0 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,0,0,0,0,0|1,1,1]=3 2 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,0,0,0,0,0|1,1,1]=3 3 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 34a_100011935283_200025704644 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 7a_100011935283_200025704644 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.52 CC(C)Nc1ccc(c(c1)C#N)O 34a_100011249283_100000210206 [0,0,0,0,0,0|4,0,0]=4 6 B13R1.52 CC(C)Oc1ccc(c(c1)C=O)O 271570a_203496583355_200012936200 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.52 CC(C)Sc1ccc(c(c1)C#N)O 62a_100000210206_100000687585 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.52 CC(C)Sc1ccc(c(c1)C=O)O 62a_100000210206_100000186750 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.52 CC(C)Sc1ccc(c(c1)CN)O 62a_100000210206_100000730032 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.52 CC(C)Sc1ccc(c(c1)CN)O 62a_100000730032_100000210206 [0,0,0,0,0,0|4,0,0]=4 11 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000210206 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000210206_100000184703 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.52 CCc1cc(ccc1Br)NC(C)C 2230a_100010109747_100000210206 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.52 CCc1cc(ccc1Br)NC(C)C 34a_100010109747_100000210206 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.52 CCc1cc(ccc1Br)NC(C)C 7a_100010109747_100000210206 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.52 CCc1cc(ccc1Br)SC(C)C 62a_100000210206_100010244631 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.52 CCc1cc(ccc1Br)SC(C)C 62a_100010244631_100000210206 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.52 CCc1cc(ccc1Cl)OC(C)C 34a_100000212063_100000210206 [0,0,0,0,0,0|4,0,0]=4 19 B13R1.52 CCc1cc(ccc1Cl)OC(C)C 7a_100000212063_100000210206 [0,0,0,0,0,0|4,0,0]=4 20 B13R1.52 CCc1cc(ccc1F)CN(C)C 270004a_100102631434_100009840867 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.52 CCc1cc(ccc1F)SC(C)C 62a_100000210206_100010244625 [0,0,0,0,0,0|4,0,0]=4 22 B13R1.52 CCc1cc(ccc1F)SC(C)C 62a_100010244625_100000210206 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.52 CCc1cc(ccc1N)SC(C)C 62a_100000210206_100000686106 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.52 CCc1cc(ccc1N)SC(C)C 62a_100000686106_100000210206 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.52 CCc1cc(ccc1O)C=C(C)C 271570a_100102525489_100012338938 [0,0,0,0,0,0|2,0,2]=4 26 B13R1.52 CCc1cc(ccc1O)SC(C)C 62a_100000210206_100012338938 [0,0,0,0,0,0|3,0,0]=3 27 B13R1.52 CN(C)Cc1ccc(c(c1)C=O)O 269982a_100102631434_100000008128 [0,0,0,0,0,0|4,0,0]=4 28 B13R1.52 CNc1cc(ccc1C)SC(C)C 62a_100000210206_100020629602 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.52 CNc1cc(ccc1C)SC(C)C 62a_100020629602_100000210206 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.52 CNc1cc(ccc1F)SC(C)C 62a_100000210206_100011314990 [0,0,0,0,0,0|4,0,0]=4 31 B13R1.52 CNc1cc(ccc1F)SC(C)C 62a_100011314990_100000210206 [0,0,0,0,0,0|4,0,0]=4 32 B13R1.52 CNc1cc(ccc1N)SC(C)C 62a_100000694363_100000210206 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.52 COc1cc(c[nH]c1=O)SC(C)C 62a_100000210206_100010125397 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.52 COc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100012353699 [0,0,0,0,0,0|2,0,2]=4 35 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,0,0,0,0,0|2,0,1]=3 36 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,0,0,0,0,0|2,0,1]=3 37 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,0,0,0,0,0|2,0,1]=3 38 B13R1.52 COc1cc(ccc1Br)CN(C)C 2230a_100102631434_100010110085 [0,0,0,0,0,0|3,0,0]=3 39 B13R1.52 COc1cc(ccc1Br)CN(C)C 269982a_100102631434_100010110085 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.52 COc1cc(ccc1Br)CN(C)C 270004a_100102631434_100010244714 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.52 COc1cc(ccc1Br)NC(=O)C 11a_100000765947_100015343762 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.52 COc1cc(ccc1Br)NC(=O)C 1626a_100000765947_100015343762 [0,0,0,0,0,0|3,0,1]=4 43 B13R1.52 COc1cc(ccc1Br)NC(=O)C 22a_100000765947_100000070787 [0,0,0,0,0,0|3,0,1]=4 44 B13R1.52 COc1cc(ccc1Br)NC(=O)C 527a_100000765947_100103153847 [0,0,0,0,0,0|3,0,1]=4 45 B13R1.52 COc1cc(ccc1Br)NC(C)C 2230a_100000765947_100000210206 [0,0,0,0,0,0|3,0,0]=3 46 B13R1.52 COc1cc(ccc1Br)NC(C)C 34a_100000765947_100000210206 [0,0,0,0,0,0|3,0,0]=3 47 B13R1.52 COc1cc(ccc1Br)OC(C)C 34a_100011827694_100000210206 [0,0,0,0,0,0|3,0,0]=3 48 B13R1.52 COc1cc(ccc1Br)OC(C)C 7a_100011827694_100000210206 [0,0,0,0,0,0|3,0,0]=3 49 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100000210206_100012353699 [0,0,0,0,0,0|3,0,0]=3 50 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100012353699_100000210206 [0,0,0,0,0,0|3,0,0]=3 51 B13R1.52 COc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011830276 [0,0,0,0,0,0|2,0,2]=4 52 B13R1.52 COc1cc(ccc1C)CN(C)C 270004a_100102631434_100000719150 [0,0,0,0,0,0|3,0,0]=3 53 B13R1.52 COc1cc(ccc1C)NC(=O)C 11a_100011279678_100015343762 [0,0,0,0,0,0|3,0,1]=4 54 B13R1.52 COc1cc(ccc1C)NC(=O)C 1626a_100011279678_100015343762 [0,0,0,0,0,0|3,0,1]=4 55 B13R1.52 COc1cc(ccc1C)NC(=O)C 22a_100011279678_100000070787 [0,0,0,0,0,0|3,0,1]=4 56 B13R1.52 COc1cc(ccc1C)NC(=O)C 527a_100011279678_100103153847 [0,0,0,0,0,0|3,0,1]=4 57 B13R1.52 COc1cc(ccc1C)NC(C)C 2230a_100011279678_100000210206 [0,0,0,0,0,0|3,0,0]=3 58 B13R1.52 COc1cc(ccc1C)NC(C)C 34a_100011279678_100000210206 [0,0,0,0,0,0|3,0,0]=3 59 B13R1.52 COc1cc(ccc1C)OC(C)C 34a_100009865632_100000210206 [0,0,0,0,0,0|3,0,0]=3 60 B13R1.52 COc1cc(ccc1C)OC(C)C 7a_100009865632_100000210206 [0,0,0,0,0,0|3,0,0]=3 61 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100000210206_100011830276 [0,0,0,0,0,0|3,0,0]=3 62 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100011830276_100000210206 [0,0,0,0,0,0|3,0,0]=3 63 B13R1.52 COc1cc(ccc1Cl)C=C(C)C 271570a_100102525489_100011356853 [0,0,0,0,0,0|2,0,2]=4 64 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,0,0,0,0,0|2,0,1]=3 65 B13R1.52 COc1cc(ccc1Cl)CN(C)C 2230a_100102631434_200010214485 [0,0,0,0,0,0|3,0,0]=3 66 B13R1.52 COc1cc(ccc1Cl)CN(C)C 269982a_100102631434_200010214485 [0,0,0,0,0,0|3,0,0]=3 67 B13R1.52 COc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100011998524 [0,0,0,0,0,0|3,0,0]=3 68 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 11a_100000742311_100015343762 [0,0,0,0,0,0|3,0,1]=4 69 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 1626a_100000742311_100015343762 [0,0,0,0,0,0|3,0,1]=4 70 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 22a_100000742311_100000070787 [0,0,0,0,0,0|3,0,1]=4 71 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 34a_100011935283_200000210301 [0,0,0,0,0,0|3,0,1]=4 72 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 527a_100000742311_100103153847 [0,0,0,0,0,0|3,0,1]=4 73 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 7a_100011935283_200000210301 [0,0,0,0,0,0|3,0,1]=4 74 B13R1.52 COc1cc(ccc1Cl)NC(C)C 2230a_100000742311_100000210206 [0,0,0,0,0,0|3,0,0]=3 75 B13R1.52 COc1cc(ccc1Cl)NC(C)C 34a_100000742311_100000210206 [0,0,0,0,0,0|3,0,0]=3 76 B13R1.52 COc1cc(ccc1Cl)OC(C)C 34a_100012186310_100000210206 [0,0,0,0,0,0|3,0,0]=3 77 B13R1.52 COc1cc(ccc1Cl)OC(C)C 7a_100012186310_100000210206 [0,0,0,0,0,0|3,0,0]=3 78 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100000210206_100011356853 [0,0,0,0,0,0|3,0,0]=3 79 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100011356853_100000210206 [0,0,0,0,0,0|3,0,0]=3 80 B13R1.52 COc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011934186 [0,0,0,0,0,0|2,0,2]=4 81 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,0,0,0,0,0|2,0,1]=3 82 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,0,0,0,0,0|2,0,1]=3 83 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,0,0,0,0,0|2,0,1]=3 84 B13R1.52 COc1cc(ccc1F)CN(C)C 2230a_100102631434_100012349856 [0,0,0,0,0,0|3,0,0]=3 85 B13R1.52 COc1cc(ccc1F)CN(C)C 269982a_100102631434_100012349856 [0,0,0,0,0,0|3,0,0]=3 86 B13R1.52 COc1cc(ccc1F)CN(C)C 270004a_100102631434_100000692873 [0,0,0,0,0,0|3,0,0]=3 87 B13R1.52 COc1cc(ccc1F)NC(=O)C 11a_100000701188_100015343762 [0,0,0,0,0,0|3,0,1]=4 88 B13R1.52 COc1cc(ccc1F)NC(=O)C 1626a_100000701188_100015343762 [0,0,0,0,0,0|3,0,1]=4 89 B13R1.52 COc1cc(ccc1F)NC(=O)C 22a_100000701188_100000070787 [0,0,0,0,0,0|3,0,1]=4 90 B13R1.52 COc1cc(ccc1F)NC(=O)C 527a_100000701188_100103153847 [0,0,0,0,0,0|3,0,1]=4 91 B13R1.52 COc1cc(ccc1F)NC(C)C 2230a_100000701188_100000210206 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.52 COc1cc(ccc1F)NC(C)C 34a_100000701188_100000210206 [0,0,0,0,0,0|3,0,0]=3 93 B13R1.52 COc1cc(ccc1F)OC(C)C 34a_100012001760_100000210206 [0,0,0,0,0,0|3,0,0]=3 94 B13R1.52 COc1cc(ccc1F)OC(C)C 7a_100012001760_100000210206 [0,0,0,0,0,0|3,0,0]=3 95 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100000210206_100011934186 [0,0,0,0,0,0|3,0,0]=3 96 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100011934186_100000210206 [0,0,0,0,0,0|3,0,0]=3 97 B13R1.52 COc1cc(ccc1I)NC(=O)C 11a_100000746945_100015343762 [0,0,0,0,0,0|3,0,1]=4 98 B13R1.52 COc1cc(ccc1I)NC(=O)C 1626a_100000746945_100015343762 [0,0,0,0,0,0|3,0,1]=4 99 B13R1.52 COc1cc(ccc1I)NC(=O)C 22a_100000746945_100000070787 [0,0,0,0,0,0|3,0,1]=4 100 B13R1.52 COc1cc(ccc1I)NC(=O)C 527a_100000746945_100103153847 [0,0,0,0,0,0|3,0,1]=4 101 B13R1.52 COc1cc(ccc1I)NC(C)C 34a_100000746945_100000210206 [0,0,0,0,0,0|3,0,0]=3 102 B13R1.52 COc1cc(ccc1N)C=C(C)C 271570a_100102525489_100011279103 [0,0,0,0,0,0|2,0,2]=4 103 B13R1.52 COc1cc(ccc1N)OC(C)C 34a_100015326901_100000210206 [0,0,0,0,0,0|3,0,0]=3 104 B13R1.52 COc1cc(ccc1N)OC(C)C 7a_100015326901_100000210206 [0,0,0,0,0,0|3,0,0]=3 105 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100000210206_100015196925 [0,0,0,0,0,0|3,0,0]=3 106 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100011279103_100000210206 [0,0,0,0,0,0|3,0,0]=3 107 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,0,0,0,0,0|1,0,2]=3 108 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,0,0,0,0,0|1,0,1]=2 109 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,0,0,0,0,0|1,0,1]=2 110 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,0,0,0,0,0|2,0,1]=3 111 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,0,0,0,0,0|2,0,1]=3 112 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [0,0,0,0,0,0|2,0,0]=2 113 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [0,0,0,0,0,0|2,0,0]=2 114 B13R1.52 COc1cc(cnc1C)SC(C)C 62a_100000210206_100010254219 [0,0,0,0,0,0|4,0,0]=4 115 B13R1.52 COc1cc(cnc1C)SC(C)C 62a_100010254219_100000210206 [0,0,0,0,0,0|4,0,0]=4 116 B13R1.52 COc1cc(cnc1F)SC(C)C 62a_100000210206_100010214931 [0,0,0,0,0,0|4,0,0]=4 117 B13R1.52 COc1cc(cnc1F)SC(C)C 62a_100010214931_100000210206 [0,0,0,0,0,0|4,0,0]=4 118 B13R1.52 COc1cc(cnc1N)SC(C)C 62a_100000210206_106354213024 [0,0,0,0,0,0|4,0,0]=4 119 B13R1.52 COc1cc(cnc1N)SC(C)C 62a_106354213024_100000210206 [0,0,0,0,0,0|4,0,0]=4 120 B13R1.52 COc1cc(ncc1C)SC(C)C 62a_100000210206_100010067687 [0,0,0,0,0,0|4,0,0]=4 121 B13R1.52 COc1cc(ncc1C)SC(C)C 62a_100010067687_100000210206 [0,0,0,0,0,0|4,0,0]=4 122 B13R1.52 COc1cc(ncc1F)SC(C)C 62a_100000210206_200010136270 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.52 COc1cc(ncc1F)SC(C)C 62a_200010136270_100000210206 [0,0,0,0,0,0|4,0,0]=4 124 B13R1.52 COc1cc(ncc1N)SC(C)C 62a_100000210206_100009887741 [0,0,0,0,0,0|4,0,0]=4 125 B13R1.52 COc1cc(ncc1N)SC(C)C 62a_100009887741_100000210206 [0,0,0,0,0,0|4,0,0]=4 126 B13R1.52 COc1nc(ccc1Br)CC(=O)C 1458a_100000070787_200010066506 [0,0,0,0,0,0|3,0,1]=4 127 B13R1.52 COc1nc(ccc1Br)CN(C)C 2230a_100102631434_200010066506 [0,0,0,0,0,0|4,0,0]=4 128 B13R1.52 COc1nc(ccc1N)SC(C)C 62a_100000210206_100000687816 [0,0,0,0,0,0|4,0,0]=4 129 B13R1.52 COc1nc(ccc1N)SC(C)C 62a_100000687816_100000210206 [0,0,0,0,0,0|4,0,0]=4 130 B13R1.52 COc1nc(ccc1O)C=C(C)C 271570a_100102525489_100010893133 [0,0,0,0,0,0|2,0,2]=4 131 B13R1.52 COc1nc(ccc1O)SC(C)C 62a_100000210206_100010893133 [0,0,0,0,0,0|3,0,0]=3 132 B13R1.52 COc1nc(cnc1O)SC(C)C 62a_100000210206_200010365344 [0,0,0,0,0,0|4,0,0]=4 133 B13R1.52 COc1nc(cnc1O)SC(C)C 62a_200010365344_100000210206 [0,0,0,0,0,0|4,0,0]=4 134 B13R1.52 CSc1cc(ccc1C)OC(C)C 62a_200000210301_200010081138 [0,0,0,0,0,0|3,1,0]=4 135 B13R1.52 CSc1cc(ccc1C)OC(C)C 62a_200010081138_200000210301 [0,0,0,0,0,0|3,1,0]=4 136 B13R1.52 CSc1cc(ccc1F)SC(C)C 62a_100000210206_100010341305 [0,0,0,0,0,0|3,1,0]=4 137 B13R1.52 CSc1cc(ccc1F)SC(C)C 62a_100010341305_100000210206 [0,0,0,0,0,0|3,1,0]=4 138 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,0,0,0,0,0|1,1,1]=3 139 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,0,0,0,0,0|1,1,1]=3 140 B13R1.52 Cc1ccc(cc1S[13CH3])OC(C)C 62a_200010081138_200025704644 [0,0,0,0,0,0|3,1,0]=4 141 B13R1.52 Cc1ccc(cc1S[13CH3])OC(C)C 62a_200025704644_200010081138 [0,0,0,0,0,0|3,1,0]=4 142 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [1,0,0,0,0,0|1,0,2]=4 143 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,0,0,0,0,0|1,0,2]=4 144 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,0,0,0,0,0|2,0,1]=4 145 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [1,0,0,0,0,0|2,0,1]=4 146 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [1,0,0,0,0,0|2,0,1]=4 147 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [1,0,0,0,0,0|2,0,1]=4 148 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [1,0,0,0,0,0|2,0,1]=4 149 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [1,0,0,0,0,0|2,0,1]=4 150 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [1,0,0,0,0,0|2,0,1]=4 151 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [1,0,0,0,0,0|2,0,1]=4 152 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,0,0,0,0,0|1,0,1]=3 153 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,0,0,0,0,0|2,0,1]=4 154 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,0,0,0,0,0|2,0,1]=4 155 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,0,0,0,0,0|2,0,1]=4 156 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,0,0,0,0,0|1,0,1]=3 157 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,0,0,0,0,0|1,0,1]=3 158 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [1,0,0,0,0,0|2,0,1]=4 159 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [1,0,0,0,0,0|2,0,1]=4 160 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [1,0,0,0,0,0|2,0,1]=4 161 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [1,0,0,0,0,0|2,0,1]=4 162 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,0,0,0,0,0|2,0,1]=4 163 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,0,0,0,0,0|2,0,1]=4 164 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [1,0,0,0,0,0|3,0,0]=4 167 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [1,0,0,0,0,0|3,0,0]=4 168 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [1,0,0,0,0,0|3,0,0]=4 169 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [1,0,0,0,0,0|3,0,0]=4 170 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [1,0,0,0,0,0|3,0,0]=4 171 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,0,0,0,0,0|2,0,0]=3 172 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [1,0,0,0,0,0|3,0,0]=4 173 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [1,0,0,0,0,0|3,0,0]=4 174 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [1,0,0,0,0,0|3,0,0]=4 175 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [1,0,0,0,0,0|3,0,0]=4 176 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [1,0,0,0,0,0|3,0,0]=4 178 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [1,0,0,0,0,0|3,0,0]=4 179 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [1,0,0,0,0,0|3,0,0]=4 180 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [1,0,0,0,0,0|3,0,0]=4 182 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [1,0,0,0,0,0|3,0,0]=4 183 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [1,0,0,0,0,0|3,0,0]=4 184 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [1,0,0,0,0,0|3,0,0]=4 185 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [1,0,0,0,0,0|3,0,0]=4 186 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [1,0,0,0,0,0|3,0,0]=4 187 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [1,0,0,0,0,0|3,0,0]=4 188 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [1,0,0,0,0,0|3,0,0]=4 189 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,0,0,0,0,0|2,0,0]=3 190 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [1,0,0,0,0,0|2,0,1]=4 191 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [1,0,0,0,0,0|3,0,0]=4 192 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [1,0,0,0,0,0|3,0,0]=4 194 B12R1.19 Cc1cc(ccc1Br)NC(C)C 2230a_100000210723_100000210206 [1,0,0,0,0,0|3,0,0]=4 195 B12R1.19 Cc1cc(ccc1Br)NC(C)C 34a_100000210723_100000210206 [1,0,0,0,0,0|3,0,0]=4 196 B12R1.19 Cc1cc(ccc1Br)NC(C)C 7a_100000210723_100000210206 [1,0,0,0,0,0|3,0,0]=4 197 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [1,0,0,0,0,0|3,0,0]=4 198 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [1,0,0,0,0,0|3,0,0]=4 199 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100000210206_100009813585 [1,0,0,0,0,0|3,0,0]=4 200 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100009813585_100000210206 [1,0,0,0,0,0|3,0,0]=4 201 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [1,0,0,0,0,0|3,0,0]=4 202 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [1,0,0,0,0,0|3,0,0]=4 203 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [1,0,0,0,0,0|3,0,0]=4 204 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 2230a_100000187808_100000210206 [1,0,0,0,0,0|3,0,0]=4 205 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 34a_100000187808_100000210206 [1,0,0,0,0,0|3,0,0]=4 206 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 7a_100000187808_100000210206 [1,0,0,0,0,0|3,0,0]=4 207 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [1,0,0,0,0,0|3,0,0]=4 208 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [1,0,0,0,0,0|3,0,0]=4 209 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000049509_100000210206 [1,0,0,0,0,0|3,0,0]=4 210 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000210206_100000049509 [1,0,0,0,0,0|3,0,0]=4 211 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [1,0,0,0,0,0|2,0,1]=4 212 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [1,0,0,0,0,0|3,0,0]=4 213 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [1,0,0,0,0,0|3,0,0]=4 214 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [1,0,0,0,0,0|3,0,0]=4 215 B12R1.19 Cc1cc(ccc1F)NC(C)C 2230a_100000750164_100000210206 [1,0,0,0,0,0|3,0,0]=4 216 B12R1.19 Cc1cc(ccc1F)NC(C)C 34a_100000750164_100000210206 [1,0,0,0,0,0|3,0,0]=4 217 B12R1.19 Cc1cc(ccc1F)NC(C)C 7a_100000750164_100000210206 [1,0,0,0,0,0|3,0,0]=4 218 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [1,0,0,0,0,0|3,0,0]=4 219 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [1,0,0,0,0,0|3,0,0]=4 220 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100000210206_100011218330 [1,0,0,0,0,0|3,0,0]=4 221 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100011218330_100000210206 [1,0,0,0,0,0|3,0,0]=4 222 B12R1.19 Cc1cc(ccc1I)NC(C)C 34a_100000198070_100000210206 [1,0,0,0,0,0|3,0,0]=4 223 B12R1.19 Cc1cc(ccc1I)NC(C)C 7a_100000198070_100000210206 [1,0,0,0,0,0|3,0,0]=4 224 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [1,0,0,0,0,0|3,0,0]=4 225 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [1,0,0,0,0,0|3,0,0]=4 226 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [1,0,0,0,0,0|3,0,0]=4 227 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [1,0,0,0,0,0|3,0,0]=4 228 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000210206_100000211769 [1,0,0,0,0,0|3,0,0]=4 229 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000211769_100000210206 [1,0,0,0,0,0|3,0,0]=4 230 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,0,0,0,0,0|1,0,1]=3 231 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [1,0,0,0,0,0|2,0,1]=4 232 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,0,0,0,0,0|2,0,0]=3 233 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,0,0,0,0,0|2,0,0]=3 234 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,0,0,0,0,0|2,0,0]=3 235 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000210206_100000685391 [1,0,0,0,0,0|3,0,0]=4 236 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000685391_100000210206 [1,0,0,0,0,0|3,0,0]=4 237 B12R1.19 Cc1cc(ncc1O)SC(C)C 62a_100000210206_100000692680 [1,0,0,0,0,0|3,0,0]=4 238 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [1,0,0,0,0,0|2,0,1]=4 239 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [1,0,0,0,0,0|3,0,0]=4 240 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [1,0,0,0,0,0|3,0,0]=4 241 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [1,0,0,0,0,0|3,0,0]=4 242 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [1,0,0,0,0,0|3,0,0]=4 243 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [1,0,0,0,0,0|3,0,0]=4 244 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [1,0,0,0,0,0|3,0,0]=4 246 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [1,0,0,0,0,0|3,0,0]=4 247 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [1,0,0,0,0,0|3,0,0]=4 248 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [1,0,0,0,0,0|3,0,0]=4 249 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [1,0,0,0,0,0|3,0,0]=4 250 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [1,0,0,0,0,0|3,0,0]=4 251 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [1,0,0,0,0,0|3,0,0]=4 252 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [1,0,0,0,0,0|3,0,0]=4 253 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [1,0,0,0,0,0|3,0,0]=4 254 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [1,0,0,0,0,0|3,0,0]=4 255 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,0,0,0,0,0|2,0,1]=4 256 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,0,0,0,0,0|3,0,0]=4 257 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,0,0,0,0,0|3,0,0]=4 258 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,0,0,0,0,0|3,0,0]=4 259 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,0,0,0,0,0|3,0,0]=4 260 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,0,0,0,0,0|3,0,0]=4 261 B12R1.19 Cc1nc(ccc1O)OC(C)C 271570a_203496583355_200012350186 [1,0,0,0,0,0|3,0,0]=4 262 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100000210206_100010233687 [1,0,0,0,0,0|3,0,0]=4 263 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100010233687_100000210206 [1,0,0,0,0,0|3,0,0]=4 264 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,0,0,0,0,0|2,0,1]=4 265 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,0,0,0,0,0|2,0,1]=4 266 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,0,0,0,0,0|2,0,1]=4 267 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,0,0,0,0,0|1,0,1]=3 268 B12R1.286 C=C=Cc1ccc(c(c1)OC)O 271570a_100015277604_100000694246 [1,0,0,0,0,0|0,0,3]=4 269 B12R1.286 CC=Cc1ccc(c(c1)CC)O 271570a_100016259895_100012338938 [1,0,0,0,0,0|1,0,2]=4 270 B12R1.286 CC=Cc1ccc(c(c1)OC)Br 271570a_100016259895_100012353699 [1,0,0,0,0,0|1,0,2]=4 271 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [1,0,0,0,0,0|1,0,2]=4 272 B12R1.286 CC=Cc1ccc(c(c1)OC)Cl 271570a_100016259895_100011356853 [1,0,0,0,0,0|1,0,2]=4 273 B12R1.286 CC=Cc1ccc(c(c1)OC)F 271570a_100016259895_100011934186 [1,0,0,0,0,0|1,0,2]=4 274 B12R1.286 CC=Cc1ccc(c(c1)OC)N 271570a_100016259895_100011279103 [1,0,0,0,0,0|1,0,2]=4 275 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [1,0,0,0,0,0|0,0,2]=3 276 B12R1.286 CC=Cc1ccc(c(n1)OC)O 271570a_100016259895_100010893133 [1,0,0,0,0,0|1,0,2]=4 277 B12R1.286 CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210202 [1,0,0,0,0,0|3,0,0]=4 278 B12R1.286 CCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210202 [1,0,0,0,0,0|3,0,0]=4 279 B12R1.286 CCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210202 [1,0,0,0,0,0|3,0,0]=4 280 B12R1.286 CCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210202 [1,0,0,0,0,0|3,0,0]=4 281 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [1,0,0,0,0,0|2,0,0]=3 282 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [1,0,0,0,0,0|2,0,0]=3 283 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [1,0,0,0,0,0|2,0,0]=3 284 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [1,0,0,0,0,0|2,0,0]=3 285 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [1,0,0,0,0,0|2,0,0]=3 286 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [1,0,0,0,0,0|2,0,0]=3 287 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [1,0,0,0,0,0|2,0,0]=3 288 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [1,0,0,0,0,0|2,0,0]=3 289 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [1,0,0,0,0,0|2,0,0]=3 290 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [1,0,0,0,0,0|1,0,0]=2 291 B12R1.286 CCOc1ccc(c(c1)C=O)O 271570a_203496583355_100012345016 [1,0,0,0,0,0|3,0,0]=4 292 B12R1.286 CCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210202 [1,0,0,0,0,0|3,0,0]=4 293 B12R1.286 CCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210202 [1,0,0,0,0,0|3,0,0]=4 294 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [1,0,0,0,0,0|2,0,0]=3 295 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [1,0,0,0,0,0|2,0,0]=3 296 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [1,0,0,0,0,0|2,0,0]=3 297 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [1,0,0,0,0,0|2,0,0]=3 298 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [1,0,0,0,0,0|2,0,0]=3 299 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [1,0,0,0,0,0|2,0,0]=3 300 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [1,0,0,0,0,0|2,0,0]=3 301 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [1,0,0,0,0,0|2,0,0]=3 302 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [1,0,0,0,0,0|2,0,0]=3 303 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [1,0,0,0,0,0|2,0,0]=3 304 B12R1.286 CCOc1ccc(c(c1)SC)C 62a_200000210301_100011099959 [1,0,0,0,0,0|2,1,0]=4 305 B12R1.286 CCOc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011099959 [1,0,0,0,0,0|2,1,0]=4 306 B12R1.286 CCSc1c[nH]c(=O)c(c1)OC 62a_100000210202_100010125397 [1,0,0,0,0,0|2,0,1]=4 307 B12R1.286 CCSc1cc(c(cn1)C)OC 62a_100000210202_100010067687 [1,0,0,0,0,0|3,0,0]=4 308 B12R1.286 CCSc1cc(c(cn1)C)OC 62a_100010067687_100000210202 [1,0,0,0,0,0|3,0,0]=4 309 B12R1.286 CCSc1cc(c(cn1)F)OC 62a_100000210202_200010136270 [1,0,0,0,0,0|3,0,0]=4 310 B12R1.286 CCSc1cc(c(cn1)F)OC 62a_200010136270_100000210202 [1,0,0,0,0,0|3,0,0]=4 311 B12R1.286 CCSc1cc(c(cn1)N)OC 62a_100000210202_100009887741 [1,0,0,0,0,0|3,0,0]=4 312 B12R1.286 CCSc1cc(c(cn1)N)OC 62a_100009887741_100000210202 [1,0,0,0,0,0|3,0,0]=4 313 B12R1.286 CCSc1ccc(c(c1)C#N)O 62a_100000210202_100000687585 [1,0,0,0,0,0|3,0,0]=4 314 B12R1.286 CCSc1ccc(c(c1)C=O)O 62a_100000210202_100000186750 [1,0,0,0,0,0|3,0,0]=4 315 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100000210202_100010244631 [1,0,0,0,0,0|3,0,0]=4 316 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210202 [1,0,0,0,0,0|3,0,0]=4 317 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100000210202_100010244625 [1,0,0,0,0,0|3,0,0]=4 318 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100010244625_100000210202 [1,0,0,0,0,0|3,0,0]=4 319 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000210202_100000686106 [1,0,0,0,0,0|3,0,0]=4 320 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000686106_100000210202 [1,0,0,0,0,0|3,0,0]=4 321 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [1,0,0,0,0,0|2,0,0]=3 322 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000210202_100000730032 [1,0,0,0,0,0|3,0,0]=4 323 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000730032_100000210202 [1,0,0,0,0,0|3,0,0]=4 324 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210202 [1,0,0,0,0,0|3,0,0]=4 325 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000210202_100000184703 [1,0,0,0,0,0|3,0,0]=4 326 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100000210202_100020629602 [1,0,0,0,0,0|3,0,0]=4 327 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100020629602_100000210202 [1,0,0,0,0,0|3,0,0]=4 328 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100000210202_100011314990 [1,0,0,0,0,0|3,0,0]=4 329 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100011314990_100000210202 [1,0,0,0,0,0|3,0,0]=4 330 B12R1.286 CCSc1ccc(c(c1)NC)N 62a_100000694363_100000210202 [1,0,0,0,0,0|3,0,0]=4 331 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [1,0,0,0,0,0|2,0,0]=3 332 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [1,0,0,0,0,0|2,0,0]=3 333 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [1,0,0,0,0,0|2,0,0]=3 334 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [1,0,0,0,0,0|2,0,0]=3 335 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [1,0,0,0,0,0|2,0,0]=3 336 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [1,0,0,0,0,0|2,0,0]=3 337 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [1,0,0,0,0,0|2,0,0]=3 338 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [1,0,0,0,0,0|2,0,0]=3 339 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [1,0,0,0,0,0|2,0,0]=3 340 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [1,0,0,0,0,0|2,0,0]=3 341 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [1,0,0,0,0,0|1,0,0]=2 342 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100000210202_100010341305 [1,0,0,0,0,0|2,1,0]=4 343 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100010341305_100000210202 [1,0,0,0,0,0|2,1,0]=4 344 B12R1.286 CCSc1ccc(c(n1)OC)N 62a_100000210202_100000687816 [1,0,0,0,0,0|3,0,0]=4 345 B12R1.286 CCSc1ccc(c(n1)OC)N 62a_100000687816_100000210202 [1,0,0,0,0,0|3,0,0]=4 346 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [1,0,0,0,0,0|2,0,0]=3 347 B12R1.286 CCSc1cnc(c(c1)OC)C 62a_100000210202_100010254219 [1,0,0,0,0,0|3,0,0]=4 348 B12R1.286 CCSc1cnc(c(c1)OC)C 62a_100010254219_100000210202 [1,0,0,0,0,0|3,0,0]=4 349 B12R1.286 CCSc1cnc(c(c1)OC)F 62a_100000210202_100010214931 [1,0,0,0,0,0|3,0,0]=4 350 B12R1.286 CCSc1cnc(c(c1)OC)F 62a_100010214931_100000210202 [1,0,0,0,0,0|3,0,0]=4 351 B12R1.286 CCSc1cnc(c(c1)OC)N 62a_100000210202_106354213024 [1,0,0,0,0,0|3,0,0]=4 352 B12R1.286 CCSc1cnc(c(c1)OC)N 62a_106354213024_100000210202 [1,0,0,0,0,0|3,0,0]=4 353 B12R1.286 CCSc1cnc(c(n1)OC)O 62a_100000210202_200010365344 [1,0,0,0,0,0|3,0,0]=4 354 B12R1.286 CCSc1cnc(c(n1)OC)O 62a_200010365344_100000210202 [1,0,0,0,0,0|3,0,0]=4 355 B12R1.286 CCc1cc(ccc1Cl)CNC 26a_100102657272_100000212063 [1,0,0,0,0,0|3,0,0]=4 356 B12R1.286 CCc1cc(ccc1F)CNC 207a_100102657272_100009840867 [1,0,0,0,0,0|3,0,0]=4 357 B12R1.286 CCc1cc(ccc1F)CNC 2230a_114873767189_200000210301 [1,0,0,0,0,0|3,0,0]=4 358 B12R1.286 CCc1cc(ccc1F)CNC 269862a_106832991636_100009840867 [1,0,0,0,0,0|3,0,0]=4 359 B12R1.286 CCc1cc(ccc1F)CNC 270004a_106832991635_100009840867 [1,0,0,0,0,0|3,0,0]=4 360 B12R1.286 CCc1cc(ccc1F)CNC 34a_114873767189_200000210301 [1,0,0,0,0,0|3,0,0]=4 361 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 2230a_114873767189_200025704644 [1,0,0,0,0,0|3,0,0]=4 362 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 34a_114873767189_200025704644 [1,0,0,0,0,0|3,0,0]=4 363 B12R1.286 CCc1cc(ccc1O)SCF 62a_100015361967_100012338938 [1,0,0,0,0,0|3,0,0]=4 364 B12R1.286 CNCc1ccc(c(c1)C=O)O 7a_106832991635_100000008128 [1,0,0,0,0,0|3,0,0]=4 365 B12R1.286 CNCc1ccc(c(c1)OC)Br 207a_100102657272_100010244714 [1,0,0,0,0,0|2,0,0]=3 366 B12R1.286 CNCc1ccc(c(c1)OC)Br 2230a_106832991635_100010110085 [1,0,0,0,0,0|2,0,0]=3 367 B12R1.286 CNCc1ccc(c(c1)OC)Br 26a_100102657272_100011827694 [1,0,0,0,0,0|2,0,0]=3 368 B12R1.286 CNCc1ccc(c(c1)OC)Br 270004a_106832991635_100010244714 [1,0,0,0,0,0|2,0,0]=3 369 B12R1.286 CNCc1ccc(c(c1)OC)Br 34a_100102657272_100010110085 [1,0,0,0,0,0|2,0,0]=3 370 B12R1.286 CNCc1ccc(c(c1)OC)Br 7a_106832991635_100010110085 [1,0,0,0,0,0|2,0,0]=3 371 B12R1.286 CNCc1ccc(c(c1)OC)C 207a_100102657272_100000719150 [1,0,0,0,0,0|2,0,0]=3 372 B12R1.286 CNCc1ccc(c(c1)OC)C 270004a_106832991635_100000719150 [1,0,0,0,0,0|2,0,0]=3 373 B12R1.286 CNCc1ccc(c(c1)OC)Cl 207a_100102657272_100011998524 [1,0,0,0,0,0|2,0,0]=3 374 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_200000210301 [1,0,0,0,0,0|2,0,0]=3 375 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_106832991635_200010214485 [1,0,0,0,0,0|2,0,0]=3 376 B12R1.286 CNCc1ccc(c(c1)OC)Cl 26a_100102657272_100012186310 [1,0,0,0,0,0|2,0,0]=3 377 B12R1.286 CNCc1ccc(c(c1)OC)Cl 270004a_106832991635_100011998524 [1,0,0,0,0,0|2,0,0]=3 378 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100015204853_200000210301 [1,0,0,0,0,0|2,0,0]=3 379 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100102657272_200010214485 [1,0,0,0,0,0|2,0,0]=3 380 B12R1.286 CNCc1ccc(c(c1)OC)Cl 7a_106832991635_200010214485 [1,0,0,0,0,0|2,0,0]=3 381 B12R1.286 CNCc1ccc(c(c1)OC)F 207a_100102657272_100000692873 [1,0,0,0,0,0|2,0,0]=3 382 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_100020626639_200000210301 [1,0,0,0,0,0|2,0,0]=3 383 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_106832991635_100012349856 [1,0,0,0,0,0|2,0,0]=3 384 B12R1.286 CNCc1ccc(c(c1)OC)F 270004a_106832991635_100000692873 [1,0,0,0,0,0|2,0,0]=3 385 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100020626639_200000210301 [1,0,0,0,0,0|2,0,0]=3 386 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100102657272_100012349856 [1,0,0,0,0,0|2,0,0]=3 387 B12R1.286 CNCc1ccc(c(c1)OC)F 7a_106832991635_100012349856 [1,0,0,0,0,0|2,0,0]=3 388 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [1,0,0,0,0,0|1,0,0]=2 389 B12R1.286 CNCc1ccc(c(n1)OC)Br 2230a_106832991635_200010066506 [1,0,0,0,0,0|3,0,0]=4 390 B12R1.286 CNCc1ccc(c(n1)OC)Br 34a_100102657272_200010066506 [1,0,0,0,0,0|3,0,0]=4 391 B12R1.286 CNCc1ccc(c(n1)OC)Br 7a_106832991635_200010066506 [1,0,0,0,0,0|3,0,0]=4 392 B12R1.286 CNc1cc(ccc1Br)COC 34a_200013033220_200000210301 [1,0,0,0,0,0|3,0,0]=4 393 B12R1.286 COCc1cc(c(cn1)Br)OC 34a_100010999569_200000210301 [1,0,0,0,0,0|3,0,0]=4 394 B12R1.286 COCc1ccc(c(c1)N[13CH3])Br 34a_200013033220_200025704644 [1,0,0,0,0,0|3,0,0]=4 395 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [1,0,0,0,0,0|2,0,0]=3 396 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [1,0,0,0,0,0|2,0,0]=3 397 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [1,0,0,0,0,0|2,0,0]=3 398 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [1,0,0,0,0,0|2,0,0]=3 399 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [1,0,0,0,0,0|2,0,0]=3 400 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [1,0,0,0,0,0|2,0,0]=3 401 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [1,0,0,0,0,0|2,0,0]=3 402 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [1,0,0,0,0,0|2,0,0]=3 403 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [1,0,0,0,0,0|2,0,0]=3 404 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [1,0,0,0,0,0|2,0,0]=3 405 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [1,0,0,0,0,0|2,0,0]=3 406 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200000210301_200015395492 [1,0,0,0,0,0|2,1,0]=4 407 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200015395492_200000210301 [1,0,0,0,0,0|2,1,0]=4 408 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200000210301_200011493689 [1,0,0,0,0,0|2,1,0]=4 409 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200011493689_200000210301 [1,0,0,0,0,0|2,1,0]=4 410 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200015395492_200025704644 [1,0,0,0,0,0|2,1,0]=4 411 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200025704644_200015395492 [1,0,0,0,0,0|2,1,0]=4 412 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200011493689_200025704644 [1,0,0,0,0,0|2,1,0]=4 413 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200011493689 [1,0,0,0,0,0|2,1,0]=4 414 B12R1.286 COCc1ccc(c(n1)OC)Br 34a_100138415774_200010066506 [1,0,0,0,0,0|3,0,0]=4 415 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [1,0,0,0,0,0|2,0,0]=3 416 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [1,0,0,0,0,0|2,0,0]=3 417 B12R1.286 COc1cc(ccc1Br)CSC 62a_100010110085_200000210301 [1,0,0,0,0,0|2,0,0]=3 418 B12R1.286 COc1cc(ccc1Br)CSC 62a_200000210301_100010110085 [1,0,0,0,0,0|2,0,0]=3 419 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_100010110085_200025704644 [1,0,0,0,0,0|2,0,0]=3 420 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100010110085 [1,0,0,0,0,0|2,0,0]=3 421 B12R1.286 COc1cc(ccc1Br)NCF 34a_100000765947_100015361967 [1,0,0,0,0,0|3,0,0]=4 422 B12R1.286 COc1cc(ccc1Br)OCF 34a_100011827694_100015361967 [1,0,0,0,0,0|3,0,0]=4 423 B12R1.286 COc1cc(ccc1Br)OCF 7a_100011827694_100015361967 [1,0,0,0,0,0|3,0,0]=4 424 B12R1.286 COc1cc(ccc1Br)SCF 62a_100012353699_100015361967 [1,0,0,0,0,0|3,0,0]=4 425 B12R1.286 COc1cc(ccc1Br)SCF 62a_100015361967_100012353699 [1,0,0,0,0,0|3,0,0]=4 426 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [1,0,0,0,0,0|2,0,0]=3 427 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [1,0,0,0,0,0|2,0,0]=3 428 B12R1.286 COc1cc(ccc1C)NCF 34a_100011279678_100015361967 [1,0,0,0,0,0|3,0,0]=4 429 B12R1.286 COc1cc(ccc1C)OCF 34a_100009865632_100015361967 [1,0,0,0,0,0|3,0,0]=4 430 B12R1.286 COc1cc(ccc1C)OCF 7a_100009865632_100015361967 [1,0,0,0,0,0|3,0,0]=4 431 B12R1.286 COc1cc(ccc1C)SCF 62a_100011830276_100015361967 [1,0,0,0,0,0|3,0,0]=4 432 B12R1.286 COc1cc(ccc1C)SCF 62a_100015361967_100011830276 [1,0,0,0,0,0|3,0,0]=4 433 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 2230a_100015204853_200025704644 [1,0,0,0,0,0|2,0,0]=3 434 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 34a_100015204853_200025704644 [1,0,0,0,0,0|2,0,0]=3 435 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [1,0,0,0,0,0|2,0,0]=3 436 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200000210301_200010214485 [1,0,0,0,0,0|2,0,0]=3 437 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200010214485_200000210301 [1,0,0,0,0,0|2,0,0]=3 438 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200010214485_200025704644 [1,0,0,0,0,0|2,0,0]=3 439 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_200010214485 [1,0,0,0,0,0|2,0,0]=3 440 B12R1.286 COc1cc(ccc1Cl)NCF 34a_100000742311_100015361967 [1,0,0,0,0,0|3,0,0]=4 441 B12R1.286 COc1cc(ccc1Cl)OCF 34a_100012186310_100015361967 [1,0,0,0,0,0|3,0,0]=4 442 B12R1.286 COc1cc(ccc1Cl)OCF 7a_100012186310_100015361967 [1,0,0,0,0,0|3,0,0]=4 443 B12R1.286 COc1cc(ccc1Cl)SCF 62a_100011356853_100015361967 [1,0,0,0,0,0|3,0,0]=4 444 B12R1.286 COc1cc(ccc1Cl)SCF 62a_100015361967_100011356853 [1,0,0,0,0,0|3,0,0]=4 445 B12R1.286 COc1cc(ccc1F)CN[13CH3] 2230a_100020626639_200025704644 [1,0,0,0,0,0|2,0,0]=3 446 B12R1.286 COc1cc(ccc1F)CN[13CH3] 34a_100020626639_200025704644 [1,0,0,0,0,0|2,0,0]=3 447 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [1,0,0,0,0,0|2,0,0]=3 448 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [1,0,0,0,0,0|2,0,0]=3 449 B12R1.286 COc1cc(ccc1F)CSC 62a_100012349856_200000210301 [1,0,0,0,0,0|2,0,0]=3 450 B12R1.286 COc1cc(ccc1F)CSC 62a_200000210301_100012349856 [1,0,0,0,0,0|2,0,0]=3 451 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_100012349856_200025704644 [1,0,0,0,0,0|2,0,0]=3 452 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_200025704644_100012349856 [1,0,0,0,0,0|2,0,0]=3 453 B12R1.286 COc1cc(ccc1F)NCF 34a_100000701188_100015361967 [1,0,0,0,0,0|3,0,0]=4 454 B12R1.286 COc1cc(ccc1F)OCF 34a_100012001760_100015361967 [1,0,0,0,0,0|3,0,0]=4 455 B12R1.286 COc1cc(ccc1F)OCF 7a_100012001760_100015361967 [1,0,0,0,0,0|3,0,0]=4 456 B12R1.286 COc1cc(ccc1F)SCF 62a_100011934186_100015361967 [1,0,0,0,0,0|3,0,0]=4 457 B12R1.286 COc1cc(ccc1F)SCF 62a_100015361967_100011934186 [1,0,0,0,0,0|3,0,0]=4 458 B12R1.286 COc1cc(ccc1I)NCF 34a_100000746945_100015361967 [1,0,0,0,0,0|3,0,0]=4 459 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [1,0,0,0,0,0|2,0,0]=3 460 B12R1.286 COc1cc(ccc1N)OCF 34a_100015326901_100015361967 [1,0,0,0,0,0|3,0,0]=4 461 B12R1.286 COc1cc(ccc1N)OCF 7a_100015326901_100015361967 [1,0,0,0,0,0|3,0,0]=4 462 B12R1.286 COc1cc(ccc1N)SCF 62a_100011279103_100015361967 [1,0,0,0,0,0|3,0,0]=4 463 B12R1.286 COc1cc(ccc1N)SCF 62a_100015361967_100015196925 [1,0,0,0,0,0|3,0,0]=4 464 B12R1.286 COc1cc(ccc1O)CC#N 271570a_203496583355_100010176002 [1,0,0,0,0,0|0,0,2]=3 465 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [1,0,0,0,0,0|1,0,0]=2 466 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [1,0,0,0,0,0|2,0,0]=3 467 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [1,0,0,0,0,0|2,0,0]=3 468 B12R1.286 COc1cc(ncc1Br)CO[13CH3] 34a_100010999569_200025704644 [1,0,0,0,0,0|3,0,0]=4 469 B12R1.286 COc1nc(ccc1Br)CSC 62a_200000210301_200010066506 [1,0,0,0,0,0|3,0,0]=4 470 B12R1.286 COc1nc(ccc1Br)CSC 62a_200010066506_200000210301 [1,0,0,0,0,0|3,0,0]=4 471 B12R1.286 COc1nc(ccc1Br)CS[13CH3] 62a_200010066506_200025704644 [1,0,0,0,0,0|3,0,0]=4 472 B12R1.286 COc1nc(ccc1Br)CS[13CH3] 62a_200025704644_200010066506 [1,0,0,0,0,0|3,0,0]=4 473 B12R1.286 COc1nc(ccc1O)SCF 62a_100015361967_100010893133 [1,0,0,0,0,0|3,0,0]=4 474 B12R1.286 CSCc1ccc(c(c1)C=O)O 62a_200000210301_100000008128 [1,0,0,0,0,0|3,0,0]=4 475 B12R1.286 [13CH3]SCc1ccc(c(c1)C=O)O 62a_200025704644_100000008128 [1,0,0,0,0,0|3,0,0]=4 476 B12R1.438 C=Cc1cccc(c1)CC(C)C 271570a_100011290941_100010883412 [1,0,0,0,0,0|2,0,1]=4 477 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [1,0,0,0,0,0|1,1,1]=4 478 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [1,0,0,0,0,0|1,1,1]=4 479 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [1,0,0,0,0,0|2,0,1]=4 480 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [1,0,0,0,0,0|2,0,1]=4 481 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [1,0,0,0,0,0|2,0,1]=4 482 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [1,0,0,0,0,0|1,1,0]=3 