814814 [1,1,0,0,0,0|0,0,0]=2 3730 B11R1.277 Cc1cc(c(cc1F)O)N[13CH3] 34a_100012022779_200025704644 [1,1,0,0,0,0|1,0,0]=3 3731 B11R1.277 Cc1cc(c(cc1F)O)N[13CH3] 7a_100012022779_200025704644 [1,1,0,0,0,0|1,0,0]=3 3732 B11R1.277 Cc1cc(c(cc1I)C)O[13CH3] 34a_200011215153_200025704644 [1,1,0,0,0,0|2,0,0]=4 3733 B11R1.277 Cc1cc(c(cc1I)C)O[13CH3] 7a_200011215153_200025704644 [1,1,0,0,0,0|2,0,0]=4 3734 B11R1.277 Cc1cc(c(cc1N)C)O[13CH3] 34a_100000720036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3735 B11R1.277 Cc1cc(c(cc1N)C)O[13CH3] 7a_100000720036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3736 B11R1.277 Cc1cc(c(cc1N)C)S[13CH3] 62a_100011934712_200025704644 [1,1,0,0,0,0|2,0,0]=4 3737 B11R1.277 Cc1cc(c(cc1N)C)S[13CH3] 62a_200025704644_100011934712 [1,1,0,0,0,0|2,0,0]=4 3738 B11R1.277 Cc1cc(c(cc1N)F)S[13CH3] 62a_100000695870_200025704644 [1,1,0,0,0,0|2,0,0]=4 3739 B11R1.277 Cc1cc(c(cc1N)F)S[13CH3] 62a_200025704644_100000695870 [1,1,0,0,0,0|2,0,0]=4 3740 B11R1.277 Cc1cc(c(cc1N)N)S[13CH3] 62a_200013038441_200025704644 [1,1,0,0,0,0|2,0,0]=4 3741 B11R1.277 Cc1cc(c(cc1N)N)S[13CH3] 62a_200025704644_200013038441 [1,1,0,0,0,0|2,0,0]=4 3742 B11R1.277 Cc1cc(c(cc1O)C)C=O 271570a_203496583355_100012024176 [1,1,0,0,0,0|1,0,0]=3 3743 B11R1.277 Cc1cc(c(cc1O)C)N[13CH3] 34a_100000720036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3744 B11R1.277 Cc1cc(c(cc1O)C)N[13CH3] 7a_100000720036_200025704644 [1,1,0,0,0,0|2,0,0]=4 3745 B11R1.277 Cc1cc(c(cc1O)C)S[13CH3] 62a_100000698207_200025704644 [1,1,0,0,0,0|2,0,0]=4 3746 B11R1.277 Cc1cc(c(cc1O)C)S[13CH3] 62a_200025704644_100000698207 [1,1,0,0,0,0|2,0,0]=4 3747 B11R1.277 Cc1cc(c(cc1O)C=O)F 271570a_203496583355_100010138641 [1,1,0,0,0,0|2,0,0]=4 3748 B11R1.277 Cc1cc(c(cc1O)C=O)O 271570a_203496583355_100010186689 [1,1,0,0,0,0|1,0,0]=3 3749 B11R1.277 Cc1cc(c(cc1O)F)C=O 271570a_203496583355_100010186291 [1,1,0,0,0,0|1,0,0]=3 3750 B11R1.277 Cc1cc(c(cc1O)O)C=O 271570a_203496583355_200010762526 [1,1,0,0,0,0|0,0,0]=2 3751 B11R1.277 Nc1cc(c(cc1C=O)O)F 271570a_203496583355_200010571964 [1,1,0,0,0,0|2,0,0]=4 3752 B11R1.277 O=Cc1cc(c(cc1F)F)O 271570a_203496583355_100009814802 [1,1,0,0,0,0|2,0,0]=4 3753 B11R1.277 O=Cc1cc(c(cc1F)O)F 271570a_203496583355_100011998483 [1,1,0,0,0,0|2,0,0]=4 3754 B11R1.277 O=Cc1cc(c(cc1O)F)F 271570a_203496583355_100012344232 [1,1,0,0,0,0|1,0,0]=3 3755 B11R1.277 O=Cc1cc(c(cc1O)F)O 271570a_203496583355_100010175118 [1,1,0,0,0,0|1,0,0]=3 3756 B11R1.277 O=Cc1cc(c(cc1O)O)F 271570a_203496583355_200010762562 [1,1,0,0,0,0|1,0,0]=3 3757 B11R1.277 O=Cc1cc(c(cc1O)O)O 271570a_203496583355_100010888506 [1,1,0,0,0,0|1,0,0]=3 3758 B11R1.277 O=Cc1cc(c(cc1O)O)O 271570a_203496583355_200010132312 [1,1,0,0,0,0|1,0,0]=3 3759 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)Br 7a_200010781931_200025704644 [1,1,0,0,0,0|2,0,0]=4 3760 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)F 34a_100013038943_200025704644 [1,1,0,0,0,0|2,0,0]=4 3761 B11R1.277 [13CH3]Nc1cc(c(cc1O)Br)F 7a_100013038943_200025704644 [1,1,0,0,0,0|2,0,0]=4 3762 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Br 34a_100013488937_200025704644 [1,1,0,0,0,0|2,0,0]=4 3763 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Br 7a_100013488937_200025704644 [1,1,0,0,0,0|2,0,0]=4 3764 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Cl 34a_100000696747_200025704644 [1,1,0,0,0,0|2,0,0]=4 3765 B11R1.277 [13CH3]Nc1cc(c(cc1O)Cl)Cl 7a_100000696747_200025704644 [1,1,0,0,0,0|2,0,0]=4 3766 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)Br 34a_100012359894_200025704644 [1,1,0,0,0,0|2,0,0]=4 3767 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)Br 7a_100012359894_200025704644 [1,1,0,0,0,0|2,0,0]=4 3768 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 2230a_106722365970_200025704644 [1,1,0,0,0,0|2,0,0]=4 3769 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 34a_106722365970_200025704644 [1,1,0,0,0,0|2,0,0]=4 3770 B11R1.277 [13CH3]Nc1cc(c(cc1O)F)F 7a_106722365970_200025704644 [1,1,0,0,0,0|2,0,0]=4 3771 B11R1.277 [13CH3]Sc1cc(c(cc1O)F)F 62a_100009813768_200025704644 [1,1,0,0,0,0|2,0,0]=4 3772 B11R1.277 [13CH3]Sc1cc(c(cc1O)F)F 62a_200025704644_100009813768 [1,1,0,0,0,0|2,0,0]=4 3773 B11R1.280 C=Cc1cc(ccc1Br)OC 271570a_100011290941_100009992028 [1,1,0,0,0,0|1,0,1]=4 3774 B11R1.280 C=Cc1cc(ccc1C)CO 271570a_100011290941_100000050133 [1,1,0,0,0,0|1,0,1]=4 3775 B11R1.280 C=Cc1cc(ccc1C)NC 271570a_100011290941_100000707694 [1,1,0,0,0,0|1,0,1]=4 3776 B11R1.280 C=Cc1cc(ccc1C)OC 271570a_100011290941_100012349166 [1,1,0,0,0,0|1,0,1]=4 3777 B11R1.280 C=Cc1cc(ccc1Cl)OC 271570a_100011290941_100011356938 [1,1,0,0,0,0|1,0,1]=4 3778 B11R1.280 C=Cc1cc(ccc1F)CC 271570a_100011290941_200010244628 [1,1,0,0,0,0|1,0,1]=4 3779 B11R1.280 C=Cc1cc(ccc1F)CN 271570a_100011290941_100015193890 [1,1,0,0,0,0|1,0,1]=4 3780 B11R1.280 C=Cc1cc(ccc1F)CO 271570a_100011290941_100000246287 [1,1,0,0,0,0|1,0,1]=4 3781 B11R1.280 C=Cc1cc(ccc1F)OC 271570a_100011290941_100000699733 [1,1,0,0,0,0|1,0,1]=4 3782 B11R1.280 C=Cc1cc(ccc1F)SC 271570a_100011290941_200010708804 [1,1,0,0,0,0|1,0,1]=4 3783 B11R1.280 C=Cc1cc(ccc1F)SC 62a_100000688377_200000210301 [1,1,0,0,0,0|1,0,1]=4 3784 B11R1.280 C=Cc1cc(ccc1F)SC 62a_200000210301_100000688377 [1,1,0,0,0,0|1,0,1]=4 3785 B11R1.280 C=Cc1cc(ccc1F)S[13CH3] 62a_100000688377_200025704644 [1,1,0,0,0,0|1,0,1]=4 3786 B11R1.280 C=Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100000688377 [1,1,0,0,0,0|1,0,1]=4 3787 B11R1.280 C=Cc1cc(ccc1N)CC 271570a_100011290941_100012339725 [1,1,0,0,0,0|1,0,1]=4 3788 B11R1.280 C=Cc1cc(ccc1N)OC 271570a_100011290941_100015195136 [1,1,0,0,0,0|1,0,1]=4 3789 B11R1.280 C=Cc1cc(ccc1O)C#N 271570a_100011290941_100000725478 [1,1,0,0,0,0|0,0,2]=4 3790 B11R1.280 C=Cc1cc(ccc1O)C=O 271570a_100011290941_100000184552 [1,1,0,0,0,0|0,0,2]=4 3791 B11R1.280 C=Cc1cc(ccc1O)CC 271570a_100011290941_100012339963 [1,1,0,0,0,0|0,0,1]=3 3792 B11R1.280 C=Cc1cc(ccc1O)CO 271570a_100011290941_100011191544 [1,1,0,0,0,0|0,0,1]=3 3793 B11R1.280 C=Cc1cc(ccc1O)OC 271570a_100011290941_100000685887 [1,1,0,0,0,0|0,0,1]=3 3794 B11R1.280 C=Cc1ccc(c(c1)C=O)Br 271570a_100011290941_100010185652 [1,1,0,0,0,0|1,0,1]=4 3795 B11R1.280 C=Cc1ccc(c(c1)C=O)C 271570a_100011290941_100011361606 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.280 C=Cc1ccc(c(c1)C=O)Cl 271570a_100011290941_100010254384 [1,1,0,0,0,0|1,0,1]=4 3797 B11R1.280 C=Cc1ccc(c(c1)C=O)F 271570a_100011290941_100000211465 [1,1,0,0,0,0|1,0,1]=4 3798 B11R1.280 C=Cc1ccc(c(c1)C=O)N 271570a_100011290941_100011935258 [1,1,0,0,0,0|1,0,1]=4 3799 B11R1.280 C=Cc1ccc(c(c1)C=O)O 271570a_100011290941_100000186750 [1,1,0,0,0,0|0,0,1]=3 3800 B11R1.280 C=Cc1ccc(c(c1)CC)O 271570a_100011290941_100012338938 [1,1,0,0,0,0|0,0,2]=4 3801 B11R1.280 C=Cc1ccc(c(c1)OC)O 271570a_100011290941_100000694246 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.280 C=Cc1nc(ccc1O)CO 271570a_100011290941_200000118097 [1,1,0,0,0,0|1,0,1]=4 3803 B11R1.280 CCc1cc(ccc1Br)NC 2230a_100010109747_200000210301 [1,1,0,0,0,0|1,0,1]=4 3804 B11R1.280 CCc1cc(ccc1Br)NC 34a_100010109747_200000210301 [1,1,0,0,0,0|1,0,1]=4 3805 B11R1.280 CCc1cc(ccc1Br)NC 7a_100010109747_200000210301 [1,1,0,0,0,0|1,0,1]=4 3806 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 2230a_100010109747_200025704644 [1,1,0,0,0,0|1,0,1]=4 3807 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 34a_100010109747_200025704644 [1,1,0,0,0,0|1,0,1]=4 3808 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 7a_100010109747_200025704644 [1,1,0,0,0,0|1,0,1]=4 3809 B11R1.280 CCc1cc(ccc1Br)SC 62a_100010244631_200000210301 [1,1,0,0,0,0|1,0,1]=4 3810 B11R1.280 CCc1cc(ccc1Br)SC 62a_200000210301_100010244631 [1,1,0,0,0,0|1,0,1]=4 3811 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_100010244631_200025704644 [1,1,0,0,0,0|1,0,1]=4 3812 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_200025704644_100010244631 [1,1,0,0,0,0|1,0,1]=4 3813 B11R1.280 CCc1cc(ccc1Cl)OC 34a_100000212063_200000210301 [1,1,0,0,0,0|1,0,1]=4 3814 B11R1.280 CCc1cc(ccc1Cl)OC 7a_100000212063_200000210301 [1,1,0,0,0,0|1,0,1]=4 3815 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 34a_100000212063_200025704644 [1,1,0,0,0,0|1,0,1]=4 3816 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 7a_100000212063_200025704644 [1,1,0,0,0,0|1,0,1]=4 3817 B11R1.280 CCc1cc(ccc1F)SC 62a_100010244625_200000210301 [1,1,0,0,0,0|1,0,1]=4 3818 B11R1.280 CCc1cc(ccc1F)SC 62a_200000210301_100010244625 [1,1,0,0,0,0|1,0,1]=4 3819 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_100010244625_200025704644 [1,1,0,0,0,0|1,0,1]=4 3820 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_200025704644_100010244625 [1,1,0,0,0,0|1,0,1]=4 3821 B11R1.280 CCc1cc(ccc1N)SC 62a_100000686106_200000210301 [1,1,0,0,0,0|1,0,1]=4 3822 B11R1.280 CCc1cc(ccc1N)SC 62a_200000210301_100000686106 [1,1,0,0,0,0|1,0,1]=4 3823 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_100000686106_200025704644 [1,1,0,0,0,0|1,0,1]=4 3824 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_200025704644_100000686106 [1,1,0,0,0,0|1,0,1]=4 3825 B11R1.280 CCc1cc(ccc1O)C#N 271570a_203496583355_100010115944 [1,1,0,0,0,0|0,0,2]=4 3826 B11R1.280 CCc1cc(ccc1O)OC 271570a_203496583355_100000720562 [1,1,0,0,0,0|0,0,1]=3 3827 B11R1.280 CCc1cc(ccc1O)SC 62a_200000210301_100012338938 [1,1,0,0,0,0|0,0,1]=3 3828 B11R1.280 CCc1cc(ccc1O)S[13CH3] 62a_200025704644_100012338938 [1,1,0,0,0,0|0,0,1]=3 3829 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3830 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3831 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [1,1,0,0,0,0|2,0,0]=4 3832 B11R1.280 CCc1ccc(c(c1)NC)O 34a_100000765835_200000210301 [1,1,0,0,0,0|1,0,0]=3 3833 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3834 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3835 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [1,1,0,0,0,0|2,0,0]=4 3836 B11R1.280 CCc1ccc(c(c1)N[13CH3])O 34a_100000765835_200025704644 [1,1,0,0,0,0|1,0,0]=3 3837 B11R1.280 CCc1ccc(c(c1)OC)N 34a_100000124328_200000210301 [1,1,0,0,0,0|2,0,0]=4 3838 B11R1.280 CCc1ccc(c(c1)OC)N 7a_100000124328_200000210301 [1,1,0,0,0,0|2,0,0]=4 3839 B11R1.280 CCc1ccc(c(c1)OC)O 271570a_203496583355_200010710389 [1,1,0,0,0,0|1,0,0]=3 3840 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 34a_100000124328_200025704644 [1,1,0,0,0,0|2,0,0]=4 3841 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 7a_100000124328_200025704644 [1,1,0,0,0,0|2,0,0]=4 3842 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200000210301_200010244628 [1,1,0,0,0,0|2,0,0]=4 3843 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200010244628_200000210301 [1,1,0,0,0,0|2,0,0]=4 3844 B11R1.280 CCc1ccc(c(c1)SC)N 62a_100012339725_200000210301 [1,1,0,0,0,0|2,0,0]=4 3845 B11R1.280 CCc1ccc(c(c1)SC)N 62a_200000210301_100012339725 [1,1,0,0,0,0|2,0,0]=4 3846 B11R1.280 CCc1ccc(c(c1)SC)O 62a_100012339963_200000210301 [1,1,0,0,0,0|1,0,0]=3 3847 B11R1.280 CCc1ccc(c(c1)SC)O 62a_200000210301_100012339963 [1,1,0,0,0,0|1,0,0]=3 3848 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200010244628_200025704644 [1,1,0,0,0,0|2,0,0]=4 3849 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010244628 [1,1,0,0,0,0|2,0,0]=4 3850 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_100012339725_200025704644 [1,1,0,0,0,0|2,0,0]=4 3851 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_200025704644_100012339725 [1,1,0,0,0,0|2,0,0]=4 3852 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_100012339963_200025704644 [1,1,0,0,0,0|1,0,0]=3 3853 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_200025704644_100012339963 [1,1,0,0,0,0|1,0,0]=3 3854 B11R1.280 CNc1cc(ccc1Br)CO 34a_100012347568_200000210301 [1,1,0,0,0,0|2,0,0]=4 3855 B11R1.280 CNc1cc(ccc1Br)OC 34a_100000748603_200000210301 [1,1,0,0,0,0|2,0,0]=4 3856 B11R1.280 CNc1cc(ccc1C)CO 2230a_100000758420_200000210301 [1,1,0,0,0,0|2,0,0]=4 3857 B11R1.280 CNc1cc(ccc1C)CO 34a_100000758420_200000210301 [1,1,0,0,0,0|2,0,0]=4 3858 B11R1.280 CNc1cc(ccc1C)OC 2230a_100000760359_200000210301 [1,1,0,0,0,0|2,0,0]=4 3859 B11R1.280 CNc1cc(ccc1C)OC 34a_100000760359_200000210301 [1,1,0,0,0,0|2,0,0]=4 3860 B11R1.280 CNc1cc(ccc1C)SC 62a_100020629602_200000210301 [1,1,0,0,0,0|2,0,0]=4 3861 B11R1.280 CNc1cc(ccc1C)SC 62a_200000210301_100020629602 [1,1,0,0,0,0|2,0,0]=4 3862 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_100020629602_200025704644 [1,1,0,0,0,0|2,0,0]=4 3863 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_200025704644_100020629602 [1,1,0,0,0,0|2,0,0]=4 3864 B11R1.280 CNc1cc(ccc1Cl)CO 34a_106256033963_200000210301 [1,1,0,0,0,0|2,0,0]=4 3865 B11R1.280 CNc1cc(ccc1Cl)OC 34a_100000745576_200000210301 [1,1,0,0,0,0|2,0,0]=4 3866 B11R1.280 CNc1cc(ccc1F)CO 2230a_102125399562_200000210301 [1,1,0,0,0,0|2,0,0]=4 3867 B11R1.280 CNc1cc(ccc1F)CO 34a_102125399562_200000210301 [1,1,0,0,0,0|2,0,0]=4 3868 B11R1.280 CNc1cc(ccc1F)OC 34a_100000764331_200000210301 [1,1,0,0,0,0|2,0,0]=4 3869 B11R1.280 CNc1cc(ccc1F)SC 62a_100011314990_200000210301 [1,1,0,0,0,0|2,0,0]=4 3870 B11R1.280 CNc1cc(ccc1F)SC 62a_200000210301_100011314990 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_100011314990_200025704644 [1,1,0,0,0,0|2,0,0]=4 3872 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_200025704644_100011314990 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.280 CNc1cc(ccc1I)OC 34a_100000748021_200000210301 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.280 CNc1cc(ccc1N)SC 62a_100000694363_200000210301 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.280 CNc1cc(ccc1N)S[13CH3] 62a_100000694363_200025704644 [1,1,0,0,0,0|2,0,0]=4 3876 B11R1.280 CNc1cc(ccc1O)C#N 34a_100000766272_200000210301 [1,1,0,0,0,0|1,0,1]=4 3877 B11R1.280 CNc1cc(ccc1O)C#N 7a_100000766272_200000210301 [1,1,0,0,0,0|1,0,1]=4 3878 B11R1.280 CNc1cc(ccc1O)CO 34a_100000123545_200000210301 [1,1,0,0,0,0|1,0,0]=3 3879 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [1,1,0,0,0,0|1,0,0]=3 3880 B11R1.280 CNc1ccc(c(c1)C#N)O 34a_100011249283_200000210301 [1,1,0,0,0,0|1,0,1]=4 3881 B11R1.280 CNc1ccc(c(c1)OC)Br 2230a_100000765947_200000210301 [1,1,0,0,0,0|2,0,0]=4 3882 B11R1.280 CNc1ccc(c(c1)OC)Br 34a_100000765947_200000210301 [1,1,0,0,0,0|2,0,0]=4 3883 B11R1.280 CNc1ccc(c(c1)OC)C 2230a_100011279678_200000210301 [1,1,0,0,0,0|2,0,0]=4 3884 B11R1.280 CNc1ccc(c(c1)OC)C 34a_100011279678_200000210301 [1,1,0,0,0,0|2,0,0]=4 3885 B11R1.280 CNc1ccc(c(c1)OC)Cl 2230a_100000742311_200000210301 [1,1,0,0,0,0|2,0,0]=4 3886 B11R1.280 CNc1ccc(c(c1)OC)Cl 34a_100000742311_200000210301 [1,1,0,0,0,0|2,0,0]=4 3887 B11R1.280 CNc1ccc(c(c1)OC)F 2230a_100000701188_200000210301 [1,1,0,0,0,0|2,0,0]=4 3888 B11R1.280 CNc1ccc(c(c1)OC)F 34a_100000701188_200000210301 [1,1,0,0,0,0|2,0,0]=4 3889 B11R1.280 CNc1ccc(c(c1)OC)I 34a_100000746945_200000210301 [1,1,0,0,0,0|2,0,0]=4 3890 B11R1.280 CNc1ccc(c(c1)OC)O 34a_100000726020_200000210301 [1,1,0,0,0,0|1,0,0]=3 3891 B11R1.280 CNc1ccc(c(c1)SC)C 62a_100000707694_200000210301 [1,1,0,0,0,0|2,0,0]=4 3892 B11R1.280 CNc1ccc(c(c1)SC)C 62a_200000210301_100000707694 [1,1,0,0,0,0|2,0,0]=4 3893 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_100000707694_200025704644 [1,1,0,0,0,0|2,0,0]=4 3894 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000707694 [1,1,0,0,0,0|2,0,0]=4 3895 B11R1.280 COc1cc(c(cn1)O)C=O 271570a_203496583355_100010171658 [1,1,0,0,0,0|1,0,0]=3 3896 B11R1.280 COc1cc(c(cn1)O)OC 271570a_203496583355_100010191559 [1,1,0,0,0,0|2,0,0]=4 3897 B11R1.280 COc1cc(ccc1Br)CO 34a_100010191536_200000210301 [1,1,0,0,0,0|2,0,0]=4 3898 B11R1.280 COc1cc(ccc1Br)CO 7a_100010191536_200000210301 [1,1,0,0,0,0|2,0,0]=4 3899 B11R1.280 COc1cc(ccc1Br)N[13CH3] 2230a_100000765947_200025704644 [1,1,0,0,0,0|2,0,0]=4 3900 B11R1.280 COc1cc(ccc1Br)N[13CH3] 34a_100000765947_200025704644 [1,1,0,0,0,0|2,0,0]=4 3901 B11R1.280 COc1cc(ccc1Br)O[13CH3] 34a_100011827694_200025704644 [1,1,0,0,0,0|2,0,0]=4 3902 B11R1.280 COc1cc(ccc1Br)O[13CH3] 7a_100011827694_200025704644 [1,1,0,0,0,0|2,0,0]=4 3903 B11R1.280 COc1cc(ccc1Br)SC 62a_100012353699_200000210301 [1,1,0,0,0,0|2,0,0]=4 3904 B11R1.280 COc1cc(ccc1Br)SC 62a_200000210301_100012353699 [1,1,0,0,0,0|2,0,0]=4 3905 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_100012353699_200025704644 [1,1,0,0,0,0|2,0,0]=4 3906 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_200025704644_100012353699 [1,1,0,0,0,0|2,0,0]=4 3907 B11R1.280 COc1cc(ccc1C)N[13CH3] 2230a_100011279678_200025704644 [1,1,0,0,0,0|2,0,0]=4 3908 B11R1.280 COc1cc(ccc1C)N[13CH3] 34a_100011279678_200025704644 [1,1,0,0,0,0|2,0,0]=4 3909 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [1,1,0,0,0,0|2,0,0]=4 3910 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [1,1,0,0,0,0|2,0,0]=4 3911 B11R1.280 COc1cc(ccc1C)SC 62a_100011830276_200000210301 [1,1,0,0,0,0|2,0,0]=4 3912 B11R1.280 COc1cc(ccc1C)SC 62a_200000210301_100011830276 [1,1,0,0,0,0|2,0,0]=4 3913 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_100011830276_200025704644 [1,1,0,0,0,0|2,0,0]=4 3914 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_200025704644_100011830276 [1,1,0,0,0,0|2,0,0]=4 3915 B11R1.280 COc1cc(ccc1Cl)CN 34a_100020636435_200000210301 [1,1,0,0,0,0|2,0,0]=4 3916 B11R1.280 COc1cc(ccc1Cl)CO 34a_100009876509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3917 B11R1.280 COc1cc(ccc1Cl)CO 7a_100009876509_200000210301 [1,1,0,0,0,0|2,0,0]=4 3918 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 2230a_100000742311_200025704644 [1,1,0,0,0,0|2,0,0]=4 3919 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 34a_100000742311_200025704644 [1,1,0,0,0,0|2,0,0]=4 3920 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 34a_100012186310_200025704644 [1,1,0,0,0,0|2,0,0]=4 3921 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 7a_100012186310_200025704644 [1,1,0,0,0,0|2,0,0]=4 3922 B11R1.280 COc1cc(ccc1Cl)SC 62a_100011356853_200000210301 [1,1,0,0,0,0|2,0,0]=4 3923 B11R1.280 COc1cc(ccc1Cl)SC 62a_200000210301_100011356853 [1,1,0,0,0,0|2,0,0]=4 3924 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_100011356853_200025704644 [1,1,0,0,0,0|2,0,0]=4 3925 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100011356853 [1,1,0,0,0,0|2,0,0]=4 3926 B11R1.280 COc1cc(ccc1F)CN 34a_100160469508_200000210301 [1,1,0,0,0,0|2,0,0]=4 3927 B11R1.280 COc1cc(ccc1F)CO 34a_100009842347_200000210301 [1,1,0,0,0,0|2,0,0]=4 3928 B11R1.280 COc1cc(ccc1F)CO 7a_100009842347_200000210301 [1,1,0,0,0,0|2,0,0]=4 3929 B11R1.280 COc1cc(ccc1F)N[13CH3] 2230a_100000701188_200025704644 [1,1,0,0,0,0|2,0,0]=4 3930 B11R1.280 COc1cc(ccc1F)N[13CH3] 34a_100000701188_200025704644 [1,1,0,0,0,0|2,0,0]=4 3931 B11R1.280 COc1cc(ccc1F)O[13CH3] 34a_100012001760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3932 B11R1.280 COc1cc(ccc1F)O[13CH3] 7a_100012001760_200025704644 [1,1,0,0,0,0|2,0,0]=4 3933 B11R1.280 COc1cc(ccc1F)SC 62a_100011934186_200000210301 [1,1,0,0,0,0|2,0,0]=4 3934 B11R1.280 COc1cc(ccc1F)SC 62a_200000210301_100011934186 [1,1,0,0,0,0|2,0,0]=4 3935 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_100011934186_200025704644 [1,1,0,0,0,0|2,0,0]=4 3936 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_200025704644_100011934186 [1,1,0,0,0,0|2,0,0]=4 3937 B11R1.280 COc1cc(ccc1I)CO 34a_100000049605_200000210301 [1,1,0,0,0,0|2,0,0]=4 3938 B11R1.280 COc1cc(ccc1I)CO 7a_100000049605_200000210301 [1,1,0,0,0,0|2,0,0]=4 3939 B11R1.280 COc1cc(ccc1I)N[13CH3] 34a_100000746945_200025704644 [1,1,0,0,0,0|2,0,0]=4 3940 B11R1.280 COc1cc(ccc1N)O[13CH3] 34a_100015326901_200025704644 [1,1,0,0,0,0|2,0,0]=4 3941 B11R1.280 COc1cc(ccc1N)O[13CH3] 7a_100015326901_200025704644 [1,1,0,0,0,0|2,0,0]=4 3942 B11R1.280 COc1cc(ccc1N)SC 62a_100011279103_200000210301 [1,1,0,0,0,0|2,0,0]=4 3943 B11R1.280 COc1cc(ccc1N)SC 62a_200000210301_100015196925 [1,1,0,0,0,0|2,0,0]=4 3944 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_100011279103_200025704644 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_200025704644_100015196925 [1,1,0,0,0,0|2,0,0]=4 3946 B11R1.280 COc1cc(ccc1O)C#N 271570a_203496583355_100012356288 [1,1,0,0,0,0|1,0,1]=4 3947 B11R1.280 COc1cc(ccc1O)C=O 271570a_203496583355_100010244714 [1,1,0,0,0,0|1,0,1]=4 3948 B11R1.280 COc1cc(ccc1O)CO 271570a_203496583355_100010234685 [1,1,0,0,0,0|1,0,0]=3 3949 B11R1.280 COc1cc(ccc1O)N[13CH3] 34a_100000726020_200025704644 [1,1,0,0,0,0|1,0,0]=3 3950 B11R1.280 COc1cc(ccc1O)SC 62a_200000210301_100000694246 [1,1,0,0,0,0|1,0,0]=3 3951 B11R1.280 COc1cc(ccc1O)S[13CH3] 62a_200025704644_100000694246 [1,1,0,0,0,0|1,0,0]=3 3952 B11R1.280 COc1cc(ncc1O)CO 271570a_203496583355_100010999569 [1,1,0,0,0,0|2,0,0]=4 3953 B11R1.280 COc1ccc(c(c1)C#N)O 271570a_203496583355_100000748272 [1,1,0,0,0,0|1,0,1]=4 3954 B11R1.280 COc1ccc(c(c1)C=O)O 271570a_203496583355_100000691568 [1,1,0,0,0,0|0,0,0]=2 3955 B11R1.280 COc1ccc(c(c1)CN)O 271570a_203496583355_100000741592 [1,1,0,0,0,0|1,0,1]=4 3956 B11R1.280 COc1ccc(c(c1)CO)O 271570a_203496583355_200011273942 [1,1,0,0,0,0|0,0,2]=4 3957 B11R1.280 COc1ccc(c(c1)N[13CH3])Br 34a_100000748603_200025704644 [1,1,0,0,0,0|2,0,0]=4 3958 B11R1.280 COc1ccc(c(c1)N[13CH3])C 2230a_100000760359_200025704644 [1,1,0,0,0,0|2,0,0]=4 3959 B11R1.280 COc1ccc(c(c1)N[13CH3])C 34a_100000760359_200025704644 [1,1,0,0,0,0|2,0,0]=4 3960 B11R1.280 COc1ccc(c(c1)N[13CH3])Cl 34a_100000745576_200025704644 [1,1,0,0,0,0|2,0,0]=4 3961 B11R1.280 COc1ccc(c(c1)N[13CH3])F 34a_100000764331_200025704644 [1,1,0,0,0,0|2,0,0]=4 3962 B11R1.280 COc1ccc(c(c1)N[13CH3])I 34a_100000748021_200025704644 [1,1,0,0,0,0|2,0,0]=4 3963 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [1,1,0,0,0,0|1,0,0]=3 3964 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100000719091_200000210301 [1,1,0,0,0,0|2,0,0]=4 3965 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100011827694_200000210301 [1,1,0,0,0,0|2,0,0]=4 3966 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100000719091_200000210301 [1,1,0,0,0,0|2,0,0]=4 3967 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100011827694_200000210301 [1,1,0,0,0,0|2,0,0]=4 3968 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [1,1,0,0,0,0|2,0,0]=4 3969 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [1,1,0,0,0,0|2,0,0]=4 3970 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [1,1,0,0,0,0|2,0,0]=4 3971 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [1,1,0,0,0,0|2,0,0]=4 3972 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100011516019_200000210301 [1,1,0,0,0,0|2,0,0]=4 3973 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100012186310_200000210301 [1,1,0,0,0,0|2,0,0]=4 3974 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100011516019_200000210301 [1,1,0,0,0,0|2,0,0]=4 3975 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100012186310_200000210301 [1,1,0,0,0,0|2,0,0]=4 3976 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012001760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3977 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012178750_200000210301 [1,1,0,0,0,0|2,0,0]=4 3978 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012001760_200000210301 [1,1,0,0,0,0|2,0,0]=4 3979 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012178750_200000210301 [1,1,0,0,0,0|2,0,0]=4 3980 B11R1.280 COc1ccc(c(c1)OC)I 34a_100010168831_200000210301 [1,1,0,0,0,0|2,0,0]=4 3981 B11R1.280 COc1ccc(c(c1)OC)I 7a_100010168831_200000210301 [1,1,0,0,0,0|2,0,0]=4 3982 B11R1.280 COc1ccc(c(c1)OC)N 34a_100015326901_200000210301 [1,1,0,0,0,0|2,0,0]=4 3983 B11R1.280 COc1ccc(c(c1)OC)N 34a_100016989039_200000210301 [1,1,0,0,0,0|2,0,0]=4 3984 B11R1.280 COc1ccc(c(c1)OC)N 7a_100015326901_200000210301 [1,1,0,0,0,0|2,0,0]=4 3985 B11R1.280 COc1ccc(c(c1)OC)N 7a_100016989039_200000210301 [1,1,0,0,0,0|2,0,0]=4 3986 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [1,1,0,0,0,0|1,0,0]=3 3987 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 34a_100000719091_200025704644 [1,1,0,0,0,0|2,0,0]=4 3988 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 7a_100000719091_200025704644 [1,1,0,0,0,0|2,0,0]=4 3989 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [1,1,0,0,0,0|2,0,0]=4 3990 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [1,1,0,0,0,0|2,0,0]=4 3991 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 34a_100011516019_200025704644 [1,1,0,0,0,0|2,0,0]=4 3992 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 7a_100011516019_200025704644 [1,1,0,0,0,0|2,0,0]=4 3993 B11R1.280 COc1ccc(c(c1)O[13CH3])F 34a_100012178750_200025704644 [1,1,0,0,0,0|2,0,0]=4 3994 B11R1.280 COc1ccc(c(c1)O[13CH3])F 7a_100012178750_200025704644 [1,1,0,0,0,0|2,0,0]=4 3995 B11R1.280 COc1ccc(c(c1)O[13CH3])I 34a_100010168831_200025704644 [1,1,0,0,0,0|2,0,0]=4 3996 B11R1.280 COc1ccc(c(c1)O[13CH3])I 7a_100010168831_200025704644 [1,1,0,0,0,0|2,0,0]=4 3997 B11R1.280 COc1ccc(c(c1)O[13CH3])N 34a_100016989039_200025704644 [1,1,0,0,0,0|2,0,0]=4 3998 B11R1.280 COc1ccc(c(c1)O[13CH3])N 7a_100016989039_200025704644 [1,1,0,0,0,0|2,0,0]=4 3999 B11R1.280 COc1ccc(c(c1)SC)Br 62a_100009992028_200000210301 [1,1,0,0,0,0|2,0,0]=4 4000 B11R1.280 COc1ccc(c(c1)SC)Br 62a_200000210301_100009992028 [1,1,0,0,0,0|2,0,0]=4 4001 B11R1.280 COc1ccc(c(c1)SC)C 62a_100012349166_200000210301 [1,1,0,0,0,0|2,0,0]=4 4002 B11R1.280 COc1ccc(c(c1)SC)C 62a_200000210301_100012349166 [1,1,0,0,0,0|2,0,0]=4 4003 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_100011356938_200000210301 [1,1,0,0,0,0|2,0,0]=4 4004 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_200000210301_100011356938 [1,1,0,0,0,0|2,0,0]=4 4005 B11R1.280 COc1ccc(c(c1)SC)F 62a_100000699733_200000210301 [1,1,0,0,0,0|2,0,0]=4 4006 B11R1.280 COc1ccc(c(c1)SC)F 62a_200000210301_100000699733 [1,1,0,0,0,0|2,0,0]=4 4007 B11R1.280 COc1ccc(c(c1)SC)N 62a_100015195136_200000210301 [1,1,0,0,0,0|2,0,0]=4 4008 B11R1.280 COc1ccc(c(c1)SC)N 62a_200000210301_100015195136 [1,1,0,0,0,0|2,0,0]=4 4009 B11R1.280 COc1ccc(c(c1)SC)O 62a_200000210301_100000685887 [1,1,0,0,0,0|1,0,0]=3 4010 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_100009992028_200025704644 [1,1,0,0,0,0|2,0,0]=4 4011 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100009992028 [1,1,0,0,0,0|2,0,0]=4 4012 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_100012349166_200025704644 [1,1,0,0,0,0|2,0,0]=4 4013 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_200025704644_100012349166 [1,1,0,0,0,0|2,0,0]=4 4014 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_100011356938_200025704644 [1,1,0,0,0,0|2,0,0]=4 4015 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011356938 [1,1,0,0,0,0|2,0,0]=4 4016 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_100000699733_200025704644 [1,1,0,0,0,0|2,0,0]=4 4017 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000699733 [1,1,0,0,0,0|2,0,0]=4 4018 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_100015195136_200025704644 [1,1,0,0,0,0|2,0,0]=4 4019 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_200025704644_100015195136 [1,1,0,0,0,0|2,0,0]=4 4020 B11R1.280 COc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000685887 [1,1,0,0,0,0|1,0,0]=3 4021 B11R1.280 COc1ccc(c(n1)C=O)O 271570a_203496583355_200010173843 [1,1,0,0,0,0|1,0,0]=3 4022 B11R1.280 COc1ccc(c(n1)OC)O 271570a_203496583355_100009816055 [1,1,0,0,0,0|2,0,0]=4 4023 B11R1.280 COc1nc(ccc1O)SC 62a_200000210301_100010893133 [1,1,0,0,0,0|2,0,0]=4 4024 B11R1.280 COc1nc(ccc1O)S[13CH3] 62a_200025704644_100010893133 [1,1,0,0,0,0|2,0,0]=4 4025 B11R1.280 CSc1cc(c(cn1)Br)C=O 62a_200000210301_200135154921 [1,1,0,0,0,0|2,0,0]=4 4026 B11R1.280 CSc1cc(c(cn1)Br)C=O 62a_200135154921_200000210301 [1,1,0,0,0,0|2,0,0]=4 4027 B11R1.280 CSc1cc(c(cn1)F)C=O 62a_100000707870_200000210301 [1,1,0,0,0,0|2,0,0]=4 4028 B11R1.280 CSc1cc(c(cn1)F)C=O 62a_200000210301_100000707870 [1,1,0,0,0,0|2,0,0]=4 4029 B11R1.280 CSc1cc(c(cn1)O)C=O 62a_200000210301_100000048449 [1,1,0,0,0,0|1,0,0]=3 4030 B11R1.280 CSc1cc(ccc1C)CO 62a_100000708995_200000210301 [1,1,0,0,0,0|2,0,0]=4 4031 B11R1.280 CSc1cc(ccc1C)CO 62a_200000210301_100000708995 [1,1,0,0,0,0|2,0,0]=4 4032 B11R1.280 CSc1cc(ccc1F)CN 62a_100015193890_200000210301 [1,1,0,0,0,0|2,0,0]=4 4033 B11R1.280 CSc1cc(ccc1F)CN 62a_200000210301_100015193890 [1,1,0,0,0,0|2,0,0]=4 4034 B11R1.280 CSc1cc(ccc1F)CO 62a_100000246287_200000210301 [1,1,0,0,0,0|2,0,0]=4 4035 B11R1.280 CSc1cc(ccc1F)CO 62a_200000210301_100000246287 [1,1,0,0,0,0|2,0,0]=4 4036 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_100010341305_200025704644 [1,1,0,0,0,0|2,0,0]=4 4037 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_200025704644_100010341305 [1,1,0,0,0,0|2,0,0]=4 4038 B11R1.280 CSc1cc(ccc1O)C#N 62a_200000210301_100000725478 [1,1,0,0,0,0|1,0,1]=4 4039 B11R1.280 CSc1cc(ccc1O)C=O 62a_100000184552_200000210301 [1,1,0,0,0,0|1,0,1]=4 4040 B11R1.280 CSc1cc(ccc1O)C=O 62a_200000210301_100000184552 [1,1,0,0,0,0|1,0,1]=4 4041 B11R1.280 CSc1cc(ccc1O)CO 62a_100011191544_200000210301 [1,1,0,0,0,0|1,0,0]=3 4042 B11R1.280 CSc1cc(ccc1O)CO 62a_200000210301_100011191544 [1,1,0,0,0,0|1,0,0]=3 4043 B11R1.280 CSc1ccc(c(c1)C#N)O 62a_200000210301_100000687585 [1,1,0,0,0,0|1,0,1]=4 4044 B11R1.280 CSc1ccc(c(c1)C=O)Br 62a_100010185652_200000210301 [1,1,0,0,0,0|1,0,0]=3 4045 B11R1.280 CSc1ccc(c(c1)C=O)Br 62a_200000210301_100010185652 [1,1,0,0,0,0|1,0,0]=3 4046 B11R1.280 CSc1ccc(c(c1)C=O)C 62a_100011361606_200000210301 [1,1,0,0,0,0|1,0,0]=3 4047 B11R1.280 CSc1ccc(c(c1)C=O)C 62a_200000210301_100011361606 [1,1,0,0,0,0|1,0,0]=3 4048 B11R1.280 CSc1ccc(c(c1)C=O)Cl 62a_100010254384_200000210301 [1,1,0,0,0,0|1,0,0]=3 4049 B11R1.280 CSc1ccc(c(c1)C=O)Cl 62a_200000210301_100010254384 [1,1,0,0,0,0|1,0,0]=3 4050 B11R1.280 CSc1ccc(c(c1)C=O)F 62a_100000050626_200000210301 [1,1,0,0,0,0|1,0,0]=3 4051 B11R1.280 CSc1ccc(c(c1)C=O)F 62a_200000210301_100000050626 [1,1,0,0,0,0|1,0,0]=3 4052 B11R1.280 CSc1ccc(c(c1)C=O)N 62a_100011935258_200000210301 [1,1,0,0,0,0|1,0,0]=3 4053 B11R1.280 CSc1ccc(c(c1)C=O)O 62a_200000210301_100000186750 [1,1,0,0,0,0|0,0,0]=2 4054 B11R1.280 CSc1ccc(c(c1)CN)O 62a_100000730032_200000210301 [1,1,0,0,0,0|1,0,1]=4 4055 B11R1.280 CSc1ccc(c(c1)CN)O 62a_200000210301_100000730032 [1,1,0,0,0,0|1,0,1]=4 4056 B11R1.280 CSc1ccc(c(c1)CO)O 62a_100000184703_200000210301 [1,1,0,0,0,0|0,0,2]=4 4057 B11R1.280 CSc1ccc(c(c1)CO)O 62a_200000210301_100000184703 [1,1,0,0,0,0|0,0,2]=4 4058 B11R1.280 CSc1ccc(c(c1)SC)F 62a_100010341305_200000210301 [1,1,0,0,0,0|2,0,0]=4 4059 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_100010341305 [1,1,0,0,0,0|2,0,0]=4 4060 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_200010708804 [1,1,0,0,0,0|2,0,0]=4 4061 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200010708804_200000210301 [1,1,0,0,0,0|2,0,0]=4 4062 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200010708804_200025704644 [1,1,0,0,0,0|2,0,0]=4 4063 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010708804 [1,1,0,0,0,0|2,0,0]=4 4064 B11R1.280 CSc1ccc(c(n1)C=O)F 62a_100009814804_200000210301 [1,1,0,0,0,0|2,0,0]=4 4065 B11R1.280 CSc1ccc(c(n1)C=O)F 62a_200000210301_100009814804 [1,1,0,0,0,0|2,0,0]=4 4066 B11R1.280 CSc1cnc(c(c1)C=O)F 62a_100009814789_200000210301 [1,1,0,0,0,0|2,0,0]=4 4067 B11R1.280 CSc1cnc(c(c1)C=O)F 62a_200000210301_100009814789 [1,1,0,0,0,0|2,0,0]=4 4068 B11R1.280 CSc1cnc(c(c1)C=O)N 62a_100009814808_200000210301 [1,1,0,0,0,0|2,0,0]=4 4069 B11R1.280 CSc1cnc(c(c1)C=O)N 62a_200000210301_100009814808 [1,1,0,0,0,0|2,0,0]=4 4070 B11R1.280 CSc1cnc(c(c1)C=O)O 62a_100010064889_200000210301 [1,1,0,0,0,0|1,0,0]=3 4071 B11R1.280 CSc1cnc(c(c1)C=O)O 62a_200000210301_100010064889 [1,1,0,0,0,0|1,0,0]=3 4072 B11R1.280 CSc1nc(ccc1O)CO 62a_200000210301_200000118097 [1,1,0,0,0,0|2,0,0]=4 4073 B11R1.280 CSc1nc(ccc1O)CO 62a_200009817064_200000210301 [1,1,0,0,0,0|2,0,0]=4 4074 B11R1.280 Cc1ccc(cc1C=O)S[13CH3] 62a_100011361606_200025704644 [1,1,0,0,0,0|1,0,0]=3 4075 B11R1.280 Cc1ccc(cc1C=O)S[13CH3] 62a_200025704644_100011361606 [1,1,0,0,0,0|1,0,0]=3 4076 B11R1.280 Cc1ccc(cc1N[13CH3])CO 2230a_100000758420_200025704644 [1,1,0,0,0,0|2,0,0]=4 4077 B11R1.280 Cc1ccc(cc1N[13CH3])CO 34a_100000758420_200025704644 [1,1,0,0,0,0|2,0,0]=4 4078 B11R1.280 Cc1ccc(cc1S[13CH3])CO 62a_100000708995_200025704644 [1,1,0,0,0,0|2,0,0]=4 4079 B11R1.280 Cc1ccc(cc1S[13CH3])CO 62a_200025704644_100000708995 [1,1,0,0,0,0|2,0,0]=4 4080 B11R1.280 N#Cc1cc(ccc1O)CN 271570a_203496583355_100009846983 [1,1,0,0,0,0|1,0,1]=4 4081 B11R1.280 N#Cc1cc(ccc1O)CO 271570a_203496583355_100010145894 [1,1,0,0,0,0|1,0,1]=4 4082 B11R1.280 N#Cc1ccc(c(c1)C=O)O 271570a_203496583355_100012179093 [1,1,0,0,0,0|0,0,1]=3 4083 B11R1.280 [13CH3]Nc1cc(ccc1Br)CO 34a_100012347568_200025704644 [1,1,0,0,0,0|2,0,0]=4 4084 B11R1.280 [13CH3]Nc1cc(ccc1Cl)CO 34a_106256033963_200025704644 [1,1,0,0,0,0|2,0,0]=4 4085 B11R1.280 [13CH3]Nc1cc(ccc1F)CO 2230a_102125399562_200025704644 [1,1,0,0,0,0|2,0,0]=4 4086 B11R1.280 [13CH3]Nc1cc(ccc1F)CO 34a_102125399562_200025704644 [1,1,0,0,0,0|2,0,0]=4 4087 B11R1.280 [13CH3]Nc1cc(ccc1O)C#N 34a_100000766272_200025704644 [1,1,0,0,0,0|1,0,1]=4 4088 B11R1.280 [13CH3]Nc1cc(ccc1O)C#N 7a_100000766272_200025704644 [1,1,0,0,0,0|1,0,1]=4 4089 B11R1.280 [13CH3]Nc1cc(ccc1O)CO 34a_100000123545_200025704644 [1,1,0,0,0,0|1,0,0]=3 4090 B11R1.280 [13CH3]Nc1ccc(c(c1)C#N)O 34a_100011249283_200025704644 [1,1,0,0,0,0|1,0,1]=4 4091 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 34a_100010191536_200025704644 [1,1,0,0,0,0|2,0,0]=4 4092 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 7a_100010191536_200025704644 [1,1,0,0,0,0|2,0,0]=4 4093 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CN 34a_100020636435_200025704644 [1,1,0,0,0,0|2,0,0]=4 4094 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 34a_100009876509_200025704644 [1,1,0,0,0,0|2,0,0]=4 4095 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 7a_100009876509_200025704644 [1,1,0,0,0,0|2,0,0]=4 4096 B11R1.280 [13CH3]Oc1cc(ccc1F)CN 34a_100160469508_200025704644 [1,1,0,0,0,0|2,0,0]=4 4097 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 34a_100009842347_200025704644 [1,1,0,0,0,0|2,0,0]=4 4098 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 7a_100009842347_200025704644 [1,1,0,0,0,0|2,0,0]=4 4099 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 34a_100000049605_200025704644 [1,1,0,0,0,0|2,0,0]=4 4100 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 7a_100000049605_200025704644 [1,1,0,0,0,0|2,0,0]=4 4101 B11R1.280 [13CH3]Sc1cc(c(cn1)Br)C=O 62a_200025704644_200135154921 [1,1,0,0,0,0|2,0,0]=4 4102 B11R1.280 [13CH3]Sc1cc(c(cn1)Br)C=O 62a_200135154921_200025704644 [1,1,0,0,0,0|2,0,0]=4 4103 B11R1.280 [13CH3]Sc1cc(c(cn1)F)C=O 62a_100000707870_200025704644 [1,1,0,0,0,0|2,0,0]=4 4104 B11R1.280 [13CH3]Sc1cc(c(cn1)F)C=O 62a_200025704644_100000707870 [1,1,0,0,0,0|2,0,0]=4 4105 B11R1.280 [13CH3]Sc1cc(c(cn1)O)C=O 62a_200025704644_100000048449 [1,1,0,0,0,0|1,0,0]=3 4106 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_100015193890_200025704644 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_200025704644_100015193890 [1,1,0,0,0,0|2,0,0]=4 4108 B11R1.280 [13CH3]Sc1cc(ccc1F)CO 62a_100000246287_200025704644 [1,1,0,0,0,0|2,0,0]=4 4109 B11R1.280 [13CH3]Sc1cc(ccc1F)CO 62a_200025704644_100000246287 [1,1,0,0,0,0|2,0,0]=4 4110 B11R1.280 [13CH3]Sc1cc(ccc1O)C#N 62a_200025704644_100000725478 [1,1,0,0,0,0|1,0,1]=4 4111 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_100000184552_200025704644 [1,1,0,0,0,0|1,0,1]=4 4112 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_200025704644_100000184552 [1,1,0,0,0,0|1,0,1]=4 4113 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_100011191544_200025704644 [1,1,0,0,0,0|1,0,0]=3 4114 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_200025704644_100011191544 [1,1,0,0,0,0|1,0,0]=3 4115 B11R1.280 [13CH3]Sc1ccc(c(c1)C#N)O 62a_200025704644_100000687585 [1,1,0,0,0,0|1,0,1]=4 4116 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)Br 62a_100010185652_200025704644 [1,1,0,0,0,0|1,0,0]=3 4117 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)Br 62a_200025704644_100010185652 [1,1,0,0,0,0|1,0,0]=3 4118 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)Cl 62a_100010254384_200025704644 [1,1,0,0,0,0|1,0,0]=3 4119 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)Cl 62a_200025704644_100010254384 [1,1,0,0,0,0|1,0,0]=3 4120 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)F 62a_100000050626_200025704644 [1,1,0,0,0,0|1,0,0]=3 4121 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)F 62a_200025704644_100000050626 [1,1,0,0,0,0|1,0,0]=3 4122 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)N 62a_100011935258_200025704644 [1,1,0,0,0,0|1,0,0]=3 4123 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)O 62a_200025704644_100000186750 [1,1,0,0,0,0|0,0,0]=2 4124 B11R1.280 [13CH3]Sc1ccc(c(c1)CN)O 62a_100000730032_200025704644 [1,1,0,0,0,0|1,0,1]=4 4125 B11R1.280 [13CH3]Sc1ccc(c(c1)CN)O 62a_200025704644_100000730032 [1,1,0,0,0,0|1,0,1]=4 4126 B11R1.280 [13CH3]Sc1ccc(c(c1)CO)O 62a_100000184703_200025704644 [1,1,0,0,0,0|0,0,2]=4 4127 B11R1.280 [13CH3]Sc1ccc(c(c1)CO)O 62a_200025704644_100000184703 [1,1,0,0,0,0|0,0,2]=4 4128 B11R1.280 [13CH3]Sc1ccc(c(n1)C=O)F 62a_100009814804_200025704644 [1,1,0,0,0,0|2,0,0]=4 4129 B11R1.280 [13CH3]Sc1ccc(c(n1)C=O)F 62a_200025704644_100009814804 [1,1,0,0,0,0|2,0,0]=4 4130 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)F 62a_100009814789_200025704644 [1,1,0,0,0,0|2,0,0]=4 4131 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)F 62a_200025704644_100009814789 [1,1,0,0,0,0|2,0,0]=4 4132 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)N 62a_100009814808_200025704644 [1,1,0,0,0,0|2,0,0]=4 4133 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)N 62a_200025704644_100009814808 [1,1,0,0,0,0|2,0,0]=4 4134 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)O 62a_100010064889_200025704644 [1,1,0,0,0,0|1,0,0]=3 4135 B11R1.280 [13CH3]Sc1cnc(c(c1)C=O)O 62a_200025704644_100010064889 [1,1,0,0,0,0|1,0,0]=3 4136 B11R1.280 [13CH3]Sc1nc(ccc1O)CO 62a_200009817064_200025704644 [1,1,0,0,0,0|2,0,0]=4 4137 B11R1.280 [13CH3]Sc1nc(ccc1O)CO 62a_200025704644_200000118097 [1,1,0,0,0,0|2,0,0]=4 4138 B11R1.53 C#Cc1ccccc1C(=O)C 1458a_100011243808_200000210301 [1,1,0,0,0,0|1,0,0]=3 4139 B11R1.53 C#Cc1ccccc1C(=O)[13CH3] 1458a_100011243808_200025704644 [1,1,0,0,0,0|1,0,0]=3 4140 B11R1.53 C=C(C)c1ccccc1C#N 271570a_100000694244_100000188569 [1,1,0,0,0,0|2,0,0]=4 4141 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [1,1,0,0,0,0|1,0,1]=4 4142 B11R1.53 C=C(C)c1ccccc1CC 271570a_100000694244_100011215823 [1,1,0,0,0,0|2,0,0]=4 4143 B11R1.53 C=C(C)c1ccccc1CN 271570a_100000694244_100000689332 [1,1,0,0,0,0|2,0,0]=4 4144 B11R1.53 C=C(C)c1ccccc1CO 271570a_100000694244_100000187465 [1,1,0,0,0,0|1,0,0]=3 4145 B11R1.53 C=C(C)c1ccccc1NC 271570a_100000694244_100020606079 [1,1,0,0,0,0|2,0,0]=4 4146 B11R1.53 C=C(C)c1ccccc1NC 34a_100000037685_200000210301 [1,1,0,0,0,0|2,0,0]=4 4147 B11R1.53 C=C(C)c1ccccc1NN 271570a_100000694244_100000241748 [1,1,0,0,0,0|2,0,0]=4 4148 B11R1.53 C=C(C)c1ccccc1N[13CH3] 34a_100000037685_200025704644 [1,1,0,0,0,0|2,0,0]=4 4149 B11R1.53 C=C(C)c1ccccc1OC 271570a_100000694244_100000174000 [1,1,0,0,0,0|1,0,0]=3 4150 B11R1.53 C=C(C)c1ccccc1SC 271570a_100000694244_100011217816 [1,1,0,0,0,0|1,1,0]=4 4151 B11R1.53 C=C(C)c1cccnc1CO 271570a_100000694244_100011996772 [1,1,0,0,0,0|2,0,0]=4 4152 B11R1.53 C=C(C)c1cccnc1OC 271570a_100000694244_100000047025 [1,1,0,0,0,0|2,0,0]=4 4153 B11R1.53 C=C(C)c1ccncc1CO 271570a_100000694244_100000117392 [1,1,0,0,0,0|2,0,0]=4 4154 B11R1.53 C=C(C)c1ccncc1OC 271570a_100000694244_100016988167 [1,1,0,0,0,0|2,0,0]=4 4155 B11R1.53 C=C(C)c1cnccc1CO 271570a_100000694244_100009873359 [1,1,0,0,0,0|2,0,0]=4 4156 B11R1.53 C=C(C)c1cnccc1OC 271570a_100000694244_100011997281 [1,1,0,0,0,0|2,0,0]=4 4157 B11R1.53 C=C(C)c1ncccc1CO 271570a_100000694244_100000748726 [1,1,0,0,0,0|2,0,0]=4 4158 B11R1.53 C=C(C)c1ncccc1OC 271570a_100000694244_100000690851 [1,1,0,0,0,0|2,0,0]=4 4159 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [1,1,0,0,0,0|1,0,0]=3 4160 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [1,1,0,0,0,0|1,0,0]=3 4161 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [1,1,0,0,0,0|2,0,0]=4 4162 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [1,1,0,0,0,0|1,0,0]=3 4163 B11R1.53 C=Cc1ccccc1S(=O)C 271570a_100011290941_100000734199 [1,1,0,0,0,0|2,0,0]=4 4164 B11R1.53 C=Cc1cccnc1C(=O)C 271570a_100011290941_100012348690 [1,1,0,0,0,0|2,0,0]=4 4165 B11R1.53 C=Cc1ccncc1C(=O)C 271570a_100011290941_100160469449 [1,1,0,0,0,0|2,0,0]=4 4166 B11R1.53 C=Cc1cnccc1C(=O)C 271570a_100011290941_100009993184 [1,1,0,0,0,0|2,0,0]=4 4167 B11R1.53 C=Cc1ncccc1C(=O)C 271570a_100011290941_100000753718 [1,1,0,0,0,0|2,0,0]=4 4168 B11R1.53 CC(=O)c1ccccc1C#N 1458a_100000742908_200000210301 [1,1,0,0,0,0|1,0,0]=3 4169 B11R1.53 CC(=O)c1ccccc1CO 1458a_100011301526_200000210301 [1,1,0,0,0,0|0,0,0]=2 4170 B11R1.53 CC(=O)c1ccccc1I=O 1458a_100000032414_200000210301 [1,1,0,0,0,0|0,0,1]=3 4171 B11R1.53 CC(=O)c1ccccc1S[13CH3] 62a_100000751169_200025704644 [1,1,0,0,0,0|0,1,0]=3 4172 B11R1.53 CC(=O)c1cccnc1S[13CH3] 62a_100000753718_200025704644 [1,1,0,0,0,0|1,1,0]=4 4173 B11R1.53 CC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000753718 [1,1,0,0,0,0|1,1,0]=4 4174 B11R1.53 CC(=O)c1ccncc1O[13CH3] 7a_100009872882_200025704644 [1,1,0,0,0,0|1,0,0]=3 4175 B11R1.53 CC(=O)c1ccncc1S[13CH3] 62a_100009993184_200025704644 [1,1,0,0,0,0|1,1,0]=4 4176 B11R1.53 CC(=O)c1ccncc1S[13CH3] 62a_200025704644_100009993184 [1,1,0,0,0,0|1,1,0]=4 4177 B11R1.53 CC(=O)c1cnccc1S[13CH3] 62a_100160469449_200025704644 [1,1,0,0,0,0|1,1,0]=4 4178 B11R1.53 CC(=O)c1cnccc1S[13CH3] 62a_200025704644_100160469449 [1,1,0,0,0,0|1,1,0]=4 4179 B11R1.53 CC(=O)c1ncccc1O[13CH3] 34a_100000087166_200025704644 [1,1,0,0,0,0|1,0,0]=3 4180 B11R1.53 CC(=O)c1ncccc1O[13CH3] 7a_100000087166_200025704644 [1,1,0,0,0,0|1,0,0]=3 4181 B11R1.53 CC(=O)c1ncccc1S[13CH3] 62a_100012348690_200025704644 [1,1,0,0,0,0|1,1,0]=4 4182 B11R1.53 CC(=O)c1ncccc1S[13CH3] 62a_200025704644_100012348690 [1,1,0,0,0,0|1,1,0]=4 4183 B11R1.53 CC(C)c1ccccc1O[13CH3] 34a_100000211617_200025704644 [1,1,0,0,0,0|1,0,1]=4 4184 B11R1.53 CC(C)c1ccccc1O[13CH3] 7a_100000211617_200025704644 [1,1,0,0,0,0|1,0,1]=4 4185 B11R1.53 CC(O)c1ccccc1O[13CH3] 34a_200011232679_200025704644 [1,1,0,0,0,0|0,0,2]=4 4186 B11R1.53 CC(O)c1ccccc1O[13CH3] 7a_200011232679_200025704644 [1,1,0,0,0,0|0,0,2]=4 4187 B11R1.53 CCc1ccccc1C(=O)C 1458a_100000689120_200000210301 [1,1,0,0,0,0|1,0,0]=3 4188 B11R1.53 CCc1ccccc1C(=O)[13CH3] 1458a_100000689120_200025704644 [1,1,0,0,0,0|1,0,0]=3 4189 B11R1.53 CNc1ccccc1C(=O)N 34a_100000185089_200000210301 [1,1,0,0,0,0|2,0,0]=4 4190 B11R1.53 CNc1ccncc1C(=O)C 27a_100102657272_100160469449 [1,1,0,0,0,0|2,0,0]=4 4191 B11R1.53 CNc1ncccc1C(=O)C 27a_100102657272_100009816689 [1,1,0,0,0,0|2,0,0]=4 4192 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [1,1,0,0,0,0|0,0,0]=2 4193 B11R1.53 COc1ccccc1C(=O)N 34a_100000192804_200000210301 [1,1,0,0,0,0|1,0,0]=3 4194 B11R1.53 COc1ccccc1C(=O)N 7a_100000192804_200000210301 [1,1,0,0,0,0|1,0,0]=3 4195 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [1,1,0,0,0,0|0,0,0]=2 4196 B11R1.53 COc1ccccc1C(=O)[O-] 7a_100015234032_200000210301 [1,1,0,0,0,0|1,0,0]=3 4197 B11R1.53 COc1ccccc1C(=S)N 7a_100000745089_200000210301 [1,1,0,0,0,0|1,1,0]=4 4198 B11R1.53 COc1ccccc1C(C)C 34a_100000211617_200000210301 [1,1,0,0,0,0|1,0,1]=4 4199 B11R1.53 COc1ccccc1C(C)C 7a_100000211617_200000210301 [1,1,0,0,0,0|1,0,1]=4 4200 B11R1.53 COc1ccccc1C(C)O 34a_200011232679_200000210301 [1,1,0,0,0,0|0,0,2]=4 4201 B11R1.53 COc1ccccc1C(C)O 7a_200011232679_200000210301 [1,1,0,0,0,0|0,0,2]=4 4202 B11R1.53 COc1ccccc1N(C)C 2230a_100000219746_200000210301 [1,1,0,0,0,0|2,0,0]=4 4203 B11R1.53 COc1ccccc1N(C)C 269982a_100000219746_200000210301 [1,1,0,0,0,0|2,0,0]=4 4204 B11R1.53 COc1ccccc1N(C)C 34a_100000219746_200000210301 [1,1,0,0,0,0|2,0,0]=4 4205 B11R1.53 COc1ccccc1N(C)[13CH3] 2230a_100000219746_200025704644 [1,1,0,0,0,0|2,0,0]=4 4206 B11R1.53 COc1ccccc1N(C)[13CH3] 269982a_100000219746_200025704644 [1,1,0,0,0,0|2,0,0]=4 4207 B11R1.53 COc1ccccc1N(C)[13CH3] 34a_100000219746_200025704644 [1,1,0,0,0,0|2,0,0]=4 4208 B11R1.53 COc1ccccc1[C@@H](C)N 34a_100025703389_200000210301 [1,1,0,0,0,0|1,0,1]=4 4209 B11R1.53 COc1ccccc1[N+](=O)[O-] 34a_100000186319_200000210301 [1,1,0,0,0,0|2,0,0]=4 4210 B11R1.53 COc1ccccc1[N+](=O)[O-] 7a_100000186319_200000210301 [1,1,0,0,0,0|2,0,0]=4 4211 B11R1.53 COc1cccnc1C(=O)C 34a_100000087166_200000210301 [1,1,0,0,0,0|1,0,0]=3 4212 B11R1.53 COc1cccnc1C(=O)C 7a_100000087166_200000210301 [1,1,0,0,0,0|1,0,0]=3 4213 B11R1.53 COc1cccnc1C(=O)N 34a_200011215183_200000210301 [1,1,0,0,0,0|2,0,0]=4 4214 B11R1.53 COc1cccnc1C(=O)N 7a_200011215183_200000210301 [1,1,0,0,0,0|2,0,0]=4 4215 B11R1.53 COc1ccncc1C(=O)N 34a_200011998761_200000210301 [1,1,0,0,0,0|2,0,0]=4 4216 B11R1.53 COc1cnccc1C(=O)C 7a_100009872882_200000210301 [1,1,0,0,0,0|1,0,0]=3 4217 B11R1.53 COc1cnccc1C(=O)N 7a_100012022987_200000210301 [1,1,0,0,0,0|2,0,0]=4 4218 B11R1.53 CS(=O)c1ccccc1S[13CH3] 62a_100000734199_200025704644 [1,1,0,0,0,0|1,1,0]=4 4219 B11R1.53 CSc1ccccc1C(=O)C 1458a_100000183967_200000210301 [1,1,0,0,0,0|0,1,0]=3 4220 B11R1.53 CSc1ccccc1C(=O)C 62a_100000751169_200000210301 [1,1,0,0,0,0|0,1,0]=3 4221 B11R1.53 CSc1ccccc1C(=O)N 62a_100000162227_200000210301 [1,1,0,0,0,0|1,1,0]=4 4222 B11R1.53 CSc1ccccc1C(=O)N 62a_200000210301_100000162227 [1,1,0,0,0,0|1,1,0]=4 4223 B11R1.53 CSc1ccccc1C(=O)O 62a_200000210301_100000734275 [1,1,0,0,0,0|1,1,0]=4 4224 B11R1.53 CSc1ccccc1C(=O)O 62a_202125556159_200000210301 [1,1,0,0,0,0|1,1,0]=4 4225 B11R1.53 CSc1ccccc1C(=O)[13CH3] 1458a_100000183967_200025704644 [1,1,0,0,0,0|0,1,0]=3 4226 B11R1.53 CSc1ccccc1S(=O)C 62a_100000734199_200000210301 [1,1,0,0,0,0|1,1,0]=4 4227 B11R1.53 CSc1cccnc1C(=O)C 62a_100012348690_200000210301 [1,1,0,0,0,0|1,1,0]=4 4228 B11R1.53 CSc1cccnc1C(=O)C 62a_200000210301_100012348690 [1,1,0,0,0,0|1,1,0]=4 4229 B11R1.53 CSc1ccncc1C(=O)C 62a_100160469449_200000210301 [1,1,0,0,0,0|1,1,0]=4 4230 B11R1.53 CSc1ccncc1C(=O)C 62a_200000210301_100160469449 [1,1,0,0,0,0|1,1,0]=4 4231 B11R1.53 CSc1cnccc1C(=O)C 62a_100009993184_200000210301 [1,1,0,0,0,0|1,1,0]=4 4232 B11R1.53 CSc1cnccc1C(=O)C 62a_200000210301_100009993184 [1,1,0,0,0,0|1,1,0]=4 4233 B11R1.53 CSc1ncccc1C(=O)C 62a_100000753718_200000210301 [1,1,0,0,0,0|1,1,0]=4 4234 B11R1.53 CSc1ncccc1C(=O)C 62a_200000210301_100000753718 [1,1,0,0,0,0|1,1,0]=4 4235 B11R1.53 C[C@@H](N)c1ccccc1O[13CH3] 34a_100025703389_200025704644 [1,1,0,0,0,0|1,0,1]=4 4236 B11R1.53 [13CH3]C(=O)c1ccccc1C#N 1458a_100000742908_200025704644 [1,1,0,0,0,0|1,0,0]=3 4237 B11R1.53 [13CH3]C(=O)c1ccccc1CO 1458a_100011301526_200025704644 [1,1,0,0,0,0|0,0,0]=2 4238 B11R1.53 [13CH3]C(=O)c1ccccc1I=O 1458a_100000032414_200025704644 [1,1,0,0,0,0|0,0,1]=3 4239 B11R1.53 [13CH3]Nc1ccccc1C(=O)N 34a_100000185089_200025704644 [1,1,0,0,0,0|2,0,0]=4 4240 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 34a_100000192804_200025704644 [1,1,0,0,0,0|1,0,0]=3 4241 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 7a_100000192804_200025704644 [1,1,0,0,0,0|1,0,0]=3 4242 B11R1.53 [13CH3]Oc1ccccc1C(=O)[O-] 7a_100015234032_200025704644 [1,1,0,0,0,0|1,0,0]=3 4243 B11R1.53 [13CH3]Oc1ccccc1C(=S)N 7a_100000745089_200025704644 [1,1,0,0,0,0|1,1,0]=4 4244 B11R1.53 [13CH3]Oc1ccccc1[N+](=O)[O-] 34a_100000186319_200025704644 [1,1,0,0,0,0|2,0,0]=4 4245 B11R1.53 [13CH3]Oc1ccccc1[N+](=O)[O-] 7a_100000186319_200025704644 [1,1,0,0,0,0|2,0,0]=4 4246 B11R1.53 [13CH3]Oc1cccnc1C(=O)N 34a_200011215183_200025704644 [1,1,0,0,0,0|2,0,0]=4 4247 B11R1.53 [13CH3]Oc1cccnc1C(=O)N 7a_200011215183_200025704644 [1,1,0,0,0,0|2,0,0]=4 4248 B11R1.53 [13CH3]Oc1ccncc1C(=O)N 34a_200011998761_200025704644 [1,1,0,0,0,0|2,0,0]=4 4249 B11R1.53 [13CH3]Oc1cnccc1C(=O)N 7a_100012022987_200025704644 [1,1,0,0,0,0|2,0,0]=4 4250 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_100000162227_200025704644 [1,1,0,0,0,0|1,1,0]=4 4251 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_200025704644_100000162227 [1,1,0,0,0,0|1,1,0]=4 4252 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_200025704644_100000734275 [1,1,0,0,0,0|1,1,0]=4 4253 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_202125556159_200025704644 [1,1,0,0,0,0|1,1,0]=4 4254 B11R1.87 CC(C)(C)c1ccccc1O 271570a_203496583355_100012339570 [1,1,0,0,0,0|1,0,1]=4 4255 B11R1.87 CC(C)(N)c1ccccc1O 271570a_203496583355_100020606264 [1,1,0,0,0,0|1,0,1]=4 4256 B11R1.87 CC(C)(O)c1ccccc1O 271570a_203496583355_100011346021 [1,1,0,0,0,0|0,0,2]=4 4257 B11R1.87 CC(F)(F)c1ccccc1O 271570a_203496583355_100010220483 [1,1,0,0,0,0|1,0,1]=4 4258 B11R1.87 CS(=O)(=O)c1ccccc1O 271570a_203496583355_100000751929 [1,1,0,0,0,0|1,0,0]=3 4259 B11R1.87 CS(=O)(=O)c1ccncc1O 271570a_203496583355_200010191168 [1,1,0,0,0,0|2,0,0]=4 4260 B11R1.87 CS(=O)(=O)c1ncccc1O 271570a_203496583355_100009830116 [1,1,0,0,0,0|2,0,0]=4 4261 B11R1.87 NS(=O)(=O)c1ccccc1O 271570a_203496583355_100000735520 [1,1,0,0,0,0|2,0,0]=4 4262 B11R1.156 C=C(C)c1c(cccc1Br)Br 271570a_100000694244_100009994525 [1,1,0,0,0,0|2,0,0]=4 4263 B11R1.156 C=C(C)c1c(cccc1Br)Cl 271570a_100000694244_100010214488 [1,1,0,0,0,0|2,0,0]=4 4264 B11R1.156 C=C(C)c1c(cccc1Br)F 271570a_100000694244_100011219512 [1,1,0,0,0,0|2,0,0]=4 4265 B11R1.156 C=C(C)c1c(cccc1Br)N 271570a_100000694244_100020590159 [1,1,0,0,0,0|2,0,0]=4 4266 B11R1.156 C=C(C)c1c(cccc1Br)O 271570a_100000694244_100010187912 [1,1,0,0,0,0|1,0,0]=3 4267 B11R1.156 C=C(C)c1c(cccc1C)C 271570a_100000694244_100000033847 [1,1,0,0,0,0|2,0,0]=4 4268 B11R1.156 C=C(C)c1c(cccc1Cl)C 271570a_100000694244_100000043165 [1,1,0,0,0,0|2,0,0]=4 4269 B11R1.156 C=C(C)c1c(cccc1Cl)Cl 271570a_100000694244_100000034237 [1,1,0,0,0,0|2,0,0]=4 4270 B11R1.156 C=C(C)c1c(cccc1Cl)F 271570a_100000694244_100000050007 [1,1,0,0,0,0|2,0,0]=4 4271 B11R1.156 C=C(C)c1c(cccc1Cl)N 271570a_100000694244_100000049713 [1,1,0,0,0,0|2,0,0]=4 4272 B11R1.156 C=C(C)c1c(cccc1Cl)O 271570a_100000694244_100000050174 [1,1,0,0,0,0|1,0,0]=3 4273 B11R1.156 C=C(C)c1c(cccc1F)C 271570a_100000694244_100012349962 [1,1,0,0,0,0|2,0,0]=4 4274 B11R1.156 C=C(C)c1c(cccc1F)F 271570a_100000694244_100000693133 [1,1,0,0,0,0|2,0,0]=4 4275 B11R1.156 C=C(C)c1c(cccc1F)N 271570a_100000694244_100011934729 [1,1,0,0,0,0|2,0,0]=4 4276 B11R1.156 C=C(C)c1c(cccc1F)O 271570a_100000694244_100009820682 [1,1,0,0,0,0|1,0,0]=3 4277 B11R1.156 C=C(C)c1c(cccc1N)C 271570a_100000694244_100000684715 [1,1,0,0,0,0|2,0,0]=4 4278 B11R1.156 C=C(C)c1c(cccc1O)C 271570a_100000694244_100000686692 [1,1,0,0,0,0|1,0,0]=3 4279 B11R1.156 C=C(C)c1c(cccc1O)N 271570a_100000694244_100012183704 [1,1,0,0,0,0|1,0,0]=3 4280 B11R1.156 C=C(C)c1c(cccc1O)O 271570a_100000694244_100010205330 [1,1,0,0,0,0|1,0,0]=3 4281 B11R1.156 C=C(C)c1c(ccnc1O)C 271570a_100000694244_100012000493 [1,1,0,0,0,0|2,0,0]=4 4282 B11R1.156 C=C(C)c1c(ccnc1O)O 271570a_100000694244_200009817435 [1,1,0,0,0,0|2,0,0]=4 4283 B11R1.156 CC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000210301 [1,1,0,0,0,0|1,0,0]=3 4284 B11R1.156 CC(=O)c1c(cccc1Br)C 1458a_100000701904_200000210301 [1,1,0,0,0,0|1,0,0]=3 4285 B11R1.156 CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000210301 [1,1,0,0,0,0|1,0,0]=3 4286 B11R1.156 CC(=O)c1c(cccc1Br)F 1458a_100000752694_200000210301 [1,1,0,0,0,0|1,0,0]=3 4287 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [1,1,0,0,0,0|0,0,0]=2 4288 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [1,1,0,0,0,0|1,0,0]=3 4289 B11R1.156 CC(=O)c1c(cccc1Cl)C 1458a_100000692601_200000210301 [1,1,0,0,0,0|1,0,0]=3 4290 B11R1.156 CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000210301 [1,1,0,0,0,0|1,0,0]=3 4291 B11R1.156 CC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000210301 [1,1,0,0,0,0|1,0,0]=3 4292 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [1,1,0,0,0,0|0,0,0]=2 4293 B11R1.156 CC(=O)c1c(cccc1F)C 1458a_100000762013_200000210301 [1,1,0,0,0,0|1,0,0]=3 4294 B11R1.156 CC(=O)c1c(cccc1F)F 1458a_100000210804_200000210301 [1,1,0,0,0,0|1,0,0]=3 4295 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [1,1,0,0,0,0|0,0,0]=2 4296 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [1,1,0,0,0,0|0,0,0]=2 4297 B11R1.156 CC(=O)c1c(cccc1I)Br 1458a_100010232521_200000210301 [1,1,0,0,0,0|1,0,0]=3 4298 B11R1.156 CC(=O)c1c(cccc1I)C 1458a_100000688020_200000210301 [1,1,0,0,0,0|1,0,0]=3 4299 B11R1.156 CC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000210301 [1,1,0,0,0,0|1,0,0]=3 4300 B11R1.156 CC(=O)c1c(cccc1I)F 1458a_100000023732_200000210301 [1,1,0,0,0,0|1,0,0]=3 4301 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [1,1,0,0,0,0|0,0,0]=2 4302 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [1,1,0,0,0,0|0,0,0]=2 4303 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [1,1,0,0,0,0|0,0,0]=2 4304 B11R1.156 CC(=O)c1c(ccnc1O)N 271570a_203496583355_200010729368 [1,1,0,0,0,0|1,0,0]=3 4305 B11R1.156 CC(O)c1c(cccc1F)O 271570a_203496583355_100013085324 [1,1,0,0,0,0|0,0,2]=4 4306 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Br 1458a_100000701904_200025704644 [1,1,0,0,0,0|1,0,0]=3 4307 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [1,1,0,0,0,0|1,0,0]=3 4308 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Cl 1458a_100000692601_200025704644 [1,1,0,0,0,0|1,0,0]=3 4309 B11R1.156 Cc1cccc(c1C(=O)[13CH3])F 1458a_100000762013_200025704644 [1,1,0,0,0,0|1,0,0]=3 4310 B11R1.156 Cc1cccc(c1C(=O)[13CH3])I 1458a_100000688020_200025704644 [1,1,0,0,0,0|1,0,0]=3 4311 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [1,1,0,0,0,0|0,0,0]=2 4312 B11R1.156 NC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010147686 [1,1,0,0,0,0|1,0,0]=3 4313 B11R1.156 NC(=O)c1c(cccc1F)O 271570a_203496583355_100011219063 [1,1,0,0,0,0|1,0,0]=3 4314 B11R1.156 NC(=O)c1c(cncc1F)O 271570a_203496583355_100010271514 [1,1,0,0,0,0|2,0,0]=4 4315 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Br 1458a_100000690891_200025704644 [1,1,0,0,0,0|1,0,0]=3 4316 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200025704644 [1,1,0,0,0,0|1,0,0]=3 4317 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)F 1458a_100000752694_200025704644 [1,1,0,0,0,0|1,0,0]=3 4318 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [1,1,0,0,0,0|0,0,0]=2 4319 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200025704644 [1,1,0,0,0,0|1,0,0]=3 4320 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)F 1458a_100000210369_200025704644 [1,1,0,0,0,0|1,0,0]=3 4321 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [1,1,0,0,0,0|0,0,0]=2 4322 B11R1.156 [13CH3]C(=O)c1c(cccc1F)F 1458a_100000210804_200025704644 [1,1,0,0,0,0|1,0,0]=3 4323 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [1,1,0,0,0,0|0,0,0]=2 4324 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Br 1458a_100010232521_200025704644 [1,1,0,0,0,0|1,0,0]=3 4325 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Cl 1458a_100000702859_200025704644 [1,1,0,0,0,0|1,0,0]=3 4326 B11R1.156 [13CH3]C(=O)c1c(cccc1I)F 1458a_100000023732_200025704644 [1,1,0,0,0,0|1,0,0]=3 4327 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [1,1,0,0,0,0|0,0,0]=2 4328 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,1,0,0,0,0|2,0,0]=4 4329 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [1,1,0,0,0,0|2,0,0]=4 4330 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [1,1,0,0,0,0|2,0,0]=4 4331 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [1,1,0,0,0,0|2,0,0]=4 4332 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [1,1,0,0,0,0|2,0,0]=4 4333 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [1,1,0,0,0,0|2,0,0]=4 4334 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,1,0,0,0,0|2,0,0]=4 4335 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [1,1,0,0,0,0|2,0,0]=4 4336 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [1,1,0,0,0,0|2,0,0]=4 4337 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [1,1,0,0,0,0|2,0,0]=4 4338 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [1,1,0,0,0,0|2,0,0]=4 4339 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,1,0,0,0,0|2,0,0]=4 4340 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [1,1,0,0,0,0|2,0,0]=4 4341 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [1,1,0,0,0,0|2,0,0]=4 4342 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [1,1,0,0,0,0|2,0,0]=4 4343 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [1,1,0,0,0,0|2,0,0]=4 4344 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [1,1,0,0,0,0|2,0,0]=4 4345 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,1,0,0,0,0|2,0,0]=4 4346 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [1,1,0,0,0,0|2,0,0]=4 4347 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [1,1,0,0,0,0|2,0,0]=4 4348 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [1,1,0,0,0,0|2,0,0]=4 4349 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [1,1,0,0,0,0|2,0,0]=4 4350 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [1,1,0,0,0,0|2,0,0]=4 4351 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,1,0,0,0,0|2,0,0]=4 4352 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [1,1,0,0,0,0|1,0,0]=3 4353 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [1,1,0,0,0,0|1,0,0]=3 4354 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [1,1,0,0,0,0|1,0,0]=3 4355 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [1,1,0,0,0,0|1,0,0]=3 4356 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [1,1,0,0,0,0|1,0,0]=3 4357 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,1,0,0,0,0|1,0,0]=3 4358 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [1,1,0,0,0,0|2,0,0]=4 4359 B11R1.159 C=C(C)c1nccc(c1O)F 271570a_100000694244_100009867227 [1,1,0,0,0,0|2,0,0]=4 4360 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [1,1,0,0,0,0|1,0,0]=3 4361 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,1,0,0,0,0|1,0,0]=3 4362 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [1,1,0,0,0,0|1,0,0]=3 4363 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [1,1,0,0,0,0|1,0,0]=3 4364 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [1,1,0,0,0,0|1,0,0]=3 4365 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [1,1,0,0,0,0|1,0,0]=3 4366 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [1,1,0,0,0,0|1,0,0]=3 4367 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,1,0,0,0,0|1,0,0]=3 4368 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [1,1,0,0,0,0|1,0,0]=3 4369 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [1,1,0,0,0,0|1,0,0]=3 4370 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [1,1,0,0,0,0|1,0,0]=3 4371 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [1,1,0,0,0,0|1,0,0]=3 4372 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [1,1,0,0,0,0|1,0,0]=3 4373 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [1,1,0,0,0,0|1,0,0]=3 4374 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,1,0,0,0,0|1,0,0]=3 4375 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [1,1,0,0,0,0|1,0,0]=3 4376 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [1,1,0,0,0,0|1,0,0]=3 4377 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [1,1,0,0,0,0|1,0,0]=3 4378 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [1,1,0,0,0,0|1,0,0]=3 4379 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [1,1,0,0,0,0|1,0,0]=3 4380 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,1,0,0,0,0|1,0,0]=3 4381 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [1,1,0,0,0,0|1,0,0]=3 4382 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [1,1,0,0,0,0|1,0,0]=3 4383 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [1,1,0,0,0,0|1,0,0]=3 4384 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [1,1,0,0,0,0|1,0,0]=3 4385 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [1,1,0,0,0,0|1,0,0]=3 4386 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [1,1,0,0,0,0|1,0,0]=3 4387 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,1,0,0,0,0|1,0,0]=3 4388 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [1,1,0,0,0,0|1,0,0]=3 4389 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [1,1,0,0,0,0|1,0,0]=3 4390 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [1,1,0,0,0,0|1,0,0]=3 4391 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,1,0,0,0,0|0,0,0]=2 4392 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,1,0,0,0,0|0,0,0]=2 4393 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,1,0,0,0,0|0,0,0]=2 4394 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,1,0,0,0,0|0,0,0]=2 4395 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,1,0,0,0,0|0,0,0]=2 4396 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,1,0,0,0,0|0,0,0]=2 4397 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,1,0,0,0,0|0,0,0]=2 4398 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [1,1,0,0,0,0|2,0,0]=4 4399 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [1,1,0,0,0,0|2,0,0]=4 4400 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [1,1,0,0,0,0|2,0,0]=4 4401 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [1,1,0,0,0,0|1,0,0]=3 4402 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [1,1,0,0,0,0|1,0,0]=3 4403 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [1,1,0,0,0,0|1,0,0]=3 4404 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [1,1,0,0,0,0|1,0,0]=3 4405 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [1,1,0,0,0,0|1,0,0]=3 4406 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,1,0,0,0,0|1,0,0]=3 4407 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,1,0,0,0,0|1,0,0]=3 4408 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,1,0,0,0,0|1,0,0]=3 4409 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,1,0,0,0,0|1,0,0]=3 4410 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,1,0,0,0,0|1,0,0]=3 4411 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,1,0,0,0,0|1,0,0]=3 4412 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,1,0,0,0,0|0,0,0]=2 4413 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [1,1,0,0,0,0|2,0,0]=4 4414 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [1,1,0,0,0,0|2,0,0]=4 4415 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [1,1,0,0,0,0|1,0,0]=3 4416 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [1,1,0,0,0,0|1,0,0]=3 4417 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [1,1,0,0,0,0|1,0,0]=3 4418 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [1,1,0,0,0,0|1,0,0]=3 4419 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [1,1,0,0,0,0|1,0,0]=3 4420 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [1,1,0,0,0,0|1,0,0]=3 4421 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [1,1,0,0,0,0|1,0,0]=3 4422 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [1,1,0,0,0,0|1,0,0]=3 4423 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [1,1,0,0,0,0|1,0,0]=3 4424 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [1,1,0,0,0,0|1,0,0]=3 4425 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [1,1,0,0,0,0|1,0,0]=3 4426 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [1,1,0,0,0,0|1,0,0]=3 4427 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [1,1,0,0,0,0|1,0,0]=3 4428 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [1,1,0,0,0,0|1,0,0]=3 4429 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [1,1,0,0,0,0|1,0,0]=3 4430 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [1,1,0,0,0,0|1,0,0]=3 4431 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [1,1,0,0,0,0|1,0,0]=3 4432 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [1,1,0,0,0,0|1,0,0]=3 4433 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [1,1,0,0,0,0|1,0,0]=3 4434 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [1,1,0,0,0,0|1,0,0]=3 4435 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,1,0,0,0,0|0,0,0]=2 4436 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,1,0,0,0,0|0,0,0]=2 4437 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,1,0,0,0,0|0,0,0]=2 4438 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,1,0,0,0,0|0,0,0]=2 4439 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [1,1,0,0,0,0|2,0,0]=4 