483 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [1,0,0,0,0,0|1,1,0]=3 484 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_100000219649_200025704644 [1,0,0,0,0,0|2,1,0]=4 485 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000219649 [1,0,0,0,0,0|2,1,0]=4 486 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 2230a_100011194262_200025704644 [1,0,0,0,0,0|3,0,0]=4 487 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 34a_100011194262_200025704644 [1,0,0,0,0,0|3,0,0]=4 488 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 7a_100011194262_200025704644 [1,0,0,0,0,0|3,0,0]=4 489 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [1,0,0,0,0,0|2,0,0]=3 490 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [1,0,0,0,0,0|2,0,0]=3 491 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_100000170003_200025704644 [1,0,0,0,0,0|2,1,0]=4 492 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_200025704644_100000170003 [1,0,0,0,0,0|2,1,0]=4 493 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_100009815759_200025704644 [1,0,0,0,0,0|2,1,0]=4 494 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_200025704644_100009815759 [1,0,0,0,0,0|2,1,0]=4 495 B12R1.438 CCc1cccc(c1)CN(C)C 270004a_100102631434_100011999841 [1,0,0,0,0,0|3,0,0]=4 496 B12R1.438 CCc1cccc(c1)NC(C)C 2230a_100000211250_100000210206 [1,0,0,0,0,0|3,0,0]=4 497 B12R1.438 CCc1cccc(c1)NC(C)C 34a_100000211250_100000210206 [1,0,0,0,0,0|3,0,0]=4 498 B12R1.438 CCc1cccc(c1)NC(C)C 7a_100000211250_100000210206 [1,0,0,0,0,0|3,0,0]=4 499 B12R1.438 CCc1cccc(c1)OC(C)C 34a_100000211550_100000210206 [1,0,0,0,0,0|3,0,0]=4 500 B12R1.438 CCc1cccc(c1)OC(C)C 7a_100000211550_100000210206 [1,0,0,0,0,0|3,0,0]=4 501 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100000210206_100011263222 [1,0,0,0,0,0|3,0,0]=4 502 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100011263222_100000210206 [1,0,0,0,0,0|3,0,0]=4 503 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_100000174759_200025704644 [1,0,0,0,0,0|2,1,0]=4 504 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000174759 [1,0,0,0,0,0|2,1,0]=4 505 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [1,0,0,0,0,0|2,0,1]=4 506 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [1,0,0,0,0,0|2,0,1]=4 507 B12R1.438 CNc1cccc(c1)OC(C)C 2230a_100011194262_200000210301 [1,0,0,0,0,0|3,0,0]=4 508 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100000756613_100000210206 [1,0,0,0,0,0|3,0,0]=4 509 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100011194262_200000210301 [1,0,0,0,0,0|3,0,0]=4 510 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100000756613_100000210206 [1,0,0,0,0,0|3,0,0]=4 511 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100011194262_200000210301 [1,0,0,0,0,0|3,0,0]=4 512 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000210206_100000219648 [1,0,0,0,0,0|3,0,0]=4 513 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000219648_100000210206 [1,0,0,0,0,0|3,0,0]=4 514 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [1,0,0,0,0,0|2,0,1]=4 515 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [1,0,0,0,0,0|2,0,1]=4 516 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [1,0,0,0,0,0|2,0,1]=4 517 B12R1.438 COc1cc(ccn1)CN(C)C 2230a_100102631434_100103152439 [1,0,0,0,0,0|3,0,0]=4 518 B12R1.438 COc1cc(ccn1)CN(C)C 269982a_100102631434_100103152439 [1,0,0,0,0,0|3,0,0]=4 519 B12R1.438 COc1cc(ccn1)CN(C)C 270004a_100102631434_100000050969 [1,0,0,0,0,0|3,0,0]=4 520 B12R1.438 COc1cc(ccn1)OC(C)C 34a_100012181050_100000210206 [1,0,0,0,0,0|3,0,0]=4 521 B12R1.438 COc1cc(ccn1)SC(C)C 62a_100000117307_100000210206 [1,0,0,0,0,0|3,0,0]=4 522 B12R1.438 COc1cc(ccn1)SC(C)C 62a_100000210206_100000117307 [1,0,0,0,0,0|3,0,0]=4 523 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [1,0,0,0,0,0|1,0,2]=4 524 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,0,0,0,0,0|1,0,1]=3 525 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,0,0,0,0,0|1,0,1]=3 526 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,0,0,0,0,0|1,0,1]=3 527 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,0,0,0,0,0|1,0,1]=3 528 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,0,0,0,0,0|1,0,1]=3 529 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [1,0,0,0,0,0|2,0,0]=3 530 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [1,0,0,0,0,0|2,0,0]=3 531 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [1,0,0,0,0,0|2,0,0]=3 532 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [1,0,0,0,0,0|2,0,0]=3 533 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [1,0,0,0,0,0|2,0,0]=3 534 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [1,0,0,0,0,0|2,0,0]=3 535 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [1,0,0,0,0,0|2,0,0]=3 536 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [1,0,0,0,0,0|2,0,1]=4 537 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [1,0,0,0,0,0|2,0,1]=4 538 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [1,0,0,0,0,0|2,0,1]=4 539 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [1,0,0,0,0,0|2,0,1]=4 540 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [1,0,0,0,0,0|2,0,1]=4 541 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [1,0,0,0,0,0|2,0,1]=4 542 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [1,0,0,0,0,0|2,0,1]=4 543 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [1,0,0,0,0,0|2,0,1]=4 544 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [1,0,0,0,0,0|2,0,1]=4 545 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [1,0,0,0,0,0|2,0,0]=3 546 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [1,0,0,0,0,0|2,0,1]=4 547 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [1,0,0,0,0,0|2,0,0]=3 548 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [1,0,0,0,0,0|2,0,0]=3 549 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [1,0,0,0,0,0|2,0,0]=3 550 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [1,0,0,0,0,0|2,0,0]=3 551 B12R1.438 COc1cccc(c1)OC(F)F 34a_100000703596_200000210301 [1,0,0,0,0,0|3,0,0]=4 552 B12R1.438 COc1cccc(c1)OC(F)F 7a_100000703596_200000210301 [1,0,0,0,0,0|3,0,0]=4 553 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [1,0,0,0,0,0|2,0,0]=3 554 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [1,0,0,0,0,0|2,0,1]=4 555 B12R1.438 COc1cccc(n1)CN(C)C 2230a_100102631434_100000755263 [1,0,0,0,0,0|3,0,0]=4 556 B12R1.438 COc1cccc(n1)CN(C)C 269982a_100102631434_100000755263 [1,0,0,0,0,0|3,0,0]=4 557 B12R1.438 COc1cccc(n1)CN(C)C 270004a_100102631434_100000694346 [1,0,0,0,0,0|3,0,0]=4 558 B12R1.438 COc1cccc(n1)SC(C)C 62a_100000210206_100000760917 [1,0,0,0,0,0|3,0,0]=4 559 B12R1.438 COc1cccc(n1)SC(C)C 62a_100000760917_100000210206 [1,0,0,0,0,0|3,0,0]=4 560 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [1,0,0,0,0,0|2,0,1]=4 561 B12R1.438 COc1ccnc(c1)CN(C)C 2230a_100102631434_100000752681 [1,0,0,0,0,0|3,0,0]=4 562 B12R1.438 COc1ccnc(c1)CN(C)C 269982a_100102631434_100000752681 [1,0,0,0,0,0|3,0,0]=4 563 B12R1.438 COc1ccnc(c1)CN(C)C 270004a_100102631434_100000087537 [1,0,0,0,0,0|3,0,0]=4 564 B12R1.438 COc1ccnc(c1)SC(C)C 62a_100000210206_100011216251 [1,0,0,0,0,0|3,0,0]=4 565 B12R1.438 COc1ccnc(c1)SC(C)C 62a_100009817693_100000210206 [1,0,0,0,0,0|3,0,0]=4 566 B12R1.438 COc1cncc(c1)CN(C)C 270004a_100102631434_100011361638 [1,0,0,0,0,0|3,0,0]=4 567 B12R1.438 COc1cncc(c1)OC(C)C 34a_100000084572_100000210206 [1,0,0,0,0,0|3,0,0]=4 568 B12R1.438 COc1cncc(c1)OC(C)C 7a_100000084572_100000210206 [1,0,0,0,0,0|3,0,0]=4 569 B12R1.438 COc1cncc(c1)SC(C)C 62a_100000050176_100000210206 [1,0,0,0,0,0|3,0,0]=4 570 B12R1.438 COc1cncc(c1)SC(C)C 62a_100000210206_100000050176 [1,0,0,0,0,0|3,0,0]=4 571 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [1,0,0,0,0,0|1,1,1]=4 572 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [1,0,0,0,0,0|1,1,1]=4 573 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [1,0,0,0,0,0|1,1,1]=4 574 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [1,0,0,0,0,0|1,1,1]=4 575 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [1,0,0,0,0,0|1,1,1]=4 576 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [1,0,0,0,0,0|1,1,1]=4 577 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [1,0,0,0,0,0|1,1,0]=3 578 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [1,0,0,0,0,0|1,1,0]=3 579 B12R1.438 CSc1cccc(c1)CN(C)C 2230a_100011934695_200000210301 [1,0,0,0,0,0|2,1,0]=4 580 B12R1.438 CSc1cccc(c1)CN(C)C 269982a_100011934695_200000210301 [1,0,0,0,0,0|2,1,0]=4 581 B12R1.438 CSc1cccc(c1)CN(C)C 270004a_100102631434_100011935093 [1,0,0,0,0,0|2,1,0]=4 582 B12R1.438 CSc1cccc(c1)CN(C)C 62a_100000174759_200000210301 [1,0,0,0,0,0|2,1,0]=4 583 B12R1.438 CSc1cccc(c1)CN(C)C 62a_200000210301_100000174759 [1,0,0,0,0,0|2,1,0]=4 584 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 2230a_100011934695_200025704644 [1,0,0,0,0,0|2,1,0]=4 585 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 269982a_100011934695_200025704644 [1,0,0,0,0,0|2,1,0]=4 586 B12R1.438 CSc1cccc(c1)NC(C)C 2230a_100000210049_100000210206 [1,0,0,0,0,0|2,1,0]=4 587 B12R1.438 CSc1cccc(c1)NC(C)C 34a_100000210049_100000210206 [1,0,0,0,0,0|2,1,0]=4 588 B12R1.438 CSc1cccc(c1)NC(C)C 62a_100000219649_200000210301 [1,0,0,0,0,0|2,1,0]=4 589 B12R1.438 CSc1cccc(c1)NC(C)C 62a_200000210301_100000219649 [1,0,0,0,0,0|2,1,0]=4 590 B12R1.438 CSc1cccc(c1)OC(C)C 34a_100011265683_100000210206 [1,0,0,0,0,0|2,1,0]=4 591 B12R1.438 CSc1cccc(c1)OC(C)C 62a_100000170003_200000210301 [1,0,0,0,0,0|2,1,0]=4 592 B12R1.438 CSc1cccc(c1)OC(C)C 62a_200000210301_100000170003 [1,0,0,0,0,0|2,1,0]=4 593 B12R1.438 CSc1cccc(c1)OC(C)C 7a_100011265683_100000210206 [1,0,0,0,0,0|2,1,0]=4 594 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100000210206_100011215954 [1,0,0,0,0,0|2,1,0]=4 595 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100009815759_200000210301 [1,0,0,0,0,0|2,1,0]=4 596 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100011215954_100000210206 [1,0,0,0,0,0|2,1,0]=4 597 B12R1.438 CSc1cccc(c1)SC(C)C 62a_200000210301_100009815759 [1,0,0,0,0,0|2,1,0]=4 598 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [1,0,0,0,0,0|2,0,1]=4 599 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [1,0,0,0,0,0|2,0,1]=4 600 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,0,0,0,0,0|1,0,1]=3 601 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,0,0,0,0,0|1,0,1]=3 602 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [1,0,0,0,0,0|2,0,1]=4 603 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [1,0,0,0,0,0|2,0,1]=4 604 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [1,0,0,0,0,0|2,0,1]=4 605 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 34a_100000703596_200025704644 [1,0,0,0,0,0|3,0,0]=4 606 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 7a_100000703596_200025704644 [1,0,0,0,0,0|3,0,0]=4 607 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [1,0,0,0,0,0|1,1,1]=4 608 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [1,0,0,0,0,0|1,1,1]=4 609 B14R1.41 COc1cc(ccc1Br)C(=O)C(C)C 1458a_100011934951_100000210206 [0,1,0,0,0,0|2,0,1]=4 610 B14R1.41 COc1cc(ccc1C)C(=O)C(C)C 1458a_100000212341_100000210206 [0,1,0,0,0,0|2,0,1]=4 611 B14R1.41 COc1cc(ccc1Cl)C(=O)C(C)C 1458a_100000181799_100000210206 [0,1,0,0,0,0|2,0,1]=4 612 B14R1.41 COc1cc(ccc1F)C(=O)C(C)C 1458a_100000757635_100000210206 [0,1,0,0,0,0|2,0,1]=4 613 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 2230a_200012002703_100000210206 [0,1,0,0,0,0|3,0,0]=4 614 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 269982a_200012002703_100000210206 [0,1,0,0,0,0|3,0,0]=4 615 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 34a_200012002703_100000210206 [0,1,0,0,0,0|3,0,0]=4 616 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 38a_200012002703_100000210206 [0,1,0,0,0,0|3,0,0]=4 617 B14R1.41 COc1cc(ccc1I)C(=O)C(C)C 1458a_100012356290_100000210206 [0,1,0,0,0,0|2,0,1]=4 618 B14R1.41 COc1cc(ccc1O)C(=C(C)C)C 271570a_200000049429_100000694246 [0,1,0,0,0,0|1,0,2]=4 619 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [0,1,0,0,0,0|1,0,1]=3 620 B14R1.41 COc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000687070 [0,1,0,0,0,0|2,0,1]=4 621 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,0,0,0,0|1,0,1]=3 622 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,0,0,0,0|1,0,1]=3 623 B14R1.343 CCc1cc(cc(c1O)C)SC(C)C 62a_100000210206_100010659108 [0,1,0,0,0,0|3,0,0]=4 624 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 2230a_100010131419_100000210206 [0,1,0,0,0,0|3,0,0]=4 625 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 34a_100010131419_100000210206 [0,1,0,0,0,0|3,0,0]=4 626 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 7a_100010131419_100000210206 [0,1,0,0,0,0|3,0,0]=4 627 B14R1.343 COc1cc(cc(c1F)C)SC(C)C 62a_100000210206_100010271686 [0,1,0,0,0,0|3,0,0]=4 628 B14R1.343 COc1cc(cc(c1F)C)SC(C)C 62a_100010271686_100000210206 [0,1,0,0,0,0|3,0,0]=4 629 B14R1.343 COc1cc(cc(c1F)F)CN(C)C 270004a_100102631434_100000050682 [0,1,0,0,0,0|3,0,0]=4 630 B14R1.343 COc1cc(cc(c1F)F)SC(C)C 62a_100000210206_100011218012 [0,1,0,0,0,0|3,0,0]=4 631 B14R1.343 COc1cc(cc(c1F)F)SC(C)C 62a_100011218012_100000210206 [0,1,0,0,0,0|3,0,0]=4 632 B14R1.343 COc1cc(cc(c1F)O)SC(C)C 62a_100000210206_200015524394 [0,1,0,0,0,0|3,0,0]=4 633 B14R1.343 COc1cc(cc(c1F)O)SC(C)C 62a_200015524394_100000210206 [0,1,0,0,0,0|3,0,0]=4 634 B14R1.343 COc1cc(cc(c1N)C)SC(C)C 62a_100000210206_100000741850 [0,1,0,0,0,0|3,0,0]=4 635 B14R1.343 COc1cc(cc(c1N)C)SC(C)C 62a_100000741850_100000210206 [0,1,0,0,0,0|3,0,0]=4 636 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)C 1458a_100009814412_200000210301 [0,1,0,0,0,0|1,0,1]=3 637 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)[13CH3] 1458a_100009814412_200025704644 [0,1,0,0,0,0|1,0,1]=3 638 B14R1.343 COc1cc(cc(c1O)O)SC(C)C 62a_100000210206_200159242197 [0,1,0,0,0,0|2,0,0]=3 639 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100010141077_100015361967 [0,1,0,0,0,0|1,1,1]=4 640 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100015361967_100010141077 [0,1,0,0,0,0|1,1,1]=4 641 B14R1.439 CC=Cc1cc(ccc1O)CC(=O)C 271570a_100016259895_100010141077 [0,1,0,0,0,0|2,0,1]=4 642 B14R1.439 CCOc1cc(ccc1Br)CN(C)C 270004a_100102631434_200010381951 [0,1,0,0,0,0|3,0,0]=4 643 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 2230a_200016990551_100000210206 [0,1,0,0,0,0|3,0,0]=4 644 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 34a_200016990551_100000210206 [0,1,0,0,0,0|3,0,0]=4 645 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 7a_200016990551_100000210206 [0,1,0,0,0,0|3,0,0]=4 646 B14R1.439 CCOc1cc(ccc1C)SC(C)C 62a_100000210206_100012361169 [0,1,0,0,0,0|3,0,0]=4 647 B14R1.439 CCOc1cc(ccc1C)SC(C)C 62a_100012361169_100000210206 [0,1,0,0,0,0|3,0,0]=4 648 B14R1.439 CCOc1cc(ccc1Cl)NC(C)C 2230a_100011964961_100000210206 [0,1,0,0,0,0|3,0,0]=4 649 B14R1.439 CCOc1cc(ccc1Cl)NC(C)C 34a_100011964961_100000210206 [0,1,0,0,0,0|3,0,0]=4 650 B14R1.439 CCOc1cc(ccc1F)CN(C)C 270004a_100102631434_200000106648 [0,1,0,0,0,0|3,0,0]=4 651 B14R1.439 CCOc1cc(ccc1F)SC(C)C 62a_100000210206_200012344967 [0,1,0,0,0,0|3,0,0]=4 652 B14R1.439 CCOc1cc(ccc1F)SC(C)C 62a_200012344967_100000210206 [0,1,0,0,0,0|3,0,0]=4 653 B14R1.439 CCOc1cc(ccc1N)SC(C)C 62a_100000688918_100000210206 [0,1,0,0,0,0|3,0,0]=4 654 B14R1.439 CCOc1cc(ccc1O)CC(=O)C 1458a_200000048972_200000210301 [0,1,0,0,0,0|1,0,1]=3 655 B14R1.439 CCOc1cc(ccc1O)CC(=O)[13CH3] 1458a_200000048972_200025704644 [0,1,0,0,0,0|1,0,1]=3 656 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100000210202_100010141077 [0,1,0,0,0,0|1,1,1]=4 657 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100010141077_100000210202 [0,1,0,0,0,0|1,1,1]=4 658 B14R1.439 CNCc1cc(ccc1O)SC(C)C 62a_100000210206_100011602694 [0,1,0,0,0,0|3,0,0]=4 659 B14R1.439 CNCc1cc(ccc1O)SC(C)C 62a_100011602694_100000210206 [0,1,0,0,0,0|3,0,0]=4 660 B14R1.439 COCc1cc(ccc1Br)SC(C)C 62a_100000210206_202125822959 [0,1,0,0,0,0|3,0,0]=4 661 B14R1.439 COCc1cc(ccc1Br)SC(C)C 62a_202125822959_100000210206 [0,1,0,0,0,0|3,0,0]=4 662 B14R1.439 COCc1cc(ccc1F)SC(C)C 62a_100000210206_100010140362 [0,1,0,0,0,0|3,0,0]=4 663 B14R1.439 COCc1cc(ccc1F)SC(C)C 62a_100010140362_100000210206 [0,1,0,0,0,0|3,0,0]=4 664 B14R1.705 C=C(C)c1cc(ccc1O)CC(=O)C 271570a_100000694244_100010141077 [0,1,0,0,0,0|2,0,1]=4 665 B14R1.705 CC(C)Sc1ccc(c(c1)C(C)C)O 62a_100000210206_100000691460 [0,1,0,0,0,0|3,0,0]=4 666 B14R1.705 CC(C)Sc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210206 [0,1,0,0,0,0|3,0,0]=4 667 B14R1.881 COc1cc(c(cc1Br)Br)CN(C)C 270004a_100102631434_100010996155 [0,1,0,0,0,0|3,0,0]=4 668 B14R1.881 COc1cc(c(cc1Br)Br)NC(C)C 34a_100000718616_100000210206 [0,1,0,0,0,0|3,0,0]=4 669 B14R1.881 COc1cc(c(cc1Br)Br)NC(C)C 7a_100000718616_100000210206 [0,1,0,0,0,0|3,0,0]=4 670 B14R1.881 COc1cc(c(cc1Br)Br)SC(C)C 62a_100000210206_200014006352 [0,1,0,0,0,0|3,0,0]=4 671 B14R1.881 COc1cc(c(cc1Br)Br)SC(C)C 62a_200014006352_100000210206 [0,1,0,0,0,0|3,0,0]=4 672 B14R1.881 COc1cc(c(cc1Br)C)NC(C)C 34a_100010232211_100000210206 [0,1,0,0,0,0|3,0,0]=4 673 B14R1.881 COc1cc(c(cc1Br)C)NC(C)C 7a_100010232211_100000210206 [0,1,0,0,0,0|3,0,0]=4 674 B14R1.881 COc1cc(c(cc1Br)Cl)NC(C)C 34a_100012361290_100000210206 [0,1,0,0,0,0|3,0,0]=4 675 B14R1.881 COc1cc(c(cc1Br)Cl)NC(C)C 7a_100012361290_100000210206 [0,1,0,0,0,0|3,0,0]=4 676 B14R1.881 COc1cc(c(cc1Br)F)CN(C)C 270004a_100102631434_100000695681 [0,1,0,0,0,0|3,0,0]=4 677 B14R1.881 COc1cc(c(cc1C)Br)NC(C)C 34a_100010244135_100000210206 [0,1,0,0,0,0|3,0,0]=4 678 B14R1.881 COc1cc(c(cc1C)Br)NC(C)C 7a_100010244135_100000210206 [0,1,0,0,0,0|3,0,0]=4 679 B14R1.881 COc1cc(c(cc1C)N)SC(C)C 62a_100000210206_200010584344 [0,1,0,0,0,0|3,0,0]=4 680 B14R1.881 COc1cc(c(cc1C)N)SC(C)C 62a_200010584344_100000210206 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.881 COc1cc(c(cc1Cl)Br)NC(C)C 34a_100013022580_100000210206 [0,1,0,0,0,0|3,0,0]=4 682 B14R1.881 COc1cc(c(cc1Cl)Br)NC(C)C 7a_100013022580_100000210206 [0,1,0,0,0,0|3,0,0]=4 683 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 2230a_100009858536_100000210206 [0,1,0,0,0,0|3,0,0]=4 684 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 34a_100009858536_100000210206 [0,1,0,0,0,0|3,0,0]=4 685 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 7a_100009858536_100000210206 [0,1,0,0,0,0|3,0,0]=4 686 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(C)C 34a_100011830341_100000210206 [0,1,0,0,0,0|3,0,0]=4 687 B14R1.881 COc1cc(c(cc1Cl)F)CN(C)C 270004a_100102631434_100000050388 [0,1,0,0,0,0|3,0,0]=4 688 B14R1.881 COc1cc(c(cc1Cl)F)NC(C)C 34a_100009872666_100000210206 [0,1,0,0,0,0|3,0,0]=4 689 B14R1.881 COc1cc(c(cc1Cl)F)NC(C)C 7a_100009872666_100000210206 [0,1,0,0,0,0|3,0,0]=4 690 B14R1.881 COc1cc(c(cc1Cl)F)SC(C)C 62a_100000210206_100010739614 [0,1,0,0,0,0|3,0,0]=4 691 B14R1.881 COc1cc(c(cc1Cl)F)SC(C)C 62a_100010739614_100000210206 [0,1,0,0,0,0|3,0,0]=4 692 B14R1.881 COc1cc(c(cc1F)Br)CN(C)C 270004a_100102631434_100010366953 [0,1,0,0,0,0|3,0,0]=4 693 B14R1.881 COc1cc(c(cc1F)Br)NC(C)C 34a_100010208193_100000210206 [0,1,0,0,0,0|3,0,0]=4 694 B14R1.881 COc1cc(c(cc1F)Br)NC(C)C 7a_100010208193_100000210206 [0,1,0,0,0,0|3,0,0]=4 695 B14R1.881 COc1cc(c(cc1F)C)SC(C)C 62a_100000210206_100011009880 [0,1,0,0,0,0|3,0,0]=4 696 B14R1.881 COc1cc(c(cc1F)C)SC(C)C 62a_100011009880_100000210206 [0,1,0,0,0,0|3,0,0]=4 697 B14R1.881 COc1cc(c(cc1F)Cl)NC(C)C 34a_100009958774_100000210206 [0,1,0,0,0,0|3,0,0]=4 698 B14R1.881 COc1cc(c(cc1F)Cl)NC(C)C 7a_100009958774_100000210206 [0,1,0,0,0,0|3,0,0]=4 699 B14R1.881 COc1cc(c(cc1F)F)CN(C)C 270004a_100102631434_100010630602 [0,1,0,0,0,0|3,0,0]=4 700 B14R1.881 COc1cc(c(cc1F)F)SC(C)C 62a_100000210206_200015541288 [0,1,0,0,0,0|3,0,0]=4 701 B14R1.881 COc1cc(c(cc1F)F)SC(C)C 62a_200015541288_100000210206 [0,1,0,0,0,0|3,0,0]=4 702 B14R1.881 COc1cc(c(cc1F)N)SC(C)C 62a_100000210206_100010365326 [0,1,0,0,0,0|3,0,0]=4 703 B14R1.881 COc1cc(c(cc1F)N)SC(C)C 62a_100010365326_100000210206 [0,1,0,0,0,0|3,0,0]=4 704 B14R1.881 COc1cc(c(cc1N)C)SC(C)C 62a_100000210206_100010141321 [0,1,0,0,0,0|3,0,0]=4 705 B14R1.881 COc1cc(c(cc1N)C)SC(C)C 62a_100010141321_100000210206 [0,1,0,0,0,0|3,0,0]=4 706 B14R1.881 COc1cc(c(cc1N)F)SC(C)C 62a_100000210206_100012766639 [0,1,0,0,0,0|3,0,0]=4 707 B14R1.881 COc1cc(c(cc1N)F)SC(C)C 62a_100012766639_100000210206 [0,1,0,0,0,0|3,0,0]=4 708 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [0,1,0,0,0,0|1,0,1]=3 709 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [0,1,0,0,0,0|1,0,1]=3 710 B14R1.881 COc1cc(c(cc1O)F)C=C(C)C 271570a_100102525489_100010189133 [0,1,0,0,0,0|1,0,2]=4 711 B14R1.881 COc1cc(c(cc1O)F)SC(C)C 62a_100000210206_100010189133 [0,1,0,0,0,0|2,0,0]=3 712 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_200000035995 [0,1,0,0,0,0|3,0,0]=4 713 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)C 34a_100011279678_200000035995 [0,1,0,0,0,0|3,0,0]=4 714 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_200000035995 [0,1,0,0,0,0|3,0,0]=4 715 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)F 34a_100000701188_200000035995 [0,1,0,0,0,0|3,0,0]=4 716 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)I 34a_100000746945_200000035995 [0,1,0,0,0,0|3,0,0]=4 717 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_200000035995 [0,1,0,0,0,0|2,0,0]=3 718 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_200000035995 [0,1,0,0,0,0|3,0,0]=4 719 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)C 34a_100009865632_200000035995 [0,1,0,0,0,0|3,0,0]=4 720 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_200000035995 [0,1,0,0,0,0|3,0,0]=4 721 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)F 34a_100012001760_200000035995 [0,1,0,0,0,0|3,0,0]=4 722 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)N 34a_100015326901_200000035995 [0,1,0,0,0,0|3,0,0]=4 723 B14R1.3405 C#CC(C)Sc1ccc(c(c1)CC)O 62a_200000035995_100012338938 [0,1,0,0,0,0|3,0,0]=4 724 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)Br 62a_200000035995_100012353699 [0,1,0,0,0,0|3,0,0]=4 725 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)C 62a_200000035995_100011830276 [0,1,0,0,0,0|3,0,0]=4 726 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)Cl 62a_200000035995_100011356853 [0,1,0,0,0,0|3,0,0]=4 727 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)F 62a_200000035995_100011934186 [0,1,0,0,0,0|3,0,0]=4 728 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)N 62a_200000035995_100015196925 [0,1,0,0,0,0|3,0,0]=4 729 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)O 62a_200000035995_100000694246 [0,1,0,0,0,0|2,0,0]=3 730 B14R1.3405 C#CC(C)Sc1ccc(c(n1)OC)O 62a_200000035995_100010893133 [0,1,0,0,0,0|3,0,0]=4 731 B14R1.3405 C=CC(C)Sc1ccc(c(c1)CC)O 62a_100011215867_100012338938 [0,1,0,0,0,0|3,0,0]=4 732 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Br 62a_100011215867_100012353699 [0,1,0,0,0,0|3,0,0]=4 733 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)C 62a_100011215867_100011830276 [0,1,0,0,0,0|3,0,0]=4 734 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Cl 62a_100011215867_100011356853 [0,1,0,0,0,0|3,0,0]=4 735 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)F 62a_100011215867_100011934186 [0,1,0,0,0,0|3,0,0]=4 736 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)N 62a_100011215867_100015196925 [0,1,0,0,0,0|3,0,0]=4 737 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)O 62a_100011215867_100000694246 [0,1,0,0,0,0|2,0,0]=3 738 B14R1.3405 C=CC(C)Sc1ccc(c(n1)OC)O 62a_100011215867_100010893133 [0,1,0,0,0,0|3,0,0]=4 739 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Br 1458a_100000210414_100010110085 [0,1,0,0,0,0|2,0,1]=4 740 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Br 1458a_200010002685_100000210202 [0,1,0,0,0,0|2,0,1]=4 741 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Cl 1458a_100000210414_200010214485 [0,1,0,0,0,0|2,0,1]=4 742 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)F 1458a_100000117344_100000210202 [0,1,0,0,0,0|2,0,1]=4 743 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)F 1458a_100000210414_100012349856 [0,1,0,0,0,0|2,0,1]=4 744 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [0,1,0,0,0,0|1,0,1]=3 745 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000210414 [0,1,0,0,0,0|2,0,1]=4 746 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100000210414 [0,1,0,0,0,0|2,0,1]=4 747 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100000758301 [0,1,0,0,0,0|3,0,0]=4 748 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_100011215416 [0,1,0,0,0,0|3,0,0]=4 749 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)C 2230a_100011279678_100000758301 [0,1,0,0,0,0|3,0,0]=4 750 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)C 34a_100011279678_100011215416 [0,1,0,0,0,0|3,0,0]=4 751 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100000758301 [0,1,0,0,0,0|3,0,0]=4 752 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_100011215416 [0,1,0,0,0,0|3,0,0]=4 753 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)F 2230a_100000701188_100000758301 [0,1,0,0,0,0|3,0,0]=4 754 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)F 34a_100000701188_100011215416 [0,1,0,0,0,0|3,0,0]=4 755 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)I 34a_100000746945_100011215416 [0,1,0,0,0,0|3,0,0]=4 756 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [0,1,0,0,0,0|2,0,0]=3 757 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_100011215416 [0,1,0,0,0,0|3,0,0]=4 758 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Br 7a_100011827694_100000758301 [0,1,0,0,0,0|3,0,0]=4 759 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)C 34a_100009865632_100011215416 [0,1,0,0,0,0|3,0,0]=4 760 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)C 7a_100009865632_100000758301 [0,1,0,0,0,0|3,0,0]=4 761 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_100011215416 [0,1,0,0,0,0|3,0,0]=4 762 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100000758301 [0,1,0,0,0,0|3,0,0]=4 763 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)F 34a_100012001760_100011215416 [0,1,0,0,0,0|3,0,0]=4 764 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)F 7a_100012001760_100000758301 [0,1,0,0,0,0|3,0,0]=4 765 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)N 34a_100015326901_100011215416 [0,1,0,0,0,0|3,0,0]=4 766 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)N 7a_100015326901_100000758301 [0,1,0,0,0,0|3,0,0]=4 767 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Br 62a_100000758301_100012353699 [0,1,0,0,0,0|3,0,0]=4 768 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Br 62a_100012353699_100000758301 [0,1,0,0,0,0|3,0,0]=4 769 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)C 62a_100000758301_100011830276 [0,1,0,0,0,0|3,0,0]=4 770 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)C 62a_100011830276_100000758301 [0,1,0,0,0,0|3,0,0]=4 771 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Cl 62a_100000758301_100011356853 [0,1,0,0,0,0|3,0,0]=4 772 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100000758301 [0,1,0,0,0,0|3,0,0]=4 773 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)F 62a_100000758301_100011934186 [0,1,0,0,0,0|3,0,0]=4 774 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)F 62a_100011934186_100000758301 [0,1,0,0,0,0|3,0,0]=4 775 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)N 62a_100000758301_100015196925 [0,1,0,0,0,0|3,0,0]=4 776 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)N 62a_100011279103_100000758301 [0,1,0,0,0,0|3,0,0]=4 777 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [0,1,0,0,0,0|2,0,0]=3 778 B14R1.3405 CCC(C)Sc1ccc(c(n1)OC)O 62a_100000758301_100010893133 [0,1,0,0,0,0|3,0,0]=4 779 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 2230a_100000225621_100010110085 [0,1,0,0,0,0|3,0,0]=4 780 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 269982a_100000225621_100010110085 [0,1,0,0,0,0|3,0,0]=4 781 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 26a_100000225621_100011827694 [0,1,0,0,0,0|3,0,0]=4 782 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 2230a_100000225621_200010214485 [0,1,0,0,0,0|3,0,0]=4 783 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 269982a_100000225621_200010214485 [0,1,0,0,0,0|3,0,0]=4 784 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 26a_100000225621_100012186310 [0,1,0,0,0,0|3,0,0]=4 785 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)F 2230a_100000225621_100012349856 [0,1,0,0,0,0|3,0,0]=4 786 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)F 269982a_100000225621_100012349856 [0,1,0,0,0,0|3,0,0]=4 787 B14R1.3405 CCc1cc(ccc1O)SC(C)C#N 62a_100000703298_100012338938 [0,1,0,0,0,0|2,0,1]=4 788 B14R1.3405 CCc1cc(ccc1O)SC(C)CC 62a_100000758301_100012338938 [0,1,0,0,0,0|3,0,0]=4 789 B14R1.3405 CCc1cc(ccc1O)SC(C)CO 62a_100012180447_100012338938 [0,1,0,0,0,0|3,0,0]=4 790 B14R1.3405 CCc1cc(ccc1O)SC(C)OC 62a_100009879195_100012338938 [0,1,0,0,0,0|3,0,0]=4 791 B14R1.3405 CCc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100012338938 [0,1,0,0,0,0|3,0,0]=4 792 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 11a_106832991635_200010002685 [0,1,0,0,0,0|2,0,1]=4 793 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 240690a_100102657272_200010002685 [0,1,0,0,0,0|2,0,1]=4 794 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 527a_100102657272_200010002685 [0,1,0,0,0,0|2,0,1]=4 795 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 11a_106832991635_100000117344 [0,1,0,0,0,0|2,0,1]=4 796 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 1626a_100102657272_100000117344 [0,1,0,0,0,0|2,0,1]=4 797 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 240690a_100102657272_100000117344 [0,1,0,0,0,0|2,0,1]=4 798 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 527a_100102657272_100000117344 [0,1,0,0,0,0|2,0,1]=4 799 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [0,1,0,0,0,0|1,0,1]=3 800 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [0,1,0,0,0,0|1,0,1]=3 801 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)O 2430a_100000726020_100102657272 [0,1,0,0,0,0|2,0,1]=4 802 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [0,1,0,0,0,0|1,0,0]=2 803 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [0,1,0,0,0,0|1,0,0]=2 804 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)N 34a_200009957001_200000210301 [0,1,0,0,0,0|2,0,1]=4 805 B14R1.3405 COC(=O)Cc1ccc(c(c1)O[13CH3])N 34a_200009957001_200025704644 [0,1,0,0,0,0|2,0,1]=4 806 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_100010222482_200000210301 [0,1,0,0,0,0|1,1,1]=4 807 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_200000210301_100010222482 [0,1,0,0,0,0|1,1,1]=4 808 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010222482_200025704644 [0,1,0,0,0,0|1,1,1]=4 809 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010222482 [0,1,0,0,0,0|1,1,1]=4 810 B14R1.3405 COc1cc(ccc1Br)CC(=O)CF 1458a_200010002685_100015361967 [0,1,0,0,0,0|2,0,1]=4 811 B14R1.3405 COc1cc(ccc1Br)CC(=O)CO 1458a_100000210174_100010110085 [0,1,0,0,0,0|2,0,1]=4 812 B14R1.3405 COc1cc(ccc1Br)NC(C)C#N 2230a_100000765947_100000184139 [0,1,0,0,0,0|2,0,1]=4 813 B14R1.3405 COc1cc(ccc1Br)NC(C)CO 2230a_100000765947_100012180447 [0,1,0,0,0,0|3,0,0]=4 814 B14R1.3405 COc1cc(ccc1Br)NC(C)CO 34a_100000765947_100012180447 [0,1,0,0,0,0|3,0,0]=4 815 B14R1.3405 COc1cc(ccc1Br)OC(C)C#N 7a_100011827694_100000703298 [0,1,0,0,0,0|2,0,1]=4 816 B14R1.3405 COc1cc(ccc1Br)OC(C)CO 34a_100011827694_100012180447 [0,1,0,0,0,0|3,0,0]=4 817 B14R1.3405 COc1cc(ccc1Br)OC(C)CO 7a_100011827694_100012180447 [0,1,0,0,0,0|3,0,0]=4 818 B14R1.3405 COc1cc(ccc1Br)SC(C)C#N 62a_100000703298_100012353699 [0,1,0,0,0,0|2,0,1]=4 819 B14R1.3405 COc1cc(ccc1Br)SC(C)C#N 62a_100012353699_100000703298 [0,1,0,0,0,0|2,0,1]=4 820 B14R1.3405 COc1cc(ccc1Br)SC(C)CO 62a_100012180447_100012353699 [0,1,0,0,0,0|3,0,0]=4 821 B14R1.3405 COc1cc(ccc1Br)SC(C)OC 62a_100009879195_100012353699 [0,1,0,0,0,0|3,0,0]=4 822 B14R1.3405 COc1cc(ccc1Br)SC(C)OC 62a_100012353699_100009879195 [0,1,0,0,0,0|3,0,0]=4 823 B14R1.3405 COc1cc(ccc1Br)S[C@H](C)CO 62a_100012353699_100016084084 [0,1,0,0,0,0|3,0,0]=4 824 B14R1.3405 COc1cc(ccc1Br)S[C@H](C)CO 62a_100016084084_100012353699 [0,1,0,0,0,0|3,0,0]=4 825 B14R1.3405 COc1cc(ccc1C)NC(C)C#N 2230a_100011279678_100000184139 [0,1,0,0,0,0|2,0,1]=4 826 B14R1.3405 COc1cc(ccc1C)NC(C)CO 2230a_100011279678_100012180447 [0,1,0,0,0,0|3,0,0]=4 827 B14R1.3405 COc1cc(ccc1C)NC(C)CO 34a_100011279678_100012180447 [0,1,0,0,0,0|3,0,0]=4 828 B14R1.3405 COc1cc(ccc1C)OC(C)C#N 7a_100009865632_100000703298 [0,1,0,0,0,0|2,0,1]=4 829 B14R1.3405 COc1cc(ccc1C)OC(C)CO 34a_100009865632_100012180447 [0,1,0,0,0,0|3,0,0]=4 830 B14R1.3405 COc1cc(ccc1C)OC(C)CO 7a_100009865632_100012180447 [0,1,0,0,0,0|3,0,0]=4 831 B14R1.3405 COc1cc(ccc1C)SC(C)C#N 62a_100000703298_100011830276 [0,1,0,0,0,0|2,0,1]=4 832 B14R1.3405 COc1cc(ccc1C)SC(C)C#N 62a_100011830276_100000703298 [0,1,0,0,0,0|2,0,1]=4 833 B14R1.3405 COc1cc(ccc1C)SC(C)CO 62a_100012180447_100011830276 [0,1,0,0,0,0|3,0,0]=4 834 B14R1.3405 COc1cc(ccc1C)SC(C)OC 62a_100009879195_100011830276 [0,1,0,0,0,0|3,0,0]=4 835 B14R1.3405 COc1cc(ccc1C)SC(C)OC 62a_100011830276_100009879195 [0,1,0,0,0,0|3,0,0]=4 836 B14R1.3405 COc1cc(ccc1C)S[C@H](C)CO 62a_100011830276_100016084084 [0,1,0,0,0,0|3,0,0]=4 837 B14R1.3405 COc1cc(ccc1C)S[C@H](C)CO 62a_100016084084_100011830276 [0,1,0,0,0,0|3,0,0]=4 838 B14R1.3405 COc1cc(ccc1Cl)CC(=O)CO 1458a_100000210174_200010214485 [0,1,0,0,0,0|2,0,1]=4 839 B14R1.3405 COc1cc(ccc1Cl)NC(C)C#N 2230a_100000742311_100000184139 [0,1,0,0,0,0|2,0,1]=4 840 B14R1.3405 COc1cc(ccc1Cl)NC(C)CO 2230a_100000742311_100012180447 [0,1,0,0,0,0|3,0,0]=4 841 B14R1.3405 COc1cc(ccc1Cl)NC(C)CO 34a_100000742311_100012180447 [0,1,0,0,0,0|3,0,0]=4 842 B14R1.3405 COc1cc(ccc1Cl)OC(C)C#N 7a_100012186310_100000703298 [0,1,0,0,0,0|2,0,1]=4 843 B14R1.3405 COc1cc(ccc1Cl)OC(C)CO 34a_100012186310_100012180447 [0,1,0,0,0,0|3,0,0]=4 844 B14R1.3405 COc1cc(ccc1Cl)OC(C)CO 7a_100012186310_100012180447 [0,1,0,0,0,0|3,0,0]=4 845 B14R1.3405 COc1cc(ccc1Cl)SC(C)C#N 62a_100000703298_100011356853 [0,1,0,0,0,0|2,0,1]=4 846 B14R1.3405 COc1cc(ccc1Cl)SC(C)C#N 62a_100011356853_100000703298 [0,1,0,0,0,0|2,0,1]=4 847 B14R1.3405 COc1cc(ccc1Cl)SC(C)CO 62a_100012180447_100011356853 [0,1,0,0,0,0|3,0,0]=4 848 B14R1.3405 COc1cc(ccc1Cl)SC(C)OC 62a_100009879195_100011356853 [0,1,0,0,0,0|3,0,0]=4 849 B14R1.3405 COc1cc(ccc1Cl)SC(C)OC 62a_100011356853_100009879195 [0,1,0,0,0,0|3,0,0]=4 850 B14R1.3405 COc1cc(ccc1Cl)S[C@H](C)CO 62a_100011356853_100016084084 [0,1,0,0,0,0|3,0,0]=4 851 B14R1.3405 COc1cc(ccc1Cl)S[C@H](C)CO 62a_100016084084_100011356853 [0,1,0,0,0,0|3,0,0]=4 852 B14R1.3405 COc1cc(ccc1F)CC(=O)CF 1458a_100000117344_100015361967 [0,1,0,0,0,0|2,0,1]=4 853 B14R1.3405 COc1cc(ccc1F)CC(=O)CO 1458a_100000210174_100012349856 [0,1,0,0,0,0|2,0,1]=4 854 B14R1.3405 COc1cc(ccc1F)NC(C)C#N 2230a_100000701188_100000184139 [0,1,0,0,0,0|2,0,1]=4 855 B14R1.3405 COc1cc(ccc1F)NC(C)CO 2230a_100000701188_100012180447 [0,1,0,0,0,0|3,0,0]=4 856 B14R1.3405 COc1cc(ccc1F)NC(C)CO 34a_100000701188_100012180447 [0,1,0,0,0,0|3,0,0]=4 857 B14R1.3405 COc1cc(ccc1F)OC(C)C#N 7a_100012001760_100000703298 [0,1,0,0,0,0|2,0,1]=4 858 B14R1.3405 COc1cc(ccc1F)OC(C)CO 34a_100012001760_100012180447 [0,1,0,0,0,0|3,0,0]=4 859 B14R1.3405 COc1cc(ccc1F)OC(C)CO 7a_100012001760_100012180447 [0,1,0,0,0,0|3,0,0]=4 860 B14R1.3405 COc1cc(ccc1F)SC(C)C#N 62a_100000703298_100011934186 [0,1,0,0,0,0|2,0,1]=4 861 B14R1.3405 COc1cc(ccc1F)SC(C)C#N 62a_100011934186_100000703298 [0,1,0,0,0,0|2,0,1]=4 862 B14R1.3405 COc1cc(ccc1F)SC(C)CO 62a_100012180447_100011934186 [0,1,0,0,0,0|3,0,0]=4 863 B14R1.3405 COc1cc(ccc1F)SC(C)OC 62a_100009879195_100011934186 [0,1,0,0,0,0|3,0,0]=4 864 B14R1.3405 COc1cc(ccc1F)SC(C)OC 62a_100011934186_100009879195 [0,1,0,0,0,0|3,0,0]=4 865 B14R1.3405 COc1cc(ccc1F)S[C@H](C)CO 62a_100011934186_100016084084 [0,1,0,0,0,0|3,0,0]=4 866 B14R1.3405 COc1cc(ccc1F)S[C@H](C)CO 62a_100016084084_100011934186 [0,1,0,0,0,0|3,0,0]=4 867 B14R1.3405 COc1cc(ccc1I)NC(C)CO 34a_100000746945_100012180447 [0,1,0,0,0,0|3,0,0]=4 868 B14R1.3405 COc1cc(ccc1N)OC(C)C#N 7a_100015326901_100000703298 [0,1,0,0,0,0|2,0,1]=4 869 B14R1.3405 COc1cc(ccc1N)OC(C)CO 34a_100015326901_100012180447 [0,1,0,0,0,0|3,0,0]=4 870 B14R1.3405 COc1cc(ccc1N)OC(C)CO 7a_100015326901_100012180447 [0,1,0,0,0,0|3,0,0]=4 871 B14R1.3405 COc1cc(ccc1N)SC(C)C#N 62a_100000703298_100015196925 [0,1,0,0,0,0|2,0,1]=4 872 B14R1.3405 COc1cc(ccc1N)SC(C)C#N 62a_100011279103_100000703298 [0,1,0,0,0,0|2,0,1]=4 873 B14R1.3405 COc1cc(ccc1N)SC(C)CO 62a_100012180447_100015196925 [0,1,0,0,0,0|3,0,0]=4 874 B14R1.3405 COc1cc(ccc1N)SC(C)OC 62a_100009879195_100015196925 [0,1,0,0,0,0|3,0,0]=4 875 B14R1.3405 COc1cc(ccc1N)SC(C)OC 62a_100011279103_100009879195 [0,1,0,0,0,0|3,0,0]=4 876 B14R1.3405 COc1cc(ccc1N)S[C@H](C)CO 62a_100011279103_100016084084 [0,1,0,0,0,0|3,0,0]=4 877 B14R1.3405 COc1cc(ccc1N)S[C@H](C)CO 62a_100016084084_100015196925 [0,1,0,0,0,0|3,0,0]=4 878 B14R1.3405 COc1cc(ccc1O)CC(=O)CF 1458a_100000032101_100015361967 [0,1,0,0,0,0|1,0,1]=3 879 B14R1.3405 COc1cc(ccc1O)NC(=O)CO 22a_100000726020_100000210174 [0,1,0,0,0,0|2,0,1]=4 880 B14R1.3405 COc1cc(ccc1O)NC(=O)CO 527a_100000726020_100000210174 [0,1,0,0,0,0|2,0,1]=4 881 B14R1.3405 COc1cc(ccc1O)NC(C)CO 34a_100000726020_100012180447 [0,1,0,0,0,0|2,0,0]=3 882 B14R1.3405 COc1cc(ccc1O)SC(C)C#N 62a_100000703298_100000694246 [0,1,0,0,0,0|1,0,1]=3 883 B14R1.3405 COc1cc(ccc1O)SC(C)CO 62a_100012180447_100000694246 [0,1,0,0,0,0|2,0,0]=3 884 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [0,1,0,0,0,0|2,0,0]=3 885 B14R1.3405 COc1cc(ccc1O)SC(F)C#N 62a_200000117898_100000694246 [0,1,0,0,0,0|2,0,1]=4 886 B14R1.3405 COc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000694246 [0,1,0,0,0,0|2,0,0]=3 887 B14R1.3405 COc1nc(ccc1O)SC(C)C#N 62a_100000703298_100010893133 [0,1,0,0,0,0|2,0,1]=4 888 B14R1.3405 COc1nc(ccc1O)SC(C)CO 62a_100012180447_100010893133 [0,1,0,0,0,0|3,0,0]=4 889 B14R1.3405 COc1nc(ccc1O)SC(C)OC 62a_100009879195_100010893133 [0,1,0,0,0,0|3,0,0]=4 890 B14R1.3405 COc1nc(ccc1O)S[C@H](C)CO 62a_100016084084_100010893133 [0,1,0,0,0,0|3,0,0]=4 891 B14R1.3412 CCc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100012338938 [0,1,0,0,0,0|3,0,0]=4 892 B14R1.3412 CNc1cc(ccc1O)CS(=O)(=O)N 2230a_200010686696_200000210301 [0,1,0,0,0,0|3,0,0]=4 893 B14R1.3412 CNc1cc(ccc1O)CS(=O)(=O)N 34a_200010686696_200000210301 [0,1,0,0,0,0|3,0,0]=4 894 B14R1.3412 COc1cc(ccc1Br)NC(C)(C)C 34a_100000765947_100000210625 [0,1,0,0,0,0|3,0,0]=4 895 B14R1.3412 COc1cc(ccc1Br)OC(C)(C)C 34a_100011827694_100000210625 [0,1,0,0,0,0|3,0,0]=4 896 B14R1.3412 COc1cc(ccc1Br)SC(C)(C)C 62a_100000211941_100012353699 [0,1,0,0,0,0|3,0,0]=4 897 B14R1.3412 COc1cc(ccc1Br)SC(C)(C)C 62a_100012353699_100000211941 [0,1,0,0,0,0|3,0,0]=4 898 B14R1.3412 COc1cc(ccc1C)NC(C)(C)C 34a_100011279678_100000210625 [0,1,0,0,0,0|3,0,0]=4 899 B14R1.3412 COc1cc(ccc1C)OC(C)(C)C 34a_100009865632_100000210625 [0,1,0,0,0,0|3,0,0]=4 900 B14R1.3412 COc1cc(ccc1C)SC(C)(C)C 62a_100000211941_100011830276 [0,1,0,0,0,0|3,0,0]=4 901 B14R1.3412 COc1cc(ccc1C)SC(C)(C)C 62a_100011830276_100000211941 [0,1,0,0,0,0|3,0,0]=4 902 B14R1.3412 COc1cc(ccc1Cl)NC(C)(C)C 34a_100000742311_100000210625 [0,1,0,0,0,0|3,0,0]=4 903 B14R1.3412 COc1cc(ccc1Cl)OC(C)(C)C 34a_100012186310_100000210625 [0,1,0,0,0,0|3,0,0]=4 904 B14R1.3412 COc1cc(ccc1Cl)SC(C)(C)C 62a_100000211941_100011356853 [0,1,0,0,0,0|3,0,0]=4 905 B14R1.3412 COc1cc(ccc1Cl)SC(C)(C)C 62a_100011356853_100000211941 [0,1,0,0,0,0|3,0,0]=4 906 B14R1.3412 COc1cc(ccc1F)NC(C)(C)C 34a_100000701188_100000210625 [0,1,0,0,0,0|3,0,0]=4 907 B14R1.3412 COc1cc(ccc1F)OC(C)(C)C 34a_100012001760_100000210625 [0,1,0,0,0,0|3,0,0]=4 908 B14R1.3412 COc1cc(ccc1F)SC(C)(C)C 62a_100000211941_100011934186 [0,1,0,0,0,0|3,0,0]=4 909 B14R1.3412 COc1cc(ccc1F)SC(C)(C)C 62a_100011934186_100000211941 [0,1,0,0,0,0|3,0,0]=4 910 B14R1.3412 COc1cc(ccc1I)NC(C)(C)C 34a_100000746945_100000210625 [0,1,0,0,0,0|3,0,0]=4 911 B14R1.3412 COc1cc(ccc1N)OC(C)(C)C 34a_100015326901_100000210625 [0,1,0,0,0,0|3,0,0]=4 912 B14R1.3412 COc1cc(ccc1N)SC(C)(C)C 62a_100000211941_100015196925 [0,1,0,0,0,0|3,0,0]=4 913 B14R1.3412 COc1cc(ccc1N)SC(C)(C)C 62a_100011279103_100000211941 [0,1,0,0,0,0|3,0,0]=4 914 B14R1.3412 COc1cc(ccc1O)NC(C)(C)C 34a_100000726020_100000210625 [0,1,0,0,0,0|2,0,0]=3 915 B14R1.3412 COc1cc(ccc1O)NC(F)(F)F 34a_100000726020_200103152311 [0,1,0,0,0,0|3,0,0]=4 916 B14R1.3412 COc1cc(ccc1O)NS(=O)(=O)C 40a_100000726020_100000738038 [0,1,0,0,0,0|3,0,0]=4 917 B14R1.3412 COc1cc(ccc1O)OC(F)(F)F 271570a_203496583355_100010195628 [0,1,0,0,0,0|3,0,0]=4 918 B14R1.3412 COc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100000694246 [0,1,0,0,0,0|2,0,0]=3 919 B14R1.3412 COc1cc(ccc1O)SC(F)(F)F 62a_200000243211_100000694246 [0,1,0,0,0,0|3,0,0]=4 920 B14R1.3412 COc1nc(ccc1O)SC(C)(C)C 62a_100000211941_100010893133 [0,1,0,0,0,0|3,0,0]=4 921 B14R1.3412 [13CH3]Nc1cc(ccc1O)CS(=O)(=O)N 2230a_200010686696_200025704644 [0,1,0,0,0,0|3,0,0]=4 922 B14R1.3412 [13CH3]Nc1cc(ccc1O)CS(=O)(=O)N 34a_200010686696_200025704644 [0,1,0,0,0,0|3,0,0]=4 923 B14R1.3651 CCc1cc(ccc1OC)SC(C)C 62a_100000210206_200010179862 [0,1,0,0,0,0|3,0,0]=4 924 B14R1.3651 CCc1cc(ccc1OC)SC(C)C 62a_200010179862_100000210206 [0,1,0,0,0,0|3,0,0]=4 925 B14R1.3651 CCc1ccc(cc1OC)SC(C)C 62a_100000210206_200010710398 [0,1,0,0,0,0|3,0,0]=4 926 B14R1.3651 CCc1ccc(cc1OC)SC(C)C 62a_200010710398_100000210206 [0,1,0,0,0,0|3,0,0]=4 927 B14R1.3651 COc1cc(ccc1C#N)CN(C)C 270004a_100102631434_100000726430 [0,1,0,0,0,0|3,0,0]=4 928 B14R1.3651 COc1cc(ccc1C#N)NC(C)C 34a_100011999456_100000210206 [0,1,0,0,0,0|3,0,0]=4 929 B14R1.3651 