4440 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [1,1,0,0,0,0|2,0,0]=4 4441 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [1,1,0,0,0,0|2,0,0]=4 4442 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [1,1,0,0,0,0|2,0,0]=4 4443 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [1,1,0,0,0,0|2,0,0]=4 4444 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [1,1,0,0,0,0|2,0,0]=4 4445 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [1,1,0,0,0,0|2,0,0]=4 4446 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [1,1,0,0,0,0|2,0,0]=4 4447 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [1,1,0,0,0,0|2,0,0]=4 4448 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [1,1,0,0,0,0|2,0,0]=4 4449 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [1,1,0,0,0,0|2,0,0]=4 4450 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [1,1,0,0,0,0|2,0,0]=4 4451 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [1,1,0,0,0,0|2,0,0]=4 4452 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [1,1,0,0,0,0|2,0,0]=4 4453 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [1,1,0,0,0,0|2,0,0]=4 4454 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [1,1,0,0,0,0|2,0,0]=4 4455 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [1,1,0,0,0,0|2,0,0]=4 4456 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [1,1,0,0,0,0|2,0,0]=4 4457 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [1,1,0,0,0,0|2,0,0]=4 4458 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [1,1,0,0,0,0|2,0,0]=4 4459 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [1,1,0,0,0,0|2,0,0]=4 4460 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [1,1,0,0,0,0|2,0,0]=4 4461 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [1,1,0,0,0,0|2,0,0]=4 4462 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [1,1,0,0,0,0|2,0,0]=4 4463 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [1,1,0,0,0,0|2,0,0]=4 4464 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [1,1,0,0,0,0|2,0,0]=4 4465 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [1,1,0,0,0,0|2,0,0]=4 4466 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [1,1,0,0,0,0|2,0,0]=4 4467 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [1,1,0,0,0,0|2,0,0]=4 4468 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [1,1,0,0,0,0|2,0,0]=4 4469 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [1,1,0,0,0,0|1,0,0]=3 4470 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [1,1,0,0,0,0|1,0,0]=3 4471 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [1,1,0,0,0,0|1,0,0]=3 4472 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [1,1,0,0,0,0|1,0,0]=3 4473 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [1,1,0,0,0,0|1,0,0]=3 4474 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [1,1,0,0,0,0|2,0,0]=4 4475 B11R1.166 C=C(C)c1cnc(cc1O)C 271570a_100000694244_100011016184 [1,1,0,0,0,0|2,0,0]=4 4476 B11R1.166 C=C(C)c1ncc(cc1O)Br 271570a_100000694244_100010210634 [1,1,0,0,0,0|2,0,0]=4 4477 B11R1.166 C=C(C)c1ncc(cc1O)C 271570a_100000694244_100012000487 [1,1,0,0,0,0|2,0,0]=4 4478 B11R1.166 C=C(C)c1ncc(cc1O)Cl 271570a_100000694244_100010233512 [1,1,0,0,0,0|2,0,0]=4 4479 B11R1.166 C=C(C)c1ncc(cc1O)F 271570a_100000694244_100000079967 [1,1,0,0,0,0|2,0,0]=4 4480 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [1,1,0,0,0,0|1,0,0]=3 4481 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [1,1,0,0,0,0|1,0,0]=3 4482 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [1,1,0,0,0,0|1,0,0]=3 4483 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [1,1,0,0,0,0|1,0,0]=3 4484 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [1,1,0,0,0,0|1,0,0]=3 4485 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [1,1,0,0,0,0|1,0,0]=3 4486 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [1,1,0,0,0,0|1,0,0]=3 4487 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [1,1,0,0,0,0|1,0,0]=3 4488 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [1,1,0,0,0,0|1,0,0]=3 4489 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [1,1,0,0,0,0|1,0,0]=3 4490 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [1,1,0,0,0,0|1,0,0]=3 4491 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [1,1,0,0,0,0|1,0,0]=3 4492 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [1,1,0,0,0,0|1,0,0]=3 4493 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [1,1,0,0,0,0|1,0,0]=3 4494 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [1,1,0,0,0,0|1,0,0]=3 4495 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [1,1,0,0,0,0|1,0,0]=3 4496 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [1,1,0,0,0,0|1,0,0]=3 4497 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [1,1,0,0,0,0|1,0,0]=3 4498 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [1,1,0,0,0,0|1,0,0]=3 4499 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [1,1,0,0,0,0|1,0,0]=3 4500 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [1,1,0,0,0,0|1,0,0]=3 4501 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [1,1,0,0,0,0|1,0,0]=3 4502 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [1,1,0,0,0,0|1,0,0]=3 4503 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [1,1,0,0,0,0|1,0,0]=3 4504 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [1,1,0,0,0,0|1,0,0]=3 4505 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [1,1,0,0,0,0|1,0,0]=3 4506 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [1,1,0,0,0,0|1,0,0]=3 4507 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [1,1,0,0,0,0|1,0,0]=3 4508 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [1,1,0,0,0,0|1,0,0]=3 4509 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [1,1,0,0,0,0|1,0,0]=3 4510 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [1,1,0,0,0,0|1,0,0]=3 4511 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [1,1,0,0,0,0|0,0,0]=2 4512 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [1,1,0,0,0,0|0,0,0]=2 4513 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [1,1,0,0,0,0|0,0,0]=2 4514 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [1,1,0,0,0,0|0,0,0]=2 4515 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [1,1,0,0,0,0|0,0,0]=2 4516 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [1,1,0,0,0,0|0,0,0]=2 4517 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [1,1,0,0,0,0|0,0,0]=2 4518 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [1,1,0,0,0,0|0,0,0]=2 4519 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [1,1,0,0,0,0|0,0,0]=2 4520 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [1,1,0,0,0,0|0,0,0]=2 4521 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [1,1,0,0,0,0|2,0,0]=4 4522 B11R1.166 CN(C)c1ccc(cc1O)F 271570a_203496583355_100012349029 [1,1,0,0,0,0|2,0,0]=4 4523 B11R1.166 CN(C)c1ccc(cc1O)N 271570a_203496583355_100011534197 [1,1,0,0,0,0|2,0,0]=4 4524 B11R1.166 C[C@@H](N)c1ccc(cc1O)F 271570a_203496583355_100025704064 [1,1,0,0,0,0|1,0,1]=4 4525 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [1,1,0,0,0,0|2,0,0]=4 4526 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [1,1,0,0,0,0|1,0,0]=3 4527 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [1,1,0,0,0,0|1,0,0]=3 4528 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [1,1,0,0,0,0|1,0,0]=3 4529 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [1,1,0,0,0,0|1,0,0]=3 4530 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [1,1,0,0,0,0|1,0,0]=3 4531 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [1,1,0,0,0,0|1,0,0]=3 4532 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [1,1,0,0,0,0|1,0,0]=3 4533 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [1,1,0,0,0,0|1,0,0]=3 4534 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [1,1,0,0,0,0|1,0,0]=3 4535 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [1,1,0,0,0,0|1,0,0]=3 4536 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [1,1,0,0,0,0|0,0,0]=2 4537 B11R1.166 Cc1ccc(c(c1)O)N(C)C 271570a_203496583355_100012353700 [1,1,0,0,0,0|2,0,0]=4 4538 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 271570a_203496583355_100000041523 [1,1,0,0,0,0|2,0,0]=4 4539 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [1,1,0,0,0,0|2,0,0]=4 4540 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [1,1,0,0,0,0|2,0,0]=4 4541 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [1,1,0,0,0,0|2,0,0]=4 4542 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [1,1,0,0,0,0|1,0,0]=3 4543 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [1,1,0,0,0,0|1,0,0]=3 4544 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [1,1,0,0,0,0|1,0,0]=3 4545 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [1,1,0,0,0,0|1,0,0]=3 4546 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [1,1,0,0,0,0|1,0,0]=3 4547 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [1,1,0,0,0,0|1,0,0]=3 4548 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [1,1,0,0,0,0|1,0,0]=3 4549 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [1,1,0,0,0,0|1,0,0]=3 4550 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [1,1,0,0,0,0|1,0,0]=3 4551 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [1,1,0,0,0,0|1,0,0]=3 4552 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [1,1,0,0,0,0|1,0,0]=3 4553 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [1,1,0,0,0,0|1,0,0]=3 4554 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [1,1,0,0,0,0|1,0,0]=3 4555 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [1,1,0,0,0,0|1,0,0]=3 4556 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [1,1,0,0,0,0|1,0,0]=3 4557 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [1,1,0,0,0,0|1,0,0]=3 4558 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [1,1,0,0,0,0|1,0,0]=3 4559 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [1,1,0,0,0,0|1,0,0]=3 4560 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [1,1,0,0,0,0|1,0,0]=3 4561 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [1,1,0,0,0,0|1,0,0]=3 4562 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [1,1,0,0,0,0|1,0,0]=3 4563 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [1,1,0,0,0,0|0,0,0]=2 4564 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [1,1,0,0,0,0|0,0,0]=2 4565 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [1,1,0,0,0,0|0,0,0]=2 4566 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [1,1,0,0,0,0|0,0,0]=2 4567 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [1,1,0,0,0,0|0,0,0]=2 4568 B11R1.222 CC(C#N)c1ccccc1O 271570a_203496583355_200010232107 [1,1,0,0,0,0|1,0,1]=4 4569 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [1,1,0,0,0,0|1,0,0]=3 4570 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [1,1,0,0,0,0|1,0,0]=3 4571 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [1,1,0,0,0,0|1,0,0]=3 4572 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [1,1,0,0,0,0|1,0,0]=3 4573 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [1,1,0,0,0,0|1,0,0]=3 4574 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [1,1,0,0,0,0|0,0,0]=2 4575 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [1,1,0,0,0,0|0,0,1]=3 4576 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [1,1,0,0,0,0|2,0,0]=4 4577 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [1,1,0,0,0,0|2,0,0]=4 4578 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [1,1,0,0,0,0|2,0,0]=4 4579 B11R1.222 CN(CF)c1ccccc1O 269982a_100000033821_100015361967 [1,1,0,0,0,0|2,0,0]=4 4580 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [1,1,0,0,0,0|1,0,0]=3 4581 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 4582 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 4583 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [1,1,0,0,0,0|1,0,0]=3 4584 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [1,1,0,0,0,0|1,0,0]=3 4585 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 4586 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 4587 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [1,1,0,0,0,0|1,0,0]=3 4588 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [1,1,0,0,0,0|1,0,0]=3 4589 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 4590 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 4591 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [1,1,0,0,0,0|1,0,0]=3 4592 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [1,1,0,0,0,0|1,0,0]=3 4593 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 4594 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 4595 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [1,1,0,0,0,0|1,0,0]=3 4596 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [1,1,0,0,0,0|1,0,0]=3 4597 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 4598 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 4599 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [1,1,0,0,0,0|1,0,0]=3 4600 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [1,1,0,0,0,0|0,0,0]=2 4601 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [1,1,0,0,0,0|0,0,0]=2 4602 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [1,1,0,0,0,0|0,0,1]=3 4603 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [1,1,0,0,0,0|0,0,1]=3 4604 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [1,1,0,0,0,0|0,0,1]=3 4605 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [1,1,0,0,0,0|1,0,0]=3 4606 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [1,1,0,0,0,0|1,0,1]=4 4607 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [1,1,0,0,0,0|1,0,1]=4 4608 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [1,1,0,0,0,0|0,0,0]=2 4609 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [1,1,0,0,0,0|1,0,0]=3 4610 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [1,1,0,0,0,0|1,0,0]=3 4611 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [1,1,0,0,0,0|1,0,0]=3 4612 B11R1.222 COC(=O)c1cncnc1O 271570a_203496583355_100000726419 [1,1,0,0,0,0|2,0,0]=4 4613 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [1,1,0,0,0,0|1,0,0]=3 4614 B11R1.222 COC(=O)c1nccnc1O 271570a_203496583355_100000688410 [1,1,0,0,0,0|2,0,0]=4 4615 B11R1.222 COC(=O)c1ncncc1O 271570a_203496583355_100012360100 [1,1,0,0,0,0|2,0,0]=4 4616 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [1,1,0,0,0,0|1,0,1]=4 4617 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [1,1,0,0,0,0|1,0,0]=3 4618 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [1,1,0,0,0,0|0,0,2]=4 4619 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [1,1,0,0,0,0|1,0,0]=3 4620 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [1,1,0,0,0,0|1,0,1]=4 4621 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [1,1,0,0,0,0|1,0,0]=3 4622 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [1,1,0,0,0,0|1,0,0]=3 4623 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [1,1,0,0,0,0|1,0,0]=3 4624 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [1,1,0,0,0,0|1,0,0]=3 4625 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [1,1,0,0,0,0|0,0,0]=2 4626 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [1,1,0,0,0,0|0,0,1]=3 4627 B11R1.21 C=C(C)c1cc(c(cn1)Br)C 271570a_100000694244_100012356354 [1,1,0,0,0,0|2,0,0]=4 4628 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [1,1,0,0,0,0|2,0,0]=4 4629 B11R1.21 C=C(C)c1cc(c(cn1)F)C 271570a_100000694244_100009818257 [1,1,0,0,0,0|2,0,0]=4 4630 B11R1.21 C=C(C)c1cc(c(cn1)N)C 271570a_100000694244_100000765520 [1,1,0,0,0,0|2,0,0]=4 4631 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [1,1,0,0,0,0|2,0,0]=4 4632 B11R1.21 C=C(C)c1ccc(=O)n(c1)C 271570a_100000694244_100011245003 [1,1,0,0,0,0|2,0,0]=4 4633 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [1,1,0,0,0,0|2,0,0]=4 4634 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [1,1,0,0,0,0|2,0,0]=4 4635 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [1,1,0,0,0,0|2,0,0]=4 4636 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [1,1,0,0,0,0|2,0,0]=4 4637 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [1,1,0,0,0,0|2,0,0]=4 4638 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [1,1,0,0,0,0|2,0,0]=4 4639 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [1,1,0,0,0,0|1,0,0]=3 4640 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [1,1,0,0,0,0|1,0,0]=3 4641 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [1,1,0,0,0,0|1,0,0]=3 4642 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [1,1,0,0,0,0|1,0,0]=3 4643 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [1,1,0,0,0,0|1,0,0]=3 4644 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [1,1,0,0,0,0|1,0,0]=3 4645 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [1,1,0,0,0,0|2,0,0]=4 4646 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [1,1,0,0,0,0|2,0,0]=4 4647 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [1,1,0,0,0,0|2,0,0]=4 4648 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [1,1,0,0,0,0|2,0,0]=4 4649 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [1,1,0,0,0,0|2,0,0]=4 4650 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [1,1,0,0,0,0|2,0,0]=4 4651 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [1,1,0,0,0,0|2,0,0]=4 4652 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [1,1,0,0,0,0|2,0,0]=4 4653 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [1,1,0,0,0,0|2,0,0]=4 4654 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [1,1,0,0,0,0|2,0,0]=4 4655 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [1,1,0,0,0,0|2,0,0]=4 4656 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [1,1,0,0,0,0|2,0,0]=4 4657 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [1,1,0,0,0,0|2,0,0]=4 4658 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [1,1,0,0,0,0|2,0,0]=4 4659 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [1,1,0,0,0,0|2,0,0]=4 4660 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [1,1,0,0,0,0|2,0,0]=4 4661 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [1,1,0,0,0,0|2,0,0]=4 4662 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [1,1,0,0,0,0|2,0,0]=4 4663 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [1,1,0,0,0,0|2,0,0]=4 4664 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [1,1,0,0,0,0|2,0,0]=4 4665 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [1,1,0,0,0,0|2,0,0]=4 4666 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [1,1,0,0,0,0|2,0,0]=4 4667 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [1,1,0,0,0,0|2,0,0]=4 4668 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,1,0,0,0,0|2,0,0]=4 4669 B11R1.21 C=C(C)c1ccc(c(n1)C)Br 271570a_100000694244_100012360386 [1,1,0,0,0,0|2,0,0]=4 4670 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [1,1,0,0,0,0|2,0,0]=4 4671 B11R1.21 C=C(C)c1ccc(c(n1)C)F 271570a_100000694244_100009814307 [1,1,0,0,0,0|2,0,0]=4 4672 B11R1.21 C=C(C)c1ccc(c(n1)C)N 271570a_100000694244_100000760127 [1,1,0,0,0,0|2,0,0]=4 4673 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [1,1,0,0,0,0|2,0,0]=4 4674 B11R1.21 C=C(C)c1cnc(c(c1)C)Br 271570a_100000694244_100009816107 [1,1,0,0,0,0|2,0,0]=4 4675 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [1,1,0,0,0,0|2,0,0]=4 4676 B11R1.21 C=C(C)c1cnc(c(c1)C)Cl 271570a_100000694244_100009922867 [1,1,0,0,0,0|2,0,0]=4 4677 B11R1.21 C=C(C)c1cnc(c(c1)C)F 271570a_100000694244_100000709442 [1,1,0,0,0,0|2,0,0]=4 4678 B11R1.21 C=C(C)c1cnc(c(c1)C)N 271570a_100000694244_100000186686 [1,1,0,0,0,0|2,0,0]=4 4679 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [1,1,0,0,0,0|2,0,0]=4 4680 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [1,1,0,0,0,0|1,0,0]=3 4681 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [1,1,0,0,0,0|1,0,0]=3 4682 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [1,1,0,0,0,0|1,0,0]=3 4683 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [1,1,0,0,0,0|1,0,0]=3 4684 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [1,1,0,0,0,0|1,0,0]=3 4685 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [1,1,0,0,0,0|1,0,0]=3 4686 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [1,1,0,0,0,0|1,0,0]=3 4687 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [1,1,0,0,0,0|1,0,0]=3 4688 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [1,1,0,0,0,0|0,0,0]=2 4689 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [1,1,0,0,0,0|0,0,0]=2 4690 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [1,1,0,0,0,0|0,0,0]=2 4691 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [1,1,0,0,0,0|0,0,0]=2 4692 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [1,1,0,0,0,0|0,0,0]=2 4693 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,1,0,0,0,0|0,0,0]=2 4694 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,1,0,0,0,0|0,0,0]=2 4695 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [1,1,0,0,0,0|1,0,0]=3 4696 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [1,1,0,0,0,0|1,0,0]=3 4697 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [1,1,0,0,0,0|1,0,0]=3 4698 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [1,1,0,0,0,0|1,0,0]=3 4699 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [1,1,0,0,0,0|1,0,0]=3 4700 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [1,1,0,0,0,0|1,0,0]=3 4701 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [1,1,0,0,0,0|1,0,0]=3 4702 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [1,1,0,0,0,0|1,0,0]=3 4703 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [1,1,0,0,0,0|1,0,0]=3 4704 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [1,1,0,0,0,0|1,0,0]=3 4705 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [1,1,0,0,0,0|1,0,0]=3 4706 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [1,1,0,0,0,0|1,0,0]=3 4707 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [1,1,0,0,0,0|1,0,0]=3 4708 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [1,1,0,0,0,0|1,0,0]=3 4709 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [1,1,0,0,0,0|1,0,0]=3 4710 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [1,1,0,0,0,0|1,0,0]=3 4711 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [1,1,0,0,0,0|1,0,0]=3 4712 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [1,1,0,0,0,0|1,0,0]=3 4713 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [1,1,0,0,0,0|1,0,0]=3 4714 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [1,1,0,0,0,0|1,0,0]=3 4715 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [1,1,0,0,0,0|1,0,0]=3 4716 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [1,1,0,0,0,0|1,0,0]=3 4717 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [1,1,0,0,0,0|1,0,0]=3 4718 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [1,1,0,0,0,0|1,0,0]=3 4719 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [1,1,0,0,0,0|1,0,0]=3 4720 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [1,1,0,0,0,0|1,0,0]=3 4721 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [1,1,0,0,0,0|1,0,0]=3 4722 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [1,1,0,0,0,0|1,0,0]=3 4723 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [1,1,0,0,0,0|1,0,0]=3 4724 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,1,0,0,0,0|1,0,0]=3 4725 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,1,0,0,0,0|1,0,0]=3 4726 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [1,1,0,0,0,0|1,0,0]=3 4727 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [1,1,0,0,0,0|2,0,0]=4 4728 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [1,1,0,0,0,0|0,0,0]=2 4729 B11R1.21 Cc1cc(ccc1Br)N(C)C 2230a_100102888905_200000210301 [1,1,0,0,0,0|2,0,0]=4 4730 B11R1.21 Cc1cc(ccc1Br)N(C)C 269982a_100102888905_200000210301 [1,1,0,0,0,0|2,0,0]=4 4731 B11R1.21 Cc1cc(ccc1Br)N(C)C 34a_100102888905_200000210301 [1,1,0,0,0,0|2,0,0]=4 4732 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 2230a_100102888905_200025704644 [1,1,0,0,0,0|2,0,0]=4 4733 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 269982a_100102888905_200025704644 [1,1,0,0,0,0|2,0,0]=4 4734 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 34a_100102888905_200025704644 [1,1,0,0,0,0|2,0,0]=4 4735 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [1,1,0,0,0,0|0,0,0]=2 4736 B11R1.21 Cc1cc(ccc1Cl)N(C)C 2230a_114849113799_200000210301 [1,1,0,0,0,0|2,0,0]=4 4737 B11R1.21 Cc1cc(ccc1Cl)N(C)C 269982a_114849113799_200000210301 [1,1,0,0,0,0|2,0,0]=4 4738 B11R1.21 Cc1cc(ccc1Cl)N(C)C 34a_114849113799_200000210301 [1,1,0,0,0,0|2,0,0]=4 4739 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 2230a_114849113799_200025704644 [1,1,0,0,0,0|2,0,0]=4 4740 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 269982a_114849113799_200025704644 [1,1,0,0,0,0|2,0,0]=4 4741 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 34a_114849113799_200025704644 [1,1,0,0,0,0|2,0,0]=4 4742 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [1,1,0,0,0,0|0,0,0]=2 4743 B11R1.21 Cc1cc(ccc1F)N(C)C 2230a_100011756966_200000210301 [1,1,0,0,0,0|2,0,0]=4 4744 B11R1.21 Cc1cc(ccc1F)N(C)C 269982a_100011756966_200000210301 [1,1,0,0,0,0|2,0,0]=4 4745 B11R1.21 Cc1cc(ccc1F)N(C)C 34a_100011756966_200000210301 [1,1,0,0,0,0|2,0,0]=4 4746 B11R1.21 Cc1cc(ccc1F)N(C)C 38a_100011756966_200000210301 [1,1,0,0,0,0|2,0,0]=4 4747 B11R1.21 Cc1cc(ccc1F)N(C)C 7a_100011756966_200000210301 [1,1,0,0,0,0|2,0,0]=4 4748 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 2230a_100011756966_200025704644 [1,1,0,0,0,0|2,0,0]=4 4749 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 269982a_100011756966_200025704644 [1,1,0,0,0,0|2,0,0]=4 4750 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 34a_100011756966_200025704644 [1,1,0,0,0,0|2,0,0]=4 4751 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 38a_100011756966_200025704644 [1,1,0,0,0,0|2,0,0]=4 4752 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 7a_100011756966_200025704644 [1,1,0,0,0,0|2,0,0]=4 4753 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [1,1,0,0,0,0|0,0,0]=2 4754 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,1,0,0,0,0|1,0,0]=3 4755 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,1,0,0,0,0|0,0,0]=2 4756 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [1,1,0,0,0,0|2,0,0]=4 4757 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [1,1,0,0,0,0|1,0,0]=3 4758 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [1,1,0,0,0,0|0,0,0]=2 4759 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [1,1,0,0,0,0|1,0,0]=3 4760 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [1,1,0,0,0,0|1,0,0]=3 4761 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [1,1,0,0,0,0|1,0,0]=3 4762 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [1,1,0,0,0,0|2,0,0]=4 4763 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [1,1,0,0,0,0|1,0,0]=3 4764 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [1,1,0,0,0,0|2,0,0]=4 4765 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [1,1,0,0,0,0|2,0,0]=4 4766 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [1,1,0,0,0,0|2,0,0]=4 4767 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,1,0,0,0,0|2,0,0]=4 4768 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [1,1,0,0,0,0|1,0,0]=3 4769 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [1,1,0,0,0,0|1,0,0]=3 4770 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [1,1,0,0,0,0|1,0,0]=3 4771 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [1,1,0,0,0,0|1,0,0]=3 4772 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [1,1,0,0,0,0|1,0,0]=3 4773 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [1,1,0,0,0,0|1,0,0]=3 4774 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [1,1,0,0,0,0|1,0,0]=3 4775 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [1,1,0,0,0,0|1,0,0]=3 4776 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [1,1,0,0,0,0|1,0,0]=3 4777 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [1,1,0,0,0,0|1,0,0]=3 4778 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [1,1,0,0,0,0|1,0,0]=3 4779 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [1,1,0,0,0,0|1,0,0]=3 4780 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [1,1,0,0,0,0|1,0,0]=3 4781 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [1,1,0,0,0,0|1,0,0]=3 4782 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [1,1,0,0,0,0|1,0,0]=3 4783 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [1,1,0,0,0,0|1,0,0]=3 4784 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [1,1,0,0,0,0|1,0,0]=3 4785 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [1,1,0,0,0,0|1,0,0]=3 4786 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [1,1,0,0,0,0|1,0,0]=3 4787 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [1,1,0,0,0,0|1,0,0]=3 4788 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [1,1,0,0,0,0|1,0,0]=3 4789 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [1,1,0,0,0,0|1,0,0]=3 4790 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [1,1,0,0,0,0|1,0,0]=3 4791 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [1,1,0,0,0,0|1,0,0]=3 4792 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,1,0,0,0,0|1,0,0]=3 4793 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [1,1,0,0,0,0|2,0,0]=4 4794 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [1,1,0,0,0,0|1,0,0]=3 4795 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [1,1,0,0,0,0|0,0,0]=2 4796 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [1,1,0,0,0,0|1,0,0]=3 4797 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [1,1,0,0,0,0|1,0,0]=3 4798 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [1,1,0,0,0,0|1,0,0]=3 4799 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [1,1,0,0,0,0|1,0,0]=3 4800 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [1,1,0,0,0,0|1,0,0]=3 4801 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [1,1,0,0,0,0|2,0,0]=4 4802 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000182157_200000210301 [1,1,0,0,0,0|2,0,0]=4 4803 B11R1.23 CCN(C)c1cccc(c1)C 2230a_100000219674_100000210202 [1,1,0,0,0,0|2,0,0]=4 4804 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000182157_200000210301 [1,1,0,0,0,0|2,0,0]=4 4805 B11R1.23 CCN(C)c1cccc(c1)C 269982a_100000219674_100000204670 [1,1,0,0,0,0|2,0,0]=4 4806 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000182157_200000210301 [1,1,0,0,0,0|2,0,0]=4 4807 B11R1.23 CCN(C)c1cccc(c1)C 34a_100000219674_100000210202 [1,1,0,0,0,0|2,0,0]=4 4808 B11R1.23 CCN(C)c1cccc(c1)C 7a_100000182157_200000210301 [1,1,0,0,0,0|2,0,0]=4 4809 B11R1.23 CCN([13CH3])c1cccc(c1)C 2230a_100000182157_200025704644 [1,1,0,0,0,0|2,0,0]=4 4810 B11R1.23 CCN([13CH3])c1cccc(c1)C 269982a_100000182157_200025704644 [1,1,0,0,0,0|2,0,0]=4 4811 B11R1.23 CCN([13CH3])c1cccc(c1)C 34a_100000182157_200025704644 [1,1,0,0,0,0|2,0,0]=4 4812 B11R1.23 CCN([13CH3])c1cccc(c1)C 7a_100000182157_200025704644 [1,1,0,0,0,0|2,0,0]=4 4813 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [1,1,0,0,0,0|2,0,0]=4 4814 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [1,1,0,0,0,0|1,0,0]=3 4815 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 4816 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 4817 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [1,1,0,0,0,0|1,0,0]=3 4818 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [1,1,0,0,0,0|0,0,0]=2 4819 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [1,1,0,0,0,0|0,0,0]=2 4820 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [1,1,0,0,0,0|0,0,0]=2 4821 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [1,1,0,0,0,0|0,0,0]=2 4822 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [1,1,0,0,0,0|1,0,0]=3 4823 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 4824 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 4825 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [1,1,0,0,0,0|1,0,0]=3 4826 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [1,1,0,0,0,0|1,0,0]=3 4827 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 4828 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 4829 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [1,1,0,0,0,0|1,0,0]=3 4830 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [1,1,0,0,0,0|1,0,0]=3 4831 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 4832 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 4833 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [1,1,0,0,0,0|1,0,0]=3 4834 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 4835 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [1,1,0,0,0,0|1,0,0]=3 4836 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [1,1,0,0,0,0|1,0,0]=3 4837 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [1,1,0,0,0,0|2,0,0]=4 4838 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [1,1,0,0,0,0|2,0,0]=4 4839 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [1,1,0,0,0,0|2,0,0]=4 4840 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [1,1,0,0,0,0|1,0,1]=4 4841 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [1,1,0,0,0,0|1,0,1]=4 4842 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [1,1,0,0,0,0|1,0,1]=4 4843 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [1,1,0,0,0,0|2,0,0]=4 4844 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [1,1,0,0,0,0|1,0,0]=3 4845 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [1,1,0,0,0,0|2,0,0]=4 4846 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [1,1,0,0,0,0|2,0,0]=4 4847 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [1,1,0,0,0,0|2,0,0]=4 4848 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [1,1,0,0,0,0|0,0,2]=4 4849 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [1,1,0,0,0,0|0,0,2]=4 4850 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [1,1,0,0,0,0|0,0,0]=2 4851 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [1,1,0,0,0,0|0,0,2]=4 4852 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [1,1,0,0,0,0|0,0,2]=4 4853 B11R1.23 Cc1cccc(c1)N(C)CF 269982a_100000219674_100015361967 [1,1,0,0,0,0|2,0,0]=4 4854 B11R1.23 Cc1cccc(c1)N(C)CF 34a_100000219674_100015361967 [1,1,0,0,0,0|2,0,0]=4 4855 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [1,1,0,0,0,0|1,0,1]=4 4856 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [1,1,0,0,0,0|1,0,1]=4 4857 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [1,1,0,0,0,0|1,0,1]=4 4858 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [1,1,0,0,0,0|1,0,0]=3 4859 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [1,1,0,0,0,0|2,0,0]=4 4860 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [1,1,0,0,0,0|1,0,0]=3 4861 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [1,1,0,0,0,0|1,0,0]=3 4862 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [1,1,0,0,0,0|1,0,0]=3 4863 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [1,1,0,0,0,0|1,0,0]=3 4864 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [1,1,0,0,0,0|1,0,0]=3 4865 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [1,1,0,0,0,0|1,0,1]=4 4866 B11R1.74 C=C(C)c1cc([nH]c(=O)c1)C 271570a_100000694244_100009861981 [1,1,0,0,0,0|2,0,0]=4 4867 B11R1.74 C=C(C)c1cc(cc(c1)Br)Br 271570a_100000694244_100009814770 [1,1,0,0,0,0|2,0,0]=4 4868 B11R1.74 C=C(C)c1cc(cc(c1)Br)Cl 271570a_100000694244_100009814755 [1,1,0,0,0,0|2,0,0]=4 4869 B11R1.74 C=C(C)c1cc(cc(c1)Br)F 271570a_100000694244_100009814764 [1,1,0,0,0,0|2,0,0]=4 4870 B11R1.74 C=C(C)c1cc(cc(c1)Br)N 271570a_100000694244_100009814763 [1,1,0,0,0,0|2,0,0]=4 4871 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [1,1,0,0,0,0|2,0,0]=4 4872 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [1,1,0,0,0,0|1,0,0]=3 4873 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [1,1,0,0,0,0|1,0,0]=3 4874 B11R1.74 C=C(C)c1cc(cc(c1)Cl)Cl 271570a_100000694244_100000747138 [1,1,0,0,0,0|2,0,0]=4 4875 B11R1.74 C=C(C)c1cc(cc(c1)Cl)F 271570a_100000694244_100013859453 [1,1,0,0,0,0|2,0,0]=4 4876 B11R1.74 C=C(C)c1cc(cc(c1)Cl)N 271570a_100000694244_100010147676 [1,1,0,0,0,0|2,0,0]=4 4877 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [1,1,0,0,0,0|2,0,0]=4 4878 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [1,1,0,0,0,0|1,0,0]=3 4879 B11R1.74 C=C(C)c1cc(cc(c1)F)F 271570a_100000694244_100011218498 [1,1,0,0,0,0|2,0,0]=4 4880 B11R1.74 C=C(C)c1cc(cc(c1)F)N 271570a_100000694244_100011356972 [1,1,0,0,0,0|2,0,0]=4 4881 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [1,1,0,0,0,0|2,0,0]=4 4882 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [1,1,0,0,0,0|1,0,0]=3 4883 B11R1.74 C=C(C)c1cc(cc(c1)N)N 271570a_100000694244_100011999608 [1,1,0,0,0,0|2,0,0]=4 4884 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [1,1,0,0,0,0|1,0,0]=3 4885 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [1,1,0,0,0,0|2,0,0]=4 4886 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [1,1,0,0,0,0|2,0,0]=4 4887 B11R1.74 C=C(C)c1cc(cc(n1)F)C 271570a_100000694244_100009819601 [1,1,0,0,0,0|2,0,0]=4 4888 B11R1.74 C=C(C)c1cc(cc(n1)N)C 271570a_100000694244_100009819863 [1,1,0,0,0,0|2,0,0]=4 4889 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [1,1,0,0,0,0|2,0,0]=4 4890 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [1,1,0,0,0,0|2,0,0]=4 4891 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [1,1,0,0,0,0|2,0,0]=4 4892 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [1,1,0,0,0,0|1,0,0]=3 4893 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [1,1,0,0,0,0|0,0,0]=2 4894 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [1,1,0,0,0,0|1,0,0]=3 4895 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [1,1,0,0,0,0|1,0,0]=3 4896 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [1,1,0,0,0,0|1,0,0]=3 4897 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [1,1,0,0,0,0|1,0,0]=3 4898 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [1,1,0,0,0,0|0,0,0]=2 4899 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [1,1,0,0,0,0|0,0,0]=2 4900 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [1,1,0,0,0,0|1,0,0]=3 4901 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [1,1,0,0,0,0|1,0,0]=3 4902 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [1,1,0,0,0,0|1,0,0]=3 4903 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [1,1,0,0,0,0|0,0,0]=2 4904 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [1,1,0,0,0,0|1,0,0]=3 4905 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [1,1,0,0,0,0|1,0,0]=3 4906 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [1,1,0,0,0,0|1,0,0]=3 4907 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [1,1,0,0,0,0|1,0,0]=3 4908 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [1,1,0,0,0,0|0,0,0]=2 4909 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [1,1,0,0,0,0|1,0,0]=3 4910 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [1,1,0,0,0,0|1,0,0]=3 4911 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [1,1,0,0,0,0|1,0,0]=3 4912 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [1,1,0,0,0,0|0,0,0]=2 4913 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [1,1,0,0,0,0|0,0,0]=2 4914 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [1,1,0,0,0,0|1,0,0]=3 4915 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,1,0,0,0,0|1,0,0]=3 4916 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [1,1,0,0,0,0|0,0,0]=2 4917 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [1,1,0,0,0,0|0,0,0]=2 4918 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [1,1,0,0,0,0|0,0,0]=2 4919 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [1,1,0,0,0,0|0,0,0]=2 4920 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [1,1,0,0,0,0|0,0,0]=2 4921 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [1,1,0,0,0,0|0,0,0]=2 4922 B11R1.74 Cc1cc(cc(c1)N(C)C)F 2230a_103496528823_200000210301 [1,1,0,0,0,0|2,0,0]=4 4923 B11R1.74 Cc1cc(cc(c1)N(C)C)F 269982a_103496528823_200000210301 [1,1,0,0,0,0|2,0,0]=4 4924 B11R1.74 Cc1cc(cc(c1)N(C)C)F 34a_103496528823_200000210301 [1,1,0,0,0,0|2,0,0]=4 4925 B11R1.74 Cc1cc(cc(c1)N(C)C)F 38a_103496528823_200000210301 [1,1,0,0,0,0|2,0,0]=4 4926 B11R1.74 Cc1cc(cc(c1)N(C)C)F 7a_103496528823_200000210301 [1,1,0,0,0,0|2,0,0]=4 4927 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 2230a_103496528823_200025704644 [1,1,0,0,0,0|2,0,0]=4 4928 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 269982a_103496528823_200025704644 [1,1,0,0,0,0|2,0,0]=4 4929 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 34a_103496528823_200025704644 [1,1,0,0,0,0|2,0,0]=4 4930 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 38a_103496528823_200025704644 [1,1,0,0,0,0|2,0,0]=4 4931 B11R1.74 Cc1cc(cc(c1)N(C)[13CH3])F 7a_103496528823_200025704644 [1,1,0,0,0,0|2,0,0]=4 4932 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [1,1,0,0,0,0|2,0,0]=4 4933 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [1,1,0,0,0,0|2,0,0]=4 4934 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [1,1,0,0,0,0|1,0,0]=3 4935 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [1,1,0,0,0,0|1,0,0]=3 4936 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [1,1,0,0,0,0|1,0,0]=3 4937 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [1,1,0,0,0,0|1,0,0]=3 4938 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [1,1,0,0,0,0|1,0,0]=3 4939 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [1,1,0,0,0,0|1,0,0]=3 4940 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [1,1,0,0,0,0|1,0,0]=3 4941 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [1,1,0,0,0,0|1,0,0]=3 4942 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [1,1,0,0,0,0|1,0,0]=3 4943 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [1,1,0,0,0,0|1,0,0]=3 4944 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [1,1,0,0,0,0|1,0,0]=3 4945 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [1,1,0,0,0,0|1,0,0]=3 4946 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [1,1,0,0,0,0|1,0,0]=3 4947 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [1,1,0,0,0,0|2,0,0]=4 4948 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [1,1,0,0,0,0|0,0,1]=3 4949 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [1,1,0,0,0,0|0,0,1]=3 4950 B11R1.266 C=C(C)c1cc(ccn1)CC 271570a_100000694244_100009817561 [1,1,0,0,0,0|2,0,0]=4 4951 B11R1.266 C=C(C)c1cc(ccn1)CO 271570a_100000694244_100009814636 [1,1,0,0,0,0|2,0,0]=4 4952 B11R1.266 C=C(C)c1cc(ccn1)NC 271570a_100000694244_100009869472 [1,1,0,0,0,0|2,0,0]=4 4953 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [1,1,0,0,0,0|2,0,0]=4 4954 B11R1.266 C=C(C)c1cc(ccn1)SC 271570a_100000694244_100010883326 [1,1,0,0,0,0|2,0,0]=4 4955 B11R1.266 C=C(C)c1cccc(c1)C#N 271570a_100000694244_100000189340 [1,1,0,0,0,0|1,0,1]=4 4956 B11R1.266 C=C(C)c1cccc(c1)C=O 271570a_100000694244_100000014684 [1,1,0,0,0,0|1,0,1]=4 4957 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [1,1,0,0,0,0|1,0,0]=3 4958 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [1,1,0,0,0,0|1,0,0]=3 4959 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [1,1,0,0,0,0|1,0,0]=3 4960 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [1,1,0,0,0,0|1,0,0]=3 4961 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [1,1,0,0,0,0|1,0,0]=3 4962 B11R1.266 C=C(C)c1cccc(c1)NN 271570a_100000694244_100000217339 [1,1,0,0,0,0|2,0,0]=4 4963 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,1,0,0,0,0|1,0,0]=3 4964 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [1,1,0,0,0,0|1,0,0]=3 4965 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [1,1,0,0,0,0|1,0,0]=3 4966 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [1,1,0,0,0,0|1,0,0]=3 4967 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [1,1,0,0,0,0|1,0,0]=3 4968 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [1,1,0,0,0,0|1,0,0]=3 4969 B11R1.266 C=C(C)c1cccc(n1)CC 271570a_100000694244_100009856026 [1,1,0,0,0,0|2,0,0]=4 4970 B11R1.266 C=C(C)c1cccc(n1)CN 271570a_100000694244_100016990191 [1,1,0,0,0,0|2,0,0]=4 4971 B11R1.266 C=C(C)c1cccc(n1)CO 271570a_100000694244_100000694195 [1,1,0,0,0,0|2,0,0]=4 4972 B11R1.266 C=C(C)c1cccc(n1)NC 271570a_100000694244_100000703281 [1,1,0,0,0,0|2,0,0]=4 4973 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [1,1,0,0,0,0|2,0,0]=4 4974 B11R1.266 C=C(C)c1cccc(n1)SC 271570a_100000694244_100011960944 [1,1,0,0,0,0|2,0,0]=4 4975 B11R1.266 C=C(C)c1ccnc(c1)CC 271570a_100000694244_100009820011 [1,1,0,0,0,0|2,0,0]=4 4976 B11R1.266 C=C(C)c1ccnc(c1)CN 271570a_100000694244_100000085674 [1,1,0,0,0,0|2,0,0]=4 4977 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [1,1,0,0,0,0|2,0,0]=4 4978 B11R1.266 C=C(C)c1ccnc(c1)NC 271570a_100000694244_100009819592 [1,1,0,0,0,0|2,0,0]=4 4979 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [1,1,0,0,0,0|2,0,0]=4 4980 B11R1.266 C=C(C)c1cncc(c1)CC 271570a_100000694244_200009819073 [1,1,0,0,0,0|2,0,0]=4 4981 B11R1.266 C=C(C)c1cncc(c1)CN 271570a_100000694244_100011249555 [1,1,0,0,0,0|2,0,0]=4 4982 B11R1.266 C=C(C)c1cncc(c1)CO 271570a_100000694244_100011259137 [1,1,0,0,0,0|2,0,0]=4 4983 B11R1.266 C=C(C)c1cncc(c1)NC 271570a_100000694244_100012184536 [1,1,0,0,0,0|2,0,0]=4 4984 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [1,1,0,0,0,0|2,0,0]=4 4985 B11R1.266 C=C(C)c1cncc(c1)SC 271570a_100000694244_100009816972 [1,1,0,0,0,0|2,0,0]=4 4986 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200000210301_200009889500 [1,1,0,0,0,0|2,0,0]=4 4987 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200009889500_200000210301 [1,1,0,0,0,0|2,0,0]=4 4988 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200009889500_200025704644 [1,1,0,0,0,0|2,0,0]=4 4989 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200025704644_200009889500 [1,1,0,0,0,0|2,0,0]=4 4990 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [1,1,0,0,0,0|1,0,1]=4 4991 B11R1.266 C=Cc1cccc(c1)C(=C)C 271570a_100011290941_100012123953 [1,1,0,0,0,0|1,0,1]=4 4992 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [1,1,0,0,0,0|0,0,1]=3 4993 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [1,1,0,0,0,0|0,0,1]=3 4994 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [1,1,0,0,0,0|1,0,1]=4 4995 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [1,1,0,0,0,0|0,0,1]=3 4996 B11R1.266 C=Cc1cccc(c1)S(=O)C 271570a_100011290941_100009816267 [1,1,0,0,0,0|1,0,1]=4 4997 B11R1.266 C=Cc1cccc(n1)C(=O)C 271570a_100011290941_100009816502 [1,1,0,0,0,0|1,0,1]=4 4998 B11R1.266 C=Cc1ccnc(c1)C(=O)C 271570a_100011290941_100000709912 [1,1,0,0,0,0|1,0,1]=4 4999 B11R1.266 C=Cc1cncc(c1)C(=O)C 271570a_100011290941_100011216243 [1,1,0,0,0,0|1,0,1]=4 5000 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_100000709912_200025704644 [1,1,0,0,0,0|1,0,0]=3 5001 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000709912 [1,1,0,0,0,0|1,0,0]=3 5002 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [1,1,0,0,0,0|0,0,1]=3 5003 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [1,1,0,0,0,0|0,0,0]=2 5004 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,1,0,0,0,0|0,0,0]=2 5005 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,1,0,0,0,0|0,0,0]=2 5006 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [1,1,0,0,0,0|0,0,0]=2 5007 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [1,1,0,0,0,0|0,0,0]=2 5008 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_100009816502_200025704644 [1,1,0,0,0,0|1,0,0]=3 5009 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100009816502 [1,1,0,0,0,0|1,0,0]=3 5010 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [1,1,0,0,0,0|1,0,0]=3 5011 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [1,1,0,0,0,0|1,0,0]=3 5012 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_100010643186_200025704644 [1,1,0,0,0,0|2,0,0]=4 5013 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_200025704644_100010643186 [1,1,0,0,0,0|2,0,0]=4 5014 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_100011216243_200025704644 [1,1,0,0,0,0|1,0,0]=3 5015 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100011216243 [1,1,0,0,0,0|1,0,0]=3 5016 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 2230a_100000211879_200025704644 [1,1,0,0,0,0|1,0,1]=4 5017 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 34a_100000211879_200025704644 [1,1,0,0,0,0|1,0,1]=4 5018 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 7a_100000211879_200025704644 [1,1,0,0,0,0|1,0,1]=4 5019 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [1,1,0,0,0,0|1,0,1]=4 5020 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [1,1,0,0,0,0|1,0,1]=4 5021 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_100011214899_200025704644 [1,1,0,0,0,0|1,0,1]=4 5022 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011214899 [1,1,0,0,0,0|1,0,1]=4 5023 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [1,1,0,0,0,0|1,0,1]=4 5024 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [1,1,0,0,0,0|1,0,1]=4 5025 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [1,1,0,0,0,0|1,0,1]=4 5026 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [1,1,0,0,0,0|1,0,1]=4 5027 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 2230a_100011217120_200025704644 [1,1,0,0,0,0|0,0,2]=4 5028 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 34a_100011217120_200025704644 [1,1,0,0,0,0|0,0,2]=4 5029 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [1,1,0,0,0,0|0,0,2]=4 5030 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [1,1,0,0,0,0|0,0,2]=4 5031 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_100000246457_200025704644 [1,1,0,0,0,0|0,0,2]=4 5032 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_200025704644_100000246457 [1,1,0,0,0,0|0,0,2]=4 5033 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [1,1,0,0,0,0|0,0,0]=2 5034 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [1,1,0,0,0,0|0,0,0]=2 5035 B11R1.266 CN(C)c1cccc(c1)N[13CH3] 34a_100000209982_200025704644 [1,1,0,0,0,0|2,0,0]=4 5036 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [1,1,0,0,0,0|2,0,0]=4 5037 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_100011215952_200025704644 [1,1,0,0,0,0|2,0,0]=4 5038 B11R1.266 CN(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011215952 [1,1,0,0,0,0|2,0,0]=4 5039 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [1,1,0,0,0,0|1,0,0]=3 5040 B11R1.266 CNc1cccc(c1)C(C)C 2230a_100000211879_200000210301 [1,1,0,0,0,0|1,0,1]=4 5041 B11R1.266 CNc1cccc(c1)C(C)C 34a_100000211879_200000210301 [1,1,0,0,0,0|1,0,1]=4 5042 B11R1.266 CNc1cccc(c1)C(C)C 7a_100000211879_200000210301 [1,1,0,0,0,0|1,0,1]=4 5043 B11R1.266 CNc1cccc(c1)C(C)O 2230a_100011217120_200000210301 [1,1,0,0,0,0|0,0,2]=4 5044 B11R1.266 CNc1cccc(c1)C(C)O 34a_100011217120_200000210301 [1,1,0,0,0,0|0,0,2]=4 5045 B11R1.266 CNc1cccc(c1)N(C)C 34a_100000209982_200000210301 [1,1,0,0,0,0|2,0,0]=4 5046 B11R1.266 CNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200000210301 [1,1,0,0,0,0|2,0,0]=4 5047 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [1,1,0,0,0,0|1,0,0]=3 5048 B11R1.266 CNc1cccc(n1)C(=O)N 27a_100102657272_100011834053 [1,1,0,0,0,0|2,0,0]=4 5049 B11R1.266 CNc1ccnc(c1)C(=O)N 27a_100102657272_100000229564 [1,1,0,0,0,0|2,0,0]=4 5050 B11R1.266 CNc1nccc(n1)C(=O)C 27a_100102657272_100010643186 [1,1,0,0,0,0|2,0,0]=4 5051 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,1,0,0,0,0|0,0,0]=2 5052 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,1,0,0,0,0|0,0,0]=2 5053 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,1,0,0,0,0|0,0,0]=2 5054 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,1,0,0,0,0|1,0,0]=3 5055 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,1,0,0,0,0|1,0,0]=3 5056 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,1,0,0,0,0|0,0,0]=2 5057 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,1,0,0,0,0|1,1,0]=4 5058 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [1,1,0,0,0,0|1,0,1]=4 5059 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [1,1,0,0,0,0|1,0,1]=4 5060 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [1,1,0,0,0,0|1,0,1]=4 5061 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [1,1,0,0,0,0|1,0,1]=4 5062 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [1,1,0,0,0,0|0,0,2]=4 5063 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [1,1,0,0,0,0|0,0,2]=4 5064 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 5065 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 5066 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [1,1,0,0,0,0|2,0,0]=4 5067 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [1,1,0,0,0,0|2,0,0]=4 5068 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 5069 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 5070 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [1,1,0,0,0,0|2,0,0]=4 5071 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [1,1,0,0,0,0|2,0,0]=4 5072 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [1,1,0,0,0,0|2,0,0]=4 5073 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [1,1,0,0,0,0|2,0,0]=4 5074 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [1,1,0,0,0,0|1,0,0]=3 5075 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [1,1,0,0,0,0|1,0,0]=3 5076 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [1,1,0,0,0,0|1,0,0]=3 5077 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [1,1,0,0,0,0|1,0,0]=3 5078 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_100000229836_200000210301 [1,1,0,0,0,0|2,0,0]=4 5079 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_200000210301_100000229836 [1,1,0,0,0,0|2,0,0]=4 5080 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [1,1,0,0,0,0|0,0,0]=2 5081 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [1,1,0,0,0,0|0,0,0]=2 5082 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [1,1,0,0,0,0|0,0,0]=2 5083 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [1,1,0,0,0,0|1,0,0]=3 5084 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [1,1,0,0,0,0|1,0,0]=3 5085 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [1,1,0,0,0,0|0,0,0]=2 5086 B11R1.266 CSc1cccc(c1)C(C)C 62a_100011214899_200000210301 [1,1,0,0,0,0|1,0,1]=4 5087 B11R1.266 CSc1cccc(c1)C(C)C 62a_200000210301_100011214899 [1,1,0,0,0,0|1,0,1]=4 5088 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [1,1,0,0,0,0|1,0,1]=4 5089 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [1,1,0,0,0,0|1,0,1]=4 5090 B11R1.266 CSc1cccc(c1)C(C)O 62a_100000246457_200000210301 [1,1,0,0,0,0|0,0,2]=4 5091 B11R1.266 CSc1cccc(c1)C(C)O 62a_200000210301_100000246457 [1,1,0,0,0,0|0,0,2]=4 5092 B11R1.266 CSc1cccc(c1)N(C)C 2230a_100020672454_200000210301 [1,1,0,0,0,0|2,0,0]=4 5093 B11R1.266 CSc1cccc(c1)N(C)C 269982a_100020672454_200000210301 [1,1,0,0,0,0|2,0,0]=4 5094 B11R1.266 CSc1cccc(c1)N(C)C 34a_100020672454_200000210301 [1,1,0,0,0,0|2,0,0]=4 5095 B11R1.266 CSc1cccc(c1)N(C)C 62a_100011215952_200000210301 [1,1,0,0,0,0|2,0,0]=4 5096 B11R1.266 CSc1cccc(c1)N(C)C 62a_200000210301_100011215952 [1,1,0,0,0,0|2,0,0]=4 5097 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 2230a_100020672454_200025704644 [1,1,0,0,0,0|2,0,0]=4 5098 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 269982a_100020672454_200025704644 [1,1,0,0,0,0|2,0,0]=4 5099 B11R1.266 CSc1cccc(c1)N(C)[13CH3] 34a_100020672454_200025704644 [1,1,0,0,0,0|2,0,0]=4 5100 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [1,1,0,0,0,0|1,0,0]=3 5101 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [1,1,0,0,0,0|1,0,0]=3 5102 B11R1.266 CSc1cccc(n1)C(=O)C 62a_100009816502_200000210301 [1,1,0,0,0,0|1,0,0]=3 5103 B11R1.266 CSc1cccc(n1)C(=O)C 62a_200000210301_100009816502 [1,1,0,0,0,0|1,0,0]=3 5104 B11R1.266 CSc1cccc(n1)C(=O)N 62a_100011834053_200000210301 [1,1,0,0,0,0|2,0,0]=4 5105 B11R1.266 CSc1cccc(n1)C(=O)N 62a_200000210301_100011834053 [1,1,0,0,0,0|2,0,0]=4 5106 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_100000709912_200000210301 [1,1,0,0,0,0|1,0,0]=3 5107 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_200000210301_100000709912 [1,1,0,0,0,0|1,0,0]=3 5108 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_100000229564_200000210301 [1,1,0,0,0,0|2,0,0]=4 5109 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_200000210301_100000229564 [1,1,0,0,0,0|2,0,0]=4 5110 B11R1.266 CSc1cncc(c1)C(=O)C 62a_100011216243_200000210301 [1,1,0,0,0,0|1,0,0]=3 5111 B11R1.266 CSc1cncc(c1)C(=O)C 62a_200000210301_100011216243 [1,1,0,0,0,0|1,0,0]=3 5112 B11R1.266 CSc1cncc(c1)C(=O)N 62a_100000162242_200000210301 [1,1,0,0,0,0|2,0,0]=4 5113 B11R1.266 CSc1cncc(c1)C(=O)N 62a_200000210301_100000162242 [1,1,0,0,0,0|2,0,0]=4 5114 B11R1.266 CSc1nccc(n1)C(=O)C 62a_100010643186_200000210301 [1,1,0,0,0,0|2,0,0]=4 5115 B11R1.266 CSc1nccc(n1)C(=O)C 62a_200000210301_100010643186 [1,1,0,0,0,0|2,0,0]=4 5116 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [1,1,0,0,0,0|0,0,1]=3 5117 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [1,1,0,0,0,0|0,0,0]=2 5118 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [1,1,0,0,0,0|1,0,0]=3 5119 B11R1.266 [13CH3]Nc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200025704644 [1,1,0,0,0,0|2,0,0]=4 5120 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,1,0,0,0,0|1,0,0]=3 5121 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,1,0,0,0,0|1,0,0]=3 5122 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,1,0,0,0,0|1,1,0]=4 5123 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [1,1,0,0,0,0|2,0,0]=4 5124 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [1,1,0,0,0,0|2,0,0]=4 5125 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [1,1,0,0,0,0|2,0,0]=4 5126 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_100000229836_200025704644 [1,1,0,0,0,0|2,0,0]=4 5127 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_200025704644_100000229836 [1,1,0,0,0,0|2,0,0]=4 5128 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [1,1,0,0,0,0|1,0,0]=3 5129 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [1,1,0,0,0,0|1,0,0]=3 5130 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_100011834053_200025704644 [1,1,0,0,0,0|2,0,0]=4 5131 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_200025704644_100011834053 [1,1,0,0,0,0|2,0,0]=4 5132 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_100000229564_200025704644 [1,1,0,0,0,0|2,0,0]=4 5133 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_200025704644_100000229564 [1,1,0,0,0,0|2,0,0]=4 5134 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_100000162242_200025704644 [1,1,0,0,0,0|2,0,0]=4 5135 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_200025704644_100000162242 [1,1,0,0,0,0|2,0,0]=4 5136 B11R1.225 COC(=O)c1cc(sc1O)C 271570a_203496583355_100009817063 [0,1,0,0,1,0|1,0,0]=3 5137 B11R1.225 COC(=O)c1nc(sc1O)C 271570a_203496583355_100000730370 [0,1,0,0,1,0|2,0,0]=4 5138 B11R1.225 COC(=O)c1nn(cc1O)C 271570a_203496583355_100010124786 [0,1,0,0,1,0|2,0,0]=4 5139 B11R1.225 COC(=O)c1sc(cc1O)C 271570a_203496583355_100009817204 [0,1,0,0,1,0|1,0,0]=3 5140 B11R1.875 COC(=O)c1c(cnn1C)O 271570a_203496583355_100010000105 [0,1,0,0,1,0|2,0,0]=4 5141 B11R1.875 COC(=O)c1c(csc1N)O 271570a_203496583355_200010874472 [0,1,0,0,1,0|2,0,0]=4 5142 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 11a_100012022948_100015343762 [0,1,0,0,0,1|1,0,1]=4 5143 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 1626a_100012022948_100015343762 [0,1,0,0,0,1|1,0,1]=4 5144 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 22a_100012022948_100000070787 [0,1,0,0,0,1|1,0,1]=4 5145 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 527a_100012022948_100103153847 [0,1,0,0,0,1|1,0,1]=4 5146 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 11a_100000100531_100015343762 [0,1,0,0,0,1|1,0,1]=4 5147 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 1626a_100000100531_100015343762 [0,1,0,0,0,1|1,0,1]=4 5148 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 22a_100000100531_100000070787 [0,1,0,0,0,1|1,0,1]=4 5149 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 527a_100000100531_100103153847 [0,1,0,0,0,1|1,0,1]=4 5150 B13R1.97 C=Cc1ccc(c(c1)CC(=O)C)O 271570a_100011290941_200010006938 [0,1,0,0,0,1|0,0,1]=3 5151 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)C 271570a_100011290941_100011344836 [0,1,0,0,0,1|1,0,1]=4 5152 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)F 271570a_100011290941_200011951791 [0,1,0,0,0,1|1,0,1]=4 5153 B13R1.97 C=Cc1ccc(c(c1)OC(=O)C)C 271570a_100011290941_100103282185 [0,1,0,0,0,1|1,0,1]=4 5154 B13R1.97 CC(=Cc1cc(ccc1C)CO)C 271570a_100102525489_100000050133 [0,1,0,0,0,1|2,0,0]=4 5155 B13R1.97 CC(=Cc1cc(ccc1F)CN)C 271570a_100102525489_100015193890 [0,1,0,0,0,1|2,0,0]=4 5156 B13R1.97 CC(=Cc1cc(ccc1F)CO)C 271570a_100102525489_100000246287 [0,1,0,0,0,1|2,0,0]=4 5157 B13R1.97 CC(=Cc1cc(ccc1O)C#N)C 271570a_100102525489_100000725478 [0,1,0,0,0,1|1,0,1]=4 5158 B13R1.97 CC(=Cc1cc(ccc1O)C=O)C 271570a_100102525489_100000184552 [0,1,0,0,0,1|1,0,1]=4 5159 B13R1.97 CC(=Cc1cc(ccc1O)CO)C 271570a_100102525489_100011191544 [0,1,0,0,0,1|1,0,0]=3 5160 B13R1.97 CC(=Cc1nc(ccc1O)CO)C 271570a_100102525489_200000118097 [0,1,0,0,0,1|2,0,0]=4 5161 B13R1.97 CC(=O)Cc1cc(ccc1Br)C#N 1458a_100000070787_100012145668 [0,1,0,0,0,1|1,0,1]=4 5162 B13R1.97 CC(=O)Cc1cc(ccc1F)C#N 1458a_100000070787_100000239971 [0,1,0,0,0,1|1,0,1]=4 5163 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200010006938_200025704644 [0,1,0,0,0,1|0,0,0]=2 5164 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200025704644_200010006938 [0,1,0,0,0,1|0,0,0]=2 5165 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 11a_100012001879_100015343762 [0,1,0,0,0,1|1,0,1]=4 5166 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 1626a_100012001879_100015343762 [0,1,0,0,0,1|1,0,1]=4 5167 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 11a_100000748024_100015343762 [0,1,0,0,0,1|1,0,1]=4 5168 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 1626a_100000748024_100015343762 [0,1,0,0,0,1|1,0,1]=4 5169 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 22a_100000748024_100000070787 [0,1,0,0,0,1|1,0,1]=4 5170 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 527a_100000748024_100103153847 [0,1,0,0,0,1|1,0,1]=4 5171 B13R1.97 CC(=O)Nc1cc(ccc1C)CO 22a_100000758420_100000070787 [0,1,0,0,0,1|1,0,0]=3 5172 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 34a_100000740626_200025704644 [0,1,0,0,0,1|1,0,0]=3 5173 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 7a_100000740626_200025704644 [0,1,0,0,0,1|1,0,0]=3 5174 B13R1.97 CC(=O)Nc1cc(ccc1C)S[13CH3] 62a_200025704644_100011344836 [0,1,0,0,0,1|1,0,0]=3 5175 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 11a_100000766345_100015343762 [0,1,0,0,0,1|1,0,1]=4 5176 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 1626a_100000766345_100015343762 [0,1,0,0,0,1|1,0,1]=4 5177 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 34a_100000745429_200025704644 [0,1,0,0,0,1|1,0,0]=3 5178 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 7a_100000745429_200025704644 [0,1,0,0,0,1|1,0,0]=3 5179 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 11a_100011934650_100015343762 [0,1,0,0,0,1|1,0,1]=4 5180 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 1626a_100011934650_100015343762 [0,1,0,0,0,1|1,0,1]=4 5181 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 22a_100011934650_100000070787 [0,1,0,0,0,1|1,0,1]=4 5182 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 527a_100011934650_100103153847 [0,1,0,0,0,1|1,0,1]=4 5183 B13R1.97 CC(=O)Nc1cc(ccc1F)CO 22a_102125399562_100000070787 [0,1,0,0,0,1|1,0,0]=3 5184 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 34a_100000736141_200025704644 [0,1,0,0,0,1|1,0,0]=3 5185 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 7a_100000736141_200025704644 [0,1,0,0,0,1|1,0,0]=3 5186 B13R1.97 CC(=O)Nc1cc(ccc1F)S[13CH3] 62a_200025704644_200011951791 [0,1,0,0,0,1|1,0,0]=3 5187 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 11a_200012349464_100015343762 [0,1,0,0,0,1|1,0,1]=4 5188 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 1626a_200012349464_100015343762 [0,1,0,0,0,1|1,0,1]=4 5189 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 22a_100000766272_100000070787 [0,1,0,0,0,1|0,0,1]=3 5190 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 527a_100000766272_100103153847 [0,1,0,0,0,1|0,0,1]=3 5191 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 22a_100000123545_100000070787 [0,1,0,0,0,1|0,0,0]=2 5192 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 527a_100000123545_100103153847 [0,1,0,0,0,1|0,0,0]=2 5193 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 34a_100000070259_200025704644 [0,1,0,0,0,1|0,0,0]=2 5194 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 7a_100000070259_200025704644 [0,1,0,0,0,1|0,0,0]=2 5195 B13R1.97 CC(=O)Nc1cc(cnc1C)S[13CH3] 62a_100010117071_200025704644 [0,1,0,0,0,1|2,0,0]=4 5196 B13R1.97 CC(=O)Nc1cc(cnc1C)S[13CH3] 62a_200025704644_100010117071 [0,1,0,0,0,1|2,0,0]=4 5197 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_100103282185_200025704644 [0,1,0,0,0,1|1,0,0]=3 5198 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_200025704644_100103282185 [0,1,0,0,0,1|1,0,0]=3 5199 B13R1.97 CC(C)Nc1cc(ccc1O)CO 34a_100000123545_100000210206 [0,1,0,0,0,1|1,0,1]=4 5200 B13R1.97 CC(C)Sc1cc(ccc1O)CO 62a_100000210206_100011191544 [0,1,0,0,0,1|1,0,1]=4 5201 B13R1.97 CC(C)Sc1cc(ccc1O)CO 62a_100011191544_100000210206 [0,1,0,0,0,1|1,0,1]=4 5202 B13R1.97 CCc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_200010244628 [0,1,0,0,0,1|2,0,0]=4 5203 B13R1.97 CCc1ccc(c(c1)C=C(C)C)N 271570a_100102525489_100012339725 [0,1,0,0,0,1|2,0,0]=4 5204 B13R1.97 CCc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100012339963 [0,1,0,0,0,1|1,0,0]=3 5205 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 11a_200012022522_100015343762 [0,1,0,0,0,1|1,0,0]=3 5206 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 1626a_200012022522_100015343762 [0,1,0,0,0,1|1,0,0]=3 5207 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 22a_200012022522_100000070787 [0,1,0,0,0,1|1,0,0]=3 5208 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 527a_200012022522_100103153847 [0,1,0,0,0,1|1,0,0]=3 5209 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 22a_100000765835_100000070787 [0,1,0,0,0,1|0,0,0]=2 5210 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 527a_100000765835_100103153847 [0,1,0,0,0,1|0,0,0]=2 5211 B13R1.97 CCc1ccc(c(c1)NC(C)C)O 34a_100000765835_100000210206 [0,1,0,0,0,1|1,0,1]=4 5212 B13R1.97 CCc1ccc(c(c1)SC(C)C)O 62a_100000210206_100012339963 [0,1,0,0,0,1|1,0,1]=4 5213 B13R1.97 CCc1ccc(c(c1)SC(C)C)O 62a_100012339963_100000210206 [0,1,0,0,0,1|1,0,1]=4 5214 B13R1.97 CNc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_100000707694 [0,1,0,0,0,1|2,0,0]=4 5215 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_200000210301 [0,1,0,0,0,1|1,0,0]=3 5216 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_200000210301 [0,1,0,0,0,1|1,0,0]=3 5217 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_200000210301 [0,1,0,0,0,1|1,0,0]=3 5218 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_200000210301 [0,1,0,0,0,1|1,0,0]=3 5219 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_200000210301 [0,1,0,0,0,1|1,0,0]=3 5220 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_200000210301 [0,1,0,0,0,1|1,0,0]=3 5221 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_200000210301 [0,1,0,0,0,1|0,0,0]=2 5222 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_200000210301 [0,1,0,0,0,1|0,0,0]=2 5223 B13R1.97 COc1ccc(c(c1)C=C(C)C)Br 271570a_100102525489_100009992028 [0,1,0,0,0,1|2,0,0]=4 5224 B13R1.97 COc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_100012349166 [0,1,0,0,0,1|2,0,0]=4 5225 B13R1.97 COc1ccc(c(c1)C=C(C)C)Cl 271570a_100102525489_100011356938 [0,1,0,0,0,1|2,0,0]=4 5226 B13R1.97 COc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_100000699733 [0,1,0,0,0,1|2,0,0]=4 5227 B13R1.97 COc1ccc(c(c1)C=C(C)C)N 271570a_100102525489_100015195136 [0,1,0,0,0,1|2,0,0]=4 5228 B13R1.97 COc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100000685887 [0,1,0,0,0,1|1,0,0]=3 5229 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100000761528 [0,1,0,0,0,1|1,0,0]=3 5230 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000690513_200000210301 [0,1,0,0,0,1|1,0,0]=3 5231 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000718613 [0,1,0,0,0,1|1,0,0]=3 5232 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100010217559_200000210301 [0,1,0,0,0,1|1,0,0]=3 5233 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100000070787_100010243555 [0,1,0,0,0,1|1,0,0]=3 5234 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100009868546_200000210301 [0,1,0,0,0,1|1,0,0]=3 5235 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100000690513_200025704644 [0,1,0,0,0,1|1,0,0]=3 5236 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Cl 1458a_100010217559_200025704644 [0,1,0,0,0,1|1,0,0]=3 5237 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100009868546_200025704644 [0,1,0,0,0,1|1,0,0]=3 5238 B13R1.97 COc1ccc(c(c1)CN(C)C)O 271570a_203496583355_100000727244 [0,1,0,0,0,1|2,0,0]=4 5239 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 11a_100000748603_100015343762 [0,1,0,0,0,1|1,0,0]=3 5240 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 1626a_100000748603_100015343762 [0,1,0,0,0,1|1,0,0]=3 5241 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 22a_100000748603_100000070787 [0,1,0,0,0,1|1,0,0]=3 5242 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 11a_100000760359_100015343762 [0,1,0,0,0,1|1,0,0]=3 5243 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 1626a_100000760359_100015343762 [0,1,0,0,0,1|1,0,0]=3 5244 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 22a_100000760359_100000070787 [0,1,0,0,0,1|1,0,0]=3 5245 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 527a_100000760359_100103153847 [0,1,0,0,0,1|1,0,0]=3 5246 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 11a_100000745576_100015343762 [0,1,0,0,0,1|1,0,0]=3 5247 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 1626a_100000745576_100015343762 [0,1,0,0,0,1|1,0,0]=3 5248 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 22a_100000745576_100000070787 [0,1,0,0,0,1|1,0,0]=3 5249 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 11a_100000764331_100015343762 [0,1,0,0,0,1|1,0,0]=3 5250 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 1626a_100000764331_100015343762 [0,1,0,0,0,1|1,0,0]=3 5251 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 22a_100000764331_100000070787 [0,1,0,0,0,1|1,0,0]=3 5252 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 527a_100000764331_100103153847 [0,1,0,0,0,1|1,0,0]=3 5253 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 11a_100000748021_100015343762 [0,1,0,0,0,1|1,0,0]=3 5254 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 1626a_100000748021_100015343762 [0,1,0,0,0,1|1,0,0]=3 5255 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 22a_100000748021_100000070787 [0,1,0,0,0,1|1,0,0]=3 5256 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 22a_100000188146_100000070787 [0,1,0,0,0,1|0,0,0]=2 5257 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 271570a_203496583355_100011665069 [0,1,0,0,0,1|0,0,0]=2 5258 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 527a_100000188146_100103153847 [0,1,0,0,0,1|0,0,0]=2 5259 B13R1.97 COc1ccc(c(c1)NC(C)C)O 34a_100000188146_100000210206 [0,1,0,0,0,1|1,0,1]=4 5260 B13R1.97 COc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000685887 [0,1,0,0,0,1|1,0,1]=4 5261 B13R1.97 CSc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_200010708804 [0,1,0,0,0,1|2,0,0]=4 5262 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200000210301_200010006938 [0,1,0,0,0,1|0,0,0]=2 5263 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_200000210301 [0,1,0,0,0,1|0,0,0]=2 5264 B13R1.97 CSc1ccc(c(c1)NC(=O)C)C 62a_200000210301_100011344836 [0,1,0,0,0,1|1,0,0]=3 5265 B13R1.97 CSc1ccc(c(c1)NC(=O)C)F 62a_200000210301_200011951791 [0,1,0,0,0,1|1,0,0]=3 5266 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_200000210301 [0,1,0,0,0,1|1,0,0]=3 5267 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_200000210301_100103282185 [0,1,0,0,0,1|1,0,0]=3 5268 B13R1.97 CSc1cnc(c(c1)NC(=O)C)C 62a_100010117071_200000210301 [0,1,0,0,0,1|2,0,0]=4 5269 B13R1.97 CSc1cnc(c(c1)NC(=O)C)C 62a_200000210301_100010117071 [0,1,0,0,0,1|2,0,0]=4 5270 B13R1.876 CC(=Cc1cc(c(cc1Br)F)C)C 271570a_100102525489_200009814773 [0,1,0,0,0,1|2,0,0]=4 5271 B13R1.876 CC(=Cc1cc(c(cc1C)Br)C)C 271570a_100102525489_100011356911 [0,1,0,0,0,1|2,0,0]=4 5272 B13R1.876 CC(=Cc1cc(c(cc1C)C)C)C 271570a_100102525489_100000759388 [0,1,0,0,0,1|2,0,0]=4 5273 B13R1.876 CC(=Cc1cc(c(cc1C)Cl)C)C 271570a_100102525489_100012357408 [0,1,0,0,0,1|2,0,0]=4 5274 B13R1.876 CC(=Cc1cc(c(cc1C)F)C)C 271570a_100102525489_100010212296 [0,1,0,0,0,1|2,0,0]=4 5275 B13R1.876 CC(=Cc1cc(c(cc1C)N)C)C 271570a_100102525489_100011934712 [0,1,0,0,0,1|2,0,0]=4 5276 B13R1.876 CC(=Cc1cc(c(cc1C)O)C)C 271570a_100102525489_100000698207 [0,1,0,0,0,1|2,0,0]=4 5277 B13R1.876 CC(=Cc1cc(c(cc1Cl)Br)C)C 271570a_100102525489_100010259621 [0,1,0,0,0,1|2,0,0]=4 5278 B13R1.876 CC(=Cc1cc(c(cc1F)Br)C)C 271570a_100102525489_200009814772 [0,1,0,0,0,1|2,0,0]=4 5279 B13R1.876 CC(=Cc1cc(c(cc1F)C)C)C 271570a_100102525489_100010197417 [0,1,0,0,0,1|2,0,0]=4 5280 B13R1.876 CC(=Cc1cc(c(cc1F)F)C)C 271570a_100102525489_100000692463 [0,1,0,0,0,1|2,0,0]=4 5281 B13R1.876 CC(=Cc1cc(c(cc1F)N)C)C 271570a_100102525489_100000695870 [0,1,0,0,0,1|2,0,0]=4 5282 B13R1.876 CC(=Cc1cc(c(cc1N)Br)C)C 271570a_100102525489_200015600912 [0,1,0,0,0,1|2,0,0]=4 5283 B13R1.876 CC(=Cc1cc(c(cc1N)C)C)C 271570a_100102525489_100012337760 [0,1,0,0,0,1|2,0,0]=4 5284 B13R1.876 CC(=Cc1cc(c(cc1N)F)C)C 271570a_100102525489_100011218008 [0,1,0,0,0,1|2,0,0]=4 5285 B13R1.876 CC(=Cc1cc(c(cc1N)N)C)C 271570a_100102525489_200013038441 [0,1,0,0,0,1|2,0,0]=4 5286 B13R1.876 CC(=Cc1cc(c(cc1O)C)C)C 271570a_100102525489_100009814663 [0,1,0,0,0,1|1,0,0]=3 5287 B13R1.876 CC(=Cc1cc(c(cc1O)F)F)C 271570a_100102525489_100009813768 [0,1,0,0,0,1|2,0,0]=4 5288 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100000070787_100010077255 [0,1,0,0,0,1|2,0,0]=4 5289 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200000210301 [0,1,0,0,0,1|2,0,0]=4 5290 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)Cl 1458a_100000070787_100010220947 [0,1,0,0,0,1|2,0,0]=4 5291 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100000070787_100009813697 [0,1,0,0,0,1|2,0,0]=4 5292 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200000210301 [0,1,0,0,0,1|2,0,0]=4 5293 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200000210301 [0,1,0,0,0,1|2,0,0]=4 5294 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000070787_100011830393 [0,1,0,0,0,1|2,0,0]=4 5295 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100000070787_100012024439 [0,1,0,0,0,1|2,0,0]=4 5296 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200000210301 [0,1,0,0,0,1|2,0,0]=4 5297 B13R1.876 CC(=O)Cc1cc(c(cc1F)Cl)F 1458a_100000070787_200012361342 [0,1,0,0,0,1|2,0,0]=4 5298 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)C 1458a_100000070787_100012347589 [0,1,0,0,0,1|1,0,0]=3 5299 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100000070787_100010994231 [0,1,0,0,0,1|2,0,0]=4 5300 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200000210301 [0,1,0,0,0,1|2,0,0]=4 5301 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000070787_100011218792 [0,1,0,0,0,1|2,0,0]=4 5302 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200000210301 [0,1,0,0,0,1|2,0,0]=4 5303 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)I 1458a_100000070787_100019984567 [0,1,0,0,0,1|2,0,0]=4 5304 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)Br 11a_100009998182_100015343762 [0,1,0,0,0,1|2,0,0]=4 5305 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)C 11a_100009995518_100015343762 [0,1,0,0,0,1|1,0,0]=3 5306 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)C 1626a_100009995518_100015343762 [0,1,0,0,0,1|1,0,0]=3 5307 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F 11a_100010212202_100015343762 [0,1,0,0,0,1|2,0,0]=4 5308 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F 1626a_100010212202_100015343762 [0,1,0,0,0,1|2,0,0]=4 5309 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Br 11a_100012348304_100015343762 [0,1,0,0,0,1|2,0,0]=4 5310 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Br 1626a_100012348304_100015343762 [0,1,0,0,0,1|2,0,0]=4 5311 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)C 11a_100012337760_100015343762 [0,1,0,0,0,1|1,0,0]=3 5312 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)C 1626a_100012337760_100015343762 [0,1,0,0,0,1|1,0,0]=3 5313 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 11a_100000702286_100015343762 [0,1,0,0,0,1|2,0,0]=4 5314 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 1626a_100000702286_100015343762 [0,1,0,0,0,1|2,0,0]=4 5315 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 22a_100000702286_100000070787 [0,1,0,0,0,1|2,0,0]=4 5316 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F 11a_100011218008_100015343762 [0,1,0,0,0,1|2,0,0]=4 5317 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F 1626a_100011218008_100015343762 [0,1,0,0,0,1|2,0,0]=4 5318 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Cl)F 11a_100010254744_100015343762 [0,1,0,0,0,1|2,0,0]=4 5319 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Cl)F 1626a_100010254744_100015343762 [0,1,0,0,0,1|2,0,0]=4 5320 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br 11a_100010131408_100015343762 [0,1,0,0,0,1|2,0,0]=4 5321 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br 1626a_100010131408_100015343762 [0,1,0,0,0,1|2,0,0]=4 5322 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)C 11a_100010233353_100015343762 [0,1,0,0,0,1|1,0,0]=3 5323 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)C 1626a_100010233353_100015343762 [0,1,0,0,0,1|1,0,0]=3 5324 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Cl 11a_100009817155_100015343762 [0,1,0,0,0,1|2,0,0]=4 5325 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Cl 1626a_100009817155_100015343762 [0,1,0,0,0,1|2,0,0]=4 5326 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)F 11a_100000690790_100015343762 [0,1,0,0,0,1|2,0,0]=4 5327 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)F 1626a_100000690790_100015343762 [0,1,0,0,0,1|2,0,0]=4 5328 B13R1.876 CC(=O)Nc1cc(c(cc1Br)O)Br 527a_100011080774_100103153847 [0,1,0,0,0,1|2,0,0]=4 5329 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 11a_100011934712_100015343762 [0,1,0,0,0,1|1,0,0]=3 5330 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 1626a_100011934712_100015343762 [0,1,0,0,0,1|1,0,0]=3 5331 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 22a_100011934712_100000070787 [0,1,0,0,0,1|1,0,0]=3 5332 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 527a_100011934712_100103153847 [0,1,0,0,0,1|1,0,0]=3 5333 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 11a_100012353740_100015343762 [0,1,0,0,0,1|2,0,0]=4 5334 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 1626a_100012353740_100015343762 [0,1,0,0,0,1|2,0,0]=4 5335 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 22a_100012353740_100000070787 [0,1,0,0,0,1|2,0,0]=4 5336 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 11a_100000695870_100015343762 [0,1,0,0,0,1|2,0,0]=4 5337 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 1626a_100000695870_100015343762 [0,1,0,0,0,1|2,0,0]=4 5338 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 22a_100000695870_100000070787 [0,1,0,0,0,1|2,0,0]=4 5339 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 11a_100000703630_100015343762 [0,1,0,0,0,1|2,0,0]=4 5340 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 1626a_100000703630_100015343762 [0,1,0,0,0,1|2,0,0]=4 5341 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 22a_100000703630_100000070787 [0,1,0,0,0,1|2,0,0]=4 5342 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 527a_100000703630_100103153847 [0,1,0,0,0,1|2,0,0]=4 5343 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 11a_100011217141_100015343762 [0,1,0,0,0,1|1,0,0]=3 5344 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 1626a_100011217141_100015343762 [0,1,0,0,0,1|1,0,0]=3 5345 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 22a_100011217141_100000070787 [0,1,0,0,0,1|1,0,0]=3 5346 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 11a_100010244688_100015343762 [0,1,0,0,0,1|2,0,0]=4 5347 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 1626a_100010244688_100015343762 [0,1,0,0,0,1|2,0,0]=4 5348 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 22a_100010244688_100000070787 [0,1,0,0,0,1|2,0,0]=4 5349 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 527a_100010244688_100103153847 [0,1,0,0,0,1|2,0,0]=4 5350 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 11a_100011830454_100015343762 [0,1,0,0,0,1|1,0,0]=3 5351 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 1626a_100011830454_100015343762 [0,1,0,0,0,1|1,0,0]=3 5352 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 22a_100011830454_100000070787 [0,1,0,0,0,1|1,0,0]=3 5353 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 11a_100012017293_100015343762 [0,1,0,0,0,1|2,0,0]=4 5354 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 1626a_100012017293_100015343762 [0,1,0,0,0,1|2,0,0]=4 5355 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 22a_100012017293_100000070787 [0,1,0,0,0,1|2,0,0]=4 5356 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)O 22a_100009961766_100000070787 [0,1,0,0,0,1|2,0,0]=4 5357 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 11a_100000717900_100015343762 [0,1,0,0,0,1|2,0,0]=4 5358 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 1626a_100000717900_100015343762 [0,1,0,0,0,1|2,0,0]=4 5359 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 22a_100000717900_100000070787 [0,1,0,0,0,1|2,0,0]=4 5360 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 527a_100000717900_100103153847 [0,1,0,0,0,1|2,0,0]=4 5361 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 11a_100012017673_100015343762 [0,1,0,0,0,1|2,0,0]=4 5362 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 1626a_100012017673_100015343762 [0,1,0,0,0,1|2,0,0]=4 5363 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 22a_100012017673_100000070787 [0,1,0,0,0,1|2,0,0]=4 5364 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 11a_100011830416_100015343762 [0,1,0,0,0,1|2,0,0]=4 5365 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 1626a_100011830416_100015343762 [0,1,0,0,0,1|2,0,0]=4 5366 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 22a_100011830416_100000070787 [0,1,0,0,0,1|2,0,0]=4 5367 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 11a_100010291052_100015343762 [0,1,0,0,0,1|2,0,0]=4 5368 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 1626a_100010291052_100015343762 [0,1,0,0,0,1|2,0,0]=4 5369 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 22a_100010291052_100000070787 [0,1,0,0,0,1|2,0,0]=4 5370 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 11a_100000720036_100015343762 [0,1,0,0,0,1|1,0,0]=3 5371 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 22a_100000720036_100000070787 [0,1,0,0,0,1|1,0,0]=3 5372 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 271570a_203496583355_100009992581 [0,1,0,0,0,1|1,0,0]=3 5373 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 527a_100000720036_100103153847 [0,1,0,0,0,1|1,0,0]=3 5374 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)F 271570a_203496583355_200013212116 [0,1,0,0,0,1|2,0,0]=4 5375 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)Cl 11a_100000246133_100015343762 [0,1,0,0,0,1|2,0,0]=4 5376 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)Cl 1626a_100000246133_100015343762 [0,1,0,0,0,1|2,0,0]=4 5377 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)F 11a_100000688864_100015343762 [0,1,0,0,0,1|2,0,0]=4 5378 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)F 1626a_100000688864_100015343762 [0,1,0,0,0,1|2,0,0]=4 5379 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 11a_100012183282_100015343762 [0,1,0,0,0,1|1,0,0]=3 5380 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 1626a_100012183282_100015343762 [0,1,0,0,0,1|1,0,0]=3 5381 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 22a_100012183282_100000070787 [0,1,0,0,0,1|1,0,0]=3 5382 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)O 22a_100000092876_100000070787 [0,1,0,0,0,1|2,0,0]=4 5383 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Br 11a_200012360370_100015343762 [0,1,0,0,0,1|2,0,0]=4 5384 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Br 1626a_200012360370_100015343762 [0,1,0,0,0,1|2,0,0]=4 5385 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)C 11a_100012000392_100015343762 [0,1,0,0,0,1|1,0,0]=3 5386 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)C 1626a_100012000392_100015343762 [0,1,0,0,0,1|1,0,0]=3 5387 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Cl 11a_100000211015_100015343762 [0,1,0,0,0,1|2,0,0]=4 5388 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Cl 1626a_100000211015_100015343762 [0,1,0,0,0,1|2,0,0]=4 5389 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)F 11a_100012017157_100015343762 [0,1,0,0,0,1|2,0,0]=4 5390 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)F 1626a_100012017157_100015343762 [0,1,0,0,0,1|2,0,0]=4 5391 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)I 11a_100016224655_100015343762 [0,1,0,0,0,1|2,0,0]=4 5392 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)I 1626a_100016224655_100015343762 [0,1,0,0,0,1|2,0,0]=4 5393 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Br 11a_100000685351_100015343762 [0,1,0,0,0,1|2,0,0]=4 5394 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Br 1626a_100000685351_100015343762 [0,1,0,0,0,1|2,0,0]=4 5395 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 11a_100000729549_100015343762 [0,1,0,0,0,1|1,0,0]=3 5396 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 1626a_100000729549_100015343762 [0,1,0,0,0,1|1,0,0]=3 5397 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 22a_100000729549_100000070787 [0,1,0,0,0,1|1,0,0]=3 5398 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 11a_100000085081_100015343762 [0,1,0,0,0,1|2,0,0]=4 5399 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 1626a_100000085081_100015343762 [0,1,0,0,0,1|2,0,0]=4 5400 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 22a_100000085081_100000070787 [0,1,0,0,0,1|2,0,0]=4 5401 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)F 11a_100000766337_100015343762 [0,1,0,0,0,1|2,0,0]=4 5402 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)F 1626a_100000766337_100015343762 [0,1,0,0,0,1|2,0,0]=4 5403 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)O)F 22a_100009886023_100000070787 [0,1,0,0,0,1|2,0,0]=4 5404 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)O)F 527a_100009886023_100103153847 [0,1,0,0,0,1|2,0,0]=4 5405 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 11a_200010212207_100015343762 [0,1,0,0,0,1|2,0,0]=4 5406 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 1626a_200010212207_100015343762 [0,1,0,0,0,1|2,0,0]=4 5407 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 22a_200010212207_100000070787 [0,1,0,0,0,1|2,0,0]=4 5408 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 527a_200010212207_100103153847 [0,1,0,0,0,1|2,0,0]=4 5409 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 11a_100000691575_100015343762 [0,1,0,0,0,1|1,0,0]=3 5410 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 1626a_100000691575_100015343762 [0,1,0,0,0,1|1,0,0]=3 5411 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 22a_100000691575_100000070787 [0,1,0,0,0,1|1,0,0]=3 5412 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 11a_100012356688_100015343762 [0,1,0,0,0,1|2,0,0]=4 5413 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 1626a_100012356688_100015343762 [0,1,0,0,0,1|2,0,0]=4 5414 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 22a_100012356688_100000070787 [0,1,0,0,0,1|2,0,0]=4 5415 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 11a_100000690247_100015343762 [0,1,0,0,0,1|2,0,0]=4 5416 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 1626a_100000690247_100015343762 [0,1,0,0,0,1|2,0,0]=4 5417 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 22a_100000690247_100000070787 [0,1,0,0,0,1|2,0,0]=4 5418 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 11a_100010239588_100015343762 [0,1,0,0,0,1|2,0,0]=4 5419 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 1626a_100010239588_100015343762 [0,1,0,0,0,1|2,0,0]=4 5420 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 527a_100010239588_100103153847 [0,1,0,0,0,1|2,0,0]=4 5421 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 11a_100012002673_100015343762 [0,1,0,0,0,1|2,0,0]=4 5422 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 1626a_100012002673_100015343762 [0,1,0,0,0,1|2,0,0]=4 5423 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 22a_100012002673_100000070787 [0,1,0,0,0,1|2,0,0]=4 5424 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 11a_100011014115_100015343762 [0,1,0,0,0,1|2,0,0]=4 5425 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 1626a_100011014115_100015343762 [0,1,0,0,0,1|2,0,0]=4 5426 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 22a_100011014115_100000070787 [0,1,0,0,0,1|2,0,0]=4 5427 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 527a_100011014115_100103153847 [0,1,0,0,0,1|2,0,0]=4 5428 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)O 22a_100000117193_100000070787 [0,1,0,0,0,1|2,0,0]=4 5429 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)O 527a_100000117193_100103153847 [0,1,0,0,0,1|2,0,0]=4 5430 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Br 11a_100013023876_100015343762 [0,1,0,0,0,1|2,0,0]=4 5431 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Br 1626a_100013023876_100015343762 [0,1,0,0,0,1|2,0,0]=4 5432 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 11a_100000091823_100015343762 [0,1,0,0,0,1|1,0,0]=3 5433 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 1626a_100000091823_100015343762 [0,1,0,0,0,1|1,0,0]=3 5434 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 22a_100000091823_100000070787 [0,1,0,0,0,1|1,0,0]=3 5435 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Cl 11a_100000724578_100015343762 [0,1,0,0,0,1|2,0,0]=4 5436 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Cl 1626a_100000724578_100015343762 [0,1,0,0,0,1|2,0,0]=4 5437 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)F 11a_100011998097_100015343762 [0,1,0,0,0,1|2,0,0]=4 5438 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)F 1626a_100011998097_100015343762 [0,1,0,0,0,1|2,0,0]=4 5439 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)O 22a_100000042052_100000070787 [0,1,0,0,0,1|2,0,0]=4 5440 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 11a_100000700208_100015343762 [0,1,0,0,0,1|2,0,0]=4 5441 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 1626a_100000700208_100015343762 [0,1,0,0,0,1|2,0,0]=4 5442 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 22a_100000700208_100000070787 [0,1,0,0,0,1|2,0,0]=4 5443 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 11a_100011998096_100015343762 [0,1,0,0,0,1|2,0,0]=4 5444 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 1626a_100011998096_100015343762 [0,1,0,0,0,1|2,0,0]=4 5445 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 22a_100011998096_100000070787 [0,1,0,0,0,1|2,0,0]=4 5446 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 11a_100000750162_100015343762 [0,1,0,0,0,1|2,0,0]=4 5447 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 1626a_100000750162_100015343762 [0,1,0,0,0,1|2,0,0]=4 5448 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 22a_100000750162_100000070787 [0,1,0,0,0,1|2,0,0]=4 5449 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 22a_100011219470_100000070787 [0,1,0,0,0,1|2,0,0]=4 5450 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 271570a_203496583355_200013902858 [0,1,0,0,0,1|2,0,0]=4 5451 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 527a_100011219470_100103153847 [0,1,0,0,0,1|2,0,0]=4 5452 B13R1.876 CC(=O)Nc1cc(c(cc1F)I)F 11a_100010185194_100015343762 [0,1,0,0,0,1|2,0,0]=4 5453 B13R1.876 CC(=O)Nc1cc(c(cc1F)I)F 1626a_100010185194_100015343762 [0,1,0,0,0,1|2,0,0]=4 5454 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 22a_100020635945_100000070787 [0,1,0,0,0,1|2,0,0]=4 5455 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 271570a_203496583355_200012359909 [0,1,0,0,0,1|2,0,0]=4 5456 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 527a_100020635945_100103153847 [0,1,0,0,0,1|2,0,0]=4 5457 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)F 11a_100010888672_100015343762 [0,1,0,0,0,1|2,0,0]=4 5458 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)F 1626a_100010888672_100015343762 [0,1,0,0,0,1|2,0,0]=4 5459 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br 11a_200015600912_100015343762 [0,1,0,0,0,1|2,0,0]=4 5460 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br 1626a_200015600912_100015343762 [0,1,0,0,0,1|2,0,0]=4 5461 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C 11a_100012353678_100015343762 [0,1,0,0,0,1|1,0,0]=3 5462 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C 1626a_100012353678_100015343762 [0,1,0,0,0,1|1,0,0]=3 5463 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)Cl 11a_200011093942_100015343762 [0,1,0,0,0,1|2,0,0]=4 5464 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)Cl 1626a_200011093942_100015343762 [0,1,0,0,0,1|2,0,0]=4 5465 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F 11a_100010892166_100015343762 [0,1,0,0,0,1|2,0,0]=4 5466 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F 1626a_100010892166_100015343762 [0,1,0,0,0,1|2,0,0]=4 5467 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Br 11a_200021016574_100015343762 [0,1,0,0,0,1|2,0,0]=4 5468 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Br 1626a_200021016574_100015343762 [0,1,0,0,0,1|2,0,0]=4 5469 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)C 11a_100010238302_100015343762 [0,1,0,0,0,1|1,0,0]=3 5470 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)C 1626a_100010238302_100015343762 [0,1,0,0,0,1|1,0,0]=3 5471 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Cl 11a_200010992381_100015343762 [0,1,0,0,0,1|2,0,0]=4 5472 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Cl 1626a_200010992381_100015343762 [0,1,0,0,0,1|2,0,0]=4 5473 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)F 11a_100000765032_100015343762 [0,1,0,0,0,1|2,0,0]=4 5474 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)F 1626a_100000765032_100015343762 [0,1,0,0,0,1|2,0,0]=4 5475 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)Br 22a_200010781931_100000070787 [0,1,0,0,0,1|1,0,0]=3 5476 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)Br 527a_200010781931_100103153847 [0,1,0,0,0,1|1,0,0]=3 5477 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)C 22a_200010107346_100000070787 [0,1,0,0,0,1|0,0,0]=2 5478 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)C 527a_200010107346_100103153847 [0,1,0,0,0,1|0,0,0]=2 5479 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)F 22a_100013038943_100000070787 [0,1,0,0,0,1|1,0,0]=3 5480 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)F 527a_100013038943_100103153847 [0,1,0,0,0,1|1,0,0]=3 5481 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Br 22a_200010235796_100000070787 [0,1,0,0,0,1|1,0,0]=3 5482 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Br 527a_200010235796_100103153847 [0,1,0,0,0,1|1,0,0]=3 5483 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 22a_100133014134_100000070787 [0,1,0,0,0,1|0,0,0]=2 5484 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 271570a_203496583355_100010006330 [0,1,0,0,0,1|0,0,0]=2 5485 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 527a_100133014134_100103153847 [0,1,0,0,0,1|0,0,0]=2 5486 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Cl 22a_100000091707_100000070787 [0,1,0,0,0,1|1,0,0]=3 5487 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Cl 527a_100000091707_100103153847 [0,1,0,0,0,1|1,0,0]=3 5488 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br 22a_100013488937_100000070787 [0,1,0,0,0,1|1,0,0]=3 5489 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br 527a_100013488937_100103153847 [0,1,0,0,0,1|1,0,0]=3 5490 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Cl 22a_100000696747_100000070787 [0,1,0,0,0,1|1,0,0]=3 5491 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Cl 527a_100000696747_100103153847 [0,1,0,0,0,1|1,0,0]=3 5492 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)I 22a_100011011175_100000070787 [0,1,0,0,0,1|1,0,0]=3 5493 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)I 527a_100011011175_100103153847 [0,1,0,0,0,1|1,0,0]=3 5494 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)Br 22a_100012359894_100000070787 [0,1,0,0,0,1|1,0,0]=3 5495 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)Br 527a_100012359894_100103153847 [0,1,0,0,0,1|1,0,0]=3 5496 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)C 22a_100012022779_100000070787 [0,1,0,0,0,1|0,0,0]=2 5497 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)C 527a_100012022779_100103153847 [0,1,0,0,0,1|0,0,0]=2 5498 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 22a_106722365970_100000070787 [0,1,0,0,0,1|1,0,0]=3 5499 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 271570a_203496583355_100010198355 [0,1,0,0,0,1|1,0,0]=3 5500 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 527a_106722365970_100103153847 [0,1,0,0,0,1|1,0,0]=3 5501 B13R1.876 Cc1cc(c(cc1Br)O)NC(C)C 34a_200010107346_100000210206 [0,1,0,0,0,1|1,0,1]=4 5502 B13R1.876 Cc1cc(c(cc1C)NC(C)C)O 34a_100133014134_100000210206 [0,1,0,0,0,1|1,0,1]=4 5503 B13R1.876 Cc1cc(c(cc1C)NC(C)C)O 7a_100133014134_100000210206 [0,1,0,0,0,1|1,0,1]=4 5504 B13R1.876 Cc1cc(c(cc1C)SC(C)C)O 62a_100000210206_100009814663 [0,1,0,0,0,1|1,0,1]=4 5505 B13R1.876 Cc1cc(c(cc1C)SC(C)C)O 62a_100009814663_100000210206 [0,1,0,0,0,1|1,0,1]=4 5506 B13R1.876 Cc1cc(c(cc1F)O)NC(C)C 34a_100012022779_100000210206 [0,1,0,0,0,1|1,0,1]=4 5507 B13R1.876 Cc1cc(c(cc1F)O)NC(C)C 7a_100012022779_100000210206 [0,1,0,0,0,1|1,0,1]=4 5508 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200025704644 [0,1,0,0,0,1|2,0,0]=4 5509 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200025704644 [0,1,0,0,0,1|2,0,0]=4 5510 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200025704644 [0,1,0,0,0,1|2,0,0]=4 5511 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200025704644 [0,1,0,0,0,1|2,0,0]=4 5512 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200025704644 [0,1,0,0,0,1|2,0,0]=4 5513 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200025704644 [0,1,0,0,0,1|2,0,0]=4 5514 B13R1.885 CC(=O)Cc1c(ccc(c1Br)Cl)F 1458a_100000070787_100011099539 [0,1,0,0,0,1|2,0,0]=4 5515 B13R1.885 CC(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200000210301 [0,1,0,0,0,1|2,0,0]=4 5516 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)Cl 1458a_100000070787_200010220899 [0,1,0,0,0,1|1,0,0]=3 5517 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000038137_200000210301 [0,1,0,0,0,1|1,0,0]=3 5518 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000070787_100009813558 [0,1,0,0,0,1|1,0,0]=3 5519 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200000210301 [0,1,0,0,0,1|2,0,0]=4 5520 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200000210301 [0,1,0,0,0,1|2,0,0]=4 5521 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000070787_100009813715 [0,1,0,0,0,1|2,0,0]=4 5522 B13R1.885 CC(=O)Cc1c(ccc(c1F)Br)Cl 1458a_100000070787_100010993448 [0,1,0,0,0,1|2,0,0]=4 5523 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000035286_200000210301 [0,1,0,0,0,1|1,0,0]=3 5524 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000070787_100009813557 [0,1,0,0,0,1|1,0,0]=3 5525 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100000070787_100011217880 [0,1,0,0,0,1|1,0,0]=3 5526 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100011218906_200000210301 [0,1,0,0,0,1|1,0,0]=3 5527 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Br 1458a_100000070787_100011071994 [0,1,0,0,0,1|2,0,0]=4 5528 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Cl 1458a_100000070787_100009814555 [0,1,0,0,0,1|2,0,0]=4 5529 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200000210301 [0,1,0,0,0,1|2,0,0]=4 5530 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000070787_100009813610 [0,1,0,0,0,1|2,0,0]=4 5531 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100000070787_100011070584 [0,1,0,0,0,1|2,0,0]=4 5532 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200000210301 [0,1,0,0,0,1|2,0,0]=4 5533 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Cl 1458a_100000070787_100010381632 [0,1,0,0,0,1|2,0,0]=4 5534 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200000210301 [0,1,0,0,0,1|2,0,0]=4 5535 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000070787_100009813269 [0,1,0,0,0,1|2,0,0]=4 5536 B13R1.885 CC(=O)Nc1c(ccc(c1Br)F)F 11a_100014094178_100015343762 [0,1,0,0,0,1|2,0,0]=4 5537 B13R1.885 CC(=O)Nc1c(ccc(c1Br)F)F 1626a_100014094178_100015343762 [0,1,0,0,0,1|2,0,0]=4 5538 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 11a_200010074581_100015343762 [0,1,0,0,0,1|2,0,0]=4 5539 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 1626a_200010074581_100015343762 [0,1,0,0,0,1|2,0,0]=4 5540 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 22a_200010074581_100000070787 [0,1,0,0,0,1|2,0,0]=4 5541 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)F 11a_100010588651_100015343762 [0,1,0,0,0,1|2,0,0]=4 5542 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)F 1626a_100010588651_100015343762 [0,1,0,0,0,1|2,0,0]=4 5543 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)O 22a_100013039247_100000070787 [0,1,0,0,0,1|1,0,0]=3 5544 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)O 527a_100013039247_100103153847 [0,1,0,0,0,1|1,0,0]=3 5545 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 11a_100000117417_100015343762 [0,1,0,0,0,1|1,0,0]=3 5546 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 1626a_100000117417_100015343762 [0,1,0,0,0,1|1,0,0]=3 5547 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 22a_100000117417_100000070787 [0,1,0,0,0,1|1,0,0]=3 5548 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)C 11a_200020642106_100015343762 [0,1,0,0,0,1|2,0,0]=4 5549 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)C 1626a_200020642106_100015343762 [0,1,0,0,0,1|2,0,0]=4 5550 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)Cl 11a_100009961198_100015343762 [0,1,0,0,0,1|2,0,0]=4 5551 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)Cl 1626a_100009961198_100015343762 [0,1,0,0,0,1|2,0,0]=4 5552 B13R1.885 CC(=O)Nc1c(ccc(c1C)F)Br 11a_100011009917_100015343762 [0,1,0,0,0,1|2,0,0]=4 5553 B13R1.885 CC(=O)Nc1c(ccc(c1C)F)Br 1626a_100011009917_100015343762 [0,1,0,0,0,1|2,0,0]=4 5554 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 11a_200010115591_100015343762 [0,1,0,0,0,1|2,0,0]=4 5555 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 1626a_200010115591_100015343762 [0,1,0,0,0,1|2,0,0]=4 5556 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 22a_200010115591_100000070787 [0,1,0,0,0,1|2,0,0]=4 5557 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)Cl 11a_100000210993_100015343762 [0,1,0,0,0,1|1,0,0]=3 5558 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)F 11a_106744479701_100015343762 [0,1,0,0,0,1|1,0,0]=3 5559 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)F 1626a_106744479701_100015343762 [0,1,0,0,0,1|1,0,0]=3 5560 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)Cl 11a_103437851083_100015343762 [0,1,0,0,0,1|2,0,0]=4 5561 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)Cl 1626a_103437851083_100015343762 [0,1,0,0,0,1|2,0,0]=4 5562 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)F 11a_100000061523_100015343762 [0,1,0,0,0,1|2,0,0]=4 5563 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)F 1626a_100000061523_100015343762 [0,1,0,0,0,1|2,0,0]=4 5564 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)F)F 11a_100000062006_100015343762 [0,1,0,0,0,1|2,0,0]=4 5565 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)F)F 1626a_100000062006_100015343762 [0,1,0,0,0,1|2,0,0]=4 5566 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)Cl 11a_100010995236_100015343762 [0,1,0,0,0,1|2,0,0]=4 5567 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)Cl 1626a_100010995236_100015343762 [0,1,0,0,0,1|2,0,0]=4 5568 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)F 11a_100025793129_100015343762 [0,1,0,0,0,1|2,0,0]=4 5569 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)F 1626a_100025793129_100015343762 [0,1,0,0,0,1|2,0,0]=4 5570 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)Cl 11a_100000062009_100015343762 [0,1,0,0,0,1|1,0,0]=3 5571 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)Cl 1626a_100000062009_100015343762 [0,1,0,0,0,1|1,0,0]=3 5572 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)F 11a_102495364760_100015343762 [0,1,0,0,0,1|1,0,0]=3 5573 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)F 1626a_102495364760_100015343762 [0,1,0,0,0,1|1,0,0]=3 5574 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Br 11a_100011010633_100015343762 [0,1,0,0,0,1|2,0,0]=4 5575 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Br 1626a_100011010633_100015343762 [0,1,0,0,0,1|2,0,0]=4 5576 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Cl 11a_200000061452_100015343762 [0,1,0,0,0,1|2,0,0]=4 5577 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Cl 1626a_200000061452_100015343762 [0,1,0,0,0,1|2,0,0]=4 5578 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)F 11a_102495364764_100015343762 [0,1,0,0,0,1|2,0,0]=4 5579 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)F 1626a_102495364764_100015343762 [0,1,0,0,0,1|2,0,0]=4 5580 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Br 11a_100010008850_100015343762 [0,1,0,0,0,1|2,0,0]=4 5581 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Br 1626a_100010008850_100015343762 [0,1,0,0,0,1|2,0,0]=4 5582 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Cl 11a_200010381624_100015343762 [0,1,0,0,0,1|2,0,0]=4 5583 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Cl 1626a_200010381624_100015343762 [0,1,0,0,0,1|2,0,0]=4 5584 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)F 11a_100000037384_100015343762 [0,1,0,0,0,1|2,0,0]=4 5585 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)F 1626a_100000037384_100015343762 [0,1,0,0,0,1|2,0,0]=4 5586 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)I 11a_100015763296_100015343762 [0,1,0,0,0,1|2,0,0]=4 5587 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)I 1626a_100015763296_100015343762 [0,1,0,0,0,1|2,0,0]=4 5588 B13R1.885 CC(=O)Nc1c(ccc(c1O)Br)I 527a_100020748643_100103153847 [0,1,0,0,0,1|2,0,0]=4 5589 B13R1.885 Cc1ccc(c(c1Cl)CC(=O)[13CH3])F 1458a_100000038137_200025704644 [0,1,0,0,0,1|1,0,0]=3 5590 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])Cl 1458a_100000035286_200025704644 [0,1,0,0,0,1|1,0,0]=3 5591 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])F 1458a_100011218906_200025704644 [0,1,0,0,0,1|1,0,0]=3 5592 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200025704644 [0,1,0,0,0,1|2,0,0]=4 5593 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200025704644 [0,1,0,0,0,1|2,0,0]=4 5594 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200025704644 [0,1,0,0,0,1|2,0,0]=4 5595 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200025704644 [0,1,0,0,0,1|2,0,0]=4 5596 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200025704644 [0,1,0,0,0,1|2,0,0]=4 5597 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200025704644 [0,1,0,0,0,1|2,0,0]=4 5598 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)O 34a_100011215204_100000210625 [0,1,0,0,0,1|1,0,1]=4 5599 B13R1.894 Cc1ccc(c(c1)NS(=O)(=O)C)C 40a_100000185781_100000738038 [0,1,0,0,0,1|2,0,0]=4 5600 B13R1.894 Cc1ccc(c(c1)NS(=O)(=O)C)Cl 40a_100011215360_100000738038 [0,1,0,0,0,1|2,0,0]=4 5601 B13R1.894 Cc1ccc(c(c1)NS(=O)(=O)C)F 40a_100000211285_100000738038 [0,1,0,0,0,1|2,0,0]=4 5602 B13R1.894 Cc1ccc(c(c1)NS(=O)(=O)C)I 40a_100011216686_100000738038 [0,1,0,0,0,1|2,0,0]=4 5603 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)O 62a_100000211941_100000765521 [0,1,0,0,0,1|1,0,1]=4 5604 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)O 62a_100000765521_100000211941 [0,1,0,0,0,1|1,0,1]=4 5605 B13R1.897 CC(=C(C)c1cc(ccc1Br)C)C 271570a_200000049429_100012353751 [0,1,0,0,0,1|2,0,0]=4 5606 B13R1.897 CC(=C(C)c1cc(ccc1C)C)C 271570a_200000049429_100000210833 [0,1,0,0,0,1|2,0,0]=4 5607 B13R1.897 CC(=C(C)c1cc(ccc1Cl)C)C 271570a_200000049429_100012356289 [0,1,0,0,0,1|2,0,0]=4 5608 B13R1.897 CC(=C(C)c1cc(ccc1F)C)C 271570a_200000049429_100000736223 [0,1,0,0,0,1|2,0,0]=4 5609 B13R1.897 CC(=C(C)c1cc(ccc1N)C)C 271570a_200000049429_100000210942 [0,1,0,0,0,1|2,0,0]=4 5610 B13R1.897 CC(=C(C)c1cc(ccc1O)Br)C 271570a_200000049429_100012355227 [0,1,0,0,0,1|2,0,0]=4 5611 B13R1.897 CC(=C(C)c1cc(ccc1O)C)C 271570a_200000049429_100000765521 [0,1,0,0,0,1|1,0,0]=3 5612 B13R1.897 CC(=C(C)c1cc(ccc1O)Cl)C 271570a_200000049429_100011356953 [0,1,0,0,0,1|2,0,0]=4 5613 B13R1.897 CC(=C(C)c1cc(ccc1O)F)C 271570a_200000049429_100000211999 [0,1,0,0,0,1|2,0,0]=4 5614 B13R1.897 CC(=C(C)c1cc(ccc1O)N)C 271570a_200000049429_100011534360 [0,1,0,0,0,1|2,0,0]=4 5615 B13R1.897 CC(=C(C)c1cc(ccc1O)O)C 271570a_200000049429_100009813629 [0,1,0,0,0,1|2,0,0]=4 5616 B13R1.897 CC(=C(C)c1cc(cnc1O)C)C 271570a_200000049429_100000049931 [0,1,0,0,0,1|2,0,0]=4 5617 B13R1.897 CC(=C(C)c1cc(ncc1O)C)C 271570a_200000049429_100009843476 [0,1,0,0,0,1|2,0,0]=4 5618 B13R1.897 CC(=C(C)c1nc(ccc1O)C)C 271570a_200000049429_100000702858 [0,1,0,0,0,1|2,0,0]=4 5619 B13R1.897 CC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_200000210301 [0,1,0,0,0,1|1,0,0]=3 5620 B13R1.897 CC(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200000210301 [0,1,0,0,0,1|2,0,0]=4 5621 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)Cl 11a_100020633006_100015343762 [0,1,0,0,0,1|2,0,0]=4 5622 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)Cl 1626a_100020633006_100015343762 [0,1,0,0,0,1|2,0,0]=4 5623 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)F 11a_100020633008_100015343762 [0,1,0,0,0,1|2,0,0]=4 5624 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)F 1626a_100020633008_100015343762 [0,1,0,0,0,1|2,0,0]=4 5625 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100015343762 [0,1,0,0,0,1|2,0,0]=4 5626 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100015343762 [0,1,0,0,0,1|2,0,0]=4 5627 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100103153847 [0,1,0,0,0,1|2,0,0]=4 5628 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100015343762 [0,1,0,0,0,1|2,0,0]=4 5629 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100015343762 [0,1,0,0,0,1|2,0,0]=4 5630 B13R1.897 CC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100015343762 [0,1,0,0,0,1|2,0,0]=4 5631 B13R1.897 CC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100015343762 [0,1,0,0,0,1|2,0,0]=4 5632 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Br 11a_100011772073_100015343762 [0,1,0,0,0,1|2,0,0]=4 5633 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Br 1626a_100011772073_100015343762 [0,1,0,0,0,1|2,0,0]=4 5634 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Cl 11a_100000742562_100015343762 [0,1,0,0,0,1|2,0,0]=4 5635 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Cl 1626a_100000742562_100015343762 [0,1,0,0,0,1|2,0,0]=4 5636 B13R1.897 CC(=O)N(C)c1cc(ccc1F)Br 11a_100011314990_100015343762 [0,1,0,0,0,1|2,0,0]=4 5637 B13R1.897 CC(=O)N(C)c1cc(ccc1F)Br 1626a_100011314990_100015343762 [0,1,0,0,0,1|2,0,0]=4 5638 B13R1.897 Cc1ccc(c(c1)C(=O)C(C)C)O 1458a_100000229998_100000210206 [0,1,0,0,0,1|1,0,1]=4 5639 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)O 240690a_100102631434_100000229998 [0,1,0,0,0,1|2,0,0]=4 5640 B13R1.897 Cc1ccc(c(c1)C(=O)N(C)C)O 527a_100102631434_100000229998 [0,1,0,0,0,1|2,0,0]=4 5641 B13R1.897 Cc1ccc(c(c1)C(O)C(=O)[13CH3])C 1458a_100011497465_200025704644 [0,1,0,0,0,1|1,0,0]=3 5642 B13R1.897 [13CH3]C(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200025704644 [0,1,0,0,0,1|2,0,0]=4 5643 B13R1.2816 CC(=Cc1cc(cc(c1C)F)C)C 271570a_100102525489_100015473476 [0,1,0,0,0,1|2,0,0]=4 5644 B13R1.2816 CC(=Cc1cc(cc(c1C)N)C)C 271570a_100102525489_102495365385 [0,1,0,0,0,1|2,0,0]=4 5645 B13R1.2816 CC(=Cc1cc(cc(c1F)C)C)C 271570a_100102525489_200010204574 [0,1,0,0,0,1|2,0,0]=4 5646 B13R1.2816 CC(=Cc1cc(cc(c1F)F)C)C 271570a_100102525489_100010141297 [0,1,0,0,0,1|2,0,0]=4 5647 B13R1.2816 CC(=Cc1cc(cc(c1F)N)C)C 271570a_100102525489_100010589139 [0,1,0,0,0,1|2,0,0]=4 5648 B13R1.2816 CC(=Cc1cc(cc(c1N)C)C)C 271570a_100102525489_100000688863 [0,1,0,0,0,1|2,0,0]=4 5649 B13R1.2816 CC(=Cc1cc(cc(c1N)F)C)C 271570a_100102525489_100012353694 [0,1,0,0,0,1|2,0,0]=4 5650 B13R1.2816 CC(=Cc1cc(cc(c1N)N)C)C 271570a_100102525489_100012348275 [0,1,0,0,0,1|2,0,0]=4 5651 B13R1.2816 CC(=Cc1cc(cc(c1O)Br)F)C 271570a_100102525489_200013085147 [0,1,0,0,0,1|2,0,0]=4 5652 B13R1.2816 CC(=Cc1cc(cc(c1O)C)C)C 271570a_100102525489_100011934984 [0,1,0,0,0,1|1,0,0]=3 5653 B13R1.2816 CC(=Cc1cc(cc(c1O)C)Cl)C 271570a_100102525489_100012343667 [0,1,0,0,0,1|2,0,0]=4 5654 B13R1.2816 CC(=Cc1cc(cc(c1O)C)N)C 271570a_100102525489_100010064301 [0,1,0,0,0,1|2,0,0]=4 5655 B13R1.2816 CC(=Cc1cc(cc(c1O)Cl)Cl)C 271570a_100102525489_200012339341 [0,1,0,0,0,1|2,0,0]=4 5656 B13R1.2816 CC(=Cc1cc(cc(c1O)F)Br)C 271570a_100102525489_100013354677 [0,1,0,0,0,1|2,0,0]=4 5657 B13R1.2816 CC(=Cc1cc(cc(c1O)F)C)C 271570a_100102525489_200135191068 [0,1,0,0,0,1|1,0,0]=3 5658 B13R1.2816 CC(=Cc1cc(cc(c1O)F)F)C 271570a_100102525489_100000688693 [0,1,0,0,0,1|2,0,0]=4 5659 B13R1.2816 CC(=Cc1cc(cc(c1O)N)F)C 271570a_100102525489_200011217456 [0,1,0,0,0,1|2,0,0]=4 5660 B13R1.2816 CC(=O)Cc1cc(cc(c1Br)F)F 1458a_100000070787_100015714476 [0,1,0,0,0,1|2,0,0]=4 5661 B13R1.2816 CC(=O)Cc1cc(cc(c1Cl)Br)I 1458a_100000070787_100021522891 [0,1,0,0,0,1|2,0,0]=4 5662 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)C 1458a_100000070787_100015889675 [0,1,0,0,0,1|1,0,0]=3 5663 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100000070787_100009813678 [0,1,0,0,0,1|2,0,0]=4 5664 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200000210301 [0,1,0,0,0,1|2,0,0]=4 5665 B13R1.2816 CC(=O)Cc1cc(cc(c1I)I)I 1458a_100000070787_100010206063 [0,1,0,0,0,1|2,0,0]=4 5666 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Br)Br 1458a_100000070787_200009814416 [0,1,0,0,0,1|1,0,0]=3 5667 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200000210301 [0,1,0,0,0,1|1,0,0]=3 5668 B13R1.2816 CC(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200000210301 [0,1,0,0,0,1|1,0,0]=3 5669 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)Cl)Cl 11a_200010220950_100015343762 [0,1,0,0,0,1|2,0,0]=4 5670 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)Cl)Cl 1626a_200010220950_100015343762 [0,1,0,0,0,1|2,0,0]=4 5671 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)F)F 11a_100000716482_100015343762 [0,1,0,0,0,1|2,0,0]=4 5672 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)F)F 1626a_100000716482_100015343762 [0,1,0,0,0,1|2,0,0]=4 5673 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 11a_100010206801_100015343762 [0,1,0,0,0,1|2,0,0]=4 5674 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 1626a_100010206801_100015343762 [0,1,0,0,0,1|2,0,0]=4 5675 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 527a_100010206801_100103153847 [0,1,0,0,0,1|2,0,0]=4 5676 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 11a_102495365385_100015343762 [0,1,0,0,0,1|1,0,0]=3 5677 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 1626a_102495365385_100015343762 [0,1,0,0,0,1|1,0,0]=3 5678 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 22a_102495365385_100000070787 [0,1,0,0,0,1|1,0,0]=3 5679 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 527a_102495365385_100103153847 [0,1,0,0,0,1|1,0,0]=3 5680 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 11a_100010063005_100015343762 [0,1,0,0,0,1|2,0,0]=4 5681 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 1626a_100010063005_100015343762 [0,1,0,0,0,1|2,0,0]=4 5682 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 527a_100010063005_100103153847 [0,1,0,0,0,1|2,0,0]=4 5683 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 11a_100009814351_100015343762 [0,1,0,0,0,1|2,0,0]=4 5684 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 1626a_100009814351_100015343762 [0,1,0,0,0,1|2,0,0]=4 5685 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 22a_100009814351_100000070787 [0,1,0,0,0,1|2,0,0]=4 5686 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 527a_100009814351_100103153847 [0,1,0,0,0,1|2,0,0]=4 5687 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 11a_100000035412_100015343762 [0,1,0,0,0,1|1,0,0]=3 5688 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 1626a_100000035412_100015343762 [0,1,0,0,0,1|1,0,0]=3 5689 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 22a_100000035412_100000070787 [0,1,0,0,0,1|1,0,0]=3 5690 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Cl)Cl 11a_200009956477_100015343762 [0,1,0,0,0,1|2,0,0]=4 5691 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Cl)Cl 1626a_200009956477_100015343762 [0,1,0,0,0,1|2,0,0]=4 5692 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 11a_100009813729_100015343762 [0,1,0,0,0,1|2,0,0]=4 5693 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 1626a_100009813729_100015343762 [0,1,0,0,0,1|2,0,0]=4 5694 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 527a_100009813729_100103153847 [0,1,0,0,0,1|2,0,0]=4 5695 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 11a_200000050010_100015343762 [0,1,0,0,0,1|2,0,0]=4 5696 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 1626a_200000050010_100015343762 [0,1,0,0,0,1|2,0,0]=4 5697 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 527a_200000050010_100103153847 [0,1,0,0,0,1|2,0,0]=4 5698 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)Cl)Cl 11a_106623411496_100015343762 [0,1,0,0,0,1|2,0,0]=4 5699 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)Cl)Cl 1626a_106623411496_100015343762 [0,1,0,0,0,1|2,0,0]=4 5700 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)F)F 11a_100000037168_100015343762 [0,1,0,0,0,1|2,0,0]=4 5701 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)F)F 1626a_100000037168_100015343762 [0,1,0,0,0,1|2,0,0]=4 5702 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 11a_100010589139_100015343762 [0,1,0,0,0,1|1,0,0]=3 5703 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 1626a_100010589139_100015343762 [0,1,0,0,0,1|1,0,0]=3 5704 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 22a_100010589139_100000070787 [0,1,0,0,0,1|1,0,0]=3 5705 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)Cl 11a_100010110407_100015343762 [0,1,0,0,0,1|2,0,0]=4 5706 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)Cl 1626a_100010110407_100015343762 [0,1,0,0,0,1|2,0,0]=4 5707 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 11a_100000722353_100015343762 [0,1,0,0,0,1|2,0,0]=4 5708 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 1626a_100000722353_100015343762 [0,1,0,0,0,1|2,0,0]=4 5709 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 22a_100000722353_100000070787 [0,1,0,0,0,1|2,0,0]=4 5710 B13R1.2816 CC(=O)Nc1cc(cc(c1F)C)Br 11a_100010381932_100015343762 [0,1,0,0,0,1|2,0,0]=4 5711 B13R1.2816 CC(=O)Nc1cc(cc(c1F)C)Br 1626a_100010381932_100015343762 [0,1,0,0,0,1|2,0,0]=4 5712 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Cl)Cl 11a_100010713094_100015343762 [0,1,0,0,0,1|2,0,0]=4 5713 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Cl)Cl 1626a_100010713094_100015343762 [0,1,0,0,0,1|2,0,0]=4 5714 B13R1.2816 CC(=O)Nc1cc(cc(c1F)F)F 11a_100000037171_100015343762 [0,1,0,0,0,1|2,0,0]=4 5715 B13R1.2816 CC(=O)Nc1cc(cc(c1F)F)F 1626a_100000037171_100015343762 [0,1,0,0,0,1|2,0,0]=4 5716 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)Cl 11a_100011155807_100015343762 [0,1,0,0,0,1|2,0,0]=4 5717 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)Cl 1626a_100011155807_100015343762 [0,1,0,0,0,1|2,0,0]=4 5718 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)F 11a_200010740111_100015343762 [0,1,0,0,0,1|2,0,0]=4 5719 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)F 1626a_200010740111_100015343762 [0,1,0,0,0,1|2,0,0]=4 5720 B13R1.2816 CC(=O)Nc1cc(cc(c1I)C)Cl 11a_100000698757_100015343762 [0,1,0,0,0,1|2,0,0]=4 5721 B13R1.2816 CC(=O)Nc1cc(cc(c1I)C)Cl 1626a_100000698757_100015343762 [0,1,0,0,0,1|2,0,0]=4 5722 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)C 11a_100021129147_100015343762 [0,1,0,0,0,1|1,0,0]=3 5723 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)C 1626a_100021129147_100015343762 [0,1,0,0,0,1|1,0,0]=3 5724 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)Cl 11a_200021297760_100015343762 [0,1,0,0,0,1|2,0,0]=4 5725 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)Cl 1626a_200021297760_100015343762 [0,1,0,0,0,1|2,0,0]=4 5726 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)F 11a_100016149863_100015343762 [0,1,0,0,0,1|2,0,0]=4 5727 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)F 1626a_100016149863_100015343762 [0,1,0,0,0,1|2,0,0]=4 5728 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 22a_100010781877_100000070787 [0,1,0,0,0,1|1,0,0]=3 5729 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 527a_100010781877_100103153847 [0,1,0,0,0,1|1,0,0]=3 5730 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 22a_106741647128_100000070787 [0,1,0,0,0,1|1,0,0]=3 5731 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 527a_106741647128_100103153847 [0,1,0,0,0,1|1,0,0]=3 5732 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 22a_200011217456_100000070787 [0,1,0,0,0,1|1,0,0]=3 5733 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 527a_200011217456_100103153847 [0,1,0,0,0,1|1,0,0]=3 5734 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 11a_100011825904_100015343762 [0,1,0,0,0,1|1,0,0]=3 5735 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 22a_100011825904_100000070787 [0,1,0,0,0,1|1,0,0]=3 5736 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 527a_100011825904_100103153847 [0,1,0,0,0,1|1,0,0]=3 5737 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 11a_100011216242_100015343762 [0,1,0,0,0,1|0,0,0]=2 5738 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 22a_100011216242_100000070787 [0,1,0,0,0,1|0,0,0]=2 5739 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 527a_100011216242_100103153847 [0,1,0,0,0,1|0,0,0]=2 5740 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 11a_100000130126_100015343762 [0,1,0,0,0,1|1,0,0]=3 5741 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 22a_100000130126_100000070787 [0,1,0,0,0,1|1,0,0]=3 5742 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 527a_100000130126_100103153847 [0,1,0,0,0,1|1,0,0]=3 5743 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 22a_100000694353_100000070787 [0,1,0,0,0,1|1,0,0]=3 5744 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 527a_100000694353_100103153847 [0,1,0,0,0,1|1,0,0]=3 5745 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 22a_100000695819_100000070787 [0,1,0,0,0,1|1,0,0]=3 5746 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 527a_100000695819_100103153847 [0,1,0,0,0,1|1,0,0]=3 5747 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 22a_100011217383_100000070787 [0,1,0,0,0,1|1,0,0]=3 5748 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 527a_100011217383_100103153847 [0,1,0,0,0,1|1,0,0]=3 5749 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 1626a_100015205836_100015343762 [0,1,0,0,0,1|1,0,0]=3 5750 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 22a_100015205836_100000070787 [0,1,0,0,0,1|1,0,0]=3 5751 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 527a_100015205836_100103153847 [0,1,0,0,0,1|1,0,0]=3 5752 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000070787 [0,1,0,0,0,1|1,0,0]=3 5753 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 527a_100016071998_100103153847 [0,1,0,0,0,1|1,0,0]=3 5754 B13R1.2816 Cc1cc(c(c(c1)NC(C)C)O)C 34a_100011216242_100000210206 [0,1,0,0,0,1|1,0,1]=4 5755 B13R1.2816 Cc1cc(c(c(c1)NC(C)C)O)C 7a_100011216242_100000210206 [0,1,0,0,0,1|1,0,1]=4 5756 B13R1.2816 Cc1cc(c(c(c1)SC(C)C)O)C 62a_100000210206_100011934984 [0,1,0,0,0,1|1,0,1]=4 5757 B13R1.2816 Cc1cc(c(c(c1)SC(C)C)O)C 62a_100011934984_100000210206 [0,1,0,0,0,1|1,0,1]=4 5758 B13R1.2816 Cc1cc(c(c(c1)SC(C)C)O)F 62a_100000210206_200135191068 [0,1,0,0,0,1|1,0,1]=4 5759 B13R1.2816 Cc1cc(c(c(c1)SC(C)C)O)F 62a_200135191068_100000210206 [0,1,0,0,0,1|1,0,1]=4 5760 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200025704644 [0,1,0,0,0,1|2,0,0]=4 5761 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200025704644 [0,1,0,0,0,1|1,0,0]=3 5762 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200025704644 [0,1,0,0,0,1|1,0,0]=3 5763 B13R1.2872 C#CC(=O)Cc1cc(ccc1C)C 1458a_100000211873_100000184699 [0,1,0,0,0,1|1,0,1]=4 5764 B13R1.2872 C#CC(=O)Cc1cc(ccc1Cl)C 1458a_100000211873_100009871730 [0,1,0,0,0,1|1,0,1]=4 5765 B13R1.2872 C#CC(=O)Cc1cc(ccc1F)C 1458a_100000211873_100011260760 [0,1,0,0,0,1|1,0,1]=4 5766 B13R1.2872 C#CC(=O)Cc1cc(ccc1O)F 1458a_100000211873_100010161318 [0,1,0,0,0,1|1,0,1]=4 5767 B13R1.2872 C#CC(=O)Cc1nc(ccc1O)C 1458a_100000211873_100020630696 [0,1,0,0,0,1|1,0,1]=4 5768 B13R1.2872 C#CC(C)Nc1cc(ccc1O)C 34a_100011215204_200000035995 [0,1,0,0,0,1|1,0,1]=4 5769 B13R1.2872 C#CC(C)Sc1cc(ccc1O)C 62a_200000035995_100000765521 [0,1,0,0,0,1|1,0,1]=4 5770 B13R1.2872 C=CC(=O)Cc1cc(ccc1C)C 1458a_100000185746_100000184699 [0,1,0,0,0,1|1,0,1]=4 5771 B13R1.2872 C=CC(=O)Cc1cc(ccc1Cl)C 1458a_100000185746_100009871730 [0,1,0,0,0,1|1,0,1]=4 5772 B13R1.2872 C=CC(=O)Cc1cc(ccc1F)C 1458a_100000185746_100011260760 [0,1,0,0,0,1|1,0,1]=4 5773 B13R1.2872 C=CC(=O)Cc1cc(ccc1O)F 1458a_100000185746_100010161318 [0,1,0,0,0,1|1,0,1]=4 5774 B13R1.2872 C=CC(=O)Cc1nc(ccc1O)C 1458a_100000185746_100020630696 [0,1,0,0,0,1|1,0,1]=4 5775 B13R1.2872 C=CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000185746 [0,1,0,0,0,1|1,0,1]=4 5776 B13R1.2872 C=CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000185746 [0,1,0,0,0,1|1,0,1]=4 5777 B13R1.2872 C=CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000185746 [0,1,0,0,0,1|1,0,1]=4 5778 B13R1.2872 C=CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000185746 [0,1,0,0,0,1|1,0,1]=4 5779 B13R1.2872 C=CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000185746 [0,1,0,0,0,1|1,0,1]=4 5780 B13R1.2872 C=CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000185746 [0,1,0,0,0,1|1,0,1]=4 5781 B13R1.2872 C=CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000185746 [0,1,0,0,0,1|1,0,1]=4 5782 B13R1.2872 C=CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000185746 [0,1,0,0,0,1|1,0,1]=4 5783 B13R1.2872 C=CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000185746 [0,1,0,0,0,1|1,0,1]=4 5784 B13R1.2872 C=CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000185746 [0,1,0,0,0,1|0,0,1]=3 5785 B13R1.2872 C=CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000185746 [0,1,0,0,0,1|1,0,1]=4 5786 B13R1.2872 C=CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000185746 [0,1,0,0,0,1|1,0,1]=4 5787 B13R1.2872 C=CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000185746 [0,1,0,0,0,1|1,0,1]=4 5788 B13R1.2872 C=CC(C)Sc1cc(ccc1O)C 62a_100011215867_100000765521 [0,1,0,0,0,1|1,0,1]=4 5789 B13R1.2872 CC(=Cc1cc(ccc1F)C)C#N 6a_100000756917_200000212204 [0,1,0,0,0,1|2,0,0]=4 5790 