COc1cc(ccc1C#N)SC(C)C 62a_100000210206_100000694671 [0,1,0,0,0,0|3,0,0]=4 930 B14R1.3651 COc1cc(ccc1C=O)SC(C)C 62a_100000210206_100010290300 [0,1,0,0,0,0|2,0,1]=4 931 B14R1.3651 COc1cc(ccc1C=O)SC(C)C 62a_100000697075_100000210206 [0,1,0,0,0,0|2,0,1]=4 932 B14R1.3651 COc1cc(ccc1CO)C=C(C)C 271570a_100102525489_100011277633 [0,1,0,0,0,0|1,0,2]=4 933 B14R1.3651 COc1cc(ccc1CO)NC(=O)C 22a_100012183141_100000070787 [0,1,0,0,0,0|2,0,1]=4 934 B14R1.3651 COc1cc(ccc1CO)NC(C)C 34a_100012183141_100000210206 [0,1,0,0,0,0|2,0,0]=3 935 B14R1.3651 COc1cc(ccc1CO)OC(C)C 34a_200000116926_100000210206 [0,1,0,0,0,0|2,0,0]=3 936 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100000210206_100011277633 [0,1,0,0,0,0|2,0,0]=3 937 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100011277633_100000210206 [0,1,0,0,0,0|2,0,0]=3 938 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,1,0,0,0,0|1,0,1]=3 939 B14R1.3651 COc1cc(ccc1SC)CN(C)C 270004a_100102631434_100000050949 [0,1,0,0,0,0|2,1,0]=4 940 B14R1.3651 COc1cc(ccc1SC)SC(C)C 62a_200011001119_100000210206 [0,1,0,0,0,0|2,1,0]=4 941 B14R1.3651 COc1cc(cnc1CO)SC(C)C 62a_100000210206_200010246159 [0,1,0,0,0,0|3,0,0]=4 942 B14R1.3651 COc1cc(cnc1CO)SC(C)C 62a_200010246159_100000210206 [0,1,0,0,0,0|3,0,0]=4 943 B14R1.3651 COc1cc(cnc1OC)CN(C)C 270004a_100102631434_100000117638 [0,1,0,0,0,0|3,0,0]=4 944 B14R1.3651 COc1cc(cnc1OC)SC(C)C 62a_100000210206_100010234541 [0,1,0,0,0,0|3,0,0]=4 945 B14R1.3651 COc1cc(ncc1CO)SC(C)C 62a_100000210206_100010714672 [0,1,0,0,0,0|3,0,0]=4 946 B14R1.3651 COc1cc(ncc1CO)SC(C)C 62a_100010714672_100000210206 [0,1,0,0,0,0|3,0,0]=4 947 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [0,1,0,0,0,0|1,0,2]=4 948 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,1,0,0,0,0|1,0,1]=3 949 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,1,0,0,0,0|1,0,1]=3 950 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,1,0,0,0,0|1,0,1]=3 951 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [0,1,0,0,0,0|2,0,0]=3 952 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [0,1,0,0,0,0|2,0,0]=3 953 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [0,1,0,0,0,0|2,0,0]=3 954 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [0,1,0,0,0,0|2,0,0]=3 955 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [0,1,0,0,0,0|2,0,0]=3 956 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [0,1,0,0,0,0|2,0,0]=3 957 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [0,1,0,0,0,0|2,0,0]=3 958 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 11a_100000187404_100015343762 [0,1,0,0,0,0|2,0,1]=4 959 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 1626a_100000187404_100015343762 [0,1,0,0,0,0|2,0,1]=4 960 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 22a_100000187404_100000070787 [0,1,0,0,0,0|2,0,1]=4 961 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 527a_100000187404_100103153847 [0,1,0,0,0,0|2,0,1]=4 962 B14R1.3651 COc1ccc(cc1OC)NC(C)C 34a_100000187404_100000210206 [0,1,0,0,0,0|2,0,0]=3 963 B14R1.3651 COc1ccc(cc1OC)OC(C)C 34a_100000039706_100000210206 [0,1,0,0,0,0|2,0,0]=3 964 B14R1.3651 COc1ccc(cc1OC)SC(C)C 62a_100000210206_100011356967 [0,1,0,0,0,0|2,0,0]=3 965 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_100011493462_200000210301 [0,1,0,0,0,0|1,1,1]=4 966 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_200000210301_100011493462 [0,1,0,0,0,0|1,1,1]=4 967 B14R1.3651 COc1ccc(cc1SC)SC(C)C 62a_200009892704_100000210206 [0,1,0,0,0,0|2,1,0]=4 968 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_100011493462_200025704644 [0,1,0,0,0,0|1,1,1]=4 969 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_200025704644_100011493462 [0,1,0,0,0,0|1,1,1]=4 970 B14R1.3651 COc1ccc(nc1OC)SC(C)C 62a_100000210206_100010214848 [0,1,0,0,0,0|3,0,0]=4 971 B14R1.3651 COc1nc(ccc1CO)SC(C)C 62a_100000210206_100010988397 [0,1,0,0,0,0|3,0,0]=4 972 B14R1.3651 COc1nc(ccc1CO)SC(C)C 62a_100010988397_100000210206 [0,1,0,0,0,0|3,0,0]=4 973 B14R1.4106 CC(C)Oc1ccc(c(c1F)O[13CH3])Br 34a_202127810487_200025704644 [0,1,0,0,0,0|3,0,0]=4 974 B14R1.4106 CC(C)Oc1ccc(c(c1F)O[13CH3])Br 7a_202127810487_200025704644 [0,1,0,0,0,0|3,0,0]=4 975 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)Cl 1458a_100000070787_100010116237 [0,1,0,0,0,0|2,0,1]=4 976 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)F 1458a_100000070787_100009814548 [0,1,0,0,0,0|2,0,1]=4 977 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 2230a_100102631434_100010116237 [0,1,0,0,0,0|3,0,0]=4 978 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 269982a_100102631434_100010116237 [0,1,0,0,0,0|3,0,0]=4 979 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 270004a_100102631434_100009889114 [0,1,0,0,0,0|3,0,0]=4 980 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 2230a_100102631434_100009814548 [0,1,0,0,0,0|3,0,0]=4 981 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 269982a_100102631434_100009814548 [0,1,0,0,0,0|3,0,0]=4 982 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 270004a_100102631434_100000050928 [0,1,0,0,0,0|3,0,0]=4 983 B14R1.4106 COc1c(ccc(c1F)NC(C)C)F 34a_100137314619_100000210206 [0,1,0,0,0,0|3,0,0]=4 984 B14R1.4106 COc1c(ccc(c1F)OC(C)C)Br 34a_202127810487_200000210301 [0,1,0,0,0,0|3,0,0]=4 985 B14R1.4106 COc1c(ccc(c1F)OC(C)C)Br 7a_202127810487_200000210301 [0,1,0,0,0,0|3,0,0]=4 986 B14R1.4106 COc1c(ccc(c1F)OC(C)C)F 34a_100000062073_100000210206 [0,1,0,0,0,0|3,0,0]=4 987 B14R1.4106 COc1c(ccc(c1F)OC(C)C)F 7a_100000062073_100000210206 [0,1,0,0,0,0|3,0,0]=4 988 B14R1.4106 COc1c(ccc(c1F)SC(C)C)Cl 62a_100000210206_200135222481 [0,1,0,0,0,0|3,0,0]=4 989 B14R1.4106 COc1c(ccc(c1F)SC(C)C)Cl 62a_200135222481_100000210206 [0,1,0,0,0,0|3,0,0]=4 990 B14R1.4106 COc1c(ccc(c1F)SC(C)C)N 62a_100000210206_100010734149 [0,1,0,0,0,0|3,0,0]=4 991 B14R1.4106 COc1c(ccc(c1F)SC(C)C)N 62a_100010734149_100000210206 [0,1,0,0,0,0|3,0,0]=4 992 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,0,0,1,0,0|1,0,2]=4 993 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,0,0,1,0,0|2,0,1]=4 994 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,0,0,1,0,0|1,0,1]=3 995 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,0,0,1,0,0|2,0,1]=4 996 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,0,0,1,0,0|2,0,1]=4 997 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,0,0,1,0,0|2,0,1]=4 998 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,0,0,1,0,0|2,0,1]=4 999 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000210206 [0,0,0,1,0,0|3,0,0]=4 1000 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100000210206 [0,0,0,1,0,0|3,0,0]=4 1001 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000210206 [0,0,0,1,0,0|2,0,0]=3 1002 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210206 [0,0,0,1,0,0|2,0,0]=3 1003 B14R2.1008 CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210206 [0,0,0,1,0,0|2,0,0]=3 1004 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000210206_100000729065 [0,0,0,1,0,0|3,0,0]=4 1005 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000210206 [0,0,0,1,0,0|3,0,0]=4 1006 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100000210206_100009818566 [0,0,0,1,0,0|3,0,0]=4 1007 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000210206 [0,0,0,1,0,0|3,0,0]=4 1008 B14R2.1008 CN(C)Cc1ccc2c(c1)CCO2 270004a_100102631434_100011218456 [0,0,0,1,0,0|3,0,0]=4 1009 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [0,0,0,1,0,0|2,0,0]=3 1010 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [0,0,0,1,0,0|2,0,0]=3 1011 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [0,0,0,1,0,0|2,0,0]=3 1012 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [0,0,0,1,0,0|2,0,0]=3 1013 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [0,0,0,1,0,0|2,0,0]=3 1014 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,0,0,1,0,0|2,0,1]=4 1015 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,0,0,1,0,0|1,0,1]=3 1016 B14R2.3168 COc1cc(ccc1Br)NC2CC2 34a_100000765947_100000211595 [0,0,0,1,0,0|3,0,0]=4 1017 B14R2.3168 COc1cc(ccc1Br)OC2CC2 34a_100011827694_100000211595 [0,0,0,1,0,0|3,0,0]=4 1018 B14R2.3168 COc1cc(ccc1Br)SC2CC2 62a_100012353699_100000211595 [0,0,0,1,0,0|3,0,0]=4 1019 B14R2.3168 COc1cc(ccc1C)NC2CC2 34a_100011279678_100000211595 [0,0,0,1,0,0|3,0,0]=4 1020 B14R2.3168 COc1cc(ccc1C)OC2CC2 34a_100009865632_100000211595 [0,0,0,1,0,0|3,0,0]=4 1021 B14R2.3168 COc1cc(ccc1C)SC2CC2 62a_100011830276_100000211595 [0,0,0,1,0,0|3,0,0]=4 1022 B14R2.3168 COc1cc(ccc1Cl)NC2CC2 34a_100000742311_100000211595 [0,0,0,1,0,0|3,0,0]=4 1023 B14R2.3168 COc1cc(ccc1Cl)OC2CC2 34a_100012186310_100000211595 [0,0,0,1,0,0|3,0,0]=4 1024 B14R2.3168 COc1cc(ccc1Cl)SC2CC2 62a_100011356853_100000211595 [0,0,0,1,0,0|3,0,0]=4 1025 B14R2.3168 COc1cc(ccc1F)NC2CC2 34a_100000701188_100000211595 [0,0,0,1,0,0|3,0,0]=4 1026 B14R2.3168 COc1cc(ccc1F)OC2CC2 34a_100012001760_100000211595 [0,0,0,1,0,0|3,0,0]=4 1027 B14R2.3168 COc1cc(ccc1F)SC2CC2 62a_100011934186_100000211595 [0,0,0,1,0,0|3,0,0]=4 1028 B14R2.3168 COc1cc(ccc1I)NC2CC2 34a_100000746945_100000211595 [0,0,0,1,0,0|3,0,0]=4 1029 B14R2.3168 COc1cc(ccc1N)OC2CC2 34a_100015326901_100000211595 [0,0,0,1,0,0|3,0,0]=4 1030 B14R2.3168 COc1cc(ccc1N)SC2CC2 62a_100011279103_100000211595 [0,0,0,1,0,0|3,0,0]=4 1031 B14R2.3168 COc1cc(ccc1O)NC2CC2 34a_100000726020_100000211595 [0,0,0,1,0,0|2,0,0]=3 1032 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,0,0,0,1,0|2,0,1]=4 1033 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [0,0,0,0,1,0|2,0,1]=4 1034 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [0,0,0,0,1,0|2,0,1]=4 1035 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [0,0,0,0,1,0|2,0,1]=4 1036 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [0,0,0,0,1,0|2,0,1]=4 1037 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [0,0,0,0,1,0|2,0,1]=4 1038 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,0,0,0,1,0|1,0,1]=3 1039 B12R1.56 C=C(C)c1ccc(c(n1)OC)O 271570a_100000694244_100010893133 [0,0,0,0,1,0|2,0,1]=4 1040 B12R1.56 C=Cc1cc(ccc1F)[C@H](C)N 271570a_100011290941_100000753309 [0,0,0,0,1,0|2,0,1]=4 1041 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [0,0,0,0,1,0|2,0,1]=4 1042 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [0,0,0,0,1,0|2,0,1]=4 1043 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [0,0,0,0,1,0|2,0,1]=4 1044 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [0,0,0,0,1,0|2,0,1]=4 1045 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,0,0,0,1,0|1,1,1]=4 1046 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 34a_200000187366_200025704644 [0,0,0,0,1,0|2,0,0]=3 1047 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 7a_200000187366_200025704644 [0,0,0,0,1,0|2,0,0]=3 1048 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_100011218581_200025704644 [0,0,0,0,1,0|2,1,0]=4 1049 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100011218581 [0,0,0,0,1,0|2,1,0]=4 1050 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_100011191524_200025704644 [0,0,0,0,1,0|2,1,0]=4 1051 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011191524 [0,0,0,0,1,0|2,1,0]=4 1052 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [0,0,0,0,1,0|3,0,0]=4 1053 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [0,0,0,0,1,0|3,0,0]=4 1054 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [0,0,0,0,1,0|3,0,0]=4 1055 B12R1.56 CNc1cc(ccc1O)C(C)C 34a_200000187366_200000210301 [0,0,0,0,1,0|2,0,0]=3 1056 B12R1.56 CNc1cc(ccc1O)C(C)C 7a_200000187366_200000210301 [0,0,0,0,1,0|2,0,0]=3 1057 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [0,0,0,0,1,0|2,0,1]=4 1058 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,0,0,0,1,0|2,0,1]=4 1059 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,0,0,0,1,0|2,0,1]=4 1060 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [0,0,0,0,1,0|2,0,1]=4 1061 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [0,0,0,0,1,0|2,0,1]=4 1062 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [0,0,0,0,1,0|2,0,1]=4 1063 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [0,0,0,0,1,0|2,0,1]=4 1064 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [0,0,0,0,1,0|2,0,1]=4 1065 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [0,0,0,0,1,0|2,0,0]=3 1066 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [0,0,0,0,1,0|2,0,0]=3 1067 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [0,0,0,0,1,0|2,0,1]=4 1068 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [0,0,0,0,1,0|2,0,1]=4 1069 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [0,0,0,0,1,0|2,0,1]=4 1070 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [0,0,0,0,1,0|2,0,1]=4 1071 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [0,0,0,0,1,0|2,0,1]=4 1072 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [0,0,0,0,1,0|2,0,1]=4 1073 B12R1.56 COc1cc(ccc1F)N(C)C 2230a_200012002703_200000210301 [0,0,0,0,1,0|3,0,0]=4 1074 B12R1.56 COc1cc(ccc1F)N(C)C 269982a_200012002703_200000210301 [0,0,0,0,1,0|3,0,0]=4 1075 B12R1.56 COc1cc(ccc1F)N(C)C 34a_200012002703_200000210301 [0,0,0,0,1,0|3,0,0]=4 1076 B12R1.56 COc1cc(ccc1F)N(C)C 38a_200012002703_200000210301 [0,0,0,0,1,0|3,0,0]=4 1077 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 2230a_200012002703_200025704644 [0,0,0,0,1,0|3,0,0]=4 1078 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 269982a_200012002703_200025704644 [0,0,0,0,1,0|3,0,0]=4 1079 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 34a_200012002703_200025704644 [0,0,0,0,1,0|3,0,0]=4 1080 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 38a_200012002703_200025704644 [0,0,0,0,1,0|3,0,0]=4 1081 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [0,0,0,0,1,0|2,0,1]=4 1082 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [0,0,0,0,1,0|2,0,1]=4 1083 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,0,0,0,1,0|2,0,1]=4 1084 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,0,0,0,1,0|2,0,1]=4 1085 B12R1.56 COc1cc(ccc1O)B(O)O 271570a_203496583355_100012355544 [0,0,0,0,1,0|3,0,0]=4 1086 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,0,0,0,1,0|1,0,1]=3 1087 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,0,0,0,1,0|1,0,1]=3 1088 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,0,0,0,1,0|1,0,1]=3 1089 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,0,0,0,1,0|1,0,1]=3 1090 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,0,0,0,1,0|1,0,0]=2 1091 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_100011191524_200000210301 [0,0,0,0,1,0|2,1,0]=4 1092 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_200000210301_100011191524 [0,0,0,0,1,0|2,1,0]=4 1093 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_100000753309_200000210301 [0,0,0,0,1,0|1,1,0]=3 1094 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_200000210301_100000753309 [0,0,0,0,1,0|1,1,0]=3 1095 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_100011218581_200000210301 [0,0,0,0,1,0|2,1,0]=4 1096 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_200000210301_100011218581 [0,0,0,0,1,0|2,1,0]=4 1097 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,0,0,0,1,0|1,1,1]=4 1098 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_100000753309_200025704644 [0,0,0,0,1,0|1,1,0]=3 1099 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000753309 [0,0,0,0,1,0|1,1,0]=3 1100 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [0,0,0,0,1,0|3,0,0]=4 1101 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [0,0,0,0,1,0|3,0,0]=4 1102 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [0,0,0,0,1,0|3,0,0]=4 1103 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [0,0,0,0,1,0|2,0,0]=3 1104 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [0,0,0,0,1,0|2,0,0]=3 1105 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,0,0,0,1,0|2,0,1]=4 1106 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,0,0,0,1,0|2,0,1]=4 1107 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,0,0,0,1,0|2,0,1]=4 1108 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,0,0,0,1,0|2,0,1]=4 1109 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748629 [0,0,0,0,0,1|2,0,1]=4 1110 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000748629 [0,0,0,0,0,1|2,0,1]=4 1111 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000748629 [0,0,0,0,0,1|2,0,1]=4 1112 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 34a_100011279678_100000748629 [0,0,0,0,0,1|2,0,1]=4 1113 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748629 [0,0,0,0,0,1|2,0,1]=4 1114 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748629 [0,0,0,0,0,1|2,0,1]=4 1115 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000748629 [0,0,0,0,0,1|2,0,1]=4 1116 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 34a_100000701188_100000748629 [0,0,0,0,0,1|2,0,1]=4 1117 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)I 34a_100000746945_100000748629 [0,0,0,0,0,1|2,0,1]=4 1118 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,0,0,0,0,1|1,0,1]=3 1119 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 34a_100011827694_100000748629 [0,0,0,0,0,1|2,0,1]=4 1120 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 7a_100011827694_100000748629 [0,0,0,0,0,1|2,0,1]=4 1121 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 34a_100009865632_100000748629 [0,0,0,0,0,1|2,0,1]=4 1122 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 7a_100009865632_100000748629 [0,0,0,0,0,1|2,0,1]=4 1123 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000748629 [0,0,0,0,0,1|2,0,1]=4 1124 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000748629 [0,0,0,0,0,1|2,0,1]=4 1125 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 34a_100012001760_100000748629 [0,0,0,0,0,1|2,0,1]=4 1126 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 7a_100012001760_100000748629 [0,0,0,0,0,1|2,0,1]=4 1127 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 34a_100015326901_100000748629 [0,0,0,0,0,1|2,0,1]=4 1128 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 7a_100015326901_100000748629 [0,0,0,0,0,1|2,0,1]=4 1129 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)O 62a_100000748629_100012338938 [0,0,0,0,0,1|2,0,1]=4 1130 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100000748629_100012353699 [0,0,0,0,0,1|2,0,1]=4 1131 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000211660 [0,0,0,0,0,1|2,0,1]=4 1132 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100000748629_100011830276 [0,0,0,0,0,1|2,0,1]=4 1133 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100011830276_100000211660 [0,0,0,0,0,1|2,0,1]=4 1134 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100000748629_100011356853 [0,0,0,0,0,1|2,0,1]=4 1135 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000211660 [0,0,0,0,0,1|2,0,1]=4 1136 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100000748629_100011934186 [0,0,0,0,0,1|2,0,1]=4 1137 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100011934186_100000211660 [0,0,0,0,0,1|2,0,1]=4 1138 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100000748629_100015196925 [0,0,0,0,0,1|2,0,1]=4 1139 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100011279103_100000211660 [0,0,0,0,0,1|2,0,1]=4 1140 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,0,0,0,0,1|1,0,1]=3 1141 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)O 62a_100000748629_100010893133 [0,0,0,0,0,1|2,0,1]=4 1142 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)O 34a_100000726020_100009893438 [0,0,0,0,0,1|1,0,2]=4 1143 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)O 62a_100000042424_100000694246 [0,0,0,0,0,1|1,0,2]=4 1144 B14R1.42 CC(C)CNc1ccc(c(c1)C#N)O 34a_100011249283_100000210624 [0,0,0,0,0,1|3,0,0]=4 1145 B14R1.42 CC(C)CSc1ccc(c(c1)C#N)O 62a_100000210624_100000687585 [0,0,0,0,0,1|3,0,0]=4 1146 B14R1.42 CC(C)CSc1ccc(c(c1)C=O)O 62a_100000210624_100000186750 [0,0,0,0,0,1|3,0,0]=4 1147 B14R1.42 CC(C)CSc1ccc(c(c1)CN)O 62a_100000210624_100000730032 [0,0,0,0,0,1|3,0,0]=4 1148 B14R1.42 CC(C)CSc1ccc(c(c1)CN)O 62a_100000730032_100000210760 [0,0,0,0,0,1|3,0,0]=4 1149 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000184703_100000210760 [0,0,0,0,0,1|3,0,0]=4 1150 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000210624_100000184703 [0,0,0,0,0,1|3,0,0]=4 1151 B14R1.42 CC(C)SCc1ccc(c(c1)C=O)O 62a_100000210206_100000008128 [0,0,0,0,0,1|3,0,0]=4 1152 B14R1.42 CC(O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100011218427 [0,0,0,0,0,1|3,0,0]=4 1153 B14R1.42 CC(O)CSc1ccc(c(c1)C#N)O 62a_100011218427_100000687585 [0,0,0,0,0,1|3,0,0]=4 1154 B14R1.42 CC(O)CSc1ccc(c(c1)C=O)O 62a_100011218427_100000186750 [0,0,0,0,0,1|3,0,0]=4 1155 B14R1.42 CC(O)CSc1ccc(c(c1)CN)O 62a_100000730032_100011218427 [0,0,0,0,0,1|3,0,0]=4 1156 B14R1.42 CC(O)CSc1ccc(c(c1)CN)O 62a_100011218427_100000730032 [0,0,0,0,0,1|3,0,0]=4 1157 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100000184703_100011218427 [0,0,0,0,0,1|3,0,0]=4 1158 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100011218427_100000184703 [0,0,0,0,0,1|3,0,0]=4 1159 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 2230a_100010109747_100000210760 [0,0,0,0,0,1|3,0,0]=4 1160 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 34a_100010109747_100000210624 [0,0,0,0,0,1|3,0,0]=4 1161 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 7a_100010109747_100000210760 [0,0,0,0,0,1|3,0,0]=4 1162 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 2230a_100010109747_100011218427 [0,0,0,0,0,1|3,0,0]=4 1163 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 34a_100010109747_100011218427 [0,0,0,0,0,1|3,0,0]=4 1164 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 7a_100010109747_100011218427 [0,0,0,0,0,1|3,0,0]=4 1165 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 2230a_100010109747_100009817552 [0,0,0,0,0,1|3,0,0]=4 1166 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 34a_100010109747_100009817552 [0,0,0,0,0,1|3,0,0]=4 1167 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 7a_100010109747_100009817552 [0,0,0,0,0,1|3,0,0]=4 1168 B14R1.42 CCc1cc(ccc1Br)SCC(C)C 62a_100000210624_100010244631 [0,0,0,0,0,1|3,0,0]=4 1169 B14R1.42 CCc1cc(ccc1Br)SCC(C)C 62a_100010244631_100000210760 [0,0,0,0,0,1|3,0,0]=4 1170 B14R1.42 CCc1cc(ccc1Br)SCC(C)O 62a_100010244631_100011218427 [0,0,0,0,0,1|3,0,0]=4 1171 B14R1.42 CCc1cc(ccc1Br)SCC(C)O 62a_100011218427_100010244631 [0,0,0,0,0,1|3,0,0]=4 1172 B14R1.42 CCc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100010244631 [0,0,0,0,0,1|3,0,0]=4 1173 B14R1.42 CCc1cc(ccc1Br)SC[C@@H](C)O 62a_100010244631_100009817552 [0,0,0,0,0,1|3,0,0]=4 1174 B14R1.42 CCc1cc(ccc1Cl)OCC(C)C 34a_100000212063_100000210624 [0,0,0,0,0,1|3,0,0]=4 1175 B14R1.42 CCc1cc(ccc1Cl)OCC(C)C 7a_100000212063_100000210760 [0,0,0,0,0,1|3,0,0]=4 1176 B14R1.42 CCc1cc(ccc1Cl)OCC(C)O 34a_100000212063_100011218427 [0,0,0,0,0,1|3,0,0]=4 1177 B14R1.42 CCc1cc(ccc1Cl)OCC(C)O 7a_100000212063_100011218427 [0,0,0,0,0,1|3,0,0]=4 1178 B14R1.42 CCc1cc(ccc1Cl)OC[C@@H](C)O 34a_100000212063_100009817552 [0,0,0,0,0,1|3,0,0]=4 1179 B14R1.42 CCc1cc(ccc1Cl)OC[C@@H](C)O 7a_100000212063_100009817552 [0,0,0,0,0,1|3,0,0]=4 1180 B14R1.42 CCc1cc(ccc1F)CNC(C)C 207a_100138425928_100009840867 [0,0,0,0,0,1|3,0,0]=4 1181 B14R1.42 CCc1cc(ccc1F)CNC(C)C 2230a_114873767189_100000210206 [0,0,0,0,0,1|3,0,0]=4 1182 B14R1.42 CCc1cc(ccc1F)CNC(C)C 34a_114873767189_100000210206 [0,0,0,0,0,1|3,0,0]=4 1183 B14R1.42 CCc1cc(ccc1F)SCC(C)C 62a_100000210624_100010244625 [0,0,0,0,0,1|3,0,0]=4 1184 B14R1.42 CCc1cc(ccc1F)SCC(C)C 62a_100010244625_100000210760 [0,0,0,0,0,1|3,0,0]=4 1185 B14R1.42 CCc1cc(ccc1F)SCC(C)O 62a_100010244625_100011218427 [0,0,0,0,0,1|3,0,0]=4 1186 B14R1.42 CCc1cc(ccc1F)SCC(C)O 62a_100011218427_100010244625 [0,0,0,0,0,1|3,0,0]=4 1187 B14R1.42 CCc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100010244625 [0,0,0,0,0,1|3,0,0]=4 1188 B14R1.42 CCc1cc(ccc1F)SC[C@@H](C)O 62a_100010244625_100009817552 [0,0,0,0,0,1|3,0,0]=4 1189 B14R1.42 CCc1cc(ccc1N)SCC(C)C 62a_100000210624_100000686106 [0,0,0,0,0,1|3,0,0]=4 1190 B14R1.42 CCc1cc(ccc1N)SCC(C)C 62a_100000686106_100000210760 [0,0,0,0,0,1|3,0,0]=4 1191 B14R1.42 CCc1cc(ccc1N)SCC(C)O 62a_100000686106_100011218427 [0,0,0,0,0,1|3,0,0]=4 1192 B14R1.42 CCc1cc(ccc1N)SCC(C)O 62a_100011218427_100000686106 [0,0,0,0,0,1|3,0,0]=4 1193 B14R1.42 CCc1cc(ccc1N)SC[C@@H](C)O 62a_100000686106_100009817552 [0,0,0,0,0,1|3,0,0]=4 1194 B14R1.42 CCc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100000686106 [0,0,0,0,0,1|3,0,0]=4 1195 B14R1.42 CCc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100012338938 [0,0,0,0,0,1|2,0,1]=4 1196 B14R1.42 CCc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100012338938 [0,0,0,0,0,1|2,0,1]=4 1197 B14R1.42 CCc1cc(ccc1O)SCC(=O)N 62a_100000747473_100012338938 [0,0,0,0,0,1|2,0,1]=4 1198 B14R1.42 CCc1cc(ccc1O)SCC(C)C 62a_100000210624_100012338938 [0,0,0,0,0,1|2,0,0]=3 1199 B14R1.42 CCc1cc(ccc1O)SCC(C)O 62a_100011218427_100012338938 [0,0,0,0,0,1|2,0,0]=3 1200 B14R1.42 CCc1cc(ccc1O)SCC(F)F 62a_100011934356_100012338938 [0,0,0,0,0,1|3,0,0]=4 1201 B14R1.42 CCc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100012338938 [0,0,0,0,0,1|2,0,0]=3 1202 B14R1.42 CNc1cc(ccc1C)SCC(C)C 62a_100000210624_100020629602 [0,0,0,0,0,1|3,0,0]=4 1203 B14R1.42 CNc1cc(ccc1C)SCC(C)C 62a_100020629602_100000210760 [0,0,0,0,0,1|3,0,0]=4 1204 B14R1.42 CNc1cc(ccc1C)SCC(C)O 62a_100011218427_100020629602 [0,0,0,0,0,1|3,0,0]=4 1205 B14R1.42 CNc1cc(ccc1C)SCC(C)O 62a_100020629602_100011218427 [0,0,0,0,0,1|3,0,0]=4 1206 B14R1.42 CNc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100020629602 [0,0,0,0,0,1|3,0,0]=4 1207 B14R1.42 CNc1cc(ccc1C)SC[C@@H](C)O 62a_100020629602_100009817552 [0,0,0,0,0,1|3,0,0]=4 1208 B14R1.42 CNc1cc(ccc1F)SCC(C)C 62a_100000210624_100011314990 [0,0,0,0,0,1|3,0,0]=4 1209 B14R1.42 CNc1cc(ccc1F)SCC(C)C 62a_100011314990_100000210760 [0,0,0,0,0,1|3,0,0]=4 1210 B14R1.42 CNc1cc(ccc1F)SCC(C)O 62a_100011218427_100011314990 [0,0,0,0,0,1|3,0,0]=4 1211 B14R1.42 CNc1cc(ccc1F)SCC(C)O 62a_100011314990_100011218427 [0,0,0,0,0,1|3,0,0]=4 1212 B14R1.42 CNc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011314990 [0,0,0,0,0,1|3,0,0]=4 1213 B14R1.42 CNc1cc(ccc1F)SC[C@@H](C)O 62a_100011314990_100009817552 [0,0,0,0,0,1|3,0,0]=4 1214 B14R1.42 CNc1cc(ccc1N)SCC(C)C 62a_100000694363_100000210760 [0,0,0,0,0,1|3,0,0]=4 1215 B14R1.42 CNc1cc(ccc1N)SCC(C)O 62a_100000694363_100011218427 [0,0,0,0,0,1|3,0,0]=4 1216 B14R1.42 CNc1cc(ccc1N)SC[C@@H](C)O 62a_100000694363_100009817552 [0,0,0,0,0,1|3,0,0]=4 1217 B14R1.42 COc1cc(c[nH]c1=O)SCC(C)C 62a_100000210624_100010125397 [0,0,0,0,0,1|2,0,1]=4 1218 B14R1.42 COc1cc(c[nH]c1=O)SCC(C)O 62a_100011218427_100010125397 [0,0,0,0,0,1|2,0,1]=4 1219 B14R1.42 COc1cc(c[nH]c1=O)SC[C@@H](C)O 62a_100009817552_100010125397 [0,0,0,0,0,1|2,0,1]=4 1220 B14R1.42 COc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_100012353699 [0,0,0,0,0,1|2,0,1]=4 1221 B14R1.42 COc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_100012353699 [0,0,0,0,0,1|2,0,1]=4 1222 B14R1.42 COc1cc(ccc1Br)CNC(C)C 207a_100138425928_100010244714 [0,0,0,0,0,1|2,0,0]=3 1223 B14R1.42 COc1cc(ccc1Br)CNC(C)C 2230a_100138425928_100010110085 [0,0,0,0,0,1|2,0,0]=3 1224 B14R1.42 COc1cc(ccc1Br)CNC(C)C 34a_100138425928_100010110085 [0,0,0,0,0,1|2,0,0]=3 1225 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100000212225_100010110085 [0,0,0,0,0,1|2,0,0]=3 1226 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100010234685_100000210206 [0,0,0,0,0,1|2,0,0]=3 1227 B14R1.42 COc1cc(ccc1Br)COC(C)C 7a_100010234685_100000210206 [0,0,0,0,0,1|2,0,0]=3 1228 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100000210206_100010110085 [0,0,0,0,0,1|2,0,0]=3 1229 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100010110085_100000210206 [0,0,0,0,0,1|2,0,0]=3 1230 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 2230a_100000765947_100000747473 [0,0,0,0,0,1|2,0,1]=4 1231 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 34a_100000765947_100000187820 [0,0,0,0,0,1|2,0,1]=4 1232 B14R1.42 COc1cc(ccc1Br)NCC(C)C 2230a_100000765947_100000210760 [0,0,0,0,0,1|2,0,0]=3 1233 B14R1.42 COc1cc(ccc1Br)NCC(C)C 34a_100000765947_100000210624 [0,0,0,0,0,1|2,0,0]=3 1234 B14R1.42 COc1cc(ccc1Br)NCC(C)O 2230a_100000765947_100011218427 [0,0,0,0,0,1|2,0,0]=3 1235 B14R1.42 COc1cc(ccc1Br)NCC(C)O 34a_100000765947_100011218427 [0,0,0,0,0,1|2,0,0]=3 1236 B14R1.42 COc1cc(ccc1Br)NCC(F)F 2230a_100000765947_100011934356 [0,0,0,0,0,1|3,0,0]=4 1237 B14R1.42 COc1cc(ccc1Br)NCC(F)F 34a_100000765947_100011934356 [0,0,0,0,0,1|3,0,0]=4 1238 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 2230a_100000765947_100009817552 [0,0,0,0,0,1|2,0,0]=3 1239 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 34a_100000765947_100009817552 [0,0,0,0,0,1|2,0,0]=3 1240 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 34a_100011827694_100000187820 [0,0,0,0,0,1|2,0,1]=4 1241 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 7a_100011827694_100000187820 [0,0,0,0,0,1|2,0,1]=4 1242 B14R1.42 COc1cc(ccc1Br)OCC(C)C 34a_100011827694_100000210624 [0,0,0,0,0,1|2,0,0]=3 1243 B14R1.42 COc1cc(ccc1Br)OCC(C)C 7a_100011827694_100000210760 [0,0,0,0,0,1|2,0,0]=3 1244 B14R1.42 COc1cc(ccc1Br)OCC(C)O 34a_100011827694_100011218427 [0,0,0,0,0,1|2,0,0]=3 1245 B14R1.42 COc1cc(ccc1Br)OCC(C)O 7a_100011827694_100011218427 [0,0,0,0,0,1|2,0,0]=3 1246 B14R1.42 COc1cc(ccc1Br)OCC(F)F 34a_100011827694_100011934356 [0,0,0,0,0,1|3,0,0]=4 1247 B14R1.42 COc1cc(ccc1Br)OCC(F)F 7a_100011827694_100011934356 [0,0,0,0,0,1|3,0,0]=4 1248 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 34a_100011827694_100009817552 [0,0,0,0,0,1|2,0,0]=3 1249 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 7a_100011827694_100009817552 [0,0,0,0,0,1|2,0,0]=3 1250 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100000747473_100012353699 [0,0,0,0,0,1|2,0,1]=4 1251 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100012353699_100000747473 [0,0,0,0,0,1|2,0,1]=4 1252 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100000210624_100012353699 [0,0,0,0,0,1|2,0,0]=3 1253 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100012353699_100000210760 [0,0,0,0,0,1|2,0,0]=3 1254 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100011218427_100012353699 [0,0,0,0,0,1|2,0,0]=3 1255 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100012353699_100011218427 [0,0,0,0,0,1|2,0,0]=3 1256 B14R1.42 COc1cc(ccc1Br)SCC(F)F 62a_100011934356_100012353699 [0,0,0,0,0,1|3,0,0]=4 1257 B14R1.42 COc1cc(ccc1Br)SCC(F)F 62a_100012353699_100011934356 [0,0,0,0,0,1|3,0,0]=4 1258 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100012353699 [0,0,0,0,0,1|2,0,0]=3 1259 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100012353699_100009817552 [0,0,0,0,0,1|2,0,0]=3 1260 B14R1.42 COc1cc(ccc1C)C=CC(C)C 271570a_100016257149_100011830276 [0,0,0,0,0,1|2,0,1]=4 1261 B14R1.42 COc1cc(ccc1C)C=CC(C)O 271570a_200011019289_100011830276 [0,0,0,0,0,1|2,0,1]=4 1262 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [0,0,0,0,0,1|2,0,1]=4 1263 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [0,0,0,0,0,1|2,0,1]=4 1264 B14R1.42 COc1cc(ccc1C)CNC(C)C 207a_100138425928_100000719150 [0,0,0,0,0,1|2,0,0]=3 1265 B14R1.42 COc1cc(ccc1C)COC(C)C 34a_100000752651_100000210206 [0,0,0,0,0,1|2,0,0]=3 1266 B14R1.42 COc1cc(ccc1C)COC(C)C 7a_100000752651_100000210206 [0,0,0,0,0,1|2,0,0]=3 1267 B14R1.42 COc1cc(ccc1C)NCC(=O)N 2230a_100011279678_100000747473 [0,0,0,0,0,1|2,0,1]=4 1268 B14R1.42 COc1cc(ccc1C)NCC(=O)N 34a_100011279678_100000187820 [0,0,0,0,0,1|2,0,1]=4 1269 B14R1.42 COc1cc(ccc1C)NCC(C)C 2230a_100011279678_100000210760 [0,0,0,0,0,1|2,0,0]=3 1270 B14R1.42 COc1cc(ccc1C)NCC(C)C 34a_100011279678_100000210624 [0,0,0,0,0,1|2,0,0]=3 1271 B14R1.42 COc1cc(ccc1C)NCC(C)O 2230a_100011279678_100011218427 [0,0,0,0,0,1|2,0,0]=3 1272 B14R1.42 COc1cc(ccc1C)NCC(C)O 34a_100011279678_100011218427 [0,0,0,0,0,1|2,0,0]=3 1273 B14R1.42 COc1cc(ccc1C)NCC(F)F 2230a_100011279678_100011934356 [0,0,0,0,0,1|3,0,0]=4 1274 B14R1.42 COc1cc(ccc1C)NCC(F)F 34a_100011279678_100011934356 [0,0,0,0,0,1|3,0,0]=4 1275 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 2230a_100011279678_100009817552 [0,0,0,0,0,1|2,0,0]=3 1276 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 34a_100011279678_100009817552 [0,0,0,0,0,1|2,0,0]=3 1277 B14R1.42 COc1cc(ccc1C)OCC(=O)N 34a_100009865632_100000187820 [0,0,0,0,0,1|2,0,1]=4 1278 B14R1.42 COc1cc(ccc1C)OCC(=O)N 7a_100009865632_100000187820 [0,0,0,0,0,1|2,0,1]=4 1279 B14R1.42 COc1cc(ccc1C)OCC(C)C 34a_100009865632_100000210624 [0,0,0,0,0,1|2,0,0]=3 1280 B14R1.42 COc1cc(ccc1C)OCC(C)C 7a_100009865632_100000210760 [0,0,0,0,0,1|2,0,0]=3 1281 B14R1.42 COc1cc(ccc1C)OCC(C)O 34a_100009865632_100011218427 [0,0,0,0,0,1|2,0,0]=3 1282 B14R1.42 COc1cc(ccc1C)OCC(C)O 7a_100009865632_100011218427 [0,0,0,0,0,1|2,0,0]=3 1283 B14R1.42 COc1cc(ccc1C)OCC(F)F 34a_100009865632_100011934356 [0,0,0,0,0,1|3,0,0]=4 1284 B14R1.42 COc1cc(ccc1C)OCC(F)F 7a_100009865632_100011934356 [0,0,0,0,0,1|3,0,0]=4 1285 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 34a_100009865632_100009817552 [0,0,0,0,0,1|2,0,0]=3 1286 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 7a_100009865632_100009817552 [0,0,0,0,0,1|2,0,0]=3 1287 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100000747473_100011830276 [0,0,0,0,0,1|2,0,1]=4 1288 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100011830276_100000747473 [0,0,0,0,0,1|2,0,1]=4 1289 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100000210624_100011830276 [0,0,0,0,0,1|2,0,0]=3 1290 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100011830276_100000210760 [0,0,0,0,0,1|2,0,0]=3 1291 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011218427_100011830276 [0,0,0,0,0,1|2,0,0]=3 1292 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011830276_100011218427 [0,0,0,0,0,1|2,0,0]=3 1293 B14R1.42 COc1cc(ccc1C)SCC(F)F 62a_100011830276_100011934356 [0,0,0,0,0,1|3,0,0]=4 1294 B14R1.42 COc1cc(ccc1C)SCC(F)F 62a_100011934356_100011830276 [0,0,0,0,0,1|3,0,0]=4 1295 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100011830276 [0,0,0,0,0,1|2,0,0]=3 1296 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100011830276_100009817552 [0,0,0,0,0,1|2,0,0]=3 1297 B14R1.42 COc1cc(ccc1Cl)C=CC(C)C 271570a_100016257149_100011356853 [0,0,0,0,0,1|2,0,1]=4 1298 B14R1.42 COc1cc(ccc1Cl)C=CC(C)O 271570a_200011019289_100011356853 [0,0,0,0,0,1|2,0,1]=4 1299 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 11a_100015204853_100015343762 [0,0,0,0,0,1|2,0,1]=4 1300 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 1626a_100015204853_100015343762 [0,0,0,0,0,1|2,0,1]=4 1301 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 240690a_100015204853_100015343762 [0,0,0,0,0,1|2,0,1]=4 1302 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 527a_100015204853_100103153847 [0,0,0,0,0,1|2,0,1]=4 1303 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 207a_100138425928_100011998524 [0,0,0,0,0,1|2,0,0]=3 1304 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100015204853_100000210206 [0,0,0,0,0,1|2,0,0]=3 1305 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100138425928_200010214485 [0,0,0,0,0,1|2,0,0]=3 1306 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100015204853_100000210206 [0,0,0,0,0,1|2,0,0]=3 1307 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100138425928_200010214485 [0,0,0,0,0,1|2,0,0]=3 1308 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100000212225_200010214485 [0,0,0,0,0,1|2,0,0]=3 1309 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100012179228_100000210206 [0,0,0,0,0,1|2,0,0]=3 1310 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_100000210206_200010214485 [0,0,0,0,0,1|2,0,0]=3 1311 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_200010214485_100000210206 [0,0,0,0,0,1|2,0,0]=3 1312 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 2230a_100000742311_100000747473 [0,0,0,0,0,1|2,0,1]=4 1313 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 34a_100000742311_100000187820 [0,0,0,0,0,1|2,0,1]=4 1314 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 2230a_100000742311_100000210760 [0,0,0,0,0,1|2,0,0]=3 1315 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 34a_100000742311_100000210624 [0,0,0,0,0,1|2,0,0]=3 1316 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 2230a_100000742311_100011218427 [0,0,0,0,0,1|2,0,0]=3 1317 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 34a_100000742311_100011218427 [0,0,0,0,0,1|2,0,0]=3 1318 B14R1.42 COc1cc(ccc1Cl)NCC(F)F 2230a_100000742311_100011934356 [0,0,0,0,0,1|3,0,0]=4 1319 B14R1.42 COc1cc(ccc1Cl)NCC(F)F 34a_100000742311_100011934356 [0,0,0,0,0,1|3,0,0]=4 1320 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 2230a_100000742311_100009817552 [0,0,0,0,0,1|2,0,0]=3 1321 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 34a_100000742311_100009817552 [0,0,0,0,0,1|2,0,0]=3 1322 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 34a_100012186310_100000187820 [0,0,0,0,0,1|2,0,1]=4 1323 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 7a_100012186310_100000187820 [0,0,0,0,0,1|2,0,1]=4 1324 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 34a_100012186310_100000210624 [0,0,0,0,0,1|2,0,0]=3 1325 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 7a_100012186310_100000210760 [0,0,0,0,0,1|2,0,0]=3 1326 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 34a_100012186310_100011218427 [0,0,0,0,0,1|2,0,0]=3 1327 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 7a_100012186310_100011218427 [0,0,0,0,0,1|2,0,0]=3 1328 B14R1.42 COc1cc(ccc1Cl)OCC(F)F 34a_100012186310_100011934356 [0,0,0,0,0,1|3,0,0]=4 1329 B14R1.42 COc1cc(ccc1Cl)OCC(F)F 7a_100012186310_100011934356 [0,0,0,0,0,1|3,0,0]=4 1330 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 34a_100012186310_100009817552 [0,0,0,0,0,1|2,0,0]=3 1331 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 7a_100012186310_100009817552 [0,0,0,0,0,1|2,0,0]=3 1332 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100000747473_100011356853 [0,0,0,0,0,1|2,0,1]=4 1333 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100011356853_100000747473 [0,0,0,0,0,1|2,0,1]=4 1334 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100000210624_100011356853 [0,0,0,0,0,1|2,0,0]=3 1335 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100011356853_100000210760 [0,0,0,0,0,1|2,0,0]=3 1336 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011218427_100011356853 [0,0,0,0,0,1|2,0,0]=3 1337 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011356853_100011218427 [0,0,0,0,0,1|2,0,0]=3 1338 B14R1.42 COc1cc(ccc1Cl)SCC(F)F 62a_100011356853_100011934356 [0,0,0,0,0,1|3,0,0]=4 1339 B14R1.42 COc1cc(ccc1Cl)SCC(F)F 62a_100011934356_100011356853 [0,0,0,0,0,1|3,0,0]=4 1340 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100009817552_100011356853 [0,0,0,0,0,1|2,0,0]=3 1341 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100011356853_100009817552 [0,0,0,0,0,1|2,0,0]=3 1342 B14R1.42 COc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100011934186 [0,0,0,0,0,1|2,0,1]=4 1343 B14R1.42 COc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100011934186 [0,0,0,0,0,1|2,0,1]=4 1344 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [0,0,0,0,0,1|2,0,1]=4 1345 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [0,0,0,0,0,1|2,0,1]=4 1346 B14R1.42 COc1cc(ccc1F)CNC(=O)C 11a_100020626639_100015343762 [0,0,0,0,0,1|2,0,1]=4 1347 B14R1.42 COc1cc(ccc1F)CNC(=O)C 1626a_100020626639_100015343762 [0,0,0,0,0,1|2,0,1]=4 1348 B14R1.42 COc1cc(ccc1F)CNC(=O)C 240690a_100020626639_100015343762 [0,0,0,0,0,1|2,0,1]=4 1349 B14R1.42 COc1cc(ccc1F)CNC(=O)C 527a_100020626639_100103153847 [0,0,0,0,0,1|2,0,1]=4 1350 B14R1.42 COc1cc(ccc1F)CNC(C)C 207a_100138425928_100000692873 [0,0,0,0,0,1|2,0,0]=3 1351 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100020626639_100000210206 [0,0,0,0,0,1|2,0,0]=3 1352 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100138425928_100012349856 [0,0,0,0,0,1|2,0,0]=3 1353 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100020626639_100000210206 [0,0,0,0,0,1|2,0,0]=3 1354 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100138425928_100012349856 [0,0,0,0,0,1|2,0,0]=3 1355 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000212225_100012349856 [0,0,0,0,0,1|2,0,0]=3 1356 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000692429_100000210206 [0,0,0,0,0,1|2,0,0]=3 1357 B14R1.42 COc1cc(ccc1F)COC(C)C 7a_100000692429_100000210206 [0,0,0,0,0,1|2,0,0]=3 1358 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100000210206_100012349856 [0,0,0,0,0,1|2,0,0]=3 1359 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100012349856_100000210206 [0,0,0,0,0,1|2,0,0]=3 1360 B14R1.42 COc1cc(ccc1F)NCC(=O)N 2230a_100000701188_100000747473 [0,0,0,0,0,1|2,0,1]=4 1361 B14R1.42 COc1cc(ccc1F)NCC(=O)N 34a_100000701188_100000187820 [0,0,0,0,0,1|2,0,1]=4 1362 B14R1.42 COc1cc(ccc1F)NCC(C)C 2230a_100000701188_100000210760 [0,0,0,0,0,1|2,0,0]=3 1363 B14R1.42 COc1cc(ccc1F)NCC(C)C 34a_100000701188_100000210624 [0,0,0,0,0,1|2,0,0]=3 1364 B14R1.42 COc1cc(ccc1F)NCC(C)O 2230a_100000701188_100011218427 [0,0,0,0,0,1|2,0,0]=3 1365 B14R1.42 COc1cc(ccc1F)NCC(C)O 34a_100000701188_100011218427 [0,0,0,0,0,1|2,0,0]=3 1366 B14R1.42 COc1cc(ccc1F)NCC(F)F 2230a_100000701188_100011934356 [0,0,0,0,0,1|3,0,0]=4 1367 B14R1.42 COc1cc(ccc1F)NCC(F)F 34a_100000701188_100011934356 [0,0,0,0,0,1|3,0,0]=4 1368 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 2230a_100000701188_100009817552 [0,0,0,0,0,1|2,0,0]=3 1369 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 34a_100000701188_100009817552 [0,0,0,0,0,1|2,0,0]=3 1370 B14R1.42 COc1cc(ccc1F)OCC(=O)N 34a_100012001760_100000187820 [0,0,0,0,0,1|2,0,1]=4 1371 B14R1.42 COc1cc(ccc1F)OCC(=O)N 7a_100012001760_100000187820 [0,0,0,0,0,1|2,0,1]=4 1372 B14R1.42 COc1cc(ccc1F)OCC(C)C 34a_100012001760_100000210624 [0,0,0,0,0,1|2,0,0]=3 1373 B14R1.42 COc1cc(ccc1F)OCC(C)C 7a_100012001760_100000210760 [0,0,0,0,0,1|2,0,0]=3 1374 B14R1.42 COc1cc(ccc1F)OCC(C)O 34a_100012001760_100011218427 [0,0,0,0,0,1|2,0,0]=3 1375 B14R1.42 COc1cc(ccc1F)OCC(C)O 7a_100012001760_100011218427 [0,0,0,0,0,1|2,0,0]=3 1376 B14R1.42 COc1cc(ccc1F)OCC(F)F 34a_100012001760_100011934356 [0,0,0,0,0,1|3,0,0]=4 1377 B14R1.42 COc1cc(ccc1F)OCC(F)F 7a_100012001760_100011934356 [0,0,0,0,0,1|3,0,0]=4 1378 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 34a_100012001760_100009817552 [0,0,0,0,0,1|2,0,0]=3 1379 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 7a_100012001760_100009817552 [0,0,0,0,0,1|2,0,0]=3 1380 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100000747473_100011934186 [0,0,0,0,0,1|2,0,1]=4 1381 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100011934186_100000747473 [0,0,0,0,0,1|2,0,1]=4 1382 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100000210624_100011934186 [0,0,0,0,0,1|2,0,0]=3 1383 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100011934186_100000210760 [0,0,0,0,0,1|2,0,0]=3 1384 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011218427_100011934186 [0,0,0,0,0,1|2,0,0]=3 1385 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011934186_100011218427 [0,0,0,0,0,1|2,0,0]=3 1386 B14R1.42 COc1cc(ccc1F)SCC(F)F 62a_100011934186_100011934356 [0,0,0,0,0,1|3,0,0]=4 1387 B14R1.42 COc1cc(ccc1F)SCC(F)F 62a_100011934356_100011934186 [0,0,0,0,0,1|3,0,0]=4 1388 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011934186 [0,0,0,0,0,1|2,0,0]=3 1389 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100011934186_100009817552 [0,0,0,0,0,1|2,0,0]=3 1390 B14R1.42 COc1cc(ccc1I)NCC(=O)N 34a_100000746945_100000187820 [0,0,0,0,0,1|2,0,1]=4 1391 B14R1.42 COc1cc(ccc1I)NCC(C)C 34a_100000746945_100000210624 [0,0,0,0,0,1|2,0,0]=3 1392 B14R1.42 COc1cc(ccc1I)NCC(C)O 34a_100000746945_100011218427 [0,0,0,0,0,1|2,0,0]=3 1393 B14R1.42 COc1cc(ccc1I)NCC(F)F 34a_100000746945_100011934356 [0,0,0,0,0,1|3,0,0]=4 1394 B14R1.42 COc1cc(ccc1I)NC[C@@H](C)O 34a_100000746945_100009817552 [0,0,0,0,0,1|2,0,0]=3 1395 B14R1.42 COc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100011279103 [0,0,0,0,0,1|2,0,1]=4 1396 B14R1.42 COc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100011279103 [0,0,0,0,0,1|2,0,1]=4 1397 B14R1.42 COc1cc(ccc1N)COC(C)C 34a_100000087641_100000210206 [0,0,0,0,0,1|2,0,0]=3 1398 B14R1.42 COc1cc(ccc1N)OCC(=O)N 34a_100015326901_100000187820 [0,0,0,0,0,1|2,0,1]=4 1399 B14R1.42 COc1cc(ccc1N)OCC(=O)N 7a_100015326901_100000187820 [0,0,0,0,0,1|2,0,1]=4 1400 B14R1.42 COc1cc(ccc1N)OCC(C)C 34a_100015326901_100000210624 [0,0,0,0,0,1|2,0,0]=3 1401 B14R1.42 COc1cc(ccc1N)OCC(C)C 7a_100015326901_100000210760 [0,0,0,0,0,1|2,0,0]=3 1402 B14R1.42 COc1cc(ccc1N)OCC(C)O 34a_100015326901_100011218427 [0,0,0,0,0,1|2,0,0]=3 1403 B14R1.42 COc1cc(ccc1N)OCC(C)O 7a_100015326901_100011218427 [0,0,0,0,0,1|2,0,0]=3 1404 B14R1.42 COc1cc(ccc1N)OCC(F)F 34a_100015326901_100011934356 [0,0,0,0,0,1|3,0,0]=4 1405 B14R1.42 COc1cc(ccc1N)OCC(F)F 7a_100015326901_100011934356 [0,0,0,0,0,1|3,0,0]=4 1406 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 34a_100015326901_100009817552 [0,0,0,0,0,1|2,0,0]=3 1407 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 7a_100015326901_100009817552 [0,0,0,0,0,1|2,0,0]=3 1408 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100000747473_100015196925 [0,0,0,0,0,1|2,0,1]=4 1409 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100011279103_100000747473 [0,0,0,0,0,1|2,0,1]=4 1410 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100000210624_100015196925 [0,0,0,0,0,1|2,0,0]=3 1411 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100011279103_100000210760 [0,0,0,0,0,1|2,0,0]=3 1412 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011218427_100015196925 [0,0,0,0,0,1|2,0,0]=3 1413 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011279103_100011218427 [0,0,0,0,0,1|2,0,0]=3 1414 B14R1.42 COc1cc(ccc1N)SCC(F)F 62a_100011279103_100011934356 [0,0,0,0,0,1|3,0,0]=4 1415 B14R1.42 COc1cc(ccc1N)SCC(F)F 62a_100011934356_100015196925 [0,0,0,0,0,1|3,0,0]=4 1416 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100015196925 [0,0,0,0,0,1|2,0,0]=3 1417 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100011279103_100009817552 [0,0,0,0,0,1|2,0,0]=3 1418 B14R1.42 COc1cc(ccc1O)C=CC(=O)C 1458a_100000182119_200000210301 [0,0,0,0,0,1|1,0,2]=4 1419 B14R1.42 COc1cc(ccc1O)C=CC(=O)[13CH3] 1458a_100000182119_200025704644 [0,0,0,0,0,1|1,0,2]=4 1420 B14R1.42 COc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000694246 [0,0,0,0,0,1|1,0,1]=3 1421 B14R1.42 COc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000694246 [0,0,0,0,0,1|1,0,1]=3 1422 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,0,0,0,0,1|1,0,1]=3 1423 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,0,0,0,0,1|1,0,1]=3 1424 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,0,0,0,0,1|1,0,1]=3 1425 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,0,0,0,0,1|2,0,0]=3 1426 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,0,0,0,0,1|2,0,0]=3 1427 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,0,0,0,0,1|1,0,1]=3 1428 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,0,0,0,0,1|1,0,1]=3 1429 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,0,0,0,0,1|1,0,1]=3 1430 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,0,0,0,0,1|1,0,0]=2 1431 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [0,0,0,0,0,1|1,0,1]=3 1432 B14R1.42 COc1cc(ccc1O)NCC(=O)[O-] 34a_100000726020_100020667443 [0,0,0,0,0,1|2,0,1]=4 1433 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,0,0,0,0,1|1,0,0]=2 1434 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,0,0,0,0,1|1,0,0]=2 1435 B14R1.42 COc1cc(ccc1O)NCC(F)F 34a_100000726020_100011934356 [0,0,0,0,0,1|2,0,0]=3 1436 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,0,0,0,0,1|1,0,0]=2 1437 B14R1.42 COc1cc(ccc1O)NC[N+](=O)[O-] 34a_100000726020_100000761209 [0,0,0,0,0,1|3,0,0]=4 1438 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [0,0,0,0,0,1|1,0,1]=3 1439 B14R1.42 COc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000694246 [0,0,0,0,0,1|2,0,1]=4 1440 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,0,0,0,0,1|1,0,0]=2 1441 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,0,0,0,0,1|1,0,0]=2 1442 B14R1.42 COc1cc(ccc1O)SCC(F)F 62a_100011934356_100000694246 [0,0,0,0,0,1|2,0,0]=3 1443 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,0,0,0,0,1|1,0,0]=2 1444 B14R1.42 COc1cc(cnc1C)SCC(C)C 62a_100000210624_100010254219 [0,0,0,0,0,1|3,0,0]=4 1445 B14R1.42 COc1cc(cnc1C)SCC(C)C 62a_100010254219_100000210760 [0,0,0,0,0,1|3,0,0]=4 1446 B14R1.42 COc1cc(cnc1C)SCC(C)O 62a_100010254219_100011218427 [0,0,0,0,0,1|3,0,0]=4 1447 B14R1.42 COc1cc(cnc1C)SCC(C)O 62a_100011218427_100010254219 [0,0,0,0,0,1|3,0,0]=4 1448 B14R1.42 COc1cc(cnc1C)SC[C@@H](C)O 62a_100009817552_100010254219 [0,0,0,0,0,1|3,0,0]=4 1449 B14R1.42 COc1cc(cnc1C)SC[C@@H](C)O 62a_100010254219_100009817552 [0,0,0,0,0,1|3,0,0]=4 1450 B14R1.42 COc1cc(cnc1F)SCC(C)C 62a_100000210624_100010214931 [0,0,0,0,0,1|3,0,0]=4 1451 B14R1.42 COc1cc(cnc1F)SCC(C)C 62a_100010214931_100000210760 [0,0,0,0,0,1|3,0,0]=4 1452 B14R1.42 COc1cc(cnc1F)SCC(C)O 62a_100010214931_100011218427 [0,0,0,0,0,1|3,0,0]=4 1453 B14R1.42 COc1cc(cnc1F)SCC(C)O 62a_100011218427_100010214931 [0,0,0,0,0,1|3,0,0]=4 1454 B14R1.42 COc1cc(cnc1F)SC[C@@H](C)O 62a_100009817552_100010214931 [0,0,0,0,0,1|3,0,0]=4 1455 B14R1.42 COc1cc(cnc1F)SC[C@@H](C)O 62a_100010214931_100009817552 [0,0,0,0,0,1|3,0,0]=4 1456 B14R1.42 COc1cc(cnc1N)SCC(C)C 62a_100000210624_106354213024 [0,0,0,0,0,1|3,0,0]=4 1457 B14R1.42 COc1cc(cnc1N)SCC(C)C 62a_106354213024_100000210760 [0,0,0,0,0,1|3,0,0]=4 1458 B14R1.42 COc1cc(cnc1N)SCC(C)O 62a_100011218427_106354213024 [0,0,0,0,0,1|3,0,0]=4 1459 B14R1.42 COc1cc(cnc1N)SCC(C)O 62a_106354213024_100011218427 [0,0,0,0,0,1|3,0,0]=4 1460 B14R1.42 COc1cc(cnc1N)SC[C@@H](C)O 62a_100009817552_106354213024 [0,0,0,0,0,1|3,0,0]=4 1461 B14R1.42 COc1cc(cnc1N)SC[C@@H](C)O 62a_106354213024_100009817552 [0,0,0,0,0,1|3,0,0]=4 1462 B14R1.42 COc1cc(ncc1Br)COC(C)C 34a_100010999569_100000210206 [0,0,0,0,0,1|3,0,0]=4 1463 B14R1.42 COc1cc(ncc1C)SCC(C)C 62a_100000210624_100010067687 [0,0,0,0,0,1|3,0,0]=4 1464 B14R1.42 COc1cc(ncc1C)SCC(C)C 62a_100010067687_100000210760 [0,0,0,0,0,1|3,0,0]=4 1465 B14R1.42 COc1cc(ncc1C)SCC(C)O 62a_100010067687_100011218427 [0,0,0,0,0,1|3,0,0]=4 1466 B14R1.42 COc1cc(ncc1C)SCC(C)O 62a_100011218427_100010067687 [0,0,0,0,0,1|3,0,0]=4 1467 B14R1.42 COc1cc(ncc1C)SC[C@@H](C)O 62a_100009817552_100010067687 [0,0,0,0,0,1|3,0,0]=4 1468 B14R1.42 COc1cc(ncc1C)SC[C@@H](C)O 62a_100010067687_100009817552 [0,0,0,0,0,1|3,0,0]=4 1469 B14R1.42 COc1cc(ncc1F)SCC(C)C 62a_100000210624_200010136270 [0,0,0,0,0,1|3,0,0]=4 1470 B14R1.42 COc1cc(ncc1F)SCC(C)C 62a_200010136270_100000210760 [0,0,0,0,0,1|3,0,0]=4 1471 B14R1.42 COc1cc(ncc1F)SCC(C)O 62a_100011218427_200010136270 [0,0,0,0,0,1|3,0,0]=4 1472 B14R1.42 COc1cc(ncc1F)SCC(C)O 62a_200010136270_100011218427 [0,0,0,0,0,1|3,0,0]=4 1473 B14R1.42 COc1cc(ncc1F)SC[C@@H](C)O 62a_100009817552_200010136270 [0,0,0,0,0,1|3,0,0]=4 1474 B14R1.42 COc1cc(ncc1F)SC[C@@H](C)O 62a_200010136270_100009817552 [0,0,0,0,0,1|3,0,0]=4 1475 B14R1.42 COc1cc(ncc1N)SCC(C)C 62a_100000210624_100009887741 [0,0,0,0,0,1|3,0,0]=4 1476 B14R1.42 COc1cc(ncc1N)SCC(C)C 62a_100009887741_100000210760 [0,0,0,0,0,1|3,0,0]=4 1477 B14R1.42 COc1cc(ncc1N)SCC(C)O 62a_100009887741_100011218427 [0,0,0,0,0,1|3,0,0]=4 1478 B14R1.42 COc1cc(ncc1N)SCC(C)O 62a_100011218427_100009887741 [0,0,0,0,0,1|3,0,0]=4 1479 B14R1.42 COc1cc(ncc1N)SC[C@@H](C)O 62a_100009817552_100009887741 [0,0,0,0,0,1|3,0,0]=4 1480 B14R1.42 COc1cc(ncc1N)SC[C@@H](C)O 62a_100009887741_100009817552 [0,0,0,0,0,1|3,0,0]=4 1481 B14R1.42 COc1nc(ccc1Br)CNC(C)C 2230a_100138425928_200010066506 [0,0,0,0,0,1|3,0,0]=4 1482 B14R1.42 COc1nc(ccc1Br)CNC(C)C 34a_100138425928_200010066506 [0,0,0,0,0,1|3,0,0]=4 1483 B14R1.42 COc1nc(ccc1Br)COC(C)C 34a_100000212225_200010066506 [0,0,0,0,0,1|3,0,0]=4 1484 B14R1.42 COc1nc(ccc1Br)CSC(C)C 62a_100000210206_200010066506 [0,0,0,0,0,1|3,0,0]=4 1485 B14R1.42 COc1nc(ccc1Br)CSC(C)C 62a_200010066506_100000210206 [0,0,0,0,0,1|3,0,0]=4 1486 B14R1.42 COc1nc(ccc1N)SCC(C)C 62a_100000210624_100000687816 [0,0,0,0,0,1|3,0,0]=4 1487 B14R1.42 COc1nc(ccc1N)SCC(C)C 62a_100000687816_100000210760 [0,0,0,0,0,1|3,0,0]=4 1488 B14R1.42 COc1nc(ccc1N)SCC(C)O 62a_100000687816_100011218427 [0,0,0,0,0,1|3,0,0]=4 1489 B14R1.42 COc1nc(ccc1N)SCC(C)O 62a_100011218427_100000687816 [0,0,0,0,0,1|3,0,0]=4 1490 B14R1.42 COc1nc(ccc1N)SC[C@@H](C)O 62a_100000687816_100009817552 [0,0,0,0,0,1|3,0,0]=4 1491 B14R1.42 COc1nc(ccc1N)SC[C@@H](C)O 62a_100009817552_100000687816 [0,0,0,0,0,1|3,0,0]=4 1492 B14R1.42 COc1nc(ccc1O)C=CC(C)C 271570a_100016257149_100010893133 [0,0,0,0,0,1|2,0,1]=4 1493 B14R1.42 COc1nc(ccc1O)C=CC(C)O 271570a_200011019289_100010893133 [0,0,0,0,0,1|2,0,1]=4 1494 B14R1.42 COc1nc(ccc1O)SCC(=O)N 62a_100000747473_100010893133 [0,0,0,0,0,1|2,0,1]=4 1495 B14R1.42 COc1nc(ccc1O)SCC(C)C 62a_100000210624_100010893133 [0,0,0,0,0,1|2,0,0]=3 1496 B14R1.42 COc1nc(ccc1O)SCC(C)O 62a_100011218427_100010893133 [0,0,0,0,0,1|2,0,0]=3 1497 B14R1.42 COc1nc(ccc1O)SCC(F)F 62a_100011934356_100010893133 [0,0,0,0,0,1|3,0,0]=4 1498 B14R1.42 COc1nc(ccc1O)SC[C@@H](C)O 62a_100009817552_100010893133 [0,0,0,0,0,1|2,0,0]=3 1499 B14R1.42 COc1nc(cnc1O)SCC(C)C 62a_100000210624_200010365344 [0,0,0,0,0,1|3,0,0]=4 1500 B14R1.42 COc1nc(cnc1O)SCC(C)C 62a_200010365344_100000210760 [0,0,0,0,0,1|3,0,0]=4 1501 B14R1.42 COc1nc(cnc1O)SCC(C)O 62a_100011218427_200010365344 [0,0,0,0,0,1|3,0,0]=4 1502 B14R1.42 COc1nc(cnc1O)SCC(C)O 62a_200010365344_100011218427 [0,0,0,0,0,1|3,0,0]=4 1503 B14R1.42 COc1nc(cnc1O)SC[C@@H](C)O 62a_100009817552_200010365344 [0,0,0,0,0,1|3,0,0]=4 1504 B14R1.42 COc1nc(cnc1O)SC[C@@H](C)O 62a_200010365344_100009817552 [0,0,0,0,0,1|3,0,0]=4 1505 B14R1.42 CSc1cc(ccc1F)SCC(C)C 62a_100000210624_100010341305 [0,0,0,0,0,1|2,1,0]=4 1506 B14R1.42 CSc1cc(ccc1F)SCC(C)C 62a_100010341305_100000210760 [0,0,0,0,0,1|2,1,0]=4 1507 B14R1.42 CSc1cc(ccc1F)SCC(C)O 62a_100010341305_100011218427 [0,0,0,0,0,1|2,1,0]=4 1508 B14R1.42 CSc1cc(ccc1F)SCC(C)O 62a_100011218427_100010341305 [0,0,0,0,0,1|2,1,0]=4 1509 B14R1.42 CSc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100010341305 [0,0,0,0,0,1|2,1,0]=4 1510 B14R1.42 CSc1cc(ccc1F)SC[C@@H](C)O 62a_100010341305_100009817552 [0,0,0,0,0,1|2,1,0]=4 1511 B14R1.42 C[C@@H](O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100009817552 [0,0,0,0,0,1|3,0,0]=4 1512 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)C#N)O 62a_100009817552_100000687585 [0,0,0,0,0,1|3,0,0]=4 1513 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)C=O)O 62a_100009817552_100000186750 [0,0,0,0,0,1|3,0,0]=4 1514 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CN)O 62a_100000730032_100009817552 [0,0,0,0,0,1|3,0,0]=4 1515 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CN)O 62a_100009817552_100000730032 [0,0,0,0,0,1|3,0,0]=4 1516 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100000184703_100009817552 [0,0,0,0,0,1|3,0,0]=4 1517 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100009817552_100000184703 [0,0,0,0,0,1|3,0,0]=4 1518 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [2,0,0,0,0,0|1,0,1]=4 1519 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [2,0,0,0,0,0|1,0,1]=4 1520 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [2,0,0,0,0,0|1,0,0]=3 1521 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [2,0,0,0,0,0|2,0,0]=4 1522 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [2,0,0,0,0,0|2,0,0]=4 1523 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [2,0,0,0,0,0|2,0,0]=4 1524 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [2,0,0,0,0,0|2,0,0]=4 1525 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [2,0,0,0,0,0|2,0,0]=4 1526 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [2,0,0,0,0,0|2,0,0]=4 1527 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [2,0,0,0,0,0|2,0,0]=4 1528 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [2,0,0,0,0,0|2,0,0]=4 1529 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [2,0,0,0,0,0|2,0,0]=4 1530 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [2,0,0,0,0,0|2,0,0]=4 1531 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [2,0,0,0,0,0|1,0,1]=4 1532 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [2,0,0,0,0,0|1,0,1]=4 1533 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [2,0,0,0,0,0|1,0,1]=4 1534 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [2,0,0,0,0,0|1,0,1]=4 1535 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [2,0,0,0,0,0|1,0,1]=4 1536 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [2,0,0,0,0,0|1,0,1]=4 1537 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [2,0,0,0,0,0|1,0,1]=4 1538 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [2,0,0,0,0,0|1,0,0]=3 1539 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [2,0,0,0,0,0|2,0,0]=4 1540 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [2,0,0,0,0,0|2,0,0]=4 1541 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [2,0,0,0,0,0|2,0,0]=4 1542 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [2,0,0,0,0,0|2,0,0]=4 1543 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [2,0,0,0,0,0|2,0,0]=4 1544 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [2,0,0,0,0,0|2,0,0]=4 1545 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [2,0,0,0,0,0|2,0,0]=4 1546 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [2,0,0,0,0,0|2,0,0]=4 1547 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [2,0,0,0,0,0|2,0,0]=4 1548 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [2,0,0,0,0,0|2,0,0]=4 1549 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [2,0,0,0,0,0|2,0,0]=4 1550 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [2,0,0,0,0,0|2,0,0]=4 1551 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [2,0,0,0,0,0|2,0,0]=4 1552 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [2,0,0,0,0,0|1,0,1]=4 1553 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [2,0,0,0,0,0|2,0,0]=4 1554 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [2,0,0,0,0,0|2,0,0]=4 1555 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [2,0,0,0,0,0|2,0,0]=4 1556 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [2,0,0,0,0,0|2,0,0]=4 1557 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [2,0,0,0,0,0|2,0,0]=4 1558 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [2,0,0,0,0,0|2,0,0]=4 1559 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [2,0,0,0,0,0|2,0,0]=4 1560 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [2,0,0,0,0,0|2,0,0]=4 1561 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [2,0,0,0,0,0|2,0,0]=4 1562 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [2,0,0,0,0,0|2,0,0]=4 1563 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [2,0,0,0,0,0|2,0,0]=4 1564 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [2,0,0,0,0,0|2,0,0]=4 1565 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [2,0,0,0,0,0|2,0,0]=4 1566 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [2,0,0,0,0,0|2,0,0]=4 1567 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [2,0,0,0,0,0|2,0,0]=4 1568 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [2,0,0,0,0,0|1,0,1]=4 1569 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [2,0,0,0,0,0|1,0,1]=4 1570 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [2,0,0,0,0,0|0,0,2]=4 1571 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [2,0,0,0,0,0|0,0,2]=4 1572 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [2,0,0,0,0,0|1,0,0]=3 1573 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [2,0,0,0,0,0|2,0,0]=4 1574 B11R1.192 CCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210202 [2,0,0,0,0,0|2,0,0]=4 1575 B11R1.192 CCNc1ccc(c(c1)C)Br 34a_100000210723_100000210202 [2,0,0,0,0,0|2,0,0]=4 1576 B11R1.192 CCNc1ccc(c(c1)C)Br 7a_100000210723_100000210202 [2,0,0,0,0,0|2,0,0]=4 1577 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [2,0,0,0,0,0|2,0,0]=4 1578 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [2,0,0,0,0,0|2,0,0]=4 1579 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [2,0,0,0,0,0|2,0,0]=4 1580 B11R1.192 CCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210202 [2,0,0,0,0,0|2,0,0]=4 1581 B11R1.192 CCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210202 [2,0,0,0,0,0|2,0,0]=4 1582 B11R1.192 CCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210202 [2,0,0,0,0,0|2,0,0]=4 1583 B11R1.192 CCNc1ccc(c(c1)C)F 2230a_100000750164_100000210202 [2,0,0,0,0,0|2,0,0]=4 1584 B11R1.192 CCNc1ccc(c(c1)C)F 34a_100000750164_100000210202 [2,0,0,0,0,0|2,0,0]=4 1585 B11R1.192 CCNc1ccc(c(c1)C)F 7a_100000750164_100000210202 [2,0,0,0,0,0|2,0,0]=4 1586 B11R1.192 CCNc1ccc(c(c1)C)I 34a_100000198070_100000210202 [2,0,0,0,0,0|2,0,0]=4 1587 B11R1.192 CCNc1ccc(c(c1)C)I 7a_100000198070_100000210202 [2,0,0,0,0,0|2,0,0]=4 1588 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [2,0,0,0,0,0|1,0,0]=3 1589 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [2,0,0,0,0,0|1,0,0]=3 1590 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [2,0,0,0,0,0|1,0,0]=3 1591 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [2,0,0,0,0,0|2,0,0]=4 1592 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [2,0,0,0,0,0|2,0,0]=4 1593 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [2,0,0,0,0,0|2,0,0]=4 1594 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [2,0,0,0,0,0|2,0,0]=4 1595 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [2,0,0,0,0,0|2,0,0]=4 1596 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [2,0,0,0,0,0|2,0,0]=4 1597 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [2,0,0,0,0,0|2,0,0]=4 1598 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [2,0,0,0,0,0|2,0,0]=4 1599 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [2,0,0,0,0,0|1,0,0]=3 1600 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [2,0,0,0,0,0|2,0,0]=4 1601 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [2,0,0,0,0,0|2,0,0]=4 1602 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [2,0,0,0,0,0|2,0,0]=4 1603 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [2,0,0,0,0,0|2,0,0]=4 1604 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [2,0,0,0,0,0|2,0,0]=4 1605 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [2,0,0,0,0,0|2,0,0]=4 1606 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [2,0,0,0,0,0|2,0,0]=4 1607 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [2,0,0,0,0,0|2,0,0]=4 1608 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [2,0,0,0,0,0|2,0,0]=4 1609 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [2,0,0,0,0,0|2,0,0]=4 1610 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [2,0,0,0,0,0|2,0,0]=4 1611 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [2,0,0,0,0,0|2,0,0]=4 1612 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [2,0,0,0,0,0|2,0,0]=4 1613 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [2,0,0,0,0,0|1,0,0]=3 1614 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [2,0,0,0,0,0|2,0,0]=4 1615 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [2,0,0,0,0,0|2,0,0]=4 1616 B11R1.192 CCSc1cc(c(cn1)O)C 62a_100000210202_100000692680 [2,0,0,0,0,0|2,0,0]=4 1617 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [2,0,0,0,0,0|2,0,0]=4 1618 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [2,0,0,0,0,0|2,0,0]=4 1619 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100000210202_100009813585 [2,0,0,0,0,0|2,0,0]=4 1620 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100009813585_100000210202 [2,0,0,0,0,0|2,0,0]=4 1621 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [2,0,0,0,0,0|2,0,0]=4 1622 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [2,0,0,0,0,0|2,0,0]=4 1623 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210202 [2,0,0,0,0,0|2,0,0]=4 1624 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000210202_100000049509 [2,0,0,0,0,0|2,0,0]=4 1625 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100000210202_100011218330 [2,0,0,0,0,0|2,0,0]=4 1626 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100011218330_100000210202 [2,0,0,0,0,0|2,0,0]=4 1627 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000210202_100000211769 [2,0,0,0,0,0|2,0,0]=4 1628 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000211769_100000210202 [2,0,0,0,0,0|2,0,0]=4 1629 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [2,0,0,0,0,0|1,0,0]=3 1630 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [2,0,0,0,0,0|2,0,0]=4 1631 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [2,0,0,0,0,0|2,0,0]=4 1632 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [2,0,0,0,0,0|2,0,0]=4 1633 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [2,0,0,0,0,0|2,0,0]=4 1634 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [2,0,0,0,0,0|2,0,0]=4 1635 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [2,0,0,0,0,0|2,0,0]=4 1636 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [2,0,0,0,0,0|2,0,0]=4 1637 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [2,0,0,0,0,0|2,0,0]=4 1638 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [2,0,0,0,0,0|2,0,0]=4 1639 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [2,0,0,0,0,0|2,0,0]=4 1640 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [2,0,0,0,0,0|2,0,0]=4 1641 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [2,0,0,0,0,0|2,0,0]=4 1642 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [2,0,0,0,0,0|2,0,0]=4 1643 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [2,0,0,0,0,0|2,0,0]=4 1644 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [2,0,0,0,0,0|2,0,0]=4 1645 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [2,0,0,0,0,0|2,0,0]=4 1646 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [2,0,0,0,0,0|1,0,0]=3 1647 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [2,0,0,0,0,0|2,0,0]=4 1648 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [2,0,0,0,0,0|2,0,0]=4 1649 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000210202_100000685391 [2,0,0,0,0,0|2,0,0]=4 1650 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000685391_100000210202 [2,0,0,0,0,0|2,0,0]=4 1651 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [2,0,0,0,0,0|2,0,0]=4 1652 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [2,0,0,0,0,0|2,0,0]=4 1653 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [2,0,0,0,0,0|2,0,0]=4 1654 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [2,0,0,0,0,0|2,0,0]=4 1655 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [2,0,0,0,0,0|2,0,0]=4 1656 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [2,0,0,0,0,0|2,0,0]=4 1657 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [2,0,0,0,0,0|2,0,0]=4 1658 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [2,0,0,0,0,0|2,0,0]=4 1659 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [2,0,0,0,0,0|2,0,0]=4 1660 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [2,0,0,0,0,0|2,0,0]=4 1661 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [2,0,0,0,0,0|2,0,0]=4 1662 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [2,0,0,0,0,0|2,0,0]=4 1663 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [2,0,0,0,0,0|2,0,0]=4 1664 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [2,0,0,0,0,0|2,0,0]=4 1665 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [2,0,0,0,0,0|2,0,0]=4 1666 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [2,0,0,0,0,0|2,0,0]=4 1667 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [2,0,0,0,0,0|2,0,0]=4 1668 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [2,0,0,0,0,0|2,0,0]=4 1669 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [2,0,0,0,0,0|2,0,0]=4 1670 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [2,0,0,0,0,0|2,0,0]=4 1671 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [2,0,0,0,0,0|2,0,0]=4 1672 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [2,0,0,0,0,0|2,0,0]=4 1673 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [2,0,0,0,0,0|2,0,0]=4 1674 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [2,0,0,0,0,0|2,0,0]=4 1675 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [2,0,0,0,0,0|2,0,0]=4 1676 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [2,0,0,0,0,0|2,0,0]=4 1677 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [2,0,0,0,0,0|2,0,0]=4 1678 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [2,0,0,0,0,0|2,0,0]=4 1679 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [2,0,0,0,0,0|2,0,0]=4 1680 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [2,0,0,0,0,0|2,0,0]=4 1681 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [2,0,0,0,0,0|2,0,0]=4 1682 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [2,0,0,0,0,0|1,0,0]=3 1683 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [2,0,0,0,0,0|2,0,0]=4 1684 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [2,0,0,0,0,0|2,0,0]=4 1685 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [2,0,0,0,0,0|2,0,0]=4 1686 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [2,0,0,0,0,0|2,0,0]=4 1687 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [2,0,0,0,0,0|2,0,0]=4 1688 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [2,0,0,0,0,0|2,0,0]=4 1689 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [2,0,0,0,0,0|2,0,0]=4 1690 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [2,0,0,0,0,0|2,0,0]=4 1691 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [2,0,0,0,0,0|2,0,0]=4 1692 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [2,0,0,0,0,0|2,0,0]=4 1693 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [2,0,0,0,0,0|2,0,0]=4 1694 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [2,0,0,0,0,0|2,0,0]=4 1695 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [2,0,0,0,0,0|2,0,0]=4 1696 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [2,0,0,0,0,0|2,0,0]=4 1697 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [2,0,0,0,0,0|2,0,0]=4 1698 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [2,0,0,0,0,0|2,0,0]=4 1699 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [2,0,0,0,0,0|2,0,0]=4 1700 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [2,0,0,0,0,0|2,0,0]=4 1701 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [2,0,0,0,0,0|2,0,0]=4 1702 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [2,0,0,0,0,0|2,0,0]=4 1703 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [2,0,0,0,0,0|2,0,0]=4 1704 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [2,0,0,0,0,0|2,0,0]=4 1705 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [2,0,0,0,0,0|2,0,0]=4 1706 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [2,0,0,0,0,0|2,0,0]=4 1707 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [2,0,0,0,0,0|2,0,0]=4 1708 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [2,0,0,0,0,0|2,0,0]=4 1709 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [2,0,0,0,0,0|2,0,0]=4 1710 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [2,0,0,0,0,0|2,0,0]=4 1711 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [2,0,0,0,0,0|2,0,0]=4 1712 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [2,0,0,0,0,0|2,0,0]=4 1713 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [2,0,0,0,0,0|2,0,0]=4 1714 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [2,0,0,0,0,0|2,0,0]=4 1715 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [2,0,0,0,0,0|2,0,0]=4 1716 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [2,0,0,0,0,0|2,0,0]=4 1717 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [2,0,0,0,0,0|2,0,0]=4 1718 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [2,0,0,0,0,0|2,0,0]=4 1719 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [2,0,0,0,0,0|2,0,0]=4 1720 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [2,0,0,0,0,0|2,0,0]=4 1721 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [2,0,0,0,0,0|0,0,2]=4 1722 B11R1.192 Cc1cc(ccc1O)NCF 34a_100011218179_100015361967 [2,0,0,0,0,0|2,0,0]=4 1723 B11R1.192 Cc1cc(ccc1O)NCF 7a_100011218179_100015361967 [2,0,0,0,0,0|2,0,0]=4 1724 B11R1.192 Cc1cc(ccc1O)SCF 62a_100015361967_100000186361 [2,0,0,0,0,0|2,0,0]=4 1725 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [2,0,0,0,0,0|2,0,0]=4 1726 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [2,0,0,0,0,0|2,0,0]=4 1727 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [2,0,0,0,0,0|2,0,0]=4 1728 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [2,0,0,0,0,0|2,0,0]=4 1729 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [2,0,0,0,0,0|2,0,0]=4 1730 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [2,0,0,0,0,0|2,0,0]=4 1731 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [2,0,0,0,0,0|2,0,0]=4 1732 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [2,0,0,0,0,0|2,0,0]=4 1733 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [2,0,0,0,0,0|2,0,0]=4 1734 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [2,0,0,0,0,0|2,0,0]=4 1735 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [2,0,0,0,0,0|2,0,0]=4 1736 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [2,0,0,0,0,0|2,0,0]=4 1737 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [2,0,0,0,0,0|1,0,0]=3 1738 B11R1.189 C=Cc1cccc(c1)CCC 271570a_100011290941_100000694964 [2,0,0,0,0,0|1,0,1]=4 1739 B11R1.189 C=Cc1cccc(c1)CCN 271570a_100011290941_100011207229 [2,0,0,0,0,0|1,0,1]=4 1740 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [2,0,0,0,0,0|0,0,2]=4 1741 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [2,0,0,0,0,0|0,0,0]=2 1742 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [2,0,0,0,0,0|0,0,0]=2 1743 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [2,0,0,0,0,0|0,0,0]=2 1744 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [2,0,0,0,0,0|0,0,0]=2 1745 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [2,0,0,0,0,0|0,1,0]=3 1746 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [2,0,0,0,0,0|0,1,0]=3 1747 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [2,0,0,0,0,0|0,1,0]=3 1748 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [2,0,0,0,0,0|0,1,0]=3 1749 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [2,0,0,0,0,0|2,0,0]=4 1750 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [2,0,0,0,0,0|2,0,0]=4 1751 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [2,0,0,0,0,0|2,0,0]=4 1752 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [2,0,0,0,0,0|1,0,0]=3 1753 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [2,0,0,0,0,0|1,0,0]=3 1754 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [2,0,0,0,0,0|1,0,0]=3 1755 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [2,0,0,0,0,0|1,0,0]=3 1756 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [2,0,0,0,0,0|1,0,0]=3 1757 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [2,0,0,0,0,0|1,1,0]=4 1758 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [2,0,0,0,0,0|1,1,0]=4 1759 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [2,0,0,0,0,0|1,1,0]=4 1760 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [2,0,0,0,0,0|1,1,0]=4 1761 B11R1.189 CCOc1cccc(c1)CC 34a_100000211550_100000210202 [2,0,0,0,0,0|2,0,0]=4 1762 B11R1.189 CCOc1cccc(c1)CC 7a_100000211550_100000210202 [2,0,0,0,0,0|2,0,0]=4 1763 B11R1.189 CCOc1cccc(c1)NC 2230a_100000742568_200000210301 [2,0,0,0,0,0|2,0,0]=4 1764 B11R1.189 CCOc1cccc(c1)NC 34a_100000742568_200000210301 [2,0,0,0,0,0|2,0,0]=4 1765 B11R1.189 CCOc1cccc(c1)NC 34a_100000756613_100000210202 [2,0,0,0,0,0|2,0,0]=4 1766 B11R1.189 CCOc1cccc(c1)NC 7a_100000756613_100000210202 [2,0,0,0,0,0|2,0,0]=4 1767 B11R1.189 CCOc1cccc(c1)N[13CH3] 2230a_100000742568_200025704644 [2,0,0,0,0,0|2,0,0]=4 1768 B11R1.189 CCOc1cccc(c1)N[13CH3] 34a_100000742568_200025704644 [2,0,0,0,0,0|2,0,0]=4 1769 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [2,0,0,0,0,0|1,0,0]=3 1770 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [2,0,0,0,0,0|1,0,0]=3 1771 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [2,0,0,0,0,0|1,0,0]=3 1772 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [2,0,0,0,0,0|1,0,0]=3 1773 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [2,0,0,0,0,0|1,0,0]=3 1774 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [2,0,0,0,0,0|1,0,0]=3 1775 B11R1.189 CCOc1cccc(c1)SC 34a_100011265683_100000210202 [2,0,0,0,0,0|1,1,0]=4 1776 B11R1.189 CCOc1cccc(c1)SC 62a_200000210301_100000170002 [2,0,0,0,0,0|1,1,0]=4 1777 B11R1.189 CCOc1cccc(c1)SC 7a_100011265683_100000210202 [2,0,0,0,0,0|1,1,0]=4 1778 B11R1.189 CCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170002 [2,0,0,0,0,0|1,1,0]=4 1779 B11R1.189 CCOc1ccnc(c1)OC 34a_100012181050_100000210202 [2,0,0,0,0,0|2,0,0]=4 1780 B11R1.189 CCOc1cncc(c1)OC 34a_100000084572_100000210202 [2,0,0,0,0,0|2,0,0]=4 1781 B11R1.189 CCOc1cncc(c1)OC 7a_100000084572_100000210202 [2,0,0,0,0,0|2,0,0]=4 1782 B11R1.189 CCSc1cc(ccn1)OC 62a_100000210202_100011216251 [2,0,0,0,0,0|2,0,0]=4 1783 B11R1.189 CCSc1cc(ccn1)OC 62a_100009817693_100000210202 [2,0,0,0,0,0|2,0,0]=4 1784 B11R1.189 CCSc1cccc(c1)CC 62a_100000210202_100011263222 [2,0,0,0,0,0|2,0,0]=4 1785 B11R1.189 CCSc1cccc(c1)CC 62a_100011263222_100000210202 [2,0,0,0,0,0|2,0,0]=4 1786 B11R1.189 CCSc1cccc(c1)NC 62a_100000210202_100000219648 [2,0,0,0,0,0|2,0,0]=4 1787 B11R1.189 CCSc1cccc(c1)NC 62a_100000219648_100000210202 [2,0,0,0,0,0|2,0,0]=4 1788 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [2,0,0,0,0,0|1,0,0]=3 1789 B11R1.189 CCSc1cccc(c1)SC 62a_100000210202_100011215954 [2,0,0,0,0,0|1,1,0]=4 1790 B11R1.189 CCSc1cccc(c1)SC 62a_100000703699_200000210301 [2,0,0,0,0,0|1,1,0]=4 1791 B11R1.189 CCSc1cccc(c1)SC 62a_100011215954_100000210202 [2,0,0,0,0,0|1,1,0]=4 1792 B11R1.189 CCSc1cccc(c1)SC 62a_200000210301_100000703699 [2,0,0,0,0,0|1,1,0]=4 1793 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_100000703699_200025704644 [2,0,0,0,0,0|1,1,0]=4 1794 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_200025704644_100000703699 [2,0,0,0,0,0|1,1,0]=4 1795 B11R1.189 CCSc1cccc(n1)OC 62a_100000210202_100000760917 [2,0,0,0,0,0|2,0,0]=4 1796 B11R1.189 CCSc1cccc(n1)OC 62a_100000760917_100000210202 [2,0,0,0,0,0|2,0,0]=4 1797 B11R1.189 CCSc1ccnc(c1)OC 62a_100000117307_100000210202 [2,0,0,0,0,0|2,0,0]=4 1798 B11R1.189 CCSc1ccnc(c1)OC 62a_100000210202_100000117307 [2,0,0,0,0,0|2,0,0]=4 1799 B11R1.189 CCSc1cncc(c1)OC 62a_100000050176_100000210202 [2,0,0,0,0,0|2,0,0]=4 1800 B11R1.189 CCSc1cncc(c1)OC 62a_100000210202_100000050176 [2,0,0,0,0,0|2,0,0]=4 1801 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [2,0,0,0,0,0|2,0,0]=4 1802 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [2,0,0,0,0,0|2,0,0]=4 1803 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [2,0,0,0,0,0|2,0,0]=4 1804 B11R1.189 CNCc1cc(ccn1)OC 207a_100102657272_100000087537 [2,0,0,0,0,0|2,0,0]=4 1805 B11R1.189 CNCc1cc(ccn1)OC 2230a_106832991635_100000752681 [2,0,0,0,0,0|2,0,0]=4 1806 B11R1.189 CNCc1cc(ccn1)OC 270004a_106832991635_100000087537 [2,0,0,0,0,0|2,0,0]=4 1807 B11R1.189 CNCc1cc(ccn1)OC 34a_100102657272_100000752681 [2,0,0,0,0,0|2,0,0]=4 1808 B11R1.189 CNCc1cc(ccn1)OC 7a_106832991635_100000752681 [2,0,0,0,0,0|2,0,0]=4 1809 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [2,0,0,0,0,0|1,0,0]=3 1810 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [2,0,0,0,0,0|1,0,0]=3 1811 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [2,0,0,0,0,0|1,0,0]=3 1812 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [2,0,0,0,0,0|1,0,0]=3 1813 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [2,0,0,0,0,0|1,0,0]=3 1814 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [2,0,0,0,0,0|1,0,0]=3 1815 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [2,0,0,0,0,0|1,0,0]=3 1816 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [2,0,0,0,0,0|1,0,0]=3 1817 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [2,0,0,0,0,0|1,0,0]=3 1818 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [2,0,0,0,0,0|1,0,0]=3 1819 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [2,0,0,0,0,0|1,1,0]=4 1820 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [2,0,0,0,0,0|1,1,0]=4 1821 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [2,0,0,0,0,0|1,1,0]=4 1822 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [2,0,0,0,0,0|1,1,0]=4 1823 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [2,0,0,0,0,0|1,1,0]=4 1824 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [2,0,0,0,0,0|1,1,0]=4 1825 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [2,0,0,0,0,0|1,1,0]=4 1826 B11R1.189 CNCc1cccc(n1)OC 207a_100102657272_100000694346 [2,0,0,0,0,0|2,0,0]=4 1827 B11R1.189 CNCc1cccc(n1)OC 2230a_100000746380_200000210301 [2,0,0,0,0,0|2,0,0]=4 1828 B11R1.189 CNCc1cccc(n1)OC 2230a_106832991635_100000755263 [2,0,0,0,0,0|2,0,0]=4 1829 B11R1.189 CNCc1cccc(n1)OC 270004a_106832991635_100000694346 [2,0,0,0,0,0|2,0,0]=4 1830 B11R1.189 CNCc1cccc(n1)OC 34a_100102657272_100000755263 [2,0,0,0,0,0|2,0,0]=4 1831 B11R1.189 CNCc1cccc(n1)OC 7a_106832991635_100000755263 [2,0,0,0,0,0|2,0,0]=4 1832 B11R1.189 CNCc1ccnc(c1)OC 207a_100102657272_100000050969 [2,0,0,0,0,0|2,0,0]=4 1833 B11R1.189 CNCc1ccnc(c1)OC 2230a_106832991635_100103152439 [2,0,0,0,0,0|2,0,0]=4 1834 B11R1.189 CNCc1ccnc(c1)OC 270004a_106832991635_100000050969 [2,0,0,0,0,0|2,0,0]=4 1835 B11R1.189 CNCc1ccnc(c1)OC 34a_100102657272_100103152439 [2,0,0,0,0,0|2,0,0]=4 1836 B11R1.189 CNCc1ccnc(c1)OC 7a_106832991635_100103152439 [2,0,0,0,0,0|2,0,0]=4 1837 B11R1.189 CNCc1cncc(c1)OC 207a_100102657272_100011361638 [2,0,0,0,0,0|2,0,0]=4 1838 B11R1.189 CNCc1cncc(c1)OC 2230a_100020589029_200000210301 [2,0,0,0,0,0|2,0,0]=4 1839 B11R1.189 CNCc1cncc(c1)OC 270004a_106832991635_100011361638 [2,0,0,0,0,0|2,0,0]=4 1840 B11R1.189 CNCc1cncc(c1)OC 34a_100020589029_200000210301 [2,0,0,0,0,0|2,0,0]=4 1841 B11R1.189 CNc1cccc(c1)CCO 2230a_100011996697_200000210301 [2,0,0,0,0,0|2,0,0]=4 1842 B11R1.189 CNc1cccc(c1)CCO 34a_100011996697_200000210301 [2,0,0,0,0,0|2,0,0]=4 1843 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [2,0,0,0,0,0|2,0,0]=4 1844 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [2,0,0,0,0,0|2,0,0]=4 1845 B11R1.189 COCc1cc(ccn1)OC 34a_100000749536_200000210301 [2,0,0,0,0,0|2,0,0]=4 1846 B11R1.189 COCc1cc(ccn1)OC 34a_100138415774_100000752681 [2,0,0,0,0,0|2,0,0]=4 1847 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [2,0,0,0,0,0|2,0,0]=4 1848 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [2,0,0,0,0,0|2,0,0]=4 1849 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [2,0,0,0,0,0|1,0,0]=3 1850 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [2,0,0,0,0,0|1,0,0]=3 1851 B11R1.189 COCc1cccc(c1)SC 62a_100011493687_200000210301 [2,0,0,0,0,0|1,1,0]=4 1852 B11R1.189 COCc1cccc(c1)SC 62a_200000210301_100011493687 [2,0,0,0,0,0|1,1,0]=4 1853 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_100011493687_200025704644 [2,0,0,0,0,0|1,1,0]=4 1854 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_200025704644_100011493687 [2,0,0,0,0,0|1,1,0]=4 1855 B11R1.189 COCc1cccc(n1)OC 34a_100138415774_100000755263 [2,0,0,0,0,0|2,0,0]=4 1856 B11R1.189 COCc1ccnc(c1)OC 34a_100138415774_100103152439 [2,0,0,0,0,0|2,0,0]=4 1857 B11R1.189 COCc1cncc(c1)OC 34a_100000732071_200000210301 [2,0,0,0,0,0|2,0,0]=4 1858 B11R1.189 COc1cc(ccn1)CSC 62a_100103152439_200000210301 [2,0,0,0,0,0|2,0,0]=4 1859 B11R1.189 COc1cc(ccn1)CSC 62a_200000210301_100103152439 [2,0,0,0,0,0|2,0,0]=4 1860 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_100103152439_200025704644 [2,0,0,0,0,0|2,0,0]=4 