B13R1.2872 CC(=Cc1cc(ccc1I)C)C#N 6a_100010150105_200000212204 [0,1,0,0,0,1|2,0,0]=4 5791 B13R1.2872 CC(=Cc1cc(ccc1O)I)C#N 6a_100011215628_200000212204 [0,1,0,0,0,1|2,0,0]=4 5792 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100000210414_100011982794 [0,1,0,0,0,1|2,0,0]=4 5793 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210202 [0,1,0,0,0,1|2,0,0]=4 5794 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210202 [0,1,0,0,0,1|1,0,0]=3 5795 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000210414_100000733903 [0,1,0,0,0,1|2,0,0]=4 5796 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210202 [0,1,0,0,0,1|2,0,0]=4 5797 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000210414_100000736370 [0,1,0,0,0,1|2,0,0]=4 5798 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210202 [0,1,0,0,0,1|2,0,0]=4 5799 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)I 1458a_100000210414_100012355412 [0,1,0,0,0,1|2,0,0]=4 5800 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210202 [0,1,0,0,0,1|2,0,0]=4 5801 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000210414_100000184699 [0,1,0,0,0,1|1,0,0]=3 5802 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210202 [0,1,0,0,0,1|1,0,0]=3 5803 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Cl 1458a_100000210414_100012186985 [0,1,0,0,0,1|2,0,0]=4 5804 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100000210414_100000709795 [0,1,0,0,0,1|2,0,0]=4 5805 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210202 [0,1,0,0,0,1|2,0,0]=4 5806 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000210414_100000763347 [0,1,0,0,0,1|2,0,0]=4 5807 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210202 [0,1,0,0,0,1|2,0,0]=4 5808 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)C 1458a_100000210414_100009871730 [0,1,0,0,0,1|1,0,0]=3 5809 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000210414_100000754809 [0,1,0,0,0,1|2,0,0]=4 5810 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210202 [0,1,0,0,0,1|2,0,0]=4 5811 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100000210414_100000709952 [0,1,0,0,0,1|2,0,0]=4 5812 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210202 [0,1,0,0,0,1|2,0,0]=4 5813 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)I 1458a_100000210414_100010188191 [0,1,0,0,0,1|2,0,0]=4 5814 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000210414_100000736399 [0,1,0,0,0,1|2,0,0]=4 5815 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210202 [0,1,0,0,0,1|2,0,0]=4 5816 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100000210414_100011260760 [0,1,0,0,0,1|1,0,0]=3 5817 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210202 [0,1,0,0,0,1|1,0,0]=3 5818 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100000210414_100000716957 [0,1,0,0,0,1|2,0,0]=4 5819 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210202 [0,1,0,0,0,1|2,0,0]=4 5820 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000210414_100000741279 [0,1,0,0,0,1|2,0,0]=4 5821 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210202 [0,1,0,0,0,1|2,0,0]=4 5822 B13R1.2872 CCC(=O)Cc1cc(ccc1F)I 1458a_100000210414_200010149601 [0,1,0,0,0,1|2,0,0]=4 5823 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Br 1458a_100000210414_100012362523 [0,1,0,0,0,1|2,0,0]=4 5824 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Cl 1458a_100000210414_100012348826 [0,1,0,0,0,1|2,0,0]=4 5825 B13R1.2872 CCC(=O)Cc1cc(ccc1I)F 1458a_100000210414_100010149606 [0,1,0,0,0,1|2,0,0]=4 5826 B13R1.2872 CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210202 [0,1,0,0,0,1|1,0,0]=3 5827 B13R1.2872 CCC(=O)Cc1cc(ccc1O)F 1458a_100000210414_100010161318 [0,1,0,0,0,1|1,0,0]=3 5828 B13R1.2872 CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210202 [0,1,0,0,0,1|1,0,0]=3 5829 B13R1.2872 CCC(=O)Cc1nc(ccc1Cl)C 1458a_100000210414_200009852033 [0,1,0,0,0,1|2,0,0]=4 5830 B13R1.2872 CCC(=O)Cc1nc(ccc1O)C 1458a_100000210414_100020630696 [0,1,0,0,0,1|1,0,0]=3 5831 B13R1.2872 CCC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_100000210202 [0,1,0,0,0,1|1,0,1]=4 5832 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000210414 [0,1,0,0,0,1|2,0,0]=4 5833 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000210414 [0,1,0,0,0,1|2,0,0]=4 5834 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000210414 [0,1,0,0,0,1|1,0,0]=3 5835 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000210414 [0,1,0,0,0,1|1,0,0]=3 5836 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000210414 [0,1,0,0,0,1|2,0,0]=4 5837 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000210414 [0,1,0,0,0,1|2,0,0]=4 5838 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000210414 [0,1,0,0,0,1|2,0,0]=4 5839 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000210414 [0,1,0,0,0,1|2,0,0]=4 5840 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000210414 [0,1,0,0,0,1|2,0,0]=4 5841 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000210414 [0,1,0,0,0,1|2,0,0]=4 5842 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000210414 [0,1,0,0,0,1|2,0,0]=4 5843 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000210414 [0,1,0,0,0,1|2,0,0]=4 5844 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000210414 [0,1,0,0,0,1|2,0,0]=4 5845 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000210414 [0,1,0,0,0,1|2,0,0]=4 5846 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000210414 [0,1,0,0,0,1|2,0,0]=4 5847 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000210414 [0,1,0,0,0,1|2,0,0]=4 5848 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000210414 [0,1,0,0,0,1|1,0,0]=3 5849 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000210414 [0,1,0,0,0,1|1,0,0]=3 5850 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000210414 [0,1,0,0,0,1|1,0,0]=3 5851 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000210414 [0,1,0,0,0,1|2,0,0]=4 5852 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000210414 [0,1,0,0,0,1|2,0,0]=4 5853 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000210414 [0,1,0,0,0,1|2,0,0]=4 5854 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000210414 [0,1,0,0,0,1|2,0,0]=4 5855 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000210414 [0,1,0,0,0,1|2,0,0]=4 5856 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000210414 [0,1,0,0,0,1|2,0,0]=4 5857 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000210414 [0,1,0,0,0,1|2,0,0]=4 5858 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000210414 [0,1,0,0,0,1|2,0,0]=4 5859 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000210414 [0,1,0,0,0,1|2,0,0]=4 5860 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000210414 [0,1,0,0,0,1|2,0,0]=4 5861 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000210414 [0,1,0,0,0,1|2,0,0]=4 5862 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000210414 [0,1,0,0,0,1|2,0,0]=4 5863 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000210414 [0,1,0,0,0,1|2,0,0]=4 5864 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000210414 [0,1,0,0,0,1|2,0,0]=4 5865 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000210414 [0,1,0,0,0,1|2,0,0]=4 5866 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000210414 [0,1,0,0,0,1|1,0,0]=3 5867 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000210414 [0,1,0,0,0,1|1,0,0]=3 5868 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000210414 [0,1,0,0,0,1|1,0,0]=3 5869 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000210414 [0,1,0,0,0,1|2,0,0]=4 5870 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000210414 [0,1,0,0,0,1|2,0,0]=4 5871 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000210414 [0,1,0,0,0,1|2,0,0]=4 5872 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000210414 [0,1,0,0,0,1|2,0,0]=4 5873 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000210414 [0,1,0,0,0,1|2,0,0]=4 5874 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000210414 [0,1,0,0,0,1|2,0,0]=4 5875 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000210414 [0,1,0,0,0,1|2,0,0]=4 5876 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000210414 [0,1,0,0,0,1|2,0,0]=4 5877 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000210414 [0,1,0,0,0,1|2,0,0]=4 5878 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000210414 [0,1,0,0,0,1|2,0,0]=4 5879 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000210414 [0,1,0,0,0,1|1,0,0]=3 5880 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000210414 [0,1,0,0,0,1|1,0,0]=3 5881 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000210414 [0,1,0,0,0,1|1,0,0]=3 5882 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000210414 [0,1,0,0,0,1|1,0,0]=3 5883 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000210414 [0,1,0,0,0,1|2,0,0]=4 5884 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000210414 [0,1,0,0,0,1|2,0,0]=4 5885 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000210414 [0,1,0,0,0,1|2,0,0]=4 5886 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000210414 [0,1,0,0,0,1|2,0,0]=4 5887 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000210414 [0,1,0,0,0,1|2,0,0]=4 5888 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000210414 [0,1,0,0,0,1|2,0,0]=4 5889 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000210414 [0,1,0,0,0,1|2,0,0]=4 5890 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000210414 [0,1,0,0,0,1|2,0,0]=4 5891 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000210414 [0,1,0,0,0,1|2,0,0]=4 5892 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000210414 [0,1,0,0,0,1|2,0,0]=4 5893 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000210414 [0,1,0,0,0,1|2,0,0]=4 5894 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000210414 [0,1,0,0,0,1|2,0,0]=4 5895 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000210414 [0,1,0,0,0,1|1,0,0]=3 5896 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000210414 [0,1,0,0,0,1|1,0,0]=3 5897 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000210414 [0,1,0,0,0,1|2,0,0]=4 5898 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000210414 [0,1,0,0,0,1|2,0,0]=4 5899 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000210414 [0,1,0,0,0,1|2,0,0]=4 5900 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000210414 [0,1,0,0,0,1|2,0,0]=4 5901 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000210414 [0,1,0,0,0,1|2,0,0]=4 5902 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000210414 [0,1,0,0,0,1|1,0,0]=3 5903 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000210414 [0,1,0,0,0,1|1,0,0]=3 5904 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000210414 [0,1,0,0,0,1|0,0,0]=2 5905 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000210414 [0,1,0,0,0,1|0,0,0]=2 5906 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000210414 [0,1,0,0,0,1|1,0,0]=3 5907 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000210414 [0,1,0,0,0,1|1,0,0]=3 5908 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000210414 [0,1,0,0,0,1|1,0,0]=3 5909 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000210414 [0,1,0,0,0,1|1,0,0]=3 5910 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000210414 [0,1,0,0,0,1|1,0,0]=3 5911 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000210414 [0,1,0,0,0,1|1,0,0]=3 5912 B13R1.2872 CCC(C)Nc1cc(ccc1O)C 34a_100011215204_100011215416 [0,1,0,0,0,1|1,0,1]=4 5913 B13R1.2872 CCC(C)Sc1cc(ccc1O)C 62a_100000758301_100000765521 [0,1,0,0,0,1|1,0,1]=4 5914 B13R1.2872 CCC(C)Sc1cc(ccc1O)C 62a_100000765521_100000758301 [0,1,0,0,0,1|1,0,1]=4 5915 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 11a_106832991635_100010004897 [0,1,0,0,0,1|2,0,0]=4 5916 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 240690a_100102657272_100010004897 [0,1,0,0,0,1|2,0,0]=4 5917 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 527a_100102657272_100010004897 [0,1,0,0,0,1|2,0,0]=4 5918 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 11a_106832991635_100010004923 [0,1,0,0,0,1|1,0,0]=3 5919 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 1626a_100102657272_100010004923 [0,1,0,0,0,1|1,0,0]=3 5920 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 240690a_100102657272_100010004923 [0,1,0,0,0,1|1,0,0]=3 5921 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 527a_100102657272_100010004923 [0,1,0,0,0,1|1,0,0]=3 5922 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 11a_106832991635_100000690875 [0,1,0,0,0,1|2,0,0]=4 5923 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 1626a_100102657272_100000690875 [0,1,0,0,0,1|2,0,0]=4 5924 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 240690a_100102657272_100000690875 [0,1,0,0,0,1|2,0,0]=4 5925 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 527a_100102657272_100000690875 [0,1,0,0,0,1|2,0,0]=4 5926 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 11a_106832991635_100000690878 [0,1,0,0,0,1|2,0,0]=4 5927 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 1626a_100102657272_100000690878 [0,1,0,0,0,1|2,0,0]=4 5928 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 240690a_100102657272_100000690878 [0,1,0,0,0,1|2,0,0]=4 5929 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 527a_100102657272_100000690878 [0,1,0,0,0,1|2,0,0]=4 5930 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 11a_106832991635_100010244045 [0,1,0,0,0,1|2,0,0]=4 5931 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 1626a_100102657272_100010244045 [0,1,0,0,0,1|2,0,0]=4 5932 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 240690a_100102657272_100010244045 [0,1,0,0,0,1|2,0,0]=4 5933 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 527a_100102657272_100010244045 [0,1,0,0,0,1|2,0,0]=4 5934 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 11a_106832991635_100000749331 [0,1,0,0,0,1|1,0,0]=3 5935 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 1626a_100102657272_100000749331 [0,1,0,0,0,1|1,0,0]=3 5936 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 240690a_100102657272_100000749331 [0,1,0,0,0,1|1,0,0]=3 5937 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 527a_100102657272_100000749331 [0,1,0,0,0,1|1,0,0]=3 5938 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 11a_106832991635_100011219217 [0,1,0,0,0,1|2,0,0]=4 5939 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 1626a_100102657272_100011219217 [0,1,0,0,0,1|2,0,0]=4 5940 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 240690a_100102657272_100011219217 [0,1,0,0,0,1|2,0,0]=4 5941 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 527a_100102657272_100011219217 [0,1,0,0,0,1|2,0,0]=4 5942 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 11a_106832991635_100011600618 [0,1,0,0,0,1|2,0,0]=4 5943 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 1626a_100102657272_100011600618 [0,1,0,0,0,1|2,0,0]=4 5944 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 240690a_100102657272_100011600618 [0,1,0,0,0,1|2,0,0]=4 5945 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 527a_100102657272_100011600618 [0,1,0,0,0,1|2,0,0]=4 5946 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 11a_106832991635_100000748246 [0,1,0,0,0,1|2,0,0]=4 5947 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100102657272_100000748246 [0,1,0,0,0,1|2,0,0]=4 5948 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100102657272_100000748246 [0,1,0,0,0,1|2,0,0]=4 5949 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 527a_100102657272_100000748246 [0,1,0,0,0,1|2,0,0]=4 5950 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 11a_106832991635_100011830335 [0,1,0,0,0,1|2,0,0]=4 5951 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 1626a_100102657272_100011830335 [0,1,0,0,0,1|2,0,0]=4 5952 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 240690a_100102657272_100011830335 [0,1,0,0,0,1|2,0,0]=4 5953 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 527a_100102657272_100011830335 [0,1,0,0,0,1|2,0,0]=4 5954 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 11a_106832991635_100000690877 [0,1,0,0,0,1|2,0,0]=4 5955 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 1626a_100102657272_100000690877 [0,1,0,0,0,1|2,0,0]=4 5956 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 240690a_100102657272_100000690877 [0,1,0,0,0,1|2,0,0]=4 5957 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 527a_100102657272_100000690877 [0,1,0,0,0,1|2,0,0]=4 5958 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 11a_106832991635_100011667363 [0,1,0,0,0,1|1,0,0]=3 5959 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 1626a_100102657272_100011667363 [0,1,0,0,0,1|1,0,0]=3 5960 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 240690a_100102657272_100011667363 [0,1,0,0,0,1|1,0,0]=3 5961 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 527a_100102657272_100011667363 [0,1,0,0,0,1|1,0,0]=3 5962 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 11a_106832991635_100011217548 [0,1,0,0,0,1|2,0,0]=4 5963 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 1626a_100102657272_100011217548 [0,1,0,0,0,1|2,0,0]=4 5964 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 240690a_100102657272_100011217548 [0,1,0,0,0,1|2,0,0]=4 5965 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 527a_100102657272_100011217548 [0,1,0,0,0,1|2,0,0]=4 5966 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 11a_106832991635_100000762760 [0,1,0,0,0,1|2,0,0]=4 5967 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 1626a_100102657272_100000762760 [0,1,0,0,0,1|2,0,0]=4 5968 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 240690a_100102657272_100000762760 [0,1,0,0,0,1|2,0,0]=4 5969 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 527a_100102657272_100000762760 [0,1,0,0,0,1|2,0,0]=4 5970 B13R1.2872 CNC(=O)Cc1cc(ccc1O)Br 240690a_100102657272_100010072483 [0,1,0,0,0,1|1,0,0]=3 5971 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 11a_106832991635_100009850670 [0,1,0,0,0,1|1,0,1]=4 5972 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 1626a_100102657272_100009850670 [0,1,0,0,0,1|1,0,1]=4 5973 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 240690a_100102657272_100009850670 [0,1,0,0,0,1|1,0,1]=4 5974 B13R1.2872 CNC(=O)Cn1cc(ccc1=O)C 527a_100102657272_100009850670 [0,1,0,0,0,1|1,0,1]=4 5975 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100102657272 [0,1,0,0,0,1|2,0,0]=4 5976 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100102657272 [0,1,0,0,0,1|1,0,0]=3 5977 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100102657272 [0,1,0,0,0,1|2,0,0]=4 5978 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100102657272 [0,1,0,0,0,1|2,0,0]=4 5979 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100102657272 [0,1,0,0,0,1|2,0,0]=4 5980 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100102657272 [0,1,0,0,0,1|2,0,0]=4 5981 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100102657272 [0,1,0,0,0,1|2,0,0]=4 5982 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100102657272 [0,1,0,0,0,1|2,0,0]=4 5983 B13R1.2872 CNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100102657272 [0,1,0,0,0,1|1,0,0]=3 5984 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100102657272 [0,1,0,0,0,1|2,0,0]=4 5985 B13R1.2872 CNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100102657272 [0,1,0,0,0,1|2,0,0]=4 5986 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100102657272 [0,1,0,0,0,1|2,0,0]=4 5987 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100102657272 [0,1,0,0,0,1|2,0,0]=4 5988 B13R1.2872 CNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100102657272 [0,1,0,0,0,1|2,0,0]=4 5989 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100102657272 [0,1,0,0,0,1|1,0,0]=3 5990 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100102657272 [0,1,0,0,0,1|2,0,0]=4 5991 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100102657272 [0,1,0,0,0,1|2,0,0]=4 5992 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100102657272 [0,1,0,0,0,1|2,0,0]=4 5993 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100102657272 [0,1,0,0,0,1|2,0,0]=4 5994 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100102657272 [0,1,0,0,0,1|2,0,0]=4 5995 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100102657272 [0,1,0,0,0,1|2,0,0]=4 5996 B13R1.2872 CNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100102657272 [0,1,0,0,0,1|1,0,0]=3 5997 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100102657272 [0,1,0,0,0,1|2,0,0]=4 5998 B13R1.2872 CNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100102657272 [0,1,0,0,0,1|2,0,0]=4 5999 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100102657272 [0,1,0,0,0,1|2,0,0]=4 6000 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100102657272 [0,1,0,0,0,1|2,0,0]=4 6001 B13R1.2872 CNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100102657272 [0,1,0,0,0,1|2,0,0]=4 6002 B13R1.2872 CNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100102657272 [0,1,0,0,0,1|2,0,0]=4 6003 B13R1.2872 CNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100102657272 [0,1,0,0,0,1|1,0,0]=3 6004 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100102657272 [0,1,0,0,0,1|2,0,0]=4 6005 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100102657272 [0,1,0,0,0,1|2,0,0]=4 6006 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100102657272 [0,1,0,0,0,1|1,0,0]=3 6007 B13R1.2872 CNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100102657272 [0,1,0,0,0,1|0,0,0]=2 6008 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100102657272 [0,1,0,0,0,1|1,0,0]=3 6009 B13R1.2872 CNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100102657272 [0,1,0,0,0,1|1,0,0]=3 6010 B13R1.2872 CNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100102657272 [0,1,0,0,0,1|1,0,0]=3 6011 B13R1.2872 COC(=O)Cc1cc(ccc1O)O 271570a_203496583355_100010185610 [0,1,0,0,0,1|1,0,0]=3 6012 B13R1.2872 COC(C)Sc1cc(ccc1O)C 62a_100000765521_100009879195 [0,1,0,0,0,1|0,0,2]=4 6013 B13R1.2872 COC(C)Sc1cc(ccc1O)C 62a_100009879195_100000765521 [0,1,0,0,0,1|0,0,2]=4 6014 B13R1.2872 Cc1ccc(=O)n(c1)CC(=O)CF 1458a_100009850670_100015361967 [0,1,0,0,0,1|1,0,1]=4 6015 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)Br 1458a_100010004923_100015361967 [0,1,0,0,0,1|1,0,0]=3 6016 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)C 1458a_100000749331_100015361967 [0,1,0,0,0,1|1,0,0]=3 6017 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)F 1458a_100011667363_100015361967 [0,1,0,0,0,1|1,0,0]=3 6018 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)C 1458a_100000210174_100000184699 [0,1,0,0,0,1|1,0,0]=3 6019 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)Cl 1458a_100000210174_100009871730 [0,1,0,0,0,1|1,0,0]=3 6020 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)F 1458a_100000210174_100011260760 [0,1,0,0,0,1|1,0,0]=3 6021 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)C 22a_100000185781_100000210174 [0,1,0,0,0,1|1,0,0]=3 6022 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)Cl 22a_100011215360_100000210174 [0,1,0,0,0,1|1,0,0]=3 6023 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)F 22a_100000211285_100000210174 [0,1,0,0,0,1|1,0,0]=3 6024 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)F 527a_100000211285_100000210174 [0,1,0,0,0,1|1,0,0]=3 6025 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)O 22a_100011215204_100000210174 [0,1,0,0,0,1|0,0,0]=2 6026 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)O 527a_100011215204_100000210174 [0,1,0,0,0,1|0,0,0]=2 6027 B13R1.2872 Cc1ccc(c(c1)NC(C)CO)O 34a_100011215204_100012180447 [0,1,0,0,0,1|0,0,2]=4 6028 B13R1.2872 Cc1ccc(c(c1)SC(C)C#N)O 62a_100000703298_100000765521 [0,1,0,0,0,1|1,0,1]=4 6029 B13R1.2872 Cc1ccc(c(c1)SC(C)C#N)O 62a_100000765521_100000703298 [0,1,0,0,0,1|1,0,1]=4 6030 B13R1.2872 Cc1ccc(c(c1)SC(C)CO)O 62a_100012180447_100000765521 [0,1,0,0,0,1|0,0,2]=4 6031 B13R1.2872 Cc1ccc(c(c1)S[C@H](C)CO)O 62a_100000765521_100016084084 [0,1,0,0,0,1|0,0,2]=4 6032 B13R1.2872 Cc1ccc(c(c1)S[C@H](C)CO)O 62a_100016084084_100000765521 [0,1,0,0,0,1|0,0,2]=4 6033 B13R1.2872 Cc1ccc(c(n1)CC(=O)CO)Cl 1458a_100000210174_200009852033 [0,1,0,0,0,1|2,0,0]=4 6034 B13R1.2872 Cc1ccc(c(n1)CC(=O)CO)O 1458a_100000210174_100020630696 [0,1,0,0,0,1|1,0,0]=3 6035 B13R1.2872 Cc1ccc(cc1CC(=O)CF)Br 1458a_100010244045_100015361967 [0,1,0,0,0,1|2,0,0]=4 6036 B13R1.2872 Cc1ccc(cc1CC(=O)CF)F 1458a_100011219217_100015361967 [0,1,0,0,0,1|2,0,0]=4 6037 B13R1.2872 Cc1ccc(cc1CC(=O)CO)Cl 1458a_100000210174_100012186985 [0,1,0,0,0,1|2,0,0]=4 6038 B13R1.2872 Cc1ccc(cc1CC(=O)CO)F 1458a_100000210174_100000709795 [0,1,0,0,0,1|2,0,0]=4 6039 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Br 22a_100000741167_100000210174 [0,1,0,0,0,1|2,0,0]=4 6040 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Br 527a_100000741167_100000210174 [0,1,0,0,0,1|2,0,0]=4 6041 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Cl 22a_100000211374_100000210174 [0,1,0,0,0,1|2,0,0]=4 6042 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Cl 527a_100000211374_100000210174 [0,1,0,0,0,1|2,0,0]=4 6043 B13R1.2872 Cc1ccc(cc1NC(=O)CO)F 22a_100000211107_100000210174 [0,1,0,0,0,1|2,0,0]=4 6044 B13R1.2872 Cc1ccc(cc1NC(=O)CO)I 22a_100000761890_100000210174 [0,1,0,0,0,1|2,0,0]=4 6045 B13R1.2872 Cc1ccc(cc1NC(=O)CO)I 527a_100000761890_100000210174 [0,1,0,0,0,1|2,0,0]=4 6046 B13R1.2872 Cc1ccc(cc1NC(=O)CO)O 22a_100011216113_100000210174 [0,1,0,0,0,1|2,0,0]=4 6047 B13R1.2872 Cc1ccc(cc1NC(=O)CO)O 527a_100011216113_100000210174 [0,1,0,0,0,1|2,0,0]=4 6048 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Br 1458a_100010004897_100015361967 [0,1,0,0,0,1|2,0,0]=4 6049 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Cl 1458a_100000690875_100015361967 [0,1,0,0,0,1|2,0,0]=4 6050 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)F 1458a_100000690878_100015361967 [0,1,0,0,0,1|2,0,0]=4 6051 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Br 1458a_100011600618_100015361967 [0,1,0,0,0,1|2,0,0]=4 6052 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100015361967 [0,1,0,0,0,1|2,0,0]=4 6053 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)F 1458a_100011830335_100015361967 [0,1,0,0,0,1|2,0,0]=4 6054 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Br 1458a_100000690877_100015361967 [0,1,0,0,0,1|2,0,0]=4 6055 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Cl 1458a_100011217548_100015361967 [0,1,0,0,0,1|2,0,0]=4 6056 B13R1.2872 O=C(CF)Cc1cc(ccc1F)F 1458a_100000762760_100015361967 [0,1,0,0,0,1|2,0,0]=4 6057 B13R1.2872 O=C(CF)Cc1cc(ccc1O)Br 1458a_100010072483_100015361967 [0,1,0,0,0,1|1,0,0]=3 6058 B13R1.2872 O=C(CF)Cc1cc(ccc1O)O 1458a_100000038496_100015361967 [0,1,0,0,0,1|1,0,0]=3 6059 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Br 1458a_100000210174_100011982794 [0,1,0,0,0,1|2,0,0]=4 6060 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Cl 1458a_100000210174_100000733903 [0,1,0,0,0,1|2,0,0]=4 6061 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)F 1458a_100000210174_100000736370 [0,1,0,0,0,1|2,0,0]=4 6062 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)I 1458a_100000210174_100012355412 [0,1,0,0,0,1|2,0,0]=4 6063 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Br 1458a_100000210174_100000763347 [0,1,0,0,0,1|2,0,0]=4 6064 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Cl 1458a_100000210174_100000754809 [0,1,0,0,0,1|2,0,0]=4 6065 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)F 1458a_100000210174_100000709952 [0,1,0,0,0,1|2,0,0]=4 6066 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)I 1458a_100000210174_100010188191 [0,1,0,0,0,1|2,0,0]=4 6067 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Br 1458a_100000210174_100000736399 [0,1,0,0,0,1|2,0,0]=4 6068 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Cl 1458a_100000210174_100000716957 [0,1,0,0,0,1|2,0,0]=4 6069 B13R1.2872 O=C(CO)Cc1cc(ccc1F)F 1458a_100000210174_100000741279 [0,1,0,0,0,1|2,0,0]=4 6070 B13R1.2872 O=C(CO)Cc1cc(ccc1F)I 1458a_100000210174_200010149601 [0,1,0,0,0,1|2,0,0]=4 6071 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Br 1458a_100000210174_100012362523 [0,1,0,0,0,1|2,0,0]=4 6072 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Cl 1458a_100000210174_100012348826 [0,1,0,0,0,1|2,0,0]=4 6073 B13R1.2872 O=C(CO)Cc1cc(ccc1I)F 1458a_100000210174_100010149606 [0,1,0,0,0,1|2,0,0]=4 6074 B13R1.2872 O=C(CO)Cc1cc(ccc1O)F 1458a_100000210174_100010161318 [0,1,0,0,0,1|1,0,0]=3 6075 B13R1.2872 O=C(CO)Nc1cc(ccc1Br)O 22a_100011999798_100000210174 [0,1,0,0,0,1|2,0,0]=4 6076 B13R1.2872 O=C(CO)Nc1cc(ccc1Br)O 527a_100011999798_100000210174 [0,1,0,0,0,1|2,0,0]=4 6077 B13R1.2872 O=C(CO)Nc1cc(ccc1Cl)O 527a_100011934297_100000210174 [0,1,0,0,0,1|2,0,0]=4 6078 B13R1.2872 O=C(CO)Nc1cc(ccc1F)Br 22a_100000740924_100000210174 [0,1,0,0,0,1|2,0,0]=4 6079 B13R1.2872 O=C(CO)Nc1cc(ccc1F)F 22a_100000210742_100000210174 [0,1,0,0,0,1|2,0,0]=4 6080 B13R1.2872 O=C(CO)Nc1cc(ccc1F)O 22a_100012017239_100000210174 [0,1,0,0,0,1|2,0,0]=4 6081 B13R1.2872 O=C(CO)Nc1cc(ccc1F)O 527a_100012017239_100000210174 [0,1,0,0,0,1|2,0,0]=4 6082 B13R1.2872 O=C(CO)Nc1cc(ccc1I)Cl 22a_100000761886_100000210174 [0,1,0,0,0,1|2,0,0]=4 6083 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Br 22a_100000752626_100000210174 [0,1,0,0,0,1|1,0,0]=3 6084 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Br 527a_100000752626_100000210174 [0,1,0,0,0,1|1,0,0]=3 6085 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Cl 22a_100000210500_100000210174 [0,1,0,0,0,1|1,0,0]=3 6086 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Cl 527a_100000210500_100000210174 [0,1,0,0,0,1|1,0,0]=3 6087 B13R1.2872 O=C(CO)Nc1cc(ccc1O)F 22a_100000759472_100000210174 [0,1,0,0,0,1|1,0,0]=3 6088 B13R1.2872 O=C(CO)Nc1cc(ccc1O)F 527a_100000759472_100000210174 [0,1,0,0,0,1|1,0,0]=3 6089 B13R1.2872 O=C(CO)Nc1cc(ccc1O)I 22a_100000753495_100000210174 [0,1,0,0,0,1|1,0,0]=3 6090 B13R1.2872 O=C(CO)Nc1cc(ccc1O)I 527a_100000753495_100000210174 [0,1,0,0,0,1|1,0,0]=3 6091 B13R1.3089 C=Cc1ccc(cc1NC(=O)C)C 271570a_100011290941_100000182586 [0,1,0,0,0,1|1,0,0]=3 6092 B13R1.3089 C=Cc1ccc(cc1NC(=O)C)F 271570a_100011290941_100012558231 [0,1,0,0,0,1|2,0,0]=4 6093 B13R1.3089 C=Cc1ccc(cc1OC(=O)C)F 271570a_100011290941_200015685721 [0,1,0,0,0,1|2,0,0]=4 6094 B13R1.3089 CC(=Cc1cc(ccc1C#N)C)C 271570a_100102525489_100000693804 [0,1,0,0,0,1|2,0,0]=4 6095 B13R1.3089 CC(=Cc1cc(ccc1C=O)C)C 271570a_100102525489_100000692596 [0,1,0,0,0,1|1,0,1]=4 6096 B13R1.3089 CC(=Cc1cc(ccc1CO)Br)C 271570a_100102525489_100010146605 [0,1,0,0,0,1|2,0,0]=4 6097 B13R1.3089 CC(=Cc1cc(ccc1CO)Cl)C 271570a_100102525489_100000722340 [0,1,0,0,0,1|2,0,0]=4 6098 B13R1.3089 CC(=Cc1cc(ccc1CO)F)C 271570a_100102525489_100000744086 [0,1,0,0,0,1|2,0,0]=4 6099 B13R1.3089 CC(=Cc1cc(ccc1CO)O)C 271570a_100102525489_100010146404 [0,1,0,0,0,1|2,0,0]=4 6100 B13R1.3089 CC(=Cc1cc(ccc1NN)C)C 271570a_100102525489_100016996181 [0,1,0,0,0,1|2,0,0]=4 6101 B13R1.3089 CC(=Cc1nc(ccc1CO)C)C 271570a_100102525489_102495338573 [0,1,0,0,0,1|2,0,0]=4 6102 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)Br 1458a_100000070787_100000718229 [0,1,0,0,0,1|2,0,0]=4 6103 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)F 1458a_100000070787_100000759424 [0,1,0,0,0,1|2,0,0]=4 6104 B13R1.3089 CC(=O)Cc1cc(ccc1C=O)F 1458a_100000070787_100010132768 [0,1,0,0,0,1|1,0,1]=4 6105 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 34a_200010006938_200025704644 [0,1,0,0,0,1|1,0,0]=3 6106 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 7a_200010006938_200025704644 [0,1,0,0,0,1|1,0,0]=3 6107 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Br 1626a_100000699244_100015343762 [0,1,0,0,0,1|2,0,0]=4 6108 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)C 11a_100011218341_100015343762 [0,1,0,0,0,1|1,0,0]=3 6109 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)C 1626a_100011218341_100015343762 [0,1,0,0,0,1|1,0,0]=3 6110 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Cl 11a_100000211392_100015343762 [0,1,0,0,0,1|2,0,0]=4 6111 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Cl 1626a_100000211392_100015343762 [0,1,0,0,0,1|2,0,0]=4 6112 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)F 11a_100011935279_100015343762 [0,1,0,0,0,1|2,0,0]=4 6113 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)F 1626a_100011935279_100015343762 [0,1,0,0,0,1|2,0,0]=4 6114 B13R1.3089 CC(=O)Nc1cc(ccc1CO)C 22a_100000087799_100000070787 [0,1,0,0,0,1|0,0,0]=2 6115 B13R1.3089 CC(=O)Nc1cc(ccc1N[13CH3])Cl 34a_100000749253_200025704644 [0,1,0,0,0,1|2,0,0]=4 6116 B13R1.3089 CC(=O)Nc1cc(ccc1N[13CH3])Cl 7a_100000749253_200025704644 [0,1,0,0,0,1|2,0,0]=4 6117 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])C 34a_100000035807_200025704644 [0,1,0,0,0,1|0,0,0]=2 6118 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])C 7a_100000035807_200025704644 [0,1,0,0,0,1|0,0,0]=2 6119 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])Cl 34a_100000012038_200025704644 [0,1,0,0,0,1|1,0,0]=3 6120 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])Cl 7a_100000012038_200025704644 [0,1,0,0,0,1|1,0,0]=3 6121 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])N 34a_100000070259_200025704644 [0,1,0,0,0,1|1,0,0]=3 6122 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])N 7a_100000070259_200025704644 [0,1,0,0,0,1|1,0,0]=3 6123 B13R1.3089 CC(=O)Nc1cc(ccc1S[13CH3])C 62a_200025704644_100000182586 [0,1,0,0,0,1|0,1,0]=3 6124 B13R1.3089 CC(=O)Nc1cc(ccc1S[13CH3])F 62a_200025704644_100012558231 [0,1,0,0,0,1|1,1,0]=4 6125 B13R1.3089 CC(=O)Oc1cc(ccc1S[13CH3])F 62a_200015685721_200025704644 [0,1,0,0,0,1|1,1,0]=4 6126 B13R1.3089 CC(=O)Oc1cc(ccc1S[13CH3])F 62a_200025704644_200015685721 [0,1,0,0,0,1|1,1,0]=4 6127 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 11a_100012354963_100015343762 [0,1,0,0,0,1|2,0,0]=4 6128 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 1626a_100012354963_100015343762 [0,1,0,0,0,1|2,0,0]=4 6129 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 22a_100012354963_100000070787 [0,1,0,0,0,1|2,0,0]=4 6130 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 527a_100012354963_100103153847 [0,1,0,0,0,1|2,0,0]=4 6131 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 11a_200012281948_100015343762 [0,1,0,0,0,1|2,0,0]=4 6132 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 1626a_200012281948_100015343762 [0,1,0,0,0,1|2,0,0]=4 6133 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 22a_200012281948_100000070787 [0,1,0,0,0,1|2,0,0]=4 6134 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 527a_200012281948_100103153847 [0,1,0,0,0,1|2,0,0]=4 6135 B13R1.3089 CNc1ccc(cc1C=C(C)C)C 271570a_100102525489_100000221369 [0,1,0,0,0,1|2,0,0]=4 6136 B13R1.3089 CNc1ccc(cc1NC(=O)C)Cl 34a_100000749253_200000210301 [0,1,0,0,0,1|2,0,0]=4 6137 B13R1.3089 CNc1ccc(cc1NC(=O)C)Cl 7a_100000749253_200000210301 [0,1,0,0,0,1|2,0,0]=4 6138 B13R1.3089 COc1ccc(cc1C=C(C)C)Br 271570a_100102525489_100012351588 [0,1,0,0,0,1|2,0,0]=4 6139 B13R1.3089 COc1ccc(cc1C=C(C)C)C 271570a_100102525489_100000186399 [0,1,0,0,0,1|1,0,0]=3 6140 B13R1.3089 COc1ccc(cc1C=C(C)C)Cl 271570a_100102525489_100011215930 [0,1,0,0,0,1|2,0,0]=4 6141 B13R1.3089 COc1ccc(cc1C=C(C)C)F 271570a_100102525489_100000171694 [0,1,0,0,0,1|2,0,0]=4 6142 B13R1.3089 COc1ccc(cc1C=C(C)C)N 271570a_100102525489_100000187427 [0,1,0,0,0,1|2,0,0]=4 6143 B13R1.3089 COc1ccc(cc1C=C(C)C)O 271570a_100102525489_100010084122 [0,1,0,0,0,1|2,0,0]=4 6144 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000070787_100000204665 [0,1,0,0,0,1|1,0,0]=3 6145 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000763194_200000210301 [0,1,0,0,0,1|1,0,0]=3 6146 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 34a_200010006938_200000210301 [0,1,0,0,0,1|1,0,0]=3 6147 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 7a_200010006938_200000210301 [0,1,0,0,0,1|1,0,0]=3 6148 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000070787_100000199068 [0,1,0,0,0,1|0,0,0]=2 6149 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000204598_200000210301 [0,1,0,0,0,1|0,0,0]=2 6150 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000070787_100000209806 [0,1,0,0,0,1|1,0,0]=3 6151 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000209874_200000210301 [0,1,0,0,0,1|1,0,0]=3 6152 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000070787_100011830354 [0,1,0,0,0,1|1,0,0]=3 6153 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000707523_200000210301 [0,1,0,0,0,1|1,0,0]=3 6154 B13R1.3089 COc1ccc(cc1CC(=O)C)O 271570a_203496583355_200011493461 [0,1,0,0,0,1|1,0,0]=3 6155 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Br 1458a_100000763194_200025704644 [0,1,0,0,0,1|1,0,0]=3 6156 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])C 1458a_100000204598_200025704644 [0,1,0,0,0,1|0,0,0]=2 6157 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Cl 1458a_100000209874_200025704644 [0,1,0,0,0,1|1,0,0]=3 6158 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])F 1458a_100000707523_200025704644 [0,1,0,0,0,1|1,0,0]=3 6159 B13R1.3089 COc1ccc(cc1CN(C)C)C 2230a_100102631434_100000199068 [0,1,0,0,0,1|2,0,0]=4 6160 B13R1.3089 COc1ccc(cc1CN(C)C)C 269982a_100102631434_100000199068 [0,1,0,0,0,1|2,0,0]=4 6161 B13R1.3089 COc1ccc(cc1CN(C)C)C 270004a_100102631434_100000203738 [0,1,0,0,0,1|2,0,0]=4 6162 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 11a_100000743470_100015343762 [0,1,0,0,0,1|1,0,0]=3 6163 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 1626a_100000743470_100015343762 [0,1,0,0,0,1|1,0,0]=3 6164 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 22a_100000743470_100000070787 [0,1,0,0,0,1|1,0,0]=3 6165 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 527a_100000743470_100103153847 [0,1,0,0,0,1|1,0,0]=3 6166 B13R1.3089 COc1ccc(cc1NC(=O)C)C 11a_100000210980_100015343762 [0,1,0,0,0,1|0,0,0]=2 6167 B13R1.3089 COc1ccc(cc1NC(=O)C)C 1626a_100000210980_100015343762 [0,1,0,0,0,1|0,0,0]=2 6168 B13R1.3089 COc1ccc(cc1NC(=O)C)C 22a_100000210980_100000070787 [0,1,0,0,0,1|0,0,0]=2 6169 B13R1.3089 COc1ccc(cc1NC(=O)C)C 34a_100000035807_200000210301 [0,1,0,0,0,1|0,0,0]=2 6170 B13R1.3089 COc1ccc(cc1NC(=O)C)C 527a_100000210980_100103153847 [0,1,0,0,0,1|0,0,0]=2 6171 B13R1.3089 COc1ccc(cc1NC(=O)C)C 7a_100000035807_200000210301 [0,1,0,0,0,1|0,0,0]=2 6172 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 11a_100000182114_100015343762 [0,1,0,0,0,1|1,0,0]=3 6173 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 1626a_100000182114_100015343762 [0,1,0,0,0,1|1,0,0]=3 6174 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 22a_100000182114_100000070787 [0,1,0,0,0,1|1,0,0]=3 6175 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 34a_100000012038_200000210301 [0,1,0,0,0,1|1,0,0]=3 6176 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 7a_100000012038_200000210301 [0,1,0,0,0,1|1,0,0]=3 6177 B13R1.3089 COc1ccc(cc1NC(=O)C)F 11a_100000757179_100015343762 [0,1,0,0,0,1|1,0,0]=3 6178 B13R1.3089 COc1ccc(cc1NC(=O)C)F 1626a_100000757179_100015343762 [0,1,0,0,0,1|1,0,0]=3 6179 B13R1.3089 COc1ccc(cc1NC(=O)C)F 22a_100000757179_100000070787 [0,1,0,0,0,1|1,0,0]=3 6180 B13R1.3089 COc1ccc(cc1NC(=O)C)F 527a_100000757179_100103153847 [0,1,0,0,0,1|1,0,0]=3 6181 B13R1.3089 COc1ccc(cc1NC(=O)C)I 11a_100011249504_100015343762 [0,1,0,0,0,1|1,0,0]=3 6182 B13R1.3089 COc1ccc(cc1NC(=O)C)I 1626a_100011249504_100015343762 [0,1,0,0,0,1|1,0,0]=3 6183 B13R1.3089 COc1ccc(cc1NC(=O)C)I 22a_100011249504_100000070787 [0,1,0,0,0,1|1,0,0]=3 6184 B13R1.3089 COc1ccc(cc1NC(=O)C)N 34a_100000070259_200000210301 [0,1,0,0,0,1|1,0,0]=3 6185 B13R1.3089 COc1ccc(cc1NC(=O)C)N 7a_100000070259_200000210301 [0,1,0,0,0,1|1,0,0]=3 6186 B13R1.3089 COc1ccc(cc1NC(=O)C)O 271570a_203496583355_200011407902 [0,1,0,0,0,1|1,0,0]=3 6187 B13R1.3089 COc1ccc(cc1NC(C)C)C 2230a_100000210980_100000210206 [0,1,0,0,0,1|1,0,1]=4 6188 B13R1.3089 COc1ccc(cc1NC(C)C)C 34a_100000210980_100000210206 [0,1,0,0,0,1|1,0,1]=4 6189 B13R1.3089 COc1ccc(cc1OC(=O)C)O 271570a_203496583355_200011016479 [0,1,0,0,0,1|1,0,0]=3 6190 B13R1.3089 COc1ccc(cc1OC(C)C)C 34a_100011216497_100000210206 [0,1,0,0,0,1|1,0,1]=4 6191 B13R1.3089 COc1ccc(cc1OC(C)C)C 7a_100011216497_100000210206 [0,1,0,0,0,1|1,0,1]=4 6192 B13R1.3089 COc1ccc(cc1SC(C)C)C 62a_100000186399_100000210206 [0,1,0,0,0,1|1,0,1]=4 6193 B13R1.3089 COc1ccc(cc1SC(C)C)C 62a_100000210206_100000186399 [0,1,0,0,0,1|1,0,1]=4 6194 B13R1.3089 COc1ccc(nc1C=C(C)C)C 271570a_100102525489_100009820875 [0,1,0,0,0,1|2,0,0]=4 6195 B13R1.3089 COc1cnc(cc1C=C(C)C)C 271570a_100102525489_100010109759 [0,1,0,0,0,1|2,0,0]=4 6196 B13R1.3089 COc1ncc(cc1C=C(C)C)C 271570a_100102525489_100012353929 [0,1,0,0,0,1|2,0,0]=4 6197 B13R1.3089 COc1ncc(cc1CC(=O)C)Br 1458a_100000070787_100010065838 [0,1,0,0,0,1|2,0,0]=4 6198 B13R1.3089 CSc1ccc(cc1C=C(C)C)C 271570a_100102525489_200010201864 [0,1,0,0,0,1|1,1,0]=4 6199 B13R1.3089 CSc1ccc(cc1NC(=O)C)C 62a_200000210301_100000182586 [0,1,0,0,0,1|0,1,0]=3 6200 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 11a_100000745667_100015343762 [0,1,0,0,0,1|1,1,0]=4 6201 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 1626a_100000745667_100015343762 [0,1,0,0,0,1|1,1,0]=4 6202 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 22a_100000745667_100000070787 [0,1,0,0,0,1|1,1,0]=4 6203 B13R1.3089 CSc1ccc(cc1NC(=O)C)F 62a_200000210301_100012558231 [0,1,0,0,0,1|1,1,0]=4 6204 B13R1.3089 CSc1ccc(cc1OC(=O)C)F 62a_200000210301_200015685721 [0,1,0,0,0,1|1,1,0]=4 6205 B13R1.3089 CSc1ccc(cc1OC(=O)C)F 62a_200015685721_200000210301 [0,1,0,0,0,1|1,1,0]=4 6206 B13R1.3089 Cc1ccc(c(c1)NC(C)C)CO 34a_100000087799_100000210206 [0,1,0,0,0,1|1,0,1]=4 6207 B13R1.141 C=C(C)c1cc(ccc1OCC)C 271570a_100000694244_200000230997 [0,2,0,0,0,0|1,0,0]=3 6208 B13R1.141 C=C(C)c1cc(ccc1OCC)F 271570a_100000694244_100000171695 [0,2,0,0,0,0|2,0,0]=4 6209 B13R1.141 C=C=Cc1ccc(cc1C(=O)C)Br 271570a_100015277604_100012349576 [0,2,0,0,0,0|2,0,0]=4 6210 B13R1.141 C=C=Cc1ccc(cc1C(=O)C)C 271570a_100015277604_100012361225 [0,2,0,0,0,0|1,0,0]=3 6211 B13R1.141 C=C=Cc1ccc(cc1C(=O)C)F 271570a_100015277604_100012353695 [0,2,0,0,0,0|2,0,0]=4 6212 B13R1.141 C=C=Cc1ccc(cc1C(=O)C)N 271570a_100015277604_100012349454 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.141 C=C=Cc1ccc(cc1C(=O)N)C 271570a_100015277604_200012349609 [0,2,0,0,0,0|2,0,0]=4 6214 B13R1.141 CC(=O)c1cc(ccc1N=[N+]=[N-])Cl 1458a_100009849217_200000210301 [0,2,0,0,0,0|2,0,0]=4 6215 B13R1.141 CC(=O)c1cc(ccc1OCF)Br 34a_100000212127_100015361967 [0,2,0,0,0,0|1,0,0]=3 6216 B13R1.141 CC(=O)c1cc(ccc1OCF)Br 7a_100000212127_100015361967 [0,2,0,0,0,0|1,0,0]=3 6217 B13R1.141 CC(=O)c1cc(ccc1OCF)C 34a_100000195442_100015361967 [0,2,0,0,0,0|0,0,0]=2 6218 B13R1.141 CC(=O)c1cc(ccc1OCF)C 7a_100000195442_100015361967 [0,2,0,0,0,0|0,0,0]=2 6219 B13R1.141 CC(=O)c1cc(ccc1OCF)Cl 34a_100000185566_100015361967 [0,2,0,0,0,0|1,0,0]=3 6220 B13R1.141 CC(=O)c1cc(ccc1OCF)Cl 7a_100000185566_100015361967 [0,2,0,0,0,0|1,0,0]=3 6221 B13R1.141 CC(=O)c1cc(ccc1OCF)F 7a_100000182812_100015361967 [0,2,0,0,0,0|1,0,0]=3 6222 B13R1.141 CC(=O)c1cc(ccc1OCF)I 7a_100010712555_100015361967 [0,2,0,0,0,0|1,0,0]=3 6223 B13R1.141 CC(=O)c1cc(ccc1OCF)N 34a_100011218865_100015361967 [0,2,0,0,0,0|1,0,0]=3 6224 B13R1.141 CC(=O)c1cc(ccc1SCF)Br 62a_100012349576_100015361967 [0,2,0,0,0,0|1,1,0]=4 6225 B13R1.141 CC(=O)c1cc(ccc1SCF)C 62a_100012361225_100015361967 [0,2,0,0,0,0|0,1,0]=3 6226 B13R1.141 CC(=O)c1cc(ccc1SCF)C 62a_100015361967_100012361225 [0,2,0,0,0,0|0,1,0]=3 6227 B13R1.141 CC(=O)c1cc(ccc1SCF)F 62a_100012353695_100015361967 [0,2,0,0,0,0|1,1,0]=4 6228 B13R1.141 CC(=O)c1cc(ccc1SCF)F 62a_100015361967_100010200798 [0,2,0,0,0,0|1,1,0]=4 6229 B13R1.141 CC(=O)c1cc(ccc1SCF)N 62a_100012349454_100015361967 [0,2,0,0,0,0|1,1,0]=4 6230 B13R1.141 CC=Cc1ccc(cc1C(=O)C)Br 271570a_100016259895_100012349576 [0,2,0,0,0,0|2,0,0]=4 6231 B13R1.141 CC=Cc1ccc(cc1C(=O)C)C 271570a_100016259895_100012361225 [0,2,0,0,0,0|1,0,0]=3 6232 B13R1.141 CC=Cc1ccc(cc1C(=O)C)F 271570a_100016259895_100012353695 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.141 CC=Cc1ccc(cc1C(=O)C)N 271570a_100016259895_100012349454 [0,2,0,0,0,0|2,0,0]=4 6234 B13R1.141 CC=Cc1ccc(cc1C(=O)N)C 271570a_100016259895_200012349609 [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.141 CCNc1ccc(cc1C(=O)N)C 34a_100011692829_100000210202 [0,2,0,0,0,0|2,0,0]=4 6236 B13R1.141 CCOc1ccc(cc1C(=O)C)Br 1458a_200000215690_200000210301 [0,2,0,0,0,0|1,0,0]=3 6237 B13R1.141 CCOc1ccc(cc1C(=O)C)Br 34a_100000212127_100000210202 [0,2,0,0,0,0|1,0,0]=3 6238 B13R1.141 CCOc1ccc(cc1C(=O)C)Br 7a_100000212127_100000210202 [0,2,0,0,0,0|1,0,0]=3 6239 B13R1.141 CCOc1ccc(cc1C(=O)C)C 34a_100000195442_100000210202 [0,2,0,0,0,0|0,0,0]=2 6240 B13R1.141 CCOc1ccc(cc1C(=O)C)C 7a_100000195442_100000210202 [0,2,0,0,0,0|0,0,0]=2 6241 B13R1.141 CCOc1ccc(cc1C(=O)C)Cl 1458a_200000215692_200000210301 [0,2,0,0,0,0|1,0,0]=3 6242 B13R1.141 CCOc1ccc(cc1C(=O)C)Cl 34a_100000185566_100000210202 [0,2,0,0,0,0|1,0,0]=3 6243 B13R1.141 CCOc1ccc(cc1C(=O)C)Cl 7a_100000185566_100000210202 [0,2,0,0,0,0|1,0,0]=3 6244 B13R1.141 CCOc1ccc(cc1C(=O)C)F 7a_100000182812_100000210202 [0,2,0,0,0,0|1,0,0]=3 6245 B13R1.141 CCOc1ccc(cc1C(=O)C)I 7a_100010712555_100000210202 [0,2,0,0,0,0|1,0,0]=3 6246 B13R1.141 CCOc1ccc(cc1C(=O)C)N 34a_100011218865_100000210202 [0,2,0,0,0,0|1,0,0]=3 6247 B13R1.141 CCOc1ccc(cc1C(=O)C)O 271570a_203496583355_100000173016 [0,2,0,0,0,0|1,0,0]=3 6248 B13R1.141 CCOc1ccc(cc1C(=O)N)Br 34a_100000192807_100000210202 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.141 CCOc1ccc(cc1C(=O)N)Br 7a_100000192807_100000210202 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.141 CCOc1ccc(cc1C(=O)N)C 34a_200000192840_100000210202 [0,2,0,0,0,0|1,0,0]=3 6251 B13R1.141 CCOc1ccc(cc1C(=O)N)C 7a_200000192840_100000210202 [0,2,0,0,0,0|1,0,0]=3 6252 B13R1.141 CCOc1ccc(cc1C(=O)N)Cl 34a_100000185026_100000210202 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.141 CCOc1ccc(cc1C(=O)N)Cl 7a_100000185026_100000210202 [0,2,0,0,0,0|2,0,0]=4 6254 B13R1.141 CCOc1ccc(cc1C(=O)N)F 34a_100012186459_100000210202 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.141 CCOc1ccc(cc1C(=O)N)F 7a_100012186459_100000210202 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.141 CCOc1ccc(cc1C(=O)N)I 34a_100000192813_100000210202 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.141 CCOc1ccc(cc1C(=O)N)I 7a_100000192813_100000210202 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.141 CCOc1ccc(cc1C(=O)[13CH3])Br 1458a_200000215690_200025704644 [0,2,0,0,0,0|1,0,0]=3 6259 B13R1.141 CCOc1ccc(cc1C(=O)[13CH3])Cl 1458a_200000215692_200025704644 [0,2,0,0,0,0|1,0,0]=3 6260 B13R1.141 CCOc1ccc(cc1[N+](=O)[O-])C 34a_100000195567_100000210202 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.141 CCOc1ccc(cc1[N+](=O)[O-])C 7a_100000195567_100000210202 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.141 CCSc1ccc(cc1C(=O)C)Br 62a_100012349576_100000210202 [0,2,0,0,0,0|1,1,0]=4 6263 B13R1.141 CCSc1ccc(cc1C(=O)C)C 62a_100000210202_100012361225 [0,2,0,0,0,0|0,1,0]=3 6264 B13R1.141 CCSc1ccc(cc1C(=O)C)C 62a_100012361225_100000210202 [0,2,0,0,0,0|0,1,0]=3 6265 B13R1.141 CCSc1ccc(cc1C(=O)C)F 62a_100000210202_100010200798 [0,2,0,0,0,0|1,1,0]=4 6266 B13R1.141 CCSc1ccc(cc1C(=O)C)F 62a_100012353695_100000210202 [0,2,0,0,0,0|1,1,0]=4 6267 B13R1.141 CCSc1ccc(cc1C(=O)C)N 62a_100012349454_100000210202 [0,2,0,0,0,0|1,1,0]=4 6268 B13R1.141 CCSc1ccc(cc1C(=O)N)C 62a_100000210202_200012349609 [0,2,0,0,0,0|1,1,0]=4 6269 B13R1.141 CCSc1ccc(cc1C(=O)N)C 62a_200012349609_100000210202 [0,2,0,0,0,0|1,1,0]=4 6270 B13R1.141 CNCc1ccc(cc1C(=O)C)Br 26a_100102657272_100000212127 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.141 COCc1ccc(cc1[N+](=O)[O-])C 34a_100138415774_200009879986 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.141 COCc1ccc(cc1[N+](=O)[O-])C 7a_100000087798_200000210301 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.141 Cc1ccc(c(c1)C(=O)N)NCF 34a_100011692829_100015361967 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.141 Cc1ccc(c(c1)C(=O)N)OCF 34a_200000192840_100015361967 [0,2,0,0,0,0|1,0,0]=3 6275 B13R1.141 Cc1ccc(c(c1)C(=O)N)OCF 7a_200000192840_100015361967 [0,2,0,0,0,0|1,0,0]=3 6276 B13R1.141 Cc1ccc(c(c1)C(=O)N)SCF 62a_100015361967_200012349609 [0,2,0,0,0,0|1,1,0]=4 6277 B13R1.141 Cc1ccc(c(c1)C(=O)N)SCF 62a_200012349609_100015361967 [0,2,0,0,0,0|1,1,0]=4 6278 B13R1.141 Cc1ccc(c(c1)[N+](=O)[O-])CO[13CH3] 7a_100000087798_200025704644 [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.141 Cc1ccc(c(c1)[N+](=O)[O-])OCF 34a_100000195567_100015361967 [0,2,0,0,0,0|2,0,0]=4 6280 B13R1.141 Cc1ccc(c(c1)[N+](=O)[O-])OCF 7a_100000195567_100015361967 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.141 NC(=O)c1cc(ccc1OCF)Br 34a_100000192807_100015361967 [0,2,0,0,0,0|2,0,0]=4 6282 B13R1.141 NC(=O)c1cc(ccc1OCF)Br 7a_100000192807_100015361967 [0,2,0,0,0,0|2,0,0]=4 6283 B13R1.141 NC(=O)c1cc(ccc1OCF)Cl 34a_100000185026_100015361967 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.141 NC(=O)c1cc(ccc1OCF)Cl 7a_100000185026_100015361967 [0,2,0,0,0,0|2,0,0]=4 6285 B13R1.141 NC(=O)c1cc(ccc1OCF)F 34a_100012186459_100015361967 [0,2,0,0,0,0|2,0,0]=4 6286 B13R1.141 NC(=O)c1cc(ccc1OCF)F 7a_100012186459_100015361967 [0,2,0,0,0,0|2,0,0]=4 6287 B13R1.141 NC(=O)c1cc(ccc1OCF)I 34a_100000192813_100015361967 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.141 NC(=O)c1cc(ccc1OCF)I 7a_100000192813_100015361967 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.141 [13CH3]C(=O)c1cc(ccc1N=[N+]=[N-])Cl 1458a_100009849217_200025704644 [0,2,0,0,0,0|2,0,0]=4 6290 B13R1.165 C=C(C)c1cc(ccc1B(O)O)C 271570a_100000694244_200011068827 [0,2,0,0,0,0|1,0,0]=3 6291 B13R1.165 C=C(C)c1cc(ccc1B(O)O)F 271570a_100000694244_100010175514 [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.165 C=C(C)c1cc(ccc1C(=O)C)C 271570a_100000694244_100012353930 [0,2,0,0,0,0|1,0,1]=4 6293 B13R1.165 C=C(C)c1cc(ccc1N(C)C)C 271570a_100000694244_100012353700 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.165 C=C(C)c1ccc(cc1C(=O)C)Br 271570a_100000694244_100012349576 [0,2,0,0,0,0|2,0,0]=4 6295 B13R1.165 C=C(C)c1ccc(cc1C(=O)C)C 271570a_100000694244_100012361225 [0,2,0,0,0,0|1,0,0]=3 6296 B13R1.165 C=C(C)c1ccc(cc1C(=O)C)F 271570a_100000694244_100012353695 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.165 C=C(C)c1ccc(cc1C(=O)C)N 271570a_100000694244_100012349454 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.165 C=C(C)c1ccc(cc1C(=O)N)C 271570a_100000694244_200012349609 [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.165 CC(=O)c1cc(ccc1C(C)C)C 1458a_200012176289_200000210301 [0,2,0,0,0,0|1,0,0]=3 6300 B13R1.165 CC(=O)c1cc(ccc1C(F)F)F 1458a_100116214828_200000210301 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.165 CC(=O)c1cc(ccc1[N+](=O)[O-])Br 1458a_100009992657_200000210301 [0,2,0,0,0,0|1,0,1]=4 6302 B13R1.165 CC(=O)c1cc(ccc1[N+](=O)[O-])C 1458a_100000763269_200000210301 [0,2,0,0,0,0|0,0,1]=3 6303 B13R1.165 CC(=O)c1cc(ccc1[N+](=O)[O-])Cl 1458a_100000210914_200000210301 [0,2,0,0,0,0|1,0,1]=4 6304 B13R1.165 CC(=O)c1cc(ccc1[N+](=O)[O-])I 1458a_100010186413_200000210301 [0,2,0,0,0,0|1,0,1]=4 6305 B13R1.165 CC(=O)c1cc(ccc1[N+](=O)[O-])O 1458a_100000692585_200000210301 [0,2,0,0,0,0|1,0,1]=4 6306 B13R1.165 Cc1ccc(c(c1)C(=O)[13CH3])C(C)C 1458a_200012176289_200025704644 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.165 Cc1ccc(c(c1)C(=O)[13CH3])[N+](=O)[O-] 1458a_100000763269_200025704644 [0,2,0,0,0,0|0,0,1]=3 6308 B13R1.165 [13CH3]C(=O)c1cc(ccc1C(F)F)F 1458a_100116214828_200025704644 [0,2,0,0,0,0|2,0,0]=4 6309 B13R1.165 [13CH3]C(=O)c1cc(ccc1[N+](=O)[O-])Br 1458a_100009992657_200025704644 [0,2,0,0,0,0|1,0,1]=4 6310 B13R1.165 [13CH3]C(=O)c1cc(ccc1[N+](=O)[O-])Cl 1458a_100000210914_200025704644 [0,2,0,0,0,0|1,0,1]=4 6311 B13R1.165 [13CH3]C(=O)c1cc(ccc1[N+](=O)[O-])I 1458a_100010186413_200025704644 [0,2,0,0,0,0|1,0,1]=4 6312 B13R1.165 [13CH3]C(=O)c1cc(ccc1[N+](=O)[O-])O 1458a_100000692585_200025704644 [0,2,0,0,0,0|1,0,1]=4 6313 B13R1.2209 C=Cc1ccc(cc1C(=O)NC)Cl 271570a_100011290941_200011279454 [0,2,0,0,0,0|2,0,0]=4 6314 B13R1.2209 C=Cc1ccc(cc1C(=O)NC)F 271570a_100011290941_200000206232 [0,2,0,0,0,0|2,0,0]=4 6315 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)Br 271570a_100011290941_100000148213 [0,2,0,0,0,0|2,0,0]=4 6316 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)C 271570a_100011290941_100012339458 [0,2,0,0,0,0|1,0,0]=3 6317 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)Cl 271570a_100011290941_100011294804 [0,2,0,0,0,0|2,0,0]=4 6318 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)F 271570a_100011290941_100000205820 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)N 271570a_100011290941_100000696289 [0,2,0,0,0,0|2,0,0]=4 6320 B13R1.2209 C=Cc1ccc(cc1C(=O)OC)O 271570a_100011290941_100010230369 [0,2,0,0,0,0|2,0,0]=4 6321 B13R1.2209 C=Cc1ncc(cc1C(=O)OC)C 271570a_100011290941_100000085774 [0,2,0,0,0,0|2,0,0]=4 6322 B13R1.2209 CCC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210202 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.2209 CCC(=O)c1cc(ccc1CC)Br 1458a_100012343961_100000210202 [0,2,0,0,0,0|2,0,0]=4 6324 B13R1.2209 CCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000210202 [0,2,0,0,0,0|1,0,0]=3 6325 B13R1.2209 CCC(=O)c1cc(ccc1OC)Br 7a_100000183607_200000210301 [0,2,0,0,0,0|1,0,0]=3 6326 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210202 [0,2,0,0,0,0|0,0,0]=2 6327 B13R1.2209 CCC(=O)c1cc(ccc1OC)C 7a_100000183590_200000210301 [0,2,0,0,0,0|0,0,0]=2 6328 B13R1.2209 CCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000210202 [0,2,0,0,0,0|1,0,0]=3 6329 B13R1.2209 CCC(=O)c1cc(ccc1OC)Cl 7a_100000181482_200000210301 [0,2,0,0,0,0|1,0,0]=3 6330 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000210202 [0,2,0,0,0,0|1,0,0]=3 6331 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 34a_100000183209_200000210301 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.2209 CCC(=O)c1cc(ccc1OC)F 7a_100000183209_200000210301 [0,2,0,0,0,0|1,0,0]=3 6333 B13R1.2209 CCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000210202 [0,2,0,0,0,0|1,0,0]=3 6334 B13R1.2209 CCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210202 [0,2,0,0,0,0|1,0,0]=3 6335 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])Br 7a_100000183607_200025704644 [0,2,0,0,0,0|1,0,0]=3 6336 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])C 7a_100000183590_200025704644 [0,2,0,0,0,0|0,0,0]=2 6337 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000181482_200025704644 [0,2,0,0,0,0|1,0,0]=3 6338 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])F 34a_100000183209_200025704644 [0,2,0,0,0,0|1,0,0]=3 6339 B13R1.2209 CCC(=O)c1cc(ccc1O[13CH3])F 7a_100000183209_200025704644 [0,2,0,0,0,0|1,0,0]=3 6340 B13R1.2209 CCc1ccc(cc1C(=O)CF)Br 1458a_100012343961_100015361967 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 11a_106832991635_100012343961 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 1626a_100102657272_100012343961 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 240690a_100102657272_100012343961 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.2209 CCc1ccc(cc1C(=O)NC)Br 527a_100102657272_100012343961 [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.2209 CCc1ccc(cc1C(=O)OC)O 271570a_203496583355_100012360140 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.2209 CNC(=O)c1cc(ccc1C#N)F 11a_106832991635_100011217471 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.2209 CNC(=O)c1cc(ccc1C#N)F 1626a_100102657272_100011217471 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.2209 CNC(=O)c1cc(ccc1NC)Br 34a_100000690504_200000210301 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.2209 CNC(=O)c1cc(ccc1NC)Cl 27a_100102657272_200011279454 [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.2209 CNC(=O)c1cc(ccc1NC)Cl 34a_100000739363_200000210301 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.2209 CNC(=O)c1cc(ccc1NC)F 27a_100102657272_200000206232 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.2209 CNC(=O)c1cc(ccc1N[13CH3])Br 34a_100000690504_200025704644 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.2209 CNC(=O)c1cc(ccc1N[13CH3])Cl 34a_100000739363_200025704644 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 11a_106832991635_100000188853 [0,2,0,0,0,0|1,0,0]=3 6355 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 1626a_100102657272_100000188853 [0,2,0,0,0,0|1,0,0]=3 6356 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 240690a_100102657272_100000188853 [0,2,0,0,0,0|1,0,0]=3 6357 B13R1.2209 CNC(=O)c1cc(ccc1OC)Br 527a_100102657272_100000188853 [0,2,0,0,0,0|1,0,0]=3 6358 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 11a_106832991635_100000204667 [0,2,0,0,0,0|0,0,0]=2 6359 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 1626a_100102657272_100000204667 [0,2,0,0,0,0|0,0,0]=2 6360 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 240690a_100102657272_100000204667 [0,2,0,0,0,0|0,0,0]=2 6361 B13R1.2209 CNC(=O)c1cc(ccc1OC)C 527a_100102657272_100000204667 [0,2,0,0,0,0|0,0,0]=2 6362 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 11a_106832991635_100000211409 [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 1626a_100102657272_100000211409 [0,2,0,0,0,0|1,0,0]=3 6364 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 240690a_100102657272_100000211409 [0,2,0,0,0,0|1,0,0]=3 6365 B13R1.2209 CNC(=O)c1cc(ccc1OC)Cl 527a_100102657272_100000211409 [0,2,0,0,0,0|1,0,0]=3 6366 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 11a_106832991635_100000735445 [0,2,0,0,0,0|1,0,0]=3 6367 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 1626a_100102657272_100000735445 [0,2,0,0,0,0|1,0,0]=3 6368 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 240690a_100102657272_100000735445 [0,2,0,0,0,0|1,0,0]=3 6369 B13R1.2209 CNC(=O)c1cc(ccc1OC)F 527a_100102657272_100000735445 [0,2,0,0,0,0|1,0,0]=3 6370 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 11a_106832991635_100000230898 [0,2,0,0,0,0|1,0,0]=3 6371 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 1626a_100102657272_100000230898 [0,2,0,0,0,0|1,0,0]=3 6372 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 240690a_100102657272_100000230898 [0,2,0,0,0,0|1,0,0]=3 6373 B13R1.2209 CNC(=O)c1cc(ccc1OC)I 527a_100102657272_100000230898 [0,2,0,0,0,0|1,0,0]=3 6374 B13R1.2209 CNC(=O)c1cc(ccc1OC)O 240690a_100102657272_200000100057 [0,2,0,0,0,0|1,0,0]=3 6375 B13R1.2209 CNC(=O)c1cc(ccc1OC)O 527a_100102657272_200000100057 [0,2,0,0,0,0|1,0,0]=3 6376 B13R1.2209 CNC(=O)c1cc(ccc1SC)Cl 62a_200000210301_200011279454 [0,2,0,0,0,0|1,1,0]=4 6377 B13R1.2209 CNC(=O)c1cc(ccc1SC)Cl 62a_200011279454_200000210301 [0,2,0,0,0,0|1,1,0]=4 6378 B13R1.2209 CNC(=O)c1cc(ccc1SC)F 62a_200000206232_200000210301 [0,2,0,0,0,0|1,1,0]=4 6379 B13R1.2209 CNC(=O)c1cc(ccc1SC)F 62a_200000210301_200000206232 [0,2,0,0,0,0|1,1,0]=4 6380 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])Cl 62a_200011279454_200025704644 [0,2,0,0,0,0|1,1,0]=4 6381 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])Cl 62a_200025704644_200011279454 [0,2,0,0,0,0|1,1,0]=4 6382 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])F 62a_200000206232_200025704644 [0,2,0,0,0,0|1,1,0]=4 6383 B13R1.2209 CNC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_200000206232 [0,2,0,0,0,0|1,1,0]=4 6384 B13R1.2209 CNC(C)c1cc(ccc1OC)C 269862a_106832991636_100000212259 [0,2,0,0,0,0|1,0,1]=4 6385 B13R1.2209 CNc1ccc(cc1C(=O)OC)O 271570a_203496583355_200000216482 [0,2,0,0,0,0|2,0,0]=4 6386 B13R1.2209 CNc1ncc(cc1C(=O)OC)C 27a_100102657272_100000085774 [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.2209 COC(=O)c1cc(ccc1C#N)O 271570a_203496583355_100010201442 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.2209 COC(=O)c1cc(ccc1C=O)O 271570a_203496583355_100012355575 [0,2,0,0,0,0|1,0,1]=4 6389 B13R1.2209 COC(=O)c1cc(ccc1CN)O 271570a_203496583355_100016992124 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.2209 COC(=O)c1cc(ccc1OC)Br 34a_100000149267_200000210301 [0,2,0,0,0,0|1,0,0]=3 6391 B13R1.2209 COC(=O)c1cc(ccc1OC)Br 7a_100000149267_200000210301 [0,2,0,0,0,0|1,0,0]=3 6392 B13R1.2209 COC(=O)c1cc(ccc1OC)C 34a_100000216618_200000210301 [0,2,0,0,0,0|0,0,0]=2 6393 B13R1.2209 COC(=O)c1cc(ccc1OC)C 7a_100000216618_200000210301 [0,2,0,0,0,0|0,0,0]=2 6394 B13R1.2209 COC(=O)c1cc(ccc1OC)Cl 34a_100000149278_200000210301 [0,2,0,0,0,0|1,0,0]=3 6395 B13R1.2209 COC(=O)c1cc(ccc1OC)Cl 7a_100000149278_200000210301 [0,2,0,0,0,0|1,0,0]=3 6396 B13R1.2209 COC(=O)c1cc(ccc1OC)F 34a_100011219540_200000210301 [0,2,0,0,0,0|1,0,0]=3 6397 B13R1.2209 COC(=O)c1cc(ccc1OC)F 7a_100011219540_200000210301 [0,2,0,0,0,0|1,0,0]=3 6398 B13R1.2209 COC(=O)c1cc(ccc1OC)I 34a_100000149868_200000210301 [0,2,0,0,0,0|1,0,0]=3 6399 B13R1.2209 COC(=O)c1cc(ccc1OC)I 7a_100000149868_200000210301 [0,2,0,0,0,0|1,0,0]=3 6400 B13R1.2209 COC(=O)c1cc(ccc1OC)N 34a_100011246163_200000210301 [0,2,0,0,0,0|1,0,0]=3 6401 B13R1.2209 COC(=O)c1cc(ccc1OC)N 7a_100011246163_200000210301 [0,2,0,0,0,0|1,0,0]=3 6402 B13R1.2209 COC(=O)c1cc(ccc1OC)O 271570a_203496583355_100012047238 [0,2,0,0,0,0|1,0,0]=3 6403 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Br 34a_100000149267_200025704644 [0,2,0,0,0,0|1,0,0]=3 6404 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Br 7a_100000149267_200025704644 [0,2,0,0,0,0|1,0,0]=3 6405 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])C 34a_100000216618_200025704644 [0,2,0,0,0,0|0,0,0]=2 6406 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])C 7a_100000216618_200025704644 [0,2,0,0,0,0|0,0,0]=2 6407 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Cl 34a_100000149278_200025704644 [0,2,0,0,0,0|1,0,0]=3 6408 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])Cl 7a_100000149278_200025704644 [0,2,0,0,0,0|1,0,0]=3 6409 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])F 34a_100011219540_200025704644 [0,2,0,0,0,0|1,0,0]=3 6410 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])F 7a_100011219540_200025704644 [0,2,0,0,0,0|1,0,0]=3 6411 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])I 34a_100000149868_200025704644 [0,2,0,0,0,0|1,0,0]=3 6412 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])I 7a_100000149868_200025704644 [0,2,0,0,0,0|1,0,0]=3 6413 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])N 34a_100011246163_200025704644 [0,2,0,0,0,0|1,0,0]=3 6414 B13R1.2209 COC(=O)c1cc(ccc1O[13CH3])N 7a_100011246163_200025704644 [0,2,0,0,0,0|1,0,0]=3 6415 B13R1.2209 COC(=O)c1cc(ccc1SC)Br 62a_100000148213_200000210301 [0,2,0,0,0,0|1,1,0]=4 6416 B13R1.2209 COC(=O)c1cc(ccc1SC)Br 62a_200000210301_100000148213 [0,2,0,0,0,0|1,1,0]=4 6417 B13R1.2209 COC(=O)c1cc(ccc1SC)C 62a_100012339458_200000210301 [0,2,0,0,0,0|0,1,0]=3 6418 B13R1.2209 COC(=O)c1cc(ccc1SC)C 62a_200000210301_100012339458 [0,2,0,0,0,0|0,1,0]=3 6419 B13R1.2209 COC(=O)c1cc(ccc1SC)Cl 62a_100011294804_200000210301 [0,2,0,0,0,0|1,1,0]=4 6420 B13R1.2209 COC(=O)c1cc(ccc1SC)Cl 62a_200000210301_100011294804 [0,2,0,0,0,0|1,1,0]=4 6421 B13R1.2209 COC(=O)c1cc(ccc1SC)F 62a_100000205820_200000210301 [0,2,0,0,0,0|1,1,0]=4 6422 B13R1.2209 COC(=O)c1cc(ccc1SC)F 62a_200000210301_100000205820 [0,2,0,0,0,0|1,1,0]=4 6423 B13R1.2209 COC(=O)c1cc(ccc1SC)N 62a_100000696289_200000210301 [0,2,0,0,0,0|1,1,0]=4 6424 B13R1.2209 COC(=O)c1cc(ccc1SC)N 62a_200000210301_100011794239 [0,2,0,0,0,0|1,1,0]=4 6425 B13R1.2209 COC(=O)c1cc(ccc1SC)O 271570a_203496583355_200010204078 [0,2,0,0,0,0|1,1,0]=4 6426 B13R1.2209 COC(=O)c1cc(ccc1SC)O 62a_100010230369_200000210301 [0,2,0,0,0,0|1,1,0]=4 6427 B13R1.2209 COC(=O)c1cc(ccc1SC)O 62a_200000210301_100010230369 [0,2,0,0,0,0|1,1,0]=4 6428 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Br 62a_100000148213_200025704644 [0,2,0,0,0,0|1,1,0]=4 6429 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Br 62a_200025704644_100000148213 [0,2,0,0,0,0|1,1,0]=4 6430 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])C 62a_100012339458_200025704644 [0,2,0,0,0,0|0,1,0]=3 6431 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])C 62a_200025704644_100012339458 [0,2,0,0,0,0|0,1,0]=3 6432 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Cl 62a_100011294804_200025704644 [0,2,0,0,0,0|1,1,0]=4 6433 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])Cl 62a_200025704644_100011294804 [0,2,0,0,0,0|1,1,0]=4 6434 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])F 62a_100000205820_200025704644 [0,2,0,0,0,0|1,1,0]=4 6435 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_100000205820 [0,2,0,0,0,0|1,1,0]=4 6436 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])N 62a_100000696289_200025704644 [0,2,0,0,0,0|1,1,0]=4 6437 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])N 62a_200025704644_100011794239 [0,2,0,0,0,0|1,1,0]=4 6438 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])O 62a_100010230369_200025704644 [0,2,0,0,0,0|1,1,0]=4 6439 B13R1.2209 COC(=O)c1cc(ccc1S[13CH3])O 62a_200025704644_100010230369 [0,2,0,0,0,0|1,1,0]=4 6440 B13R1.2209 COC(=O)c1cc(cnc1OC)O 271570a_203496583355_100000698521 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.2209 COC(=O)c1cc(cnc1SC)C 62a_100010162703_200000210301 [0,2,0,0,0,0|1,1,0]=4 6442 B13R1.2209 COC(=O)c1cc(cnc1SC)C 62a_200000210301_100000085774 [0,2,0,0,0,0|1,1,0]=4 6443 B13R1.2209 COC(=O)c1cc(cnc1S[13CH3])C 62a_100010162703_200025704644 [0,2,0,0,0,0|1,1,0]=4 6444 B13R1.2209 COC(=O)c1cc(cnc1S[13CH3])C 62a_200025704644_100000085774 [0,2,0,0,0,0|1,1,0]=4 6445 B13R1.2209 COC(=O)c1cc(ncc1OC)Br 34a_100010136202_200000210301 [0,2,0,0,0,0|2,0,0]=4 6446 B13R1.2209 COC(=O)c1cc(ncc1OC)Br 7a_100010136202_200000210301 [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.2209 COC(=O)c1cc(ncc1O[13CH3])Br 34a_100010136202_200025704644 [0,2,0,0,0,0|2,0,0]=4 6448 B13R1.2209 COC(=O)c1cc(ncc1O[13CH3])Br 7a_100010136202_200025704644 [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.2209 COC(=O)c1nc(ccc1OC)Br 34a_100000697862_200000210301 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.2209 COC(=O)c1nc(ccc1OC)Br 7a_100000697862_200000210301 [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.2209 COC(=O)c1nc(ccc1OC)C 34a_100009869402_200000210301 [0,2,0,0,0,0|1,0,0]=3 6452 B13R1.2209 COC(=O)c1nc(ccc1OC)C 7a_100009869402_200000210301 [0,2,0,0,0,0|1,0,0]=3 6453 B13R1.2209 COC(=O)c1nc(ccc1OC)O 271570a_203496583355_100010136180 [0,2,0,0,0,0|2,0,0]=4 6454 B13R1.2209 COC(=O)c1nc(ccc1O[13CH3])Br 34a_100000697862_200025704644 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.2209 COC(=O)c1nc(ccc1O[13CH3])Br 7a_100000697862_200025704644 [0,2,0,0,0,0|2,0,0]=4 6456 B13R1.2209 COC(=O)c1nc(ccc1O[13CH3])C 34a_100009869402_200025704644 [0,2,0,0,0,0|1,0,0]=3 6457 B13R1.2209 COC(=O)c1nc(ccc1O[13CH3])C 7a_100009869402_200025704644 [0,2,0,0,0,0|1,0,0]=3 6458 B13R1.2209 COc1ccc(cc1C(=O)CBr)Br 7a_200009828000_200000210301 [0,2,0,0,0,0|1,0,0]=3 6459 B13R1.2209 COc1ccc(cc1C(=O)CBr)Cl 7a_200009816716_200000210301 [0,2,0,0,0,0|1,0,0]=3 6460 B13R1.2209 COc1ccc(cc1C(=O)CBr)F 7a_100009814381_200000210301 [0,2,0,0,0,0|1,0,0]=3 6461 B13R1.2209 COc1ccc(cc1C(=O)CCl)F 7a_100000047744_200000210301 [0,2,0,0,0,0|1,0,0]=3 6462 B13R1.2209 COc1ccc(cc1C(=O)CF)Br 1458a_100000188853_100015361967 [0,2,0,0,0,0|1,0,0]=3 6463 B13R1.2209 COc1ccc(cc1C(=O)CF)C 1458a_100000204667_100015361967 [0,2,0,0,0,0|0,0,0]=2 6464 B13R1.2209 COc1ccc(cc1C(=O)CF)Cl 1458a_100000211409_100015361967 [0,2,0,0,0,0|1,0,0]=3 6465 B13R1.2209 COc1ccc(cc1C(=O)CF)F 1458a_100000735445_100015361967 [0,2,0,0,0,0|1,0,0]=3 6466 B13R1.2209 COc1ccc(cc1C(=O)CF)I 1458a_100000230898_100015361967 [0,2,0,0,0,0|1,0,0]=3 6467 B13R1.2209 COc1ccc(cc1C(=O)CF)O 1458a_200000100057_100015361967 [0,2,0,0,0,0|1,0,0]=3 6468 B13R1.2209 COc1ccc(cc1C(=O)NN)Br 34a_100000193350_200000210301 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.2209 COc1ccc(cc1C(=O)NN)C 34a_200000193374_200000210301 [0,2,0,0,0,0|1,0,0]=3 6470 B13R1.2209 COc1ccc(cc1C(=O)NO)Cl 34a_100000199126_200000210301 [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.2209 Cc1ccc(c(c1)C(=O)NN)O[13CH3] 34a_200000193374_200025704644 [0,2,0,0,0,0|1,0,0]=3 6472 B13R1.2209 N#Cc1ccc(cc1C(=O)CF)F 1458a_100011217471_100015361967 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)CBr)Br 7a_200009828000_200025704644 [0,2,0,0,0,0|1,0,0]=3 6474 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)CBr)Cl 7a_200009816716_200025704644 [0,2,0,0,0,0|1,0,0]=3 6475 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)CBr)F 7a_100009814381_200025704644 [0,2,0,0,0,0|1,0,0]=3 6476 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)CCl)F 7a_100000047744_200025704644 [0,2,0,0,0,0|1,0,0]=3 6477 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)NN)Br 34a_100000193350_200025704644 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.2209 [13CH3]Oc1ccc(cc1C(=O)NO)Cl 34a_100000199126_200025704644 [0,2,0,0,0,0|2,0,0]=4 6479 B13R1.2279 C=C(C)c1c(ccc(c1F)F)CO 271570a_100000694244_100015087060 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.2279 C=C(C)c1c(ccc(c1F)F)OC 271570a_100000694244_100010204329 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.2279 COc1ccc(c(c1C(=O)C)C)Br 1458a_200010273786_200000210301 [0,2,0,0,0,0|1,0,0]=3 6482 B13R1.2279 COc1ccc(c(c1C(=O)C)F)Br 1458a_100010782282_200000210301 [0,2,0,0,0,0|1,0,0]=3 6483 B13R1.2279 COc1ccc(c(c1C(=O)C)F)F 1458a_100000062122_200000210301 [0,2,0,0,0,0|1,0,0]=3 6484 B13R1.2279 COc1ccc(c(c1C(=O)[13CH3])C)Br 1458a_200010273786_200025704644 [0,2,0,0,0,0|1,0,0]=3 6485 B13R1.2279 COc1ccc(c(c1C(=O)[13CH3])F)Br 1458a_100010782282_200025704644 [0,2,0,0,0,0|1,0,0]=3 6486 B13R1.2279 COc1ccc(c(c1C(=O)[13CH3])F)F 1458a_100000062122_200025704644 [0,2,0,0,0,0|1,0,0]=3 6487 B13R1.2398 C=C(C)c1cc(c(cc1C#N)F)C 271570a_100000694244_100010186300 [0,2,0,0,0,0|2,0,0]=4 6488 B13R1.2398 C=C(C)c1cc(c(cc1C=O)C)C 271570a_100000694244_100010184403 [0,2,0,0,0,0|1,0,1]=4 6489 B13R1.2398 C=C(C)c1cc(c(cc1C=O)F)C 271570a_100000694244_100010186290 [0,2,0,0,0,0|1,0,1]=4 6490 B13R1.2398 C=C(C)c1cc(c(cc1C=O)O)C 271570a_100000694244_100010186689 [0,2,0,0,0,0|1,0,1]=4 6491 B13R1.2398 C=C(C)c1cc(c(cc1CO)C)C 271570a_100000694244_100010184405 [0,2,0,0,0,0|1,0,0]=3 6492 B13R1.2398 C=C(C)c1cc(c(cc1CO)F)F 271570a_100000694244_100012344399 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.2398 C=C(C)c1cc(c(cc1OC)C)N 271570a_100000694244_106657271712 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.2398 C=C(C)c1cc(c(cc1OC)F)C 271570a_100000694244_100010201977 [0,2,0,0,0,0|1,0,0]=3 6495 B13R1.2398 C=C(C)c1cc(c(cc1OC)F)F 271570a_100000694244_100009813744 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.2398 C=C(C)c1cc(c(cc1OC)N)C 271570a_100000694244_100010232211 [0,2,0,0,0,0|1,0,0]=3 6497 B13R1.2398 C=C(C)c1cc(c(cc1OC)N)N 271570a_100000694244_100012769537 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.2398 C=Cc1cc(c(cc1C(=O)C)F)F 271570a_100011290941_100013243444 [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Br)C 34a_100009816031_200025704644 [0,2,0,0,0,0|0,0,0]=2 6500 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Br)C 7a_100009816031_200025704644 [0,2,0,0,0,0|0,0,0]=2 6501 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Br)F 34a_200010245088_200025704644 [0,2,0,0,0,0|1,0,0]=3 6502 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Br)F 7a_200010245088_200025704644 [0,2,0,0,0,0|1,0,0]=3 6503 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)Br 34a_200010233951_200025704644 [0,2,0,0,0,0|1,0,0]=3 6504 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)Br 7a_200010233951_200025704644 [0,2,0,0,0,0|1,0,0]=3 6505 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)C 34a_100000014572_200025704644 [0,2,0,0,0,0|0,0,0]=2 6506 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)C 7a_100000014572_200025704644 [0,2,0,0,0,0|0,0,0]=2 6507 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)Cl 34a_100000014566_200025704644 [0,2,0,0,0,0|1,0,0]=3 6508 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])C)Cl 7a_100000014566_200025704644 [0,2,0,0,0,0|1,0,0]=3 6509 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Cl)Cl 34a_100000720105_200025704644 [0,2,0,0,0,0|1,0,0]=3 6510 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])Cl)Cl 7a_100000720105_200025704644 [0,2,0,0,0,0|1,0,0]=3 6511 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])F)Br 34a_100000691652_200025704644 [0,2,0,0,0,0|1,0,0]=3 6512 B13R1.2398 CC(=O)c1cc(c(cc1O[13CH3])F)Br 7a_100000691652_200025704644 [0,2,0,0,0,0|1,0,0]=3 6513 B13R1.2398 CC(=O)c1cc(c(cc1S[13CH3])F)F 62a_100013243444_200025704644 [0,2,0,0,0,0|1,1,0]=4 6514 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)C 1458a_100000728833_200000210301 [0,2,0,0,0,0|1,0,0]=3 6515 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)C 34a_200010233951_200000210301 [0,2,0,0,0,0|1,0,0]=3 6516 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)C 7a_200010233951_200000210301 [0,2,0,0,0,0|1,0,0]=3 6517 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)Cl 1458a_100000760434_200000210301 [0,2,0,0,0,0|1,0,0]=3 6518 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)F 1458a_100012355408_200000210301 [0,2,0,0,0,0|1,0,0]=3 6519 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)F 34a_100000691652_200000210301 [0,2,0,0,0,0|1,0,0]=3 6520 B13R1.2398 COc1cc(c(cc1C(=O)C)Br)F 7a_100000691652_200000210301 [0,2,0,0,0,0|1,0,0]=3 6521 B13R1.2398 COc1cc(c(cc1C(=O)C)C)Br 34a_100009816031_200000210301 [0,2,0,0,0,0|0,0,0]=2 6522 B13R1.2398 COc1cc(c(cc1C(=O)C)C)Br 7a_100009816031_200000210301 [0,2,0,0,0,0|0,0,0]=2 6523 B13R1.2398 COc1cc(c(cc1C(=O)C)C)C 34a_100000014572_200000210301 [0,2,0,0,0,0|0,0,0]=2 6524 B13R1.2398 COc1cc(c(cc1C(=O)C)C)C 7a_100000014572_200000210301 [0,2,0,0,0,0|0,0,0]=2 6525 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)C 34a_100000014566_200000210301 [0,2,0,0,0,0|1,0,0]=3 6526 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)C 7a_100000014566_200000210301 [0,2,0,0,0,0|1,0,0]=3 6527 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)Cl 1458a_100000684457_200000210301 [0,2,0,0,0,0|1,0,0]=3 6528 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)Cl 34a_100000720105_200000210301 [0,2,0,0,0,0|1,0,0]=3 6529 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)Cl 7a_100000720105_200000210301 [0,2,0,0,0,0|1,0,0]=3 6530 B13R1.2398 COc1cc(c(cc1C(=O)C)Cl)I 1458a_200000738201_200000210301 [0,2,0,0,0,0|1,0,0]=3 6531 B13R1.2398 COc1cc(c(cc1C(=O)C)F)Br 1458a_100010827335_200000210301 [0,2,0,0,0,0|1,0,0]=3 6532 B13R1.2398 COc1cc(c(cc1C(=O)C)F)Br 34a_200010245088_200000210301 [0,2,0,0,0,0|1,0,0]=3 6533 B13R1.2398 COc1cc(c(cc1C(=O)C)F)Br 7a_200010245088_200000210301 [0,2,0,0,0,0|1,0,0]=3 6534 B13R1.2398 COc1cc(c(cc1C(=O)C)F)F 1458a_100000062012_200000210301 [0,2,0,0,0,0|1,0,0]=3 6535 B13R1.2398 COc1cc(c(cc1C(=O)C)I)Cl 1458a_100013369036_200000210301 [0,2,0,0,0,0|1,0,0]=3 6536 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])Br)C 1458a_100000728833_200025704644 [0,2,0,0,0,0|1,0,0]=3 6537 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])Br)Cl 1458a_100000760434_200025704644 [0,2,0,0,0,0|1,0,0]=3 6538 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])Br)F 1458a_100012355408_200025704644 [0,2,0,0,0,0|1,0,0]=3 6539 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100000684457_200025704644 [0,2,0,0,0,0|1,0,0]=3 6540 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])Cl)I 1458a_200000738201_200025704644 [0,2,0,0,0,0|1,0,0]=3 6541 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])F)Br 1458a_100010827335_200025704644 [0,2,0,0,0,0|1,0,0]=3 6542 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])F)F 1458a_100000062012_200025704644 [0,2,0,0,0,0|1,0,0]=3 6543 B13R1.2398 COc1cc(c(cc1C(=O)[13CH3])I)Cl 1458a_100013369036_200025704644 [0,2,0,0,0,0|1,0,0]=3 6544 B13R1.2398 COc1cc(c(cc1[N+](=O)[O-])C)Cl 34a_200009838783_200000210301 [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.2398 COc1cc(c(cc1[N+](=O)[O-])C)Cl 7a_200009838783_200000210301 [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.2398 COc1cc(c(cc1[N+](=O)[O-])C)F 34a_100012182840_200000210301 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.2398 COc1cc(c(cc1[N+](=O)[O-])C)F 7a_100012182840_200000210301 [0,2,0,0,0,0|2,0,0]=4 6548 B13R1.2398 CSc1cc(c(cc1C(=O)C)F)F 62a_100013243444_200000210301 [0,2,0,0,0,0|1,1,0]=4 6549 B13R1.2398 Cc1cc(c(cc1Cl)O[13CH3])[N+](=O)[O-] 34a_200009838783_200025704644 [0,2,0,0,0,0|2,0,0]=4 6550 B13R1.2398 Cc1cc(c(cc1Cl)O[13CH3])[N+](=O)[O-] 7a_200009838783_200025704644 [0,2,0,0,0,0|2,0,0]=4 6551 B13R1.2398 Cc1cc(c(cc1F)O[13CH3])[N+](=O)[O-] 34a_100012182840_200025704644 [0,2,0,0,0,0|2,0,0]=4 6552 B13R1.2398 Cc1cc(c(cc1F)O[13CH3])[N+](=O)[O-] 7a_100012182840_200025704644 [0,2,0,0,0,0|2,0,0]=4 6553 B13R1.2430 C=C(C)c1cc(ccc1C#N)CC 271570a_100000694244_100010295696 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.2430 C=C(C)c1cc(ccc1C#N)CO 271570a_100000694244_100009876504 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.2430 C=C(C)c1cc(ccc1C#N)OC 271570a_100000694244_100012355471 [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.2430 C=C(C)c1cc(ccc1C=O)OC 271570a_100000694244_100000723261 [0,2,0,0,0,0|1,0,1]=4 6557 B13R1.2430 C=C(C)c1cc(ccc1CO)C#N 271570a_100000694244_100010214422 [0,2,0,0,0,0|1,0,1]=4 6558 B13R1.2430 C=C(C)c1cc(ccc1CO)CO 271570a_100000694244_100010881536 [0,2,0,0,0,0|1,0,0]=3 6559 B13R1.2430 C=C(C)c1cc(ccc1CO)OC 271570a_100000694244_100011982768 [0,2,0,0,0,0|1,0,0]=3 6560 B13R1.2430 C=C(C)c1cc(ccc1OC)C#N 271570a_100000694244_100000188253 [0,2,0,0,0,0|1,0,1]=4 6561 B13R1.2430 C=C(C)c1cc(ccc1OC)C=O 271570a_100000694244_100000173361 [0,2,0,0,0,0|1,0,1]=4 6562 B13R1.2430 C=C(C)c1cc(ccc1OC)CC 271570a_100000694244_100010062400 [0,2,0,0,0,0|1,0,0]=3 6563 B13R1.2430 C=C(C)c1cc(ccc1OC)CN 271570a_100000694244_100159240714 [0,2,0,0,0,0|1,0,0]=3 6564 B13R1.2430 C=C(C)c1cc(ccc1OC)CO 271570a_100000694244_100000246451 [0,2,0,0,0,0|1,0,0]=3 6565 B13R1.2430 C=C(C)c1cc(ccc1OC)NC 271570a_100000694244_114948341033 [0,2,0,0,0,0|1,0,0]=3 6566 B13R1.2430 C=C(C)c1cc(ccc1OC)OC 271570a_100000694244_100011215452 [0,2,0,0,0,0|1,0,0]=3 6567 B13R1.2430 C=C(C)c1nc(ccc1CO)OC 271570a_100000694244_100009885603 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.2430 C=C(C)c1nc(ccc1OC)CO 271570a_100000694244_100009842956 [0,2,0,0,0,0|2,0,0]=4 6569 B13R1.2430 C=Cc1ccc(c(c1)C(=O)C)OC 271570a_100011290941_100000173343 [0,2,0,0,0,0|0,0,1]=3 6570 B13R1.2430 C=Cc1ccc(cc1C(=O)C)OC 271570a_100011290941_100011360761 [0,2,0,0,0,0|1,0,0]=3 6571 B13R1.2430 C=Cc1ccc(cc1C(=O)N)OC 271570a_100011290941_100000162014 [0,2,0,0,0,0|2,0,0]=4 6572 B13R1.2430 C=Cc1cnc(c(c1)C(=O)C)OC 271570a_100011290941_100010135678 [0,2,0,0,0,0|1,0,1]=4 6573 B13R1.2430 CC(=O)c1cc(ccc1O[13CH3])C#N 34a_100000074817_200025704644 [0,2,0,0,0,0|0,0,1]=3 6574 B13R1.2430 CC(=O)c1cc(ccc1O[13CH3])C#N 7a_100000074817_200025704644 [0,2,0,0,0,0|0,0,1]=3 6575 B13R1.2430 CCc1ccc(c(c1)C(=O)C)OC 34a_100000230022_200000210301 [0,2,0,0,0,0|0,0,0]=2 6576 B13R1.2430 CCc1ccc(c(c1)C(=O)C)OC 7a_100000230022_200000210301 [0,2,0,0,0,0|0,0,0]=2 6577 B13R1.2430 CCc1ccc(c(c1)C(=O)C)O[13CH3] 34a_100000230022_200025704644 [0,2,0,0,0,0|0,0,0]=2 6578 B13R1.2430 CCc1ccc(c(c1)C(=O)C)O[13CH3] 7a_100000230022_200025704644 [0,2,0,0,0,0|0,0,0]=2 6579 B13R1.2430 CCc1ccc(c(c1)C(=O)N)NC 34a_100014932089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.2430 CCc1ccc(c(c1)C(=O)N)NC 7a_100014932089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.2430 CCc1ccc(c(c1)C(=O)N)N[13CH3] 34a_100014932089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.2430 CCc1ccc(c(c1)C(=O)N)N[13CH3] 7a_100014932089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.2430 CCc1ccc(c(c1)[N+](=O)[O-])OC 34a_100000756517_200000210301 [0,2,0,0,0,0|2,0,0]=4 6584 B13R1.2430 CCc1ccc(c(c1)[N+](=O)[O-])OC 7a_100000756517_200000210301 [0,2,0,0,0,0|2,0,0]=4 6585 B13R1.2430 CCc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 34a_100000756517_200025704644 [0,2,0,0,0,0|2,0,0]=4 6586 B13R1.2430 CCc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 7a_100000756517_200025704644 [0,2,0,0,0,0|2,0,0]=4 6587 B13R1.2430 CNc1ccc(c(c1)C(=O)N)OC 34a_200011413973_200000210301 [0,2,0,0,0,0|1,0,0]=3 6588 B13R1.2430 CNc1ccc(c(c1)C(=O)N)OC 7a_200011413973_200000210301 [0,2,0,0,0,0|1,0,0]=3 6589 B13R1.2430 CNc1ccc(c(c1)C(C)C)OC 2230a_100025764739_200000210301 [0,2,0,0,0,0|1,0,1]=4 6590 B13R1.2430 CNc1ccc(c(c1)C(C)C)OC 34a_100025764739_200000210301 [0,2,0,0,0,0|1,0,1]=4 6591 B13R1.2430 CNc1ccc(c(c1)[N+](=O)[O-])OC 34a_100000042093_200000210301 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.2430 CNc1ccc(cc1C(=O)N)OC 34a_100011380456_200000210301 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.2430 CNc1ccc(cc1C(=O)N)SC 62a_200010114593_200000210301 [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.2430 CNc1ccc(cc1C(=O)N)S[13CH3] 62a_200010114593_200025704644 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.2430 COc1ccc(c(c1)C(=O)C)C#N 1458a_100011219403_200000210301 [0,2,0,0,0,0|1,0,0]=3 6596 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 1458a_100000185243_200000210301 [0,2,0,0,0,0|0,0,0]=2 6597 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 34a_100000081070_200000210301 [0,2,0,0,0,0|0,0,0]=2 6598 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 34a_100000211518_200000210301 [0,2,0,0,0,0|0,0,0]=2 6599 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 7a_100000081070_200000210301 [0,2,0,0,0,0|0,0,0]=2 6600 B13R1.2430 COc1ccc(c(c1)C(=O)C)OC 7a_100000211518_200000210301 [0,2,0,0,0,0|0,0,0]=2 6601 B13R1.2430 COc1ccc(c(c1)C(=O)C)O[13CH3] 34a_100000211518_200025704644 [0,2,0,0,0,0|0,0,0]=2 6602 B13R1.2430 COc1ccc(c(c1)C(=O)C)O[13CH3] 7a_100000211518_200025704644 [0,2,0,0,0,0|0,0,0]=2 6603 B13R1.2430 COc1ccc(c(c1)C(=O)C)SC 62a_100011360761_200000210301 [0,2,0,0,0,0|0,1,0]=3 6604 B13R1.2430 COc1ccc(c(c1)C(=O)C)S[13CH3] 62a_100011360761_200025704644 [0,2,0,0,0,0|0,1,0]=3 6605 B13R1.2430 COc1ccc(c(c1)C(=O)N)N[13CH3] 34a_100011380456_200025704644 [0,2,0,0,0,0|2,0,0]=4 6606 B13R1.2430 COc1ccc(c(c1)C(=O)N)SC 62a_100000162014_200000210301 [0,2,0,0,0,0|1,1,0]=4 6607 B13R1.2430 COc1ccc(c(c1)C(=O)N)S[13CH3] 62a_100000162014_200025704644 [0,2,0,0,0,0|1,1,0]=4 6608 B13R1.2430 COc1ccc(c(c1)C(=O)[13CH3])C#N 1458a_100011219403_200025704644 [0,2,0,0,0,0|1,0,0]=3 6609 B13R1.2430 COc1ccc(c(c1)C(=O)[13CH3])OC 1458a_100000185243_200025704644 [0,2,0,0,0,0|0,0,0]=2 6610 B13R1.2430 COc1ccc(c(c1)C(C)C)OC 34a_100011998526_200000210301 [0,2,0,0,0,0|1,0,1]=4 6611 B13R1.2430 COc1ccc(c(c1)C(C)C)OC 7a_100011998526_200000210301 [0,2,0,0,0,0|1,0,1]=4 6612 B13R1.2430 COc1ccc(c(c1)C(C)C)O[13CH3] 34a_100011998526_200025704644 [0,2,0,0,0,0|1,0,1]=4 6613 B13R1.2430 COc1ccc(c(c1)C(C)C)O[13CH3] 7a_100011998526_200025704644 [0,2,0,0,0,0|1,0,1]=4 6614 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 2230a_100000221073_200000210301 [0,2,0,0,0,0|2,0,0]=4 6615 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 269982a_100000221073_200000210301 [0,2,0,0,0,0|2,0,0]=4 6616 B13R1.2430 COc1ccc(c(c1)N(C)C)OC 34a_100000221073_200000210301 [0,2,0,0,0,0|2,0,0]=4 6617 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 2230a_100000221073_200025704644 [0,2,0,0,0,0|2,0,0]=4 6618 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 269982a_100000221073_200025704644 [0,2,0,0,0,0|2,0,0]=4 6619 B13R1.2430 COc1ccc(c(c1)N(C)[13CH3])OC 34a_100000221073_200025704644 [0,2,0,0,0,0|2,0,0]=4 6620 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])CO 34a_200009888365_200000210301 [0,2,0,0,0,0|2,0,0]=4 6621 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])CO 7a_200009888365_200000210301 [0,2,0,0,0,0|2,0,0]=4 6622 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])OC 34a_100000211607_200000210301 [0,2,0,0,0,0|2,0,0]=4 6623 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])OC 34a_100000716441_200000210301 [0,2,0,0,0,0|2,0,0]=4 6624 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])OC 7a_100000211607_200000210301 [0,2,0,0,0,0|2,0,0]=4 6625 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])OC 7a_100000716441_200000210301 [0,2,0,0,0,0|2,0,0]=4 6626 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 34a_100000211607_200025704644 [0,2,0,0,0,0|2,0,0]=4 6627 B13R1.2430 COc1ccc(c(c1)[N+](=O)[O-])O[13CH3] 7a_100000211607_200025704644 [0,2,0,0,0,0|2,0,0]=4 6628 B13R1.2430 COc1ccc(cc1C(=O)C)C#N 1458a_100009859923_200000210301 [0,2,0,0,0,0|0,0,1]=3 6629 B13R1.2430 COc1ccc(cc1C(=O)C)C#N 34a_100000074817_200000210301 [0,2,0,0,0,0|0,0,1]=3 6630 B13R1.2430 COc1ccc(cc1C(=O)C)C#N 7a_100000074817_200000210301 [0,2,0,0,0,0|0,0,1]=3 6631 B13R1.2430 COc1ccc(cc1C(=O)C)O[13CH3] 34a_100000081070_200025704644 [0,2,0,0,0,0|0,0,0]=2 6632 B13R1.2430 COc1ccc(cc1C(=O)C)O[13CH3] 7a_100000081070_200025704644 [0,2,0,0,0,0|0,0,0]=2 6633 B13R1.2430 COc1ccc(cc1C(=O)C)SC 62a_100000173343_200000210301 [0,2,0,0,0,0|0,0,0]=2 6634 B13R1.2430 COc1ccc(cc1C(=O)C)S[13CH3] 62a_100000173343_200025704644 [0,2,0,0,0,0|0,0,0]=2 6635 B13R1.2430 COc1ccc(cc1C(=O)N)N[13CH3] 34a_200011413973_200025704644 [0,2,0,0,0,0|1,0,0]=3 6636 B13R1.2430 COc1ccc(cc1C(=O)N)N[13CH3] 7a_200011413973_200025704644 [0,2,0,0,0,0|1,0,0]=3 6637 B13R1.2430 COc1ccc(cc1C(=O)[13CH3])C#N 1458a_100009859923_200025704644 [0,2,0,0,0,0|0,0,1]=3 6638 B13R1.2430 COc1ccc(cc1C(C)C)N[13CH3] 2230a_100025764739_200025704644 [0,2,0,0,0,0|1,0,1]=4 6639 B13R1.2430 COc1ccc(cc1C(C)C)N[13CH3] 34a_100025764739_200025704644 [0,2,0,0,0,0|1,0,1]=4 6640 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CBr 34a_100010149780_200000210301 [0,2,0,0,0,0|2,0,0]=4 6641 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CBr 7a_100010149780_200000210301 [0,2,0,0,0,0|2,0,0]=4 6642 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CCl 34a_200000683477_200000210301 [0,2,0,0,0,0|2,0,0]=4 6643 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CCl 7a_200000683477_200000210301 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CO 34a_100011216038_200000210301 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])CO 7a_100011216038_200000210301 [0,2,0,0,0,0|2,0,0]=4 6646 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])N[13CH3] 34a_100000042093_200025704644 [0,2,0,0,0,0|2,0,0]=4 6647 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])O[13CH3] 34a_100000716441_200025704644 [0,2,0,0,0,0|2,0,0]=4 6648 B13R1.2430 COc1ccc(cc1[N+](=O)[O-])O[13CH3] 7a_100000716441_200025704644 [0,2,0,0,0,0|2,0,0]=4 6649 B13R1.2430 COc1ncc(cc1C(=O)C)SC 62a_100010135678_200000210301 [0,2,0,0,0,0|1,0,0]=3 6650 B13R1.2430 COc1ncc(cc1C(=O)C)SC 62a_200000210301_100010135678 [0,2,0,0,0,0|1,0,0]=3 6651 B13R1.2430 COc1ncc(cc1C(=O)C)S[13CH3] 62a_100010135678_200025704644 [0,2,0,0,0,0|1,0,0]=3 6652 B13R1.2430 COc1ncc(cc1C(=O)C)S[13CH3] 62a_200025704644_100010135678 [0,2,0,0,0,0|1,0,0]=3 6653 B13R1.2430 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])CO 34a_200009888365_200025704644 [0,2,0,0,0,0|2,0,0]=4 6654 B13R1.2430 [13CH3]Oc1ccc(c(c1)[N+](=O)[O-])CO 7a_200009888365_200025704644 [0,2,0,0,0,0|2,0,0]=4 6655 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CBr 34a_100010149780_200025704644 [0,2,0,0,0,0|2,0,0]=4 6656 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CBr 7a_100010149780_200025704644 [0,2,0,0,0,0|2,0,0]=4 6657 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CCl 34a_200000683477_200025704644 [0,2,0,0,0,0|2,0,0]=4 6658 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CCl 7a_200000683477_200025704644 [0,2,0,0,0,0|2,0,0]=4 6659 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CO 34a_100011216038_200025704644 [0,2,0,0,0,0|2,0,0]=4 6660 B13R1.2430 [13CH3]Oc1ccc(cc1[N+](=O)[O-])CO 7a_100011216038_200025704644 [0,2,0,0,0,0|2,0,0]=4 6661 B13R1.3090 CNc1ccc(cc1P(=O)(C)C)C 2230a_202126155009_200000210301 [0,2,0,0,0,0|2,0,0]=4 6662 B13R1.3090 CNc1ccc(cc1P(=O)(C)C)C 34a_202126155009_200000210301 [0,2,0,0,0,0|2,0,0]=4 6663 B13R1.3090 CNc1ccc(cc1P(=O)(C)C)C 7a_202126155009_200000210301 [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.3090 COc1ccc(cc1C(C)(C)C)C 34a_100000211090_200000210301 [0,2,0,0,0,0|1,0,1]=4 6665 B13R1.3090 COc1ccc(cc1C(C)(C)C)C 7a_100000211090_200000210301 [0,2,0,0,0,0|1,0,1]=4 6666 B13R1.3090 COc1ccc(cc1S(=O)(=O)C)Br 34a_200015712519_200000210301 [0,2,0,0,0,0|2,0,0]=4 6667 B13R1.3090 COc1ccc(cc1S(=O)(=O)C)Br 7a_200015712519_200000210301 [0,2,0,0,0,0|2,0,0]=4 6668 B13R1.3090 CS(=O)(=O)c1cc(ccc1O[13CH3])Br 34a_200015712519_200025704644 [0,2,0,0,0,0|2,0,0]=4 6669 B13R1.3090 CS(=O)(=O)c1cc(ccc1O[13CH3])Br 7a_200015712519_200025704644 [0,2,0,0,0,0|2,0,0]=4 6670 B13R1.3090 Cc1ccc(c(c1)C(C)(C)C)O[13CH3] 34a_100000211090_200025704644 [0,2,0,0,0,0|1,0,1]=4 6671 B13R1.3090 Cc1ccc(c(c1)C(C)(C)C)O[13CH3] 7a_100000211090_200025704644 [0,2,0,0,0,0|1,0,1]=4 6672 B13R1.3090 Cc1ccc(c(c1)P(=O)(C)C)N[13CH3] 2230a_202126155009_200025704644 [0,2,0,0,0,0|2,0,0]=4 6673 B13R1.3090 Cc1ccc(c(c1)P(=O)(C)C)N[13CH3] 34a_202126155009_200025704644 [0,2,0,0,0,0|2,0,0]=4 6674 B13R1.3090 Cc1ccc(c(c1)P(=O)(C)C)N[13CH3] 7a_202126155009_200025704644 [0,2,0,0,0,0|2,0,0]=4 6675 B13R1.3255 C=C(C)c1cc(cc(c1C#N)F)C 271570a_100000694244_100016215262 [0,2,0,0,0,0|2,0,0]=4 6676 B13R1.3255 C=C(C)c1cc(cc(c1C=O)F)C 271570a_100000694244_100010341274 [0,2,0,0,0,0|1,0,1]=4 6677 B13R1.3255 C=C(C)c1cc(cc(c1CO)F)C 271570a_100000694244_100016175008 [0,2,0,0,0,0|1,0,0]=3 6678 B13R1.3255 C=C(C)c1cc(cc(c1CO)F)F 271570a_100000694244_100015506809 [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.3255 C=C(C)c1cc(cc(c1OC)C)N 271570a_100000694244_100010071304 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.3255 C=C(C)c1cc(cc(c1OC)F)C 271570a_100000694244_200010713180 [0,2,0,0,0,0|1,0,0]=3 6681 B13R1.3255 C=C(C)c1cc(cc(c1OC)F)F 271570a_100000694244_100009813607 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.3255 C=C(C)c1cc(cc(c1OC)F)N 271570a_100000694244_200009816006 [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.3255 C=C(C)c1cc(cc(c1OC)N)Br 271570a_100000694244_100015658936 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.3255 C=C(C)c1cc(cc(c1OC)N)F 271570a_100000694244_100011190657 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.3255 C=C(C)c1cc(cc(c1SC)F)C 271570a_100000694244_202125771776 [0,2,0,0,0,0|1,1,0]=4 6686 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)Br 7a_100000212130_200025704644 [0,2,0,0,0,0|1,0,0]=3 6687 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)C 7a_100011659362_200025704644 [0,2,0,0,0,0|0,0,0]=2 6688 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Br)Cl 7a_100011218835_200025704644 [0,2,0,0,0,0|1,0,0]=3 6689 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])C)C 34a_100000188341_200025704644 [0,2,0,0,0,0|0,0,0]=2 6690 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])C)C 7a_100000188341_200025704644 [0,2,0,0,0,0|0,0,0]=2 6691 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)C 34a_100010659243_200025704644 [0,2,0,0,0,0|0,0,0]=2 6692 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)C 7a_100010659243_200025704644 [0,2,0,0,0,0|0,0,0]=2 6693 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)Cl 7a_100000182809_200025704644 [0,2,0,0,0,0|1,0,0]=3 6694 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)F 34a_100011659368_200025704644 [0,2,0,0,0,0|1,0,0]=3 6695 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])Cl)F 7a_100011659368_200025704644 [0,2,0,0,0,0|1,0,0]=3 6696 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])F)F 34a_100000751779_200025704644 [0,2,0,0,0,0|1,0,0]=3 6697 B13R1.3255 CC(=O)c1cc(cc(c1O[13CH3])F)F 7a_100000751779_200025704644 [0,2,0,0,0,0|1,0,0]=3 6698 B13R1.3255 COc1c(cc(cc1C(=O)C)Br)Br 1458a_100000188141_200000210301 [0,2,0,0,0,0|1,0,0]=3 6699 B13R1.3255 COc1c(cc(cc1C(=O)C)Br)Br 7a_100000212130_200000210301 [0,2,0,0,0,0|1,0,0]=3 6700 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Br 7a_100011659362_200000210301 [0,2,0,0,0,0|0,0,0]=2 6701 B13R1.3255 COc1c(cc(cc1C(=O)C)C)C 34a_100000188341_200000210301 [0,2,0,0,0,0|0,0,0]=2 6702 B13R1.3255 COc1c(cc(cc1C(=O)C)C)C 7a_100000188341_200000210301 [0,2,0,0,0,0|0,0,0]=2 6703 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Cl 34a_100010659243_200000210301 [0,2,0,0,0,0|0,0,0]=2 6704 B13R1.3255 COc1c(cc(cc1C(=O)C)C)Cl 7a_100010659243_200000210301 [0,2,0,0,0,0|0,0,0]=2 6705 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Br 7a_100011218835_200000210301 [0,2,0,0,0,0|1,0,0]=3 6706 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Cl 1458a_100000186506_200000210301 [0,2,0,0,0,0|1,0,0]=3 6707 B13R1.3255 COc1c(cc(cc1C(=O)C)Cl)Cl 7a_100000182809_200000210301 [0,2,0,0,0,0|1,0,0]=3 6708 B13R1.3255 COc1c(cc(cc1C(=O)C)F)Cl 34a_100011659368_200000210301 [0,2,0,0,0,0|1,0,0]=3 6709 B13R1.3255 COc1c(cc(cc1C(=O)C)F)Cl 7a_100011659368_200000210301 [0,2,0,0,0,0|1,0,0]=3 6710 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 1458a_100000062013_200000210301 [0,2,0,0,0,0|1,0,0]=3 6711 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 34a_100000751779_200000210301 [0,2,0,0,0,0|1,0,0]=3 6712 B13R1.3255 COc1c(cc(cc1C(=O)C)F)F 7a_100000751779_200000210301 [0,2,0,0,0,0|1,0,0]=3 6713 B13R1.3255 COc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_200000210301 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.3255 COc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_200000210301 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.3255 COc1c(cc(cc1C(=O)N)F)I 34a_200135271384_200000210301 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.3255 COc1c(cc(cc1C(=O)N)F)I 7a_200135271384_200000210301 [0,2,0,0,0,0|2,0,0]=4 6717 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])Br)Br 1458a_100000188141_200025704644 [0,2,0,0,0,0|1,0,0]=3 6718 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])Cl)Cl 1458a_100000186506_200025704644 [0,2,0,0,0,0|1,0,0]=3 6719 B13R1.3255 COc1c(cc(cc1C(=O)[13CH3])F)F 1458a_100000062013_200025704644 [0,2,0,0,0,0|1,0,0]=3 6720 B13R1.3255 COc1c(cc(cc1[N+](=O)[O-])C)C 7a_100000195569_200000210301 [0,2,0,0,0,0|2,0,0]=4 6721 B13R1.3255 Cc1cc(c(c(c1)[N+](=O)[O-])O[13CH3])C 7a_100000195569_200025704644 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)Br)Br 34a_200009812496_200025704644 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)Br)Br 7a_200009812496_200025704644 [0,2,0,0,0,0|2,0,0]=4 6724 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)F)I 34a_200135271384_200025704644 [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.3255 [13CH3]Oc1c(cc(cc1C(=O)N)F)I 7a_200135271384_200025704644 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.98 C=Cc1ccc(c(c1)S(=O)(=O)C)O 271570a_100011290941_200015712519 [0,2,0,0,0,0|1,0,1]=4 6727 B13R1.98 CC(C)(C)c1cc(ccc1O)S[13CH3] 62a_100000704011_200025704644 [0,2,0,0,0,0|1,0,1]=4 6728 B13R1.98 CC(C)(C)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000704011 [0,2,0,0,0,0|1,0,1]=4 6729 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)C)F 34a_100015204152_200000210301 [0,2,0,0,0,0|2,0,0]=4 6730 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)C)F 7a_100015204152_200000210301 [0,2,0,0,0,0|2,0,0]=4 6731 B13R1.98 CS(=O)(=O)c1cc(ccc1Br)S[13CH3] 62a_100011102953_200025704644 [0,2,0,0,0,0|2,0,0]=4 6732 B13R1.98 CS(=O)(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_100011102953 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.98 CS(=O)(=O)c1cc(ccc1F)N[13CH3] 34a_100015204152_200025704644 [0,2,0,0,0,0|2,0,0]=4 6734 B13R1.98 CS(=O)(=O)c1cc(ccc1F)N[13CH3] 7a_100015204152_200025704644 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.98 CS(=O)(=O)c1cc(ccc1F)S[13CH3] 62a_100010195686_200025704644 [0,2,0,0,0,0|2,0,0]=4 6736 B13R1.98 CS(=O)(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010195686 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.98 CS(=O)(=O)c1cc(ccc1N)S[13CH3] 62a_100000692581_200025704644 [0,2,0,0,0,0|2,0,0]=4 6738 B13R1.98 CS(=O)(=O)c1cc(ccc1O)S[13CH3] 62a_200015712519_200025704644 [0,2,0,0,0,0|1,0,0]=3 6739 B13R1.98 CSc1ccc(c(c1)C(C)(C)C)O 62a_100000704011_200000210301 [0,2,0,0,0,0|1,0,1]=4 6740 B13R1.98 CSc1ccc(c(c1)C(C)(C)C)O 62a_200000210301_100000704011 [0,2,0,0,0,0|1,0,1]=4 6741 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)Br 62a_100011102953_200000210301 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)Br 62a_200000210301_100011102953 [0,2,0,0,0,0|2,0,0]=4 6743 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)C 62a_100009814363_200000210301 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)C 62a_200000210301_100009814363 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)F 62a_100010195686_200000210301 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)F 62a_200000210301_100010195686 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)N 62a_100000692581_200000210301 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)O 62a_200015712519_200000210301 [0,2,0,0,0,0|1,0,0]=3 6749 B13R1.98 Cc1ccc(cc1S(=O)(=O)C)S[13CH3] 62a_100009814363_200025704644 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.98 Cc1ccc(cc1S(=O)(=O)C)S[13CH3] 62a_200025704644_100009814363 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)C 270084a_100102657272_100000755929 [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.257 CNS(=O)(=O)c1cc(ccc1Br)C 274078a_100102657272_100000755929 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)C 270084a_100102657272_100000182921 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.257 CNS(=O)(=O)c1cc(ccc1C)C 274078a_100102657272_100000182921 [0,2,0,0,0,0|2,0,0]=4 6755 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)C 270084a_100102657272_100000695277 [0,2,0,0,0,0|2,0,0]=4 6756 B13R1.257 CNS(=O)(=O)c1cc(ccc1Cl)C 274078a_100102657272_100000695277 [0,2,0,0,0,0|2,0,0]=4 6757 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)C 270084a_100102657272_100000739338 [0,2,0,0,0,0|2,0,0]=4 6758 B13R1.257 CNS(=O)(=O)c1cc(ccc1F)C 274078a_100102657272_100000739338 [0,2,0,0,0,0|2,0,0]=4 6759 B13R1.651 C=C(C)c1cc(c(cc1Br)Br)OC 271570a_100000694244_200014006352 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.651 C=C(C)c1cc(c(cc1C)F)OC 271570a_100000694244_100011009880 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.651 C=C(C)c1cc(c(cc1C)N)OC 271570a_100000694244_100010141321 [0,2,0,0,0,0|2,0,0]=4 6762 B13R1.651 C=C(C)c1cc(c(cc1F)Cl)OC 271570a_100000694244_100010739614 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.651 C=C(C)c1cc(c(cc1F)F)CO 271570a_100000694244_100016029355 [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.651 C=C(C)c1cc(c(cc1F)F)OC 271570a_100000694244_200015541288 [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.651 C=C(C)c1cc(c(cc1F)N)NC 271570a_100000694244_100013631271 [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.651 C=C(C)c1cc(c(cc1F)N)OC 271570a_100000694244_100012766639 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.651 C=C(C)c1cc(c(cc1F)O)OC 271570a_100000694244_100010189133 [0,2,0,0,0,0|2,0,0]=4 6768 B13R1.651 C=C(C)c1cc(c(cc1N)C)OC 271570a_100000694244_200010584344 [0,2,0,0,0,0|2,0,0]=4 6769 B13R1.651 C=C(C)c1cc(c(cc1N)F)OC 271570a_100000694244_100010365326 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.651 C=C(C)c1cc(c(cc1O)F)C#N 271570a_100000694244_100011015635 [0,2,0,0,0,0|1,0,1]=4 6771 B13R1.651 C=C(C)c1cc(c(cc1O)O)C=O 271570a_100000694244_200010132312 [0,2,0,0,0,0|1,0,1]=4 6772 B13R1.651 C=Cc1cc(c(cc1C)O)C(=O)C 271570a_100011290941_200010233951 [0,2,0,0,0,0|0,0,1]=3 6773 B13R1.651 C=Cc1cc(c(cc1F)F)C(=O)C 271570a_100011290941_100009817148 [0,2,0,0,0,0|1,0,1]=4 6774 B13R1.651 C=Cc1cc(c(cc1F)O)C(=O)C 271570a_100011290941_100000691652 [0,2,0,0,0,0|0,0,1]=3 6775 B13R1.651 CC(=O)c1cc(c(cc1Cl)Cl)C#N 1458a_200015787993_200000210301 [0,2,0,0,0,0|1,0,1]=4 6776 B13R1.651 CC(=O)c1cc(c(cc1F)F)S[13CH3] 62a_100009817148_200025704644 [0,2,0,0,0,0|1,0,0]=3 6777 B13R1.651 CC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_200010233951_200025704644 [0,2,0,0,0,0|0,0,0]=2 6778 B13R1.651 CC(=O)c1cc(c(cc1O)F)S[13CH3] 62a_100000691652_200025704644 [0,2,0,0,0,0|0,0,0]=2 6779 B13R1.651 CNc1cc(c(cc1C)O)C(C)C 34a_100000686282_200000210301 [0,2,0,0,0,0|1,0,1]=4 6780 B13R1.651 CNc1cc(c(cc1C)O)C(C)C 7a_100000686282_200000210301 [0,2,0,0,0,0|1,0,1]=4 6781 B13R1.651 CNc1cc(c(cc1F)F)C(=O)N 27a_100102657272_100015235948 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.651 COc1cc(c(cc1C)Br)C(=O)C 1458a_100010289115_200000210301 [0,2,0,0,0,0|1,0,0]=3 6783 B13R1.651 COc1cc(c(cc1C)Br)C(=O)[13CH3] 1458a_100010289115_200025704644 [0,2,0,0,0,0|1,0,0]=3 6784 B13R1.651 COc1cc(c(cc1F)Br)C(=O)C 1458a_100010174800_200000210301 [0,2,0,0,0,0|1,0,0]=3 6785 B13R1.651 COc1cc(c(cc1F)Br)C(=O)[13CH3] 1458a_100010174800_200025704644 [0,2,0,0,0,0|1,0,0]=3 6786 B13R1.651 CSc1cc(c(cc1C)O)C(=O)C 62a_200010233951_200000210301 [0,2,0,0,0,0|0,0,0]=2 6787 B13R1.651 CSc1cc(c(cc1F)F)C(=O)C 62a_100009817148_200000210301 [0,2,0,0,0,0|1,0,0]=3 6788 B13R1.651 CSc1cc(c(cc1F)F)C(=O)N 62a_100015235948_200000210301 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.651 CSc1cc(c(cc1F)F)C(=O)N 62a_200000210301_100015235948 [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.651 CSc1cc(c(cc1F)N)C(=O)N 62a_100015444839_200000210301 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.651 CSc1cc(c(cc1F)O)C(=O)C 62a_100000691652_200000210301 [0,2,0,0,0,0|0,0,0]=2 6792 B13R1.651 Cc1cc(c(cc1N[13CH3])C(C)C)O 34a_100000686282_200025704644 [0,2,0,0,0,0|1,0,1]=4 6793 B13R1.651 Cc1cc(c(cc1N[13CH3])C(C)C)O 7a_100000686282_200025704644 [0,2,0,0,0,0|1,0,1]=4 6794 B13R1.651 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)C#N 1458a_200015787993_200025704644 [0,2,0,0,0,0|1,0,1]=4 6795 B13R1.651 [13CH3]Sc1cc(c(cc1F)F)C(=O)N 62a_100015235948_200025704644 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.651 [13CH3]Sc1cc(c(cc1F)F)C(=O)N 62a_200025704644_100015235948 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.651 [13CH3]Sc1cc(c(cc1F)N)C(=O)N 62a_100015444839_200025704644 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.652 C=C(C)c1cc(c(cc1C)C=O)C 271570a_100000694244_100012024176 [0,2,0,0,0,0|2,0,0]=4 6799 B13R1.652 C=C(C)c1cc(c(cc1C)OC)C 271570a_100000694244_100000698960 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.652 C=C(C)c1cc(c(cc1F)C#N)C 271570a_100000694244_100012353738 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.652 C=C(C)c1cc(c(cc1F)C=O)C 271570a_100000694244_100010186292 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.652 C=C(C)c1cc(c(cc1N)OC)C 271570a_100000694244_100010244135 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.652 C=C(C)c1cc(c(cc1O)C=O)O 271570a_100000694244_100010888506 [0,2,0,0,0,0|2,0,0]=4 6804 B13R1.652 C=Cc1cc(c(cc1C)C(=O)C)O 271570a_100011290941_100009816031 [0,2,0,0,0,0|0,0,0]=2 6805 B13R1.652 C=Cc1cc(c(cc1F)C(=O)C)F 271570a_100011290941_100012024335 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.652 C=Cc1cc(c(cc1F)C(=O)C)O 271570a_100011290941_200010245088 [0,2,0,0,0,0|1,0,0]=3 6807 B13R1.652 CC(=O)c1cc(c(cc1F)S[13CH3])F 62a_100012024335_200025704644 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.652 CC(=O)c1cc(c(cc1O)S[13CH3])C 62a_100009816031_200025704644 [0,2,0,0,0,0|0,0,0]=2 6809 B13R1.652 CC(=O)c1cc(c(cc1O)S[13CH3])F 62a_200010245088_200025704644 [0,2,0,0,0,0|1,0,0]=3 6810 B13R1.652 COc1cc(c(cc1Br)C(=O)C)C 1458a_100010233827_200000210301 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.652 COc1cc(c(cc1Br)C(=O)C)F 1458a_100010270082_200000210301 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.652 COc1cc(c(cc1Br)C(=O)C)O 1458a_100009816734_200000210301 [0,2,0,0,0,0|1,0,0]=3 6813 B13R1.652 COc1cc(c(cc1Br)C(=O)[13CH3])C 1458a_100010233827_200025704644 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.652 COc1cc(c(cc1Br)C(=O)[13CH3])F 1458a_100010270082_200025704644 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.652 COc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100009816734_200025704644 [0,2,0,0,0,0|1,0,0]=3 6816 B13R1.652 COc1cc(c(cc1C)C(=O)C)C 1458a_100011996352_200000210301 [0,2,0,0,0,0|1,0,0]=3 6817 B13R1.652 COc1cc(c(cc1C)C(=O)[13CH3])C 1458a_100011996352_200025704644 [0,2,0,0,0,0|1,0,0]=3 6818 B13R1.652 COc1cc(c(cc1F)C(=O)C)F 1458a_100009861218_200000210301 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.652 COc1cc(c(cc1F)C(=O)[13CH3])F 1458a_100009861218_200025704644 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.652 COc1cc(c(cc1O)C(=O)C)Br 1458a_100010074811_200000210301 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.652 COc1cc(c(cc1O)C(=O)C)O 271570a_203496583355_100009813116 [0,2,0,0,0,0|1,0,0]=3 6822 B13R1.652 COc1cc(c(cc1O)C(=O)[13CH3])Br 1458a_100010074811_200025704644 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.652 CSc1cc(c(cc1C)C(=O)C)O 62a_100009816031_200000210301 [0,2,0,0,0,0|0,0,0]=2 6824 B13R1.652 CSc1cc(c(cc1F)C(=O)C)F 62a_100012024335_200000210301 [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.652 CSc1cc(c(cc1F)C(=O)C)O 62a_200010245088_200000210301 [0,2,0,0,0,0|1,0,0]=3 6826 B13R1.1807 CCC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_100000210202 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_100000210202 [0,2,0,0,0,0|1,0,0]=3 6828 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100000210202 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.1807 CCC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_100000210202 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_100000210202 [0,2,0,0,0,0|1,0,0]=3 6831 B13R1.1807 CCC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_100000210202 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_100000210202 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210202 [0,2,0,0,0,0|1,0,0]=3 6834 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_100000210202 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_100000210202 [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.1807 CCC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_100000210202 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_100000210202 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_100000210202 [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.1807 CCC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_100000210202 [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100000210202 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100000210202 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_100000210202 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_100000210202 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100000210202 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100000210202 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_100000210202 [0,2,0,0,0,0|1,0,0]=3 6847 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_100000210202 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.1807 CCC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_100000210202 [0,2,0,0,0,0|2,0,0]=4 6849 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_100000210202 [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_100000210202 [0,2,0,0,0,0|1,0,0]=3 6851 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100000210202 [0,2,0,0,0,0|2,0,0]=4 6852 B13R1.1807 CCC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_100000210202 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_100000210202 [0,2,0,0,0,0|2,0,0]=4 6854 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_100000210202 [0,2,0,0,0,0|2,0,0]=4 6855 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_100000210202 [0,2,0,0,0,0|2,0,0]=4 6856 B13R1.1807 CCC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_100000210202 [0,2,0,0,0,0|2,0,0]=4 6857 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100000210202 [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100000210202 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_100000210202 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.1807 CCC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_100000210202 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_100000210202 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_100000210202 [0,2,0,0,0,0|1,0,0]=3 6863 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_100000210202 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_100000210202 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.1807 CCC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_100000210202 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.1807 CCC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_100000210202 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.1807 CCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210202 [0,2,0,0,0,0|1,0,0]=3 6868 B13R1.1807 CCC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_100000210202 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.1807 CCC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_100000210202 [0,2,0,0,0,0|1,0,0]=3 6870 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_100000210202 [0,2,0,0,0,0|1,0,0]=3 6871 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210202 [0,2,0,0,0,0|0,0,0]=2 6872 B13R1.1807 CCC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100000210202 [0,2,0,0,0,0|1,0,0]=3 6873 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_100000210202 [0,2,0,0,0,0|1,0,0]=3 6874 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_100000210202 [0,2,0,0,0,0|1,0,0]=3 6875 B13R1.1807 CCC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_100000210202 [0,2,0,0,0,0|1,0,0]=3 6876 B13R1.1807 CCC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_100000210202 [0,2,0,0,0,0|1,0,0]=3 6877 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 11a_106832991635_200012355688 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 1626a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 240690a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.1807 CNC(=O)c1cc(c(cc1Br)C)F 527a_100102657272_200012355688 [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 11a_106832991635_100010204433 [0,2,0,0,0,0|1,0,0]=3 6882 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 1626a_100102657272_100010204433 [0,2,0,0,0,0|1,0,0]=3 6883 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 240690a_100102657272_100010204433 [0,2,0,0,0,0|1,0,0]=3 6884 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)C 527a_100102657272_100010204433 [0,2,0,0,0,0|1,0,0]=3 6885 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 11a_106832991635_100012921620 [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 1626a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 240690a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)Cl 527a_100102657272_100012921620 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 11a_106832991635_100000685074 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 1626a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 240690a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6892 B13R1.1807 CNC(=O)c1cc(c(cc1Br)F)F 527a_100102657272_100000685074 [0,2,0,0,0,0|2,0,0]=4 6893 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 11a_106832991635_100000695896 [0,2,0,0,0,0|1,0,0]=3 6894 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 1626a_100102657272_100000695896 [0,2,0,0,0,0|1,0,0]=3 6895 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 240690a_100102657272_100000695896 [0,2,0,0,0,0|1,0,0]=3 6896 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)C 527a_100102657272_100000695896 [0,2,0,0,0,0|1,0,0]=3 6897 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 11a_106832991635_100012344525 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 1626a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 240690a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.1807 CNC(=O)c1cc(c(cc1C)Br)F 527a_100102657272_100012344525 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 11a_106832991635_100012920494 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 1626a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 240690a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)Br 527a_100102657272_100012920494 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 11a_106832991635_100011216168 [0,2,0,0,0,0|1,0,0]=3 6906 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 1626a_100102657272_100011216168 [0,2,0,0,0,0|1,0,0]=3 6907 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 240690a_100102657272_100011216168 [0,2,0,0,0,0|1,0,0]=3 6908 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 527a_100102657272_100011216168 [0,2,0,0,0,0|1,0,0]=3 6909 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 11a_106832991635_100000723791 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 1626a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 240690a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)I 527a_100102657272_100000723791 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 11a_106832991635_100010439669 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 1626a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 240690a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)Cl 527a_100102657272_100010439669 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 11a_106832991635_200010768543 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 1626a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 240690a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.1807 CNC(=O)c1cc(c(cc1C)Cl)F 527a_100102657272_200010768543 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 11a_106832991635_100000724332 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 1626a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 240690a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6924 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)Br 527a_100102657272_100000724332 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 11a_106832991635_100000062099 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 1626a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 240690a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)F 527a_100102657272_100000062099 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 11a_106832991635_100013328184 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 1626a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 240690a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.1807 CNC(=O)c1cc(c(cc1C)F)I 527a_100102657272_100013328184 [0,2,0,0,0,0|2,0,0]=4 6933 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 11a_106832991635_100000246132 [0,2,0,0,0,0|2,0,0]=4 6934 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 1626a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 240690a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6936 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)Cl 527a_100102657272_100000246132 [0,2,0,0,0,0|2,0,0]=4 6937 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 11a_106832991635_100000724438 [0,2,0,0,0,0|2,0,0]=4 6938 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 1626a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 240690a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Br)F 527a_100102657272_100000724438 [0,2,0,0,0,0|2,0,0]=4 6941 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 11a_106832991635_100013033594 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 1626a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6943 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 240690a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)Cl 527a_100102657272_100013033594 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 11a_106832991635_100009857485 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 1626a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 240690a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)C)F 527a_100102657272_100009857485 [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 11a_106832991635_100011934218 [0,2,0,0,0,0|2,0,0]=4 6950 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 1626a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6951 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 240690a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6952 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)Cl 527a_100102657272_100011934218 [0,2,0,0,0,0|2,0,0]=4 6953 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 11a_106832991635_100000212284 [0,2,0,0,0,0|2,0,0]=4 6954 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 1626a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6955 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 240690a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)Cl)F 527a_100102657272_100000212284 [0,2,0,0,0,0|2,0,0]=4 6957 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 11a_106832991635_100000687843 [0,2,0,0,0,0|1,0,0]=3 6958 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 1626a_100102657272_100000687843 [0,2,0,0,0,0|1,0,0]=3 6959 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 240690a_100102657272_100000687843 [0,2,0,0,0,0|1,0,0]=3 6960 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)C 527a_100102657272_100000687843 [0,2,0,0,0,0|1,0,0]=3 6961 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 11a_106832991635_100025704182 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 1626a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 240690a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)F 527a_100102657272_100025704182 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 11a_106832991635_100012920486 [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 1626a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 240690a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.1807 CNC(=O)c1cc(c(cc1Cl)F)I 527a_100102657272_100012920486 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 11a_106832991635_200011217225 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 1626a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6971 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 240690a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Br 527a_100102657272_200011217225 [0,2,0,0,0,0|2,0,0]=4 6973 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 11a_106832991635_100012354683 [0,2,0,0,0,0|1,0,0]=3 6974 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 1626a_100102657272_100012354683 [0,2,0,0,0,0|1,0,0]=3 6975 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 240690a_100102657272_100012354683 [0,2,0,0,0,0|1,0,0]=3 6976 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)C 527a_100102657272_100012354683 [0,2,0,0,0,0|1,0,0]=3 6977 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 11a_106832991635_100012347732 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 1626a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 240690a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)Cl 527a_100102657272_100012347732 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 11a_106832991635_100012024349 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 1626a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 240690a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.1807 CNC(=O)c1cc(c(cc1F)Br)F 527a_100102657272_100012024349 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 11a_106832991635_100012920545 [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 1626a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 240690a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Br 527a_100102657272_100012920545 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 11a_106832991635_100012180961 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 1626a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 240690a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)Cl 527a_100102657272_100012180961 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 11a_106832991635_100000686409 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 1626a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 240690a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)F 527a_100102657272_100000686409 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.1807 CNC(=O)c1cc(c(cc1F)C)O 240690a_100102657272_100009839767 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 11a_106832991635_100011217226 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 1626a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 240690a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Br 527a_100102657272_100011217226 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 11a_106832991635_100011217469 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 1626a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 240690a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)Cl 527a_100102657272_100011217469 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 11a_106832991635_100000690020 [0,2,0,0,0,0|2,0,0]=4 7007 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 1626a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 240690a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)F 527a_100102657272_100000690020 [0,2,0,0,0,0|2,0,0]=4 7010 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 11a_106832991635_100012920488 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 1626a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7012 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 240690a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.1807 CNC(=O)c1cc(c(cc1F)Cl)I 527a_100102657272_100012920488 [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 11a_106832991635_100000718434 [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 1626a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 240690a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Br 527a_100102657272_100000718434 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 11a_106832991635_100000767126 [0,2,0,0,0,0|1,0,0]=3 7019 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 1626a_100102657272_100000767126 [0,2,0,0,0,0|1,0,0]=3 7020 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 240690a_100102657272_100000767126 [0,2,0,0,0,0|1,0,0]=3 7021 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)C 527a_100102657272_100000767126 [0,2,0,0,0,0|1,0,0]=3 7022 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 11a_106832991635_100011997751 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 1626a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 240690a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)Cl 527a_100102657272_100011997751 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 11a_106832991635_100000687535 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 1626a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 240690a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)F 527a_100102657272_100000687535 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 11a_106832991635_100000691139 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 1626a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 240690a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.1807 CNC(=O)c1cc(c(cc1F)F)I 527a_100102657272_100000691139 [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 240690a_100102657272_200009924051 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)Cl 527a_100102657272_200009924051 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.1807 CNC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_200107972064 [0,2,0,0,0,0|2,0,0]=4 7037 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 11a_106832991635_100010184404 [0,2,0,0,0,0|1,0,0]=3 7038 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 1626a_100102657272_100010184404 [0,2,0,0,0,0|1,0,0]=3 7039 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 240690a_100102657272_100010184404 [0,2,0,0,0,0|1,0,0]=3 7040 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 527a_100102657272_100010184404 [0,2,0,0,0,0|1,0,0]=3 7041 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 11a_106832991635_100000688017 [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 1626a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7043 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 240690a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7044 B13R1.1807 CNC(=O)c1cc(c(cc1I)F)F 527a_100102657272_100000688017 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 240690a_100102657272_100010827371 [0,2,0,0,0,0|1,0,0]=3 7046 B13R1.1807 CNC(=O)c1cc(c(cc1O)Br)F 527a_100102657272_100010827371 [0,2,0,0,0,0|1,0,0]=3 7047 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 240690a_100102657272_100010233826 [0,2,0,0,0,0|1,0,0]=3 7048 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)Br 527a_100102657272_100010233826 [0,2,0,0,0,0|1,0,0]=3 7049 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 240690a_100102657272_100009831561 [0,2,0,0,0,0|0,0,0]=2 7050 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 527a_100102657272_100009831561 [0,2,0,0,0,0|0,0,0]=2 7051 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 240690a_100102657272_200009814723 [0,2,0,0,0,0|1,0,0]=3 7052 B13R1.1807 CNC(=O)c1cc(c(cc1O)Cl)Br 527a_100102657272_200009814723 [0,2,0,0,0,0|1,0,0]=3 7053 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 240690a_100102657272_100010188153 [0,2,0,0,0,0|1,0,0]=3 7054 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Br 527a_100102657272_100010188153 [0,2,0,0,0,0|1,0,0]=3 7055 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 240690a_100102657272_100009910333 [0,2,0,0,0,0|1,0,0]=3 7056 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)Cl 527a_100102657272_100009910333 [0,2,0,0,0,0|1,0,0]=3 7057 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 240690a_100102657272_100012182723 [0,2,0,0,0,0|1,0,0]=3 7058 B13R1.1807 CNC(=O)c1cc(c(cc1O)F)F 527a_100102657272_100012182723 [0,2,0,0,0,0|1,0,0]=3 7059 B13R1.1807 CNC(=O)c1cc(c(cc1O)O)Br 527a_100102657272_100009813906 [0,2,0,0,0,0|1,0,0]=3 7060 B13R1.1807 CNC(C)c1cc(c(cc1O)C)C 269862a_106832991636_100000014572 [0,2,0,0,0,0|1,0,1]=4 7061 B13R1.1807 COC(=O)c1cc(c(cc1C)C)O 271570a_203496583355_200012360129 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.1807 COC(=O)c1cc(c(cc1C)F)O 271570a_203496583355_100013328185 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.1807 COC(=O)c1cc(c(cc1C)N)O 271570a_203496583355_100010236254 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.1807 COC(=O)c1cc(c(cc1C)O)F 271570a_203496583355_100010291504 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.1807 COC(=O)c1cc(c(cc1Cl)C)O 271570a_203496583355_100014124666 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.1807 COC(=O)c1cc(c(cc1Cl)N)O 271570a_203496583355_100010204190 [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.1807 COC(=O)c1cc(c(cc1F)C)O 271570a_203496583355_100012920548 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.1807 COC(=O)c1cc(c(cc1F)Cl)O 271570a_203496583355_100012920370 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.1807 COC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100000718433 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.1807 COC(=O)c1cc(c(cc1F)N)O 271570a_203496583355_100010764354 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.1807 COC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010769226 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.1807 COC(=O)c1cc(c(cc1F)O)N 271570a_203496583355_100000760059 [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.1807 COC(=O)c1cc(c(cc1N)C)O 271570a_203496583355_100010892302 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.1807 COC(=O)c1cc(c(cc1N)Cl)O 271570a_203496583355_100010253894 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.1807 