1861 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_200025704644_100103152439 [2,0,0,0,0,0|2,0,0]=4 1862 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [2,0,0,0,0,0|0,0,2]=4 1863 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [2,0,0,0,0,0|0,0,0]=2 1864 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [2,0,0,0,0,0|1,0,0]=3 1865 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [2,0,0,0,0,0|1,0,0]=3 1866 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [2,0,0,0,0,0|1,0,0]=3 1867 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [2,0,0,0,0,0|1,0,0]=3 1868 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [2,0,0,0,0,0|1,0,0]=3 1869 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [2,0,0,0,0,0|1,0,0]=3 1870 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [2,0,0,0,0,0|1,0,0]=3 1871 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [2,0,0,0,0,0|1,0,0]=3 1872 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [2,0,0,0,0,0|1,0,0]=3 1873 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [2,0,0,0,0,0|1,0,0]=3 1874 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [2,0,0,0,0,0|2,0,0]=4 1875 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [2,0,0,0,0,0|2,0,0]=4 1876 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [2,0,0,0,0,0|2,0,0]=4 1877 B11R1.189 COc1cccc(c1)SCF 62a_100015361967_100000170001 [2,0,0,0,0,0|2,0,0]=4 1878 B11R1.189 COc1cccc(n1)CN[13CH3] 2230a_100000746380_200025704644 [2,0,0,0,0,0|2,0,0]=4 1879 B11R1.189 COc1cccc(n1)CSC 62a_100000755263_200000210301 [2,0,0,0,0,0|2,0,0]=4 1880 B11R1.189 COc1cccc(n1)CSC 62a_200000210301_100000755263 [2,0,0,0,0,0|2,0,0]=4 1881 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_100000755263_200025704644 [2,0,0,0,0,0|2,0,0]=4 1882 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_200025704644_100000755263 [2,0,0,0,0,0|2,0,0]=4 1883 B11R1.189 COc1ccnc(c1)CO[13CH3] 34a_100000749536_200025704644 [2,0,0,0,0,0|2,0,0]=4 1884 B11R1.189 COc1ccnc(c1)CSC 62a_100000752681_200000210301 [2,0,0,0,0,0|2,0,0]=4 1885 B11R1.189 COc1ccnc(c1)CSC 62a_200000210301_100000752681 [2,0,0,0,0,0|2,0,0]=4 1886 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_100000752681_200025704644 [2,0,0,0,0,0|2,0,0]=4 1887 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_200025704644_100000752681 [2,0,0,0,0,0|2,0,0]=4 1888 B11R1.189 COc1cncc(c1)CN[13CH3] 2230a_100020589029_200025704644 [2,0,0,0,0,0|2,0,0]=4 1889 B11R1.189 COc1cncc(c1)CN[13CH3] 34a_100020589029_200025704644 [2,0,0,0,0,0|2,0,0]=4 1890 B11R1.189 COc1cncc(c1)CO[13CH3] 34a_100000732071_200025704644 [2,0,0,0,0,0|2,0,0]=4 1891 B11R1.189 CSc1cccc(c1)CCN 62a_100011207229_200000210301 [2,0,0,0,0,0|0,1,0]=3 1892 B11R1.189 CSc1cccc(c1)CCN 62a_200000210301_100011207229 [2,0,0,0,0,0|0,1,0]=3 1893 B11R1.189 CSc1cccc(c1)CCO 62a_100011217444_200000210301 [2,0,0,0,0,0|1,1,0]=4 1894 B11R1.189 CSc1cccc(c1)CCO 62a_200000210301_100011217444 [2,0,0,0,0,0|1,1,0]=4 1895 B11R1.189 CSc1cccc(c1)CNN 62a_100000686200_200000210301 [2,0,0,0,0,0|1,1,0]=4 1896 B11R1.189 CSc1cccc(c1)CNN 62a_200000210301_100000686200 [2,0,0,0,0,0|1,1,0]=4 1897 B11R1.189 [13CH3]Nc1cccc(c1)CCO 2230a_100011996697_200025704644 [2,0,0,0,0,0|2,0,0]=4 1898 B11R1.189 [13CH3]Nc1cccc(c1)CCO 34a_100011996697_200025704644 [2,0,0,0,0,0|2,0,0]=4 1899 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [2,0,0,0,0,0|0,0,2]=4 1900 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [2,0,0,0,0,0|0,0,0]=2 1901 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [2,0,0,0,0,0|1,0,0]=3 1902 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [2,0,0,0,0,0|1,0,0]=3 1903 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [2,0,0,0,0,0|1,0,0]=3 1904 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_100011207229_200025704644 [2,0,0,0,0,0|0,1,0]=3 1905 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_200025704644_100011207229 [2,0,0,0,0,0|0,1,0]=3 1906 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_100011217444_200025704644 [2,0,0,0,0,0|1,1,0]=4 1907 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_200025704644_100011217444 [2,0,0,0,0,0|1,1,0]=4 1908 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_100000686200_200025704644 [2,0,0,0,0,0|1,1,0]=4 1909 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_200025704644_100000686200 [2,0,0,0,0,0|1,1,0]=4 1910 B11R1.280 C=Cc1cc(ccc1O)CC 271570a_100011290941_100012339963 [2,0,0,0,0,0|1,0,1]=4 1911 B11R1.280 C=Cc1ccc(c(c1)OC)O 271570a_100011290941_100000694246 [2,0,0,0,0,0|0,0,2]=4 1912 B11R1.280 CCc1cc(ccc1O)OC 271570a_203496583355_100000720562 [2,0,0,0,0,0|2,0,0]=4 1913 B11R1.280 CCc1cc(ccc1O)SC 62a_200000210301_100012338938 [2,0,0,0,0,0|2,0,0]=4 1914 B11R1.280 CCc1cc(ccc1O)S[13CH3] 62a_200025704644_100012338938 [2,0,0,0,0,0|2,0,0]=4 1915 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [2,0,0,0,0,0|2,0,0]=4 1916 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [2,0,0,0,0,0|2,0,0]=4 1917 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [2,0,0,0,0,0|2,0,0]=4 1918 B11R1.280 CCc1ccc(c(c1)NC)O 34a_100000765835_200000210301 [2,0,0,0,0,0|1,0,0]=3 1919 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [2,0,0,0,0,0|2,0,0]=4 1920 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [2,0,0,0,0,0|2,0,0]=4 1921 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [2,0,0,0,0,0|2,0,0]=4 1922 B11R1.280 CCc1ccc(c(c1)N[13CH3])O 34a_100000765835_200025704644 [2,0,0,0,0,0|1,0,0]=3 1923 B11R1.280 CCc1ccc(c(c1)OC)N 34a_100000124328_200000210301 [2,0,0,0,0,0|1,0,0]=3 1924 B11R1.280 CCc1ccc(c(c1)OC)N 7a_100000124328_200000210301 [2,0,0,0,0,0|1,0,0]=3 1925 B11R1.280 CCc1ccc(c(c1)OC)O 271570a_203496583355_200010710389 [2,0,0,0,0,0|0,0,0]=2 1926 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 34a_100000124328_200025704644 [2,0,0,0,0,0|1,0,0]=3 1927 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 7a_100000124328_200025704644 [2,0,0,0,0,0|1,0,0]=3 1928 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200000210301_200010244628 [2,0,0,0,0,0|1,1,0]=4 1929 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200010244628_200000210301 [2,0,0,0,0,0|1,1,0]=4 1930 B11R1.280 CCc1ccc(c(c1)SC)N 62a_100012339725_200000210301 [2,0,0,0,0,0|1,1,0]=4 1931 B11R1.280 CCc1ccc(c(c1)SC)N 62a_200000210301_100012339725 [2,0,0,0,0,0|1,1,0]=4 1932 B11R1.280 CCc1ccc(c(c1)SC)O 62a_100012339963_200000210301 [2,0,0,0,0,0|0,1,0]=3 1933 B11R1.280 CCc1ccc(c(c1)SC)O 62a_200000210301_100012339963 [2,0,0,0,0,0|0,1,0]=3 1934 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200010244628_200025704644 [2,0,0,0,0,0|1,1,0]=4 1935 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010244628 [2,0,0,0,0,0|1,1,0]=4 1936 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_100012339725_200025704644 [2,0,0,0,0,0|1,1,0]=4 1937 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_200025704644_100012339725 [2,0,0,0,0,0|1,1,0]=4 1938 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_100012339963_200025704644 [2,0,0,0,0,0|0,1,0]=3 1939 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_200025704644_100012339963 [2,0,0,0,0,0|0,1,0]=3 1940 B11R1.280 CNc1cc(ccc1O)CO 34a_100000123545_200000210301 [2,0,0,0,0,0|2,0,0]=4 1941 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [2,0,0,0,0,0|2,0,0]=4 1942 B11R1.280 CNc1ccc(c(c1)OC)Br 2230a_100000765947_200000210301 [2,0,0,0,0,0|2,0,0]=4 1943 B11R1.280 CNc1ccc(c(c1)OC)Br 34a_100000765947_200000210301 [2,0,0,0,0,0|2,0,0]=4 1944 B11R1.280 CNc1ccc(c(c1)OC)C 2230a_100011279678_200000210301 [2,0,0,0,0,0|2,0,0]=4 1945 B11R1.280 CNc1ccc(c(c1)OC)C 34a_100011279678_200000210301 [2,0,0,0,0,0|2,0,0]=4 1946 B11R1.280 CNc1ccc(c(c1)OC)Cl 2230a_100000742311_200000210301 [2,0,0,0,0,0|2,0,0]=4 1947 B11R1.280 CNc1ccc(c(c1)OC)Cl 34a_100000742311_200000210301 [2,0,0,0,0,0|2,0,0]=4 1948 B11R1.280 CNc1ccc(c(c1)OC)F 2230a_100000701188_200000210301 [2,0,0,0,0,0|2,0,0]=4 1949 B11R1.280 CNc1ccc(c(c1)OC)F 34a_100000701188_200000210301 [2,0,0,0,0,0|2,0,0]=4 1950 B11R1.280 CNc1ccc(c(c1)OC)I 34a_100000746945_200000210301 [2,0,0,0,0,0|2,0,0]=4 1951 B11R1.280 CNc1ccc(c(c1)OC)O 34a_100000726020_200000210301 [2,0,0,0,0,0|1,0,0]=3 1952 B11R1.280 COc1cc(c(cn1)O)OC 271570a_203496583355_100010191559 [2,0,0,0,0,0|2,0,0]=4 1953 B11R1.280 COc1cc(ccc1Br)CO 34a_100010191536_200000210301 [2,0,0,0,0,0|2,0,0]=4 1954 B11R1.280 COc1cc(ccc1Br)CO 7a_100010191536_200000210301 [2,0,0,0,0,0|2,0,0]=4 1955 B11R1.280 COc1cc(ccc1Br)N[13CH3] 2230a_100000765947_200025704644 [2,0,0,0,0,0|2,0,0]=4 1956 B11R1.280 COc1cc(ccc1Br)N[13CH3] 34a_100000765947_200025704644 [2,0,0,0,0,0|2,0,0]=4 1957 B11R1.280 COc1cc(ccc1Br)O[13CH3] 34a_100011827694_200025704644 [2,0,0,0,0,0|2,0,0]=4 1958 B11R1.280 COc1cc(ccc1Br)O[13CH3] 7a_100011827694_200025704644 [2,0,0,0,0,0|2,0,0]=4 1959 B11R1.280 COc1cc(ccc1Br)SC 62a_100012353699_200000210301 [2,0,0,0,0,0|2,0,0]=4 1960 B11R1.280 COc1cc(ccc1Br)SC 62a_200000210301_100012353699 [2,0,0,0,0,0|2,0,0]=4 1961 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_100012353699_200025704644 [2,0,0,0,0,0|2,0,0]=4 1962 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_200025704644_100012353699 [2,0,0,0,0,0|2,0,0]=4 1963 B11R1.280 COc1cc(ccc1C)N[13CH3] 2230a_100011279678_200025704644 [2,0,0,0,0,0|2,0,0]=4 1964 B11R1.280 COc1cc(ccc1C)N[13CH3] 34a_100011279678_200025704644 [2,0,0,0,0,0|2,0,0]=4 1965 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [2,0,0,0,0,0|2,0,0]=4 1966 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [2,0,0,0,0,0|2,0,0]=4 1967 B11R1.280 COc1cc(ccc1C)SC 62a_100011830276_200000210301 [2,0,0,0,0,0|2,0,0]=4 1968 B11R1.280 COc1cc(ccc1C)SC 62a_200000210301_100011830276 [2,0,0,0,0,0|2,0,0]=4 1969 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_100011830276_200025704644 [2,0,0,0,0,0|2,0,0]=4 1970 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_200025704644_100011830276 [2,0,0,0,0,0|2,0,0]=4 1971 B11R1.280 COc1cc(ccc1Cl)CN 34a_100020636435_200000210301 [2,0,0,0,0,0|1,0,0]=3 1972 B11R1.280 COc1cc(ccc1Cl)CO 34a_100009876509_200000210301 [2,0,0,0,0,0|2,0,0]=4 1973 B11R1.280 COc1cc(ccc1Cl)CO 7a_100009876509_200000210301 [2,0,0,0,0,0|2,0,0]=4 1974 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 2230a_100000742311_200025704644 [2,0,0,0,0,0|2,0,0]=4 1975 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 34a_100000742311_200025704644 [2,0,0,0,0,0|2,0,0]=4 1976 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 34a_100012186310_200025704644 [2,0,0,0,0,0|2,0,0]=4 1977 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 7a_100012186310_200025704644 [2,0,0,0,0,0|2,0,0]=4 1978 B11R1.280 COc1cc(ccc1Cl)SC 62a_100011356853_200000210301 [2,0,0,0,0,0|2,0,0]=4 1979 B11R1.280 COc1cc(ccc1Cl)SC 62a_200000210301_100011356853 [2,0,0,0,0,0|2,0,0]=4 1980 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_100011356853_200025704644 [2,0,0,0,0,0|2,0,0]=4 1981 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100011356853 [2,0,0,0,0,0|2,0,0]=4 1982 B11R1.280 COc1cc(ccc1F)CN 34a_100160469508_200000210301 [2,0,0,0,0,0|1,0,0]=3 1983 B11R1.280 COc1cc(ccc1F)CO 34a_100009842347_200000210301 [2,0,0,0,0,0|2,0,0]=4 1984 B11R1.280 COc1cc(ccc1F)CO 7a_100009842347_200000210301 [2,0,0,0,0,0|2,0,0]=4 1985 B11R1.280 COc1cc(ccc1F)N[13CH3] 2230a_100000701188_200025704644 [2,0,0,0,0,0|2,0,0]=4 1986 B11R1.280 COc1cc(ccc1F)N[13CH3] 34a_100000701188_200025704644 [2,0,0,0,0,0|2,0,0]=4 1987 B11R1.280 COc1cc(ccc1F)O[13CH3] 34a_100012001760_200025704644 [2,0,0,0,0,0|2,0,0]=4 1988 B11R1.280 COc1cc(ccc1F)O[13CH3] 7a_100012001760_200025704644 [2,0,0,0,0,0|2,0,0]=4 1989 B11R1.280 COc1cc(ccc1F)SC 62a_100011934186_200000210301 [2,0,0,0,0,0|2,0,0]=4 1990 B11R1.280 COc1cc(ccc1F)SC 62a_200000210301_100011934186 [2,0,0,0,0,0|2,0,0]=4 1991 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_100011934186_200025704644 [2,0,0,0,0,0|2,0,0]=4 1992 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_200025704644_100011934186 [2,0,0,0,0,0|2,0,0]=4 1993 B11R1.280 COc1cc(ccc1I)CO 34a_100000049605_200000210301 [2,0,0,0,0,0|2,0,0]=4 1994 B11R1.280 COc1cc(ccc1I)CO 7a_100000049605_200000210301 [2,0,0,0,0,0|2,0,0]=4 1995 B11R1.280 COc1cc(ccc1I)N[13CH3] 34a_100000746945_200025704644 [2,0,0,0,0,0|2,0,0]=4 1996 B11R1.280 COc1cc(ccc1N)O[13CH3] 34a_100015326901_200025704644 [2,0,0,0,0,0|2,0,0]=4 1997 B11R1.280 COc1cc(ccc1N)O[13CH3] 7a_100015326901_200025704644 [2,0,0,0,0,0|2,0,0]=4 1998 B11R1.280 COc1cc(ccc1N)SC 62a_100011279103_200000210301 [2,0,0,0,0,0|2,0,0]=4 1999 B11R1.280 COc1cc(ccc1N)SC 62a_200000210301_100015196925 [2,0,0,0,0,0|2,0,0]=4 2000 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_100011279103_200025704644 [2,0,0,0,0,0|2,0,0]=4 2001 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_200025704644_100015196925 [2,0,0,0,0,0|2,0,0]=4 2002 B11R1.280 COc1cc(ccc1O)C#N 271570a_203496583355_100012356288 [2,0,0,0,0,0|0,0,2]=4 2003 B11R1.280 COc1cc(ccc1O)C=O 271570a_203496583355_100010244714 [2,0,0,0,0,0|1,0,1]=4 2004 B11R1.280 COc1cc(ccc1O)CO 271570a_203496583355_100010234685 [2,0,0,0,0,0|1,0,0]=3 2005 B11R1.280 COc1cc(ccc1O)N[13CH3] 34a_100000726020_200025704644 [2,0,0,0,0,0|1,0,0]=3 2006 B11R1.280 COc1cc(ccc1O)SC 62a_200000210301_100000694246 [2,0,0,0,0,0|1,0,0]=3 2007 B11R1.280 COc1cc(ccc1O)S[13CH3] 62a_200025704644_100000694246 [2,0,0,0,0,0|1,0,0]=3 2008 B11R1.280 COc1cc(ncc1O)CO 271570a_203496583355_100010999569 [2,0,0,0,0,0|2,0,0]=4 2009 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [2,0,0,0,0,0|2,0,0]=4 2010 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100000719091_200000210301 [2,0,0,0,0,0|2,0,0]=4 2011 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100011827694_200000210301 [2,0,0,0,0,0|2,0,0]=4 2012 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100000719091_200000210301 [2,0,0,0,0,0|2,0,0]=4 2013 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100011827694_200000210301 [2,0,0,0,0,0|2,0,0]=4 2014 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [2,0,0,0,0,0|2,0,0]=4 2015 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [2,0,0,0,0,0|2,0,0]=4 2016 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [2,0,0,0,0,0|2,0,0]=4 2017 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [2,0,0,0,0,0|2,0,0]=4 2018 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100011516019_200000210301 [2,0,0,0,0,0|2,0,0]=4 2019 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100012186310_200000210301 [2,0,0,0,0,0|2,0,0]=4 2020 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100011516019_200000210301 [2,0,0,0,0,0|2,0,0]=4 2021 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100012186310_200000210301 [2,0,0,0,0,0|2,0,0]=4 2022 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012001760_200000210301 [2,0,0,0,0,0|2,0,0]=4 2023 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012178750_200000210301 [2,0,0,0,0,0|2,0,0]=4 2024 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012001760_200000210301 [2,0,0,0,0,0|2,0,0]=4 2025 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012178750_200000210301 [2,0,0,0,0,0|2,0,0]=4 2026 B11R1.280 COc1ccc(c(c1)OC)I 34a_100010168831_200000210301 [2,0,0,0,0,0|2,0,0]=4 2027 B11R1.280 COc1ccc(c(c1)OC)I 7a_100010168831_200000210301 [2,0,0,0,0,0|2,0,0]=4 2028 B11R1.280 COc1ccc(c(c1)OC)N 34a_100015326901_200000210301 [2,0,0,0,0,0|2,0,0]=4 2029 B11R1.280 COc1ccc(c(c1)OC)N 34a_100016989039_200000210301 [2,0,0,0,0,0|2,0,0]=4 2030 B11R1.280 COc1ccc(c(c1)OC)N 7a_100015326901_200000210301 [2,0,0,0,0,0|2,0,0]=4 2031 B11R1.280 COc1ccc(c(c1)OC)N 7a_100016989039_200000210301 [2,0,0,0,0,0|2,0,0]=4 2032 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [2,0,0,0,0,0|1,0,0]=3 2033 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 34a_100000719091_200025704644 [2,0,0,0,0,0|2,0,0]=4 2034 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 7a_100000719091_200025704644 [2,0,0,0,0,0|2,0,0]=4 2035 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [2,0,0,0,0,0|2,0,0]=4 2036 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [2,0,0,0,0,0|2,0,0]=4 2037 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 34a_100011516019_200025704644 [2,0,0,0,0,0|2,0,0]=4 2038 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 7a_100011516019_200025704644 [2,0,0,0,0,0|2,0,0]=4 2039 B11R1.280 COc1ccc(c(c1)O[13CH3])F 34a_100012178750_200025704644 [2,0,0,0,0,0|2,0,0]=4 2040 B11R1.280 COc1ccc(c(c1)O[13CH3])F 7a_100012178750_200025704644 [2,0,0,0,0,0|2,0,0]=4 2041 B11R1.280 COc1ccc(c(c1)O[13CH3])I 34a_100010168831_200025704644 [2,0,0,0,0,0|2,0,0]=4 2042 B11R1.280 COc1ccc(c(c1)O[13CH3])I 7a_100010168831_200025704644 [2,0,0,0,0,0|2,0,0]=4 2043 B11R1.280 COc1ccc(c(c1)O[13CH3])N 34a_100016989039_200025704644 [2,0,0,0,0,0|2,0,0]=4 2044 B11R1.280 COc1ccc(c(c1)O[13CH3])N 7a_100016989039_200025704644 [2,0,0,0,0,0|2,0,0]=4 2045 B11R1.280 COc1ccc(c(c1)SC)O 62a_200000210301_100000685887 [2,0,0,0,0,0|1,1,0]=4 2046 B11R1.280 COc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000685887 [2,0,0,0,0,0|1,1,0]=4 2047 B11R1.280 COc1ccc(c(n1)OC)O 271570a_203496583355_100009816055 [2,0,0,0,0,0|2,0,0]=4 2048 B11R1.280 COc1nc(ccc1O)SC 62a_200000210301_100010893133 [2,0,0,0,0,0|2,0,0]=4 2049 B11R1.280 COc1nc(ccc1O)S[13CH3] 62a_200025704644_100010893133 [2,0,0,0,0,0|2,0,0]=4 2050 B11R1.280 CSc1cc(ccc1F)CN 62a_100015193890_200000210301 [2,0,0,0,0,0|1,1,0]=4 2051 B11R1.280 CSc1cc(ccc1F)CN 62a_200000210301_100015193890 [2,0,0,0,0,0|1,1,0]=4 2052 B11R1.280 CSc1cc(ccc1O)CO 62a_100011191544_200000210301 [2,0,0,0,0,0|1,1,0]=4 2053 B11R1.280 CSc1cc(ccc1O)CO 62a_200000210301_100011191544 [2,0,0,0,0,0|1,1,0]=4 2054 B11R1.280 N#Cc1cc(ccc1O)CN 271570a_203496583355_100009846983 [2,0,0,0,0,0|2,0,0]=4 2055 B11R1.280 [13CH3]Nc1cc(ccc1O)CO 34a_100000123545_200025704644 [2,0,0,0,0,0|2,0,0]=4 2056 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 34a_100010191536_200025704644 [2,0,0,0,0,0|2,0,0]=4 2057 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 7a_100010191536_200025704644 [2,0,0,0,0,0|2,0,0]=4 2058 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CN 34a_100020636435_200025704644 [2,0,0,0,0,0|1,0,0]=3 2059 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 34a_100009876509_200025704644 [2,0,0,0,0,0|2,0,0]=4 2060 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 7a_100009876509_200025704644 [2,0,0,0,0,0|2,0,0]=4 2061 B11R1.280 [13CH3]Oc1cc(ccc1F)CN 34a_100160469508_200025704644 [2,0,0,0,0,0|1,0,0]=3 2062 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 34a_100009842347_200025704644 [2,0,0,0,0,0|2,0,0]=4 2063 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 7a_100009842347_200025704644 [2,0,0,0,0,0|2,0,0]=4 2064 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 34a_100000049605_200025704644 [2,0,0,0,0,0|2,0,0]=4 2065 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 7a_100000049605_200025704644 [2,0,0,0,0,0|2,0,0]=4 2066 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_100015193890_200025704644 [2,0,0,0,0,0|1,1,0]=4 2067 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_200025704644_100015193890 [2,0,0,0,0,0|1,1,0]=4 2068 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_100011191544_200025704644 [2,0,0,0,0,0|1,1,0]=4 2069 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_200025704644_100011191544 [2,0,0,0,0,0|1,1,0]=4 2070 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [1,1,0,0,0,0|1,0,1]=4 2071 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [1,1,0,0,0,0|1,0,1]=4 2072 B13R1.35 CC(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100000210206 [1,1,0,0,0,0|2,0,0]=4 2073 B13R1.35 CC(C)Sc1ccc(c(c1)O)CO 62a_100000210206_100000071718 [1,1,0,0,0,0|2,0,0]=4 2074 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [1,1,0,0,0,0|1,0,1]=4 2075 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [1,1,0,0,0,0|1,0,1]=4 2076 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [1,1,0,0,0,0|1,0,1]=4 2077 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [1,1,0,0,0,0|1,0,1]=4 2078 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [1,1,0,0,0,0|1,0,1]=4 2079 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100000241087_200000210301 [1,1,0,0,0,0|2,0,0]=4 2080 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100102631434_200011290836 [1,1,0,0,0,0|2,0,0]=4 2081 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100000241087_200000210301 [1,1,0,0,0,0|2,0,0]=4 2082 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100102631434_200011290836 [1,1,0,0,0,0|2,0,0]=4 2083 B13R1.35 COc1ccc(cc1C)CN(C)C 270004a_100102631434_100000239718 [1,1,0,0,0,0|2,0,0]=4 2084 B13R1.35 COc1ccc(cc1C)CN(C)C 34a_100000241087_200000210301 [1,1,0,0,0,0|2,0,0]=4 2085 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 2230a_100000241087_200025704644 [1,1,0,0,0,0|2,0,0]=4 2086 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 269982a_100000241087_200025704644 [1,1,0,0,0,0|2,0,0]=4 2087 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 34a_100000241087_200025704644 [1,1,0,0,0,0|2,0,0]=4 2088 B13R1.35 COc1ccc(cc1C)NC(C)C 2230a_100000743268_100000210206 [1,1,0,0,0,0|2,0,0]=4 2089 B13R1.35 COc1ccc(cc1C)NC(C)C 34a_100000743268_100000210206 [1,1,0,0,0,0|2,0,0]=4 2090 B13R1.35 COc1ccc(cc1C)NC(C)C 7a_100000743268_100000210206 [1,1,0,0,0,0|2,0,0]=4 2091 B13R1.35 COc1ccc(cc1C)OC(C)C 34a_100000759738_100000210206 [1,1,0,0,0,0|2,0,0]=4 2092 B13R1.35 COc1ccc(cc1C)OC(C)C 7a_100000759738_100000210206 [1,1,0,0,0,0|2,0,0]=4 2093 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100000210206_100011219705 [1,1,0,0,0,0|2,0,0]=4 2094 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100011219705_100000210206 [1,1,0,0,0,0|2,0,0]=4 2095 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [1,1,0,0,0,0|1,0,1]=4 2096 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [1,1,0,0,0,0|1,0,1]=4 2097 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [1,1,0,0,0,0|1,0,1]=4 2098 B13R1.35 COc1ccc(cc1O)CN(C)C 2230a_100000188468_200000210301 [1,1,0,0,0,0|2,0,0]=4 2099 B13R1.35 COc1ccc(cc1O)CN(C)C 269982a_100000188468_200000210301 [1,1,0,0,0,0|2,0,0]=4 2100 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 2230a_100000188468_200025704644 [1,1,0,0,0,0|2,0,0]=4 2101 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 269982a_100000188468_200025704644 [1,1,0,0,0,0|2,0,0]=4 2102 B13R1.35 COc1ccc(cc1O)NC(C)C 34a_100000211920_100000210206 [1,1,0,0,0,0|2,0,0]=4 2103 B13R1.35 COc1ccc(cc1O)SC(C)C 62a_100000210206_100009816560 [1,1,0,0,0,0|2,0,0]=4 2104 B13R1.35 Cc1cc(ccc1CO)NC(C)C 34a_100000102464_100000210206 [1,1,0,0,0,0|2,0,0]=4 2105 B13R1.35 Cc1cc(ccc1CO)SC(C)C 62a_100000210206_100000748258 [1,1,0,0,0,0|2,0,0]=4 2106 B13R1.35 Cc1cc(ccc1CO)SC(C)C 62a_100000748258_100000210206 [1,1,0,0,0,0|2,0,0]=4 2107 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [1,1,0,0,0,0|1,0,1]=4 2108 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [1,1,0,0,0,0|1,0,1]=4 2109 B13R1.510 Cc1cc(ccc1O)C(=O)C(C)C 1458a_100000685612_100000210206 [1,1,0,0,0,0|1,0,1]=4 2110 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [1,1,0,0,0,0|1,0,1]=4 2111 B13R1.518 CC(C)(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210625 [1,1,0,0,0,0|2,0,0]=4 2112 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)O 62a_100000211941_100009813601 [1,1,0,0,0,0|2,0,0]=4 2113 B13R1.518 Cc1cc(ccc1O)NC(C)(C)C 34a_100011218179_100000210625 [1,1,0,0,0,0|2,0,0]=4 2114 B13R1.518 Cc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100000186361 [1,1,0,0,0,0|2,0,0]=4 2115 B13R1.876 Cc1cc(c(cc1O)C)NC(C)C 34a_100000720036_100000210206 [1,1,0,0,0,0|2,0,0]=4 2116 B13R1.876 Cc1cc(c(cc1O)C)NC(C)C 7a_100000720036_100000210206 [1,1,0,0,0,0|2,0,0]=4 2117 B13R1.876 Cc1cc(c(cc1O)C)SC(C)C 62a_100000210206_100000698207 [1,1,0,0,0,0|2,0,0]=4 2118 B13R1.876 Cc1cc(c(cc1O)C)SC(C)C 62a_100000698207_100000210206 [1,1,0,0,0,0|2,0,0]=4 2119 B13R1.2879 C#CC(C)Nc1ccc(c(c1)C)O 34a_100011218179_200000035995 [1,1,0,0,0,0|2,0,0]=4 2120 B13R1.2879 C#CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_200000035995 [1,1,0,0,0,0|2,0,0]=4 2121 B13R1.2879 C#CC(C)Sc1ccc(c(c1)C)O 62a_200000035995_100000186361 [1,1,0,0,0,0|2,0,0]=4 2122 B13R1.2879 C#CC(C)Sc1ccc(c(c1)O)O 62a_200000035995_100009813601 [1,1,0,0,0,0|2,0,0]=4 2123 B13R1.2879 C=CC(C)Sc1ccc(c(c1)C)O 62a_100011215867_100000186361 [1,1,0,0,0,0|2,0,0]=4 2124 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [1,1,0,0,0,0|2,0,0]=4 2125 B13R1.2879 CC(C#N)Sc1ccc(c(c1)O)O 62a_100000703298_100009813601 [1,1,0,0,0,0|1,0,1]=4 2126 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [1,1,0,0,0,0|2,0,0]=4 2127 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [1,1,0,0,0,0|2,0,0]=4 2128 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [1,1,0,0,0,0|1,0,1]=4 2129 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [1,1,0,0,0,0|1,0,1]=4 2130 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100011215416 [1,1,0,0,0,0|2,0,0]=4 2131 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000758301 [1,1,0,0,0,0|2,0,0]=4 2132 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011215416 [1,1,0,0,0,0|2,0,0]=4 2133 B13R1.2879 CCC(C)Sc1ccc(c(c1)C)O 62a_100000758301_100000186361 [1,1,0,0,0,0|2,0,0]=4 2134 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)O 62a_100000758301_100009813601 [1,1,0,0,0,0|2,0,0]=4 2135 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [1,1,0,0,0,0|1,0,1]=4 2136 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [1,1,0,0,0,0|1,0,1]=4 2137 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [1,1,0,0,0,0|1,0,1]=4 2138 B13R1.2879 CNC(C)Cc1ccc(c(c1)Cl)Cl 270004a_106832991635_100011586667 [1,1,0,0,0,0|2,0,0]=4 2139 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [1,1,0,0,0,0|1,0,1]=4 2140 B13R1.2879 COC(C)Sc1ccc(c(c1)C)O 62a_100009879195_100000186361 [1,1,0,0,0,0|2,0,0]=4 2141 B13R1.2879 COC(C)Sc1ccc(c(c1)O)O 62a_100009879195_100009813601 [1,1,0,0,0,0|2,0,0]=4 2142 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [1,1,0,0,0,0|2,0,0]=4 2143 B13R1.2879 Cc1cc(ccc1O)CC(=O)CF 1458a_100000083968_100015361967 [1,1,0,0,0,0|1,0,1]=4 2144 B13R1.2879 Cc1cc(ccc1O)NC(C)C#N 7a_100011218179_100000703298 [1,1,0,0,0,0|1,0,1]=4 2145 B13R1.2879 Cc1cc(ccc1O)NC(C)CO 34a_100011218179_100012180447 [1,1,0,0,0,0|2,0,0]=4 2146 B13R1.2879 Cc1cc(ccc1O)NC(C)CO 7a_100011218179_100012180447 [1,1,0,0,0,0|2,0,0]=4 2147 B13R1.2879 Cc1cc(ccc1O)SC(C)C#N 62a_100000703298_100000186361 [1,1,0,0,0,0|1,0,1]=4 2148 B13R1.2879 Cc1cc(ccc1O)SC(C)CO 62a_100012180447_100000186361 [1,1,0,0,0,0|2,0,0]=4 2149 B13R1.2879 Cc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000186361 [1,1,0,0,0,0|2,0,0]=4 2150 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [1,1,0,0,0,0|1,0,1]=4 2151 B13R1.3528 CC(C)Oc1ccc(c(c1F)O)O 271570a_203496583355_202127810487 [1,1,0,0,0,0|2,0,0]=4 2152 B13R1.3528 Cc1c(ccc(c1C)NC(C)C)O 34a_200011216674_100000210206 [1,1,0,0,0,0|2,0,0]=4 2153 B13R1.3528 Cc1c(ccc(c1C)NC(C)C)O 7a_200011216674_100000210206 [1,1,0,0,0,0|2,0,0]=4 2154 B13R1.3528 Cc1c(ccc(c1C)SC(C)C)O 62a_100000210206_100012353674 [1,1,0,0,0,0|2,0,0]=4 2155 B13R1.3528 Cc1c(ccc(c1C)SC(C)C)O 62a_100012353674_100000210206 [1,1,0,0,0,0|2,0,0]=4 2156 B13R1.3528 Cc1c(ccc(c1F)NC(C)C)O 34a_200000126710_100000210206 [1,1,0,0,0,0|2,0,0]=4 2157 B13R1.3528 Cc1c(ccc(c1F)NC(C)C)O 7a_200000126710_100000210206 [1,1,0,0,0,0|2,0,0]=4 2158 B13R1.3528 Cc1c(ccc(c1F)SC(C)C)O 62a_100000210206_100010390934 [1,1,0,0,0,0|2,0,0]=4 2159 B13R1.3528 Cc1c(ccc(c1F)SC(C)C)O 62a_100010390934_100000210206 [1,1,0,0,0,0|2,0,0]=4 2160 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)O)C 1458a_200000099080_200000210301 [1,1,0,0,0,0|1,0,1]=4 2161 B13R1.3763 CC(C)Sc1cc(c(c(c1)F)O)O 62a_100000210206_100010114375 [1,1,0,0,0,0|2,0,0]=4 2162 B13R1.3763 CC(C)Sc1cc(c(c(c1)O)O)O 62a_100000210206_100010658518 [1,1,0,0,0,0|2,0,0]=4 2163 B13R1.3763 Cc1cc(cc(c1O)Br)NC(C)C 34a_100010064301_100000210206 [1,1,0,0,0,0|2,0,0]=4 2164 B13R1.3763 Cc1cc(cc(c1O)Br)NC(C)C 7a_100010064301_100000210206 [1,1,0,0,0,0|2,0,0]=4 2165 B13R1.3763 Cc1cc(cc(c1O)Br)SC(C)C 62a_100000210206_100010982682 [1,1,0,0,0,0|2,0,0]=4 2166 B13R1.3763 Cc1cc(cc(c1O)Br)SC(C)C 62a_100010982682_100000210206 [1,1,0,0,0,0|2,0,0]=4 2167 B13R1.3763 Cc1cc(cc(c1O)C)CC(=O)[13CH3] 1458a_200000099080_200025704644 [1,1,0,0,0,0|1,0,1]=4 2168 B13R1.3763 Cc1cc(cc(c1O)C)NC(C)C 34a_100000703291_100000210206 [1,1,0,0,0,0|2,0,0]=4 2169 B13R1.3763 Cc1cc(cc(c1O)C)NC(C)C 7a_100000703291_100000210206 [1,1,0,0,0,0|2,0,0]=4 2170 B13R1.3763 Cc1cc(cc(c1O)C)SC(C)C 62a_100000210206_100011216129 [1,1,0,0,0,0|2,0,0]=4 2171 B13R1.3763 Cc1cc(cc(c1O)C)SC(C)C 62a_100011216129_100000210206 [1,1,0,0,0,0|2,0,0]=4 2172 B13R1.3763 Cc1cc(cc(c1O)Cl)SC(C)C 62a_100000210206_200015900153 [1,1,0,0,0,0|2,0,0]=4 2173 B13R1.3763 Cc1cc(cc(c1O)Cl)SC(C)C 62a_200015900153_100000210206 [1,1,0,0,0,0|2,0,0]=4 2174 B13R1.3763 Cc1cc(cc(c1O)N)SC(C)C 62a_100000210206_100011825904 [1,1,0,0,0,0|2,0,0]=4 2175 B13R1.3763 Cc1cc(cc(c1O)N)SC(C)C 62a_100011825904_100000210206 [1,1,0,0,0,0|2,0,0]=4 2176 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [1,1,0,0,0,0|1,0,1]=4 2177 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [1,1,0,0,0,0|1,0,1]=4 2178 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [1,1,0,0,0,0|1,0,1]=4 2179 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [1,1,0,0,0,0|1,0,1]=4 2180 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [1,1,0,0,0,0|1,0,1]=4 2181 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [1,1,0,0,0,0|0,0,1]=3 2182 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000210202 [1,1,0,0,0,0|2,0,0]=4 2183 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000204670 [1,1,0,0,0,0|2,0,0]=4 2184 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000210202 [1,1,0,0,0,0|2,0,0]=4 2185 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000204670 [1,1,0,0,0,0|2,0,0]=4 2186 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [1,1,0,0,0,0|1,0,1]=4 2187 B13R1.49 CNC(C)c1ccc(c(c1)OC)Br 269862a_106832991636_100010110075 [1,1,0,0,0,0|2,0,0]=4 2188 B13R1.49 CNC(C)c1ccc(c(c1)OC)C 269862a_106832991636_100012706825 [1,1,0,0,0,0|2,0,0]=4 2189 B13R1.49 CNC(C)c1ccc(c(c1)OC)Cl 269862a_106832991636_100012002813 [1,1,0,0,0,0|2,0,0]=4 2190 B13R1.49 CNC(C)c1ccc(c(c1)OC)F 269862a_106832991636_100000694624 [1,1,0,0,0,0|2,0,0]=4 2191 B13R1.49 CN[C@@H](C)c1ccc(c(c1)OC)F 2230a_100025717271_200000210301 [1,1,0,0,0,0|2,0,0]=4 2192 B13R1.49 CN[C@@H](C)c1ccc(c(c1)OC)F 34a_100025717271_200000210301 [1,1,0,0,0,0|2,0,0]=4 2193 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [1,1,0,0,0,0|1,0,1]=4 2194 B13R1.49 COc1cc(ccc1F)[C@H](C)N[13CH3] 2230a_100025717271_200025704644 [1,1,0,0,0,0|2,0,0]=4 2195 B13R1.49 COc1cc(ccc1F)[C@H](C)N[13CH3] 34a_100025717271_200025704644 [1,1,0,0,0,0|2,0,0]=4 2196 B13R1.49 COc1cc(ccc1O)C(=O)CF 1458a_100000687070_100015361967 [1,1,0,0,0,0|1,0,1]=4 2197 B13R1.384 CCNc1ccc(c(c1)OCC)Br 2230a_200016990551_100000210202 [1,1,0,0,0,0|2,0,0]=4 2198 B13R1.384 CCNc1ccc(c(c1)OCC)Br 34a_200016990551_100000210202 [1,1,0,0,0,0|2,0,0]=4 2199 B13R1.384 CCNc1ccc(c(c1)OCC)Br 7a_200016990551_100000210202 [1,1,0,0,0,0|2,0,0]=4 2200 B13R1.384 CCNc1ccc(c(c1)OCC)Cl 2230a_100011964961_100000210202 [1,1,0,0,0,0|2,0,0]=4 2201 B13R1.384 CCNc1ccc(c(c1)OCC)Cl 34a_100011964961_100000210202 [1,1,0,0,0,0|2,0,0]=4 2202 B13R1.384 CCOc1cc(ccc1Br)CNC 207a_100102657272_200010381951 [1,1,0,0,0,0|2,0,0]=4 2203 B13R1.384 CCOc1cc(ccc1Br)CNC 270004a_106832991635_200010381951 [1,1,0,0,0,0|2,0,0]=4 2204 B13R1.384 CCOc1cc(ccc1C)SCC 62a_100000210202_100012361169 [1,1,0,0,0,0|2,0,0]=4 2205 B13R1.384 CCOc1cc(ccc1C)SCC 62a_100012361169_100000210202 [1,1,0,0,0,0|2,0,0]=4 2206 B13R1.384 CCOc1cc(ccc1F)CNC 207a_100102657272_200000106648 [1,1,0,0,0,0|2,0,0]=4 2207 B13R1.384 CCOc1cc(ccc1F)CNC 270004a_106832991635_200000106648 [1,1,0,0,0,0|2,0,0]=4 2208 B13R1.384 CCOc1cc(ccc1F)SCC 62a_100000210202_200012344967 [1,1,0,0,0,0|2,0,0]=4 2209 B13R1.384 CCOc1cc(ccc1F)SCC 62a_200012344967_100000210202 [1,1,0,0,0,0|2,0,0]=4 2210 B13R1.384 CCOc1cc(ccc1N)SCC 62a_100000688918_100000210202 [1,1,0,0,0,0|2,0,0]=4 2211 B13R1.384 CCOc1cc(ccc1O)CNC 34a_200000751567_200000210301 [1,1,0,0,0,0|1,0,0]=3 2212 B13R1.384 CCOc1cc(ccc1O)CN[13CH3] 34a_200000751567_200025704644 [1,1,0,0,0,0|1,0,0]=3 2213 B13R1.384 CCOc1ccc(c(n1)OCC)O 271570a_203496583355_200010081131 [1,1,0,0,0,0|2,0,0]=4 2214 B13R1.384 CCSc1ccc(c(c1)CNC)O 62a_100000210202_100011602694 [1,1,0,0,0,0|2,0,0]=4 2215 B13R1.384 CCSc1ccc(c(c1)CNC)O 62a_100011602694_100000210202 [1,1,0,0,0,0|2,0,0]=4 2216 B13R1.384 CCSc1ccc(c(c1)COC)Br 62a_100000210202_202125822959 [1,1,0,0,0,0|2,0,0]=4 2217 B13R1.384 CCSc1ccc(c(c1)COC)Br 62a_202125822959_100000210202 [1,1,0,0,0,0|2,0,0]=4 2218 B13R1.384 CCSc1ccc(c(c1)COC)F 62a_100000210202_100010140362 [1,1,0,0,0,0|2,0,0]=4 2219 B13R1.384 CCSc1ccc(c(c1)COC)F 62a_100010140362_100000210202 [1,1,0,0,0,0|2,0,0]=4 2220 B13R1.386 C=CCc1ccc(c(c1)OC)OC 34a_100000181329_200000210301 [1,1,0,0,0,0|0,0,2]=4 2221 B13R1.386 C=CCc1ccc(c(c1)OC)O[13CH3] 34a_100000181329_200025704644 [1,1,0,0,0,0|0,0,2]=4 2222 B13R1.386 C=Cc1cc(ccc1OC)CCN 271570a_100011290941_103549771065 [1,1,0,0,0,0|1,0,1]=4 2223 B13R1.386 CC=Cc1ccc(c(c1)OC)CO 271570a_100016259895_100011277633 [1,1,0,0,0,0|0,0,2]=4 2224 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 271570a_100016259895_100000187503 [1,1,0,0,0,0|0,0,2]=4 2225 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 34a_100015195088_200000210301 [1,1,0,0,0,0|0,0,2]=4 2226 B13R1.386 CC=Cc1ccc(c(c1)OC)O[13CH3] 34a_100015195088_200025704644 [1,1,0,0,0,0|0,0,2]=4 2227 B13R1.386 CCCc1ccc(c(c1)OC)OC 34a_100000012292_200000210301 [1,1,0,0,0,0|0,0,0]=2 2228 B13R1.386 CCCc1ccc(c(c1)OC)OC 7a_100000012292_200000210301 [1,1,0,0,0,0|0,0,0]=2 2229 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 34a_100000012292_200025704644 [1,1,0,0,0,0|0,0,0]=2 2230 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 7a_100000012292_200025704644 [1,1,0,0,0,0|0,0,0]=2 2231 B13R1.386 CCNc1ccc(c(c1)OC)C#N 34a_100011999456_100000210202 [1,1,0,0,0,0|2,0,0]=4 2232 B13R1.386 CCNc1ccc(c(c1)OC)CO 34a_100012183141_100000210202 [1,1,0,0,0,0|1,0,0]=3 2233 B13R1.386 CCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210202 [1,1,0,0,0,0|1,0,0]=3 2234 B13R1.386 CCOc1ccc(c(c1)OC)CO 34a_200000116926_100000210202 [1,1,0,0,0,0|1,0,0]=3 2235 B13R1.386 CCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210202 [1,1,0,0,0,0|1,0,0]=3 2236 B13R1.386 CCSc1cc(c(cn1)CO)OC 62a_100000210202_100010714672 [1,1,0,0,0,0|2,0,0]=4 2237 B13R1.386 CCSc1cc(c(cn1)CO)OC 62a_100010714672_100000210202 [1,1,0,0,0,0|2,0,0]=4 2238 B13R1.386 CCSc1ccc(c(c1)CC)OC 62a_100000210202_200010179862 [1,1,0,0,0,0|2,0,0]=4 2239 B13R1.386 CCSc1ccc(c(c1)CC)OC 62a_200010179862_100000210202 [1,1,0,0,0,0|2,0,0]=4 2240 B13R1.386 CCSc1ccc(c(c1)OC)C#N 62a_100000210202_100000694671 [1,1,0,0,0,0|2,0,0]=4 2241 B13R1.386 CCSc1ccc(c(c1)OC)C=O 62a_100000210202_100010290300 [1,1,0,0,0,0|1,0,1]=4 2242 B13R1.386 CCSc1ccc(c(c1)OC)C=O 62a_100000697075_100000210202 [1,1,0,0,0,0|1,0,1]=4 2243 B13R1.386 CCSc1ccc(c(c1)OC)CC 62a_100000210202_200010710398 [1,1,0,0,0,0|2,0,0]=4 2244 B13R1.386 CCSc1ccc(c(c1)OC)CC 62a_200010710398_100000210202 [1,1,0,0,0,0|2,0,0]=4 2245 B13R1.386 CCSc1ccc(c(c1)OC)CO 62a_100000210202_100011277633 [1,1,0,0,0,0|1,0,0]=3 2246 B13R1.386 CCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210202 [1,1,0,0,0,0|1,0,0]=3 2247 B13R1.386 CCSc1ccc(c(c1)OC)OC 62a_100000210202_100011356967 [1,1,0,0,0,0|1,0,0]=3 2248 B13R1.386 CCSc1ccc(c(c1)OC)SC 62a_200011001119_100000210202 [1,1,0,0,0,0|1,1,0]=4 2249 B13R1.386 CCSc1ccc(c(c1)SC)OC 62a_200009892704_100000210202 [1,1,0,0,0,0|1,1,0]=4 2250 B13R1.386 CCSc1ccc(c(n1)OC)CO 62a_100000210202_100010988397 [1,1,0,0,0,0|2,0,0]=4 2251 B13R1.386 CCSc1ccc(c(n1)OC)CO 62a_100010988397_100000210202 [1,1,0,0,0,0|2,0,0]=4 2252 B13R1.386 CCSc1ccc(c(n1)OC)OC 62a_100000210202_100010214848 [1,1,0,0,0,0|2,0,0]=4 2253 B13R1.386 CCSc1cnc(c(c1)OC)CO 62a_100000210202_200010246159 [1,1,0,0,0,0|2,0,0]=4 2254 B13R1.386 CCSc1cnc(c(c1)OC)CO 62a_200010246159_100000210202 [1,1,0,0,0,0|2,0,0]=4 2255 B13R1.386 CCSc1cnc(c(c1)OC)OC 62a_100000210202_100010234541 [1,1,0,0,0,0|2,0,0]=4 2256 B13R1.386 CNCc1ccc(c(c1)OC)C#N 207a_100102657272_100000726430 [1,1,0,0,0,0|2,0,0]=4 2257 B13R1.386 CNCc1ccc(c(c1)OC)C#N 270004a_106832991635_100000726430 [1,1,0,0,0,0|2,0,0]=4 2258 B13R1.386 CNCc1ccc(c(c1)OC)OC 207a_100102657272_100000170513 [1,1,0,0,0,0|1,0,0]=3 2259 B13R1.386 CNCc1ccc(c(c1)OC)OC 2230a_106832991635_100011233839 [1,1,0,0,0,0|1,0,0]=3 2260 B13R1.386 CNCc1ccc(c(c1)OC)OC 270004a_106832991635_100000170513 [1,1,0,0,0,0|1,0,0]=3 2261 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000185555_200000210301 [1,1,0,0,0,0|1,0,0]=3 2262 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000188468_200000210301 [1,1,0,0,0,0|1,0,0]=3 2263 B13R1.386 CNCc1ccc(c(c1)OC)SC 207a_100102657272_100000050949 [1,1,0,0,0,0|1,1,0]=4 2264 B13R1.386 CNCc1ccc(c(c1)OC)SC 270004a_106832991635_100000050949 [1,1,0,0,0,0|1,1,0]=4 2265 B13R1.386 CNCc1ccc(c(c1)O[13CH3])OC 34a_100000188468_200025704644 [1,1,0,0,0,0|1,0,0]=3 2266 B13R1.386 CNCc1cnc(c(c1)OC)OC 207a_100102657272_100000117638 [1,1,0,0,0,0|2,0,0]=4 2267 B13R1.386 CNCc1cnc(c(c1)OC)OC 270004a_106832991635_100000117638 [1,1,0,0,0,0|2,0,0]=4 2268 B13R1.386 COCc1ccc(c(c1)OC)OC 34a_100000210929_200000210301 [1,1,0,0,0,0|1,0,0]=3 2269 B13R1.386 COc1cc(ccc1CO)NCF 34a_100012183141_100015361967 [1,1,0,0,0,0|2,0,0]=4 2270 B13R1.386 COc1cc(ccc1CO)OCF 34a_200000116926_100015361967 [1,1,0,0,0,0|2,0,0]=4 2271 B13R1.386 COc1cc(ccc1CO)SCF 62a_100011277633_100015361967 [1,1,0,0,0,0|2,0,0]=4 2272 B13R1.386 COc1cc(ccc1CO)SCF 62a_100015361967_100011277633 [1,1,0,0,0,0|2,0,0]=4 2273 B13R1.386 COc1cc(ccc1O[13CH3])CC#N 34a_100000032377_200025704644 [1,1,0,0,0,0|0,0,2]=4 2274 B13R1.386 COc1cc(ccc1O[13CH3])CCBr 34a_100010741665_200025704644 [1,1,0,0,0,0|1,0,0]=3 2275 B13R1.386 COc1cc(ccc1O[13CH3])CCBr 7a_100010741665_200025704644 [1,1,0,0,0,0|1,0,0]=3 2276 B13R1.386 COc1cc(ccc1O[13CH3])CCN 34a_100000756042_200025704644 [1,1,0,0,0,0|0,0,0]=2 2277 B13R1.386 COc1cc(ccc1O[13CH3])CCO 34a_100011215244_200025704644 [1,1,0,0,0,0|1,0,0]=3 2278 B13R1.386 COc1ccc(cc1OC)CC#N 34a_100000032377_200000210301 [1,1,0,0,0,0|0,0,2]=4 2279 B13R1.386 COc1ccc(cc1OC)CCBr 34a_100010741665_200000210301 [1,1,0,0,0,0|1,0,0]=3 2280 B13R1.386 COc1ccc(cc1OC)CCBr 7a_100010741665_200000210301 [1,1,0,0,0,0|1,0,0]=3 2281 B13R1.386 COc1ccc(cc1OC)CCN 34a_100000756042_200000210301 [1,1,0,0,0,0|0,0,0]=2 2282 B13R1.386 COc1ccc(cc1OC)CCN 34a_100011207234_200000210301 [1,1,0,0,0,0|0,0,0]=2 2283 B13R1.386 COc1ccc(cc1OC)CCO 34a_100011215244_200000210301 [1,1,0,0,0,0|1,0,0]=3 2284 B13R1.386 COc1ccc(cc1OC)CN[13CH3] 34a_100000185555_200025704644 [1,1,0,0,0,0|1,0,0]=3 2285 B13R1.386 COc1ccc(cc1OC)CO[13CH3] 34a_100000210929_200025704644 [1,1,0,0,0,0|1,0,0]=3 2286 B13R1.386 COc1ccc(cc1OC)CSC 62a_200000210301_100011233839 [1,1,0,0,0,0|1,0,0]=3 2287 B13R1.386 COc1ccc(cc1OC)CS[13CH3] 62a_200025704644_100011233839 [1,1,0,0,0,0|1,0,0]=3 2288 B13R1.386 COc1ccc(cc1OC)NCF 34a_100000187404_100015361967 [1,1,0,0,0,0|2,0,0]=4 2289 B13R1.386 COc1ccc(cc1OC)OCF 34a_100000039706_100015361967 [1,1,0,0,0,0|2,0,0]=4 2290 B13R1.386 COc1ccc(cc1OC)SCF 62a_100015361967_100011356967 [1,1,0,0,0,0|2,0,0]=4 2291 B13R1.386 COc1ccc(cc1O[13CH3])CCN 34a_100011207234_200025704644 [1,1,0,0,0,0|0,0,0]=2 2292 B13R1.386 COc1ccc(cc1SC)CCN 62a_103549771065_200000210301 [1,1,0,0,0,0|0,1,0]=3 2293 B13R1.386 COc1ccc(cc1SC)CCN 62a_200000210301_103549771065 [1,1,0,0,0,0|0,1,0]=3 2294 B13R1.386 COc1ccc(cc1SC)CCO 62a_100011962876_200000210301 [1,1,0,0,0,0|1,1,0]=4 2295 B13R1.386 COc1ccc(cc1SC)CCO 62a_200000210301_100011962876 [1,1,0,0,0,0|1,1,0]=4 2296 B13R1.386 COc1ccc(cc1S[13CH3])CCN 62a_103549771065_200025704644 [1,1,0,0,0,0|0,1,0]=3 2297 B13R1.386 COc1ccc(cc1S[13CH3])CCN 62a_200025704644_103549771065 [1,1,0,0,0,0|0,1,0]=3 2298 B13R1.386 COc1ccc(cc1S[13CH3])CCO 62a_100011962876_200025704644 [1,1,0,0,0,0|1,1,0]=4 2299 B13R1.386 COc1ccc(cc1S[13CH3])CCO 62a_200025704644_100011962876 [1,1,0,0,0,0|1,1,0]=4 2300 B13R1.387 CCOc1ccc(c(c1)C(=O)C)O 1458a_200011255221_200000210301 [1,1,0,0,0,0|2,0,0]=4 2301 B13R1.387 CCOc1ccc(c(c1)C(=O)[13CH3])O 1458a_200011255221_200025704644 [1,1,0,0,0,0|2,0,0]=4 2302 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000210202_100000691460 [1,1,0,0,0,0|2,0,0]=4 2303 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210202 [1,1,0,0,0,0|2,0,0]=4 2304 B13R1.575 C#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000184674 [1,1,0,0,0,0|0,0,2]=4 2305 B13R1.575 C#CCSc1ccc(c(c1)OC)O 62a_100000038162_100000694246 [1,1,0,0,0,0|0,0,2]=4 2306 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [1,1,0,0,0,0|0,0,2]=4 2307 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [1,1,0,0,0,0|0,0,2]=4 2308 B13R1.575 CCCCc1c[nH]c(=O)c(c1)OC 271570a_100020621405_100010125397 [1,1,0,0,0,0|1,0,1]=4 2309 B13R1.575 CCCCc1cc(c(cn1)C)OC 271570a_100020621405_100010067687 [1,1,0,0,0,0|2,0,0]=4 2310 B13R1.575 CCCCc1cc(c(cn1)F)OC 271570a_100020621405_200010136270 [1,1,0,0,0,0|2,0,0]=4 2311 B13R1.575 CCCCc1cc(c(cn1)N)OC 271570a_100020621405_100009887741 [1,1,0,0,0,0|2,0,0]=4 2312 B13R1.575 CCCCc1ccc(c(c1)C#N)O 271570a_100020621405_100000687585 [1,1,0,0,0,0|2,0,0]=4 2313 B13R1.575 CCCCc1ccc(c(c1)C=O)O 271570a_100020621405_100000186750 [1,1,0,0,0,0|2,0,0]=4 2314 B13R1.575 CCCCc1ccc(c(c1)CC)Br 271570a_100020621405_100010244631 [1,1,0,0,0,0|2,0,0]=4 2315 B13R1.575 CCCCc1ccc(c(c1)CC)F 271570a_100020621405_100010244625 [1,1,0,0,0,0|2,0,0]=4 2316 B13R1.575 CCCCc1ccc(c(c1)CC)N 271570a_100020621405_100000686106 [1,1,0,0,0,0|2,0,0]=4 2317 B13R1.575 CCCCc1ccc(c(c1)CC)O 271570a_100020621405_100012338938 [1,1,0,0,0,0|1,0,0]=3 2318 B13R1.575 CCCCc1ccc(c(c1)CN)O 271570a_100020621405_100000730032 [1,1,0,0,0,0|2,0,0]=4 2319 B13R1.575 CCCCc1ccc(c(c1)CO)O 271570a_100020621405_100000184703 [1,1,0,0,0,0|2,0,0]=4 2320 B13R1.575 CCCCc1ccc(c(c1)NC)C 271570a_100020621405_100020629602 [1,1,0,0,0,0|2,0,0]=4 2321 B13R1.575 CCCCc1ccc(c(c1)NC)F 271570a_100020621405_100011314990 [1,1,0,0,0,0|2,0,0]=4 2322 B13R1.575 CCCCc1ccc(c(c1)NC)N 271570a_100020621405_100000694363 [1,1,0,0,0,0|2,0,0]=4 2323 B13R1.575 CCCCc1ccc(c(c1)OC)Br 271570a_100020621405_100012353699 [1,1,0,0,0,0|1,0,0]=3 2324 B13R1.575 CCCCc1ccc(c(c1)OC)C 271570a_100020621405_100011830276 [1,1,0,0,0,0|1,0,0]=3 2325 B13R1.575 CCCCc1ccc(c(c1)OC)Cl 271570a_100020621405_100011356853 [1,1,0,0,0,0|1,0,0]=3 2326 B13R1.575 CCCCc1ccc(c(c1)OC)F 271570a_100020621405_100011934186 [1,1,0,0,0,0|1,0,0]=3 2327 B13R1.575 CCCCc1ccc(c(c1)OC)N 271570a_100020621405_100011279103 [1,1,0,0,0,0|1,0,0]=3 2328 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [1,1,0,0,0,0|0,0,0]=2 2329 B13R1.575 CCCCc1ccc(c(c1)SC)F 271570a_100020621405_100010341305 [1,1,0,0,0,0|1,1,0]=4 2330 B13R1.575 CCCCc1ccc(c(n1)OC)N 271570a_100020621405_100000687816 [1,1,0,0,0,0|2,0,0]=4 2331 B13R1.575 CCCCc1ccc(c(n1)OC)O 271570a_100020621405_100010893133 [1,1,0,0,0,0|1,0,0]=3 2332 B13R1.575 CCCCc1cnc(c(c1)OC)C 271570a_100020621405_100010254219 [1,1,0,0,0,0|2,0,0]=4 2333 B13R1.575 CCCCc1cnc(c(c1)OC)F 271570a_100020621405_100010214931 [1,1,0,0,0,0|2,0,0]=4 2334 B13R1.575 CCCCc1cnc(c(c1)OC)N 271570a_100020621405_106354213024 [1,1,0,0,0,0|2,0,0]=4 2335 B13R1.575 CCCCc1cnc(c(n1)OC)O 271570a_100020621405_200010365344 [1,1,0,0,0,0|2,0,0]=4 2336 B13R1.575 CCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210303 [1,1,0,0,0,0|2,0,0]=4 2337 B13R1.575 CCCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210303 [1,1,0,0,0,0|2,0,0]=4 2338 B13R1.575 CCCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210303 [1,1,0,0,0,0|2,0,0]=4 2339 B13R1.575 CCCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210303 [1,1,0,0,0,0|2,0,0]=4 2340 B13R1.575 CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210303 [1,1,0,0,0,0|1,0,0]=3 2341 B13R1.575 CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210303 [1,1,0,0,0,0|1,0,0]=3 2342 B13R1.575 CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210303 [1,1,0,0,0,0|1,0,0]=3 2343 B13R1.575 CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210303 [1,1,0,0,0,0|1,0,0]=3 2344 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210303 [1,1,0,0,0,0|1,0,0]=3 2345 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210303 [1,1,0,0,0,0|1,0,0]=3 2346 B13R1.575 CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210303 [1,1,0,0,0,0|1,0,0]=3 2347 B13R1.575 CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210303 [1,1,0,0,0,0|1,0,0]=3 2348 B13R1.575 CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210303 [1,1,0,0,0,0|1,0,0]=3 2349 B13R1.575 CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210303 [1,1,0,0,0,0|0,0,0]=2 2350 B13R1.575 CCCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210303 [1,1,0,0,0,0|2,0,0]=4 2351 B13R1.575 CCCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210303 [1,1,0,0,0,0|2,0,0]=4 2352 B13R1.575 CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210303 [1,1,0,0,0,0|1,0,0]=3 2353 B13R1.575 CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210303 [1,1,0,0,0,0|1,0,0]=3 2354 B13R1.575 CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210303 [1,1,0,0,0,0|1,0,0]=3 2355 B13R1.575 CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210303 [1,1,0,0,0,0|1,0,0]=3 2356 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210303 [1,1,0,0,0,0|1,0,0]=3 2357 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210303 [1,1,0,0,0,0|1,0,0]=3 2358 B13R1.575 CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210303 [1,1,0,0,0,0|1,0,0]=3 2359 B13R1.575 CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210303 [1,1,0,0,0,0|1,0,0]=3 2360 B13R1.575 CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210303 [1,1,0,0,0,0|1,0,0]=3 2361 B13R1.575 CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210303 [1,1,0,0,0,0|1,0,0]=3 2362 B13R1.575 CCCSc1c[nH]c(=O)c(c1)OC 62a_100000210303_100010125397 [1,1,0,0,0,0|1,0,1]=4 2363 B13R1.575 CCCSc1cc(c(cn1)C)OC 62a_100000210303_100010067687 [1,1,0,0,0,0|2,0,0]=4 2364 B13R1.575 CCCSc1cc(c(cn1)C)OC 62a_100010067687_100000210303 [1,1,0,0,0,0|2,0,0]=4 2365 B13R1.575 CCCSc1cc(c(cn1)F)OC 62a_100000210303_200010136270 [1,1,0,0,0,0|2,0,0]=4 2366 B13R1.575 CCCSc1cc(c(cn1)F)OC 62a_200010136270_100000210303 [1,1,0,0,0,0|2,0,0]=4 2367 B13R1.575 CCCSc1cc(c(cn1)N)OC 62a_100000210303_100009887741 [1,1,0,0,0,0|2,0,0]=4 2368 B13R1.575 CCCSc1cc(c(cn1)N)OC 62a_100009887741_100000210303 [1,1,0,0,0,0|2,0,0]=4 2369 B13R1.575 CCCSc1ccc(c(c1)C#N)O 62a_100000210303_100000687585 [1,1,0,0,0,0|2,0,0]=4 2370 B13R1.575 CCCSc1ccc(c(c1)C=O)O 62a_100000210303_100000186750 [1,1,0,0,0,0|2,0,0]=4 2371 B13R1.575 CCCSc1ccc(c(c1)CC)Br 62a_100000210303_100010244631 [1,1,0,0,0,0|2,0,0]=4 2372 B13R1.575 CCCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210303 [1,1,0,0,0,0|2,0,0]=4 2373 B13R1.575 CCCSc1ccc(c(c1)CC)F 62a_100000210303_100010244625 [1,1,0,0,0,0|2,0,0]=4 2374 B13R1.575 CCCSc1ccc(c(c1)CC)F 62a_100010244625_100000210303 [1,1,0,0,0,0|2,0,0]=4 2375 B13R1.575 CCCSc1ccc(c(c1)CC)N 62a_100000210303_100000686106 [1,1,0,0,0,0|2,0,0]=4 2376 B13R1.575 CCCSc1ccc(c(c1)CC)N 62a_100000686106_100000210303 [1,1,0,0,0,0|2,0,0]=4 2377 B13R1.575 CCCSc1ccc(c(c1)CC)O 62a_100000210303_100012338938 [1,1,0,0,0,0|1,0,0]=3 2378 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000210303_100000730032 [1,1,0,0,0,0|2,0,0]=4 2379 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000730032_100000210303 [1,1,0,0,0,0|2,0,0]=4 2380 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000184703_100000210303 [1,1,0,0,0,0|2,0,0]=4 2381 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000210303_100000184703 [1,1,0,0,0,0|2,0,0]=4 2382 B13R1.575 CCCSc1ccc(c(c1)NC)C 62a_100000210303_100020629602 [1,1,0,0,0,0|2,0,0]=4 2383 B13R1.575 CCCSc1ccc(c(c1)NC)C 62a_100020629602_100000210303 [1,1,0,0,0,0|2,0,0]=4 2384 B13R1.575 CCCSc1ccc(c(c1)NC)F 62a_100000210303_100011314990 [1,1,0,0,0,0|2,0,0]=4 2385 B13R1.575 CCCSc1ccc(c(c1)NC)F 62a_100011314990_100000210303 [1,1,0,0,0,0|2,0,0]=4 2386 B13R1.575 CCCSc1ccc(c(c1)NC)N 62a_100000694363_100000210303 [1,1,0,0,0,0|2,0,0]=4 2387 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100000210303_100012353699 [1,1,0,0,0,0|1,0,0]=3 2388 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210303 [1,1,0,0,0,0|1,0,0]=3 2389 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100000210303_100011830276 [1,1,0,0,0,0|1,0,0]=3 2390 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210303 [1,1,0,0,0,0|1,0,0]=3 2391 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100000210303_100011356853 [1,1,0,0,0,0|1,0,0]=3 2392 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210303 [1,1,0,0,0,0|1,0,0]=3 2393 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100000210303_100011934186 [1,1,0,0,0,0|1,0,0]=3 2394 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210303 [1,1,0,0,0,0|1,0,0]=3 2395 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100000210303_100015196925 [1,1,0,0,0,0|1,0,0]=3 2396 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210303 [1,1,0,0,0,0|1,0,0]=3 2397 B13R1.575 CCCSc1ccc(c(c1)OC)O 62a_100000210303_100000694246 [1,1,0,0,0,0|0,0,0]=2 2398 B13R1.575 CCCSc1ccc(c(c1)SC)F 62a_100000210303_100010341305 [1,1,0,0,0,0|1,1,0]=4 2399 B13R1.575 CCCSc1ccc(c(c1)SC)F 62a_100010341305_100000210303 [1,1,0,0,0,0|1,1,0]=4 2400 B13R1.575 CCCSc1ccc(c(n1)OC)N 62a_100000210303_100000687816 [1,1,0,0,0,0|2,0,0]=4 2401 B13R1.575 CCCSc1ccc(c(n1)OC)N 62a_100000687816_100000210303 [1,1,0,0,0,0|2,0,0]=4 2402 B13R1.575 CCCSc1ccc(c(n1)OC)O 62a_100000210303_100010893133 [1,1,0,0,0,0|1,0,0]=3 2403 B13R1.575 CCCSc1cnc(c(c1)OC)C 62a_100000210303_100010254219 [1,1,0,0,0,0|2,0,0]=4 2404 B13R1.575 CCCSc1cnc(c(c1)OC)C 62a_100010254219_100000210303 [1,1,0,0,0,0|2,0,0]=4 2405 B13R1.575 CCCSc1cnc(c(c1)OC)F 62a_100000210303_100010214931 [1,1,0,0,0,0|2,0,0]=4 2406 B13R1.575 CCCSc1cnc(c(c1)OC)F 62a_100010214931_100000210303 [1,1,0,0,0,0|2,0,0]=4 2407 B13R1.575 CCCSc1cnc(c(c1)OC)N 62a_100000210303_106354213024 [1,1,0,0,0,0|2,0,0]=4 2408 B13R1.575 CCCSc1cnc(c(c1)OC)N 62a_106354213024_100000210303 [1,1,0,0,0,0|2,0,0]=4 2409 B13R1.575 CCCSc1cnc(c(n1)OC)O 62a_100000210303_200010365344 [1,1,0,0,0,0|2,0,0]=4 2410 B13R1.575 CCCSc1cnc(c(n1)OC)O 62a_200010365344_100000210303 [1,1,0,0,0,0|2,0,0]=4 2411 B13R1.575 CCNCc1ccc(c(c1)CC)F 207a_100015525214_100009840867 [1,1,0,0,0,0|2,0,0]=4 2412 B13R1.575 CCNCc1ccc(c(c1)CC)F 2230a_114873767189_100000210202 [1,1,0,0,0,0|2,0,0]=4 2413 B13R1.575 CCNCc1ccc(c(c1)CC)F 269862a_100015525214_100009840867 [1,1,0,0,0,0|2,0,0]=4 2414 B13R1.575 CCNCc1ccc(c(c1)CC)F 270004a_100015525214_100009840867 [1,1,0,0,0,0|2,0,0]=4 2415 B13R1.575 CCNCc1ccc(c(c1)CC)F 34a_114873767189_100000210202 [1,1,0,0,0,0|2,0,0]=4 2416 B13R1.575 CCNCc1ccc(c(c1)OC)Br 207a_100015525214_100010244714 [1,1,0,0,0,0|1,0,0]=3 2417 B13R1.575 CCNCc1ccc(c(c1)OC)Br 2230a_100015525214_100010110085 [1,1,0,0,0,0|1,0,0]=3 2418 B13R1.575 CCNCc1ccc(c(c1)OC)Br 270004a_100015525214_100010244714 [1,1,0,0,0,0|1,0,0]=3 2419 B13R1.575 CCNCc1ccc(c(c1)OC)C 207a_100015525214_100000719150 [1,1,0,0,0,0|1,0,0]=3 2420 B13R1.575 CCNCc1ccc(c(c1)OC)C 270004a_100015525214_100000719150 [1,1,0,0,0,0|1,0,0]=3 2421 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 207a_100015525214_100011998524 [1,1,0,0,0,0|1,0,0]=3 2422 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210202 [1,1,0,0,0,0|1,0,0]=3 2423 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015525214_200010214485 [1,1,0,0,0,0|1,0,0]=3 2424 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 270004a_100015525214_100011998524 [1,1,0,0,0,0|1,0,0]=3 2425 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210202 [1,1,0,0,0,0|1,0,0]=3 2426 B13R1.575 CCNCc1ccc(c(c1)OC)F 207a_100015525214_100000692873 [1,1,0,0,0,0|1,0,0]=3 2427 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100015525214_100012349856 [1,1,0,0,0,0|1,0,0]=3 2428 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210202 [1,1,0,0,0,0|1,0,0]=3 2429 B13R1.575 CCNCc1ccc(c(c1)OC)F 270004a_100015525214_100000692873 [1,1,0,0,0,0|1,0,0]=3 2430 B13R1.575 CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210202 [1,1,0,0,0,0|1,0,0]=3 2431 B13R1.575 CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210202 [1,1,0,0,0,0|0,0,0]=2 2432 B13R1.575 CCNCc1ccc(c(n1)OC)Br 2230a_100015525214_200010066506 [1,1,0,0,0,0|2,0,0]=4 2433 B13R1.575 CCOCc1cc(c(cn1)Br)OC 34a_100010999569_100000210202 [1,1,0,0,0,0|2,0,0]=4 2434 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210202 [1,1,0,0,0,0|1,0,0]=3 2435 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100121572206_100010110085 [1,1,0,0,0,0|1,0,0]=3 2436 B13R1.575 CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210202 [1,1,0,0,0,0|1,0,0]=3 2437 B13R1.575 CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210202 [1,1,0,0,0,0|1,0,0]=3 2438 B13R1.575 CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210202 [1,1,0,0,0,0|1,0,0]=3 2439 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210202 [1,1,0,0,0,0|1,0,0]=3 2440 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100121572206_200010214485 [1,1,0,0,0,0|1,0,0]=3 2441 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210202 [1,1,0,0,0,0|1,0,0]=3 2442 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100121572206_100012349856 [1,1,0,0,0,0|1,0,0]=3 2443 B13R1.575 CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210202 [1,1,0,0,0,0|1,0,0]=3 2444 B13R1.575 CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210202 [1,1,0,0,0,0|1,0,0]=3 2445 B13R1.575 CCOCc1ccc(c(n1)OC)Br 34a_100121572206_200010066506 [1,1,0,0,0,0|2,0,0]=4 2446 B13R1.575 CCSCc1ccc(c(c1)C=O)O 62a_100000210202_100000008128 [1,1,0,0,0,0|2,0,0]=4 2447 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100000210202_100010110085 [1,1,0,0,0,0|1,0,0]=3 2448 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210202 [1,1,0,0,0,0|1,0,0]=3 2449 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_100000210202_200010214485 [1,1,0,0,0,0|1,0,0]=3 2450 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210202 [1,1,0,0,0,0|1,0,0]=3 2451 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100000210202_100012349856 [1,1,0,0,0,0|1,0,0]=3 2452 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210202 [1,1,0,0,0,0|1,0,0]=3 2453 B13R1.575 CCSCc1ccc(c(n1)OC)Br 62a_100000210202_200010066506 [1,1,0,0,0,0|2,0,0]=4 2454 B13R1.575 CCSCc1ccc(c(n1)OC)Br 62a_200010066506_100000210202 [1,1,0,0,0,0|2,0,0]=4 2455 B13R1.575 CCc1cc(ccc1O)SCCF 62a_100011217306_100012338938 [1,1,0,0,0,0|2,0,0]=4 2456 B13R1.575 CCc1cc(ccc1O)SCCO 62a_100000211926_100012338938 [1,1,0,0,0,0|2,0,0]=4 2457 B13R1.575 CCc1cc(ccc1O)SCOC 62a_100000766300_100012338938 [1,1,0,0,0,0|2,0,0]=4 2458 B13R1.575 CCc1cc(ccc1O)SCSC 62a_100011218213_100012338938 [1,1,0,0,0,0|2,0,0]=4 2459 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [1,1,0,0,0,0|0,0,0]=2 2460 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [1,1,0,0,0,0|0,0,0]=2 2461 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [1,1,0,0,0,0|0,0,0]=2 2462 B13R1.575 COCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000766300 [1,1,0,0,0,0|2,0,0]=4 2463 B13R1.575 COCNc1ccc(c(c1)OC)C 2230a_100011279678_100000766300 [1,1,0,0,0,0|2,0,0]=4 2464 B13R1.575 COCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000766300 [1,1,0,0,0,0|2,0,0]=4 2465 B13R1.575 COCNc1ccc(c(c1)OC)F 2230a_100000701188_100000766300 [1,1,0,0,0,0|2,0,0]=4 2466 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100000766300_100012353699 [1,1,0,0,0,0|2,0,0]=4 2467 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100012353699_100000766300 [1,1,0,0,0,0|2,0,0]=4 2468 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100000766300_100011830276 [1,1,0,0,0,0|2,0,0]=4 2469 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100011830276_100000766300 [1,1,0,0,0,0|2,0,0]=4 2470 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100000766300_100011356853 [1,1,0,0,0,0|2,0,0]=4 2471 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000766300 [1,1,0,0,0,0|2,0,0]=4 2472 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100000766300_100011934186 [1,1,0,0,0,0|2,0,0]=4 2473 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100011934186_100000766300 [1,1,0,0,0,0|2,0,0]=4 2474 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100000766300_100015196925 [1,1,0,0,0,0|2,0,0]=4 2475 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100011279103_100000766300 [1,1,0,0,0,0|2,0,0]=4 2476 B13R1.575 COCSc1ccc(c(c1)OC)O 62a_100000766300_100000694246 [1,1,0,0,0,0|1,0,0]=3 2477 B13R1.575 COCSc1ccc(c(n1)OC)O 62a_100000766300_100010893133 [1,1,0,0,0,0|2,0,0]=4 2478 B13R1.575 COc1cc(ccc1Br)COCF 34a_100010234685_100015361967 [1,1,0,0,0,0|2,0,0]=4 2479 B13R1.575 COc1cc(ccc1Br)COCF 7a_100010234685_100015361967 [1,1,0,0,0,0|2,0,0]=4 2480 B13R1.575 COc1cc(ccc1Br)CSCF 62a_100010110085_100015361967 [1,1,0,0,0,0|2,0,0]=4 2481 B13R1.575 COc1cc(ccc1Br)CSCF 62a_100015361967_100010110085 [1,1,0,0,0,0|2,0,0]=4 2482 B13R1.575 COc1cc(ccc1Br)NCCF 2230a_100000765947_100011217306 [1,1,0,0,0,0|2,0,0]=4 2483 B13R1.575 COc1cc(ccc1Br)NCCF 34a_100000765947_100011217306 [1,1,0,0,0,0|2,0,0]=4 2484 B13R1.575 COc1cc(ccc1Br)NCCO 2230a_100000765947_100000211926 [1,1,0,0,0,0|2,0,0]=4 2485 B13R1.575 COc1cc(ccc1Br)NCCO 34a_100000765947_100000211926 [1,1,0,0,0,0|2,0,0]=4 2486 B13R1.575 COc1cc(ccc1Br)NCSC 2230a_100000765947_100011218213 [1,1,0,0,0,0|2,0,0]=4 2487 B13R1.575 COc1cc(ccc1Br)NCSC 34a_100000765947_100011218213 [1,1,0,0,0,0|2,0,0]=4 2488 B13R1.575 COc1cc(ccc1Br)OCCF 34a_100011827694_100011217306 [1,1,0,0,0,0|2,0,0]=4 2489 B13R1.575 COc1cc(ccc1Br)OCCF 7a_100011827694_100011217306 [1,1,0,0,0,0|2,0,0]=4 2490 B13R1.575 COc1cc(ccc1Br)OCCO 34a_100011827694_100000211926 [1,1,0,0,0,0|2,0,0]=4 2491 B13R1.575 COc1cc(ccc1Br)OCCO 7a_100011827694_100000211926 [1,1,0,0,0,0|2,0,0]=4 2492 B13R1.575 COc1cc(ccc1Br)OCSC 34a_100011827694_100011218213 [1,1,0,0,0,0|2,0,0]=4 2493 B13R1.575 COc1cc(ccc1Br)SCCF 62a_100011217306_100012353699 [1,1,0,0,0,0|2,0,0]=4 2494 B13R1.575 COc1cc(ccc1Br)SCCF 62a_100012353699_100011217306 [1,1,0,0,0,0|2,0,0]=4 2495 B13R1.575 COc1cc(ccc1Br)SCCO 62a_100000211926_100012353699 [1,1,0,0,0,0|2,0,0]=4 2496 B13R1.575 COc1cc(ccc1Br)SCCO 62a_100012353699_100000211926 [1,1,0,0,0,0|2,0,0]=4 2497 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100011218213_100012353699 [1,1,0,0,0,0|2,0,0]=4 2498 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100012353699_100011218213 [1,1,0,0,0,0|2,0,0]=4 2499 B13R1.575 COc1cc(ccc1C)COCF 34a_100000752651_100015361967 [1,1,0,0,0,0|2,0,0]=4 2500 B13R1.575 COc1cc(ccc1C)COCF 7a_100000752651_100015361967 [1,1,0,0,0,0|2,0,0]=4 2501 B13R1.575 COc1cc(ccc1C)NCCF 2230a_100011279678_100011217306 [1,1,0,0,0,0|2,0,0]=4 2502 B13R1.575 COc1cc(ccc1C)NCCF 34a_100011279678_100011217306 [1,1,0,0,0,0|2,0,0]=4 2503 B13R1.575 COc1cc(ccc1C)NCCO 2230a_100011279678_100000211926 [1,1,0,0,0,0|2,0,0]=4 2504 B13R1.575 COc1cc(ccc1C)NCCO 34a_100000057592_200000210301 [1,1,0,0,0,0|2,0,0]=4 2505 B13R1.575 COc1cc(ccc1C)NCCO 34a_100011279678_100000211926 [1,1,0,0,0,0|2,0,0]=4 2506 B13R1.575 COc1cc(ccc1C)NCCO 7a_100000057592_200000210301 [1,1,0,0,0,0|2,0,0]=4 2507 B13R1.575 COc1cc(ccc1C)NCSC 2230a_100011279678_100011218213 [1,1,0,0,0,0|2,0,0]=4 2508 B13R1.575 COc1cc(ccc1C)NCSC 34a_100011279678_100011218213 [1,1,0,0,0,0|2,0,0]=4 2509 B13R1.575 COc1cc(ccc1C)OCCF 34a_100009865632_100011217306 [1,1,0,0,0,0|2,0,0]=4 2510 B13R1.575 COc1cc(ccc1C)OCCF 7a_100009865632_100011217306 [1,1,0,0,0,0|2,0,0]=4 2511 B13R1.575 COc1cc(ccc1C)OCCO 34a_100009865632_100000211926 [1,1,0,0,0,0|2,0,0]=4 2512 B13R1.575 COc1cc(ccc1C)OCCO 7a_100009865632_100000211926 [1,1,0,0,0,0|2,0,0]=4 2513 B13R1.575 COc1cc(ccc1C)OCSC 34a_100009865632_100011218213 [1,1,0,0,0,0|2,0,0]=4 2514 B13R1.575 COc1cc(ccc1C)SCCF 62a_100011217306_100011830276 [1,1,0,0,0,0|2,0,0]=4 2515 B13R1.575 COc1cc(ccc1C)SCCF 62a_100011830276_100011217306 [1,1,0,0,0,0|2,0,0]=4 2516 B13R1.575 COc1cc(ccc1C)SCCO 62a_100000211926_100011830276 [1,1,0,0,0,0|2,0,0]=4 2517 B13R1.575 COc1cc(ccc1C)SCCO 62a_100011830276_100000211926 [1,1,0,0,0,0|2,0,0]=4 2518 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011218213_100011830276 [1,1,0,0,0,0|2,0,0]=4 2519 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011830276_100011218213 [1,1,0,0,0,0|2,0,0]=4 2520 B13R1.575 COc1cc(ccc1Cl)CNCF 34a_100015204853_100015361967 [1,1,0,0,0,0|2,0,0]=4 2521 B13R1.575 COc1cc(ccc1Cl)COCF 34a_100012179228_100015361967 [1,1,0,0,0,0|2,0,0]=4 2522 B13R1.575 COc1cc(ccc1Cl)CSCF 62a_100015361967_200010214485 [1,1,0,0,0,0|2,0,0]=4 2523 B13R1.575 COc1cc(ccc1Cl)CSCF 62a_200010214485_100015361967 [1,1,0,0,0,0|2,0,0]=4 2524 B13R1.575 COc1cc(ccc1Cl)NCCF 2230a_100000742311_100011217306 [1,1,0,0,0,0|2,0,0]=4 2525 B13R1.575 COc1cc(ccc1Cl)NCCF 34a_100000742311_100011217306 [1,1,0,0,0,0|2,0,0]=4 2526 B13R1.575 COc1cc(ccc1Cl)NCCO 2230a_100000742311_100000211926 [1,1,0,0,0,0|2,0,0]=4 2527 B13R1.575 COc1cc(ccc1Cl)NCCO 34a_100000742311_100000211926 [1,1,0,0,0,0|2,0,0]=4 2528 B13R1.575 COc1cc(ccc1Cl)NCSC 2230a_100000742311_100011218213 [1,1,0,0,0,0|2,0,0]=4 2529 B13R1.575 COc1cc(ccc1Cl)NCSC 34a_100000742311_100011218213 [1,1,0,0,0,0|2,0,0]=4 2530 B13R1.575 COc1cc(ccc1Cl)OCCF 34a_100012186310_100011217306 [1,1,0,0,0,0|2,0,0]=4 2531 B13R1.575 COc1cc(ccc1Cl)OCCF 7a_100012186310_100011217306 [1,1,0,0,0,0|2,0,0]=4 2532 B13R1.575 COc1cc(ccc1Cl)OCCO 34a_100012186310_100000211926 [1,1,0,0,0,0|2,0,0]=4 2533 B13R1.575 COc1cc(ccc1Cl)OCCO 7a_100012186310_100000211926 [1,1,0,0,0,0|2,0,0]=4 2534 B13R1.575 COc1cc(ccc1Cl)OCSC 34a_100012186310_100011218213 [1,1,0,0,0,0|2,0,0]=4 2535 B13R1.575 COc1cc(ccc1Cl)SCCF 62a_100011217306_100011356853 [1,1,0,0,0,0|2,0,0]=4 2536 B13R1.575 COc1cc(ccc1Cl)SCCF 62a_100011356853_100011217306 [1,1,0,0,0,0|2,0,0]=4 2537 B13R1.575 COc1cc(ccc1Cl)SCCO 62a_100000211926_100011356853 [1,1,0,0,0,0|2,0,0]=4 2538 B13R1.575 COc1cc(ccc1Cl)SCCO 62a_100011356853_100000211926 [1,1,0,0,0,0|2,0,0]=4 2539 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011218213_100011356853 [1,1,0,0,0,0|2,0,0]=4 2540 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011356853_100011218213 [1,1,0,0,0,0|2,0,0]=4 2541 B13R1.575 COc1cc(ccc1F)CNCF 34a_100020626639_100015361967 [1,1,0,0,0,0|2,0,0]=4 2542 B13R1.575 COc1cc(ccc1F)COCF 34a_100000692429_100015361967 [1,1,0,0,0,0|2,0,0]=4 2543 B13R1.575 COc1cc(ccc1F)COCF 7a_100000692429_100015361967 [1,1,0,0,0,0|2,0,0]=4 2544 B13R1.575 COc1cc(ccc1F)CSCF 62a_100012349856_100015361967 [1,1,0,0,0,0|2,0,0]=4 2545 B13R1.575 COc1cc(ccc1F)CSCF 62a_100015361967_100012349856 [1,1,0,0,0,0|2,0,0]=4 2546 B13R1.575 COc1cc(ccc1F)NCCF 2230a_100000701188_100011217306 [1,1,0,0,0,0|2,0,0]=4 2547 B13R1.575 COc1cc(ccc1F)NCCF 34a_100000701188_100011217306 [1,1,0,0,0,0|2,0,0]=4 2548 B13R1.575 COc1cc(ccc1F)NCCO 2230a_100000701188_100000211926 [1,1,0,0,0,0|2,0,0]=4 2549 B13R1.575 COc1cc(ccc1F)NCCO 34a_100000701188_100000211926 [1,1,0,0,0,0|2,0,0]=4 2550 B13R1.575 COc1cc(ccc1F)NCSC 2230a_100000701188_100011218213 [1,1,0,0,0,0|2,0,0]=4 2551 B13R1.575 COc1cc(ccc1F)NCSC 34a_100000701188_100011218213 [1,1,0,0,0,0|2,0,0]=4 2552 B13R1.575 COc1cc(ccc1F)OCCF 34a_100012001760_100011217306 [1,1,0,0,0,0|2,0,0]=4 2553 B13R1.575 COc1cc(ccc1F)OCCF 7a_100012001760_100011217306 [1,1,0,0,0,0|2,0,0]=4 2554 B13R1.575 COc1cc(ccc1F)OCCO 34a_100012001760_100000211926 [1,1,0,0,0,0|2,0,0]=4 2555 B13R1.575 COc1cc(ccc1F)OCCO 7a_100012001760_100000211926 [1,1,0,0,0,0|2,0,0]=4 2556 B13R1.575 COc1cc(ccc1F)OCSC 34a_100012001760_100011218213 [1,1,0,0,0,0|2,0,0]=4 2557 B13R1.575 COc1cc(ccc1F)SCCF 62a_100011217306_100011934186 [1,1,0,0,0,0|2,0,0]=4 2558 B13R1.575 COc1cc(ccc1F)SCCF 62a_100011934186_100011217306 [1,1,0,0,0,0|2,0,0]=4 2559 B13R1.575 COc1cc(ccc1F)SCCO 62a_100000211926_100011934186 [1,1,0,0,0,0|2,0,0]=4 2560 B13R1.575 COc1cc(ccc1F)SCCO 62a_100011934186_100000211926 [1,1,0,0,0,0|2,0,0]=4 2561 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011218213_100011934186 [1,1,0,0,0,0|2,0,0]=4 2562 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011934186_100011218213 [1,1,0,0,0,0|2,0,0]=4 2563 B13R1.575 COc1cc(ccc1I)NCCF 34a_100000746945_100011217306 [1,1,0,0,0,0|2,0,0]=4 2564 B13R1.575 COc1cc(ccc1I)NCCO 34a_100000746945_100000211926 [1,1,0,0,0,0|2,0,0]=4 2565 B13R1.575 COc1cc(ccc1I)NCSC 34a_100000746945_100011218213 [1,1,0,0,0,0|2,0,0]=4 2566 B13R1.575 COc1cc(ccc1N)COCF 34a_100000087641_100015361967 [1,1,0,0,0,0|2,0,0]=4 2567 B13R1.575 COc1cc(ccc1N)OCCF 34a_100015326901_100011217306 [1,1,0,0,0,0|2,0,0]=4 2568 B13R1.575 COc1cc(ccc1N)OCCF 7a_100015326901_100011217306 [1,1,0,0,0,0|2,0,0]=4 2569 B13R1.575 COc1cc(ccc1N)OCCO 34a_100015326901_100000211926 [1,1,0,0,0,0|2,0,0]=4 2570 B13R1.575 COc1cc(ccc1N)OCCO 7a_100015326901_100000211926 [1,1,0,0,0,0|2,0,0]=4 2571 B13R1.575 COc1cc(ccc1N)OCSC 34a_100015326901_100011218213 [1,1,0,0,0,0|2,0,0]=4 2572 B13R1.575 COc1cc(ccc1N)SCCF 62a_100011217306_100015196925 [1,1,0,0,0,0|2,0,0]=4 2573 B13R1.575 COc1cc(ccc1N)SCCF 62a_100011279103_100011217306 [1,1,0,0,0,0|2,0,0]=4 2574 B13R1.575 COc1cc(ccc1N)SCCO 62a_100000211926_100015196925 [1,1,0,0,0,0|2,0,0]=4 2575 B13R1.575 COc1cc(ccc1N)SCCO 62a_100011279103_100000211926 [1,1,0,0,0,0|2,0,0]=4 2576 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011218213_100015196925 [1,1,0,0,0,0|2,0,0]=4 2577 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011279103_100011218213 [1,1,0,0,0,0|2,0,0]=4 2578 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [1,1,0,0,0,0|0,0,0]=2 2579 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [1,1,0,0,0,0|0,0,0]=2 2580 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [1,1,0,0,0,0|0,0,0]=2 2581 B13R1.575 COc1cc(ccc1O)CNCF 34a_100000185554_100015361967 [1,1,0,0,0,0|1,0,0]=3 2582 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [1,1,0,0,0,0|1,0,1]=4 2583 B13R1.575 COc1cc(ccc1O)NCCF 34a_100000726020_100011217306 [1,1,0,0,0,0|1,0,0]=3 2584 B13R1.575 COc1cc(ccc1O)NCCO 34a_100000726020_100000211926 [1,1,0,0,0,0|1,0,0]=3 2585 B13R1.575 COc1cc(ccc1O)NCSC 34a_100000726020_100011218213 [1,1,0,0,0,0|1,0,0]=3 2586 B13R1.575 COc1cc(ccc1O)SCC#N 62a_100011215382_100000694246 [1,1,0,0,0,0|0,0,2]=4 2587 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [1,1,0,0,0,0|1,0,1]=4 2588 B13R1.575 COc1cc(ccc1O)SCCF 62a_100011217306_100000694246 [1,1,0,0,0,0|1,0,0]=3 2589 B13R1.575 COc1cc(ccc1O)SCCO 62a_100000211926_100000694246 [1,1,0,0,0,0|1,0,0]=3 2590 B13R1.575 COc1cc(ccc1O)SCSC 62a_100011218213_100000694246 [1,1,0,0,0,0|1,0,0]=3 2591 B13R1.575 COc1nc(ccc1O)SCCF 62a_100011217306_100010893133 [1,1,0,0,0,0|2,0,0]=4 2592 B13R1.575 COc1nc(ccc1O)SCCO 62a_100000211926_100010893133 [1,1,0,0,0,0|2,0,0]=4 2593 B13R1.575 COc1nc(ccc1O)SCSC 62a_100011218213_100010893133 [1,1,0,0,0,0|2,0,0]=4 2594 B13R1.575 Cc1ccc(cc1O[13CH3])NCCO 34a_100000057592_200025704644 [1,1,0,0,0,0|2,0,0]=4 2595 B13R1.575 Cc1ccc(cc1O[13CH3])NCCO 7a_100000057592_200025704644 [1,1,0,0,0,0|2,0,0]=4 2596 B13R1.1255 CCNc1ccc(c(c1F)OC)F 34a_100137314619_100000210202 [1,1,0,0,0,0|2,0,0]=4 2597 B13R1.1255 CCOc1ccc(c(c1F)OC)F 34a_100000062073_100000210202 [1,1,0,0,0,0|2,0,0]=4 2598 B13R1.1255 CCOc1ccc(c(c1F)OC)F 7a_100000062073_100000210202 [1,1,0,0,0,0|2,0,0]=4 2599 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_100000210202_200135222481 [1,1,0,0,0,0|2,0,0]=4 2600 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000210202 [1,1,0,0,0,0|2,0,0]=4 2601 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100000210202_100010734149 [1,1,0,0,0,0|2,0,0]=4 2602 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100010734149_100000210202 [1,1,0,0,0,0|2,0,0]=4 2603 B13R1.1255 CNCc1ccc(c(c1F)OC)Br 207a_100102657272_200010981996 [1,1,0,0,0,0|2,0,0]=4 2604 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 207a_100102657272_100009889114 [1,1,0,0,0,0|2,0,0]=4 2605 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 2230a_106832991635_100010116237 [1,1,0,0,0,0|2,0,0]=4 2606 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 270004a_106832991635_100009889114 [1,1,0,0,0,0|2,0,0]=4 2607 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_100102657272_100010116237 [1,1,0,0,0,0|2,0,0]=4 2608 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_200009889119_200000210301 [1,1,0,0,0,0|2,0,0]=4 2609 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 7a_106832991635_100010116237 [1,1,0,0,0,0|2,0,0]=4 2610 B13R1.1255 CNCc1ccc(c(c1F)OC)F 207a_100102657272_100000050928 [1,1,0,0,0,0|2,0,0]=4 2611 B13R1.1255 CNCc1ccc(c(c1F)OC)F 2230a_106832991635_100009814548 [1,1,0,0,0,0|2,0,0]=4 2612 B13R1.1255 CNCc1ccc(c(c1F)OC)F 270004a_106832991635_100000050928 [1,1,0,0,0,0|2,0,0]=4 2613 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_100102657272_100009814548 [1,1,0,0,0,0|2,0,0]=4 2614 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_115082355467_200000210301 [1,1,0,0,0,0|2,0,0]=4 2615 B13R1.1255 CNCc1ccc(c(c1F)OC)F 7a_106832991635_100009814548 [1,1,0,0,0,0|2,0,0]=4 2616 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100009889115_200000210301 [1,1,0,0,0,0|2,0,0]=4 2617 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100138415774_100010116237 [1,1,0,0,0,0|2,0,0]=4 2618 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 7a_100009889115_200000210301 [1,1,0,0,0,0|2,0,0]=4 2619 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100000081355_200000210301 [1,1,0,0,0,0|2,0,0]=4 2620 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100138415774_100009814548 [1,1,0,0,0,0|2,0,0]=4 2621 B13R1.1255 COCc1ccc(c(c1F)OC)F 7a_100000081355_200000210301 [1,1,0,0,0,0|2,0,0]=4 2622 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])Cl 34a_200009889119_200025704644 [1,1,0,0,0,0|2,0,0]=4 2623 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])F 34a_115082355467_200025704644 [1,1,0,0,0,0|2,0,0]=4 2624 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 34a_100009889115_200025704644 [1,1,0,0,0,0|2,0,0]=4 2625 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 7a_100009889115_200025704644 [1,1,0,0,0,0|2,0,0]=4 2626 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 34a_100000081355_200025704644 [1,1,0,0,0,0|2,0,0]=4 2627 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 7a_100000081355_200025704644 [1,1,0,0,0,0|2,0,0]=4 2628 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_100010116237_200000210301 [1,1,0,0,0,0|2,0,0]=4 2629 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_200000210301_100010116237 [1,1,0,0,0,0|2,0,0]=4 2630 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_100009814548_200000210301 [1,1,0,0,0,0|2,0,0]=4 2631 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_200000210301_100009814548 [1,1,0,0,0,0|2,0,0]=4 2632 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_100010116237_200025704644 [1,1,0,0,0,0|2,0,0]=4 2633 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_200025704644_100010116237 [1,1,0,0,0,0|2,0,0]=4 2634 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_100009814548_200025704644 [1,1,0,0,0,0|2,0,0]=4 2635 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_200025704644_100009814548 [1,1,0,0,0,0|2,0,0]=4 2636 B13R1.2900 CC=Cc1cc(c(cc1F)O)OC 271570a_100016259895_100010189133 [1,1,0,0,0,0|0,0,2]=4 2637 B13R1.2900 CCNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000210202 [1,1,0,0,0,0|2,0,0]=4 2638 B13R1.2900 CCNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000210202 [1,1,0,0,0,0|2,0,0]=4 2639 B13R1.2900 CCNc1cc(c(cc1Br)C)OC 34a_100010244135_100000210202 [1,1,0,0,0,0|2,0,0]=4 2640 B13R1.2900 CCNc1cc(c(cc1Br)C)OC 7a_100010244135_100000210202 [1,1,0,0,0,0|2,0,0]=4 2641 B13R1.2900 CCNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000210202 [1,1,0,0,0,0|2,0,0]=4 2642 B13R1.2900 CCNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000210202 [1,1,0,0,0,0|2,0,0]=4 2643 B13R1.2900 CCNc1cc(c(cc1Br)F)OC 34a_100010208193_100000210202 [1,1,0,0,0,0|2,0,0]=4 2644 B13R1.2900 CCNc1cc(c(cc1Br)F)OC 7a_100010208193_100000210202 [1,1,0,0,0,0|2,0,0]=4 2645 B13R1.2900 CCNc1cc(c(cc1C)Br)OC 34a_100010232211_100000210202 [1,1,0,0,0,0|2,0,0]=4 2646 B13R1.2900 CCNc1cc(c(cc1C)Br)OC 7a_100010232211_100000210202 [1,1,0,0,0,0|2,0,0]=4 2647 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000210202 [1,1,0,0,0,0|2,0,0]=4 2648 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000210202 [1,1,0,0,0,0|2,0,0]=4 2649 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000210202 [1,1,0,0,0,0|2,0,0]=4 2650 B13R1.2900 CCNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000210202 [1,1,0,0,0,0|2,0,0]=4 2651 B13R1.2900 CCNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000210202 [1,1,0,0,0,0|2,0,0]=4 2652 B13R1.2900 CCNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000210202 [1,1,0,0,0,0|2,0,0]=4 2653 B13R1.2900 CCNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000210202 [1,1,0,0,0,0|2,0,0]=4 2654 B13R1.2900 CCNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000210202 [1,1,0,0,0,0|2,0,0]=4 2655 B13R1.2900 CCNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000210202 [1,1,0,0,0,0|2,0,0]=4 2656 B13R1.2900 CCNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000210202 [1,1,0,0,0,0|2,0,0]=4 2657 B13R1.2900 CCSc1cc(c(cc1Br)Br)OC 62a_100000210202_200014006352 [1,1,0,0,0,0|2,0,0]=4 2658 B13R1.2900 CCSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000210202 [1,1,0,0,0,0|2,0,0]=4 2659 B13R1.2900 CCSc1cc(c(cc1C)F)OC 62a_100000210202_100011009880 [1,1,0,0,0,0|2,0,0]=4 2660 B13R1.2900 CCSc1cc(c(cc1C)F)OC 62a_100011009880_100000210202 [1,1,0,0,0,0|2,0,0]=4 2661 B13R1.2900 CCSc1cc(c(cc1C)N)OC 62a_100000210202_100010141321 [1,1,0,0,0,0|2,0,0]=4 2662 B13R1.2900 CCSc1cc(c(cc1C)N)OC 62a_100010141321_100000210202 [1,1,0,0,0,0|2,0,0]=4 2663 B13R1.2900 CCSc1cc(c(cc1F)Cl)OC 62a_100000210202_100010739614 [1,1,0,0,0,0|2,0,0]=4 2664 B13R1.2900 CCSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000210202 [1,1,0,0,0,0|2,0,0]=4 2665 B13R1.2900 CCSc1cc(c(cc1F)F)OC 62a_100000210202_200015541288 [1,1,0,0,0,0|2,0,0]=4 2666 B13R1.2900 CCSc1cc(c(cc1F)F)OC 62a_200015541288_100000210202 [1,1,0,0,0,0|2,0,0]=4 2667 B13R1.2900 CCSc1cc(c(cc1F)N)OC 62a_100000210202_100012766639 [1,1,0,0,0,0|2,0,0]=4 2668 B13R1.2900 CCSc1cc(c(cc1F)N)OC 62a_100012766639_100000210202 [1,1,0,0,0,0|2,0,0]=4 2669 B13R1.2900 CCSc1cc(c(cc1F)O)OC 62a_100000210202_100010189133 [1,1,0,0,0,0|1,0,0]=3 2670 B13R1.2900 CCSc1cc(c(cc1N)C)OC 62a_100000210202_200010584344 [1,1,0,0,0,0|2,0,0]=4 2671 B13R1.2900 CCSc1cc(c(cc1N)C)OC 62a_200010584344_100000210202 [1,1,0,0,0,0|2,0,0]=4 2672 B13R1.2900 CCSc1cc(c(cc1N)F)OC 62a_100000210202_100010365326 [1,1,0,0,0,0|2,0,0]=4 2673 B13R1.2900 CCSc1cc(c(cc1N)F)OC 62a_100010365326_100000210202 [1,1,0,0,0,0|2,0,0]=4 2674 B13R1.2900 CNCc1cc(c(cc1Br)Br)OC 207a_100102657272_100010996155 [1,1,0,0,0,0|2,0,0]=4 2675 B13R1.2900 CNCc1cc(c(cc1Br)Br)OC 270004a_106832991635_100010996155 [1,1,0,0,0,0|2,0,0]=4 2676 B13R1.2900 CNCc1cc(c(cc1Br)F)OC 207a_100102657272_100010366953 [1,1,0,0,0,0|2,0,0]=4 2677 B13R1.2900 CNCc1cc(c(cc1Br)F)OC 270004a_106832991635_100010366953 [1,1,0,0,0,0|2,0,0]=4 2678 B13R1.2900 CNCc1cc(c(cc1F)Br)OC 207a_100102657272_100000695681 [1,1,0,0,0,0|2,0,0]=4 2679 B13R1.2900 CNCc1cc(c(cc1F)Br)OC 270004a_106832991635_100000695681 [1,1,0,0,0,0|2,0,0]=4 2680 B13R1.2900 CNCc1cc(c(cc1F)Cl)OC 207a_100102657272_100000050388 [1,1,0,0,0,0|2,0,0]=4 2681 B13R1.2900 CNCc1cc(c(cc1F)Cl)OC 270004a_106832991635_100000050388 [1,1,0,0,0,0|2,0,0]=4 2682 B13R1.2900 CNCc1cc(c(cc1F)F)OC 207a_100102657272_100010630602 [1,1,0,0,0,0|2,0,0]=4 2683 B13R1.2900 CNCc1cc(c(cc1F)F)OC 270004a_106832991635_100010630602 [1,1,0,0,0,0|2,0,0]=4 2684 B13R1.2900 COc1cc(c(cc1O)F)SCF 62a_100015361967_100010189133 [1,1,0,0,0,0|2,0,0]=4 2685 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000210202 [1,1,0,0,0,0|2,0,0]=4 2686 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000210202 [1,1,0,0,0,0|2,0,0]=4 2687 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000210202 [1,1,0,0,0,0|2,0,0]=4 2688 B13R1.4030 CCSc1cc(c(c(c1)CC)O)C 62a_100000210202_100010659108 [1,1,0,0,0,0|2,0,0]=4 2689 B13R1.4030 CCSc1cc(c(c(c1)OC)F)C 62a_100000210202_100010271686 [1,1,0,0,0,0|2,0,0]=4 2690 B13R1.4030 CCSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000210202 [1,1,0,0,0,0|2,0,0]=4 2691 B13R1.4030 CCSc1cc(c(c(c1)OC)F)F 62a_100000210202_100011218012 [1,1,0,0,0,0|2,0,0]=4 2692 B13R1.4030 CCSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000210202 [1,1,0,0,0,0|2,0,0]=4 2693 B13R1.4030 CCSc1cc(c(c(c1)OC)F)O 62a_100000210202_200015524394 [1,1,0,0,0,0|2,0,0]=4 2694 B13R1.4030 CCSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000210202 [1,1,0,0,0,0|2,0,0]=4 2695 B13R1.4030 CCSc1cc(c(c(c1)OC)N)C 62a_100000210202_100000741850 [1,1,0,0,0,0|2,0,0]=4 2696 B13R1.4030 CCSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000210202 [1,1,0,0,0,0|2,0,0]=4 2697 B13R1.4030 CCSc1cc(c(c(c1)OC)O)O 62a_100000210202_200159242197 [1,1,0,0,0,0|1,0,0]=3 2698 B13R1.4030 CNCc1cc(c(c(c1)OC)F)F 207a_100102657272_100000050682 [1,1,0,0,0,0|2,0,0]=4 2699 B13R1.4030 CNCc1cc(c(c(c1)OC)F)F 270004a_106832991635_100000050682 [1,1,0,0,0,0|2,0,0]=4 2700 B13R1.4030 COc1cc(cc(c1O)O)SCF 62a_100015361967_200159242197 [1,1,0,0,0,0|2,0,0]=4 2701 B13R1.56 COc1cc(cc(c1)CC(=O)C)Br 1458a_100000070787_100010162483 [1,1,0,0,0,0|1,0,1]=4 2702 B13R1.56 COc1cc(cc(c1)CC(=O)C)Cl 1458a_100000070787_100010188059 [1,1,0,0,0,0|1,0,1]=4 2703 B13R1.56 COc1cc(cc(c1)CC(=O)C)F 1458a_100000070787_100011934817 [1,1,0,0,0,0|1,0,1]=4 2704 B13R1.56 COc1cc(cc(c1)CN(C)C)Br 2230a_100102631434_100010162483 [1,1,0,0,0,0|2,0,0]=4 2705 B13R1.56 COc1cc(cc(c1)CN(C)C)Br 269982a_100102631434_100010162483 [1,1,0,0,0,0|2,0,0]=4 2706 B13R1.56 COc1cc(cc(c1)CN(C)C)Br 270004a_100102631434_100009816777 [1,1,0,0,0,0|2,0,0]=4 2707 B13R1.56 COc1cc(cc(c1)CN(C)C)C 270004a_100102631434_100000101404 [1,1,0,0,0,0|2,0,0]=4 2708 B13R1.56 COc1cc(cc(c1)CN(C)C)Cl 2230a_100102631434_100010188059 [1,1,0,0,0,0|2,0,0]=4 2709 B13R1.56 COc1cc(cc(c1)CN(C)C)Cl 269982a_100102631434_100010188059 [1,1,0,0,0,0|2,0,0]=4 2710 B13R1.56 COc1cc(cc(c1)CN(C)C)Cl 270004a_100102631434_100000087488 [1,1,0,0,0,0|2,0,0]=4 2711 B13R1.56 COc1cc(cc(c1)CN(C)C)F 2230a_100102631434_100011934817 [1,1,0,0,0,0|2,0,0]=4 2712 B13R1.56 COc1cc(cc(c1)CN(C)C)F 269982a_100102631434_100011934817 [1,1,0,0,0,0|2,0,0]=4 2713 B13R1.56 COc1cc(cc(c1)CN(C)C)F 270004a_100102631434_100011934815 [1,1,0,0,0,0|2,0,0]=4 2714 B13R1.56 COc1cc(cc(c1)CN(C)C)O 270004a_100102631434_100009856911 [1,1,0,0,0,0|2,0,0]=4 2715 B13R1.56 COc1cc(cc(c1)NC(C)C)Br 34a_100000750983_100000210206 [1,1,0,0,0,0|2,0,0]=4 2716 B13R1.56 COc1cc(cc(c1)NC(C)C)Br 7a_100000750983_100000210206 [1,1,0,0,0,0|2,0,0]=4 2717 B13R1.56 COc1cc(cc(c1)NC(C)C)C 2230a_100012001870_100000210206 [1,1,0,0,0,0|2,0,0]=4 2718 B13R1.56 COc1cc(cc(c1)NC(C)C)C 34a_100012001870_100000210206 [1,1,0,0,0,0|2,0,0]=4 2719 B13R1.56 COc1cc(cc(c1)NC(C)C)C 7a_100012001870_100000210206 [1,1,0,0,0,0|2,0,0]=4 2720 B13R1.56 COc1cc(cc(c1)NC(C)C)Cl 2230a_100000051436_100000210206 [1,1,0,0,0,0|2,0,0]=4 2721 B13R1.56 COc1cc(cc(c1)NC(C)C)Cl 34a_100000051436_100000210206 [1,1,0,0,0,0|2,0,0]=4 2722 B13R1.56 COc1cc(cc(c1)NC(C)C)Cl 7a_100000051436_100000210206 [1,1,0,0,0,0|2,0,0]=4 2723 B13R1.56 COc1cc(cc(c1)NC(C)C)F 2230a_100000687699_100000210206 [1,1,0,0,0,0|2,0,0]=4 2724 B13R1.56 COc1cc(cc(c1)NC(C)C)F 34a_100000687699_100000210206 [1,1,0,0,0,0|2,0,0]=4 2725 B13R1.56 COc1cc(cc(c1)NC(C)C)F 7a_100000687699_100000210206 [1,1,0,0,0,0|2,0,0]=4 2726 B13R1.56 COc1cc(cc(c1)NC(C)C)O 34a_200000692186_100000210206 [1,1,0,0,0,0|2,0,0]=4 2727 B13R1.56 COc1cc(cc(c1)OC(C)C)Br 34a_100010068927_100000210206 [1,1,0,0,0,0|2,0,0]=4 2728 B13R1.56 COc1cc(cc(c1)OC(C)C)Br 7a_100010068927_100000210206 [1,1,0,0,0,0|2,0,0]=4 2729 B13R1.56 COc1cc(cc(c1)OC(C)C)C 34a_100011216608_100000210206 [1,1,0,0,0,0|2,0,0]=4 2730 B13R1.56 COc1cc(cc(c1)OC(C)C)C 7a_100011216608_100000210206 [1,1,0,0,0,0|2,0,0]=4 2731 B13R1.56 COc1cc(cc(c1)OC(C)C)Cl 34a_100000051430_100000210206 [1,1,0,0,0,0|2,0,0]=4 2732 B13R1.56 COc1cc(cc(c1)OC(C)C)Cl 7a_100000051430_100000210206 [1,1,0,0,0,0|2,0,0]=4 2733 B13R1.56 COc1cc(cc(c1)OC(C)C)F 34a_100011369910_100000210206 [1,1,0,0,0,0|2,0,0]=4 2734 B13R1.56 COc1cc(cc(c1)OC(C)C)F 7a_100011369910_100000210206 [1,1,0,0,0,0|2,0,0]=4 2735 B13R1.56 COc1cc(cc(c1)OC(C)C)N 34a_200000692186_100000210206 [1,1,0,0,0,0|2,0,0]=4 2736 B13R1.56 COc1cc(cc(c1)OC(C)C)N 7a_200000692186_100000210206 [1,1,0,0,0,0|2,0,0]=4 2737 B13R1.56 COc1cc(cc(c1)SC(C)C)Br 62a_100000210206_100010141301 [1,1,0,0,0,0|2,0,0]=4 2738 B13R1.56 COc1cc(cc(c1)SC(C)C)Br 62a_100010141301_100000210206 [1,1,0,0,0,0|2,0,0]=4 2739 B13R1.56 COc1cc(cc(c1)SC(C)C)C 62a_100000210206_100010187550 [1,1,0,0,0,0|2,0,0]=4 2740 B13R1.56 COc1cc(cc(c1)SC(C)C)Cl 62a_100000210206_100010147680 [1,1,0,0,0,0|2,0,0]=4 2741 B13R1.56 COc1cc(cc(c1)SC(C)C)Cl 62a_100010147680_100000210206 [1,1,0,0,0,0|2,0,0]=4 2742 B13R1.56 COc1cc(cc(c1)SC(C)C)F 62a_100000210206_100011934182 [1,1,0,0,0,0|2,0,0]=4 2743 B13R1.56 COc1cc(cc(c1)SC(C)C)F 62a_100011934182_100000210206 [1,1,0,0,0,0|2,0,0]=4 2744 B13R1.56 COc1cc(cc(c1)SC(C)C)N 62a_100000210206_100000750983 [1,1,0,0,0,0|2,0,0]=4 2745 B13R1.56 COc1cc(cc(c1)SC(C)C)N 62a_100000750983_100000210206 [1,1,0,0,0,0|2,0,0]=4 2746 B13R1.56 COc1cc(cc(c1)SC(C)C)O 62a_100000210206_100010068927 [1,1,0,0,0,0|2,0,0]=4 2747 B13R1.80 COc1cccc(c1)NC(C)(C)C 34a_100000210024_100000210625 [1,1,0,0,0,0|2,0,0]=4 2748 B13R1.80 COc1cccc(c1)OC(C)(C)C 34a_100000211255_100000210625 [1,1,0,0,0,0|2,0,0]=4 2749 B13R1.80 COc1cccc(c1)SC(C)(C)C 62a_100000211941_100000170001 [1,1,0,0,0,0|2,0,0]=4 2750 B13R1.81 C#CC(C)Nc1cccc(c1)OC 34a_100000210024_200000035995 [1,1,0,0,0,0|2,0,0]=4 2751 B13R1.81 C#CC(C)Oc1cccc(c1)OC 34a_100000211255_200000035995 [1,1,0,0,0,0|2,0,0]=4 2752 B13R1.81 C#CC(C)Sc1cccc(c1)OC 62a_200000035995_100000170001 [1,1,0,0,0,0|2,0,0]=4 2753 B13R1.81 C=CC(C)Sc1cccc(c1)OC 62a_100011215867_100000170001 [1,1,0,0,0,0|2,0,0]=4 2754 B13R1.81 C=Cc1cccc(c1)CC(N)CO 271570a_100011290941_114802770106 [1,1,0,0,0,0|1,0,1]=4 2755 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000210414_100000211672 [1,1,0,0,0,0|1,0,1]=4 2756 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210202 [1,1,0,0,0,0|1,0,1]=4 2757 B13R1.81 CCC(C)Nc1cccc(c1)OC 34a_100000210024_100011215416 [1,1,0,0,0,0|2,0,0]=4 2758 B13R1.81 CCC(C)Oc1cccc(c1)OC 34a_100000211255_100011215416 [1,1,0,0,0,0|2,0,0]=4 2759 B13R1.81 CCC(C)Oc1cccc(c1)OC 7a_100000211255_100000758301 [1,1,0,0,0,0|2,0,0]=4 2760 B13R1.81 CCC(C)Sc1cccc(c1)OC 62a_100000758301_100000170001 [1,1,0,0,0,0|2,0,0]=4 2761 B13R1.81 CCN(C)Cc1cccc(c1)OC 2230a_100000184262_100000210202 [1,1,0,0,0,0|2,0,0]=4 2762 B13R1.81 CCN(C)Cc1cccc(c1)OC 2230a_100000225621_100000211672 [1,1,0,0,0,0|2,0,0]=4 2763 B13R1.81 CCN(C)Cc1cccc(c1)OC 2230a_200000201205_200000210301 [1,1,0,0,0,0|2,0,0]=4 2764 B13R1.81 CCN(C)Cc1cccc(c1)OC 269982a_100000184262_100000204670 [1,1,0,0,0,0|2,0,0]=4 2765 B13R1.81 CCN(C)Cc1cccc(c1)OC 269982a_100000225621_100000688526 [1,1,0,0,0,0|2,0,0]=4 2766 B13R1.81 CCN(C)Cc1cccc(c1)OC 269982a_200000201205_200000210301 [1,1,0,0,0,0|2,0,0]=4 2767 B13R1.81 CCN(C)Cc1cccc(c1)OC 26a_100000225621_100000211255 [1,1,0,0,0,0|2,0,0]=4 2768 B13R1.81 CCN([13CH3])Cc1cccc(c1)OC 2230a_200000201205_200025704644 [1,1,0,0,0,0|2,0,0]=4 2769 B13R1.81 CCN([13CH3])Cc1cccc(c1)OC 269982a_200000201205_200025704644 [1,1,0,0,0,0|2,0,0]=4 2770 B13R1.81 CNC(=O)Cc1cccc(c1)OC 11a_106832991635_100000211281 [1,1,0,0,0,0|1,0,1]=4 2771 B13R1.81 CNC(=O)Cc1cccc(c1)OC 1626a_100102657272_100000211281 [1,1,0,0,0,0|1,0,1]=4 