COC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100000699149 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.1807 COC(=O)c1cc(c(cc1N)O)F 271570a_203496583355_100000724440 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.1807 COC(=O)c1cc(c(cc1O)Br)F 271570a_203496583355_100014686389 [0,2,0,0,0,0|1,0,0]=3 7078 B13R1.1807 COC(=O)c1cc(c(cc1O)C)F 271570a_203496583355_100015763395 [0,2,0,0,0,0|1,0,0]=3 7079 B13R1.1807 COC(=O)c1cc(c(cc1O)C)N 271570a_203496583355_100000730709 [0,2,0,0,0,0|1,0,0]=3 7080 B13R1.1807 COC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_100010233952 [0,2,0,0,0,0|1,0,0]=3 7081 B13R1.1807 COC(=O)c1cc(c(cc1O)Cl)Br 271570a_203496583355_200012920379 [0,2,0,0,0,0|1,0,0]=3 7082 B13R1.1807 COC(=O)c1cc(c(cc1O)F)C 271570a_203496583355_100015451887 [0,2,0,0,0,0|0,0,0]=2 7083 B13R1.1807 COC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100010195689 [0,2,0,0,0,0|1,0,0]=3 7084 B13R1.1807 COC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100010371811 [0,2,0,0,0,0|1,0,0]=3 7085 B13R1.1807 COC(=O)c1cc(c(cc1O)N)F 271570a_203496583355_100010764352 [0,2,0,0,0,0|1,0,0]=3 7086 B13R1.1807 COC(=O)c1cc(c(cc1O)N)O 271570a_203496583355_100010075205 [0,2,0,0,0,0|1,0,0]=3 7087 B13R1.1807 COC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_100010760826 [0,2,0,0,0,0|1,0,0]=3 7088 B13R1.1807 COC(=O)c1cc(c(nc1O)C)F 271570a_203496583355_100011155941 [0,2,0,0,0,0|2,0,0]=4 7089 B13R1.1807 Cc1cc(c(cc1Br)C(=O)CF)C 1458a_100012920494_100015361967 [0,2,0,0,0,0|2,0,0]=4 7090 B13R1.1807 Cc1cc(c(cc1Br)C(=O)CF)F 1458a_100012920545_100015361967 [0,2,0,0,0,0|2,0,0]=4 7091 B13R1.1807 Cc1cc(c(cc1Br)C(=O)CF)O 1458a_100010233826_100015361967 [0,2,0,0,0,0|1,0,0]=3 7092 B13R1.1807 Cc1cc(c(cc1Br)C)C(=O)CF 1458a_100000695896_100015361967 [0,2,0,0,0,0|1,0,0]=3 7093 B13R1.1807 Cc1cc(c(cc1Br)F)C(=O)CF 1458a_100012354683_100015361967 [0,2,0,0,0,0|1,0,0]=3 7094 B13R1.1807 Cc1cc(c(cc1C(=O)CF)Br)F 1458a_100000724332_100015361967 [0,2,0,0,0,0|2,0,0]=4 7095 B13R1.1807 Cc1cc(c(cc1C(=O)CF)Cl)Cl 1458a_100010439669_100015361967 [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.1807 Cc1cc(c(cc1C(=O)CF)F)Br 1458a_100012344525_100015361967 [0,2,0,0,0,0|2,0,0]=4 7097 B13R1.1807 Cc1cc(c(cc1C(=O)CF)F)Cl 1458a_200010768543_100015361967 [0,2,0,0,0,0|2,0,0]=4 7098 B13R1.1807 Cc1cc(c(cc1C(=O)CF)F)F 1458a_100000062099_100015361967 [0,2,0,0,0,0|2,0,0]=4 7099 B13R1.1807 Cc1cc(c(cc1C(=O)CF)I)F 1458a_100013328184_100015361967 [0,2,0,0,0,0|2,0,0]=4 7100 B13R1.1807 Cc1cc(c(cc1C)C(=O)CF)C 1458a_100011216168_100015361967 [0,2,0,0,0,0|1,0,0]=3 7101 B13R1.1807 Cc1cc(c(cc1C)C(=O)CF)I 1458a_100010184404_100015361967 [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.1807 Cc1cc(c(cc1C)C(=O)CF)O 1458a_100009831561_100015361967 [0,2,0,0,0,0|0,0,0]=2 7103 B13R1.1807 Cc1cc(c(cc1Cl)C(=O)CF)Cl 1458a_100013033594_100015361967 [0,2,0,0,0,0|2,0,0]=4 7104 B13R1.1807 Cc1cc(c(cc1Cl)C(=O)CF)F 1458a_100012180961_100015361967 [0,2,0,0,0,0|2,0,0]=4 7105 B13R1.1807 Cc1cc(c(cc1F)Br)C(=O)CF 1458a_100010204433_100015361967 [0,2,0,0,0,0|1,0,0]=3 7106 B13R1.1807 Cc1cc(c(cc1F)C(=O)CF)Br 1458a_200012355688_100015361967 [0,2,0,0,0,0|2,0,0]=4 7107 B13R1.1807 Cc1cc(c(cc1F)C(=O)CF)Cl 1458a_100009857485_100015361967 [0,2,0,0,0,0|2,0,0]=4 7108 B13R1.1807 Cc1cc(c(cc1F)C(=O)CF)F 1458a_100000686409_100015361967 [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.1807 Cc1cc(c(cc1F)Cl)C(=O)CF 1458a_100000687843_100015361967 [0,2,0,0,0,0|1,0,0]=3 7110 B13R1.1807 Cc1cc(c(cc1F)F)C(=O)CF 1458a_100000767126_100015361967 [0,2,0,0,0,0|1,0,0]=3 7111 B13R1.1807 Cc1cc(c(cc1I)C(=O)CF)C 1458a_100000723791_100015361967 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.1807 Cc1cc(c(cc1O)C(=O)CF)F 1458a_100009839767_100015361967 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.1807 O=C(CF)c1cc(c(cc1Br)F)Cl 1458a_100012921620_100015361967 [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.1807 O=C(CF)c1cc(c(cc1Br)F)F 1458a_100000685074_100015361967 [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_100015361967 [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)Br)F 1458a_100000724438_100015361967 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_100015361967 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_100015361967 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)F)F 1458a_100025704182_100015361967 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.1807 O=C(CF)c1cc(c(cc1Cl)F)I 1458a_100012920486_100015361967 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.1807 O=C(CF)c1cc(c(cc1F)Br)Br 1458a_200011217225_100015361967 [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.1807 O=C(CF)c1cc(c(cc1F)Br)Cl 1458a_100012347732_100015361967 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.1807 O=C(CF)c1cc(c(cc1F)Br)F 1458a_100012024349_100015361967 [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.1807 O=C(CF)c1cc(c(cc1F)Cl)Br 1458a_100011217226_100015361967 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.1807 O=C(CF)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_100015361967 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.1807 O=C(CF)c1cc(c(cc1F)Cl)F 1458a_100000690020_100015361967 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.1807 O=C(CF)c1cc(c(cc1F)Cl)I 1458a_100012920488_100015361967 [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.1807 O=C(CF)c1cc(c(cc1F)F)Br 1458a_100000718434_100015361967 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.1807 O=C(CF)c1cc(c(cc1F)F)Cl 1458a_100011997751_100015361967 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.1807 O=C(CF)c1cc(c(cc1F)F)F 1458a_100000687535_100015361967 [0,2,0,0,0,0|2,0,0]=4 7131 B13R1.1807 O=C(CF)c1cc(c(cc1F)F)I 1458a_100000691139_100015361967 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.1807 O=C(CF)c1cc(c(cc1F)O)Cl 1458a_200009924051_100015361967 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.1807 O=C(CF)c1cc(c(cc1I)F)F 1458a_100000688017_100015361967 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.1807 O=C(CF)c1cc(c(cc1O)Br)F 1458a_100010827371_100015361967 [0,2,0,0,0,0|1,0,0]=3 7135 B13R1.1807 O=C(CF)c1cc(c(cc1O)Cl)Br 1458a_200009814723_100015361967 [0,2,0,0,0,0|1,0,0]=3 7136 B13R1.1807 O=C(CF)c1cc(c(cc1O)F)Br 1458a_100010188153_100015361967 [0,2,0,0,0,0|1,0,0]=3 7137 B13R1.1807 O=C(CF)c1cc(c(cc1O)F)Cl 1458a_100009910333_100015361967 [0,2,0,0,0,0|1,0,0]=3 7138 B13R1.1807 O=C(CF)c1cc(c(cc1O)F)F 1458a_100012182723_100015361967 [0,2,0,0,0,0|1,0,0]=3 7139 B13R1.1807 O=C(CF)c1cc(c(cc1O)O)Br 1458a_100009813906_100015361967 [0,2,0,0,0,0|1,0,0]=3 7140 B13R1.2811 C=C(C)c1cc(c(c(c1C)C)O)C 271570a_100000694244_200012339818 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.2811 CC(=O)c1cc(c(c(c1Cl)Cl)Cl)Cl 1458a_100009827746_200000210301 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.2811 CC(=O)c1cc(c(c(c1F)Br)F)F 1458a_100009814451_200000210301 [0,2,0,0,0,0|2,0,0]=4 7143 B13R1.2811 CC(=O)c1cc(c(c(c1F)C)F)Br 1458a_202127377203_200000210301 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.2811 CC(=O)c1cc(c(c(c1F)C)F)F 1458a_200000081832_200000210301 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.2811 CC(=O)c1cc(c(c(c1F)Cl)F)F 1458a_100000037259_200000210301 [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.2811 CC(=O)c1cc(c(c(c1F)F)C)F 1458a_100009859303_200000210301 [0,2,0,0,0,0|2,0,0]=4 7147 B13R1.2811 CC(=O)c1cc(c(c(c1F)F)F)Br 1458a_100010161349_200000210301 [0,2,0,0,0,0|2,0,0]=4 7148 B13R1.2811 CC(=O)c1cc(c(c(c1F)F)F)F 1458a_100000183550_200000210301 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.2811 CC(=O)c1cc(c(c(c1F)F)O)F 1458a_100000088966_200000210301 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.2811 CC(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200000210301 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.2811 Cc1c(c(cc(c1F)C(=O)[13CH3])Br)F 1458a_202127377203_200025704644 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.2811 Cc1c(c(cc(c1F)C(=O)[13CH3])F)F 1458a_200000081832_200025704644 [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.2811 Cc1c(cc(c(c1F)F)C(=O)[13CH3])F 1458a_100009859303_200025704644 [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1Cl)Cl)Cl)Cl 1458a_100009827746_200025704644 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)Br)F)F 1458a_100009814451_200025704644 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)Cl)F)F 1458a_100000037259_200025704644 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)F)F)Br 1458a_100010161349_200025704644 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)F)F)F 1458a_100000183550_200025704644 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)F)O)F 1458a_100000088966_200025704644 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.2811 [13CH3]C(=O)c1cc(c(c(c1F)O)F)F 1458a_100000737090_200025704644 [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.2812 C=C(C)c1c(cc(c(c1C)C)O)C 271570a_100000694244_100000730119 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200000210301 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.2812 CC(=O)c1c(cc(c(c1Br)O)C)C 1458a_200009992459_200000210301 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.2812 CC(=O)c1c(cc(c(c1F)C)F)Br 1458a_200052017392_200000210301 [0,2,0,0,0,0|1,0,0]=3 7165 B13R1.2812 CC(=O)c1c(cc(c(c1F)Cl)F)Br 1458a_100010244573_200000210301 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.2812 CC(=O)c1c(cc(c(c1F)F)Br)F 1458a_100010164222_200000210301 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.2812 CC(=O)c1c(cc(c(c1F)F)F)Br 1458a_100010215015_200000210301 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.2812 CC(=O)c1c(cc(c(c1F)F)F)F 1458a_100000037219_200000210301 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.2812 CC(=O)c1c(cc(c(c1I)I)I)I 1458a_100102586059_200000210301 [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.2812 CC(=O)c1c(cc(c(c1I)O)I)I 1458a_200000042944_200000210301 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.2812 Cc1c(cc(c(c1F)C(=O)[13CH3])Br)F 1458a_200052017392_200025704644 [0,2,0,0,0,0|1,0,0]=3 7172 B13R1.2812 Cc1cc(c(c(c1O)Br)C(=O)[13CH3])C 1458a_200009992459_200025704644 [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1Br)O)Br)Br 1458a_100009813419_200025704644 [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1F)Cl)F)Br 1458a_100010244573_200025704644 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1F)F)Br)F 1458a_100010164222_200025704644 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1F)F)F)Br 1458a_100010215015_200025704644 [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1F)F)F)F 1458a_100000037219_200025704644 [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1I)I)I)I 1458a_100102586059_200025704644 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.2812 [13CH3]C(=O)c1c(cc(c(c1I)O)I)I 1458a_200000042944_200025704644 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.446 C#CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000184674 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.446 C#CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000184674 [0,2,0,0,0,0|1,0,0]=3 7182 B13R1.446 C#CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000184674 [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.446 C#CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000184674 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.446 C#CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000184674 [0,2,0,0,0,0|2,0,0]=4 7185 B13R1.446 C#CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000184674 [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.446 C#CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000184674 [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.446 C#CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000184674 [0,2,0,0,0,0|1,0,0]=3 7188 B13R1.446 C#CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000184674 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.446 C#CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000184674 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.446 C#CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000184674 [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.446 C#CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000184674 [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000184674 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000184674 [0,2,0,0,0,0|1,0,0]=3 7194 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000184674 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000184674 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000184674 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.446 C#CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000184674 [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.446 C#CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000184674 [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.446 C#CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000184674 [0,2,0,0,0,0|1,0,0]=3 7200 B13R1.446 C#CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000184674 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.446 C#CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000184674 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.446 C#CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000184674 [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.446 C#CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000184674 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.446 C#CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000184674 [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.446 C#CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000184674 [0,2,0,0,0,0|1,0,0]=3 7206 B13R1.446 C#CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000184674 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.446 C#CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000184674 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.446 C#CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000184674 [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.446 C#CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000184674 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.446 C#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000184674 [0,2,0,0,0,0|1,0,0]=3 7211 B13R1.446 C#CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000184674 [0,2,0,0,0,0|0,0,0]=2 7212 B13R1.446 C#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000184674 [0,2,0,0,0,0|1,0,0]=3 7213 B13R1.446 C#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000184674 [0,2,0,0,0,0|1,0,0]=3 7214 B13R1.446 C#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000184674 [0,2,0,0,0,0|1,0,0]=3 7215 B13R1.446 C#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000184674 [0,2,0,0,0,0|1,0,0]=3 7216 B13R1.446 C=CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210623 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.446 C=CCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210623 [0,2,0,0,0,0|1,0,0]=3 7218 B13R1.446 C=CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210623 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.446 C=CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210623 [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.446 C=CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210623 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.446 C=CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210623 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.446 C=CCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210623 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.446 C=CCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210623 [0,2,0,0,0,0|1,0,0]=3 7224 B13R1.446 C=CCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210623 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.446 C=CCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210623 [0,2,0,0,0,0|2,0,0]=4 7226 B13R1.446 C=CCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210623 [0,2,0,0,0,0|2,0,0]=4 7227 B13R1.446 C=CCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210623 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210623 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210623 [0,2,0,0,0,0|1,0,0]=3 7230 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210623 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210623 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210623 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.446 C=CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210623 [0,2,0,0,0,0|2,0,0]=4 7234 B13R1.446 C=CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210623 [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.446 C=CCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210623 [0,2,0,0,0,0|1,0,0]=3 7236 B13R1.446 C=CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210623 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.446 C=CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210623 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.446 C=CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210623 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.446 C=CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210623 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.446 C=CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210623 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.446 C=CCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210623 [0,2,0,0,0,0|1,0,0]=3 7242 B13R1.446 C=CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210623 [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.446 C=CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210623 [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.446 C=CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210623 [0,2,0,0,0,0|2,0,0]=4 7245 B13R1.446 C=CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210623 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.446 C=CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210623 [0,2,0,0,0,0|1,0,0]=3 7247 B13R1.446 C=CCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210623 [0,2,0,0,0,0|0,0,0]=2 7248 B13R1.446 C=CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210623 [0,2,0,0,0,0|1,0,0]=3 7249 B13R1.446 C=CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210623 [0,2,0,0,0,0|1,0,0]=3 7250 B13R1.446 C=CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210623 [0,2,0,0,0,0|1,0,0]=3 7251 B13R1.446 C=CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210623 [0,2,0,0,0,0|1,0,0]=3 7252 B13R1.446 CCCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210303 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.446 CCCC(=O)c1cc(ccc1Br)C 1458a_100000689033_100000210303 [0,2,0,0,0,0|1,0,0]=3 7254 B13R1.446 CCCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210303 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.446 CCCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210303 [0,2,0,0,0,0|2,0,0]=4 7256 B13R1.446 CCCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210303 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.446 CCCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210303 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.446 CCCC(=O)c1cc(ccc1C)Br 1458a_100000759961_100000210303 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.446 CCCC(=O)c1cc(ccc1C)C 1458a_100000195421_100000210303 [0,2,0,0,0,0|1,0,0]=3 7260 B13R1.446 CCCC(=O)c1cc(ccc1C)Cl 1458a_100000692595_100000210303 [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.446 CCCC(=O)c1cc(ccc1C)F 1458a_100000240043_100000210303 [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.446 CCCC(=O)c1cc(ccc1C)I 1458a_100000688012_100000210303 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.446 CCCC(=O)c1cc(ccc1C)O 1458a_100000687834_100000210303 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210303 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.446 CCCC(=O)c1cc(ccc1Cl)C 1458a_100011290873_100000210303 [0,2,0,0,0,0|1,0,0]=3 7266 B13R1.446 CCCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210303 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.446 CCCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210303 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.446 CCCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210303 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.446 CCCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210303 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.446 CCCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210303 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.446 CCCC(=O)c1cc(ccc1F)C 1458a_100000749327_100000210303 [0,2,0,0,0,0|1,0,0]=3 7272 B13R1.446 CCCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210303 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.446 CCCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210303 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.446 CCCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210303 [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.446 CCCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210303 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.446 CCCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210303 [0,2,0,0,0,0|2,0,0]=4 7277 B13R1.446 CCCC(=O)c1cc(ccc1I)C 1458a_100000057929_100000210303 [0,2,0,0,0,0|1,0,0]=3 7278 B13R1.446 CCCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210303 [0,2,0,0,0,0|2,0,0]=4 7279 B13R1.446 CCCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210303 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.446 CCCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210303 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.446 CCCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210303 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.446 CCCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210303 [0,2,0,0,0,0|1,0,0]=3 7283 B13R1.446 CCCC(=O)c1cc(ccc1O)C 1458a_100000229998_100000210303 [0,2,0,0,0,0|0,0,0]=2 7284 B13R1.446 CCCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210303 [0,2,0,0,0,0|1,0,0]=3 7285 B13R1.446 CCCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210303 [0,2,0,0,0,0|1,0,0]=3 7286 B13R1.446 CCCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210303 [0,2,0,0,0,0|1,0,0]=3 7287 B13R1.446 CCCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210303 [0,2,0,0,0,0|1,0,0]=3 7288 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 11a_100015525214_100000690610 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 240690a_100015525214_100000690610 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.446 CCNC(=O)c1cc(ccc1Br)Br 527a_100015525214_100000690610 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 11a_100015525214_100000689033 [0,2,0,0,0,0|1,0,0]=3 7292 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 240690a_100015525214_100000689033 [0,2,0,0,0,0|1,0,0]=3 7293 B13R1.446 CCNC(=O)c1cc(ccc1Br)C 527a_100015525214_100000689033 [0,2,0,0,0,0|1,0,0]=3 7294 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 11a_100015525214_100000736951 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 240690a_100015525214_100000736951 [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.446 CCNC(=O)c1cc(ccc1Br)Cl 527a_100015525214_100000736951 [0,2,0,0,0,0|2,0,0]=4 7297 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 11a_100015525214_100000212315 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 240690a_100015525214_100000212315 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.446 CCNC(=O)c1cc(ccc1Br)F 527a_100015525214_100000212315 [0,2,0,0,0,0|2,0,0]=4 7300 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 11a_100015525214_100000698340 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 240690a_100015525214_100000698340 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.446 CCNC(=O)c1cc(ccc1Br)I 527a_100015525214_100000698340 [0,2,0,0,0,0|2,0,0]=4 7303 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 240690a_100015525214_100012352043 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.446 CCNC(=O)c1cc(ccc1Br)O 527a_100015525214_100012352043 [0,2,0,0,0,0|2,0,0]=4 7305 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 11a_100015525214_100000759961 [0,2,0,0,0,0|2,0,0]=4 7306 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 240690a_100015525214_100000759961 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.446 CCNC(=O)c1cc(ccc1C)Br 527a_100015525214_100000759961 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.446 CCNC(=O)c1cc(ccc1C)C 11a_100015525214_100000195421 [0,2,0,0,0,0|1,0,0]=3 7309 B13R1.446 CCNC(=O)c1cc(ccc1C)C 240690a_100015525214_100000195421 [0,2,0,0,0,0|1,0,0]=3 7310 B13R1.446 CCNC(=O)c1cc(ccc1C)C 527a_100015525214_100000195421 [0,2,0,0,0,0|1,0,0]=3 7311 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 11a_100015525214_100000692595 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 240690a_100015525214_100000692595 [0,2,0,0,0,0|2,0,0]=4 7313 B13R1.446 CCNC(=O)c1cc(ccc1C)Cl 527a_100015525214_100000692595 [0,2,0,0,0,0|2,0,0]=4 7314 B13R1.446 CCNC(=O)c1cc(ccc1C)F 11a_100015525214_100000240043 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.446 CCNC(=O)c1cc(ccc1C)F 240690a_100015525214_100000240043 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.446 CCNC(=O)c1cc(ccc1C)F 527a_100015525214_100000240043 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.446 CCNC(=O)c1cc(ccc1C)I 11a_100015525214_100000688012 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.446 CCNC(=O)c1cc(ccc1C)I 240690a_100015525214_100000688012 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.446 CCNC(=O)c1cc(ccc1C)I 527a_100015525214_100000688012 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.446 CCNC(=O)c1cc(ccc1C)O 240690a_100015525214_100000687834 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 11a_100015525214_100000211212 [0,2,0,0,0,0|2,0,0]=4 7322 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 240690a_100015525214_100000211212 [0,2,0,0,0,0|2,0,0]=4 7323 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Br 527a_100015525214_100000211212 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 11a_100015525214_100011290873 [0,2,0,0,0,0|1,0,0]=3 7325 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 240690a_100015525214_100011290873 [0,2,0,0,0,0|1,0,0]=3 7326 B13R1.446 CCNC(=O)c1cc(ccc1Cl)C 527a_100015525214_100011290873 [0,2,0,0,0,0|1,0,0]=3 7327 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 11a_100015525214_100000210642 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 240690a_100015525214_100000210642 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.446 CCNC(=O)c1cc(ccc1Cl)Cl 527a_100015525214_100000210642 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 11a_100015525214_100011219680 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 240690a_100015525214_100011219680 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.446 CCNC(=O)c1cc(ccc1Cl)F 527a_100015525214_100011219680 [0,2,0,0,0,0|2,0,0]=4 7333 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 11a_100015525214_100000688013 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 240690a_100015525214_100000688013 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.446 CCNC(=O)c1cc(ccc1Cl)I 527a_100015525214_100000688013 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 240690a_100015525214_100000719527 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.446 CCNC(=O)c1cc(ccc1Cl)O 527a_100015525214_100000719527 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 11a_100015525214_100000212322 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 240690a_100015525214_100000212322 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.446 CCNC(=O)c1cc(ccc1F)Br 527a_100015525214_100000212322 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.446 CCNC(=O)c1cc(ccc1F)C 11a_100015525214_100000749327 [0,2,0,0,0,0|1,0,0]=3 7342 B13R1.446 CCNC(=O)c1cc(ccc1F)C 240690a_100015525214_100000749327 [0,2,0,0,0,0|1,0,0]=3 7343 B13R1.446 CCNC(=O)c1cc(ccc1F)C 527a_100015525214_100000749327 [0,2,0,0,0,0|1,0,0]=3 7344 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 11a_100015525214_100000214954 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 240690a_100015525214_100000214954 [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.446 CCNC(=O)c1cc(ccc1F)Cl 527a_100015525214_100000214954 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.446 CCNC(=O)c1cc(ccc1F)F 11a_100015525214_100000198512 [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.446 CCNC(=O)c1cc(ccc1F)F 240690a_100015525214_100000198512 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.446 CCNC(=O)c1cc(ccc1F)F 527a_100015525214_100000198512 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.446 CCNC(=O)c1cc(ccc1F)I 11a_100015525214_100000688014 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.446 CCNC(=O)c1cc(ccc1F)I 240690a_100015525214_100000688014 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.446 CCNC(=O)c1cc(ccc1F)I 527a_100015525214_100000688014 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.446 CCNC(=O)c1cc(ccc1F)O 240690a_100015525214_100000037260 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.446 CCNC(=O)c1cc(ccc1F)O 271570a_203496583355_100000155167 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.446 CCNC(=O)c1cc(ccc1F)O 527a_100015525214_100000037260 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 11a_100015525214_100000183945 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.446 CCNC(=O)c1cc(ccc1I)Br 240690a_100015525214_100000183945 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.446 CCNC(=O)c1cc(ccc1I)C 11a_100015525214_100000057929 [0,2,0,0,0,0|1,0,0]=3 7359 B13R1.446 CCNC(=O)c1cc(ccc1I)C 240690a_100015525214_100000057929 [0,2,0,0,0,0|1,0,0]=3 7360 B13R1.446 CCNC(=O)c1cc(ccc1I)C 527a_100015525214_100000057929 [0,2,0,0,0,0|1,0,0]=3 7361 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 11a_100015525214_100000739379 [0,2,0,0,0,0|2,0,0]=4 7362 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 240690a_100015525214_100000739379 [0,2,0,0,0,0|2,0,0]=4 7363 B13R1.446 CCNC(=O)c1cc(ccc1I)Cl 527a_100015525214_100000739379 [0,2,0,0,0,0|2,0,0]=4 7364 B13R1.446 CCNC(=O)c1cc(ccc1I)F 11a_100015525214_100000748905 [0,2,0,0,0,0|2,0,0]=4 7365 B13R1.446 CCNC(=O)c1cc(ccc1I)F 240690a_100015525214_100000748905 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.446 CCNC(=O)c1cc(ccc1I)F 527a_100015525214_100000748905 [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.446 CCNC(=O)c1cc(ccc1I)I 11a_100015525214_100000750460 [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.446 CCNC(=O)c1cc(ccc1I)I 240690a_100015525214_100000750460 [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.446 CCNC(=O)c1cc(ccc1I)I 527a_100015525214_100000750460 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.446 CCNC(=O)c1cc(ccc1I)O 240690a_100015525214_200009995701 [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.446 CCNC(=O)c1cc(ccc1I)O 527a_100015525214_200009995701 [0,2,0,0,0,0|2,0,0]=4 7372 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 240690a_100015525214_100000212140 [0,2,0,0,0,0|1,0,0]=3 7373 B13R1.446 CCNC(=O)c1cc(ccc1O)Br 527a_100015525214_100000212140 [0,2,0,0,0,0|1,0,0]=3 7374 B13R1.446 CCNC(=O)c1cc(ccc1O)C 240690a_100015525214_100000229998 [0,2,0,0,0,0|0,0,0]=2 7375 B13R1.446 CCNC(=O)c1cc(ccc1O)C 527a_100015525214_100000229998 [0,2,0,0,0,0|0,0,0]=2 7376 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 11a_100015525214_100000212143 [0,2,0,0,0,0|1,0,0]=3 7377 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 240690a_100015525214_100000212143 [0,2,0,0,0,0|1,0,0]=3 7378 B13R1.446 CCNC(=O)c1cc(ccc1O)Cl 527a_100015525214_100000212143 [0,2,0,0,0,0|1,0,0]=3 7379 B13R1.446 CCNC(=O)c1cc(ccc1O)F 240690a_100015525214_100000742286 [0,2,0,0,0,0|1,0,0]=3 7380 B13R1.446 CCNC(=O)c1cc(ccc1O)F 527a_100015525214_100000742286 [0,2,0,0,0,0|1,0,0]=3 7381 B13R1.446 CCNC(=O)c1cc(ccc1O)I 240690a_100015525214_100000212111 [0,2,0,0,0,0|1,0,0]=3 7382 B13R1.446 CCNC(=O)c1cc(ccc1O)I 527a_100015525214_100000212111 [0,2,0,0,0,0|1,0,0]=3 7383 B13R1.446 CCNC(C)c1cc(ccc1O)C 269862a_100015525214_100000195442 [0,2,0,0,0,0|1,0,1]=4 7384 B13R1.446 CCOC(=O)c1cc(ccc1Br)O 271570a_203496583355_200012360513 [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.446 CCOC(=O)c1cc(ccc1C)O 271570a_203496583355_100012360117 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.446 CCOC(=O)c1cc(ccc1Cl)O 271570a_203496583355_200012339456 [0,2,0,0,0,0|2,0,0]=4 7387 B13R1.446 CCOC(=O)c1cc(ccc1F)O 271570a_203496583355_100000716760 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.446 CCOC(=O)c1cc(ccc1N)O 271570a_203496583355_100000747833 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.446 CCOC(=O)c1cc(ccc1O)Br 271570a_203496583355_100000171027 [0,2,0,0,0,0|1,0,0]=3 7390 B13R1.446 CCOC(=O)c1cc(ccc1O)C 271570a_203496583355_200012353901 [0,2,0,0,0,0|0,0,0]=2 7391 B13R1.446 CCOC(=O)c1cc(ccc1O)Cl 271570a_203496583355_100011294803 [0,2,0,0,0,0|1,0,0]=3 7392 B13R1.446 CCOC(=O)c1cc(ccc1O)F 271570a_203496583355_100011206316 [0,2,0,0,0,0|1,0,0]=3 7393 B13R1.446 CCOC(=O)c1cc(ccc1O)O 271570a_203496583355_200000174078 [0,2,0,0,0,0|1,0,0]=3 7394 B13R1.446 CCOC(=O)c1cc(cnc1O)C 271570a_203496583355_100009868943 [0,2,0,0,0,0|1,0,0]=3 7395 B13R1.446 CCOC(=O)c1cc(cnc1O)F 271570a_203496583355_100012350521 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.446 CCOC(=O)c1cc(cnc1O)N 271570a_203496583355_200012352213 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.446 CCOC(=O)c1cc(cnc1O)O 271570a_203496583355_100010189763 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.446 CCOC(=O)c1nc(ccc1O)N 271570a_203496583355_100010172133 [0,2,0,0,0,0|2,0,0]=4 7399 B13R1.446 CCOC(=O)c1nc(ccc1O)O 271570a_203496583355_200010189762 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 2230a_106832991635_100012361344 [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.446 CNCC(=O)c1cc(ccc1Br)Cl 34a_100102657272_100012361344 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.446 CNCC(=O)c1cc(ccc1C)C 2230a_106832991635_100000183774 [0,2,0,0,0,0|1,0,0]=3 7403 B13R1.446 CNCC(=O)c1cc(ccc1C)C 34a_100102657272_100000183774 [0,2,0,0,0,0|1,0,0]=3 7404 B13R1.446 CNCC(=O)c1cc(ccc1C)C 7a_106832991635_100000183774 [0,2,0,0,0,0|1,0,0]=3 7405 B13R1.446 CNCC(=O)c1cc(ccc1Cl)Cl 2230a_106832991635_100000183120 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.446 CNCC(=O)c1cc(ccc1Cl)F 34a_100102657272_200010187420 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.446 CNCC(=O)c1cc(ccc1F)F 34a_100102657272_100000211571 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.446 CNCC(=O)c1cc(ccc1F)F 7a_106832991635_100000211571 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 34a_100102657272_200009828000 [0,2,0,0,0,0|1,0,0]=3 7410 B13R1.446 CNCC(=O)c1cc(ccc1O)Br 7a_106832991635_200009828000 [0,2,0,0,0,0|1,0,0]=3 7411 B13R1.446 CNCC(=O)c1cc(ccc1O)F 34a_100102657272_100009814381 [0,2,0,0,0,0|1,0,0]=3 7412 B13R1.446 CNCC(=O)c1cc(ccc1O)F 7a_106832991635_100000047744 [0,2,0,0,0,0|1,0,0]=3 7413 B13R1.446 CNCC(=O)c1cc(ccc1O)O 34a_100102657272_100009814097 [0,2,0,0,0,0|1,0,0]=3 7414 B13R1.446 CNCC(=O)c1cc(ccc1O)O 7a_106832991635_100009814097 [0,2,0,0,0,0|1,0,0]=3 7415 B13R1.446 CNNC(=O)c1cc(ccc1Br)Br 22a_100016993582_100000690610 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.446 CNNC(=O)c1cc(ccc1Br)C 22a_100016993582_100000689033 [0,2,0,0,0,0|1,0,0]=3 7417 B13R1.446 CNNC(=O)c1cc(ccc1Br)Cl 22a_100016993582_100000736951 [0,2,0,0,0,0|2,0,0]=4 7418 B13R1.446 CNNC(=O)c1cc(ccc1Br)F 22a_100016993582_100000212315 [0,2,0,0,0,0|2,0,0]=4 7419 B13R1.446 CNNC(=O)c1cc(ccc1Br)I 22a_100016993582_100000698340 [0,2,0,0,0,0|2,0,0]=4 7420 B13R1.446 CNNC(=O)c1cc(ccc1Br)O 22a_100016993582_100012352043 [0,2,0,0,0,0|2,0,0]=4 7421 B13R1.446 CNNC(=O)c1cc(ccc1C)Br 22a_100016993582_100000759961 [0,2,0,0,0,0|2,0,0]=4 7422 B13R1.446 CNNC(=O)c1cc(ccc1C)C 22a_100016993582_100000195421 [0,2,0,0,0,0|1,0,0]=3 7423 B13R1.446 CNNC(=O)c1cc(ccc1C)Cl 22a_100016993582_100000692595 [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.446 CNNC(=O)c1cc(ccc1C)F 22a_100016993582_100000240043 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.446 CNNC(=O)c1cc(ccc1C)I 22a_100016993582_100000688012 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.446 CNNC(=O)c1cc(ccc1C)O 22a_100016993582_100000687834 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Br 22a_100016993582_100000211212 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.446 CNNC(=O)c1cc(ccc1Cl)C 22a_100016993582_100011290873 [0,2,0,0,0,0|1,0,0]=3 7429 B13R1.446 CNNC(=O)c1cc(ccc1Cl)Cl 22a_100016993582_100000210642 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.446 CNNC(=O)c1cc(ccc1Cl)F 22a_100016993582_100011219680 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.446 CNNC(=O)c1cc(ccc1Cl)I 22a_100016993582_100000688013 [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.446 CNNC(=O)c1cc(ccc1Cl)O 22a_100016993582_100000719527 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.446 CNNC(=O)c1cc(ccc1F)Br 22a_100016993582_100000212322 [0,2,0,0,0,0|2,0,0]=4 7434 B13R1.446 CNNC(=O)c1cc(ccc1F)C 22a_100016993582_100000749327 [0,2,0,0,0,0|1,0,0]=3 7435 B13R1.446 CNNC(=O)c1cc(ccc1F)Cl 22a_100016993582_100000214954 [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.446 CNNC(=O)c1cc(ccc1F)F 22a_100016993582_100000198512 [0,2,0,0,0,0|2,0,0]=4 7437 B13R1.446 CNNC(=O)c1cc(ccc1F)I 22a_100016993582_100000688014 [0,2,0,0,0,0|2,0,0]=4 7438 B13R1.446 CNNC(=O)c1cc(ccc1F)O 22a_100016993582_100000037260 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.446 CNNC(=O)c1cc(ccc1I)Br 22a_100016993582_100000183945 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.446 CNNC(=O)c1cc(ccc1I)C 22a_100016993582_100000057929 [0,2,0,0,0,0|1,0,0]=3 7441 B13R1.446 CNNC(=O)c1cc(ccc1I)Cl 22a_100016993582_100000739379 [0,2,0,0,0,0|2,0,0]=4 7442 B13R1.446 CNNC(=O)c1cc(ccc1I)F 22a_100016993582_100000748905 [0,2,0,0,0,0|2,0,0]=4 7443 B13R1.446 CNNC(=O)c1cc(ccc1I)I 22a_100016993582_100000750460 [0,2,0,0,0,0|2,0,0]=4 7444 B13R1.446 CNNC(=O)c1cc(ccc1I)O 22a_100016993582_200009995701 [0,2,0,0,0,0|2,0,0]=4 7445 B13R1.446 CNNC(=O)c1cc(ccc1O)Br 22a_100016993582_100000212140 [0,2,0,0,0,0|1,0,0]=3 7446 B13R1.446 CNNC(=O)c1cc(ccc1O)C 22a_100016993582_100000229998 [0,2,0,0,0,0|0,0,0]=2 7447 B13R1.446 CNNC(=O)c1cc(ccc1O)Cl 22a_100016993582_100000212143 [0,2,0,0,0,0|1,0,0]=3 7448 B13R1.446 CNNC(=O)c1cc(ccc1O)F 22a_100016993582_100000742286 [0,2,0,0,0,0|1,0,0]=3 7449 B13R1.446 CNNC(=O)c1cc(ccc1O)I 22a_100016993582_100000212111 [0,2,0,0,0,0|1,0,0]=3 7450 B13R1.446 COCC(=O)c1cc(ccc1Br)Cl 34a_100138415774_100012361344 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.446 COCC(=O)c1cc(ccc1C)C 34a_100138415774_100000183774 [0,2,0,0,0,0|1,0,0]=3 7452 B13R1.446 COCC(=O)c1cc(ccc1Cl)F 34a_100138415774_200010187420 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.446 COCC(=O)c1cc(ccc1F)F 34a_100138415774_100000211571 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.446 COCC(=O)c1cc(ccc1O)Br 34a_100138415774_200009828000 [0,2,0,0,0,0|1,0,0]=3 7455 B13R1.446 COCC(=O)c1cc(ccc1O)F 34a_100138415774_100009814381 [0,2,0,0,0,0|1,0,0]=3 7456 B13R1.446 COCC(=O)c1cc(ccc1O)O 34a_100138415774_100009814097 [0,2,0,0,0,0|1,0,0]=3 7457 B13R1.446 CSCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200000210301 [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_100000183774_200000210301 [0,2,0,0,0,0|1,0,0]=3 7459 B13R1.446 CSCC(=O)c1cc(ccc1C)C 62a_200000210301_100000183774 [0,2,0,0,0,0|1,0,0]=3 7460 B13R1.446 CSCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200000210301 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200000210301_200010187420 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.446 CSCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200000210301 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_100000211571_200000210301 [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.446 CSCC(=O)c1cc(ccc1F)F 62a_200000210301_100000211571 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.446 CSCC(=O)c1cc(ccc1O)Br 62a_200009828000_200000210301 [0,2,0,0,0,0|1,0,0]=3 7466 B13R1.446 CSCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200000210301 [0,2,0,0,0,0|1,0,0]=3 7467 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_100009814381_200000210301 [0,2,0,0,0,0|1,0,0]=3 7468 B13R1.446 CSCC(=O)c1cc(ccc1O)F 62a_200000210301_100009814381 [0,2,0,0,0,0|1,0,0]=3 7469 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_100009814097_200000210301 [0,2,0,0,0,0|1,0,0]=3 7470 B13R1.446 CSCC(=O)c1cc(ccc1O)O 62a_200000210301_100009814097 [0,2,0,0,0,0|1,0,0]=3 7471 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)Br 1458a_100000689033_100011214920 [0,2,0,0,0,0|1,0,0]=3 7472 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)C 1458a_100000195421_100011214920 [0,2,0,0,0,0|1,0,0]=3 7473 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)Cl 1458a_100011290873_100011214920 [0,2,0,0,0,0|1,0,0]=3 7474 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)F 1458a_100000749327_100011214920 [0,2,0,0,0,0|1,0,0]=3 7475 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)I 1458a_100000057929_100011214920 [0,2,0,0,0,0|1,0,0]=3 7476 B13R1.446 Cc1ccc(c(c1)C(=O)CC#N)O 1458a_100000229998_100011214920 [0,2,0,0,0,0|0,0,0]=2 7477 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Br 1458a_100000689033_100011217306 [0,2,0,0,0,0|1,0,0]=3 7478 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)C 1458a_100000195421_100011217306 [0,2,0,0,0,0|1,0,0]=3 7479 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)Cl 1458a_100011290873_100011217306 [0,2,0,0,0,0|1,0,0]=3 7480 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)F 1458a_100000749327_100011217306 [0,2,0,0,0,0|1,0,0]=3 7481 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)I 1458a_100000057929_100011217306 [0,2,0,0,0,0|1,0,0]=3 7482 B13R1.446 Cc1ccc(c(c1)C(=O)CCF)O 1458a_100000229998_100011217306 [0,2,0,0,0,0|0,0,0]=2 7483 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Br 1458a_100000689033_100000211926 [0,2,0,0,0,0|1,0,0]=3 7484 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)C 1458a_100000195421_100000211926 [0,2,0,0,0,0|1,0,0]=3 7485 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)Cl 1458a_100011290873_100000211926 [0,2,0,0,0,0|1,0,0]=3 7486 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)F 1458a_100000749327_100000211926 [0,2,0,0,0,0|1,0,0]=3 7487 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)I 1458a_100000057929_100000211926 [0,2,0,0,0,0|1,0,0]=3 7488 B13R1.446 Cc1ccc(c(c1)C(=O)CCO)O 1458a_100000229998_100000211926 [0,2,0,0,0,0|0,0,0]=2 7489 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_100000183774_200025704644 [0,2,0,0,0,0|1,0,0]=3 7490 B13R1.446 Cc1ccc(c(c1)C(=O)CS[13CH3])C 62a_200025704644_100000183774 [0,2,0,0,0,0|1,0,0]=3 7491 B13R1.446 Cc1ccc(cc1C(=O)CC#N)Br 1458a_100000759961_100011214920 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.446 Cc1ccc(cc1C(=O)CC#N)Cl 1458a_100000692595_100011214920 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.446 Cc1ccc(cc1C(=O)CC#N)F 1458a_100000240043_100011214920 [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.446 Cc1ccc(cc1C(=O)CC#N)I 1458a_100000688012_100011214920 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.446 Cc1ccc(cc1C(=O)CC#N)O 1458a_100000687834_100011214920 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.446 Cc1ccc(cc1C(=O)CCF)Br 1458a_100000759961_100011217306 [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.446 Cc1ccc(cc1C(=O)CCF)Cl 1458a_100000692595_100011217306 [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.446 Cc1ccc(cc1C(=O)CCF)F 1458a_100000240043_100011217306 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.446 Cc1ccc(cc1C(=O)CCF)I 1458a_100000688012_100011217306 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.446 Cc1ccc(cc1C(=O)CCF)O 1458a_100000687834_100011217306 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.446 Cc1ccc(cc1C(=O)CCO)Br 1458a_100000759961_100000211926 [0,2,0,0,0,0|2,0,0]=4 7502 B13R1.446 Cc1ccc(cc1C(=O)CCO)Cl 1458a_100000692595_100000211926 [0,2,0,0,0,0|2,0,0]=4 7503 B13R1.446 Cc1ccc(cc1C(=O)CCO)F 1458a_100000240043_100000211926 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.446 Cc1ccc(cc1C(=O)CCO)I 1458a_100000688012_100000211926 [0,2,0,0,0,0|2,0,0]=4 7505 B13R1.446 Cc1ccc(cc1C(=O)CCO)O 1458a_100000687834_100000211926 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.446 N#CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100011214920 [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.446 N#CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100011214920 [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.446 N#CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100011214920 [0,2,0,0,0,0|2,0,0]=4 7509 B13R1.446 N#CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100011214920 [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.446 N#CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100011214920 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.446 N#CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100011214920 [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.446 N#CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100011214920 [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.446 N#CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100011214920 [0,2,0,0,0,0|2,0,0]=4 7514 B13R1.446 N#CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100011214920 [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.446 N#CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100011214920 [0,2,0,0,0,0|2,0,0]=4 7516 B13R1.446 N#CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100011214920 [0,2,0,0,0,0|2,0,0]=4 7517 B13R1.446 N#CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100011214920 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.446 N#CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100011214920 [0,2,0,0,0,0|2,0,0]=4 7519 B13R1.446 N#CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100011214920 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.446 N#CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100011214920 [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.446 N#CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100011214920 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.446 N#CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100011214920 [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.446 N#CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100011214920 [0,2,0,0,0,0|2,0,0]=4 7524 B13R1.446 N#CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100011214920 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.446 N#CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100011214920 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.446 N#CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100011214920 [0,2,0,0,0,0|1,0,0]=3 7527 B13R1.446 N#CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100011214920 [0,2,0,0,0,0|1,0,0]=3 7528 B13R1.446 N#CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100011214920 [0,2,0,0,0,0|1,0,0]=3 7529 B13R1.446 N#CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100011214920 [0,2,0,0,0,0|1,0,0]=3 7530 B13R1.446 N#CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100011214920 [0,2,0,0,0,0|1,0,0]=3 7531 B13R1.446 O=C(CCF)c1cc(ccc1Br)Br 1458a_100000690610_100011217306 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.446 O=C(CCF)c1cc(ccc1Br)Cl 1458a_100000736951_100011217306 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.446 O=C(CCF)c1cc(ccc1Br)F 1458a_100000212315_100011217306 [0,2,0,0,0,0|2,0,0]=4 7534 B13R1.446 O=C(CCF)c1cc(ccc1Br)I 1458a_100000698340_100011217306 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.446 O=C(CCF)c1cc(ccc1Br)O 1458a_100012352043_100011217306 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Br 1458a_100000211212_100011217306 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.446 O=C(CCF)c1cc(ccc1Cl)Cl 1458a_100000210642_100011217306 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.446 O=C(CCF)c1cc(ccc1Cl)F 1458a_100011219680_100011217306 [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.446 O=C(CCF)c1cc(ccc1Cl)I 1458a_100000688013_100011217306 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.446 O=C(CCF)c1cc(ccc1Cl)O 1458a_100000719527_100011217306 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.446 O=C(CCF)c1cc(ccc1F)Br 1458a_100000212322_100011217306 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.446 O=C(CCF)c1cc(ccc1F)Cl 1458a_100000214954_100011217306 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.446 O=C(CCF)c1cc(ccc1F)F 1458a_100000198512_100011217306 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.446 O=C(CCF)c1cc(ccc1F)I 1458a_100000688014_100011217306 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.446 O=C(CCF)c1cc(ccc1F)O 1458a_100000037260_100011217306 [0,2,0,0,0,0|2,0,0]=4 7546 B13R1.446 O=C(CCF)c1cc(ccc1I)Br 1458a_100000183945_100011217306 [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.446 O=C(CCF)c1cc(ccc1I)Cl 1458a_100000739379_100011217306 [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.446 O=C(CCF)c1cc(ccc1I)F 1458a_100000748905_100011217306 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.446 O=C(CCF)c1cc(ccc1I)I 1458a_100000750460_100011217306 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.446 O=C(CCF)c1cc(ccc1I)O 1458a_200009995701_100011217306 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.446 O=C(CCF)c1cc(ccc1O)Br 1458a_100000212140_100011217306 [0,2,0,0,0,0|1,0,0]=3 7552 B13R1.446 O=C(CCF)c1cc(ccc1O)Cl 1458a_100000212143_100011217306 [0,2,0,0,0,0|1,0,0]=3 7553 B13R1.446 O=C(CCF)c1cc(ccc1O)F 1458a_100000742286_100011217306 [0,2,0,0,0,0|1,0,0]=3 7554 B13R1.446 O=C(CCF)c1cc(ccc1O)I 1458a_100000212111_100011217306 [0,2,0,0,0,0|1,0,0]=3 7555 B13R1.446 O=C(CCF)c1cc(ccc1O)O 1458a_100000758025_100011217306 [0,2,0,0,0,0|1,0,0]=3 7556 B13R1.446 O=C(CCO)c1cc(ccc1Br)Br 1458a_100000690610_100000211926 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.446 O=C(CCO)c1cc(ccc1Br)Cl 1458a_100000736951_100000211926 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.446 O=C(CCO)c1cc(ccc1Br)F 1458a_100000212315_100000211926 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.446 O=C(CCO)c1cc(ccc1Br)I 1458a_100000698340_100000211926 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.446 O=C(CCO)c1cc(ccc1Br)O 1458a_100012352043_100000211926 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Br 1458a_100000211212_100000211926 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.446 O=C(CCO)c1cc(ccc1Cl)Cl 1458a_100000210642_100000211926 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.446 O=C(CCO)c1cc(ccc1Cl)F 1458a_100011219680_100000211926 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.446 O=C(CCO)c1cc(ccc1Cl)I 1458a_100000688013_100000211926 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.446 O=C(CCO)c1cc(ccc1Cl)O 1458a_100000719527_100000211926 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.446 O=C(CCO)c1cc(ccc1F)Br 1458a_100000212322_100000211926 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.446 O=C(CCO)c1cc(ccc1F)Cl 1458a_100000214954_100000211926 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.446 O=C(CCO)c1cc(ccc1F)F 1458a_100000198512_100000211926 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.446 O=C(CCO)c1cc(ccc1F)I 1458a_100000688014_100000211926 [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.446 O=C(CCO)c1cc(ccc1F)O 1458a_100000037260_100000211926 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.446 O=C(CCO)c1cc(ccc1I)Br 1458a_100000183945_100000211926 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.446 O=C(CCO)c1cc(ccc1I)Cl 1458a_100000739379_100000211926 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.446 O=C(CCO)c1cc(ccc1I)F 1458a_100000748905_100000211926 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.446 O=C(CCO)c1cc(ccc1I)I 1458a_100000750460_100000211926 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.446 O=C(CCO)c1cc(ccc1I)O 1458a_200009995701_100000211926 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.446 O=C(CCO)c1cc(ccc1O)Br 1458a_100000212140_100000211926 [0,2,0,0,0,0|1,0,0]=3 7577 B13R1.446 O=C(CCO)c1cc(ccc1O)Cl 1458a_100000212143_100000211926 [0,2,0,0,0,0|1,0,0]=3 7578 B13R1.446 O=C(CCO)c1cc(ccc1O)F 1458a_100000742286_100000211926 [0,2,0,0,0,0|1,0,0]=3 7579 B13R1.446 O=C(CCO)c1cc(ccc1O)I 1458a_100000212111_100000211926 [0,2,0,0,0,0|1,0,0]=3 7580 B13R1.446 O=C(CCO)c1cc(ccc1O)O 1458a_100000758025_100000211926 [0,2,0,0,0,0|1,0,0]=3 7581 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Br)Cl 62a_100012361344_200025704644 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)Cl 62a_100000183120_200025704644 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200010187420_200025704644 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1Cl)F 62a_200025704644_200010187420 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_100000211571_200025704644 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1F)F 62a_200025704644_100000211571 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Br 62a_200009828000_200025704644 [0,2,0,0,0,0|1,0,0]=3 7588 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)Cl 62a_200009816716_200025704644 [0,2,0,0,0,0|1,0,0]=3 7589 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_100009814381_200025704644 [0,2,0,0,0,0|1,0,0]=3 7590 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)F 62a_200025704644_100009814381 [0,2,0,0,0,0|1,0,0]=3 7591 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_100009814097_200025704644 [0,2,0,0,0,0|1,0,0]=3 7592 B13R1.446 [13CH3]SCC(=O)c1cc(ccc1O)O 62a_200025704644_100009814097 [0,2,0,0,0,0|1,0,0]=3 7593 B13R1.1822 CCC(=O)c1c(ccc(c1Br)C)F 1458a_100000720849_100000210202 [0,2,0,0,0,0|1,0,0]=3 7594 B13R1.1822 CCC(=O)c1c(ccc(c1Br)F)F 1458a_100010245744_100000210202 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.1822 CCC(=O)c1c(ccc(c1C)Br)C 1458a_100012355652_100000210202 [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.1822 CCC(=O)c1c(ccc(c1C)Br)F 1458a_100010768519_100000210202 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.1822 CCC(=O)c1c(ccc(c1C)F)Br 1458a_100010768524_100000210202 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_100000210202 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Br)F 1458a_100010245877_100000210202 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)C)Br 1458a_200010769262_100000210202 [0,2,0,0,0,0|1,0,0]=3 7601 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)C)F 1458a_100000036856_100000210202 [0,2,0,0,0,0|1,0,0]=3 7602 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_100000210202 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_100000210202 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_100000210202 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.1822 CCC(=O)c1c(ccc(c1Cl)F)F 1458a_100000043044_100000210202 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)Br 1458a_100010233042_100000210202 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)Cl 1458a_100010235752_100000210202 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.1822 CCC(=O)c1c(ccc(c1F)Br)F 1458a_100000721511_100000210202 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)Br 1458a_100010271678_100000210202 [0,2,0,0,0,0|1,0,0]=3 7610 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)Cl 1458a_100000039063_100000210202 [0,2,0,0,0,0|1,0,0]=3 7611 B13R1.1822 CCC(=O)c1c(ccc(c1F)C)F 1458a_100000692215_100000210202 [0,2,0,0,0,0|1,0,0]=3 7612 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)Br 1458a_100010769261_100000210202 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_100000210202 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.1822 CCC(=O)c1c(ccc(c1F)Cl)F 1458a_100011219569_100000210202 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)Br 1458a_100010177765_100000210202 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)Cl 1458a_100011998153_100000210202 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)F 1458a_100000031524_100000210202 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)I 1458a_100010177766_100000210202 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.1822 CCC(=O)c1c(ccc(c1F)F)O 1458a_100000062415_100000210202 [0,2,0,0,0,0|1,0,0]=3 7620 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)Br 1458a_100010782274_100000210202 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)Cl 1458a_100021583479_100000210202 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.1822 CCC(=O)c1c(ccc(c1F)I)F 1458a_100012359589_100000210202 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.1822 CCC(=O)c1c(ccc(c1F)O)F 1458a_100000068660_100000210202 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.1822 CCC(=O)c1c(ccc(c1O)Br)O 1458a_100010008628_100000210202 [0,2,0,0,0,0|1,0,0]=3 7625 B13R1.1822 CCC(=O)c1c(ccc(c1O)C)C 1458a_100011255215_100000210202 [0,2,0,0,0,0|1,0,0]=3 7626 B13R1.1822 CCC(=O)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100000210202 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.1822 CCC(=O)c1c(ccc(c1O)Cl)O 1458a_100000080727_100000210202 [0,2,0,0,0,0|1,0,0]=3 7628 B13R1.1822 CCC(=O)c1c(ccc(c1O)F)F 1458a_100011830443_100000210202 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 11a_106832991635_100000720849 [0,2,0,0,0,0|1,0,0]=3 7630 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 1626a_100102657272_100000720849 [0,2,0,0,0,0|1,0,0]=3 7631 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 240690a_100102657272_100000720849 [0,2,0,0,0,0|1,0,0]=3 7632 B13R1.1822 CNC(=O)c1c(ccc(c1Br)C)F 527a_100102657272_100000720849 [0,2,0,0,0,0|1,0,0]=3 7633 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 11a_106832991635_100010245744 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 1626a_100102657272_100010245744 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 240690a_100102657272_100010245744 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.1822 CNC(=O)c1c(ccc(c1Br)F)F 527a_100102657272_100010245744 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 11a_106832991635_100012355652 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 1626a_100102657272_100012355652 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 240690a_100102657272_100012355652 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)C 527a_100102657272_100012355652 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 11a_106832991635_100010768519 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 1626a_100102657272_100010768519 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 240690a_100102657272_100010768519 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.1822 CNC(=O)c1c(ccc(c1C)Br)F 527a_100102657272_100010768519 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 11a_106832991635_100010768524 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 1626a_100102657272_100010768524 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 240690a_100102657272_100010768524 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.1822 CNC(=O)c1c(ccc(c1C)F)Br 527a_100102657272_100010768524 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 11a_106832991635_100012350121 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 1626a_100102657272_100012350121 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 240690a_100102657272_100012350121 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)Cl 527a_100102657272_100012350121 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 11a_106832991635_100010245877 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 1626a_100102657272_100010245877 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 240690a_100102657272_100010245877 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Br)F 527a_100102657272_100010245877 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 11a_106832991635_200010769262 [0,2,0,0,0,0|1,0,0]=3 7658 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 1626a_100102657272_200010769262 [0,2,0,0,0,0|1,0,0]=3 7659 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 240690a_100102657272_200010769262 [0,2,0,0,0,0|1,0,0]=3 7660 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)Br 527a_100102657272_200010769262 [0,2,0,0,0,0|1,0,0]=3 7661 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 11a_106832991635_100000036856 [0,2,0,0,0,0|1,0,0]=3 7662 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 1626a_100102657272_100000036856 [0,2,0,0,0,0|1,0,0]=3 7663 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 240690a_100102657272_100000036856 [0,2,0,0,0,0|1,0,0]=3 7664 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)C)F 527a_100102657272_100000036856 [0,2,0,0,0,0|1,0,0]=3 7665 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 11a_106832991635_100000182695 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 1626a_100102657272_100000182695 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 240690a_100102657272_100000182695 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)Cl 527a_100102657272_100000182695 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 11a_106832991635_100000061834 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 1626a_100102657272_100000061834 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 240690a_100102657272_100000061834 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)Cl)F 527a_100102657272_100000061834 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 11a_106832991635_100000068355 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 1626a_100102657272_100000068355 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)Cl 240690a_100102657272_100000068355 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 11a_106832991635_100000043044 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 1626a_100102657272_100000043044 [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 240690a_100102657272_100000043044 [0,2,0,0,0,0|2,0,0]=4 7679 B13R1.1822 CNC(=O)c1c(ccc(c1Cl)F)F 527a_100102657272_100000043044 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 11a_106832991635_100010233042 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 240690a_100102657272_100010233042 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Br 527a_100102657272_100010233042 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 11a_106832991635_100010235752 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 1626a_100102657272_100010235752 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 240690a_100102657272_100010235752 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)Cl 527a_100102657272_100010235752 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 11a_106832991635_100000721511 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 1626a_100102657272_100000721511 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 240690a_100102657272_100000721511 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.1822 CNC(=O)c1c(ccc(c1F)Br)F 527a_100102657272_100000721511 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 11a_106832991635_100010271678 [0,2,0,0,0,0|1,0,0]=3 7692 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 1626a_100102657272_100010271678 [0,2,0,0,0,0|1,0,0]=3 7693 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 240690a_100102657272_100010271678 [0,2,0,0,0,0|1,0,0]=3 