2772 B13R1.81 CNC(=O)Cc1cccc(c1)OC 240690a_100102657272_100000211281 [1,1,0,0,0,0|1,0,1]=4 2773 B13R1.81 CNC(=O)Cc1cccc(c1)OC 527a_100102657272_100000211281 [1,1,0,0,0,0|1,0,1]=4 2774 B13R1.81 CNC(C)Cc1cccc(c1)OC 270004a_106832991635_100011218204 [1,1,0,0,0,0|0,0,0]=2 2775 B13R1.81 COc1cccc(c1)CC(=O)CF 1458a_100000211281_100015361967 [1,1,0,0,0,0|1,0,1]=4 2776 B13R1.81 COc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211672 [1,1,0,0,0,0|1,0,1]=4 2777 B13R1.81 COc1cccc(c1)CC(=O)NN 34a_100011472680_200000210301 [1,1,0,0,0,0|1,0,1]=4 2778 B13R1.81 COc1cccc(c1)CN(C)CF 269982a_100000184262_100015361967 [1,1,0,0,0,0|2,0,0]=4 2779 B13R1.81 COc1cccc(c1)NC(C)CO 34a_100000210024_100012180447 [1,1,0,0,0,0|2,0,0]=4 2780 B13R1.81 COc1cccc(c1)OC(C)C#N 7a_100000211255_100000703298 [1,1,0,0,0,0|1,0,1]=4 2781 B13R1.81 COc1cccc(c1)OC(C)CO 34a_100000211255_100012180447 [1,1,0,0,0,0|2,0,0]=4 2782 B13R1.81 COc1cccc(c1)OC(C)CO 7a_100000211255_100012180447 [1,1,0,0,0,0|2,0,0]=4 2783 B13R1.81 COc1cccc(c1)SC(C)C#N 62a_100000703298_100000170001 [1,1,0,0,0,0|1,0,1]=4 2784 B13R1.81 COc1cccc(c1)SC(C)CO 62a_100012180447_100000170001 [1,1,0,0,0,0|2,0,0]=4 2785 B13R1.81 COc1cccc(c1)SC(C)OC 62a_100009879195_100000170001 [1,1,0,0,0,0|2,0,0]=4 2786 B13R1.81 COc1cccc(c1)S[C@H](C)CO 62a_100016084084_100000170001 [1,1,0,0,0,0|2,0,0]=4 2787 B13R1.81 CSc1cccc(c1)CC(N)CO 62a_114802770106_200000210301 [1,1,0,0,0,0|0,1,0]=3 2788 B13R1.81 CSc1cccc(c1)CC(N)CO 62a_200000210301_114802770106 [1,1,0,0,0,0|0,1,0]=3 2789 B13R1.81 [13CH3]Oc1cccc(c1)CC(=O)NN 34a_100011472680_200025704644 [1,1,0,0,0,0|1,0,1]=4 2790 B13R1.81 [13CH3]Sc1cccc(c1)CC(N)CO 62a_114802770106_200025704644 [1,1,0,0,0,0|0,1,0]=3 2791 B13R1.81 [13CH3]Sc1cccc(c1)CC(N)CO 62a_200025704644_114802770106 [1,1,0,0,0,0|0,1,0]=3 2792 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100000761528 [1,1,0,0,0,0|1,0,1]=4 2793 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000690513_200000210301 [1,1,0,0,0,0|1,0,1]=4 2794 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000718613 [1,1,0,0,0,0|1,0,1]=4 2795 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100010217559_200000210301 [1,1,0,0,0,0|1,0,1]=4 2796 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100000070787_100010243555 [1,1,0,0,0,0|1,0,1]=4 2797 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100009868546_200000210301 [1,1,0,0,0,0|1,0,1]=4 2798 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100000690513_200025704644 [1,1,0,0,0,0|1,0,1]=4 2799 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Cl 1458a_100010217559_200025704644 [1,1,0,0,0,0|1,0,1]=4 2800 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100009868546_200025704644 [1,1,0,0,0,0|1,0,1]=4 2801 B13R1.97 COc1ccc(c(c1)CN(C)C)Br 2230a_100102631434_100000761528 [1,1,0,0,0,0|2,0,0]=4 2802 B13R1.97 COc1ccc(c(c1)CN(C)C)Br 269982a_100102631434_100000761528 [1,1,0,0,0,0|2,0,0]=4 2803 B13R1.97 COc1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100000691568 [1,1,0,0,0,0|2,0,0]=4 2804 B13R1.97 COc1ccc(c(c1)CN(C)C)C 270004a_100102631434_100012017359 [1,1,0,0,0,0|2,0,0]=4 2805 B13R1.97 COc1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100000718613 [1,1,0,0,0,0|2,0,0]=4 2806 B13R1.97 COc1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100000718613 [1,1,0,0,0,0|2,0,0]=4 2807 B13R1.97 COc1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100000117592 [1,1,0,0,0,0|2,0,0]=4 2808 B13R1.97 COc1ccc(c(c1)CN(C)C)F 2230a_100102631434_100010243555 [1,1,0,0,0,0|2,0,0]=4 2809 B13R1.97 COc1ccc(c(c1)CN(C)C)F 269982a_100102631434_100010243555 [1,1,0,0,0,0|2,0,0]=4 2810 B13R1.97 COc1ccc(c(c1)CN(C)C)F 270004a_100102631434_100000034340 [1,1,0,0,0,0|2,0,0]=4 2811 B13R1.97 COc1ccc(c(c1)CN(C)C)I 270004a_100102631434_100010075557 [1,1,0,0,0,0|2,0,0]=4 2812 B13R1.97 COc1ccc(c(c1)CN(C)C)O 271570a_203496583355_100000727244 [1,1,0,0,0,0|2,0,0]=4 2813 B13R1.97 COc1ccc(c(c1)NC(C)C)Br 34a_100000748603_100000210206 [1,1,0,0,0,0|2,0,0]=4 2814 B13R1.97 COc1ccc(c(c1)NC(C)C)C 2230a_100000760359_100000210206 [1,1,0,0,0,0|2,0,0]=4 2815 B13R1.97 COc1ccc(c(c1)NC(C)C)C 34a_100000760359_100000210206 [1,1,0,0,0,0|2,0,0]=4 2816 B13R1.97 COc1ccc(c(c1)NC(C)C)Cl 34a_100000745576_100000210206 [1,1,0,0,0,0|2,0,0]=4 2817 B13R1.97 COc1ccc(c(c1)NC(C)C)F 34a_100000764331_100000210206 [1,1,0,0,0,0|2,0,0]=4 2818 B13R1.97 COc1ccc(c(c1)NC(C)C)I 34a_100000748021_100000210206 [1,1,0,0,0,0|2,0,0]=4 2819 B13R1.97 COc1ccc(c(c1)NC(C)C)O 34a_100000188146_100000210206 [1,1,0,0,0,0|2,0,0]=4 2820 B13R1.97 COc1ccc(c(c1)OC(C)C)Br 34a_100000719091_100000210206 [1,1,0,0,0,0|2,0,0]=4 2821 B13R1.97 COc1ccc(c(c1)OC(C)C)Br 7a_100000719091_100000210206 [1,1,0,0,0,0|2,0,0]=4 2822 B13R1.97 COc1ccc(c(c1)OC(C)C)C 34a_100012179981_100000210206 [1,1,0,0,0,0|2,0,0]=4 2823 B13R1.97 COc1ccc(c(c1)OC(C)C)C 7a_100012179981_100000210206 [1,1,0,0,0,0|2,0,0]=4 2824 B13R1.97 COc1ccc(c(c1)OC(C)C)Cl 34a_100011516019_100000210206 [1,1,0,0,0,0|2,0,0]=4 2825 B13R1.97 COc1ccc(c(c1)OC(C)C)Cl 7a_100011516019_100000210206 [1,1,0,0,0,0|2,0,0]=4 2826 B13R1.97 COc1ccc(c(c1)OC(C)C)F 34a_100012178750_100000210206 [1,1,0,0,0,0|2,0,0]=4 2827 B13R1.97 COc1ccc(c(c1)OC(C)C)F 7a_100012178750_100000210206 [1,1,0,0,0,0|2,0,0]=4 2828 B13R1.97 COc1ccc(c(c1)OC(C)C)I 34a_100010168831_100000210206 [1,1,0,0,0,0|2,0,0]=4 2829 B13R1.97 COc1ccc(c(c1)OC(C)C)I 7a_100010168831_100000210206 [1,1,0,0,0,0|2,0,0]=4 2830 B13R1.97 COc1ccc(c(c1)OC(C)C)N 34a_100016989039_100000210206 [1,1,0,0,0,0|2,0,0]=4 2831 B13R1.97 COc1ccc(c(c1)OC(C)C)N 7a_100016989039_100000210206 [1,1,0,0,0,0|2,0,0]=4 2832 B13R1.97 COc1ccc(c(c1)SC(C)C)Br 62a_100000210206_100009992028 [1,1,0,0,0,0|2,0,0]=4 2833 B13R1.97 COc1ccc(c(c1)SC(C)C)Br 62a_100009992028_100000210206 [1,1,0,0,0,0|2,0,0]=4 2834 B13R1.97 COc1ccc(c(c1)SC(C)C)C 62a_100000210206_100012349166 [1,1,0,0,0,0|2,0,0]=4 2835 B13R1.97 COc1ccc(c(c1)SC(C)C)C 62a_100012349166_100000210206 [1,1,0,0,0,0|2,0,0]=4 2836 B13R1.97 COc1ccc(c(c1)SC(C)C)Cl 62a_100000210206_100011356938 [1,1,0,0,0,0|2,0,0]=4 2837 B13R1.97 COc1ccc(c(c1)SC(C)C)Cl 62a_100011356938_100000210206 [1,1,0,0,0,0|2,0,0]=4 2838 B13R1.97 COc1ccc(c(c1)SC(C)C)F 62a_100000210206_100000699733 [1,1,0,0,0,0|2,0,0]=4 2839 B13R1.97 COc1ccc(c(c1)SC(C)C)F 62a_100000699733_100000210206 [1,1,0,0,0,0|2,0,0]=4 2840 B13R1.97 COc1ccc(c(c1)SC(C)C)N 62a_100000210206_100015195136 [1,1,0,0,0,0|2,0,0]=4 2841 B13R1.97 COc1ccc(c(c1)SC(C)C)N 62a_100015195136_100000210206 [1,1,0,0,0,0|2,0,0]=4 2842 B13R1.97 COc1ccc(c(c1)SC(C)C)O 62a_100000210206_100000685887 [1,1,0,0,0,0|2,0,0]=4 2843 B13R1.373 CC(C)Cc1cccc(c1)SCF 62a_100010883412_100015361967 [1,1,0,0,0,0|1,1,0]=4 2844 B13R1.373 CC(C)Cc1cccc(c1)SCF 62a_100015361967_100010883412 [1,1,0,0,0,0|1,1,0]=4 2845 B13R1.373 CC(C)Oc1cccc(c1)OCF 34a_100000753242_100015361967 [1,1,0,0,0,0|2,0,0]=4 2846 B13R1.373 CC(C)Oc1cccc(c1)OCF 7a_100000753242_100015361967 [1,1,0,0,0,0|2,0,0]=4 2847 B13R1.373 CC=Cc1cccc(c1)CC(C)C 271570a_100016259895_100010883412 [1,1,0,0,0,0|2,0,0]=4 2848 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [1,1,0,0,0,0|1,0,1]=4 2849 B13R1.373 CCOc1cccc(c1)CC(=O)N 34a_200000747573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2850 B13R1.373 CCOc1cccc(c1)CC(=O)N 7a_200000747573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2851 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [1,1,0,0,0,0|1,0,1]=4 2852 B13R1.373 CCOc1cccc(c1)CN(C)C 270004a_100102631434_100000170239 [1,1,0,0,0,0|2,0,0]=4 2853 B13R1.373 CCOc1cccc(c1)NC(C)C 2230a_100000742568_100000210206 [1,1,0,0,0,0|2,0,0]=4 2854 B13R1.373 CCOc1cccc(c1)NC(C)C 34a_100000742568_100000210206 [1,1,0,0,0,0|2,0,0]=4 2855 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100000753242_100000210202 [1,1,0,0,0,0|2,0,0]=4 2856 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100011215941_100000210206 [1,1,0,0,0,0|2,0,0]=4 2857 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100000753242_100000210202 [1,1,0,0,0,0|2,0,0]=4 2858 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100011215941_100000210206 [1,1,0,0,0,0|2,0,0]=4 2859 B13R1.373 CCOc1cccc(c1)SC(C)C 62a_100000210206_100000170002 [1,1,0,0,0,0|2,0,0]=4 2860 B13R1.373 CCSc1cccc(c1)CC(C)C 62a_100000210202_100010883412 [1,1,0,0,0,0|1,1,0]=4 2861 B13R1.373 CCSc1cccc(c1)CC(C)C 62a_100010883412_100000210202 [1,1,0,0,0,0|1,1,0]=4 2862 B13R1.373 COCc1cccc(c1)NC(C)C 2230a_100000737370_100000210206 [1,1,0,0,0,0|2,0,0]=4 2863 B13R1.373 COCc1cccc(c1)NC(C)C 34a_100000737370_100000210206 [1,1,0,0,0,0|2,0,0]=4 2864 B13R1.373 COCc1cccc(c1)SC(C)C 62a_100000210206_100011493687 [1,1,0,0,0,0|2,0,0]=4 2865 B13R1.373 COCc1cccc(c1)SC(C)C 62a_100011493687_100000210206 [1,1,0,0,0,0|2,0,0]=4 2866 B13R1.373 NC(=O)Cc1cccc(c1)OCF 34a_200000747573_100015361967 [1,1,0,0,0,0|1,0,1]=4 2867 B13R1.373 NC(=O)Cc1cccc(c1)OCF 7a_200000747573_100015361967 [1,1,0,0,0,0|1,0,1]=4 2868 B13R1.587 C=C(C)c1cccc(c1)CC(C)C 271570a_100000694244_100010883412 [1,1,0,0,0,0|2,0,0]=4 2869 B13R1.641 COc1cccc(c1Br)CN(C)C 270004a_100102631434_100010209554 [1,1,0,0,0,0|2,0,0]=4 2870 B13R1.641 COc1cccc(c1Br)NC(C)C 34a_100000703447_100000210206 [1,1,0,0,0,0|2,0,0]=4 2871 B13R1.641 COc1cccc(c1Br)OC(C)C 34a_100010202623_100000210206 [1,1,0,0,0,0|2,0,0]=4 2872 B13R1.641 COc1cccc(c1Br)OC(C)C 7a_100010202623_100000210206 [1,1,0,0,0,0|2,0,0]=4 2873 B13R1.641 COc1cccc(c1Br)SC(C)C 62a_100000210206_100010146559 [1,1,0,0,0,0|2,0,0]=4 2874 B13R1.641 COc1cccc(c1Br)SC(C)C 62a_100010146559_100000210206 [1,1,0,0,0,0|2,0,0]=4 2875 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [1,1,0,0,0,0|1,0,1]=4 2876 B13R1.641 COc1cccc(c1C)CN(C)C 2230a_100102631434_100009876938 [1,1,0,0,0,0|2,0,0]=4 2877 B13R1.641 COc1cccc(c1C)CN(C)C 269982a_100102631434_100009876938 [1,1,0,0,0,0|2,0,0]=4 2878 B13R1.641 COc1cccc(c1C)CN(C)C 270004a_100102631434_100000101217 [1,1,0,0,0,0|2,0,0]=4 2879 B13R1.641 COc1cccc(c1C)NC(C)C 34a_100011244893_100000210206 [1,1,0,0,0,0|2,0,0]=4 2880 B13R1.641 COc1cccc(c1C)NC(C)C 7a_100011244893_100000210206 [1,1,0,0,0,0|2,0,0]=4 2881 B13R1.641 COc1cccc(c1C)SC(C)C 62a_100000210206_100010002647 [1,1,0,0,0,0|2,0,0]=4 2882 B13R1.641 COc1cccc(c1C)SC(C)C 62a_100010002647_100000210206 [1,1,0,0,0,0|2,0,0]=4 2883 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [1,1,0,0,0,0|1,0,1]=4 2884 B13R1.641 COc1cccc(c1Cl)CN(C)C 2230a_100102631434_200010147866 [1,1,0,0,0,0|2,0,0]=4 2885 B13R1.641 COc1cccc(c1Cl)CN(C)C 269982a_100102631434_200010147866 [1,1,0,0,0,0|2,0,0]=4 2886 B13R1.641 COc1cccc(c1Cl)CN(C)C 270004a_100102631434_100000068750 [1,1,0,0,0,0|2,0,0]=4 2887 B13R1.641 COc1cccc(c1Cl)NC(C)C 34a_100000089720_100000210206 [1,1,0,0,0,0|2,0,0]=4 2888 B13R1.641 COc1cccc(c1Cl)OC(C)C 34a_100000087810_100000210206 [1,1,0,0,0,0|2,0,0]=4 2889 B13R1.641 COc1cccc(c1Cl)OC(C)C 7a_100000087810_100000210206 [1,1,0,0,0,0|2,0,0]=4 2890 B13R1.641 COc1cccc(c1Cl)SC(C)C 62a_100000210206_100010147677 [1,1,0,0,0,0|2,0,0]=4 2891 B13R1.641 COc1cccc(c1Cl)SC(C)C 62a_100010147677_100000210206 [1,1,0,0,0,0|2,0,0]=4 2892 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [1,1,0,0,0,0|1,0,1]=4 2893 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [1,1,0,0,0,0|1,0,1]=4 2894 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [1,1,0,0,0,0|1,0,1]=4 2895 B13R1.641 COc1cccc(c1F)CN(C)C 2230a_100102631434_100011260763 [1,1,0,0,0,0|2,0,0]=4 2896 B13R1.641 COc1cccc(c1F)CN(C)C 2230a_106430512896_200000210301 [1,1,0,0,0,0|2,0,0]=4 2897 B13R1.641 COc1cccc(c1F)CN(C)C 269982a_100102631434_100011260763 [1,1,0,0,0,0|2,0,0]=4 2898 B13R1.641 COc1cccc(c1F)CN(C)C 269982a_106430512896_200000210301 [1,1,0,0,0,0|2,0,0]=4 2899 B13R1.641 COc1cccc(c1F)CN(C)C 270004a_100102631434_100000692048 [1,1,0,0,0,0|2,0,0]=4 2900 B13R1.641 COc1cccc(c1F)CN(C)C 34a_106430512896_200000210301 [1,1,0,0,0,0|2,0,0]=4 2901 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 2230a_106430512896_200025704644 [1,1,0,0,0,0|2,0,0]=4 2902 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 269982a_106430512896_200025704644 [1,1,0,0,0,0|2,0,0]=4 2903 B13R1.641 COc1cccc(c1F)CN(C)[13CH3] 34a_106430512896_200025704644 [1,1,0,0,0,0|2,0,0]=4 2904 B13R1.641 COc1cccc(c1F)NC(C)C 34a_100000100910_100000210206 [1,1,0,0,0,0|2,0,0]=4 2905 B13R1.641 COc1cccc(c1F)OC(C)C 34a_100000102366_100000210206 [1,1,0,0,0,0|2,0,0]=4 2906 B13R1.641 COc1cccc(c1F)OC(C)C 7a_100000102366_100000210206 [1,1,0,0,0,0|2,0,0]=4 2907 B13R1.641 COc1cccc(c1F)SC(C)C 62a_100000210206_100010185846 [1,1,0,0,0,0|2,0,0]=4 2908 B13R1.641 COc1cccc(c1F)SC(C)C 62a_100010185846_100000210206 [1,1,0,0,0,0|2,0,0]=4 2909 B13R1.641 COc1cccc(c1I)NC(C)C 34a_100010245509_100000210206 [1,1,0,0,0,0|2,0,0]=4 2910 B13R1.641 COc1cccc(c1I)OC(C)C 34a_200010201982_100000210206 [1,1,0,0,0,0|2,0,0]=4 2911 B13R1.641 COc1cccc(c1I)OC(C)C 7a_200010201982_100000210206 [1,1,0,0,0,0|2,0,0]=4 2912 B13R1.641 COc1cccc(c1N)OC(C)C 34a_100012022766_100000210206 [1,1,0,0,0,0|2,0,0]=4 2913 B13R1.641 COc1cccc(c1N)OC(C)C 7a_100012022766_100000210206 [1,1,0,0,0,0|2,0,0]=4 2914 B13R1.641 COc1cccc(c1N)SC(C)C 62a_100000708083_100000210206 [1,1,0,0,0,0|2,0,0]=4 2915 B13R1.641 COc1cccc(c1O)NC(C)C 34a_100000123586_100000210206 [1,1,0,0,0,0|2,0,0]=4 2916 B13R1.641 COc1cccc(c1O)SC(C)C 62a_100000210206_100000686866 [1,1,0,0,0,0|2,0,0]=4 2917 B13R1.642 CC(c1cccc(c1)O[13CH3])N(C)C 34a_100011952145_200025704644 [1,1,0,0,0,0|2,0,0]=4 2918 B13R1.642 CC(c1cccc(c1)O[13CH3])N(C)C 7a_100011952145_200025704644 [1,1,0,0,0,0|2,0,0]=4 2919 B13R1.642 COc1cccc(c1)C(=O)C(C)C 1458a_100000188888_100000210206 [1,1,0,0,0,0|1,0,1]=4 2920 B13R1.642 COc1cccc(c1)C(C)N(C)C 2230a_100011194365_200000210301 [1,1,0,0,0,0|2,0,0]=4 2921 B13R1.642 COc1cccc(c1)C(C)N(C)C 269982a_100011194365_200000210301 [1,1,0,0,0,0|2,0,0]=4 2922 B13R1.642 COc1cccc(c1)C(C)N(C)C 34a_100011952145_200000210301 [1,1,0,0,0,0|2,0,0]=4 2923 B13R1.642 COc1cccc(c1)C(C)N(C)C 7a_100011952145_200000210301 [1,1,0,0,0,0|2,0,0]=4 2924 B13R1.642 COc1cccc(c1)C(C)N(C)[13CH3] 2230a_100011194365_200025704644 [1,1,0,0,0,0|2,0,0]=4 2925 B13R1.642 COc1cccc(c1)C(C)N(C)[13CH3] 269982a_100011194365_200025704644 [1,1,0,0,0,0|2,0,0]=4 2926 B13R1.642 COc1cccc(c1)N(C)C(C)C 2230a_100000219725_100000210206 [1,1,0,0,0,0|2,0,0]=4 2927 B13R1.642 COc1cccc(c1)N(C)C(C)C 269982a_100000219725_100000210206 [1,1,0,0,0,0|2,0,0]=4 2928 B13R1.642 COc1cccc(c1)N(C)C(C)C 34a_100000219725_100000210206 [1,1,0,0,0,0|2,0,0]=4 2929 B13R1.13 C=C(C)c1cc(ccc1F)[C@H](C)N 271570a_100000694244_100000753309 [0,1,0,0,1,0|2,0,0]=4 2930 B13R1.50 CC(C)(C)c1ccc(c(c1)N[13CH3])O 34a_100000187365_200025704644 [0,1,0,0,1,0|2,0,0]=4 2931 B13R1.50 CC(C)(C)c1ccc(c(c1)N[13CH3])O 7a_100000187365_200025704644 [0,1,0,0,1,0|2,0,0]=4 2932 B13R1.50 CC(C)(C)c1ccc(c(c1)O[13CH3])I 34a_100010201833_200025704644 [0,1,0,0,1,0|2,0,0]=4 2933 B13R1.50 CC(C)(C)c1ccc(c(c1)O[13CH3])I 7a_100010201833_200025704644 [0,1,0,0,1,0|2,0,0]=4 2934 B13R1.50 CC(C)(C)c1ccc(c(c1)S[13CH3])O 62a_100012359415_200025704644 [0,1,0,0,1,0|1,1,0]=4 2935 B13R1.50 CC(C)(C)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100012359415 [0,1,0,0,1,0|1,1,0]=4 2936 B13R1.50 CNc1cc(ccc1O)C(C)(C)C 34a_100000187365_200000210301 [0,1,0,0,1,0|2,0,0]=4 2937 B13R1.50 CNc1cc(ccc1O)C(C)(C)C 7a_100000187365_200000210301 [0,1,0,0,1,0|2,0,0]=4 2938 B13R1.50 COc1cc(ccc1I)C(C)(C)C 34a_100010201833_200000210301 [0,1,0,0,1,0|2,0,0]=4 2939 B13R1.50 COc1cc(ccc1I)C(C)(C)C 7a_100010201833_200000210301 [0,1,0,0,1,0|2,0,0]=4 2940 B13R1.50 COc1cc(ccc1O)C(F)(F)F 271570a_203496583355_100010150383 [0,1,0,0,1,0|2,0,0]=4 2941 B13R1.50 CSc1cc(ccc1O)C(C)(C)C 62a_100012359415_200000210301 [0,1,0,0,1,0|1,1,0]=4 2942 B13R1.50 CSc1cc(ccc1O)C(C)(C)C 62a_200000210301_100012359415 [0,1,0,0,1,0|1,1,0]=4 2943 B13R1.298 COc1cc(cc(c1O)Cl)C(=O)C 1458a_100000209947_200000210301 [0,1,0,0,1,0|1,0,1]=4 2944 B13R1.298 COc1cc(cc(c1O)Cl)C(=O)[13CH3] 1458a_100000209947_200025704644 [0,1,0,0,1,0|1,0,1]=4 2945 B13R1.298 COc1cc(cc(c1O)O)C(=O)C 1458a_100000061230_200000210301 [0,1,0,0,1,0|1,0,1]=4 2946 B13R1.298 COc1cc(cc(c1O)O)C(=O)[13CH3] 1458a_100000061230_200025704644 [0,1,0,0,1,0|1,0,1]=4 2947 B13R1.354 CC(C)c1ccc(c(c1)NCF)O 34a_200000187366_100015361967 [0,1,0,0,1,0|2,0,0]=4 2948 B13R1.354 CC(C)c1ccc(c(c1)NCF)O 7a_200000187366_100015361967 [0,1,0,0,1,0|2,0,0]=4 2949 B13R1.354 CC=Cc1cc(ccc1F)[C@H](C)N 271570a_100016259895_100000753309 [0,1,0,0,1,0|2,0,0]=4 2950 B13R1.354 CCNc1cc(ccc1O)C(C)C 34a_200000187366_100000210202 [0,1,0,0,1,0|2,0,0]=4 2951 B13R1.354 CCNc1cc(ccc1O)C(C)C 7a_200000187366_100000210202 [0,1,0,0,1,0|2,0,0]=4 2952 B13R1.354 CCOc1cc(ccc1C)C(C)C 34a_100000212073_100000210202 [0,1,0,0,1,0|2,0,0]=4 2953 B13R1.354 CCOc1cc(ccc1C)C(C)C 7a_100000212073_100000210202 [0,1,0,0,1,0|2,0,0]=4 2954 B13R1.354 CCOc1cc(ccc1O)C(=O)C 1458a_100011260950_200000210301 [0,1,0,0,1,0|1,0,1]=4 2955 B13R1.354 CCOc1cc(ccc1O)C(=O)[13CH3] 1458a_100011260950_200025704644 [0,1,0,0,1,0|1,0,1]=4 2956 B13R1.354 CCSc1cc(ccc1F)[C@H](C)N 62a_100000210202_100000753309 [0,1,0,0,1,0|1,1,0]=4 2957 B13R1.354 CCSc1cc(ccc1F)[C@H](C)N 62a_100000753309_100000210202 [0,1,0,0,1,0|1,1,0]=4 2958 B13R1.354 COCc1cc(ccc1O)C(=O)C 34a_100138415774_100000010293 [0,1,0,0,1,0|1,0,1]=4 2959 B13R1.354 C[C@H](N)c1ccc(c(c1)SCF)F 62a_100000753309_100015361967 [0,1,0,0,1,0|1,1,0]=4 2960 B13R1.354 C[C@H](N)c1ccc(c(c1)SCF)F 62a_100015361967_100000753309 [0,1,0,0,1,0|1,1,0]=4 2961 B13R1.354 Cc1ccc(cc1OCF)C(C)C 34a_100000212073_100015361967 [0,1,0,0,1,0|2,0,0]=4 2962 B13R1.354 Cc1ccc(cc1OCF)C(C)C 7a_100000212073_100015361967 [0,1,0,0,1,0|2,0,0]=4 2963 B13R1.651 C=C(C)c1cc(c(cc1F)O)OC 271570a_100000694244_100010189133 [0,1,0,0,1,0|1,0,1]=4 2964 B13R1.3091 C=C(C)c1ccc(c(c1)OC)CO 271570a_100000694244_100011277633 [0,1,0,0,1,0|1,0,1]=4 2965 B13R1.3091 C=C(C)c1ccc(c(c1)OC)OC 271570a_100000694244_100000187503 [0,1,0,0,1,0|1,0,1]=4 2966 B13R1.3091 C=Cc1ccc(cc1OC)C(C)C 271570a_100011290941_100021623167 [0,1,0,0,1,0|2,0,0]=4 2967 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 34a_100000186468_200025704644 [0,1,0,0,1,0|1,0,1]=4 2968 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 7a_100000186468_200025704644 [0,1,0,0,1,0|1,0,1]=4 2969 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 34a_100000246512_200025704644 [0,1,0,0,1,0|1,0,0]=3 2970 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 7a_100000246512_200025704644 [0,1,0,0,1,0|1,0,0]=3 2971 B13R1.3091 COc1cc(ccc1SC)C(C)C 62a_100021623167_200000210301 [0,1,0,0,1,0|1,1,0]=4 2972 B13R1.3091 COc1cc(ccc1SC)C(C)C 62a_200000210301_100021623167 [0,1,0,0,1,0|1,1,0]=4 2973 B13R1.3091 COc1cc(ccc1S[13CH3])C(C)C 62a_100021623167_200025704644 [0,1,0,0,1,0|1,1,0]=4 2974 B13R1.3091 COc1cc(ccc1S[13CH3])C(C)C 62a_200025704644_100021623167 [0,1,0,0,1,0|1,1,0]=4 2975 B13R1.3091 COc1ccc(cc1OC)C(=O)C 1458a_100000211223_200000210301 [0,1,0,0,1,0|1,0,1]=4 2976 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000186468_200000210301 [0,1,0,0,1,0|1,0,1]=4 2977 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000732934_200000210301 [0,1,0,0,1,0|1,0,1]=4 2978 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000186468_200000210301 [0,1,0,0,1,0|1,0,1]=4 2979 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000732934_200000210301 [0,1,0,0,1,0|1,0,1]=4 2980 B13R1.3091 COc1ccc(cc1OC)C(=O)[13CH3] 1458a_100000211223_200025704644 [0,1,0,0,1,0|1,0,1]=4 2981 B13R1.3091 COc1ccc(cc1OC)C(C)O 34a_100000246512_200000210301 [0,1,0,0,1,0|1,0,0]=3 2982 B13R1.3091 COc1ccc(cc1OC)C(C)O 7a_100000246512_200000210301 [0,1,0,0,1,0|1,0,0]=3 2983 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 34a_100000732934_200025704644 [0,1,0,0,1,0|1,0,1]=4 2984 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 7a_100000732934_200025704644 [0,1,0,0,1,0|1,0,1]=4 2985 B13R1.3091 COc1ccc(cc1SC)C(C)O 62a_100000246541_200000210301 [0,1,0,0,1,0|1,1,0]=4 2986 B13R1.3091 COc1ccc(cc1SC)C(C)O 62a_200000210301_100000246541 [0,1,0,0,1,0|1,1,0]=4 2987 B13R1.3091 COc1ccc(cc1S[13CH3])C(C)O 62a_100000246541_200025704644 [0,1,0,0,1,0|1,1,0]=4 2988 B13R1.3091 COc1ccc(cc1S[13CH3])C(C)O 62a_200025704644_100000246541 [0,1,0,0,1,0|1,1,0]=4 2989 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)O)O 62a_100000748629_200159242197 [0,1,0,0,0,1|1,0,1]=4 2990 B15R1.392 CCc1cc(cc(c1O)C)SCC(C)C 62a_100000210624_100010659108 [0,1,0,0,0,1|2,0,0]=4 2991 B15R1.392 CCc1cc(cc(c1O)C)SCC(C)O 62a_100011218427_100010659108 [0,1,0,0,0,1|2,0,0]=4 2992 B15R1.392 CCc1cc(cc(c1O)C)SC[C@@H](C)O 62a_100009817552_100010659108 [0,1,0,0,0,1|2,0,0]=4 2993 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)C 2230a_100010131419_100000210760 [0,1,0,0,0,1|2,0,0]=4 2994 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)C 34a_100010131419_100000210624 [0,1,0,0,0,1|2,0,0]=4 2995 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)C 7a_100010131419_100000210760 [0,1,0,0,0,1|2,0,0]=4 2996 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)O 2230a_100010131419_100011218427 [0,1,0,0,0,1|2,0,0]=4 2997 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)O 34a_100010131419_100011218427 [0,1,0,0,0,1|2,0,0]=4 2998 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(C)O 7a_100010131419_100011218427 [0,1,0,0,0,1|2,0,0]=4 2999 B15R1.392 COc1cc(cc(c1Cl)Br)NC[C@@H](C)O 2230a_100010131419_100009817552 [0,1,0,0,0,1|2,0,0]=4 3000 B15R1.392 COc1cc(cc(c1Cl)Br)NC[C@@H](C)O 34a_100010131419_100009817552 [0,1,0,0,0,1|2,0,0]=4 3001 B15R1.392 COc1cc(cc(c1Cl)Br)NC[C@@H](C)O 7a_100010131419_100009817552 [0,1,0,0,0,1|2,0,0]=4 3002 B15R1.392 COc1cc(cc(c1F)C)SCC(C)C 62a_100000210624_100010271686 [0,1,0,0,0,1|2,0,0]=4 3003 B15R1.392 COc1cc(cc(c1F)C)SCC(C)C 62a_100010271686_100000210760 [0,1,0,0,0,1|2,0,0]=4 3004 B15R1.392 COc1cc(cc(c1F)C)SCC(C)O 62a_100010271686_100011218427 [0,1,0,0,0,1|2,0,0]=4 3005 B15R1.392 COc1cc(cc(c1F)C)SCC(C)O 62a_100011218427_100010271686 [0,1,0,0,0,1|2,0,0]=4 3006 B15R1.392 COc1cc(cc(c1F)C)SC[C@@H](C)O 62a_100009817552_100010271686 [0,1,0,0,0,1|2,0,0]=4 3007 B15R1.392 COc1cc(cc(c1F)C)SC[C@@H](C)O 62a_100010271686_100009817552 [0,1,0,0,0,1|2,0,0]=4 3008 B15R1.392 COc1cc(cc(c1F)F)CNC(C)C 207a_100138425928_100000050682 [0,1,0,0,0,1|2,0,0]=4 3009 B15R1.392 COc1cc(cc(c1F)F)SCC(C)C 62a_100000210624_100011218012 [0,1,0,0,0,1|2,0,0]=4 3010 B15R1.392 COc1cc(cc(c1F)F)SCC(C)C 62a_100011218012_100000210760 [0,1,0,0,0,1|2,0,0]=4 3011 B15R1.392 COc1cc(cc(c1F)F)SCC(C)O 62a_100011218012_100011218427 [0,1,0,0,0,1|2,0,0]=4 3012 B15R1.392 COc1cc(cc(c1F)F)SCC(C)O 62a_100011218427_100011218012 [0,1,0,0,0,1|2,0,0]=4 3013 B15R1.392 COc1cc(cc(c1F)F)SC[C@@H](C)O 62a_100009817552_100011218012 [0,1,0,0,0,1|2,0,0]=4 3014 B15R1.392 COc1cc(cc(c1F)F)SC[C@@H](C)O 62a_100011218012_100009817552 [0,1,0,0,0,1|2,0,0]=4 3015 B15R1.392 COc1cc(cc(c1F)O)SCC(C)C 62a_100000210624_200015524394 [0,1,0,0,0,1|2,0,0]=4 3016 B15R1.392 COc1cc(cc(c1F)O)SCC(C)C 62a_200015524394_100000210760 [0,1,0,0,0,1|2,0,0]=4 3017 B15R1.392 COc1cc(cc(c1F)O)SCC(C)O 62a_100011218427_200015524394 [0,1,0,0,0,1|2,0,0]=4 3018 B15R1.392 COc1cc(cc(c1F)O)SCC(C)O 62a_200015524394_100011218427 [0,1,0,0,0,1|2,0,0]=4 3019 B15R1.392 COc1cc(cc(c1F)O)SC[C@@H](C)O 62a_100009817552_200015524394 [0,1,0,0,0,1|2,0,0]=4 3020 B15R1.392 COc1cc(cc(c1F)O)SC[C@@H](C)O 62a_200015524394_100009817552 [0,1,0,0,0,1|2,0,0]=4 3021 B15R1.392 COc1cc(cc(c1N)C)SCC(C)C 62a_100000210624_100000741850 [0,1,0,0,0,1|2,0,0]=4 3022 B15R1.392 COc1cc(cc(c1N)C)SCC(C)C 62a_100000741850_100000210760 [0,1,0,0,0,1|2,0,0]=4 3023 B15R1.392 COc1cc(cc(c1N)C)SCC(C)O 62a_100000741850_100011218427 [0,1,0,0,0,1|2,0,0]=4 3024 B15R1.392 COc1cc(cc(c1N)C)SCC(C)O 62a_100011218427_100000741850 [0,1,0,0,0,1|2,0,0]=4 3025 B15R1.392 COc1cc(cc(c1N)C)SC[C@@H](C)O 62a_100000741850_100009817552 [0,1,0,0,0,1|2,0,0]=4 3026 B15R1.392 COc1cc(cc(c1N)C)SC[C@@H](C)O 62a_100009817552_100000741850 [0,1,0,0,0,1|2,0,0]=4 3027 B15R1.392 COc1cc(cc(c1O)O)SCC(=O)N 62a_100000747473_200159242197 [0,1,0,0,0,1|1,0,1]=4 3028 B15R1.392 COc1cc(cc(c1O)O)SCC(C)C 62a_100000210624_200159242197 [0,1,0,0,0,1|1,0,0]=3 3029 B15R1.392 COc1cc(cc(c1O)O)SCC(C)O 62a_100011218427_200159242197 [0,1,0,0,0,1|1,0,0]=3 3030 B15R1.392 COc1cc(cc(c1O)O)SCC(F)F 62a_100011934356_200159242197 [0,1,0,0,0,1|2,0,0]=4 3031 B15R1.392 COc1cc(cc(c1O)O)SC[C@@H](C)O 62a_100009817552_200159242197 [0,1,0,0,0,1|1,0,0]=3 3032 B15R1.531 CCOc1cc(ccc1Br)CNC(C)C 207a_100138425928_200010381951 [0,1,0,0,0,1|2,0,0]=4 3033 B15R1.531 CCOc1cc(ccc1Br)NCC(C)C 2230a_200016990551_100000210760 [0,1,0,0,0,1|2,0,0]=4 3034 B15R1.531 CCOc1cc(ccc1Br)NCC(C)C 34a_200016990551_100000210624 [0,1,0,0,0,1|2,0,0]=4 3035 B15R1.531 CCOc1cc(ccc1Br)NCC(C)C 7a_200016990551_100000210760 [0,1,0,0,0,1|2,0,0]=4 3036 B15R1.531 CCOc1cc(ccc1Br)NCC(C)O 2230a_200016990551_100011218427 [0,1,0,0,0,1|2,0,0]=4 3037 B15R1.531 CCOc1cc(ccc1Br)NCC(C)O 34a_200016990551_100011218427 [0,1,0,0,0,1|2,0,0]=4 3038 B15R1.531 CCOc1cc(ccc1Br)NCC(C)O 7a_200016990551_100011218427 [0,1,0,0,0,1|2,0,0]=4 3039 B15R1.531 CCOc1cc(ccc1Br)NC[C@@H](C)O 2230a_200016990551_100009817552 [0,1,0,0,0,1|2,0,0]=4 3040 B15R1.531 CCOc1cc(ccc1Br)NC[C@@H](C)O 34a_200016990551_100009817552 [0,1,0,0,0,1|2,0,0]=4 3041 B15R1.531 CCOc1cc(ccc1Br)NC[C@@H](C)O 7a_200016990551_100009817552 [0,1,0,0,0,1|2,0,0]=4 3042 B15R1.531 CCOc1cc(ccc1C)SCC(C)C 62a_100000210624_100012361169 [0,1,0,0,0,1|2,0,0]=4 3043 B15R1.531 CCOc1cc(ccc1C)SCC(C)C 62a_100012361169_100000210760 [0,1,0,0,0,1|2,0,0]=4 3044 B15R1.531 CCOc1cc(ccc1C)SCC(C)O 62a_100011218427_100012361169 [0,1,0,0,0,1|2,0,0]=4 3045 B15R1.531 CCOc1cc(ccc1C)SCC(C)O 62a_100012361169_100011218427 [0,1,0,0,0,1|2,0,0]=4 3046 B15R1.531 CCOc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100012361169 [0,1,0,0,0,1|2,0,0]=4 3047 B15R1.531 CCOc1cc(ccc1C)SC[C@@H](C)O 62a_100012361169_100009817552 [0,1,0,0,0,1|2,0,0]=4 3048 B15R1.531 CCOc1cc(ccc1Cl)NCC(C)C 2230a_100011964961_100000210760 [0,1,0,0,0,1|2,0,0]=4 3049 B15R1.531 CCOc1cc(ccc1Cl)NCC(C)C 34a_100011964961_100000210624 [0,1,0,0,0,1|2,0,0]=4 3050 B15R1.531 CCOc1cc(ccc1Cl)NCC(C)O 2230a_100011964961_100011218427 [0,1,0,0,0,1|2,0,0]=4 3051 B15R1.531 CCOc1cc(ccc1Cl)NCC(C)O 34a_100011964961_100011218427 [0,1,0,0,0,1|2,0,0]=4 3052 B15R1.531 CCOc1cc(ccc1Cl)NC[C@@H](C)O 2230a_100011964961_100009817552 [0,1,0,0,0,1|2,0,0]=4 3053 B15R1.531 CCOc1cc(ccc1Cl)NC[C@@H](C)O 34a_100011964961_100009817552 [0,1,0,0,0,1|2,0,0]=4 3054 B15R1.531 CCOc1cc(ccc1F)CNC(C)C 207a_100138425928_200000106648 [0,1,0,0,0,1|2,0,0]=4 3055 B15R1.531 CCOc1cc(ccc1F)SCC(C)C 62a_100000210624_200012344967 [0,1,0,0,0,1|2,0,0]=4 3056 B15R1.531 CCOc1cc(ccc1F)SCC(C)C 62a_200012344967_100000210760 [0,1,0,0,0,1|2,0,0]=4 3057 B15R1.531 CCOc1cc(ccc1F)SCC(C)O 62a_100011218427_200012344967 [0,1,0,0,0,1|2,0,0]=4 3058 B15R1.531 CCOc1cc(ccc1F)SCC(C)O 62a_200012344967_100011218427 [0,1,0,0,0,1|2,0,0]=4 3059 B15R1.531 CCOc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_200012344967 [0,1,0,0,0,1|2,0,0]=4 3060 B15R1.531 CCOc1cc(ccc1F)SC[C@@H](C)O 62a_200012344967_100009817552 [0,1,0,0,0,1|2,0,0]=4 3061 B15R1.531 CCOc1cc(ccc1N)SCC(C)C 62a_100000688918_100000210760 [0,1,0,0,0,1|2,0,0]=4 3062 B15R1.531 CCOc1cc(ccc1N)SCC(C)O 62a_100000688918_100011218427 [0,1,0,0,0,1|2,0,0]=4 3063 B15R1.531 CCOc1cc(ccc1N)SC[C@@H](C)O 62a_100000688918_100009817552 [0,1,0,0,0,1|2,0,0]=4 3064 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 11a_200000751567_100015343762 [0,1,0,0,0,1|1,0,1]=4 3065 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 240690a_200000751567_100015343762 [0,1,0,0,0,1|1,0,1]=4 3066 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 527a_200000751567_100103153847 [0,1,0,0,0,1|1,0,1]=4 3067 B15R1.531 CCOc1cc(ccc1O)CNC(C)C 34a_200000751567_100000210206 [0,1,0,0,0,1|1,0,0]=3 3068 B15R1.531 CNCc1cc(ccc1O)SCC(C)C 62a_100000210624_100011602694 [0,1,0,0,0,1|2,0,0]=4 3069 B15R1.531 CNCc1cc(ccc1O)SCC(C)C 62a_100011602694_100000210760 [0,1,0,0,0,1|2,0,0]=4 3070 B15R1.531 CNCc1cc(ccc1O)SCC(C)O 62a_100011218427_100011602694 [0,1,0,0,0,1|2,0,0]=4 3071 B15R1.531 CNCc1cc(ccc1O)SCC(C)O 62a_100011602694_100011218427 [0,1,0,0,0,1|2,0,0]=4 3072 B15R1.531 CNCc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100011602694 [0,1,0,0,0,1|2,0,0]=4 3073 B15R1.531 CNCc1cc(ccc1O)SC[C@@H](C)O 62a_100011602694_100009817552 [0,1,0,0,0,1|2,0,0]=4 3074 B15R1.531 COCc1cc(ccc1Br)SCC(C)C 62a_100000210624_202125822959 [0,1,0,0,0,1|2,0,0]=4 3075 B15R1.531 COCc1cc(ccc1Br)SCC(C)C 62a_202125822959_100000210760 [0,1,0,0,0,1|2,0,0]=4 3076 B15R1.531 COCc1cc(ccc1Br)SCC(C)O 62a_100011218427_202125822959 [0,1,0,0,0,1|2,0,0]=4 3077 B15R1.531 COCc1cc(ccc1Br)SCC(C)O 62a_202125822959_100011218427 [0,1,0,0,0,1|2,0,0]=4 3078 B15R1.531 COCc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_202125822959 [0,1,0,0,0,1|2,0,0]=4 3079 B15R1.531 COCc1cc(ccc1Br)SC[C@@H](C)O 62a_202125822959_100009817552 [0,1,0,0,0,1|2,0,0]=4 3080 B15R1.531 COCc1cc(ccc1F)SCC(C)C 62a_100000210624_100010140362 [0,1,0,0,0,1|2,0,0]=4 3081 B15R1.531 COCc1cc(ccc1F)SCC(C)C 62a_100010140362_100000210760 [0,1,0,0,0,1|2,0,0]=4 3082 B15R1.531 COCc1cc(ccc1F)SCC(C)O 62a_100010140362_100011218427 [0,1,0,0,0,1|2,0,0]=4 3083 B15R1.531 COCc1cc(ccc1F)SCC(C)O 62a_100011218427_100010140362 [0,1,0,0,0,1|2,0,0]=4 3084 B15R1.531 COCc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100010140362 [0,1,0,0,0,1|2,0,0]=4 3085 B15R1.531 COCc1cc(ccc1F)SC[C@@H](C)O 62a_100010140362_100009817552 [0,1,0,0,0,1|2,0,0]=4 3086 B15R1.873 CC(C)CSc1ccc(c(c1)C(C)C)O 62a_100000210624_100000691460 [0,1,0,0,0,1|2,0,0]=4 3087 B15R1.873 CC(C)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210760 [0,1,0,0,0,1|2,0,0]=4 3088 B15R1.873 CC(C)c1cc(ccc1O)SC[C@@H](C)O 62a_100000691460_100009817552 [0,1,0,0,0,1|2,0,0]=4 3089 B15R1.873 CC(C)c1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000691460 [0,1,0,0,0,1|2,0,0]=4 3090 B15R1.873 CC(O)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100011218427 [0,1,0,0,0,1|2,0,0]=4 3091 B15R1.873 CC(O)CSc1ccc(c(c1)C(C)C)O 62a_100011218427_100000691460 [0,1,0,0,0,1|2,0,0]=4 3092 B15R1.1803 C=C(C)CSc1cc(c(cc1F)O)OC 62a_100000748629_100010189133 [0,1,0,0,0,1|1,0,1]=4 3093 B15R1.1803 COc1cc(c(cc1Br)Br)CNC(C)C 207a_100138425928_100010996155 [0,1,0,0,0,1|2,0,0]=4 3094 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(C)C 34a_100000718616_100000210624 [0,1,0,0,0,1|2,0,0]=4 3095 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(C)C 7a_100000718616_100000210760 [0,1,0,0,0,1|2,0,0]=4 3096 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(C)O 34a_100000718616_100011218427 [0,1,0,0,0,1|2,0,0]=4 3097 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(C)O 7a_100000718616_100011218427 [0,1,0,0,0,1|2,0,0]=4 3098 B15R1.1803 COc1cc(c(cc1Br)Br)NC[C@@H](C)O 34a_100000718616_100009817552 [0,1,0,0,0,1|2,0,0]=4 3099 B15R1.1803 COc1cc(c(cc1Br)Br)NC[C@@H](C)O 7a_100000718616_100009817552 [0,1,0,0,0,1|2,0,0]=4 3100 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(C)C 62a_100000210624_200014006352 [0,1,0,0,0,1|2,0,0]=4 3101 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(C)C 62a_200014006352_100000210760 [0,1,0,0,0,1|2,0,0]=4 3102 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(C)O 62a_100011218427_200014006352 [0,1,0,0,0,1|2,0,0]=4 3103 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(C)O 62a_200014006352_100011218427 [0,1,0,0,0,1|2,0,0]=4 3104 B15R1.1803 COc1cc(c(cc1Br)Br)SC[C@@H](C)O 62a_100009817552_200014006352 [0,1,0,0,0,1|2,0,0]=4 3105 B15R1.1803 COc1cc(c(cc1Br)Br)SC[C@@H](C)O 62a_200014006352_100009817552 [0,1,0,0,0,1|2,0,0]=4 3106 B15R1.1803 COc1cc(c(cc1Br)C)NCC(C)C 34a_100010232211_100000210624 [0,1,0,0,0,1|2,0,0]=4 3107 B15R1.1803 COc1cc(c(cc1Br)C)NCC(C)C 7a_100010232211_100000210760 [0,1,0,0,0,1|2,0,0]=4 3108 B15R1.1803 COc1cc(c(cc1Br)C)NCC(C)O 34a_100010232211_100011218427 [0,1,0,0,0,1|2,0,0]=4 3109 B15R1.1803 COc1cc(c(cc1Br)C)NCC(C)O 7a_100010232211_100011218427 [0,1,0,0,0,1|2,0,0]=4 3110 B15R1.1803 COc1cc(c(cc1Br)C)NC[C@@H](C)O 34a_100010232211_100009817552 [0,1,0,0,0,1|2,0,0]=4 3111 B15R1.1803 COc1cc(c(cc1Br)C)NC[C@@H](C)O 7a_100010232211_100009817552 [0,1,0,0,0,1|2,0,0]=4 3112 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(C)C 34a_100012361290_100000210624 [0,1,0,0,0,1|2,0,0]=4 3113 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(C)C 7a_100012361290_100000210760 [0,1,0,0,0,1|2,0,0]=4 3114 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(C)O 34a_100012361290_100011218427 [0,1,0,0,0,1|2,0,0]=4 3115 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(C)O 7a_100012361290_100011218427 [0,1,0,0,0,1|2,0,0]=4 3116 B15R1.1803 COc1cc(c(cc1Br)Cl)NC[C@@H](C)O 34a_100012361290_100009817552 [0,1,0,0,0,1|2,0,0]=4 3117 B15R1.1803 COc1cc(c(cc1Br)Cl)NC[C@@H](C)O 7a_100012361290_100009817552 [0,1,0,0,0,1|2,0,0]=4 3118 B15R1.1803 COc1cc(c(cc1Br)F)CNC(C)C 207a_100138425928_100000695681 [0,1,0,0,0,1|2,0,0]=4 3119 B15R1.1803 COc1cc(c(cc1C)Br)NCC(C)C 34a_100010244135_100000210624 [0,1,0,0,0,1|2,0,0]=4 3120 B15R1.1803 COc1cc(c(cc1C)Br)NCC(C)C 7a_100010244135_100000210760 [0,1,0,0,0,1|2,0,0]=4 3121 B15R1.1803 COc1cc(c(cc1C)Br)NCC(C)O 34a_100010244135_100011218427 [0,1,0,0,0,1|2,0,0]=4 3122 B15R1.1803 COc1cc(c(cc1C)Br)NCC(C)O 7a_100010244135_100011218427 [0,1,0,0,0,1|2,0,0]=4 3123 B15R1.1803 COc1cc(c(cc1C)Br)NC[C@@H](C)O 34a_100010244135_100009817552 [0,1,0,0,0,1|2,0,0]=4 3124 B15R1.1803 COc1cc(c(cc1C)Br)NC[C@@H](C)O 7a_100010244135_100009817552 [0,1,0,0,0,1|2,0,0]=4 3125 B15R1.1803 COc1cc(c(cc1C)N)SCC(C)C 62a_100000210624_200010584344 [0,1,0,0,0,1|2,0,0]=4 3126 B15R1.1803 COc1cc(c(cc1C)N)SCC(C)C 62a_200010584344_100000210760 [0,1,0,0,0,1|2,0,0]=4 3127 B15R1.1803 COc1cc(c(cc1C)N)SCC(C)O 62a_100011218427_200010584344 [0,1,0,0,0,1|2,0,0]=4 3128 B15R1.1803 COc1cc(c(cc1C)N)SCC(C)O 62a_200010584344_100011218427 [0,1,0,0,0,1|2,0,0]=4 3129 B15R1.1803 COc1cc(c(cc1C)N)SC[C@@H](C)O 62a_100009817552_200010584344 [0,1,0,0,0,1|2,0,0]=4 3130 B15R1.1803 COc1cc(c(cc1C)N)SC[C@@H](C)O 62a_200010584344_100009817552 [0,1,0,0,0,1|2,0,0]=4 3131 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(C)C 34a_100013022580_100000210624 [0,1,0,0,0,1|2,0,0]=4 3132 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(C)C 7a_100013022580_100000210760 [0,1,0,0,0,1|2,0,0]=4 3133 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(C)O 34a_100013022580_100011218427 [0,1,0,0,0,1|2,0,0]=4 3134 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(C)O 7a_100013022580_100011218427 [0,1,0,0,0,1|2,0,0]=4 3135 B15R1.1803 COc1cc(c(cc1Cl)Br)NC[C@@H](C)O 34a_100013022580_100009817552 [0,1,0,0,0,1|2,0,0]=4 3136 B15R1.1803 COc1cc(c(cc1Cl)Br)NC[C@@H](C)O 7a_100013022580_100009817552 [0,1,0,0,0,1|2,0,0]=4 3137 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)C 2230a_100009858536_100000210760 [0,1,0,0,0,1|2,0,0]=4 3138 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)C 34a_100009858536_100000210624 [0,1,0,0,0,1|2,0,0]=4 3139 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)C 7a_100009858536_100000210760 [0,1,0,0,0,1|2,0,0]=4 3140 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)O 2230a_100009858536_100011218427 [0,1,0,0,0,1|2,0,0]=4 3141 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)O 34a_100009858536_100011218427 [0,1,0,0,0,1|2,0,0]=4 3142 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(C)O 7a_100009858536_100011218427 [0,1,0,0,0,1|2,0,0]=4 3143 B15R1.1803 COc1cc(c(cc1Cl)C)NC[C@@H](C)O 2230a_100009858536_100009817552 [0,1,0,0,0,1|2,0,0]=4 3144 B15R1.1803 COc1cc(c(cc1Cl)C)NC[C@@H](C)O 34a_100009858536_100009817552 [0,1,0,0,0,1|2,0,0]=4 3145 B15R1.1803 COc1cc(c(cc1Cl)C)NC[C@@H](C)O 7a_100009858536_100009817552 [0,1,0,0,0,1|2,0,0]=4 3146 B15R1.1803 COc1cc(c(cc1Cl)Cl)NCC(C)C 34a_100011830341_100000210624 [0,1,0,0,0,1|2,0,0]=4 3147 B15R1.1803 COc1cc(c(cc1Cl)Cl)NCC(C)O 34a_100011830341_100011218427 [0,1,0,0,0,1|2,0,0]=4 3148 B15R1.1803 COc1cc(c(cc1Cl)Cl)NC[C@@H](C)O 34a_100011830341_100009817552 [0,1,0,0,0,1|2,0,0]=4 3149 B15R1.1803 COc1cc(c(cc1Cl)F)CNC(C)C 207a_100138425928_100000050388 [0,1,0,0,0,1|2,0,0]=4 3150 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(C)C 34a_100009872666_100000210624 [0,1,0,0,0,1|2,0,0]=4 3151 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(C)C 7a_100009872666_100000210760 [0,1,0,0,0,1|2,0,0]=4 3152 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(C)O 34a_100009872666_100011218427 [0,1,0,0,0,1|2,0,0]=4 3153 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(C)O 7a_100009872666_100011218427 [0,1,0,0,0,1|2,0,0]=4 3154 B15R1.1803 COc1cc(c(cc1Cl)F)NC[C@@H](C)O 34a_100009872666_100009817552 [0,1,0,0,0,1|2,0,0]=4 3155 B15R1.1803 COc1cc(c(cc1Cl)F)NC[C@@H](C)O 7a_100009872666_100009817552 [0,1,0,0,0,1|2,0,0]=4 3156 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(C)C 62a_100000210624_100010739614 [0,1,0,0,0,1|2,0,0]=4 3157 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(C)C 62a_100010739614_100000210760 [0,1,0,0,0,1|2,0,0]=4 3158 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(C)O 62a_100010739614_100011218427 [0,1,0,0,0,1|2,0,0]=4 3159 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(C)O 62a_100011218427_100010739614 [0,1,0,0,0,1|2,0,0]=4 3160 B15R1.1803 COc1cc(c(cc1Cl)F)SC[C@@H](C)O 62a_100009817552_100010739614 [0,1,0,0,0,1|2,0,0]=4 3161 B15R1.1803 COc1cc(c(cc1Cl)F)SC[C@@H](C)O 62a_100010739614_100009817552 [0,1,0,0,0,1|2,0,0]=4 3162 B15R1.1803 COc1cc(c(cc1F)Br)CNC(C)C 207a_100138425928_100010366953 [0,1,0,0,0,1|2,0,0]=4 3163 B15R1.1803 COc1cc(c(cc1F)Br)NCC(C)C 34a_100010208193_100000210624 [0,1,0,0,0,1|2,0,0]=4 3164 B15R1.1803 COc1cc(c(cc1F)Br)NCC(C)C 7a_100010208193_100000210760 [0,1,0,0,0,1|2,0,0]=4 3165 B15R1.1803 COc1cc(c(cc1F)Br)NCC(C)O 34a_100010208193_100011218427 [0,1,0,0,0,1|2,0,0]=4 3166 B15R1.1803 COc1cc(c(cc1F)Br)NCC(C)O 7a_100010208193_100011218427 [0,1,0,0,0,1|2,0,0]=4 3167 B15R1.1803 COc1cc(c(cc1F)Br)NC[C@@H](C)O 34a_100010208193_100009817552 [0,1,0,0,0,1|2,0,0]=4 3168 B15R1.1803 COc1cc(c(cc1F)Br)NC[C@@H](C)O 7a_100010208193_100009817552 [0,1,0,0,0,1|2,0,0]=4 3169 B15R1.1803 COc1cc(c(cc1F)C)SCC(C)C 62a_100000210624_100011009880 [0,1,0,0,0,1|2,0,0]=4 3170 B15R1.1803 COc1cc(c(cc1F)C)SCC(C)C 62a_100011009880_100000210760 [0,1,0,0,0,1|2,0,0]=4 3171 B15R1.1803 COc1cc(c(cc1F)C)SCC(C)O 62a_100011009880_100011218427 [0,1,0,0,0,1|2,0,0]=4 3172 B15R1.1803 COc1cc(c(cc1F)C)SCC(C)O 62a_100011218427_100011009880 [0,1,0,0,0,1|2,0,0]=4 3173 B15R1.1803 COc1cc(c(cc1F)C)SC[C@@H](C)O 62a_100009817552_100011009880 [0,1,0,0,0,1|2,0,0]=4 3174 B15R1.1803 COc1cc(c(cc1F)C)SC[C@@H](C)O 62a_100011009880_100009817552 [0,1,0,0,0,1|2,0,0]=4 3175 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(C)C 34a_100009958774_100000210624 [0,1,0,0,0,1|2,0,0]=4 3176 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(C)C 7a_100009958774_100000210760 [0,1,0,0,0,1|2,0,0]=4 3177 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(C)O 34a_100009958774_100011218427 [0,1,0,0,0,1|2,0,0]=4 3178 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(C)O 7a_100009958774_100011218427 [0,1,0,0,0,1|2,0,0]=4 3179 B15R1.1803 COc1cc(c(cc1F)Cl)NC[C@@H](C)O 34a_100009958774_100009817552 [0,1,0,0,0,1|2,0,0]=4 3180 B15R1.1803 COc1cc(c(cc1F)Cl)NC[C@@H](C)O 7a_100009958774_100009817552 [0,1,0,0,0,1|2,0,0]=4 3181 B15R1.1803 COc1cc(c(cc1F)F)CNC(C)C 207a_100138425928_100010630602 [0,1,0,0,0,1|2,0,0]=4 3182 B15R1.1803 COc1cc(c(cc1F)F)SCC(C)C 62a_100000210624_200015541288 [0,1,0,0,0,1|2,0,0]=4 3183 B15R1.1803 COc1cc(c(cc1F)F)SCC(C)C 62a_200015541288_100000210760 [0,1,0,0,0,1|2,0,0]=4 3184 B15R1.1803 COc1cc(c(cc1F)F)SCC(C)O 62a_100011218427_200015541288 [0,1,0,0,0,1|2,0,0]=4 3185 B15R1.1803 COc1cc(c(cc1F)F)SCC(C)O 62a_200015541288_100011218427 [0,1,0,0,0,1|2,0,0]=4 3186 B15R1.1803 COc1cc(c(cc1F)F)SC[C@@H](C)O 62a_100009817552_200015541288 [0,1,0,0,0,1|2,0,0]=4 3187 B15R1.1803 COc1cc(c(cc1F)F)SC[C@@H](C)O 62a_200015541288_100009817552 [0,1,0,0,0,1|2,0,0]=4 3188 B15R1.1803 COc1cc(c(cc1F)N)SCC(C)C 62a_100000210624_100010365326 [0,1,0,0,0,1|2,0,0]=4 3189 B15R1.1803 COc1cc(c(cc1F)N)SCC(C)C 62a_100010365326_100000210760 [0,1,0,0,0,1|2,0,0]=4 3190 B15R1.1803 COc1cc(c(cc1F)N)SCC(C)O 62a_100010365326_100011218427 [0,1,0,0,0,1|2,0,0]=4 3191 B15R1.1803 COc1cc(c(cc1F)N)SCC(C)O 62a_100011218427_100010365326 [0,1,0,0,0,1|2,0,0]=4 3192 B15R1.1803 COc1cc(c(cc1F)N)SC[C@@H](C)O 62a_100009817552_100010365326 [0,1,0,0,0,1|2,0,0]=4 3193 B15R1.1803 COc1cc(c(cc1F)N)SC[C@@H](C)O 62a_100010365326_100009817552 [0,1,0,0,0,1|2,0,0]=4 3194 B15R1.1803 COc1cc(c(cc1N)C)SCC(C)C 62a_100000210624_100010141321 [0,1,0,0,0,1|2,0,0]=4 3195 B15R1.1803 COc1cc(c(cc1N)C)SCC(C)C 62a_100010141321_100000210760 [0,1,0,0,0,1|2,0,0]=4 3196 B15R1.1803 COc1cc(c(cc1N)C)SCC(C)O 62a_100010141321_100011218427 [0,1,0,0,0,1|2,0,0]=4 3197 B15R1.1803 COc1cc(c(cc1N)C)SCC(C)O 62a_100011218427_100010141321 [0,1,0,0,0,1|2,0,0]=4 3198 B15R1.1803 COc1cc(c(cc1N)C)SC[C@@H](C)O 62a_100009817552_100010141321 [0,1,0,0,0,1|2,0,0]=4 3199 B15R1.1803 COc1cc(c(cc1N)C)SC[C@@H](C)O 62a_100010141321_100009817552 [0,1,0,0,0,1|2,0,0]=4 3200 B15R1.1803 COc1cc(c(cc1N)F)SCC(C)C 62a_100000210624_100012766639 [0,1,0,0,0,1|2,0,0]=4 3201 B15R1.1803 COc1cc(c(cc1N)F)SCC(C)C 62a_100012766639_100000210760 [0,1,0,0,0,1|2,0,0]=4 3202 B15R1.1803 COc1cc(c(cc1N)F)SCC(C)O 62a_100011218427_100012766639 [0,1,0,0,0,1|2,0,0]=4 3203 B15R1.1803 COc1cc(c(cc1N)F)SCC(C)O 62a_100012766639_100011218427 [0,1,0,0,0,1|2,0,0]=4 3204 B15R1.1803 COc1cc(c(cc1N)F)SC[C@@H](C)O 62a_100009817552_100012766639 [0,1,0,0,0,1|2,0,0]=4 3205 B15R1.1803 COc1cc(c(cc1N)F)SC[C@@H](C)O 62a_100012766639_100009817552 [0,1,0,0,0,1|2,0,0]=4 3206 B15R1.1803 COc1cc(c(cc1O)F)C=CC(C)C 271570a_100016257149_100010189133 [0,1,0,0,0,1|1,0,1]=4 3207 B15R1.1803 COc1cc(c(cc1O)F)C=CC(C)O 271570a_200011019289_100010189133 [0,1,0,0,0,1|1,0,1]=4 3208 B15R1.1803 COc1cc(c(cc1O)F)SCC(=O)N 62a_100000747473_100010189133 [0,1,0,0,0,1|1,0,1]=4 3209 B15R1.1803 COc1cc(c(cc1O)F)SCC(C)C 62a_100000210624_100010189133 [0,1,0,0,0,1|1,0,0]=3 3210 B15R1.1803 