7694 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Br 527a_100102657272_100010271678 [0,2,0,0,0,0|1,0,0]=3 7695 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 11a_106832991635_100000039063 [0,2,0,0,0,0|1,0,0]=3 7696 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 1626a_100102657272_100000039063 [0,2,0,0,0,0|1,0,0]=3 7697 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 240690a_100102657272_100000039063 [0,2,0,0,0,0|1,0,0]=3 7698 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)Cl 527a_100102657272_100000039063 [0,2,0,0,0,0|1,0,0]=3 7699 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 11a_106832991635_100000692215 [0,2,0,0,0,0|1,0,0]=3 7700 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 1626a_100102657272_100000692215 [0,2,0,0,0,0|1,0,0]=3 7701 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 240690a_100102657272_100000692215 [0,2,0,0,0,0|1,0,0]=3 7702 B13R1.1822 CNC(=O)c1c(ccc(c1F)C)F 527a_100102657272_100000692215 [0,2,0,0,0,0|1,0,0]=3 7703 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 11a_106832991635_100010769261 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 1626a_100102657272_100010769261 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 240690a_100102657272_100010769261 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Br 527a_100102657272_100010769261 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 11a_106832991635_100000061686 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 1626a_100102657272_100000061686 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 240690a_100102657272_100000061686 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)Cl 527a_100102657272_100000061686 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 11a_106832991635_100011219569 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 1626a_100102657272_100011219569 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 240690a_100102657272_100011219569 [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.1822 CNC(=O)c1c(ccc(c1F)Cl)F 527a_100102657272_100011219569 [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 11a_106832991635_100010177765 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 1626a_100102657272_100010177765 [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 240690a_100102657272_100010177765 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Br 527a_100102657272_100010177765 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 11a_106832991635_100011998153 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 1626a_100102657272_100011998153 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 240690a_100102657272_100011998153 [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)Cl 527a_100102657272_100011998153 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 11a_106832991635_100000031524 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 1626a_100102657272_100000031524 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 240690a_100102657272_100000031524 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)F 527a_100102657272_100000031524 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 11a_106832991635_100010177766 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 1626a_100102657272_100010177766 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 240690a_100102657272_100010177766 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)I 527a_100102657272_100010177766 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)O 240690a_100102657272_100000062415 [0,2,0,0,0,0|1,0,0]=3 7732 B13R1.1822 CNC(=O)c1c(ccc(c1F)F)O 527a_100102657272_100000062415 [0,2,0,0,0,0|1,0,0]=3 7733 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 11a_106832991635_100010782274 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 1626a_100102657272_100010782274 [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 240690a_100102657272_100010782274 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Br 527a_100102657272_100010782274 [0,2,0,0,0,0|2,0,0]=4 7737 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 11a_106832991635_100021583479 [0,2,0,0,0,0|2,0,0]=4 7738 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 1626a_100102657272_100021583479 [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 240690a_100102657272_100021583479 [0,2,0,0,0,0|2,0,0]=4 7740 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)Cl 527a_100102657272_100021583479 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 11a_106832991635_100012359589 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 1626a_100102657272_100012359589 [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 240690a_100102657272_100012359589 [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.1822 CNC(=O)c1c(ccc(c1F)I)F 527a_100102657272_100012359589 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 240690a_100102657272_100000068660 [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.1822 CNC(=O)c1c(ccc(c1F)O)F 527a_100102657272_100000068660 [0,2,0,0,0,0|2,0,0]=4 7747 B13R1.1822 CNC(=O)c1c(ccc(c1O)Br)O 240690a_100102657272_100010008628 [0,2,0,0,0,0|1,0,0]=3 7748 B13R1.1822 CNC(=O)c1c(ccc(c1O)Br)O 527a_100102657272_100010008628 [0,2,0,0,0,0|1,0,0]=3 7749 B13R1.1822 CNC(=O)c1c(ccc(c1O)C)C 240690a_100102657272_100011255215 [0,2,0,0,0,0|1,0,0]=3 7750 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)Cl 240690a_100102657272_100011255222 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)Cl 527a_100102657272_100011255222 [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)O 240690a_100102657272_100000080727 [0,2,0,0,0,0|1,0,0]=3 7753 B13R1.1822 CNC(=O)c1c(ccc(c1O)Cl)O 527a_100102657272_100000080727 [0,2,0,0,0,0|1,0,0]=3 7754 B13R1.1822 CNC(=O)c1c(ccc(c1O)F)F 240690a_100102657272_100011830443 [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.1822 CNC(=O)c1c(ccc(c1O)F)F 527a_100102657272_100011830443 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.1822 COC(=O)c1c(ccc(c1C)F)O 271570a_203496583355_100015681208 [0,2,0,0,0,0|1,0,0]=3 7757 B13R1.1822 COC(=O)c1c(ccc(c1C)N)O 271570a_203496583355_100000718917 [0,2,0,0,0,0|1,0,0]=3 7758 B13R1.1822 COC(=O)c1c(ccc(c1C)O)C 271570a_203496583355_100016100700 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.1822 COC(=O)c1c(ccc(c1C)O)N 271570a_203496583355_100010203172 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.1822 COC(=O)c1c(ccc(c1C)O)O 271570a_203496583355_100010074912 [0,2,0,0,0,0|1,0,0]=3 7761 B13R1.1822 COC(=O)c1c(ccc(c1F)Br)O 271570a_203496583355_100015883209 [0,2,0,0,0,0|1,0,0]=3 7762 B13R1.1822 COC(=O)c1c(ccc(c1F)C)O 271570a_203496583355_100010782293 [0,2,0,0,0,0|0,0,0]=2 7763 B13R1.1822 COC(=O)c1c(ccc(c1F)O)F 271570a_203496583355_100000721510 [0,2,0,0,0,0|2,0,0]=4 7764 B13R1.1822 COC(=O)c1c(ccc(c1O)F)F 271570a_203496583355_100011071027 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.1822 Cc1c(ccc(c1C(=O)CF)Br)F 1458a_100010768524_100015361967 [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.1822 Cc1c(ccc(c1C(=O)CF)F)Br 1458a_100010768519_100015361967 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.1822 Cc1ccc(c(c1Br)C(=O)CF)F 1458a_100000720849_100015361967 [0,2,0,0,0,0|1,0,0]=3 7768 B13R1.1822 Cc1ccc(c(c1C(=O)CF)C)Br 1458a_100012355652_100015361967 [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.1822 Cc1ccc(c(c1Cl)C(=O)CF)Br 1458a_200010769262_100015361967 [0,2,0,0,0,0|1,0,0]=3 7770 B13R1.1822 Cc1ccc(c(c1Cl)C(=O)CF)F 1458a_100000036856_100015361967 [0,2,0,0,0,0|1,0,0]=3 7771 B13R1.1822 Cc1ccc(c(c1F)C(=O)CF)Br 1458a_100010271678_100015361967 [0,2,0,0,0,0|1,0,0]=3 7772 B13R1.1822 Cc1ccc(c(c1F)C(=O)CF)Cl 1458a_100000039063_100015361967 [0,2,0,0,0,0|1,0,0]=3 7773 B13R1.1822 Cc1ccc(c(c1F)C(=O)CF)F 1458a_100000692215_100015361967 [0,2,0,0,0,0|1,0,0]=3 7774 B13R1.1822 Cc1ccc(c(c1O)C(=O)CF)C 1458a_100011255215_100015361967 [0,2,0,0,0,0|1,0,0]=3 7775 B13R1.1822 O=C(CF)c1c(ccc(c1Br)F)F 1458a_100010245744_100015361967 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)Br)Cl 1458a_100012350121_100015361967 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)Br)F 1458a_100010245877_100015361967 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)Cl)Cl 1458a_100000182695_100015361967 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)Cl)F 1458a_100000061834_100015361967 [0,2,0,0,0,0|2,0,0]=4 7780 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)F)Cl 1458a_100000068355_100015361967 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.1822 O=C(CF)c1c(ccc(c1Cl)F)F 1458a_100000043044_100015361967 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.1822 O=C(CF)c1c(ccc(c1F)Br)Br 1458a_100010233042_100015361967 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.1822 O=C(CF)c1c(ccc(c1F)Br)Cl 1458a_100010235752_100015361967 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.1822 O=C(CF)c1c(ccc(c1F)Br)F 1458a_100000721511_100015361967 [0,2,0,0,0,0|2,0,0]=4 7785 B13R1.1822 O=C(CF)c1c(ccc(c1F)Cl)Br 1458a_100010769261_100015361967 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.1822 O=C(CF)c1c(ccc(c1F)Cl)Cl 1458a_100000061686_100015361967 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.1822 O=C(CF)c1c(ccc(c1F)Cl)F 1458a_100011219569_100015361967 [0,2,0,0,0,0|2,0,0]=4 7788 B13R1.1822 O=C(CF)c1c(ccc(c1F)F)Br 1458a_100010177765_100015361967 [0,2,0,0,0,0|2,0,0]=4 7789 B13R1.1822 O=C(CF)c1c(ccc(c1F)F)Cl 1458a_100011998153_100015361967 [0,2,0,0,0,0|2,0,0]=4 7790 B13R1.1822 O=C(CF)c1c(ccc(c1F)F)F 1458a_100000031524_100015361967 [0,2,0,0,0,0|2,0,0]=4 7791 B13R1.1822 O=C(CF)c1c(ccc(c1F)F)I 1458a_100010177766_100015361967 [0,2,0,0,0,0|2,0,0]=4 7792 B13R1.1822 O=C(CF)c1c(ccc(c1F)F)O 1458a_100000062415_100015361967 [0,2,0,0,0,0|1,0,0]=3 7793 B13R1.1822 O=C(CF)c1c(ccc(c1F)I)Br 1458a_100010782274_100015361967 [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.1822 O=C(CF)c1c(ccc(c1F)I)Cl 1458a_100021583479_100015361967 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.1822 O=C(CF)c1c(ccc(c1F)I)F 1458a_100012359589_100015361967 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.1822 O=C(CF)c1c(ccc(c1F)O)F 1458a_100000068660_100015361967 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.1822 O=C(CF)c1c(ccc(c1O)Br)O 1458a_100010008628_100015361967 [0,2,0,0,0,0|1,0,0]=3 7798 B13R1.1822 O=C(CF)c1c(ccc(c1O)Cl)Cl 1458a_100011255222_100015361967 [0,2,0,0,0,0|2,0,0]=4 7799 B13R1.1822 O=C(CF)c1c(ccc(c1O)Cl)O 1458a_100000080727_100015361967 [0,2,0,0,0,0|1,0,0]=3 7800 B13R1.1822 O=C(CF)c1c(ccc(c1O)F)F 1458a_100011830443_100015361967 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.2431 C=Cc1cc(c(cn1)O)C(=O)OC 271570a_100011290941_100010136202 [0,2,0,0,0,0|1,0,1]=4 7802 B13R1.2431 C=Cc1ccc(c(c1)C(=O)CC)O 271570a_100011290941_100000183607 [0,2,0,0,0,0|0,0,1]=3 7803 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NC)F 271570a_100011290941_100000155058 [0,2,0,0,0,0|1,0,1]=4 7804 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NC)N 271570a_100011290941_100000690504 [0,2,0,0,0,0|1,0,1]=4 7805 B13R1.2431 C=Cc1ccc(c(c1)C(=O)NN)O 271570a_100011290941_100000193350 [0,2,0,0,0,0|1,0,1]=4 7806 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)Br 271570a_100011290941_100012340073 [0,2,0,0,0,0|1,0,1]=4 7807 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)C 271570a_100011290941_100012360116 [0,2,0,0,0,0|1,0,1]=4 7808 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)Cl 271570a_100011290941_100012353682 [0,2,0,0,0,0|1,0,1]=4 7809 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)F 271570a_100011290941_100000154357 [0,2,0,0,0,0|1,0,1]=4 7810 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)N 271570a_100011290941_100000212070 [0,2,0,0,0,0|1,0,1]=4 7811 B13R1.2431 C=Cc1ccc(c(c1)C(=O)OC)O 271570a_100011290941_100000149868 [0,2,0,0,0,0|0,0,1]=3 7812 B13R1.2431 C=Cc1ccc(c(n1)C(=O)OC)O 271570a_100011290941_100000697862 [0,2,0,0,0,0|1,0,1]=4 7813 B13R1.2431 CCC(=O)c1cc(ccc1Br)C#N 1458a_100012361338_100000210202 [0,2,0,0,0,0|1,0,1]=4 7814 B13R1.2431 CCC(=O)c1cc(ccc1Br)CO 1458a_100010259715_100000210202 [0,2,0,0,0,0|1,0,0]=3 7815 B13R1.2431 CCC(=O)c1cc(ccc1Br)OC 1458a_100000211723_100000210202 [0,2,0,0,0,0|1,0,0]=3 7816 B13R1.2431 CCC(=O)c1cc(ccc1C)C#N 1458a_200012187059_100000210202 [0,2,0,0,0,0|1,0,1]=4 7817 B13R1.2431 CCC(=O)c1cc(ccc1C)OC 1458a_100011399813_100000210202 [0,2,0,0,0,0|1,0,0]=3 7818 B13R1.2431 CCC(=O)c1cc(ccc1Cl)C#N 1458a_100000729836_100000210202 [0,2,0,0,0,0|1,0,1]=4 7819 B13R1.2431 CCC(=O)c1cc(ccc1Cl)OC 1458a_100000763818_100000210202 [0,2,0,0,0,0|1,0,0]=3 7820 B13R1.2431 CCC(=O)c1cc(ccc1Cl)SC 1458a_100000212015_100000210202 [0,2,0,0,0,0|1,0,0]=3 7821 B13R1.2431 CCC(=O)c1cc(ccc1F)C#N 1458a_100011218479_100000210202 [0,2,0,0,0,0|1,0,1]=4 7822 B13R1.2431 CCC(=O)c1cc(ccc1F)OC 1458a_100011217016_100000210202 [0,2,0,0,0,0|1,0,0]=3 7823 B13R1.2431 CCC(=O)c1cc(ccc1F)SC 1458a_200012183283_100000210202 [0,2,0,0,0,0|1,0,0]=3 7824 B13R1.2431 CCC(=O)c1cc(ccc1I)C#N 1458a_200010191847_100000210202 [0,2,0,0,0,0|1,0,1]=4 7825 B13R1.2431 CCC(=O)c1cc(ccc1I)OC 1458a_100012339533_100000210202 [0,2,0,0,0,0|1,0,0]=3 7826 B13R1.2431 CCC(=O)c1cc(ccc1O)C#N 1458a_100000719980_100000210202 [0,2,0,0,0,0|0,0,1]=3 7827 B13R1.2431 CCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000210202 [0,2,0,0,0,0|0,0,0]=2 7828 B13R1.2431 CCC(=O)c1cc(ccc1O)CO 1458a_200000045694_100000210202 [0,2,0,0,0,0|0,0,0]=2 7829 B13R1.2431 CCC(=O)c1cc(ccc1O)OC 1458a_100000211986_100000210202 [0,2,0,0,0,0|0,0,0]=2 7830 B13R1.2431 CCc1ccc(c(c1)C(=O)CF)O 1458a_200000748397_100015361967 [0,2,0,0,0,0|0,0,0]=2 7831 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200000748397 [0,2,0,0,0,0|0,0,0]=2 7832 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200000748397 [0,2,0,0,0,0|0,0,0]=2 7833 B13R1.2431 CCc1ccc(c(c1)C(C)NC)O 269862a_106832991636_100000230022 [0,2,0,0,0,0|1,0,1]=4 7834 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 11a_106832991635_100012361338 [0,2,0,0,0,0|1,0,1]=4 7835 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 1626a_100102657272_100012361338 [0,2,0,0,0,0|1,0,1]=4 7836 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 240690a_100102657272_100012361338 [0,2,0,0,0,0|1,0,1]=4 7837 B13R1.2431 CNC(=O)c1cc(ccc1Br)C#N 527a_100102657272_100012361338 [0,2,0,0,0,0|1,0,1]=4 7838 B13R1.2431 CNC(=O)c1cc(ccc1Br)CO 240690a_100102657272_100010259715 [0,2,0,0,0,0|1,0,0]=3 7839 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 11a_106832991635_100000211723 [0,2,0,0,0,0|1,0,0]=3 7840 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 1626a_100102657272_100000211723 [0,2,0,0,0,0|1,0,0]=3 7841 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 240690a_100102657272_100000211723 [0,2,0,0,0,0|1,0,0]=3 7842 B13R1.2431 CNC(=O)c1cc(ccc1Br)OC 527a_100102657272_100000211723 [0,2,0,0,0,0|1,0,0]=3 7843 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 11a_106832991635_200012187059 [0,2,0,0,0,0|1,0,1]=4 7844 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 1626a_100102657272_200012187059 [0,2,0,0,0,0|1,0,1]=4 7845 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 240690a_100102657272_200012187059 [0,2,0,0,0,0|1,0,1]=4 7846 B13R1.2431 CNC(=O)c1cc(ccc1C)C#N 527a_100102657272_200012187059 [0,2,0,0,0,0|1,0,1]=4 7847 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 11a_106832991635_100011399813 [0,2,0,0,0,0|1,0,0]=3 7848 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 1626a_100102657272_100011399813 [0,2,0,0,0,0|1,0,0]=3 7849 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 240690a_100102657272_100011399813 [0,2,0,0,0,0|1,0,0]=3 7850 B13R1.2431 CNC(=O)c1cc(ccc1C)OC 527a_100102657272_100011399813 [0,2,0,0,0,0|1,0,0]=3 7851 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 11a_106832991635_100000729836 [0,2,0,0,0,0|1,0,1]=4 7852 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 1626a_100102657272_100000729836 [0,2,0,0,0,0|1,0,1]=4 7853 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 240690a_100102657272_100000729836 [0,2,0,0,0,0|1,0,1]=4 7854 B13R1.2431 CNC(=O)c1cc(ccc1Cl)C#N 527a_100102657272_100000729836 [0,2,0,0,0,0|1,0,1]=4 7855 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 2230a_100000742274_200000210301 [0,2,0,0,0,0|1,0,0]=3 7856 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 34a_100000742274_200000210301 [0,2,0,0,0,0|1,0,0]=3 7857 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 2230a_100000742274_200025704644 [0,2,0,0,0,0|1,0,0]=3 7858 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 34a_100000742274_200025704644 [0,2,0,0,0,0|1,0,0]=3 7859 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 11a_106832991635_100000763818 [0,2,0,0,0,0|1,0,0]=3 7860 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 1626a_100102657272_100000763818 [0,2,0,0,0,0|1,0,0]=3 7861 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 240690a_100102657272_100000763818 [0,2,0,0,0,0|1,0,0]=3 7862 B13R1.2431 CNC(=O)c1cc(ccc1Cl)OC 527a_100102657272_100000763818 [0,2,0,0,0,0|1,0,0]=3 7863 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 11a_106832991635_100000212015 [0,2,0,0,0,0|1,0,0]=3 7864 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 1626a_100102657272_100000212015 [0,2,0,0,0,0|1,0,0]=3 7865 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 240690a_100102657272_100000212015 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.2431 CNC(=O)c1cc(ccc1Cl)SC 527a_100102657272_100000212015 [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 11a_106832991635_100011218479 [0,2,0,0,0,0|1,0,1]=4 7868 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 1626a_100102657272_100011218479 [0,2,0,0,0,0|1,0,1]=4 7869 B13R1.2431 CNC(=O)c1cc(ccc1F)C#N 240690a_100102657272_100011218479 [0,2,0,0,0,0|1,0,1]=4 7870 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 2230a_100000747870_200000210301 [0,2,0,0,0,0|1,0,0]=3 7871 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 34a_100000747870_200000210301 [0,2,0,0,0,0|1,0,0]=3 7872 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 7a_100000747870_200000210301 [0,2,0,0,0,0|1,0,0]=3 7873 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 2230a_100000747870_200025704644 [0,2,0,0,0,0|1,0,0]=3 7874 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 34a_100000747870_200025704644 [0,2,0,0,0,0|1,0,0]=3 7875 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 7a_100000747870_200025704644 [0,2,0,0,0,0|1,0,0]=3 7876 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 11a_106832991635_100011217016 [0,2,0,0,0,0|1,0,0]=3 7877 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 1626a_100102657272_100011217016 [0,2,0,0,0,0|1,0,0]=3 7878 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 240690a_100102657272_100011217016 [0,2,0,0,0,0|1,0,0]=3 7879 B13R1.2431 CNC(=O)c1cc(ccc1F)OC 527a_100102657272_100011217016 [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 11a_106832991635_200012183283 [0,2,0,0,0,0|1,0,0]=3 7881 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 1626a_100102657272_200012183283 [0,2,0,0,0,0|1,0,0]=3 7882 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 240690a_100102657272_200012183283 [0,2,0,0,0,0|1,0,0]=3 7883 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 527a_100102657272_200012183283 [0,2,0,0,0,0|1,0,0]=3 7884 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 62a_100000155058_200000210301 [0,2,0,0,0,0|1,0,0]=3 7885 B13R1.2431 CNC(=O)c1cc(ccc1F)SC 62a_200000210301_100000155058 [0,2,0,0,0,0|1,0,0]=3 7886 B13R1.2431 CNC(=O)c1cc(ccc1F)S[13CH3] 62a_100000155058_200025704644 [0,2,0,0,0,0|1,0,0]=3 7887 B13R1.2431 CNC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000155058 [0,2,0,0,0,0|1,0,0]=3 7888 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 11a_106832991635_200010191847 [0,2,0,0,0,0|1,0,1]=4 7889 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 1626a_100102657272_200010191847 [0,2,0,0,0,0|1,0,1]=4 7890 B13R1.2431 CNC(=O)c1cc(ccc1I)C#N 240690a_100102657272_200010191847 [0,2,0,0,0,0|1,0,1]=4 7891 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 11a_106832991635_100012339533 [0,2,0,0,0,0|1,0,0]=3 7892 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 1626a_100102657272_100012339533 [0,2,0,0,0,0|1,0,0]=3 7893 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 240690a_100102657272_100012339533 [0,2,0,0,0,0|1,0,0]=3 7894 B13R1.2431 CNC(=O)c1cc(ccc1I)OC 527a_100102657272_100012339533 [0,2,0,0,0,0|1,0,0]=3 7895 B13R1.2431 CNC(=O)c1cc(ccc1N)SC 62a_100000690504_200000210301 [0,2,0,0,0,0|1,0,0]=3 7896 B13R1.2431 CNC(=O)c1cc(ccc1N)S[13CH3] 62a_100000690504_200025704644 [0,2,0,0,0,0|1,0,0]=3 7897 B13R1.2431 CNC(=O)c1cc(ccc1O)C#N 240690a_100102657272_100000719980 [0,2,0,0,0,0|0,0,1]=3 7898 B13R1.2431 CNC(=O)c1cc(ccc1O)CO 240690a_100102657272_200000045694 [0,2,0,0,0,0|0,0,0]=2 7899 B13R1.2431 CNC(=O)c1cc(ccc1O)OC 240690a_100102657272_100000211986 [0,2,0,0,0,0|0,0,0]=2 7900 B13R1.2431 CNC(=O)c1cc(ccc1O)OC 527a_100102657272_100000211986 [0,2,0,0,0,0|0,0,0]=2 7901 B13R1.2431 CNC(C)c1cc(ccc1O)OC 269862a_106832991636_100000211518 [0,2,0,0,0,0|1,0,1]=4 7902 B13R1.2431 COC(=O)c1cc(c[nH]c1=O)SC 62a_100009816710_200000210301 [0,2,0,0,0,0|1,0,1]=4 7903 B13R1.2431 COC(=O)c1cc(c[nH]c1=O)SC 62a_200000210301_100009816710 [0,2,0,0,0,0|1,0,1]=4 7904 B13R1.2431 COC(=O)c1cc(c[nH]c1=O)S[13CH3] 62a_100009816710_200025704644 [0,2,0,0,0,0|1,0,1]=4 7905 B13R1.2431 COC(=O)c1cc(c[nH]c1=O)S[13CH3] 62a_200025704644_100009816710 [0,2,0,0,0,0|1,0,1]=4 7906 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 34a_100010230369_200000210301 [0,2,0,0,0,0|1,0,0]=3 7907 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 7a_100010230369_200000210301 [0,2,0,0,0,0|1,0,0]=3 7908 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 34a_100010230369_200025704644 [0,2,0,0,0,0|1,0,0]=3 7909 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 7a_100010230369_200025704644 [0,2,0,0,0,0|1,0,0]=3 7910 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_100012340073_200000210301 [0,2,0,0,0,0|1,0,0]=3 7911 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_200000210301_100012340073 [0,2,0,0,0,0|1,0,0]=3 7912 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_100012340073_200025704644 [0,2,0,0,0,0|1,0,0]=3 7913 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_100012340073 [0,2,0,0,0,0|1,0,0]=3 7914 B13R1.2431 COC(=O)c1cc(ccc1C)OC 34a_100012002527_200000210301 [0,2,0,0,0,0|1,0,0]=3 7915 B13R1.2431 COC(=O)c1cc(ccc1C)OC 7a_100012002527_200000210301 [0,2,0,0,0,0|1,0,0]=3 7916 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 34a_100012002527_200025704644 [0,2,0,0,0,0|1,0,0]=3 7917 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 7a_100012002527_200025704644 [0,2,0,0,0,0|1,0,0]=3 7918 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_100012360116_200000210301 [0,2,0,0,0,0|1,0,0]=3 7919 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_200000210301_100012360116 [0,2,0,0,0,0|1,0,0]=3 7920 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_100012360116_200025704644 [0,2,0,0,0,0|1,0,0]=3 7921 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_200025704644_100012360116 [0,2,0,0,0,0|1,0,0]=3 7922 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 34a_100012001761_200000210301 [0,2,0,0,0,0|1,0,0]=3 7923 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 7a_100012001761_200000210301 [0,2,0,0,0,0|1,0,0]=3 7924 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100012001761_200025704644 [0,2,0,0,0,0|1,0,0]=3 7925 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100012001761_200025704644 [0,2,0,0,0,0|1,0,0]=3 7926 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_100012353682_200000210301 [0,2,0,0,0,0|1,0,0]=3 7927 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_200000210301_100012353682 [0,2,0,0,0,0|1,0,0]=3 7928 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100012353682_200025704644 [0,2,0,0,0,0|1,0,0]=3 7929 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_200025704644_100012353682 [0,2,0,0,0,0|1,0,0]=3 7930 B13R1.2431 COC(=O)c1cc(ccc1F)OC 34a_100009856154_200000210301 [0,2,0,0,0,0|1,0,0]=3 7931 B13R1.2431 COC(=O)c1cc(ccc1F)OC 7a_100009856154_200000210301 [0,2,0,0,0,0|1,0,0]=3 7932 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 34a_100009856154_200025704644 [0,2,0,0,0,0|1,0,0]=3 7933 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 7a_100009856154_200025704644 [0,2,0,0,0,0|1,0,0]=3 7934 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_100000216675_200000210301 [0,2,0,0,0,0|1,0,0]=3 7935 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_200000210301_100000216675 [0,2,0,0,0,0|1,0,0]=3 7936 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_100000216675_200025704644 [0,2,0,0,0,0|1,0,0]=3 7937 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000216675 [0,2,0,0,0,0|1,0,0]=3 7938 B13R1.2431 COC(=O)c1cc(ccc1I)OC 34a_200009888904_200000210301 [0,2,0,0,0,0|1,0,0]=3 7939 B13R1.2431 COC(=O)c1cc(ccc1I)OC 7a_200009888904_200000210301 [0,2,0,0,0,0|1,0,0]=3 7940 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 34a_200009888904_200025704644 [0,2,0,0,0,0|1,0,0]=3 7941 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 7a_200009888904_200025704644 [0,2,0,0,0,0|1,0,0]=3 7942 B13R1.2431 COC(=O)c1cc(ccc1N)OC 34a_100000694981_200000210301 [0,2,0,0,0,0|1,0,0]=3 7943 B13R1.2431 COC(=O)c1cc(ccc1N)OC 7a_100000694981_200000210301 [0,2,0,0,0,0|1,0,0]=3 7944 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 34a_100000694981_200025704644 [0,2,0,0,0,0|1,0,0]=3 7945 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 7a_100000694981_200025704644 [0,2,0,0,0,0|1,0,0]=3 7946 B13R1.2431 COC(=O)c1cc(ccc1N)SC 62a_100000212070_200000210301 [0,2,0,0,0,0|1,0,0]=3 7947 B13R1.2431 COC(=O)c1cc(ccc1N)S[13CH3] 62a_100000212070_200025704644 [0,2,0,0,0,0|1,0,0]=3 7948 B13R1.2431 COC(=O)c1cc(ccc1O)C#N 271570a_203496583355_100009817095 [0,2,0,0,0,0|0,0,1]=3 7949 B13R1.2431 COC(=O)c1cc(ccc1O)C=O 271570a_203496583355_100013328361 [0,2,0,0,0,0|0,0,1]=3 7950 B13R1.2431 COC(=O)c1cc(ccc1O)CN 271570a_203496583355_100016988414 [0,2,0,0,0,0|0,0,0]=2 7951 B13R1.2431 COC(=O)c1cc(ccc1O)OC 271570a_203496583355_100000151459 [0,2,0,0,0,0|0,0,0]=2 7952 B13R1.2431 COC(=O)c1cc(ccc1O)SC 62a_200000210301_100000149868 [0,2,0,0,0,0|0,0,0]=2 7953 B13R1.2431 COC(=O)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000149868 [0,2,0,0,0,0|0,0,0]=2 7954 B13R1.2431 COC(=O)c1cc(cnc1C)SC 62a_100010180201_200000210301 [0,2,0,0,0,0|2,0,0]=4 7955 B13R1.2431 COC(=O)c1cc(cnc1C)SC 62a_200000210301_100010180201 [0,2,0,0,0,0|2,0,0]=4 7956 B13R1.2431 COC(=O)c1cc(cnc1C)S[13CH3] 62a_100010180201_200025704644 [0,2,0,0,0,0|2,0,0]=4 7957 B13R1.2431 COC(=O)c1cc(cnc1C)S[13CH3] 62a_200025704644_100010180201 [0,2,0,0,0,0|2,0,0]=4 7958 B13R1.2431 COC(=O)c1cc(cnc1Cl)SC 62a_200000210301_100010171060 [0,2,0,0,0,0|2,0,0]=4 7959 B13R1.2431 COC(=O)c1cc(cnc1Cl)S[13CH3] 62a_200025704644_100010171060 [0,2,0,0,0,0|2,0,0]=4 7960 B13R1.2431 COC(=O)c1cc(cnc1F)SC 62a_100010243567_200000210301 [0,2,0,0,0,0|2,0,0]=4 7961 B13R1.2431 COC(=O)c1cc(cnc1F)SC 62a_200000210301_100010243567 [0,2,0,0,0,0|2,0,0]=4 7962 B13R1.2431 COC(=O)c1cc(cnc1F)S[13CH3] 62a_100010243567_200025704644 [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.2431 COC(=O)c1cc(cnc1F)S[13CH3] 62a_200025704644_100010243567 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.2431 COC(=O)c1cc(cnc1N)SC 62a_100009816750_200000210301 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.2431 COC(=O)c1cc(cnc1N)SC 62a_200000210301_100009816750 [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.2431 COC(=O)c1cc(cnc1N)S[13CH3] 62a_100009816750_200025704644 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.2431 COC(=O)c1cc(cnc1N)S[13CH3] 62a_200025704644_100009816750 [0,2,0,0,0,0|2,0,0]=4 7968 B13R1.2431 COC(=O)c1cc(ncc1C)SC 62a_100009858526_200000210301 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.2431 COC(=O)c1cc(ncc1C)SC 62a_200000210301_100009858526 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.2431 COC(=O)c1cc(ncc1C)S[13CH3] 62a_100009858526_200025704644 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.2431 COC(=O)c1cc(ncc1C)S[13CH3] 62a_200025704644_100009858526 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.2431 COC(=O)c1cc(ncc1F)SC 62a_100010218257_200000210301 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.2431 COC(=O)c1cc(ncc1F)SC 62a_200000210301_100010218257 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.2431 COC(=O)c1cc(ncc1F)S[13CH3] 62a_100010218257_200025704644 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.2431 COC(=O)c1cc(ncc1F)S[13CH3] 62a_200025704644_100010218257 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.2431 COC(=O)c1cc(ncc1N)SC 62a_100012180746_200000210301 [0,2,0,0,0,0|2,0,0]=4 7977 B13R1.2431 COC(=O)c1cc(ncc1N)SC 62a_200000210301_100012180746 [0,2,0,0,0,0|2,0,0]=4 7978 B13R1.2431 COC(=O)c1cc(ncc1N)S[13CH3] 62a_100012180746_200025704644 [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.2431 COC(=O)c1cc(ncc1N)S[13CH3] 62a_200025704644_100012180746 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.2431 COC(=O)c1cc(ncc1O)OC 271570a_203496583355_100010178712 [0,2,0,0,0,0|1,0,0]=3 7981 B13R1.2431 COC(=O)c1cc(ncc1O)SC 62a_100010136202_200000210301 [0,2,0,0,0,0|1,0,0]=3 7982 B13R1.2431 COC(=O)c1cc(ncc1O)SC 62a_200000210301_100010136202 [0,2,0,0,0,0|1,0,0]=3 7983 B13R1.2431 COC(=O)c1cc(ncc1O)S[13CH3] 62a_100010136202_200025704644 [0,2,0,0,0,0|1,0,0]=3 7984 B13R1.2431 COC(=O)c1cc(ncc1O)S[13CH3] 62a_200025704644_100010136202 [0,2,0,0,0,0|1,0,0]=3 7985 B13R1.2431 COC(=O)c1nc(ccc1C)SC 62a_100000117997_200000210301 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.2431 COC(=O)c1nc(ccc1C)SC 62a_200000210301_100000117997 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.2431 COC(=O)c1nc(ccc1C)S[13CH3] 62a_100000117997_200025704644 [0,2,0,0,0,0|2,0,0]=4 7988 B13R1.2431 COC(=O)c1nc(ccc1C)S[13CH3] 62a_200025704644_100000117997 [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.2431 COC(=O)c1nc(ccc1F)SC 62a_100000697719_200000210301 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.2431 COC(=O)c1nc(ccc1F)SC 62a_200000210301_100000697719 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.2431 COC(=O)c1nc(ccc1F)S[13CH3] 62a_100000697719_200025704644 [0,2,0,0,0,0|2,0,0]=4 7992 B13R1.2431 COC(=O)c1nc(ccc1F)S[13CH3] 62a_200025704644_100000697719 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.2431 COC(=O)c1nc(ccc1N)SC 62a_100009860768_200000210301 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.2431 COC(=O)c1nc(ccc1N)S[13CH3] 62a_100009860768_200025704644 [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.2431 COC(=O)c1nc(ccc1O)OC 271570a_203496583355_100010189643 [0,2,0,0,0,0|1,0,0]=3 7996 B13R1.2431 COC(=O)c1nc(ccc1O)SC 62a_200000210301_100000697862 [0,2,0,0,0,0|1,0,0]=3 7997 B13R1.2431 COC(=O)c1nc(ccc1O)S[13CH3] 62a_200025704644_100000697862 [0,2,0,0,0,0|1,0,0]=3 7998 B13R1.2431 COC(=O)c1nc(ncc1O)SC 271570a_203496583355_100010162528 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.2431 COc1ccc(c(c1)C(=O)CF)Br 1458a_100000211723_100015361967 [0,2,0,0,0,0|1,0,0]=3 8000 B13R1.2431 COc1ccc(c(c1)C(=O)CF)C 1458a_100011399813_100015361967 [0,2,0,0,0,0|1,0,0]=3 8001 B13R1.2431 COc1ccc(c(c1)C(=O)CF)Cl 1458a_100000763818_100015361967 [0,2,0,0,0,0|1,0,0]=3 8002 B13R1.2431 COc1ccc(c(c1)C(=O)CF)F 1458a_100011217016_100015361967 [0,2,0,0,0,0|1,0,0]=3 8003 B13R1.2431 COc1ccc(c(c1)C(=O)CF)I 1458a_100012339533_100015361967 [0,2,0,0,0,0|1,0,0]=3 8004 B13R1.2431 COc1ccc(c(c1)C(=O)CF)O 1458a_100000211986_100015361967 [0,2,0,0,0,0|0,0,0]=2 8005 B13R1.2431 COc1ccc(c(c1)C(=O)NN)O 271570a_203496583355_100000189949 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.2431 CSc1ccc(c(c1)C(=O)CF)Cl 1458a_100000212015_100015361967 [0,2,0,0,0,0|1,0,0]=3 8007 B13R1.2431 CSc1ccc(c(c1)C(=O)CF)F 1458a_200012183283_100015361967 [0,2,0,0,0,0|1,0,0]=3 8008 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Br 62a_200000210301_200011356971 [0,2,0,0,0,0|2,0,0]=4 8009 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Br 62a_200011356971_200000210301 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Cl 62a_200000049959_200000210301 [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)Cl 62a_200000210301_200000049959 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.2431 CSc1ccc(c(c1)C(=O)NN)O 62a_200000210301_100000193350 [0,2,0,0,0,0|1,0,0]=3 8013 B13R1.2431 Cc1ccc(cc1C(=O)CF)C#N 1458a_200012187059_100015361967 [0,2,0,0,0,0|1,0,1]=4 8014 B13R1.2431 N#Cc1ccc(c(c1)C(=O)CF)Br 1458a_100012361338_100015361967 [0,2,0,0,0,0|1,0,1]=4 8015 B13R1.2431 N#Cc1ccc(c(c1)C(=O)CF)Cl 1458a_100000729836_100015361967 [0,2,0,0,0,0|1,0,1]=4 8016 B13R1.2431 N#Cc1ccc(c(c1)C(=O)CF)F 1458a_100011218479_100015361967 [0,2,0,0,0,0|1,0,1]=4 8017 B13R1.2431 N#Cc1ccc(c(c1)C(=O)CF)I 1458a_200010191847_100015361967 [0,2,0,0,0,0|1,0,1]=4 8018 B13R1.2431 N#Cc1ccc(c(c1)C(=O)CF)O 1458a_100000719980_100015361967 [0,2,0,0,0,0|0,0,1]=3 8019 B13R1.2431 O=C(CF)c1cc(ccc1Br)CO 1458a_100010259715_100015361967 [0,2,0,0,0,0|1,0,0]=3 8020 B13R1.2431 O=C(CF)c1cc(ccc1O)CO 1458a_200000045694_100015361967 [0,2,0,0,0,0|0,0,0]=2 8021 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Br 62a_200011356971_200025704644 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Br 62a_200025704644_200011356971 [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Cl 62a_200000049959_200025704644 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)Cl 62a_200025704644_200000049959 [0,2,0,0,0,0|2,0,0]=4 8025 B13R1.2431 [13CH3]Sc1ccc(c(c1)C(=O)NN)O 62a_200025704644_100000193350 [0,2,0,0,0,0|1,0,0]=3 8026 B13R1.4789 CCC(=O)c1cc(cc(c1Br)Br)C 1458a_200012920551_100000210202 [0,2,0,0,0,0|1,0,0]=3 8027 B13R1.4789 CCC(=O)c1cc(cc(c1Br)C)C 1458a_200000701928_100000210202 [0,2,0,0,0,0|1,0,0]=3 8028 B13R1.4789 CCC(=O)c1cc(cc(c1Br)F)F 1458a_100010209673_100000210202 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.4789 CCC(=O)c1cc(cc(c1C)Br)Br 1458a_100012356187_100000210202 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.4789 CCC(=O)c1cc(cc(c1C)Br)F 1458a_100012347597_100000210202 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.4789 CCC(=O)c1cc(cc(c1C)C)Br 1458a_100012920495_100000210202 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.4789 CCC(=O)c1cc(cc(c1C)Cl)Br 1458a_100012921640_100000210202 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.4789 CCC(=O)c1cc(cc(c1C)Cl)F 1458a_100012177191_100000210202 [0,2,0,0,0,0|2,0,0]=4 8034 B13R1.4789 CCC(=O)c1cc(cc(c1C)F)Br 1458a_100010768523_100000210202 [0,2,0,0,0,0|2,0,0]=4 8035 B13R1.4789 CCC(=O)c1cc(cc(c1C)O)Br 1458a_100011101721_100000210202 [0,2,0,0,0,0|2,0,0]=4 8036 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_100000210202 [0,2,0,0,0,0|2,0,0]=4 8037 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Br)F 1458a_100011105905_100000210202 [0,2,0,0,0,0|2,0,0]=4 8038 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)C)F 1458a_200010768536_100000210202 [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_100000210202 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_100000210202 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_100000210202 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.4789 CCC(=O)c1cc(cc(c1Cl)F)F 1458a_100009888511_100000210202 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)C 1458a_100009996753_100000210202 [0,2,0,0,0,0|1,0,0]=3 8044 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)Cl 1458a_100000720295_100000210202 [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.4789 CCC(=O)c1cc(cc(c1F)Br)F 1458a_100012920464_100000210202 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.4789 CCC(=O)c1cc(cc(c1F)C)Br 1458a_100012928937_100000210202 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.4789 CCC(=O)c1cc(cc(c1F)Cl)Br 1458a_100012920557_100000210202 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.4789 CCC(=O)c1cc(cc(c1F)Cl)I 1458a_100012920558_100000210202 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)Br 1458a_100012349847_100000210202 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)C 1458a_100000094381_100000210202 [0,2,0,0,0,0|1,0,0]=3 8051 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)F 1458a_100011217470_100000210202 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.4789 CCC(=O)c1cc(cc(c1F)F)I 1458a_100012344719_100000210202 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.4789 CCC(=O)c1cc(cc(c1I)I)I 1458a_100000211575_100000210202 [0,2,0,0,0,0|2,0,0]=4 8054 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Br 1458a_100000212120_100000210202 [0,2,0,0,0,0|1,0,0]=3 8055 B13R1.4789 CCC(=O)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100000210202 [0,2,0,0,0,0|1,0,0]=3 8056 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Br 1458a_100011825902_100000210202 [0,2,0,0,0,0|1,0,0]=3 8057 B13R1.4789 CCC(=O)c1cc(cc(c1O)C)Cl 1458a_100011255218_100000210202 [0,2,0,0,0,0|1,0,0]=3 8058 B13R1.4789 CCC(=O)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100000210202 [0,2,0,0,0,0|1,0,0]=3 8059 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)Br 1458a_100011255233_100000210202 [0,2,0,0,0,0|1,0,0]=3 8060 B13R1.4789 CCC(=O)c1cc(cc(c1O)F)F 1458a_100011255242_100000210202 [0,2,0,0,0,0|1,0,0]=3 8061 B13R1.4789 CCC(=O)c1cc(cc(c1O)I)I 1458a_100000748652_100000210202 [0,2,0,0,0,0|1,0,0]=3 8062 B13R1.4789 CCC(=O)c1cc(cc(c1O)O)Br 1458a_200010196872_100000210202 [0,2,0,0,0,0|1,0,0]=3 8063 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 11a_106832991635_200012920551 [0,2,0,0,0,0|1,0,0]=3 8064 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 1626a_100102657272_200012920551 [0,2,0,0,0,0|1,0,0]=3 8065 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 240690a_100102657272_200012920551 [0,2,0,0,0,0|1,0,0]=3 8066 B13R1.4789 CNC(=O)c1cc(cc(c1Br)Br)C 527a_100102657272_200012920551 [0,2,0,0,0,0|1,0,0]=3 8067 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 11a_106832991635_200000701928 [0,2,0,0,0,0|1,0,0]=3 8068 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 1626a_100102657272_200000701928 [0,2,0,0,0,0|1,0,0]=3 8069 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 240690a_100102657272_200000701928 [0,2,0,0,0,0|1,0,0]=3 8070 B13R1.4789 CNC(=O)c1cc(cc(c1Br)C)C 527a_100102657272_200000701928 [0,2,0,0,0,0|1,0,0]=3 8071 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 11a_106832991635_100010209673 [0,2,0,0,0,0|2,0,0]=4 8072 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 1626a_100102657272_100010209673 [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 240690a_100102657272_100010209673 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.4789 CNC(=O)c1cc(cc(c1Br)F)F 527a_100102657272_100010209673 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 11a_106832991635_100012356187 [0,2,0,0,0,0|2,0,0]=4 8076 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 240690a_100102657272_100012356187 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)Br 527a_100102657272_100012356187 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 11a_106832991635_100012347597 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 1626a_100102657272_100012347597 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 240690a_100102657272_100012347597 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.4789 CNC(=O)c1cc(cc(c1C)Br)F 527a_100102657272_100012347597 [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 11a_106832991635_100012920495 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 1626a_100102657272_100012920495 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 240690a_100102657272_100012920495 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.4789 CNC(=O)c1cc(cc(c1C)C)Br 527a_100102657272_100012920495 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 11a_106832991635_100012921640 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 1626a_100102657272_100012921640 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 240690a_100102657272_100012921640 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)Br 527a_100102657272_100012921640 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 11a_106832991635_100012177191 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 1626a_100102657272_100012177191 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 240690a_100102657272_100012177191 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.4789 CNC(=O)c1cc(cc(c1C)Cl)F 527a_100102657272_100012177191 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 11a_106832991635_100010768523 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 1626a_100102657272_100010768523 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 240690a_100102657272_100010768523 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.4789 CNC(=O)c1cc(cc(c1C)F)Br 527a_100102657272_100010768523 [0,2,0,0,0,0|2,0,0]=4 8098 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 240690a_100102657272_100011101721 [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.4789 CNC(=O)c1cc(cc(c1C)O)Br 527a_100102657272_100011101721 [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 11a_106832991635_200012920481 [0,2,0,0,0,0|2,0,0]=4 8101 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 1626a_100102657272_200012920481 [0,2,0,0,0,0|2,0,0]=4 8102 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 240690a_100102657272_200012920481 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)Cl 527a_100102657272_200012920481 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 11a_106832991635_100011105905 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 1626a_100102657272_100011105905 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 240690a_100102657272_100011105905 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Br)F 527a_100102657272_100011105905 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 11a_106832991635_200010768536 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 1626a_100102657272_200010768536 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 240690a_100102657272_200010768536 [0,2,0,0,0,0|2,0,0]=4 8111 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)C)F 527a_100102657272_200010768536 [0,2,0,0,0,0|2,0,0]=4 8112 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 11a_106832991635_100011215521 [0,2,0,0,0,0|2,0,0]=4 8113 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 1626a_100102657272_100011215521 [0,2,0,0,0,0|2,0,0]=4 8114 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 240690a_100102657272_100011215521 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)Cl 527a_100102657272_100011215521 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 11a_106832991635_200010244589 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 1626a_100102657272_200010244589 [0,2,0,0,0,0|2,0,0]=4 8118 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 240690a_100102657272_200010244589 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)Cl)F 527a_100102657272_200010244589 [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 11a_106832991635_200012352169 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 1626a_100102657272_200012352169 [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 240690a_100102657272_200012352169 [0,2,0,0,0,0|2,0,0]=4 8123 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)Cl 527a_100102657272_200012352169 [0,2,0,0,0,0|2,0,0]=4 8124 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 11a_106832991635_100009888511 [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 1626a_100102657272_100009888511 [0,2,0,0,0,0|2,0,0]=4 8126 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 240690a_100102657272_100009888511 [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.4789 CNC(=O)c1cc(cc(c1Cl)F)F 527a_100102657272_100009888511 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 11a_106832991635_100009996753 [0,2,0,0,0,0|1,0,0]=3 8129 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 1626a_100102657272_100009996753 [0,2,0,0,0,0|1,0,0]=3 8130 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 240690a_100102657272_100009996753 [0,2,0,0,0,0|1,0,0]=3 8131 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)C 527a_100102657272_100009996753 [0,2,0,0,0,0|1,0,0]=3 8132 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 11a_106832991635_100000720295 [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 1626a_100102657272_100000720295 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 240690a_100102657272_100000720295 [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)Cl 527a_100102657272_100000720295 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 11a_106832991635_100012920464 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 1626a_100102657272_100012920464 [0,2,0,0,0,0|2,0,0]=4 8138 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 240690a_100102657272_100012920464 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.4789 CNC(=O)c1cc(cc(c1F)Br)F 527a_100102657272_100012920464 [0,2,0,0,0,0|2,0,0]=4 8140 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 11a_106832991635_100012928937 [0,2,0,0,0,0|2,0,0]=4 8141 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 1626a_100102657272_100012928937 [0,2,0,0,0,0|2,0,0]=4 8142 B13R1.4789 CNC(=O)c1cc(cc(c1F)C)Br 240690a_100102657272_100012928937 [0,2,0,0,0,0|2,0,0]=4 8143 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 11a_106832991635_100012920557 [0,2,0,0,0,0|2,0,0]=4 8144 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 1626a_100102657272_100012920557 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)Br 240690a_100102657272_100012920557 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 11a_106832991635_100012920558 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 1626a_100102657272_100012920558 [0,2,0,0,0,0|2,0,0]=4 8148 B13R1.4789 CNC(=O)c1cc(cc(c1F)Cl)I 240690a_100102657272_100012920558 [0,2,0,0,0,0|2,0,0]=4 8149 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 11a_106832991635_100012349847 [0,2,0,0,0,0|2,0,0]=4 8150 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 1626a_100102657272_100012349847 [0,2,0,0,0,0|2,0,0]=4 8151 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 240690a_100102657272_100012349847 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)Br 527a_100102657272_100012349847 [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 11a_106832991635_100000094381 [0,2,0,0,0,0|1,0,0]=3 8154 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 1626a_100102657272_100000094381 [0,2,0,0,0,0|1,0,0]=3 8155 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 240690a_100102657272_100000094381 [0,2,0,0,0,0|1,0,0]=3 8156 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)C 527a_100102657272_100000094381 [0,2,0,0,0,0|1,0,0]=3 8157 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 11a_106832991635_100011217470 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 1626a_100102657272_100011217470 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 240690a_100102657272_100011217470 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)F 527a_100102657272_100011217470 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 11a_106832991635_100012344719 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 1626a_100102657272_100012344719 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 240690a_100102657272_100012344719 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.4789 CNC(=O)c1cc(cc(c1F)F)I 527a_100102657272_100012344719 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 11a_106832991635_100000211575 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 1626a_100102657272_100000211575 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 240690a_100102657272_100000211575 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.4789 CNC(=O)c1cc(cc(c1I)I)I 527a_100102657272_100000211575 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.4789 CNC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100010284104 [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 240690a_100102657272_100000212120 [0,2,0,0,0,0|1,0,0]=3 8171 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Br 527a_100102657272_100000212120 [0,2,0,0,0,0|1,0,0]=3 8172 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 240690a_100102657272_100000765379 [0,2,0,0,0,0|1,0,0]=3 8173 B13R1.4789 CNC(=O)c1cc(cc(c1O)Br)Cl 527a_100102657272_100000765379 [0,2,0,0,0,0|1,0,0]=3 8174 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Br 240690a_100102657272_100011825902 [0,2,0,0,0,0|1,0,0]=3 8175 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 240690a_100102657272_100011255218 [0,2,0,0,0,0|1,0,0]=3 8176 B13R1.4789 CNC(=O)c1cc(cc(c1O)C)Cl 527a_100102657272_100011255218 [0,2,0,0,0,0|1,0,0]=3 8177 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 240690a_100102657272_100000215963 [0,2,0,0,0,0|1,0,0]=3 8178 B13R1.4789 CNC(=O)c1cc(cc(c1O)Cl)Cl 527a_100102657272_100000215963 [0,2,0,0,0,0|1,0,0]=3 8179 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 240690a_100102657272_100011255233 [0,2,0,0,0,0|1,0,0]=3 8180 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)Br 527a_100102657272_100011255233 [0,2,0,0,0,0|1,0,0]=3 8181 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 240690a_100102657272_100011255242 [0,2,0,0,0,0|1,0,0]=3 8182 B13R1.4789 CNC(=O)c1cc(cc(c1O)F)F 527a_100102657272_100011255242 [0,2,0,0,0,0|1,0,0]=3 8183 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 1626a_100102657272_100000748652 [0,2,0,0,0,0|1,0,0]=3 8184 B13R1.4789 CNC(=O)c1cc(cc(c1O)I)I 240690a_100102657272_100000748652 [0,2,0,0,0,0|1,0,0]=3 8185 B13R1.4789 CNC(C)c1cc(cc(c1O)Br)C 269862a_106832991636_100011659362 [0,2,0,0,0,0|1,0,1]=4 8186 B13R1.4789 CNC(C)c1cc(cc(c1O)C)C 269862a_106832991636_100000188341 [0,2,0,0,0,0|1,0,1]=4 8187 B13R1.4789 CNC(C)c1cc(cc(c1O)Cl)C 269862a_106832991636_100010659243 [0,2,0,0,0,0|1,0,1]=4 8188 B13R1.4789 COC(=O)c1cc(cc(c1C)Br)O 271570a_203496583355_100012569200 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.4789 COC(=O)c1cc(cc(c1C)F)O 271570a_203496583355_100015527428 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.4789 COC(=O)c1cc(cc(c1C)N)O 271570a_203496583355_100012257200 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.4789 COC(=O)c1cc(cc(c1C)O)F 271570a_203496583355_100012347598 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.4789 COC(=O)c1cc(cc(c1C)O)O 271570a_203496583355_200011012443 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.4789 COC(=O)c1cc(cc(c1F)C)O 271570a_203496583355_200012928940 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.4789 COC(=O)c1cc(cc(c1F)F)O 271570a_203496583355_100012362532 [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.4789 COC(=O)c1cc(cc(c1F)N)O 271570a_203496583355_100011794250 [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.4789 COC(=O)c1cc(cc(c1N)C)O 271570a_203496583355_100011356660 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.4789 COC(=O)c1cc(cc(c1N)N)O 271570a_203496583355_100010127340 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Br 271570a_203496583355_100010726126 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.4789 COC(=O)c1cc(cc(c1N)O)C 271570a_203496583355_100000216481 [0,2,0,0,0,0|1,0,0]=3 8200 B13R1.4789 COC(=O)c1cc(cc(c1N)O)Cl 271570a_203496583355_100000043629 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.4789 COC(=O)c1cc(cc(c1O)C)F 271570a_203496583355_100016049047 [0,2,0,0,0,0|1,0,0]=3 8202 B13R1.4789 COC(=O)c1cc(cc(c1O)F)F 271570a_203496583355_100010155431 [0,2,0,0,0,0|1,0,0]=3 8203 B13R1.4789 COC(=O)c1cc(cc(c1O)N)F 271570a_203496583355_100011794234 [0,2,0,0,0,0|1,0,0]=3 8204 B13R1.4789 COC(=O)c1cc(cc(c1O)O)Br 271570a_203496583355_100009996593 [0,2,0,0,0,0|1,0,0]=3 8205 B13R1.4789 Cc1c(cc(cc1C(=O)CF)Br)Br 1458a_100012356187_100015361967 [0,2,0,0,0,0|2,0,0]=4 8206 B13R1.4789 Cc1c(cc(cc1C(=O)CF)Br)Cl 1458a_100012921640_100015361967 [0,2,0,0,0,0|2,0,0]=4 8207 B13R1.4789 Cc1c(cc(cc1C(=O)CF)Br)F 1458a_100010768523_100015361967 [0,2,0,0,0,0|2,0,0]=4 8208 B13R1.4789 Cc1c(cc(cc1C(=O)CF)Br)O 1458a_100011101721_100015361967 [0,2,0,0,0,0|2,0,0]=4 8209 B13R1.4789 Cc1c(cc(cc1C(=O)CF)F)Br 1458a_100012347597_100015361967 [0,2,0,0,0,0|2,0,0]=4 8210 B13R1.4789 Cc1c(cc(cc1C(=O)CF)F)Cl 1458a_100012177191_100015361967 [0,2,0,0,0,0|2,0,0]=4 8211 B13R1.4789 Cc1cc(c(c(c1)C(=O)CF)Br)Br 1458a_200012920551_100015361967 [0,2,0,0,0,0|1,0,0]=3 8212 B13R1.4789 Cc1cc(c(c(c1)C(=O)CF)Br)C 1458a_200000701928_100015361967 [0,2,0,0,0,0|1,0,0]=3 8213 B13R1.4789 Cc1cc(c(c(c1)C(=O)CF)F)Br 1458a_100009996753_100015361967 [0,2,0,0,0,0|1,0,0]=3 8214 B13R1.4789 Cc1cc(c(c(c1)C(=O)CF)F)F 1458a_100000094381_100015361967 [0,2,0,0,0,0|1,0,0]=3 8215 B13R1.4789 Cc1cc(cc(c1C)C(=O)CF)Br 1458a_100012920495_100015361967 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.4789 Cc1cc(cc(c1Cl)C(=O)CF)F 1458a_200010768536_100015361967 [0,2,0,0,0,0|2,0,0]=4 8217 B13R1.4789 Cc1cc(cc(c1F)C(=O)CF)Br 1458a_100012928937_100015361967 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.4789 Cc1cc(cc(c1O)C(=O)CF)Br 1458a_100011825902_100015361967 [0,2,0,0,0,0|1,0,0]=3 8219 B13R1.4789 Cc1cc(cc(c1O)C(=O)CF)Cl 1458a_100011255218_100015361967 [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.4789 O=C(CF)c1cc(cc(c1Br)F)F 1458a_100010209673_100015361967 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)Br)Cl 1458a_200012920481_100015361967 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)Br)F 1458a_100011105905_100015361967 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)Cl)Cl 1458a_100011215521_100015361967 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)Cl)F 1458a_200010244589_100015361967 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)F)Cl 1458a_200012352169_100015361967 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.4789 O=C(CF)c1cc(cc(c1Cl)F)F 1458a_100009888511_100015361967 [0,2,0,0,0,0|2,0,0]=4 8227 B13R1.4789 O=C(CF)c1cc(cc(c1F)Br)Cl 1458a_100000720295_100015361967 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.4789 O=C(CF)c1cc(cc(c1F)Br)F 1458a_100012920464_100015361967 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.4789 O=C(CF)c1cc(cc(c1F)Cl)Br 1458a_100012920557_100015361967 [0,2,0,0,0,0|2,0,0]=4 8230 B13R1.4789 O=C(CF)c1cc(cc(c1F)Cl)I 1458a_100012920558_100015361967 [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.4789 O=C(CF)c1cc(cc(c1F)F)Br 1458a_100012349847_100015361967 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.4789 O=C(CF)c1cc(cc(c1F)F)F 1458a_100011217470_100015361967 [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.4789 O=C(CF)c1cc(cc(c1F)F)I 1458a_100012344719_100015361967 [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.4789 O=C(CF)c1cc(cc(c1I)I)I 1458a_100000211575_100015361967 [0,2,0,0,0,0|2,0,0]=4 8235 B13R1.4789 O=C(CF)c1cc(cc(c1O)Br)Br 1458a_100000212120_100015361967 [0,2,0,0,0,0|1,0,0]=3 8236 B13R1.4789 O=C(CF)c1cc(cc(c1O)Br)Cl 1458a_100000765379_100015361967 [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.4789 O=C(CF)c1cc(cc(c1O)Cl)Cl 1458a_100000215963_100015361967 [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.4789 O=C(CF)c1cc(cc(c1O)F)Br 1458a_100011255233_100015361967 [0,2,0,0,0,0|1,0,0]=3 8239 B13R1.4789 O=C(CF)c1cc(cc(c1O)F)F 1458a_100011255242_100015361967 [0,2,0,0,0,0|1,0,0]=3 8240 B13R1.4789 O=C(CF)c1cc(cc(c1O)I)I 1458a_100000748652_100015361967 [0,2,0,0,0,0|1,0,0]=3 8241 B13R1.4789 O=C(CF)c1cc(cc(c1O)O)Br 1458a_200010196872_100015361967 [0,2,0,0,0,0|1,0,0]=3 8242 B13R1.13 C=C(C)c1cc(c(cn1)F)C(=O)C 271570a_100000694244_100000697832 [0,2,0,0,0,0|2,0,0]=4 8243 B13R1.13 C=C(C)c1cc(ccc1Br)C(=O)C 271570a_100000694244_100010146556 [0,2,0,0,0,0|2,0,0]=4 8244 B13R1.13 C=C(C)c1cc(ccc1C)C(=O)C 271570a_100000694244_100011934287 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.13 C=C(C)c1cc(ccc1F)C(=O)C 271570a_100000694244_100000239719 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.13 C=C(C)c1cc(ccc1F)C(C)O 271570a_100000694244_100011191524 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.13 C=C(C)c1cc(ccc1F)C(F)F 271570a_100000694244_100010188717 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.13 C=C(C)c1cc(ccc1F)[C@H](C)N 271570a_100000694244_100000753309 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.13 C=C(C)c1cc(ccc1N)C(=O)C 271570a_100000694244_100012029215 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.13 C=C(C)c1cc(ccc1N)C(C)C 271570a_100000694244_100011218581 [0,2,0,0,0,0|2,0,0]=4 8251 B13R1.13 C=C(C)c1cc(ccc1N)N(C)C 271570a_100000694244_200013039233 [0,2,0,0,0,0|2,0,0]=4 8252 B13R1.13 C=C(C)c1cc(ccc1O)C(=O)C 271570a_100000694244_100011772453 [0,2,0,0,0,0|1,0,0]=3 8253 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)C)C 271570a_100000694244_100012706819 [0,2,0,0,0,0|1,0,0]=3 8254 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)C)Cl 271570a_100000694244_100010712560 [0,2,0,0,0,0|1,0,0]=3 8255 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)C)F 271570a_100000694244_100000689017 [0,2,0,0,0,0|1,0,0]=3 8256 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)C)N 271570a_100000694244_100000695420 [0,2,0,0,0,0|1,0,0]=3 8257 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)C)O 271570a_100000694244_100000212127 [0,2,0,0,0,0|0,0,0]=2 8258 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)N)C 271570a_100000694244_100012257281 [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)N)F 271570a_100000694244_100000162119 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)N)N 271570a_100000694244_100000740421 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.13 C=C(C)c1ccc(c(c1)C(=O)N)O 271570a_100000694244_100000192807 [0,2,0,0,0,0|1,0,0]=3 8262 B13R1.13 C=C(C)c1ccc(c(c1)C(C)C)O 271570a_100000694244_100000691460 [0,2,0,0,0,0|1,0,1]=4 8263 B13R1.13 C=C(C)c1ccc(c(n1)C(=O)C)F 271570a_100000694244_100009887703 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.13 C=C(C)c1cnc(c(c1)C(=O)C)C 271570a_100000694244_100138557192 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.13 C=C(C)c1cnc(c(c1)C(=O)C)F 271570a_100000694244_100010254234 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.13 C=C(C)c1cnc(c(c1)C(=O)C)N 271570a_100000694244_100010173950 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.13 CC(=O)c1cc(ccc1Br)N(C)C 1458a_100012343546_200000210301 [0,2,0,0,0,0|1,0,0]=3 8268 B13R1.13 CC(=O)c1cc(ccc1Br)[N+](=O)[O-] 1458a_100000747063_200000210301 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.13 CC(=O)c1cc(ccc1C)[N+](=O)[O-] 1458a_100000229928_200000210301 [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.13 CC(=O)c1cc(ccc1I)[N+](=O)[O-] 1458a_100000739378_200000210301 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.13 CC(=O)c1cc(ccc1O)[N+](=O)[O-] 1458a_100000740180_200000210301 [0,2,0,0,0,0|1,0,0]=3 8272 B13R1.13 CC(=O)c1ccc(c(c1)[N+](=O)[O-])O 1458a_100000744589_200000210301 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.13 CN(C)c1ccc(c(c1)C(=O)[13CH3])Br 1458a_100012343546_200025704644 [0,2,0,0,0,0|1,0,0]=3 8274 B13R1.13 Cc1ccc(cc1C(=O)[13CH3])[N+](=O)[O-] 1458a_100000229928_200025704644 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.13 [13CH3]C(=O)c1cc(ccc1Br)[N+](=O)[O-] 1458a_100000747063_200025704644 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.13 [13CH3]C(=O)c1cc(ccc1I)[N+](=O)[O-] 1458a_100000739378_200025704644 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.13 [13CH3]C(=O)c1cc(ccc1O)[N+](=O)[O-] 1458a_100000740180_200025704644 [0,2,0,0,0,0|1,0,0]=3 8278 B13R1.13 [13CH3]C(=O)c1ccc(c(c1)[N+](=O)[O-])O 1458a_100000744589_200025704644 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.387 C=C(C)c1cc(ccc1C)COC 271570a_100000694244_200015395492 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.387 C=C(C)c1cc(ccc1C)OCC 271570a_100000694244_100011099959 [0,2,0,0,0,0|2,0,0]=4 8281 B13R1.387 C=C(C)c1cc(ccc1F)CC#N 271570a_100000694244_100000742998 [0,2,0,0,0,0|2,0,0]=4 8282 B13R1.387 C=C(C)c1cc(ccc1F)COC 271570a_100000694244_200011493689 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.387 C=C(C)c1cc(ccc1N)CC#N 271570a_100000694244_100010188563 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)C 271570a_100015277604_100012706819 [0,2,0,0,0,0|1,0,1]=4 8285 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)Cl 271570a_100015277604_100010712560 [0,2,0,0,0,0|1,0,1]=4 8286 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)F 271570a_100015277604_100000689017 [0,2,0,0,0,0|1,0,1]=4 8287 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)N 271570a_100015277604_100000695420 [0,2,0,0,0,0|1,0,1]=4 8288 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)C)O 271570a_100015277604_100000212127 [0,2,0,0,0,0|0,0,1]=3 8289 B13R1.387 C=C=Cc1ccc(c(c1)C(=O)N)O 271570a_100015277604_100000192807 [0,2,0,0,0,0|1,0,1]=4 8290 B13R1.387 CC(=O)c1cc(ccc1C)SCF 62a_100012706819_100015361967 [0,2,0,0,0,0|1,0,0]=3 8291 B13R1.387 CC(=O)c1cc(ccc1Cl)OCF 34a_100009867868_100015361967 [0,2,0,0,0,0|1,0,0]=3 8292 B13R1.387 CC(=O)c1cc(ccc1Cl)OCF 7a_100009867868_100015361967 [0,2,0,0,0,0|1,0,0]=3 8293 B13R1.387 CC(=O)c1cc(ccc1Cl)SCF 62a_100010712560_100015361967 [0,2,0,0,0,0|1,0,0]=3 8294 B13R1.387 CC(=O)c1cc(ccc1F)OCF 34a_100000091700_100015361967 [0,2,0,0,0,0|1,0,0]=3 8295 B13R1.387 CC(=O)c1cc(ccc1F)OCF 7a_100000091700_100015361967 [0,2,0,0,0,0|1,0,0]=3 8296 B13R1.387 CC(=O)c1cc(ccc1F)SCF 62a_100000689017_100015361967 [0,2,0,0,0,0|1,0,0]=3 8297 B13R1.387 CC(=O)c1cc(ccc1F)SCF 62a_100015361967_100010254839 [0,2,0,0,0,0|1,0,0]=3 8298 B13R1.387 CC(=O)c1cc(ccc1N)SCF 62a_100000695420_100015361967 [0,2,0,0,0,0|1,0,0]=3 8299 B13R1.387 CC(=O)c1cc(cnc1C)SCF 62a_100015361967_100138557192 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.387 CC(=O)c1cc(cnc1C)SCF 62a_100138557192_100015361967 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.387 CC(=O)c1cc(cnc1F)SCF 62a_100010254234_100015361967 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.387 CC(=O)c1cc(cnc1F)SCF 62a_100015361967_100010254234 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.387 CC(=O)c1cc(cnc1N)SCF 62a_100010173950_100015361967 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.387 CC(=O)c1cc(cnc1N)SCF 62a_100015361967_100010173950 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.387 CC(=O)c1cc(ncc1F)SCF 62a_100000697832_100015361967 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.387 CC(=O)c1cc(ncc1F)SCF 62a_100015361967_100000697832 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.387 CC(=O)c1nc(ccc1F)SCF 62a_100009887703_100015361967 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.387 CC(=O)c1nc(ccc1F)SCF 62a_100015361967_100009887703 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.387 CC(C)c1cc(ccc1O)SCF 62a_100000691460_100015361967 [0,2,0,0,0,0|1,0,1]=4 8310 B13R1.387 CC(C)c1cc(ccc1O)SCF 62a_100015361967_100000691460 [0,2,0,0,0,0|1,0,1]=4 8311 B13R1.387 CC=Cc1cc(c(cn1)F)C(=O)C 271570a_100016259895_100000697832 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)C 271570a_100016259895_100012706819 [0,2,0,0,0,0|1,0,0]=3 8313 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)Cl 271570a_100016259895_100010712560 [0,2,0,0,0,0|1,0,0]=3 8314 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)F 271570a_100016259895_100000689017 [0,2,0,0,0,0|1,0,0]=3 8315 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)N 271570a_100016259895_100000695420 [0,2,0,0,0,0|1,0,0]=3 8316 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)O 271570a_100016259895_100000212127 [0,2,0,0,0,0|0,0,0]=2 8317 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)C 271570a_100016259895_100012257281 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)F 271570a_100016259895_100000162119 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)N 271570a_100016259895_100000740421 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.387 CC=Cc1ccc(c(c1)C(=O)N)O 271570a_100016259895_100000192807 [0,2,0,0,0,0|1,0,0]=3 8321 B13R1.387 CC=Cc1ccc(c(c1)C(C)C)O 271570a_100016259895_100000691460 [0,2,0,0,0,0|1,0,1]=4 8322 B13R1.387 CC=Cc1ccc(c(n1)C(=O)C)F 271570a_100016259895_100009887703 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.387 CC=Cc1cnc(c(c1)C(=O)C)C 271570a_100016259895_100138557192 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.387 CC=Cc1cnc(c(c1)C(=O)C)F 271570a_100016259895_100010254234 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.387 CC=Cc1cnc(c(c1)C(=O)C)N 271570a_100016259895_100010173950 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Br 34a_100015186447_100000210202 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Br 7a_100015186447_100000210202 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.387 CCNc1ccc(c(c1)C(=O)N)C 34a_100000750465_100000210202 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.387 CCNc1ccc(c(c1)C(=O)N)C 7a_100000750465_100000210202 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_100000210202 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_100000210202 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.387 CCNc1ccc(c(c1)C(=O)N)F 34a_100000738046_100000210202 [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.387 CCNc1ccc(c(c1)C(=O)N)F 7a_100000738046_100000210202 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100000210202 [0,2,0,0,0,0|1,0,0]=3 8335 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000210202 [0,2,0,0,0,0|1,0,0]=3 8336 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100000210202 [0,2,0,0,0,0|1,0,0]=3 8337 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000210202 [0,2,0,0,0,0|1,0,0]=3 8338 B13R1.387 CCOc1ccc(c(c1)C(=O)C)O 1458a_200011255221_200000210301 [0,2,0,0,0,0|0,0,0]=2 8339 B13R1.387 CCOc1ccc(c(c1)C(=O)[13CH3])O 1458a_200011255221_200025704644 [0,2,0,0,0,0|0,0,0]=2 8340 B13R1.387 CCSc1cc(c(cn1)F)C(=O)C 62a_100000210202_100000697832 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.387 CCSc1cc(c(cn1)F)C(=O)C 62a_100000697832_100000210202 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.387 CCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000210202 [0,2,0,0,0,0|1,0,0]=3 8343 B13R1.387 CCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000210202 [0,2,0,0,0,0|1,0,0]=3 8344 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000210202_100010254839 [0,2,0,0,0,0|1,0,0]=3 8345 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000210202 [0,2,0,0,0,0|1,0,0]=3 8346 B13R1.387 CCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000210202 [0,2,0,0,0,0|1,0,0]=3 8347 B13R1.387 CCSc1ccc(c(c1)C(=O)N)C 62a_100000210202_100012257281 [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.387 CCSc1ccc(c(c1)C(=O)N)C 62a_100012257281_100000210202 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.387 CCSc1ccc(c(c1)C(=O)N)F 62a_100000162119_100000210202 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.387 CCSc1ccc(c(c1)C(=O)N)N 62a_100000740421_100000210202 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.387 CCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210202 [0,2,0,0,0,0|1,0,0]=3 8352 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000210202_100000691460 [0,2,0,0,0,0|1,0,1]=4 8353 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210202 [0,2,0,0,0,0|1,0,1]=4 8354 B13R1.387 CCSc1ccc(c(n1)C(=O)C)F 62a_100000210202_100009887703 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.387 CCSc1ccc(c(n1)C(=O)C)F 62a_100009887703_100000210202 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.387 CCSc1cnc(c(c1)C(=O)C)C 62a_100000210202_100138557192 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.387 CCSc1cnc(c(c1)C(=O)C)C 62a_100138557192_100000210202 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.387 CCSc1cnc(c(c1)C(=O)C)F 62a_100000210202_100010254234 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.387 CCSc1cnc(c(c1)C(=O)C)F 62a_100010254234_100000210202 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.387 CCSc1cnc(c(c1)C(=O)C)N 62a_100000210202_100010173950 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.387 CCSc1cnc(c(c1)C(=O)C)N 62a_100010173950_100000210202 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.387 CNCc1ccc(c(c1)C(=O)C)Cl 26a_100102657272_100009867868 [0,2,0,0,0,0|1,0,0]=3 8363 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 2230a_106832991635_100010149780 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 7a_106832991635_100010149780 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.387 Cc1ccc(cc1C(=O)N)NCF 34a_100000750465_100015361967 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.387 Cc1ccc(cc1C(=O)N)NCF 7a_100000750465_100015361967 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.387 Cc1ccc(cc1C(=O)N)SCF 62a_100012257281_100015361967 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.387 Cc1ccc(cc1C(=O)N)SCF 62a_100015361967_100012257281 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.387 NC(=O)c1cc(ccc1Br)NCF 34a_100015186447_100015361967 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.387 NC(=O)c1cc(ccc1Br)NCF 7a_100015186447_100015361967 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.387 NC(=O)c1cc(ccc1Cl)NCF 34a_100000736848_100015361967 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.387 NC(=O)c1cc(ccc1Cl)NCF 7a_100000736848_100015361967 [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.387 NC(=O)c1cc(ccc1F)NCF 34a_100000738046_100015361967 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.387 NC(=O)c1cc(ccc1F)NCF 7a_100000738046_100015361967 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.387 NC(=O)c1cc(ccc1F)SCF 62a_100000162119_100015361967 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.387 NC(=O)c1cc(ccc1N)SCF 62a_100000740421_100015361967 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.387 NC(=O)c1cc(ccc1O)SCF 62a_100000192807_100015361967 [0,2,0,0,0,0|1,0,0]=3 8378 B13R1.437 C=C(C)c1cc(cc(c1F)F)CO 271570a_100000694244_100015464361 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.437 C=C(C)c1cc(cc(c1N)C)OC 271570a_100000694244_200011010636 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.437 C=C(C)c1cc(cc(c1N)N)OC 271570a_100000694244_100010194281 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.437 C=C(C)c1cc(cc(c1O)F)C=O 271570a_100000694244_100010295671 [0,2,0,0,0,0|1,0,1]=4 8382 B13R1.437 C=C(C)c1cc(cc(c1O)N)OC 271570a_100000694244_200010008348 [0,2,0,0,0,0|1,0,0]=3 8383 B13R1.437 C=C(C)c1cc(cc(c1O)O)C#N 271570a_100000694244_100010672013 [0,2,0,0,0,0|1,0,1]=4 8384 B13R1.437 CC(=O)c1cc(cc(c1Cl)Br)C#N 1458a_200015931683_200000210301 [0,2,0,0,0,0|1,0,1]=4 8385 B13R1.437 [13CH3]C(=O)c1cc(cc(c1Cl)Br)C#N 1458a_200015931683_200025704644 [0,2,0,0,0,0|1,0,1]=4 8386 B13R1.3097 C=C(C)c1c(ccc(c1C)OC)C 271570a_100000694244_100016151084 [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.3097 C=C(C)c1c(ccc(c1F)OC)F 271570a_100000694244_100010946477 [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.3097 COc1ccc(c(c1Br)C(=O)C)Br 1458a_200020932704_200000210301 [0,2,0,0,0,0|1,0,0]=3 8389 B13R1.3097 COc1ccc(c(c1Br)C(=O)[13CH3])Br 1458a_200020932704_200025704644 [0,2,0,0,0,0|1,0,0]=3 8390 B13R1.3097 COc1ccc(c(c1C)C(=O)C)Br 1458a_100010074600_200000210301 [0,2,0,0,0,0|1,0,0]=3 8391 B13R1.3097 COc1ccc(c(c1C)C(=O)[13CH3])Br 1458a_100010074600_200025704644 [0,2,0,0,0,0|1,0,0]=3 8392 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)Cl 1458a_200010760820_200000210301 [0,2,0,0,0,0|1,0,0]=3 8393 B13R1.3097 COc1ccc(c(c1Cl)C(=O)C)F 1458a_100000062076_200000210301 [0,2,0,0,0,0|1,0,0]=3 8394 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])Cl 1458a_200010760820_200025704644 [0,2,0,0,0,0|1,0,0]=3 8395 B13R1.3097 COc1ccc(c(c1Cl)C(=O)[13CH3])F 1458a_100000062076_200025704644 [0,2,0,0,0,0|1,0,0]=3 8396 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Br 1458a_100010204293_200000210301 [0,2,0,0,0,0|1,0,0]=3 8397 B13R1.3097 COc1ccc(c(c1F)C(=O)C)Cl 1458a_100000062078_200000210301 [0,2,0,0,0,0|1,0,0]=3 8398 B13R1.3097 COc1ccc(c(c1F)C(=O)C)F 1458a_100000062053_200000210301 [0,2,0,0,0,0|1,0,0]=3 8399 B13R1.3097 COc1ccc(c(c1F)C(=O)N)F 34a_100009825046_200000210301 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.3097 COc1ccc(c(c1F)C(=O)N)F 7a_100009825046_200000210301 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Br 1458a_100010204293_200025704644 [0,2,0,0,0,0|1,0,0]=3 8402 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])Cl 1458a_100000062078_200025704644 [0,2,0,0,0,0|1,0,0]=3 8403 B13R1.3097 COc1ccc(c(c1F)C(=O)[13CH3])F 1458a_100000062053_200025704644 [0,2,0,0,0,0|1,0,0]=3 8404 B13R1.3097 [13CH3]Oc1ccc(c(c1F)C(=O)N)F 34a_100009825046_200025704644 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.3097 [13CH3]Oc1ccc(c(c1F)C(=O)N)F 7a_100009825046_200025704644 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.299 C=C(C)c1cc(cc(c1F)C#N)C 271570a_100000694244_200010161325 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.299 C=C(C)c1cc(cc(c1F)C=O)C 271570a_100000694244_100010161323 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.299 C=C(C)c1cc(cc(c1O)C#N)F 271570a_100000694244_100010674538 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.299 C=C(C)c1cc(cc(c1O)C=O)C 271570a_100000694244_100000698970 [0,2,0,0,0,0|1,0,0]=3 8410 B13R1.299 C=C(C)c1cc(cc(c1O)C=O)F 271570a_100000694244_100011659637 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.299 C=C(C)c1cc(cc(c1O)OC)F 271570a_100000694244_200010391102 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.299 C=Cc1cc(cc(c1O)C(=O)C)C 271570a_100011290941_100011659362 [0,2,0,0,0,0|0,0,0]=2 8413 B13R1.299 C=Cc1cc(cc(c1O)C(=O)N)F 271570a_100011290941_200135271384 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.299 CC(=O)c1cc(cc(c1O)S[13CH3])C 62a_200025704644_100011659362 [0,2,0,0,0,0|0,0,0]=2 8415 B13R1.299 COc1cc(cc(c1Cl)C(=O)C)Br 1458a_100015568607_200000210301 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.299 COc1cc(cc(c1Cl)C(=O)[13CH3])Br 1458a_100015568607_200025704644 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.299 COc1cc(cc(c1O)C(=O)C)Br 1458a_100012340195_200000210301 [0,2,0,0,0,0|1,0,0]=3 8418 B13R1.299 COc1cc(cc(c1O)C(=O)[13CH3])Br 1458a_100012340195_200025704644 [0,2,0,0,0,0|1,0,0]=3 8419 B13R1.299 CSc1cc(cc(c1O)C(=O)C)C 62a_200000210301_100011659362 [0,2,0,0,0,0|0,0,0]=2 8420 B13R1.299 CSc1cc(cc(c1O)C(=O)N)F 62a_200000210301_200135271384 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.299 CSc1cc(cc(c1O)C(=O)N)F 62a_200135271384_200000210301 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.299 [13CH3]Sc1cc(cc(c1O)C(=O)N)F 62a_200025704644_200135271384 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.299 [13CH3]Sc1cc(cc(c1O)C(=O)N)F 62a_200135271384_200025704644 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.2818 C=C(C)c1c(c(cc(c1C)C)C)C 271570a_100000694244_100011215432 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.2818 C=C(C)c1c(c(cc(c1N)N)C)C 271570a_100000694244_100010077870 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.2818 CC(=O)c1c(c(cc(c1C)C)C)C 1458a_100011204818_200000210301 [0,2,0,0,0,0|1,0,0]=3 8427 B13R1.2818 CC(=O)c1c(c(cc(c1Cl)Cl)Cl)O 1458a_100000186488_200000210301 [0,2,0,0,0,0|1,0,0]=3 8428 B13R1.2818 CC(=O)c1c(c(cc(c1F)Br)F)F 1458a_100010874026_200000210301 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.2818 CC(=O)c1c(c(cc(c1F)F)F)F 1458a_100000766099_200000210301 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.2818 Cc1cc(c(c(c1C)C(=O)[13CH3])C)C 1458a_100011204818_200025704644 [0,2,0,0,0,0|1,0,0]=3 8431 B13R1.2818 [13CH3]C(=O)c1c(c(cc(c1Cl)Cl)Cl)O 1458a_100000186488_200025704644 [0,2,0,0,0,0|1,0,0]=3 8432 B13R1.2818 [13CH3]C(=O)c1c(c(cc(c1F)Br)F)F 1458a_100010874026_200025704644 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.2818 [13CH3]C(=O)c1c(c(cc(c1F)F)F)F 1458a_100000766099_200025704644 [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.3340 C=C(C)c1c(ccc(c1C=O)O)O 271570a_100000694244_100010184888 [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.3340 COc1c(ccc(c1C(=O)C)Cl)Cl 1458a_100000033403_200000210301 [0,2,0,0,0,0|2,0,0]=4 8436 B13R1.3340 COc1c(ccc(c1C(=O)C)F)F 1458a_100000686818_200000210301 [0,2,0,0,0,0|2,0,0]=4 8437 B13R1.3340 COc1c(ccc(c1C(=O)[13CH3])Cl)Cl 1458a_100000033403_200025704644 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.3340 COc1c(ccc(c1C(=O)[13CH3])F)F 1458a_100000686818_200025704644 [0,2,0,0,0,0|2,0,0]=4 8439 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [0,0,1,1,0,0|1,0,1]=4 8440 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [0,0,1,1,0,0|2,0,0]=4 8441 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [0,0,1,1,0,0|2,0,0]=4 8442 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [0,0,1,1,0,0|1,0,1]=4 8443 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [0,0,1,1,0,0|2,0,0]=4 8444 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [0,0,1,1,0,0|1,0,1]=4 8445 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,0,1,1,0,0|2,0,0]=4 8446 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,0,1,1,0,0|1,0,0]=3 8447 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,0,1,1,0,0|1,0,1]=4 8448 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [0,0,1,1,0,0|0,0,2]=4 8449 B11R1.605 CC=Cc1c(ccnc1C)C 271570a_100016259895_100012000501 [0,0,1,1,0,0|2,0,0]=4 8450 B11R1.605 CC=Cc1c(ccnc1C)N 271570a_100016259895_100010243816 [0,0,1,1,0,0|2,0,0]=4 8451 B11R1.605 CC=Cc1c(ccnc1O)C 271570a_100016259895_100012000493 [0,0,1,1,0,0|2,0,0]=4 8452 B11R1.605 CC=Cc1c(ccnc1O)O 271570a_100016259895_200009817435 [0,0,1,1,0,0|1,0,1]=4 8453 B11R1.605 CC=Cc1c(cn[nH]c1=O)O 271570a_100016259895_100000116976 [0,0,1,1,0,0|2,0,0]=4 8454 B11R1.75 CC(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200000210301 [0,0,1,1,0,0|2,0,0]=4 8455 B11R1.75 CC(=O)C=Cc1ccc(o1)C 1458a_100000183563_200000210301 [0,0,1,1,0,0|2,0,0]=4 8456 B11R1.75 CC(=O)C=Cc1ccc(o1)I 1458a_100000679848_200000210301 [0,0,1,1,0,0|2,0,0]=4 8457 B11R1.75 CC(=O)C=Cc1ccc(s1)Br 1458a_100102558031_200000210301 [0,0,1,1,0,0|2,0,0]=4 8458 B11R1.75 CC(=O)C=Cc1ccc(s1)C 1458a_100102558089_200000210301 [0,0,1,1,0,0|2,0,0]=4 8459 B11R1.75 CC(=O)C=Cc1ccc(s1)Cl 1458a_100102558157_200000210301 [0,0,1,1,0,0|2,0,0]=4 8460 B11R1.75 Cc1ccc(o1)C=CC(=O)[13CH3] 1458a_100000183563_200025704644 [0,0,1,1,0,0|2,0,0]=4 8461 B11R1.75 Cc1ccc(s1)C=CC(=O)[13CH3] 1458a_100102558089_200025704644 [0,0,1,1,0,0|2,0,0]=4 8462 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200025704644 [0,0,1,1,0,0|2,0,0]=4 8463 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)I 1458a_100000679848_200025704644 [0,0,1,1,0,0|2,0,0]=4 8464 B11R1.75 [13CH3]C(=O)C=Cc1ccc(s1)Br 1458a_100102558031_200025704644 [0,0,1,1,0,0|2,0,0]=4 8465 B11R1.75 [13CH3]C(=O)C=Cc1ccc(s1)Cl 1458a_100102558157_200025704644 [0,0,1,1,0,0|2,0,0]=4 8466 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,0,1,1,0,0|2,0,0]=4 8467 B11R1.86 CC(=Cc1ncccc1C)C 271570a_100102525489_100000751373 [0,0,1,1,0,0|2,0,0]=4 8468 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,0,1,1,0,0|1,0,1]=4 8469 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,0,1,1,0,0|1,0,1]=4 8470 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [0,0,1,1,0,0|1,0,1]=4 8471 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [0,0,1,1,0,0|1,0,1]=4 8472 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,0,1,1,0,0|2,0,0]=4 8473 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,0,1,1,0,0|2,0,0]=4 8474 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,0,1,1,0,0|2,0,0]=4 8475 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,0,1,1,0,0|2,0,0]=4 8476 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,0,1,1,0,0|1,0,1]=4 8477 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [0,0,1,1,0,0|1,0,1]=4 8478 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,0,1,1,0,0|1,0,1]=4 8479 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [0,0,1,1,0,0|2,0,0]=4 8480 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [0,0,1,1,0,0|1,0,1]=4 8481 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,0,1,1,0,0|1,0,1]=4 8482 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [0,0,1,1,0,0|2,0,0]=4 8483 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [0,0,1,1,0,0|1,0,1]=4 8484 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,0,1,1,0,0|1,0,1]=4 8485 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,0,1,1,0,0|1,0,1]=4 8486 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,0,1,1,0,0|2,0,0]=4 8487 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,0,1,1,0,0|2,0,0]=4 8488 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,0,1,1,0,0|1,0,1]=4 8489 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,0,1,1,0,0|1,0,1]=4 8490 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [0,0,1,1,0,0|1,0,1]=4 8491 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [0,0,1,1,0,0|1,0,1]=4 8492 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,0,1,1,0,0|2,0,0]=4 8493 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,0,1,1,0,0|2,0,0]=4 8494 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,0,1,1,0,0|2,0,0]=4 8495 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,0,1,1,0,0|2,0,0]=4 8496 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,0,1,1,0,0|1,0,1]=4 8497 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [0,0,1,1,0,0|1,0,1]=4 8498 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,0,0,1,0,0|1,0,1]=4 8499 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,0,0,1,0,0|2,0,0]=4 8500 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,0,0,1,0,0|1,0,1]=4 8501 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,0,0,1,0,0|2,0,0]=4 8502 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [1,0,0,1,0,0|0,0,2]=4 8503 B11R2.55 Oc1ccccc1C2CC2 271570a_100011220607_100000739446 [1,0,0,1,0,0|1,0,1]=4 8504 B11R2.55 Oc1ccccc1C2CC2 271570a_203496583355_100009819954 [1,0,0,1,0,0|1,0,1]=4 8505 B11R2.35 Cc1cccc(c1)C2CC2 271570a_100011220607_100011215228 [1,0,0,1,0,0|1,0,1]=4 8506 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,0,0,1,0,1|2,0,0]=4 8507 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,0,0,1,0,1|2,0,0]=4 8508 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,0,0,1,0,1|1,0,0]=3 8509 B13R2.155 O=C1COc2ccc(nc2N1)O 271570a_203496583355_100010235088 [0,0,0,1,0,1|2,0,0]=4 8510 B13R2.155 O=C1COc2ncc(cc2N1)O 271570a_203496583355_100000699640 [0,0,0,1,0,1|2,0,0]=4 8511 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [0,0,0,1,0,1|1,1,0]=4 8512 B13R2.175 Cc1ccc(c(c1)NC2CC2)O 34a_100011215204_100000211595 [0,0,0,1,0,1|1,0,1]=4 8513 B13R2.175 Cc1ccc(c(c1)SC2CC2)O 62a_100000765521_100000211595 [0,0,0,1,0,1|1,0,1]=4 8514 B13R2.5139 O=C1Cc2c(ccc(c2N1)F)O 271570a_203496583355_100012355367 [0,0,0,1,0,1|2,0,0]=4 8515 B13R2.66 COc1ccc(cc1C2CC2)C 271570a_100011220607_100000186399 [0,1,0,1,0,0|1,0,1]=4 8516 B13R2.162 O=C1CCCc2c1cc(cc2)O 271570a_203496583355_100000760428 [0,1,0,1,0,0|2,0,0]=4 8517 B13R2.162 O=C1CCNc2c1cc(cc2)O 271570a_203496583355_100000697366 [0,1,0,1,0,0|2,0,0]=4 8518 B13R2.162 O=C1CCOc2c1cc(cc2)O 271570a_203496583355_100000243215 [0,1,0,1,0,0|1,0,0]=3 8519 B13R2.162 O=C1CCSc2c1cc(cc2)O 271570a_203496583355_100000744447 [0,1,0,1,0,0|1,1,0]=4 8520 B13R2.162 O=C1COCc2c1cc(cc2)O 271570a_203496583355_100010205901 [0,1,0,1,0,0|1,0,0]=3 8521 B13R2.162 O=C1NCCc2c1cc(cc2)O 271570a_203496583355_100000688804 [0,1,0,1,0,0|2,0,0]=4 8522 B13R2.162 O=c1ccoc2c1cc(cc2)O 271570a_203496583355_100009813387 [0,1,0,1,0,0|1,0,1]=4 8523 B13R2.5187 Cc1ccc2c(nn(c2c1)C)O 271570a_203496583355_100010073239 [0,1,0,1,0,0|2,0,0]=4 8524 B13R2.5187 O=C1CC(=O)c2c1ccc(c2)O 271570a_203496583355_100009997049 [0,1,0,1,0,0|1,0,1]=4 8525 B13R2.5391 Cc1cc(c(cc1C)C2CC2)O 271570a_100011220607_100009814663 [0,1,0,1,0,0|1,0,1]=4 8526 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010133461 [0,1,0,1,0,0|2,0,0]=4 8527 B13R2.11634 Cc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010010902 [0,1,0,1,0,0|1,0,0]=3 8528 B13R2.11634 Nc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010080117 [0,1,0,1,0,0|2,0,0]=4 8529 B13R2.11634 O=C1CCc2c1cc(c(c2)F)O 271570a_203496583355_100010010871 [0,1,0,1,0,0|2,0,0]=4 8530 B13R2.11634 O=C1CCc2c1cc(c(c2)O)F 271570a_203496583355_100010010804 [0,1,0,1,0,0|2,0,0]=4 8531 B13R2.2136 CSc1n[nH]c2c1cc(cc2)C 62a_200000210301_100000123028 [0,1,0,1,0,0|2,0,0]=4 8532 B13R2.2136 Cc1ccc2[nH]nc(c2c1)S[13CH3] 62a_200025704644_100000123028 [0,1,0,1,0,0|2,0,0]=4 8533 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [0,1,0,1,0,0|2,0,0]=4 8534 B13R2.3028 CN1Cc2ccc(cc2C1=O)O 271570a_203496583355_100010125600 [0,1,0,1,0,0|2,0,0]=4 8535 B13R2.5151 Cc1ccc(c2c1C(=O)CC2)O 271570a_203496583355_100010091368 [0,1,0,1,0,0|2,0,0]=4 8536 B13R2.5151 O=C1CCc2c1c(ccc2F)O 271570a_203496583355_100000694073 [0,1,0,1,0,0|1,0,0]=3 8537 B13R2.5151 O=C1CCc2c1c(ccc2O)F 271570a_203496583355_100012347972 [0,1,0,1,0,0|2,0,0]=4 8538 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_100009816527 [0,1,0,1,0,0|1,0,0]=3 8539 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_200010133748 [0,1,0,1,0,0|1,0,0]=3 8540 B13R2.669 C=Cc1ccc2c(c1)C(=O)CC2 271570a_100011290941_100000759401 [0,1,0,1,0,0|1,0,1]=4 8541 B13R2.669 C=Cc1ccc2c(c1)C(=O)CO2 271570a_100011290941_100000752586 [0,1,0,1,0,0|0,0,1]=3 8542 B13R2.669 C=Cc1ccc2o[nH]c(=O)c2c1 271570a_100011290941_100000732257 [0,1,0,1,0,0|1,0,1]=4 8543 B13R2.669 C=Cc1ccc2occ(c2c1)C 271570a_100011290941_100000728893 [0,1,0,1,0,0|1,0,1]=4 8544 B13R2.669 C=Cc1ccc2onc(c2c1)C 271570a_100011290941_100010196875 [0,1,0,1,0,0|1,0,1]=4 8545 B13R2.669 CNc1ccc2onc(c2c1)C 34a_200000044492_200000210301 [0,1,0,1,0,0|1,0,0]=3 8546 B13R2.669 COc1ccc2[nH]cc(c2c1)C 34a_100000131216_200000210301 [0,1,0,1,0,0|2,0,0]=4 8547 B13R2.669 COc1ccc2c(c1)C(=O)CC2 34a_100009827925_200000210301 [0,1,0,1,0,0|1,0,0]=3 8548 B13R2.669 COc1ccc2c(c1)C(=O)CC2 7a_100009827925_200000210301 [0,1,0,1,0,0|1,0,0]=3 8549 B13R2.669 COc1ccc2c(c1)C(=O)NC2 34a_100000087830_200000210301 [0,1,0,1,0,0|2,0,0]=4 8550 B13R2.669 CSc1ccc2[nH][nH]c(=O)c2c1 62a_200000210301_100012353726 [0,1,0,1,0,0|2,0,0]=4 8551 B13R2.669 CSc1ccc2[nH]cc(c2c1)C 62a_200000210301_100009816687 [0,1,0,1,0,0|2,0,0]=4 8552 B13R2.669 CSc1ccc2[nH]nc(c2c1)C 62a_200000210301_100102524909 [0,1,0,1,0,0|2,0,0]=4 8553 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_100000759401_200000210301 [0,1,0,1,0,0|1,0,0]=3 8554 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_200000210301_100000759401 [0,1,0,1,0,0|1,0,0]=3 8555 B13R2.669 CSc1ccc2c(c1)C(=O)CO2 62a_200000210301_100000752586 [0,1,0,1,0,0|0,0,0]=2 8556 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_100000688121_200000210301 [0,1,0,1,0,0|2,0,0]=4 8557 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_200000210301_100000688121 [0,1,0,1,0,0|2,0,0]=4 8558 B13R2.669 CSc1ccc2c(c1)C(=O)OC2 62a_100000693025_200000210301 [0,1,0,1,0,0|2,0,0]=4 8559 B13R2.669 CSc1ccc2c(n1)C(=O)CC2 62a_100000701527_200000210301 [0,1,0,1,0,0|2,0,0]=4 8560 B13R2.669 CSc1ccc2c(n1)C(=O)CC2 62a_200000210301_100000701527 [0,1,0,1,0,0|2,0,0]=4 8561 B13R2.669 CSc1ccc2o[nH]c(=O)c2c1 62a_200000210301_100000732257 [0,1,0,1,0,0|1,0,0]=3 8562 B13R2.669 CSc1ccc2occ(c2c1)C 62a_200000210301_100000728893 [0,1,0,1,0,0|1,0,0]=3 8563 B13R2.669 CSc1ccc2onc(c2c1)C 62a_100010196875_200000210301 [0,1,0,1,0,0|1,0,0]=3 8564 B13R2.669 CSc1ccc2onc(c2c1)C 62a_200000210301_100010196875 [0,1,0,1,0,0|1,0,0]=3 8565 B13R2.669 CSc1ccc2onc(c2c1)N 62a_100012356444_200000210301 [0,1,0,1,0,0|2,0,0]=4 8566 B13R2.669 CSc1ccc2onc(c2c1)N 62a_200000210301_100012356444 [0,1,0,1,0,0|2,0,0]=4 8567 B13R2.669 CSc1ccc2scc(c2c1)C 62a_200000210301_100009814196 [0,1,0,1,0,0|1,1,0]=4 8568 B13R2.669 CSc1cnc2c(c1)C(=O)CC2 62a_100010174022_200000210301 [0,1,0,1,0,0|2,0,0]=4 8569 B13R2.669 CSc1cnc2c(c1)C(=O)CC2 62a_200000210301_100010174022 [0,1,0,1,0,0|2,0,0]=4 8570 B13R2.669 Cc1c[nH]c2c1cc(cc2)O[13CH3] 34a_100000131216_200025704644 [0,1,0,1,0,0|2,0,0]=4 8571 B13R2.669 Cc1c[nH]c2c1cc(cc2)S[13CH3] 62a_200025704644_100009816687 [0,1,0,1,0,0|2,0,0]=4 8572 B13R2.669 Cc1coc2c1cc(cc2)S[13CH3] 62a_200025704644_100000728893 [0,1,0,1,0,0|1,0,0]=3 8573 B13R2.669 Cc1csc2c1cc(cc2)S[13CH3] 62a_200025704644_100009814196 [0,1,0,1,0,0|1,1,0]=4 8574 B13R2.669 Cc1n[nH]c2c1cc(cc2)S[13CH3] 62a_200025704644_100102524909 [0,1,0,1,0,0|2,0,0]=4 8575 B13R2.669 Cc1noc2c1cc(cc2)N[13CH3] 34a_200000044492_200025704644 [0,1,0,1,0,0|1,0,0]=3 8576 B13R2.669 Cc1noc2c1cc(cc2)S[13CH3] 62a_100010196875_200025704644 [0,1,0,1,0,0|1,0,0]=3 8577 B13R2.669 Cc1noc2c1cc(cc2)S[13CH3] 62a_200025704644_100010196875 [0,1,0,1,0,0|1,0,0]=3 8578 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_200025704644 [0,1,0,1,0,0|1,0,0]=3 8579 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_200025704644 [0,1,0,1,0,0|1,0,0]=3 8580 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)NC2 34a_100000087830_200025704644 [0,1,0,1,0,0|2,0,0]=4 8581 B13R2.669 [13CH3]Sc1ccc2[nH][nH]c(=O)c2c1 62a_200025704644_100012353726 [0,1,0,1,0,0|2,0,0]=4 8582 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_100000759401_200025704644 [0,1,0,1,0,0|1,0,0]=3 8583 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_200025704644_100000759401 [0,1,0,1,0,0|1,0,0]=3 8584 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CO2 62a_200025704644_100000752586 [0,1,0,1,0,0|0,0,0]=2 8585 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_100000688121_200025704644 [0,1,0,1,0,0|2,0,0]=4 8586 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_200025704644_100000688121 [0,1,0,1,0,0|2,0,0]=4 8587 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)OC2 62a_100000693025_200025704644 [0,1,0,1,0,0|2,0,0]=4 8588 B13R2.669 [13CH3]Sc1ccc2c(n1)C(=O)CC2 62a_100000701527_200025704644 [0,1,0,1,0,0|2,0,0]=4 8589 B13R2.669 [13CH3]Sc1ccc2c(n1)C(=O)CC2 62a_200025704644_100000701527 [0,1,0,1,0,0|2,0,0]=4 8590 B13R2.669 [13CH3]Sc1ccc2o[nH]c(=O)c2c1 62a_200025704644_100000732257 [0,1,0,1,0,0|1,0,0]=3 8591 B13R2.669 [13CH3]Sc1ccc2onc(c2c1)N 62a_100012356444_200025704644 [0,1,0,1,0,0|2,0,0]=4 8592 B13R2.669 [13CH3]Sc1ccc2onc(c2c1)N 62a_200025704644_100012356444 [0,1,0,1,0,0|2,0,0]=4 8593 B13R2.669 [13CH3]Sc1cnc2c(c1)C(=O)CC2 62a_100010174022_200025704644 [0,1,0,1,0,0|2,0,0]=4 8594 B13R2.669 [13CH3]Sc1cnc2c(c1)C(=O)CC2 62a_200025704644_100010174022 [0,1,0,1,0,0|2,0,0]=4 8595 B13R2.2169 CCc1ccc(c(c1)C2CC2)O 271570a_100011220607_100012339963 [0,1,0,1,0,0|1,0,1]=4 8596 B13R2.2169 COc1ccc(c(c1)C2CC2)O 271570a_100011220607_100000685887 [0,1,0,1,0,0|1,0,1]=4 8597 B13R2.2169 OCc1ccc(c(c1)C2CC2)O 271570a_100011220607_100011191544 [0,1,0,1,0,0|1,0,1]=4 8598 B13R2.3742 Cc1cc(c2c(c1)C(=O)CC2)O 271570a_203496583355_200012347971 [0,1,0,1,0,0|1,0,0]=3 8599 B13R2.3742 Cc1cc(cc2c1CCC2=O)O 271570a_203496583355_200010133532 [0,1,0,1,0,0|2,0,0]=4 8600 B13R2.3742 O=C1CCc2c1cc(cc2F)O 271570a_203496583355_100000751134 [0,1,0,1,0,0|2,0,0]=4 8601 B13R2.3742 O=C1CCc2c1cc(cc2O)F 271570a_203496583355_100012355282 [0,1,0,1,0,0|2,0,0]=4 8602 B13R2.11035 Cc1cc(c(c(c1)C2CC2)O)C 271570a_100011220607_100011934984 [0,1,0,1,0,0|1,0,1]=4 8603 B13R2.11035 Cc1cc(c(c(c1)C2CC2)O)F 271570a_100011220607_200135191068 [0,1,0,1,0,0|1,0,1]=4 8604 B13R2.3790 Nc1ccc2c(c1O)C(=O)CC2 271570a_203496583355_100010218033 [0,1,0,1,0,0|2,0,0]=4 8605 B13R2.3790 O=C1CCc2c1c(c(cc2)F)O 271570a_203496583355_200010133456 [0,1,0,1,0,0|2,0,0]=4 8606 B9R1.22 Cc1cc(c(s1)C=O)O 271570a_203496583355_100011361552 [1,0,0,0,1,0|1,0,0]=3 8607 B9R1.27 Cn1cnc(c1C=O)O 271570a_203496583355_200000040309 [1,0,0,0,1,0|2,0,0]=4 8608 B9R1.27 Cn1ncc(c1C=O)O 271570a_203496583355_100000763672 [1,0,0,0,1,0|2,0,0]=4 8609 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [1,0,0,0,1,0|1,0,0]=3 8610 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [1,0,0,0,1,0|2,0,0]=4 8611 B9R1.41 NC(=O)c1cscc1O 271570a_203496583355_100009817205 [1,0,0,0,1,0|2,0,0]=4 8612 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [1,0,0,0,1,0|2,0,0]=4 8613 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [1,0,0,0,1,0|2,0,0]=4 8614 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [1,0,0,0,1,0|2,0,0]=4 8615 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [1,0,0,0,1,0|2,0,0]=4 8616 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [1,0,0,0,1,0|2,0,0]=4 8617 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [1,0,0,0,1,0|2,0,0]=4 8618 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [1,0,0,0,1,0|2,0,0]=4 8619 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [1,0,0,0,1,0|2,0,0]=4 8620 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [1,0,0,0,0,1|2,0,0]=4 8621 B11R1.157 CC(=Cc1ccc[n+](c1)C)C 271570a_100102525489_100009996589 [1,0,0,0,0,1|2,0,0]=4 8622 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [1,0,0,0,0,1|2,0,0]=4 8623 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [1,0,0,0,0,1|1,0,0]=3 8624 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [1,0,0,0,0,1|2,0,0]=4 8625 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [1,0,0,0,0,1|2,0,0]=4 8626 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [1,0,0,0,0,1|2,0,0]=4 8627 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [1,0,0,0,0,1|2,0,0]=4 8628 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [1,0,0,0,0,1|2,0,0]=4 8629 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [1,0,0,0,0,1|2,0,0]=4 8630 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [1,0,0,0,0,1|2,0,0]=4 8631 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [1,0,0,0,0,1|2,0,0]=4 8632 B11R1.157 CC(=O)Cc1cc(ccn1)Br 1458a_100000070787_100010173614 [1,0,0,0,0,1|2,0,0]=4 8633 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [1,0,0,0,0,1|1,0,0]=3 8634 B11R1.157 CC(=O)Cc1cc(ccn1)Cl 1458a_100000070787_100016988179 [1,0,0,0,0,1|2,0,0]=4 8635 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [1,0,0,0,0,1|1,0,0]=3 8636 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [1,0,0,0,0,1|1,0,0]=3 8637 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [1,0,0,0,0,1|0,0,0]=2 8638 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [1,0,0,0,0,1|0,0,0]=2 8639 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [1,0,0,0,0,1|1,0,0]=3 8640 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [1,0,0,0,0,1|1,0,0]=3 8641 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [1,0,0,0,0,1|1,0,0]=3 8642 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [1,0,0,0,0,1|1,0,0]=3 8643 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [1,0,0,0,0,1|1,0,0]=3 8644 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [1,0,0,0,0,1|1,0,0]=3 8645 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,0,0,0,0,1|1,0,0]=3 8646 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,0,0,0,0,1|1,0,0]=3 8647 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,0,0,0,0,1|1,0,0]=3 8648 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100000070787_100009889011 [1,0,0,0,0,1|2,0,0]=4 8649 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000210301 [1,0,0,0,0,1|2,0,0]=4 8650 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [1,0,0,0,0,1|1,0,0]=3 8651 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [1,0,0,0,0,1|1,0,0]=3 8652 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000070787_100000086093 [1,0,0,0,0,1|2,0,0]=4 8653 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000210301 [1,0,0,0,0,1|2,0,0]=4 8654 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000070787_100009819644 [1,0,0,0,0,1|2,0,0]=4 8655 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000096803_200000210301 [1,0,0,0,0,1|2,0,0]=4 8656 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100000070787_100010243470 [1,0,0,0,0,1|2,0,0]=4 8657 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000210301 [1,0,0,0,0,1|2,0,0]=4 8658 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [1,0,0,0,0,1|1,0,0]=3 8659 B11R1.157 CC(=O)Cc1ccnc(c1)Cl 1458a_100000070787_100000764220 [1,0,0,0,0,1|2,0,0]=4 8660 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000070787_100011740620 [1,0,0,0,0,1|2,0,0]=4 8661 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000210301 [1,0,0,0,0,1|2,0,0]=4 8662 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [1,0,0,0,0,1|1,0,0]=3 8663 B11R1.157 CC(=O)Cc1cncc(c1)Cl 1458a_100000070787_100016992070 [1,0,0,0,0,1|2,0,0]=4 8664 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100000070787_100000725299 [1,0,0,0,0,1|2,0,0]=4 8665 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100011667516_200000210301 [1,0,0,0,0,1|2,0,0]=4 8666 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [1,0,0,0,0,1|2,0,0]=4 8667 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [1,0,0,0,0,1|1,0,0]=3 8668 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [1,0,0,0,0,1|1,0,0]=3 8669 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [1,0,0,0,0,1|1,0,0]=3 8670 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [1,0,0,0,0,1|1,0,0]=3 8671 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [1,0,0,0,0,1|0,0,0]=2 8672 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [1,0,0,0,0,1|0,0,0]=2 8673 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [1,0,0,0,0,1|0,0,0]=2 8674 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [1,0,0,0,0,1|0,0,0]=2 8675 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [1,0,0,0,0,1|1,0,0]=3 8676 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [1,0,0,0,0,1|1,0,0]=3 8677 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [1,0,0,0,0,1|1,0,0]=3 8678 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [1,0,0,0,0,1|1,0,0]=3 8679 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [1,0,0,0,0,1|1,0,0]=3 8680 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [1,0,0,0,0,1|1,0,0]=3 8681 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [1,0,0,0,0,1|1,0,0]=3 8682 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [1,0,0,0,0,1|1,0,0]=3 8683 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [1,0,0,0,0,1|1,0,0]=3 8684 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [1,0,0,0,0,1|1,0,0]=3 8685 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [1,0,0,0,0,1|1,0,0]=3 8686 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [1,0,0,0,0,1|1,0,0]=3 8687 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [1,0,0,0,0,1|1,0,0]=3 8688 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [1,0,0,0,0,1|1,0,0]=3 8689 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [1,0,0,0,0,1|1,0,0]=3 8690 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [1,0,0,0,0,1|2,0,0]=4 8691 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [1,0,0,0,0,1|2,0,0]=4 8692 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [1,0,0,0,0,1|2,0,0]=4 8693 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [1,0,0,0,0,1|1,0,0]=3 8694 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [1,0,0,0,0,1|0,0,0]=2 8695 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [1,0,0,0,0,1|2,0,0]=4 8696 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [1,0,0,0,0,1|2,0,0]=4 8697 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [1,0,0,0,0,1|2,0,0]=4 8698 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [1,0,0,0,0,1|2,0,0]=4 8699 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [1,0,0,0,0,1|2,0,0]=4 8700 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [1,0,0,0,0,1|2,0,0]=4 8701 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [1,0,0,0,0,1|2,0,0]=4 8702 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [1,0,0,0,0,1|2,0,0]=4 8703 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [1,0,0,0,0,1|2,0,0]=4 8704 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [1,0,0,0,0,1|1,0,1]=4 8705 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [1,0,0,0,0,1|1,0,1]=4 8706 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [1,0,0,0,0,1|1,0,1]=4 8707 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [1,0,0,0,0,1|1,0,1]=4 8708 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [1,0,0,0,0,1|1,0,1]=4 8709 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [1,0,0,0,0,1|1,0,1]=4 8710 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [1,0,0,0,0,1|1,0,0]=3 8711 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [1,0,0,0,0,1|2,0,0]=4 8712 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [1,0,0,0,0,1|2,0,0]=4 8713 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [1,0,0,0,0,1|1,0,0]=3 8714 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [1,0,0,0,0,1|1,0,0]=3 8715 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [1,0,0,0,0,1|1,0,0]=3 8716 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [1,0,0,0,0,1|1,0,0]=3 8717 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,0,0,0,0,1|1,0,0]=3 8718 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Br 1458a_100010201708_200025704644 [1,0,0,0,0,1|2,0,0]=4 8719 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200025704644 [1,0,0,0,0,1|2,0,0]=4 8720 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)F 1458a_100000096803_200025704644 [1,0,0,0,0,1|2,0,0]=4 8721 B11R1.157 [13CH3]C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200025704644 [1,0,0,0,0,1|2,0,0]=4 8722 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)Br 1458a_100000239331_200025704644 [1,0,0,0,0,1|2,0,0]=4 8723 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)F 1458a_100011667516_200025704644 [1,0,0,0,0,1|2,0,0]=4 8724 B13R1.893 C=C(C)CNc1cc(ccc1Br)C 34a_100000745044_100000748629 [0,0,0,0,0,2|2,0,0]=4 8725 B13R1.893 C=C(C)CNc1cc(ccc1C)C 2230a_100000185781_100000748629 [0,0,0,0,0,2|2,0,0]=4 8726 B13R1.893 C=C(C)CNc1cc(ccc1C)C 34a_100000185781_100000748629 [0,0,0,0,0,2|2,0,0]=4 8727 B13R1.893 C=C(C)CNc1cc(ccc1C)C 7a_100000185781_100000748629 [0,0,0,0,0,2|2,0,0]=4 8728 B13R1.893 C=C(C)CNc1cc(ccc1Cl)C 34a_100011215360_100000748629 [0,0,0,0,0,2|2,0,0]=4 8729 B13R1.893 C=C(C)CNc1cc(ccc1F)C 34a_100000211285_100000748629 [0,0,0,0,0,2|2,0,0]=4 8730 B13R1.893 C=C(C)CNc1cc(ccc1I)C 34a_100011216686_100000748629 [0,0,0,0,0,2|2,0,0]=4 8731 B13R1.893 C=C(C)CNc1cc(ccc1O)Br 34a_100000752626_100000748629 [0,0,0,0,0,2|2,0,0]=4 8732 B13R1.893 C=C(C)CNc1cc(ccc1O)C 34a_100011215204_100000748629 [0,0,0,0,0,2|1,0,0]=3 8733 B13R1.893 C=C(C)CNc1cc(ccc1O)Cl 34a_100000210500_100000748629 [0,0,0,0,0,2|2,0,0]=4 8734 B13R1.893 C=C(C)CNc1cc(ccc1O)F 34a_100000759472_100000748629 [0,0,0,0,0,2|2,0,0]=4 8735 B13R1.893 C=C(C)COc1cc(ccc1Br)C 34a_100012002257_100000748629 [0,0,0,0,0,2|2,0,0]=4 8736 B13R1.893 C=C(C)COc1cc(ccc1Br)C 7a_100012002257_100000748629 [0,0,0,0,0,2|2,0,0]=4 8737 B13R1.893 C=C(C)COc1cc(ccc1C)C 34a_100000210931_100000748629 [0,0,0,0,0,2|2,0,0]=4 8738 B13R1.893 C=C(C)COc1cc(ccc1C)C 7a_100000210931_100000748629 [0,0,0,0,0,2|2,0,0]=4 8739 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 34a_100000211493_100000748629 [0,0,0,0,0,2|2,0,0]=4 8740 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 7a_100000211493_100000748629 [0,0,0,0,0,2|2,0,0]=4 8741 B13R1.893 C=C(C)COc1cc(ccc1F)C 34a_100000759540_100000748629 [0,0,0,0,0,2|2,0,0]=4 8742 B13R1.893 C=C(C)COc1cc(ccc1F)C 7a_100000759540_100000748629 [0,0,0,0,0,2|2,0,0]=4 8743 B13R1.893 C=C(C)COc1cc(ccc1N)C 34a_100000211527_100000748629 [0,0,0,0,0,2|2,0,0]=4 8744 B13R1.893 C=C(C)COc1cc(ccc1N)C 7a_100000211527_100000748629 [0,0,0,0,0,2|2,0,0]=4 8745 B13R1.893 C=C(C)CSc1cc(ccc1Br)C 62a_100000748629_100012353751 [0,0,0,0,0,2|2,0,0]=4 8746 B13R1.893 C=C(C)CSc1cc(ccc1Br)C 62a_100012353751_100000211660 [0,0,0,0,0,2|2,0,0]=4 8747 B13R1.893 C=C(C)CSc1cc(ccc1C)C 62a_100000210833_100000211660 [0,0,0,0,0,2|2,0,0]=4 8748 B13R1.893 C=C(C)CSc1cc(ccc1C)C 62a_100000748629_100000210833 [0,0,0,0,0,2|2,0,0]=4 8749 B13R1.893 C=C(C)CSc1cc(ccc1Cl)C 62a_100000748629_100012356289 [0,0,0,0,0,2|2,0,0]=4 8750 B13R1.893 C=C(C)CSc1cc(ccc1Cl)C 62a_100012356289_100000211660 [0,0,0,0,0,2|2,0,0]=4 8751 B13R1.893 C=C(C)CSc1cc(ccc1F)C 62a_100000736223_100000211660 [0,0,0,0,0,2|2,0,0]=4 8752 B13R1.893 C=C(C)CSc1cc(ccc1F)C 62a_100000748629_100000736223 [0,0,0,0,0,2|2,0,0]=4 8753 B13R1.893 C=C(C)CSc1cc(ccc1N)C 62a_100000748629_100011356834 [0,0,0,0,0,2|2,0,0]=4 8754 B13R1.893 C=C(C)CSc1cc(ccc1N)C 62a_100011356834_100000211660 [0,0,0,0,0,2|2,0,0]=4 8755 B13R1.893 C=C(C)CSc1cc(ccc1O)Br 62a_100000748629_100012355227 [0,0,0,0,0,2|2,0,0]=4 8756 B13R1.893 C=C(C)CSc1cc(ccc1O)Br 62a_100012355227_100000211660 [0,0,0,0,0,2|2,0,0]=4 8757 B13R1.893 C=C(C)CSc1cc(ccc1O)C 62a_100000748629_100000765521 [0,0,0,0,0,2|1,0,0]=3 8758 B13R1.893 C=C(C)CSc1cc(ccc1O)C 62a_100000765521_100000211660 [0,0,0,0,0,2|1,0,0]=3 8759 B13R1.893 C=C(C)CSc1cc(ccc1O)Cl 62a_100000748629_100011356953 [0,0,0,0,0,2|2,0,0]=4 8760 B13R1.893 C=C(C)CSc1cc(ccc1O)Cl 62a_100011356953_100000211660 [0,0,0,0,0,2|2,0,0]=4 8761 B13R1.893 C=C(C)CSc1cc(ccc1O)F 62a_100000211999_100000211660 [0,0,0,0,0,2|2,0,0]=4 8762 B13R1.893 C=C(C)CSc1cc(ccc1O)F 62a_100000748629_100000211999 [0,0,0,0,0,2|2,0,0]=4 8763 B13R1.893 C=C(C)CSc1cc(ccc1O)N 62a_100000748629_100011534360 [0,0,0,0,0,2|2,0,0]=4 8764 B13R1.893 C=C(C)CSc1cc(ccc1O)N 62a_100011534360_100000211660 [0,0,0,0,0,2|2,0,0]=4 8765 B13R1.893 C=C(C)CSc1cc(ccc1O)O 62a_100000748629_100009813629 [0,0,0,0,0,2|2,0,0]=4 8766 B13R1.893 C=C(C)CSc1cc(cnc1O)C 62a_100000719714_100000211660 [0,0,0,0,0,2|2,0,0]=4 8767 B13R1.893 C=C(C)CSc1cc(cnc1O)C 62a_100000748629_100000719714 [0,0,0,0,0,2|2,0,0]=4 8768 B13R1.893 C=C(C)CSc1cc(ncc1O)C 62a_100000748629_100009843476 [0,0,0,0,0,2|2,0,0]=4 8769 B13R1.893 C=C(C)CSc1cc(ncc1O)C 62a_100009843476_100000211660 [0,0,0,0,0,2|2,0,0]=4 8770 B13R1.893 C=C(C)CSc1nc(ccc1O)C 62a_100000702858_100000211660 [0,0,0,0,0,2|2,0,0]=4 8771 B13R1.893 C=C(C)CSc1nc(ccc1O)C 62a_100000748629_100000702858 [0,0,0,0,0,2|2,0,0]=4 8772 B13R1.893 C=C(F)CNc1cc(ccc1O)C 34a_100011215204_100009893438 [0,0,0,0,0,2|1,0,1]=4 8773 B13R1.893 C=C(F)CSc1cc(ccc1O)C 62a_100000042424_100000765521 [0,0,0,0,0,2|1,0,1]=4 8774 B13R1.893 C=C(F)CSc1cc(ccc1O)C 62a_100000765521_100000042424 [0,0,0,0,0,2|1,0,1]=4 8775 B13R1.893 CC(=O)C=Cc1cc(ccc1Br)F 1458a_100102525183_200000210301 [0,0,0,0,0,2|2,0,0]=4 8776 B13R1.893 CC(=O)C=Cc1cc(ccc1Cl)Cl 1458a_100000234794_200000210301 [0,0,0,0,0,2|2,0,0]=4 8777 B13R1.893 CC(=O)C=Cc1cc(ccc1F)Br 1458a_100000718207_200000210301 [0,0,0,0,0,2|2,0,0]=4 8778 B13R1.893 CC(=O)C=Cc1cc(ccc1F)C 1458a_100102526132_200000210301 [0,0,0,0,0,2|1,0,0]=3 8779 B13R1.893 CC(=O)C=Cc1cc(ccc1F)F 1458a_100000744626_200000210301 [0,0,0,0,0,2|2,0,0]=4 8780 B13R1.893 CC(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200000210301 [0,0,0,0,0,2|2,0,0]=4 8781 B13R1.893 CC(=O)CCc1cc(ccc1C)C 1458a_100011485725_200000210301 [0,0,0,0,0,2|1,0,0]=3 8782 B13R1.893 CC(=O)CCc1cc(ccc1C)F 1458a_100011830270_200000210301 [0,0,0,0,0,2|2,0,0]=4 8783 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200000210301 [0,0,0,0,0,2|2,0,0]=4 8784 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200000210301 [0,0,0,0,0,2|2,0,0]=4 8785 B13R1.893 CC(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200000210301 [0,0,0,0,0,2|2,0,0]=4 8786 B13R1.893 CC(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200000210301 [0,0,0,0,0,2|2,0,0]=4 8787 B13R1.893 CC(=O)CCc1cc(ccc1F)C 1458a_100011934859_200000210301 [0,0,0,0,0,2|1,0,0]=3 8788 B13R1.893 CC(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200000210301 [0,0,0,0,0,2|2,0,0]=4 8789 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000070787_100011755056 [0,0,0,0,0,2|2,0,0]=4 8790 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000744313_200000210301 [0,0,0,0,0,2|2,0,0]=4 8791 B13R1.893 CC(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200000210301 [0,0,0,0,0,2|2,0,0]=4 8792 B13R1.893 CC(=O)COc1cc(ccc1C)C 1458a_100000182428_200000210301 [0,0,0,0,0,2|1,0,0]=3 8793 B13R1.893 CC(=O)COc1cc(ccc1Cl)C 1458a_100000183693_200000210301 [0,0,0,0,0,2|1,0,0]=3 8794 B13R1.893 CC(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200000210301 [0,0,0,0,0,2|2,0,0]=4 8795 B13R1.893 CC(=O)COc1cc(ccc1F)F 1458a_100000752474_200000210301 [0,0,0,0,0,2|2,0,0]=4 8796 B13R1.893 CC(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200000210301 [0,0,0,0,0,2|2,0,0]=4 8797 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 11a_100000707832_100015343762 [0,0,0,0,0,2|2,0,0]=4 8798 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 1626a_100000707832_100015343762 [0,0,0,0,0,2|2,0,0]=4 8799 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 240690a_100000707832_100015343762 [0,0,0,0,0,2|2,0,0]=4 8800 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 527a_100000707832_100103153847 [0,0,0,0,0,2|2,0,0]=4 8801 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 11a_100000742738_100015343762 [0,0,0,0,0,2|2,0,0]=4 8802 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 1626a_100000742738_100015343762 [0,0,0,0,0,2|2,0,0]=4 8803 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 240690a_100000742738_100015343762 [0,0,0,0,0,2|2,0,0]=4 8804 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 527a_100000742738_100103153847 [0,0,0,0,0,2|2,0,0]=4 8805 B13R1.893 CC(=O)NCc1cc(ccc1C)C 11a_100000174964_100015343762 [0,0,0,0,0,2|1,0,0]=3 8806 B13R1.893 CC(=O)NCc1cc(ccc1C)C 1626a_100000174964_100015343762 [0,0,0,0,0,2|1,0,0]=3 8807 B13R1.893 CC(=O)NCc1cc(ccc1C)C 240690a_100000174964_100015343762 [0,0,0,0,0,2|1,0,0]=3 8808 B13R1.893 CC(=O)NCc1cc(ccc1C)C 527a_100000174964_100103153847 [0,0,0,0,0,2|1,0,0]=3 8809 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 11a_100000717755_100015343762 [0,0,0,0,0,2|2,0,0]=4 8810 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 1626a_100000717755_100015343762 [0,0,0,0,0,2|2,0,0]=4 8811 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 240690a_100000717755_100015343762 [0,0,0,0,0,2|2,0,0]=4 8812 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 527a_100000717755_100103153847 [0,0,0,0,0,2|2,0,0]=4 8813 B13R1.893 CC(=O)NCc1cc(ccc1C)F 11a_100011217291_100015343762 [0,0,0,0,0,2|2,0,0]=4 8814 B13R1.893 CC(=O)NCc1cc(ccc1C)F 1626a_100011217291_100015343762 [0,0,0,0,0,2|2,0,0]=4 8815 B13R1.893 CC(=O)NCc1cc(ccc1C)F 240690a_100011217291_100015343762 [0,0,0,0,0,2|2,0,0]=4 8816 B13R1.893 CC(=O)NCc1cc(ccc1C)F 527a_100011217291_100103153847 [0,0,0,0,0,2|2,0,0]=4 8817 B13R1.893 CC(=O)NCc1cc(ccc1C)O 240690a_200009844824_100015343762 [0,0,0,0,0,2|2,0,0]=4 8818 B13R1.893 CC(=O)NCc1cc(ccc1C)O 527a_200009844824_100103153847 [0,0,0,0,0,2|2,0,0]=4 8819 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 11a_100025772652_100015343762 [0,0,0,0,0,2|2,0,0]=4 8820 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 1626a_100025772652_100015343762 [0,0,0,0,0,2|2,0,0]=4 8821 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 240690a_100025772652_100015343762 [0,0,0,0,0,2|2,0,0]=4 8822 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 527a_100025772652_100103153847 [0,0,0,0,0,2|2,0,0]=4 8823 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 11a_100025705715_100015343762 [0,0,0,0,0,2|1,0,0]=3 8824 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 1626a_100025705715_100015343762 [0,0,0,0,0,2|1,0,0]=3 8825 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 240690a_100025705715_100015343762 [0,0,0,0,0,2|1,0,0]=3 8826 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 527a_100025705715_100103153847 [0,0,0,0,0,2|1,0,0]=3 8827 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 11a_100102946428_100015343762 [0,0,0,0,0,2|2,0,0]=4 8828 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 1626a_100102946428_100015343762 [0,0,0,0,0,2|2,0,0]=4 8829 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 240690a_100102946428_100015343762 [0,0,0,0,0,2|2,0,0]=4 8830 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 527a_100102946428_100103153847 [0,0,0,0,0,2|2,0,0]=4 8831 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 11a_100011830483_100015343762 [0,0,0,0,0,2|2,0,0]=4 8832 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 1626a_100011830483_100015343762 [0,0,0,0,0,2|2,0,0]=4 8833 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 240690a_100011830483_100015343762 [0,0,0,0,0,2|2,0,0]=4 8834 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 527a_100011830483_100103153847 [0,0,0,0,0,2|2,0,0]=4 8835 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 11a_100009815772_100015343762 [0,0,0,0,0,2|2,0,0]=4 8836 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 1626a_100009815772_100015343762 [0,0,0,0,0,2|2,0,0]=4 8837 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 240690a_100009815772_100015343762 [0,0,0,0,0,2|2,0,0]=4 8838 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 527a_100009815772_100103153847 [0,0,0,0,0,2|2,0,0]=4 8839 B13R1.893 CC(=O)NCc1cc(ccc1F)C 11a_100102693586_100015343762 [0,0,0,0,0,2|1,0,0]=3 8840 B13R1.893 CC(=O)NCc1cc(ccc1F)C 1626a_100102693586_100015343762 [0,0,0,0,0,2|1,0,0]=3 8841 B13R1.893 CC(=O)NCc1cc(ccc1F)C 240690a_100102693586_100015343762 [0,0,0,0,0,2|1,0,0]=3 8842 B13R1.893 CC(=O)NCc1cc(ccc1F)C 527a_100102693586_100103153847 [0,0,0,0,0,2|1,0,0]=3 8843 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 11a_100011211646_100015343762 [0,0,0,0,0,2|2,0,0]=4 8844 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 1626a_100011211646_100015343762 [0,0,0,0,0,2|2,0,0]=4 8845 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 240690a_100011211646_100015343762 [0,0,0,0,0,2|2,0,0]=4 8846 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 527a_100011211646_100103153847 [0,0,0,0,0,2|2,0,0]=4 8847 B13R1.893 CC(=O)NCc1cc(ccc1F)F 11a_100000752317_100015343762 [0,0,0,0,0,2|2,0,0]=4 8848 B13R1.893 CC(=O)NCc1cc(ccc1F)F 1626a_100000752317_100015343762 [0,0,0,0,0,2|2,0,0]=4 8849 B13R1.893 CC(=O)NCc1cc(ccc1F)F 240690a_100000752317_100015343762 [0,0,0,0,0,2|2,0,0]=4 8850 B13R1.893 CC(=O)NCc1cc(ccc1F)F 527a_100000752317_100103153847 [0,0,0,0,0,2|2,0,0]=4 8851 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 240690a_100000730032_100015343762 [0,0,0,0,0,2|1,0,0]=3 8852 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 527a_100000730032_100103153847 [0,0,0,0,0,2|1,0,0]=3 8853 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 240690a_100000238540_100015343762 [0,0,0,0,0,2|1,0,0]=3 8854 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 527a_100000238540_100103153847 [0,0,0,0,0,2|1,0,0]=3 8855 B13R1.893 CC(=O)NNc1cc(ccc1Br)Br 22a_200011483129_100000070787 [0,0,0,0,0,2|2,0,0]=4 8856 B13R1.893 CC(=O)NNc1cc(ccc1Br)F 22a_100012362518_100000070787 [0,0,0,0,0,2|2,0,0]=4 8857 B13R1.893 CC(=O)NNc1cc(ccc1C)C 22a_100000683361_100000070787 [0,0,0,0,0,2|1,0,0]=3 8858 B13R1.893 CC(=O)NNc1cc(ccc1C)Cl 22a_100020587667_100000070787 [0,0,0,0,0,2|2,0,0]=4 8859 B13R1.893 CC(=O)NNc1cc(ccc1C)F 22a_100011206524_100000070787 [0,0,0,0,0,2|2,0,0]=4 8860 B13R1.893 CC(=O)NNc1cc(ccc1Cl)C 22a_200020642191_100000070787 [0,0,0,0,0,2|1,0,0]=3 8861 B13R1.893 CC(=O)NNc1cc(ccc1Cl)Cl 22a_100000765587_100000070787 [0,0,0,0,0,2|2,0,0]=4 8862 B13R1.893 CC(=O)NNc1cc(ccc1Cl)F 22a_100016987657_100000070787 [0,0,0,0,0,2|2,0,0]=4 8863 B13R1.893 CC(=O)NNc1cc(ccc1F)Br 22a_100020610843_100000070787 [0,0,0,0,0,2|2,0,0]=4 8864 B13R1.893 CC(=O)NNc1cc(ccc1F)C 22a_100011248256_100000070787 [0,0,0,0,0,2|1,0,0]=3 8865 B13R1.893 CC(=O)NNc1cc(ccc1F)Cl 22a_100016987663_100000070787 [0,0,0,0,0,2|2,0,0]=4 8866 B13R1.893 CC(=O)NNc1cc(ccc1F)F 22a_100000005413_100000070787 [0,0,0,0,0,2|2,0,0]=4 8867 B13R1.893 Cc1cc(c(cn1)O)SCC(=O)N 62a_100000747473_100009843476 [0,0,0,0,0,2|2,0,0]=4 8868 B13R1.893 Cc1cc(c(cn1)O)SCC(=O)N 62a_100009843476_100000747473 [0,0,0,0,0,2|2,0,0]=4 8869 B13R1.893 Cc1cc(c(cn1)O)SCC(=O)[O-] 62a_100009843476_100020667443 [0,0,0,0,0,2|2,0,0]=4 8870 B13R1.893 Cc1cc(c(cn1)O)SCC(=O)[O-] 62a_100020667443_100009843476 [0,0,0,0,0,2|2,0,0]=4 8871 B13R1.893 Cc1ccc(c(c1)C=CC(=O)[13CH3])F 1458a_100102526132_200025704644 [0,0,0,0,0,2|1,0,0]=3 8872 B13R1.893 Cc1ccc(c(c1)C=CC(C)C)O 271570a_100016257149_100000765521 [0,0,0,0,0,2|1,0,1]=4 8873 B13R1.893 Cc1ccc(c(c1)C=CC(C)O)O 271570a_200011019289_100000765521 [0,0,0,0,0,2|0,0,2]=4 8874 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])C 1458a_100011485725_200025704644 [0,0,0,0,0,2|1,0,0]=3 8875 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])F 1458a_100011934859_200025704644 [0,0,0,0,0,2|1,0,0]=3 8876 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)Br 34a_100000745044_100000187820 [0,0,0,0,0,2|2,0,0]=4 8877 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)C 2230a_100000185781_100000747473 [0,0,0,0,0,2|2,0,0]=4 8878 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)C 34a_100000185781_100000187820 [0,0,0,0,0,2|2,0,0]=4 8879 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)C 7a_100000185781_100000187820 [0,0,0,0,0,2|2,0,0]=4 8880 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)Cl 34a_100011215360_100000187820 [0,0,0,0,0,2|2,0,0]=4 8881 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)F 34a_100000211285_100000187820 [0,0,0,0,0,2|2,0,0]=4 8882 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)I 34a_100011216686_100000187820 [0,0,0,0,0,2|2,0,0]=4 8883 B13R1.893 Cc1ccc(c(c1)NCC(=O)N)O 34a_100011215204_100000187820 [0,0,0,0,0,2|1,0,0]=3 8884 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])Br 34a_100000745044_100020667443 [0,0,0,0,0,2|2,0,0]=4 8885 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])C 34a_100000185781_100020667443 [0,0,0,0,0,2|2,0,0]=4 8886 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])Cl 34a_100011215360_100020667443 [0,0,0,0,0,2|2,0,0]=4 8887 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])F 34a_100000211285_100020667443 [0,0,0,0,0,2|2,0,0]=4 8888 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])I 34a_100011216686_100020667443 [0,0,0,0,0,2|2,0,0]=4 8889 B13R1.893 Cc1ccc(c(c1)NCC(=O)[O-])O 34a_100011215204_100020667443 [0,0,0,0,0,2|1,0,0]=3 8890 B13R1.893 Cc1ccc(c(c1)NCC(C)C)O 34a_100011215204_100000210624 [0,0,0,0,0,2|1,0,1]=4 8891 B13R1.893 Cc1ccc(c(c1)NCC(C)O)O 34a_100011215204_100011218427 [0,0,0,0,0,2|0,0,2]=4 8892 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)O 34a_100011215204_100009817552 [0,0,0,0,0,2|0,0,2]=4 8893 B13R1.893 Cc1ccc(c(c1)NC[N+](=O)[O-])O 34a_100011215204_100000761209 [0,0,0,0,0,2|2,0,0]=4 8894 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Br 34a_100012002257_100000187820 [0,0,0,0,0,2|2,0,0]=4 8895 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Br 7a_100012002257_100000187820 [0,0,0,0,0,2|2,0,0]=4 8896 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 34a_100000210931_100000187820 [0,0,0,0,0,2|2,0,0]=4 8897 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 7a_100000210931_100000187820 [0,0,0,0,0,2|2,0,0]=4 8898 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Cl 34a_100000211493_100000187820 [0,0,0,0,0,2|2,0,0]=4 8899 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Cl 7a_100000211493_100000187820 [0,0,0,0,0,2|2,0,0]=4 8900 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)F 34a_100000759540_100000187820 [0,0,0,0,0,2|2,0,0]=4 8901 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)F 7a_100000759540_100000187820 [0,0,0,0,0,2|2,0,0]=4 8902 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)N 34a_100000211527_100000187820 [0,0,0,0,0,2|2,0,0]=4 8903 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)N 7a_100000211527_100000187820 [0,0,0,0,0,2|2,0,0]=4 8904 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])C 1458a_100000182428_200025704644 [0,0,0,0,0,2|1,0,0]=3 8905 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])Cl 1458a_100000183693_200025704644 [0,0,0,0,0,2|1,0,0]=3 8906 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])Br 34a_100012002257_100020667443 [0,0,0,0,0,2|2,0,0]=4 8907 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])C 34a_100000210931_100020667443 [0,0,0,0,0,2|2,0,0]=4 8908 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])Cl 34a_100000211493_100020667443 [0,0,0,0,0,2|2,0,0]=4 8909 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])F 34a_100000759540_100020667443 [0,0,0,0,0,2|2,0,0]=4 8910 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])N 34a_100000211527_100020667443 [0,0,0,0,0,2|2,0,0]=4 8911 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)Br 62a_100000747473_100012353751 [0,0,0,0,0,2|2,0,0]=4 8912 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)Br 62a_100012353751_100000747473 [0,0,0,0,0,2|2,0,0]=4 8913 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)C 62a_100000210833_100000747473 [0,0,0,0,0,2|2,0,0]=4 8914 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)C 62a_100000747473_100000210833 [0,0,0,0,0,2|2,0,0]=4 8915 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)Cl 62a_100000747473_100012356289 [0,0,0,0,0,2|2,0,0]=4 8916 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)Cl 62a_100012356289_100000747473 [0,0,0,0,0,2|2,0,0]=4 8917 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)F 62a_100000736223_100000747473 [0,0,0,0,0,2|2,0,0]=4 8918 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)F 62a_100000747473_100000736223 [0,0,0,0,0,2|2,0,0]=4 8919 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)N 62a_100000747473_100011356834 [0,0,0,0,0,2|2,0,0]=4 8920 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)N 62a_100011356834_100000747473 [0,0,0,0,0,2|2,0,0]=4 8921 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)O 62a_100000747473_100000765521 [0,0,0,0,0,2|1,0,0]=3 8922 B13R1.893 Cc1ccc(c(c1)SCC(=O)N)O 62a_100000765521_100000747473 [0,0,0,0,0,2|1,0,0]=3 8923 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])Br 62a_100012353751_100020667443 [0,0,0,0,0,2|2,0,0]=4 8924 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])Br 62a_100020667443_100012353751 [0,0,0,0,0,2|2,0,0]=4 8925 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])C 62a_100000210833_100020667443 [0,0,0,0,0,2|2,0,0]=4 8926 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])C 62a_100020667443_100000210833 [0,0,0,0,0,2|2,0,0]=4 8927 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])Cl 62a_100012356289_100020667443 [0,0,0,0,0,2|2,0,0]=4 8928 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])Cl 62a_100020667443_100012356289 [0,0,0,0,0,2|2,0,0]=4 8929 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])F 62a_100000736223_100020667443 [0,0,0,0,0,2|2,0,0]=4 8930 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])F 62a_100020667443_100000736223 [0,0,0,0,0,2|2,0,0]=4 8931 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])N 62a_100011356834_100020667443 [0,0,0,0,0,2|2,0,0]=4 8932 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])N 62a_100020667443_100011356834 [0,0,0,0,0,2|2,0,0]=4 8933 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])O 62a_100000765521_100020667443 [0,0,0,0,0,2|1,0,0]=3 8934 B13R1.893 Cc1ccc(c(c1)SCC(=O)[O-])O 62a_100020667443_100000765521 [0,0,0,0,0,2|1,0,0]=3 8935 B13R1.893 Cc1ccc(c(c1)SCC(C)C)O 62a_100000210624_100000765521 [0,0,0,0,0,2|1,0,1]=4 8936 B13R1.893 Cc1ccc(c(c1)SCC(C)C)O 62a_100000765521_100000210760 [0,0,0,0,0,2|1,0,1]=4 8937 B13R1.893 Cc1ccc(c(c1)SCC(C)O)O 62a_100000765521_100011218427 [0,0,0,0,0,2|0,0,2]=4 8938 B13R1.893 Cc1ccc(c(c1)SCC(C)O)O 62a_100011218427_100000765521 [0,0,0,0,0,2|0,0,2]=4 8939 B13R1.893 Cc1ccc(c(c1)SC[C@@H](C)O)O 62a_100000765521_100009817552 [0,0,0,0,0,2|0,0,2]=4 8940 B13R1.893 Cc1ccc(c(c1)SC[C@@H](C)O)O 62a_100009817552_100000765521 [0,0,0,0,0,2|0,0,2]=4 8941 B13R1.893 Cc1ccc(c(c1)SC[N+](=O)[O-])O 62a_100000765521_100000761209 [0,0,0,0,0,2|2,0,0]=4 8942 B13R1.893 Cc1ccc(c(n1)SCC(=O)N)O 62a_100000702858_100000747473 [0,0,0,0,0,2|2,0,0]=4 8943 B13R1.893 Cc1ccc(c(n1)SCC(=O)N)O 62a_100000747473_100000702858 [0,0,0,0,0,2|2,0,0]=4 8944 B13R1.893 Cc1ccc(c(n1)SCC(=O)[O-])O 62a_100000702858_100020667443 [0,0,0,0,0,2|2,0,0]=4 8945 B13R1.893 Cc1ccc(c(n1)SCC(=O)[O-])O 62a_100020667443_100000702858 [0,0,0,0,0,2|2,0,0]=4 8946 B13R1.893 Cc1ccc(cc1CCC(=O)[13CH3])F 1458a_100011830270_200025704644 [0,0,0,0,0,2|2,0,0]=4 8947 B13R1.893 Cc1cnc(c(c1)SCC(=O)N)O 62a_100000719714_100000747473 [0,0,0,0,0,2|2,0,0]=4 8948 B13R1.893 Cc1cnc(c(c1)SCC(=O)N)O 62a_100000747473_100000719714 [0,0,0,0,0,2|2,0,0]=4 8949 B13R1.893 Cc1cnc(c(c1)SCC(=O)[O-])O 62a_100000719714_100020667443 [0,0,0,0,0,2|2,0,0]=4 8950 B13R1.893 Cc1cnc(c(c1)SCC(=O)[O-])O 62a_100020667443_100000719714 [0,0,0,0,0,2|2,0,0]=4 8951 B13R1.893 NC(=O)CNc1cc(ccc1O)Br 34a_100000752626_100000187820 [0,0,0,0,0,2|2,0,0]=4 8952 B13R1.893 NC(=O)CNc1cc(ccc1O)Cl 34a_100000210500_100000187820 [0,0,0,0,0,2|2,0,0]=4 8953 B13R1.893 NC(=O)CNc1cc(ccc1O)F 34a_100000759472_100000187820 [0,0,0,0,0,2|2,0,0]=4 8954 B13R1.893 NC(=O)CSc1cc(ccc1O)Br 62a_100000747473_100012355227 [0,0,0,0,0,2|2,0,0]=4 8955 B13R1.893 NC(=O)CSc1cc(ccc1O)Br 62a_100012355227_100000747473 [0,0,0,0,0,2|2,0,0]=4 8956 B13R1.893 NC(=O)CSc1cc(ccc1O)Cl 62a_100000747473_100011356953 [0,0,0,0,0,2|2,0,0]=4 8957 B13R1.893 NC(=O)CSc1cc(ccc1O)Cl 62a_100011356953_100000747473 [0,0,0,0,0,2|2,0,0]=4 8958 B13R1.893 NC(=O)CSc1cc(ccc1O)F 62a_100000211999_100000747473 [0,0,0,0,0,2|2,0,0]=4 8959 B13R1.893 NC(=O)CSc1cc(ccc1O)F 62a_100000747473_100000211999 [0,0,0,0,0,2|2,0,0]=4 8960 B13R1.893 NC(=O)CSc1cc(ccc1O)N 62a_100000747473_100011534360 [0,0,0,0,0,2|2,0,0]=4 8961 B13R1.893 NC(=O)CSc1cc(ccc1O)N 62a_100011534360_100000747473 [0,0,0,0,0,2|2,0,0]=4 8962 B13R1.893 NC(=O)CSc1cc(ccc1O)O 62a_100000747473_100009813629 [0,0,0,0,0,2|2,0,0]=4 8963 B13R1.893 Nc1ccc(c(c1)SCC(=O)[O-])O 62a_100011534360_100020667443 [0,0,0,0,0,2|2,0,0]=4 8964 B13R1.893 Nc1ccc(c(c1)SCC(=O)[O-])O 62a_100020667443_100011534360 [0,0,0,0,0,2|2,0,0]=4 8965 B13R1.893 O=C([O-])CNc1cc(ccc1O)Br 34a_100000752626_100020667443 [0,0,0,0,0,2|2,0,0]=4 8966 B13R1.893 O=C([O-])CNc1cc(ccc1O)Cl 34a_100000210500_100020667443 [0,0,0,0,0,2|2,0,0]=4 8967 B13R1.893 O=C([O-])CNc1cc(ccc1O)F 34a_100000759472_100020667443 [0,0,0,0,0,2|2,0,0]=4 8968 B13R1.893 O=C([O-])CSc1cc(ccc1O)Br 62a_100012355227_100020667443 [0,0,0,0,0,2|2,0,0]=4 8969 B13R1.893 O=C([O-])CSc1cc(ccc1O)Br 62a_100020667443_100012355227 [0,0,0,0,0,2|2,0,0]=4 8970 B13R1.893 O=C([O-])CSc1cc(ccc1O)Cl 62a_100011356953_100020667443 [0,0,0,0,0,2|2,0,0]=4 8971 B13R1.893 O=C([O-])CSc1cc(ccc1O)Cl 62a_100020667443_100011356953 [0,0,0,0,0,2|2,0,0]=4 8972 B13R1.893 O=C([O-])CSc1cc(ccc1O)F 62a_100000211999_100020667443 [0,0,0,0,0,2|2,0,0]=4 8973 B13R1.893 O=C([O-])CSc1cc(ccc1O)F 62a_100020667443_100000211999 [0,0,0,0,0,2|2,0,0]=4 8974 B13R1.893 O=C([O-])CSc1cc(ccc1O)O 62a_100020667443_100009813629 [0,0,0,0,0,2|2,0,0]=4 8975 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1Br)F 1458a_100102525183_200025704644 [0,0,0,0,0,2|2,0,0]=4 8976 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1Cl)Cl 1458a_100000234794_200025704644 [0,0,0,0,0,2|2,0,0]=4 8977 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1F)Br 1458a_100000718207_200025704644 [0,0,0,0,0,2|2,0,0]=4 8978 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1F)F 1458a_100000744626_200025704644 [0,0,0,0,0,2|2,0,0]=4 8979 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200025704644 [0,0,0,0,0,2|2,0,0]=4 8980 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200025704644 [0,0,0,0,0,2|2,0,0]=4 8981 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200025704644 [0,0,0,0,0,2|2,0,0]=4 8982 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200025704644 [0,0,0,0,0,2|2,0,0]=4 8983 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200025704644 [0,0,0,0,0,2|2,0,0]=4 8984 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200025704644 [0,0,0,0,0,2|2,0,0]=4 8985 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)F 1458a_100000744313_200025704644 [0,0,0,0,0,2|2,0,0]=4 8986 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200025704644 [0,0,0,0,0,2|2,0,0]=4 8987 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200025704644 [0,0,0,0,0,2|2,0,0]=4 8988 B13R1.893 [13CH3]C(=O)COc1cc(ccc1F)F 1458a_100000752474_200025704644 [0,0,0,0,0,2|2,0,0]=4 8989 B13R1.893 [13CH3]C(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200025704644 [0,0,0,0,0,2|2,0,0]=4