COc1cc(c(cc1O)F)SCC(C)O 62a_100011218427_100010189133 [0,1,0,0,0,1|1,0,0]=3 3211 B15R1.1803 COc1cc(c(cc1O)F)SCC(F)F 62a_100011934356_100010189133 [0,1,0,0,0,1|2,0,0]=4 3212 B15R1.1803 COc1cc(c(cc1O)F)SC[C@@H](C)O 62a_100009817552_100010189133 [0,1,0,0,0,1|1,0,0]=3 3213 B15R1.4027 CCc1cc(ccc1O)SCC(C)(C)C 62a_100011219605_100012338938 [0,1,0,0,0,1|2,0,0]=4 3214 B15R1.4027 CCc1cc(ccc1O)SCC(C)(C)F 62a_100011997219_100012338938 [0,1,0,0,0,1|2,0,0]=4 3215 B15R1.4027 CCc1cc(ccc1O)SCC(C)(C)O 62a_100000764493_100012338938 [0,1,0,0,0,1|2,0,0]=4 3216 B15R1.4027 COc1cc(ccc1Br)CNC(C)(C)C 207a_100000715429_100010244714 [0,1,0,0,0,1|2,0,0]=4 3217 B15R1.4027 COc1cc(ccc1Br)CNC(C)(C)C 2230a_100000715429_100010110085 [0,1,0,0,0,1|2,0,0]=4 3218 B15R1.4027 COc1cc(ccc1Br)COC(C)(C)C 34a_100010234685_100000210625 [0,1,0,0,0,1|2,0,0]=4 3219 B15R1.4027 COc1cc(ccc1Br)COC(C)(C)C 34a_100015890283_100010110085 [0,1,0,0,0,1|2,0,0]=4 3220 B15R1.4027 COc1cc(ccc1Br)COC(C)(C)C 7a_100015890283_100010110085 [0,1,0,0,0,1|2,0,0]=4 3221 B15R1.4027 COc1cc(ccc1Br)CSC(C)(C)C 62a_100000211941_100010110085 [0,1,0,0,0,1|2,0,0]=4 3222 B15R1.4027 COc1cc(ccc1Br)CSC(C)(C)C 62a_100010110085_100000211941 [0,1,0,0,0,1|2,0,0]=4 3223 B15R1.4027 COc1cc(ccc1Br)NCC(C)(C)C 34a_100000765947_100011219605 [0,1,0,0,0,1|2,0,0]=4 3224 B15R1.4027 COc1cc(ccc1Br)NCC(C)(C)F 34a_100000765947_100011997219 [0,1,0,0,0,1|2,0,0]=4 3225 B15R1.4027 COc1cc(ccc1Br)NCC(C)(C)O 34a_100000765947_100000764493 [0,1,0,0,0,1|2,0,0]=4 3226 B15R1.4027 COc1cc(ccc1Br)OCC(C)(C)C 34a_100011827694_100011219605 [0,1,0,0,0,1|2,0,0]=4 3227 B15R1.4027 COc1cc(ccc1Br)OCC(C)(C)F 34a_100011827694_100011997219 [0,1,0,0,0,1|2,0,0]=4 3228 B15R1.4027 COc1cc(ccc1Br)OCC(C)(C)O 34a_100011827694_100000764493 [0,1,0,0,0,1|2,0,0]=4 3229 B15R1.4027 COc1cc(ccc1Br)OCC(C)(C)O 7a_100011827694_100000764493 [0,1,0,0,0,1|2,0,0]=4 3230 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)C 62a_100011219605_100012353699 [0,1,0,0,0,1|2,0,0]=4 3231 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)C 62a_100012353699_100011219605 [0,1,0,0,0,1|2,0,0]=4 3232 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)F 62a_100011997219_100012353699 [0,1,0,0,0,1|2,0,0]=4 3233 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)F 62a_100012353699_100011997219 [0,1,0,0,0,1|2,0,0]=4 3234 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)O 62a_100000764493_100012353699 [0,1,0,0,0,1|2,0,0]=4 3235 B15R1.4027 COc1cc(ccc1Br)SCC(C)(C)O 62a_100012353699_100000764493 [0,1,0,0,0,1|2,0,0]=4 3236 B15R1.4027 COc1cc(ccc1C)CNC(C)(C)C 207a_100000715429_100000719150 [0,1,0,0,0,1|2,0,0]=4 3237 B15R1.4027 COc1cc(ccc1C)COC(C)(C)C 34a_100000752651_100000210625 [0,1,0,0,0,1|2,0,0]=4 3238 B15R1.4027 COc1cc(ccc1C)NCC(C)(C)C 34a_100011279678_100011219605 [0,1,0,0,0,1|2,0,0]=4 3239 B15R1.4027 COc1cc(ccc1C)NCC(C)(C)F 34a_100011279678_100011997219 [0,1,0,0,0,1|2,0,0]=4 3240 B15R1.4027 COc1cc(ccc1C)NCC(C)(C)O 34a_100011279678_100000764493 [0,1,0,0,0,1|2,0,0]=4 3241 B15R1.4027 COc1cc(ccc1C)OCC(C)(C)C 34a_100009865632_100011219605 [0,1,0,0,0,1|2,0,0]=4 3242 B15R1.4027 COc1cc(ccc1C)OCC(C)(C)F 34a_100009865632_100011997219 [0,1,0,0,0,1|2,0,0]=4 3243 B15R1.4027 COc1cc(ccc1C)OCC(C)(C)O 34a_100009865632_100000764493 [0,1,0,0,0,1|2,0,0]=4 3244 B15R1.4027 COc1cc(ccc1C)OCC(C)(C)O 7a_100009865632_100000764493 [0,1,0,0,0,1|2,0,0]=4 3245 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)C 62a_100011219605_100011830276 [0,1,0,0,0,1|2,0,0]=4 3246 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)C 62a_100011830276_100011219605 [0,1,0,0,0,1|2,0,0]=4 3247 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)F 62a_100011830276_100011997219 [0,1,0,0,0,1|2,0,0]=4 3248 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)F 62a_100011997219_100011830276 [0,1,0,0,0,1|2,0,0]=4 3249 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)O 62a_100000764493_100011830276 [0,1,0,0,0,1|2,0,0]=4 3250 B15R1.4027 COc1cc(ccc1C)SCC(C)(C)O 62a_100011830276_100000764493 [0,1,0,0,0,1|2,0,0]=4 3251 B15R1.4027 COc1cc(ccc1Cl)CNC(C)(C)C 207a_100000715429_100011998524 [0,1,0,0,0,1|2,0,0]=4 3252 B15R1.4027 COc1cc(ccc1Cl)CNC(C)(C)C 2230a_100000715429_200010214485 [0,1,0,0,0,1|2,0,0]=4 3253 B15R1.4027 COc1cc(ccc1Cl)CNC(C)(C)C 34a_100015204853_100000210625 [0,1,0,0,0,1|2,0,0]=4 3254 B15R1.4027 COc1cc(ccc1Cl)COC(C)(C)C 34a_100012179228_100000210625 [0,1,0,0,0,1|2,0,0]=4 3255 B15R1.4027 COc1cc(ccc1Cl)COC(C)(C)C 34a_100015890283_200010214485 [0,1,0,0,0,1|2,0,0]=4 3256 B15R1.4027 COc1cc(ccc1Cl)COC(C)(C)C 7a_100015890283_200010214485 [0,1,0,0,0,1|2,0,0]=4 3257 B15R1.4027 COc1cc(ccc1Cl)CSC(C)(C)C 62a_100000211941_200010214485 [0,1,0,0,0,1|2,0,0]=4 3258 B15R1.4027 COc1cc(ccc1Cl)CSC(C)(C)C 62a_200010214485_100000211941 [0,1,0,0,0,1|2,0,0]=4 3259 B15R1.4027 COc1cc(ccc1Cl)NCC(C)(C)C 34a_100000742311_100011219605 [0,1,0,0,0,1|2,0,0]=4 3260 B15R1.4027 COc1cc(ccc1Cl)NCC(C)(C)F 34a_100000742311_100011997219 [0,1,0,0,0,1|2,0,0]=4 3261 B15R1.4027 COc1cc(ccc1Cl)NCC(C)(C)O 34a_100000742311_100000764493 [0,1,0,0,0,1|2,0,0]=4 3262 B15R1.4027 COc1cc(ccc1Cl)OCC(C)(C)C 34a_100012186310_100011219605 [0,1,0,0,0,1|2,0,0]=4 3263 B15R1.4027 COc1cc(ccc1Cl)OCC(C)(C)F 34a_100012186310_100011997219 [0,1,0,0,0,1|2,0,0]=4 3264 B15R1.4027 COc1cc(ccc1Cl)OCC(C)(C)O 34a_100012186310_100000764493 [0,1,0,0,0,1|2,0,0]=4 3265 B15R1.4027 COc1cc(ccc1Cl)OCC(C)(C)O 7a_100012186310_100000764493 [0,1,0,0,0,1|2,0,0]=4 3266 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)C 62a_100011219605_100011356853 [0,1,0,0,0,1|2,0,0]=4 3267 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)C 62a_100011356853_100011219605 [0,1,0,0,0,1|2,0,0]=4 3268 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)F 62a_100011356853_100011997219 [0,1,0,0,0,1|2,0,0]=4 3269 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)F 62a_100011997219_100011356853 [0,1,0,0,0,1|2,0,0]=4 3270 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)O 62a_100000764493_100011356853 [0,1,0,0,0,1|2,0,0]=4 3271 B15R1.4027 COc1cc(ccc1Cl)SCC(C)(C)O 62a_100011356853_100000764493 [0,1,0,0,0,1|2,0,0]=4 3272 B15R1.4027 COc1cc(ccc1F)CNC(C)(C)C 207a_100000715429_100000692873 [0,1,0,0,0,1|2,0,0]=4 3273 B15R1.4027 COc1cc(ccc1F)CNC(C)(C)C 2230a_100000715429_100012349856 [0,1,0,0,0,1|2,0,0]=4 3274 B15R1.4027 COc1cc(ccc1F)CNC(C)(C)C 34a_100020626639_100000210625 [0,1,0,0,0,1|2,0,0]=4 3275 B15R1.4027 COc1cc(ccc1F)COC(C)(C)C 34a_100000692429_100000210625 [0,1,0,0,0,1|2,0,0]=4 3276 B15R1.4027 COc1cc(ccc1F)COC(C)(C)C 34a_100015890283_100012349856 [0,1,0,0,0,1|2,0,0]=4 3277 B15R1.4027 COc1cc(ccc1F)COC(C)(C)C 7a_100015890283_100012349856 [0,1,0,0,0,1|2,0,0]=4 3278 B15R1.4027 COc1cc(ccc1F)CSC(C)(C)C 62a_100000211941_100012349856 [0,1,0,0,0,1|2,0,0]=4 3279 B15R1.4027 COc1cc(ccc1F)CSC(C)(C)C 62a_100012349856_100000211941 [0,1,0,0,0,1|2,0,0]=4 3280 B15R1.4027 COc1cc(ccc1F)NCC(C)(C)C 34a_100000701188_100011219605 [0,1,0,0,0,1|2,0,0]=4 3281 B15R1.4027 COc1cc(ccc1F)NCC(C)(C)F 34a_100000701188_100011997219 [0,1,0,0,0,1|2,0,0]=4 3282 B15R1.4027 COc1cc(ccc1F)NCC(C)(C)O 34a_100000701188_100000764493 [0,1,0,0,0,1|2,0,0]=4 3283 B15R1.4027 COc1cc(ccc1F)OCC(C)(C)C 34a_100012001760_100011219605 [0,1,0,0,0,1|2,0,0]=4 3284 B15R1.4027 COc1cc(ccc1F)OCC(C)(C)F 34a_100012001760_100011997219 [0,1,0,0,0,1|2,0,0]=4 3285 B15R1.4027 COc1cc(ccc1F)OCC(C)(C)O 34a_100012001760_100000764493 [0,1,0,0,0,1|2,0,0]=4 3286 B15R1.4027 COc1cc(ccc1F)OCC(C)(C)O 7a_100012001760_100000764493 [0,1,0,0,0,1|2,0,0]=4 3287 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)C 62a_100011219605_100011934186 [0,1,0,0,0,1|2,0,0]=4 3288 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)C 62a_100011934186_100011219605 [0,1,0,0,0,1|2,0,0]=4 3289 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)F 62a_100011934186_100011997219 [0,1,0,0,0,1|2,0,0]=4 3290 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)F 62a_100011997219_100011934186 [0,1,0,0,0,1|2,0,0]=4 3291 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)O 62a_100000764493_100011934186 [0,1,0,0,0,1|2,0,0]=4 3292 B15R1.4027 COc1cc(ccc1F)SCC(C)(C)O 62a_100011934186_100000764493 [0,1,0,0,0,1|2,0,0]=4 3293 B15R1.4027 COc1cc(ccc1I)NCC(C)(C)C 34a_100000746945_100011219605 [0,1,0,0,0,1|2,0,0]=4 3294 B15R1.4027 COc1cc(ccc1I)NCC(C)(C)F 34a_100000746945_100011997219 [0,1,0,0,0,1|2,0,0]=4 3295 B15R1.4027 COc1cc(ccc1I)NCC(C)(C)O 34a_100000746945_100000764493 [0,1,0,0,0,1|2,0,0]=4 3296 B15R1.4027 COc1cc(ccc1N)COC(C)(C)C 34a_100000087641_100000210625 [0,1,0,0,0,1|2,0,0]=4 3297 B15R1.4027 COc1cc(ccc1N)OCC(C)(C)C 34a_100015326901_100011219605 [0,1,0,0,0,1|2,0,0]=4 3298 B15R1.4027 COc1cc(ccc1N)OCC(C)(C)F 34a_100015326901_100011997219 [0,1,0,0,0,1|2,0,0]=4 3299 B15R1.4027 COc1cc(ccc1N)OCC(C)(C)O 34a_100015326901_100000764493 [0,1,0,0,0,1|2,0,0]=4 3300 B15R1.4027 COc1cc(ccc1N)OCC(C)(C)O 7a_100015326901_100000764493 [0,1,0,0,0,1|2,0,0]=4 3301 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)C 62a_100011219605_100015196925 [0,1,0,0,0,1|2,0,0]=4 3302 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)C 62a_100011279103_100011219605 [0,1,0,0,0,1|2,0,0]=4 3303 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)F 62a_100011279103_100011997219 [0,1,0,0,0,1|2,0,0]=4 3304 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)F 62a_100011997219_100015196925 [0,1,0,0,0,1|2,0,0]=4 3305 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)O 62a_100000764493_100015196925 [0,1,0,0,0,1|2,0,0]=4 3306 B15R1.4027 COc1cc(ccc1N)SCC(C)(C)O 62a_100011279103_100000764493 [0,1,0,0,0,1|2,0,0]=4 3307 B15R1.4027 COc1cc(ccc1O)C=CC(C)(C)C 271570a_100102527731_100000694246 [0,1,0,0,0,1|1,0,1]=4 3308 B15R1.4027 COc1cc(ccc1O)C=CC(C)(C)O 271570a_200016258132_100000694246 [0,1,0,0,0,1|1,0,1]=4 3309 B15R1.4027 COc1cc(ccc1O)CNC(C)(C)C 34a_100000185554_100000210625 [0,1,0,0,0,1|1,0,0]=3 3310 B15R1.4027 COc1cc(ccc1O)CNC(F)(F)F 34a_100000185554_200103152311 [0,1,0,0,0,1|2,0,0]=4 3311 B15R1.4027 COc1cc(ccc1O)CNS(=O)(=O)C 40a_100000185554_100000738038 [0,1,0,0,0,1|2,0,0]=4 3312 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)C 34a_100000726020_100011219605 [0,1,0,0,0,1|1,0,0]=3 3313 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)F 34a_100000726020_100011997219 [0,1,0,0,0,1|1,0,0]=3 3314 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)O 34a_100000726020_100000764493 [0,1,0,0,0,1|1,0,0]=3 3315 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)C 62a_100011219605_100000694246 [0,1,0,0,0,1|1,0,0]=3 3316 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)F 62a_100011997219_100000694246 [0,1,0,0,0,1|1,0,0]=3 3317 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)O 62a_100000764493_100000694246 [0,1,0,0,0,1|1,0,0]=3 3318 B15R1.4027 COc1cc(ccc1O)SCC(F)(F)F 62a_100000763148_100000694246 [0,1,0,0,0,1|2,0,0]=4 3319 B15R1.4027 COc1cc(ccc1O)SCS(=O)(=O)N 62a_100000741382_100000694246 [0,1,0,0,0,1|2,0,0]=4 3320 B15R1.4027 COc1cc(ccc1O)SC[N+](C)(C)C 62a_200000036245_100000694246 [0,1,0,0,0,1|2,0,0]=4 3321 B15R1.4027 COc1cc(ccc1O)SC[Si](C)(C)C 62a_100000037933_100000694246 [0,1,0,0,0,1|1,1,0]=4 3322 B15R1.4027 COc1nc(ccc1O)SCC(C)(C)C 62a_100011219605_100010893133 [0,1,0,0,0,1|2,0,0]=4 3323 B15R1.4027 COc1nc(ccc1O)SCC(C)(C)F 62a_100011997219_100010893133 [0,1,0,0,0,1|2,0,0]=4 3324 B15R1.4027 COc1nc(ccc1O)SCC(C)(C)O 62a_100000764493_100010893133 [0,1,0,0,0,1|2,0,0]=4 3325 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000748629 [0,1,0,0,0,1|1,0,1]=4 3326 B15R1.4037 CCc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100012338938 [0,1,0,0,0,1|2,0,0]=4 3327 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(C)C 1458a_100011934951_100000210624 [0,1,0,0,0,1|2,0,0]=4 3328 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(C)O 1458a_100011934951_100011218427 [0,1,0,0,0,1|2,0,0]=4 3329 B15R1.4037 COc1cc(ccc1Br)[C@@H](N)CC(C)C 271570a_100015190218_100012353699 [0,1,0,0,0,1|2,0,0]=4 3330 B15R1.4037 COc1cc(ccc1C)C(=O)CC(C)C 1458a_100000212341_100000210624 [0,1,0,0,0,1|2,0,0]=4 3331 B15R1.4037 COc1cc(ccc1C)C(=O)CC(C)O 1458a_100000212341_100011218427 [0,1,0,0,0,1|2,0,0]=4 3332 B15R1.4037 COc1cc(ccc1C)[C@@H](N)CC(C)C 271570a_100015190218_100011830276 [0,1,0,0,0,1|2,0,0]=4 3333 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(C)C 1458a_100000181799_100000210624 [0,1,0,0,0,1|2,0,0]=4 3334 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(C)O 1458a_100000181799_100011218427 [0,1,0,0,0,1|2,0,0]=4 3335 B15R1.4037 COc1cc(ccc1Cl)[C@@H](N)CC(C)C 271570a_100015190218_100011356853 [0,1,0,0,0,1|2,0,0]=4 3336 B15R1.4037 COc1cc(ccc1F)C(=O)CC(C)C 1458a_100000757635_100000210624 [0,1,0,0,0,1|2,0,0]=4 3337 B15R1.4037 COc1cc(ccc1F)C(=O)CC(C)O 1458a_100000757635_100011218427 [0,1,0,0,0,1|2,0,0]=4 3338 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)C 2230a_200012002703_100000210760 [0,1,0,0,0,1|2,0,0]=4 3339 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)C 269982a_200012002703_100000210624 [0,1,0,0,0,1|2,0,0]=4 3340 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)C 34a_200012002703_100000210624 [0,1,0,0,0,1|2,0,0]=4 3341 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)C 38a_200012002703_100000210624 [0,1,0,0,0,1|2,0,0]=4 3342 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)O 2230a_200012002703_100011218427 [0,1,0,0,0,1|2,0,0]=4 3343 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)O 269982a_200012002703_100011218427 [0,1,0,0,0,1|2,0,0]=4 3344 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)O 34a_200012002703_100011218427 [0,1,0,0,0,1|2,0,0]=4 3345 B15R1.4037 COc1cc(ccc1F)N(C)CC(C)O 38a_200012002703_100011218427 [0,1,0,0,0,1|2,0,0]=4 3346 B15R1.4037 COc1cc(ccc1F)N(C)C[C@@H](C)O 2230a_200012002703_100009817552 [0,1,0,0,0,1|2,0,0]=4 3347 B15R1.4037 COc1cc(ccc1F)N(C)C[C@@H](C)O 269982a_200012002703_100009817552 [0,1,0,0,0,1|2,0,0]=4 3348 B15R1.4037 COc1cc(ccc1F)N(C)C[C@@H](C)O 34a_200012002703_100009817552 [0,1,0,0,0,1|2,0,0]=4 3349 B15R1.4037 COc1cc(ccc1F)[C@@H](N)CC(C)C 271570a_100015190218_100011934186 [0,1,0,0,0,1|2,0,0]=4 3350 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(C)C 2230a_100025717271_100000210206 [0,1,0,0,0,1|2,0,0]=4 3351 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(C)C 34a_100025717271_100000210206 [0,1,0,0,0,1|2,0,0]=4 3352 B15R1.4037 COc1cc(ccc1I)C(=O)CC(C)C 1458a_100012356290_100000210624 [0,1,0,0,0,1|2,0,0]=4 3353 B15R1.4037 COc1cc(ccc1I)C(=O)CC(C)O 1458a_100012356290_100011218427 [0,1,0,0,0,1|2,0,0]=4 3354 B15R1.4037 COc1cc(ccc1N)[C@@H](N)CC(C)C 271570a_100015190218_100011279103 [0,1,0,0,0,1|2,0,0]=4 3355 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)C 1458a_100000070787_100010206313 [0,1,0,0,0,1|1,0,1]=4 3356 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)N 1458a_100000687070_100000187820 [0,1,0,0,0,1|1,0,1]=4 3357 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)C 1458a_100000687070_100000210624 [0,1,0,0,0,1|1,0,0]=3 3358 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)O 1458a_100000687070_100011218427 [0,1,0,0,0,1|1,0,0]=3 3359 B15R1.4037 COc1cc(ccc1O)C(=O)CC(F)F 1458a_100000687070_100011934356 [0,1,0,0,0,1|2,0,0]=4 3360 B15R1.4037 COc1cc(ccc1O)C(=O)CN(C)C 269982a_100102631434_100010206313 [0,1,0,0,0,1|2,0,0]=4 3361 B15R1.4037 COc1cc(ccc1O)C(=O)NC(C)C 240690a_100138425928_100000687070 [0,1,0,0,0,1|1,0,1]=4 3362 B15R1.4037 COc1cc(ccc1O)C(=O)NC(C)C 271570a_203496583355_200010239583 [0,1,0,0,0,1|1,0,1]=4 3363 B15R1.4037 COc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000694246 [0,1,0,0,0,1|1,0,0]=3 3364 B15R1.4037 COc1nc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100010893133 [0,1,0,0,0,1|2,0,0]=4 3365 B15R1.4038 COc1cc(ccc1Br)CC(=O)C(C)C 1458a_100000210198_100010110085 [0,1,0,0,0,1|2,0,0]=4 3366 B15R1.4038 COc1cc(ccc1Br)CC(=O)C(C)C 1458a_200010002685_100000210206 [0,1,0,0,0,1|2,0,0]=4 3367 B15R1.4038 COc1cc(ccc1Br)CC(=O)C(C)F 1458a_100000062450_100010110085 [0,1,0,0,0,1|2,0,0]=4 3368 B15R1.4038 COc1cc(ccc1Br)CC(=O)[C@@H](C)O 1458a_100000717761_100010110085 [0,1,0,0,0,1|2,0,0]=4 3369 B15R1.4038 COc1cc(ccc1Br)CC(=O)[C@H](C)O 1458a_217856618621_100010110085 [0,1,0,0,0,1|2,0,0]=4 3370 B15R1.4038 COc1cc(ccc1Br)CN(C)C(C)C 269982a_200000211004_100010110085 [0,1,0,0,0,1|2,0,0]=4 3371 B15R1.4038 COc1cc(ccc1Br)CN(C)C(C)C 270004a_200000211004_100010244714 [0,1,0,0,0,1|2,0,0]=4 3372 B15R1.4038 COc1cc(ccc1C)CN(C)C(C)C 270004a_200000211004_100000719150 [0,1,0,0,0,1|2,0,0]=4 3373 B15R1.4038 COc1cc(ccc1Cl)CC(=O)C(C)C 1458a_100000210198_200010214485 [0,1,0,0,0,1|2,0,0]=4 3374 B15R1.4038 COc1cc(ccc1Cl)CC(=O)C(C)F 1458a_100000062450_200010214485 [0,1,0,0,0,1|2,0,0]=4 3375 B15R1.4038 COc1cc(ccc1Cl)CC(=O)[C@@H](C)O 1458a_100000717761_200010214485 [0,1,0,0,0,1|2,0,0]=4 3376 B15R1.4038 COc1cc(ccc1Cl)CC(=O)[C@H](C)O 1458a_217856618621_200010214485 [0,1,0,0,0,1|2,0,0]=4 3377 B15R1.4038 COc1cc(ccc1Cl)CN(C)C(C)C 269982a_200000211004_200010214485 [0,1,0,0,0,1|2,0,0]=4 3378 B15R1.4038 COc1cc(ccc1Cl)CN(C)C(C)C 270004a_200000211004_100011998524 [0,1,0,0,0,1|2,0,0]=4 3379 B15R1.4038 COc1cc(ccc1F)CC(=O)C(C)C 1458a_100000117344_100000210206 [0,1,0,0,0,1|2,0,0]=4 3380 B15R1.4038 COc1cc(ccc1F)CC(=O)C(C)C 1458a_100000210198_100012349856 [0,1,0,0,0,1|2,0,0]=4 3381 B15R1.4038 COc1cc(ccc1F)CC(=O)C(C)F 1458a_100000062450_100012349856 [0,1,0,0,0,1|2,0,0]=4 3382 B15R1.4038 COc1cc(ccc1F)CC(=O)[C@@H](C)O 1458a_100000717761_100012349856 [0,1,0,0,0,1|2,0,0]=4 3383 B15R1.4038 COc1cc(ccc1F)CC(=O)[C@H](C)O 1458a_217856618621_100012349856 [0,1,0,0,0,1|2,0,0]=4 3384 B15R1.4038 COc1cc(ccc1F)CN(C)C(C)C 269982a_200000211004_100012349856 [0,1,0,0,0,1|2,0,0]=4 3385 B15R1.4038 COc1cc(ccc1F)CN(C)C(C)C 270004a_200000211004_100000692873 [0,1,0,0,0,1|2,0,0]=4 3386 B15R1.4038 COc1cc(ccc1O)CC(=O)C(C)C 1458a_100000032101_100000210206 [0,1,0,0,0,1|1,0,0]=3 3387 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 240690a_100102631434_100000032101 [0,1,0,0,0,1|2,0,0]=4 3388 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 527a_100102631434_100000032101 [0,1,0,0,0,1|2,0,0]=4 3389 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)C 22a_100000726020_100000210198 [0,1,0,0,0,1|1,0,1]=4 3390 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)C 527a_100000726020_100000210198 [0,1,0,0,0,1|1,0,1]=4 3391 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)F 22a_100000726020_100000062450 [0,1,0,0,0,1|1,0,1]=4 3392 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)F 527a_100000726020_100000062450 [0,1,0,0,0,1|1,0,1]=4 3393 B15R1.4038 COc1cc(ccc1O)NC(=O)[C@@H](C)O 22a_100000726020_100000717761 [0,1,0,0,0,1|1,0,1]=4 3394 B15R1.4038 COc1cc(ccc1O)NC(=O)[C@H](C)O 22a_100000726020_217856618621 [0,1,0,0,0,1|1,0,1]=4 3395 B15R1.4038 COc1cc(ccc1O)NC(C)C(=O)N 34a_100000726020_100000702099 [0,1,0,0,0,1|1,0,1]=4 3396 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)N 34a_100000726020_100009813875 [0,1,0,0,0,1|1,0,1]=4 3397 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100000694246 [0,1,0,0,0,1|1,0,1]=4 3398 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000694246 [0,1,0,0,0,1|1,0,1]=4 3399 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000694246 [0,1,0,0,0,1|1,0,1]=4 3400 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Br 2230a_100000707721_100010110085 [0,1,0,0,0,1|2,0,0]=4 3401 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Br 270004a_100000707721_100010244714 [0,1,0,0,0,1|2,0,0]=4 3402 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Br 34a_100000707721_100010110085 [0,1,0,0,0,1|2,0,0]=4 3403 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)C 270004a_100000707721_100000719150 [0,1,0,0,0,1|2,0,0]=4 3404 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Cl 2230a_100000707721_200010214485 [0,1,0,0,0,1|2,0,0]=4 3405 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Cl 270004a_100000707721_100011998524 [0,1,0,0,0,1|2,0,0]=4 3406 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Cl 34a_100000707721_200010214485 [0,1,0,0,0,1|2,0,0]=4 3407 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)Cl 34a_100015204853_200000035995 [0,1,0,0,0,1|2,0,0]=4 3408 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)F 2230a_100000707721_100012349856 [0,1,0,0,0,1|2,0,0]=4 3409 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)F 270004a_100000707721_100000692873 [0,1,0,0,0,1|2,0,0]=4 3410 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)F 34a_100000707721_100012349856 [0,1,0,0,0,1|2,0,0]=4 3411 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)F 34a_100020626639_200000035995 [0,1,0,0,0,1|2,0,0]=4 3412 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_200000035995 [0,1,0,0,0,1|1,0,0]=3 3413 B15R1.4039 C#CC(C)OCc1ccc(c(c1)OC)Br 34a_100010234685_200000035995 [0,1,0,0,0,1|2,0,0]=4 3414 B15R1.4039 C#CC(C)OCc1ccc(c(c1)OC)C 34a_100000752651_200000035995 [0,1,0,0,0,1|2,0,0]=4 3415 B15R1.4039 C#CC(C)OCc1ccc(c(c1)OC)Cl 34a_100012179228_200000035995 [0,1,0,0,0,1|2,0,0]=4 3416 B15R1.4039 C#CC(C)OCc1ccc(c(c1)OC)F 34a_100000692429_200000035995 [0,1,0,0,0,1|2,0,0]=4 3417 B15R1.4039 C#CC(C)OCc1ccc(c(c1)OC)N 34a_100000087641_200000035995 [0,1,0,0,0,1|2,0,0]=4 3418 B15R1.4039 C#CC(C)SCc1ccc(c(c1)OC)Br 62a_200000035995_100010110085 [0,1,0,0,0,1|2,0,0]=4 3419 B15R1.4039 C#CC(C)SCc1ccc(c(c1)OC)Cl 62a_200000035995_200010214485 [0,1,0,0,0,1|2,0,0]=4 3420 B15R1.4039 C#CC(C)SCc1ccc(c(c1)OC)F 62a_200000035995_100012349856 [0,1,0,0,0,1|2,0,0]=4 3421 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)Br 34a_100009815206_100010110085 [0,1,0,0,0,1|2,0,0]=4 3422 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)Br 7a_100009815206_100010110085 [0,1,0,0,0,1|2,0,0]=4 3423 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)Cl 34a_100009815206_200010214485 [0,1,0,0,0,1|2,0,0]=4 3424 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)Cl 7a_100009815206_200010214485 [0,1,0,0,0,1|2,0,0]=4 3425 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)F 34a_100009815206_100012349856 [0,1,0,0,0,1|2,0,0]=4 3426 B15R1.4039 C#C[C@@H](C)OCc1ccc(c(c1)OC)F 7a_100009815206_100012349856 [0,1,0,0,0,1|2,0,0]=4 3427 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)Br 34a_100000695699_100010110085 [0,1,0,0,0,1|2,0,0]=4 3428 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)Cl 34a_100000695699_200010214485 [0,1,0,0,0,1|2,0,0]=4 3429 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)F 34a_100000695699_100012349856 [0,1,0,0,0,1|2,0,0]=4 3430 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)Br 62a_100011215867_100010110085 [0,1,0,0,0,1|2,0,0]=4 3431 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)Cl 62a_100011215867_200010214485 [0,1,0,0,0,1|2,0,0]=4 3432 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)F 62a_100011215867_100012349856 [0,1,0,0,0,1|2,0,0]=4 3433 B15R1.4039 C=CC(O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000730141 [0,1,0,0,0,1|1,0,1]=4 3434 B15R1.4039 C=CC(O)CSc1ccc(c(c1)OC)O 62a_100000730141_100000694246 [0,1,0,0,0,1|1,0,1]=4 3435 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210414_100010741665 [0,1,0,0,0,1|1,0,1]=4 3436 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210202 [0,1,0,0,0,1|1,0,1]=4 3437 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)O 62a_100000747405_100000694246 [0,1,0,0,0,1|1,0,1]=4 3438 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210414 [0,1,0,0,0,1|1,0,1]=4 3439 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210414 [0,1,0,0,0,1|1,0,1]=4 3440 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210414 [0,1,0,0,0,1|1,0,1]=4 3441 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748023 [0,1,0,0,0,1|2,0,0]=4 3442 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000748023 [0,1,0,0,0,1|2,0,0]=4 3443 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000748023 [0,1,0,0,0,1|2,0,0]=4 3444 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)C 34a_100011279678_100000748023 [0,1,0,0,0,1|2,0,0]=4 3445 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748023 [0,1,0,0,0,1|2,0,0]=4 3446 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748023 [0,1,0,0,0,1|2,0,0]=4 3447 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000748023 [0,1,0,0,0,1|2,0,0]=4 3448 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)F 34a_100000701188_100000748023 [0,1,0,0,0,1|2,0,0]=4 3449 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)I 34a_100000746945_100000748023 [0,1,0,0,0,1|2,0,0]=4 3450 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748023 [0,1,0,0,0,1|1,0,0]=3 3451 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)Br 34a_100011827694_100000748023 [0,1,0,0,0,1|2,0,0]=4 3452 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)Br 7a_100011827694_100000748023 [0,1,0,0,0,1|2,0,0]=4 3453 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)C 34a_100009865632_100000748023 [0,1,0,0,0,1|2,0,0]=4 3454 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)C 7a_100009865632_100000748023 [0,1,0,0,0,1|2,0,0]=4 3455 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000748023 [0,1,0,0,0,1|2,0,0]=4 3456 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000748023 [0,1,0,0,0,1|2,0,0]=4 3457 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)F 34a_100012001760_100000748023 [0,1,0,0,0,1|2,0,0]=4 3458 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)F 7a_100012001760_100000748023 [0,1,0,0,0,1|2,0,0]=4 3459 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)N 34a_100015326901_100000748023 [0,1,0,0,0,1|2,0,0]=4 3460 B15R1.4039 CCC(C)COc1ccc(c(c1)OC)N 7a_100015326901_100000748023 [0,1,0,0,0,1|2,0,0]=4 3461 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)Br 62a_100000748023_100012353699 [0,1,0,0,0,1|2,0,0]=4 3462 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000748023 [0,1,0,0,0,1|2,0,0]=4 3463 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)C 62a_100000748023_100011830276 [0,1,0,0,0,1|2,0,0]=4 3464 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)C 62a_100011830276_100000748023 [0,1,0,0,0,1|2,0,0]=4 3465 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)Cl 62a_100000748023_100011356853 [0,1,0,0,0,1|2,0,0]=4 3466 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000748023 [0,1,0,0,0,1|2,0,0]=4 3467 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)F 62a_100000748023_100011934186 [0,1,0,0,0,1|2,0,0]=4 3468 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)F 62a_100011934186_100000748023 [0,1,0,0,0,1|2,0,0]=4 3469 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)N 62a_100000748023_100015196925 [0,1,0,0,0,1|2,0,0]=4 3470 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)N 62a_100011279103_100000748023 [0,1,0,0,0,1|2,0,0]=4 3471 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)O 62a_100000748023_100000694246 [0,1,0,0,0,1|1,0,0]=3 3472 B15R1.4039 CCC(C)CSc1ccc(c(n1)OC)O 62a_100000748023_100010893133 [0,1,0,0,0,1|2,0,0]=4 3473 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Br 207a_100000209981_100010244714 [0,1,0,0,0,1|2,0,0]=4 3474 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Br 2230a_100000209981_100010110085 [0,1,0,0,0,1|2,0,0]=4 3475 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Br 270004a_100000209981_100010244714 [0,1,0,0,0,1|2,0,0]=4 3476 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)C 207a_100000209981_100000719150 [0,1,0,0,0,1|2,0,0]=4 3477 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)C 270004a_100000209981_100000719150 [0,1,0,0,0,1|2,0,0]=4 3478 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Cl 207a_100000209981_100011998524 [0,1,0,0,0,1|2,0,0]=4 3479 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Cl 2230a_100000209981_200010214485 [0,1,0,0,0,1|2,0,0]=4 3480 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000758301 [0,1,0,0,0,1|2,0,0]=4 3481 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Cl 270004a_100000209981_100011998524 [0,1,0,0,0,1|2,0,0]=4 3482 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)Cl 34a_100015204853_100011215416 [0,1,0,0,0,1|2,0,0]=4 3483 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)F 207a_100000209981_100000692873 [0,1,0,0,0,1|2,0,0]=4 3484 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)F 2230a_100000209981_100012349856 [0,1,0,0,0,1|2,0,0]=4 3485 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)F 2230a_100020626639_100000758301 [0,1,0,0,0,1|2,0,0]=4 3486 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)F 270004a_100000209981_100000692873 [0,1,0,0,0,1|2,0,0]=4 3487 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)F 34a_100020626639_100011215416 [0,1,0,0,0,1|2,0,0]=4 3488 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_100011215416 [0,1,0,0,0,1|1,0,0]=3 3489 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)Br 34a_100010234685_100011215416 [0,1,0,0,0,1|2,0,0]=4 3490 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)Br 7a_100000210228_100010110085 [0,1,0,0,0,1|2,0,0]=4 3491 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)Br 7a_100010234685_100000758301 [0,1,0,0,0,1|2,0,0]=4 3492 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)C 34a_100000752651_100011215416 [0,1,0,0,0,1|2,0,0]=4 3493 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)C 7a_100000752651_100000758301 [0,1,0,0,0,1|2,0,0]=4 3494 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)Cl 34a_100012179228_100011215416 [0,1,0,0,0,1|2,0,0]=4 3495 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)Cl 7a_100000210228_200010214485 [0,1,0,0,0,1|2,0,0]=4 3496 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)F 34a_100000692429_100011215416 [0,1,0,0,0,1|2,0,0]=4 3497 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)F 7a_100000210228_100012349856 [0,1,0,0,0,1|2,0,0]=4 3498 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)F 7a_100000692429_100000758301 [0,1,0,0,0,1|2,0,0]=4 3499 B15R1.4039 CCC(C)OCc1ccc(c(c1)OC)N 34a_100000087641_100011215416 [0,1,0,0,0,1|2,0,0]=4 3500 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)Br 62a_100000758301_100010110085 [0,1,0,0,0,1|2,0,0]=4 3501 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)Br 62a_100010110085_100000758301 [0,1,0,0,0,1|2,0,0]=4 3502 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)Cl 62a_100000758301_200010214485 [0,1,0,0,0,1|2,0,0]=4 3503 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)Cl 62a_200010214485_100000758301 [0,1,0,0,0,1|2,0,0]=4 3504 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)F 62a_100000758301_100012349856 [0,1,0,0,0,1|2,0,0]=4 3505 B15R1.4039 CCC(C)SCc1ccc(c(c1)OC)F 62a_100012349856_100000758301 [0,1,0,0,0,1|2,0,0]=4 3506 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100011218378 [0,1,0,0,0,1|2,0,0]=4 3507 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100011218378 [0,1,0,0,0,1|2,0,0]=4 3508 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100011218378 [0,1,0,0,0,1|2,0,0]=4 3509 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)C 34a_100011279678_100011218378 [0,1,0,0,0,1|2,0,0]=4 3510 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100011218378 [0,1,0,0,0,1|2,0,0]=4 3511 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100011218378 [0,1,0,0,0,1|2,0,0]=4 3512 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100011218378 [0,1,0,0,0,1|2,0,0]=4 3513 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)F 34a_100000701188_100011218378 [0,1,0,0,0,1|2,0,0]=4 3514 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)I 34a_100000746945_100011218378 [0,1,0,0,0,1|2,0,0]=4 3515 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)O 34a_100000726020_100011218378 [0,1,0,0,0,1|1,0,0]=3 3516 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)Br 34a_100011827694_100011218378 [0,1,0,0,0,1|2,0,0]=4 3517 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)Br 7a_100011827694_100011218378 [0,1,0,0,0,1|2,0,0]=4 3518 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)C 34a_100009865632_100011218378 [0,1,0,0,0,1|2,0,0]=4 3519 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)C 7a_100009865632_100011218378 [0,1,0,0,0,1|2,0,0]=4 3520 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100011218378 [0,1,0,0,0,1|2,0,0]=4 3521 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100011218378 [0,1,0,0,0,1|2,0,0]=4 3522 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)F 34a_100012001760_100011218378 [0,1,0,0,0,1|2,0,0]=4 3523 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)F 7a_100012001760_100011218378 [0,1,0,0,0,1|2,0,0]=4 3524 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)N 34a_100015326901_100011218378 [0,1,0,0,0,1|2,0,0]=4 3525 B15R1.4039 CCC(O)COc1ccc(c(c1)OC)N 7a_100015326901_100011218378 [0,1,0,0,0,1|2,0,0]=4 3526 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)Br 62a_100011218378_100012353699 [0,1,0,0,0,1|2,0,0]=4 3527 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100011218378 [0,1,0,0,0,1|2,0,0]=4 3528 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)C 62a_100011218378_100011830276 [0,1,0,0,0,1|2,0,0]=4 3529 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)C 62a_100011830276_100011218378 [0,1,0,0,0,1|2,0,0]=4 3530 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)Cl 62a_100011218378_100011356853 [0,1,0,0,0,1|2,0,0]=4 3531 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100011218378 [0,1,0,0,0,1|2,0,0]=4 3532 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)F 62a_100011218378_100011934186 [0,1,0,0,0,1|2,0,0]=4 3533 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)F 62a_100011934186_100011218378 [0,1,0,0,0,1|2,0,0]=4 3534 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)N 62a_100011218378_100015196925 [0,1,0,0,0,1|2,0,0]=4 3535 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)N 62a_100011279103_100011218378 [0,1,0,0,0,1|2,0,0]=4 3536 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)O 62a_100011218378_100000694246 [0,1,0,0,0,1|1,0,0]=3 3537 B15R1.4039 CCC(O)CSc1ccc(c(n1)OC)O 62a_100011218378_100010893133 [0,1,0,0,0,1|2,0,0]=4 3538 B15R1.4039 CCN(C)CCc1ccc(c(c1)OC)O 2230a_100000225621_100010741665 [0,1,0,0,0,1|2,0,0]=4 3539 B15R1.4039 CCN(C)CCc1ccc(c(c1)OC)O 269982a_100000225621_100010741665 [0,1,0,0,0,1|2,0,0]=4 3540 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100009816398 [0,1,0,0,0,1|2,0,0]=4 3541 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100009816398 [0,1,0,0,0,1|2,0,0]=4 3542 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100009816398 [0,1,0,0,0,1|2,0,0]=4 3543 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)C 34a_100011279678_100009816398 [0,1,0,0,0,1|2,0,0]=4 3544 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100009816398 [0,1,0,0,0,1|2,0,0]=4 3545 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100009816398 [0,1,0,0,0,1|2,0,0]=4 3546 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100009816398 [0,1,0,0,0,1|2,0,0]=4 3547 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)F 34a_100000701188_100009816398 [0,1,0,0,0,1|2,0,0]=4 3548 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)I 34a_100000746945_100009816398 [0,1,0,0,0,1|2,0,0]=4 3549 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)O 34a_100000726020_100009816398 [0,1,0,0,0,1|1,0,0]=3 3550 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)Br 34a_100011827694_100009816398 [0,1,0,0,0,1|2,0,0]=4 3551 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)Br 7a_100011827694_100009816398 [0,1,0,0,0,1|2,0,0]=4 3552 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)C 34a_100009865632_100009816398 [0,1,0,0,0,1|2,0,0]=4 3553 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)C 7a_100009865632_100009816398 [0,1,0,0,0,1|2,0,0]=4 3554 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100009816398 [0,1,0,0,0,1|2,0,0]=4 3555 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100009816398 [0,1,0,0,0,1|2,0,0]=4 3556 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)F 34a_100012001760_100009816398 [0,1,0,0,0,1|2,0,0]=4 3557 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)F 7a_100012001760_100009816398 [0,1,0,0,0,1|2,0,0]=4 3558 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)N 34a_100015326901_100009816398 [0,1,0,0,0,1|2,0,0]=4 3559 B15R1.4039 CC[C@H](C)COc1ccc(c(c1)OC)N 7a_100015326901_100009816398 [0,1,0,0,0,1|2,0,0]=4 3560 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)Br 62a_100009816398_100012353699 [0,1,0,0,0,1|2,0,0]=4 3561 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100009816398 [0,1,0,0,0,1|2,0,0]=4 3562 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)C 62a_100009816398_100011830276 [0,1,0,0,0,1|2,0,0]=4 3563 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)C 62a_100011830276_100009816398 [0,1,0,0,0,1|2,0,0]=4 3564 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)Cl 62a_100009816398_100011356853 [0,1,0,0,0,1|2,0,0]=4 3565 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100009816398 [0,1,0,0,0,1|2,0,0]=4 3566 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)F 62a_100009816398_100011934186 [0,1,0,0,0,1|2,0,0]=4 3567 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)F 62a_100011934186_100009816398 [0,1,0,0,0,1|2,0,0]=4 3568 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)N 62a_100009816398_100015196925 [0,1,0,0,0,1|2,0,0]=4 3569 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)N 62a_100011279103_100009816398 [0,1,0,0,0,1|2,0,0]=4 3570 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)O 62a_100009816398_100000694246 [0,1,0,0,0,1|1,0,0]=3 3571 B15R1.4039 CC[C@H](C)CSc1ccc(c(n1)OC)O 62a_100009816398_100010893133 [0,1,0,0,0,1|2,0,0]=4 3572 B15R1.4039 CCc1cc(ccc1O)SCC(C)CC 62a_100000748023_100012338938 [0,1,0,0,0,1|2,0,0]=4 3573 B15R1.4039 CCc1cc(ccc1O)SCC(O)CC 62a_100011218378_100012338938 [0,1,0,0,0,1|2,0,0]=4 3574 B15R1.4039 CCc1cc(ccc1O)SCC(O)CO 62a_100011219619_100012338938 [0,1,0,0,0,1|2,0,0]=4 3575 B15R1.4039 CCc1cc(ccc1O)SC[C@@H](C)CC 62a_100009816398_100012338938 [0,1,0,0,0,1|2,0,0]=4 3576 B15R1.4039 CCc1cc(ccc1O)SC[C@@H](C)CO 62a_100000059175_100012338938 [0,1,0,0,0,1|2,0,0]=4 3577 B15R1.4039 CCc1cc(ccc1O)SC[C@@H](O)CF 62a_100015614560_100012338938 [0,1,0,0,0,1|2,0,0]=4 3578 B15R1.4039 CCc1cc(ccc1O)SC[C@@H](O)CO 62a_100009815848_100012338938 [0,1,0,0,0,1|2,0,0]=4 3579 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)O 240690a_100102657272_100011216321 [0,1,0,0,0,1|1,0,1]=4 3580 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000183359 [0,1,0,0,0,1|1,0,1]=4 3581 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)O 62a_100000183359_100000694246 [0,1,0,0,0,1|1,0,1]=4 3582 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100000185554_106832991635 [0,1,0,0,0,1|1,0,1]=4 3583 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100102657272_100000185554 [0,1,0,0,0,1|1,0,1]=4 3584 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100102657272 [0,1,0,0,0,1|1,0,1]=4 3585 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100102657272_100000185554 [0,1,0,0,0,1|1,0,1]=4 3586 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 512a_106832991638_100000185554 [0,1,0,0,0,1|1,0,1]=4 3587 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000747449 [0,1,0,0,0,1|1,0,1]=4 3588 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)O 62a_100000747449_100000694246 [0,1,0,0,0,1|1,0,1]=4 3589 B15R1.4039 COc1cc(ccc1Br)CNC(C)C#N 2230a_100000737613_100010110085 [0,1,0,0,0,1|1,0,1]=4 3590 B15R1.4039 COc1cc(ccc1Br)CN[C@H](C)CF 207a_100102880703_100010244714 [0,1,0,0,0,1|2,0,0]=4 3591 B15R1.4039 COc1cc(ccc1Br)CN[C@H](C)CF 270004a_100102880703_100010244714 [0,1,0,0,0,1|2,0,0]=4 3592 B15R1.4039 COc1cc(ccc1Br)CN[C@H](C)CO 207a_100000737577_100010244714 [0,1,0,0,0,1|2,0,0]=4 3593 B15R1.4039 COc1cc(ccc1Br)CN[C@H](C)CO 2230a_100000737577_100010110085 [0,1,0,0,0,1|2,0,0]=4 3594 B15R1.4039 COc1cc(ccc1Br)CN[C@H](C)CO 270004a_100000737577_100010244714 [0,1,0,0,0,1|2,0,0]=4 3595 B15R1.4039 COc1cc(ccc1Br)COC(C)C#N 34a_100011218135_100010110085 [0,1,0,0,0,1|1,0,1]=4 3596 B15R1.4039 COc1cc(ccc1Br)COC(C)C#N 7a_100010234685_100000703298 [0,1,0,0,0,1|1,0,1]=4 3597 B15R1.4039 COc1cc(ccc1Br)COC(C)CF 34a_100016041109_100010110085 [0,1,0,0,0,1|2,0,0]=4 3598 B15R1.4039 COc1cc(ccc1Br)COC(C)CF 7a_100016041109_100010110085 [0,1,0,0,0,1|2,0,0]=4 3599 B15R1.4039 COc1cc(ccc1Br)COC(C)CN 34a_100000210904_100010110085 [0,1,0,0,0,1|1,0,0]=3 3600 B15R1.4039 COc1cc(ccc1Br)COC(C)CO 34a_100010234685_100012180447 [0,1,0,0,0,1|2,0,0]=4 3601 B15R1.4039 COc1cc(ccc1Br)COC(C)CO 7a_100010234685_100012180447 [0,1,0,0,0,1|2,0,0]=4 3602 B15R1.4039 COc1cc(ccc1Br)CSC(C)C#N 62a_100000703298_100010110085 [0,1,0,0,0,1|1,0,1]=4 3603 B15R1.4039 COc1cc(ccc1Br)CSC(C)C#N 62a_100010110085_100000703298 [0,1,0,0,0,1|1,0,1]=4 3604 B15R1.4039 COc1cc(ccc1Br)CSC(C)CO 62a_100012180447_100010110085 [0,1,0,0,0,1|2,0,0]=4 3605 B15R1.4039 COc1cc(ccc1Br)CSC(C)OC 62a_100009879195_100010110085 [0,1,0,0,0,1|2,0,0]=4 3606 B15R1.4039 COc1cc(ccc1Br)CSC(C)OC 62a_100010110085_100009879195 [0,1,0,0,0,1|2,0,0]=4 3607 B15R1.4039 COc1cc(ccc1Br)CS[C@H](C)CO 62a_100010110085_100016084084 [0,1,0,0,0,1|2,0,0]=4 3608 B15R1.4039 COc1cc(ccc1Br)CS[C@H](C)CO 62a_100016084084_100010110085 [0,1,0,0,0,1|2,0,0]=4 3609 B15R1.4039 COc1cc(ccc1Br)NCC(O)CO 2230a_100000765947_100011219619 [0,1,0,0,0,1|2,0,0]=4 3610 B15R1.4039 COc1cc(ccc1Br)NCC(O)CO 34a_100000765947_100011219619 [0,1,0,0,0,1|2,0,0]=4 3611 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](C)CO 2230a_100000765947_100000059175 [0,1,0,0,0,1|2,0,0]=4 3612 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](C)CO 34a_100000765947_100000059175 [0,1,0,0,0,1|2,0,0]=4 3613 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](O)CF 2230a_100000765947_100015614560 [0,1,0,0,0,1|2,0,0]=4 3614 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](O)CF 34a_100000765947_100015614560 [0,1,0,0,0,1|2,0,0]=4 3615 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](O)CO 2230a_100000765947_100009815848 [0,1,0,0,0,1|2,0,0]=4 3616 B15R1.4039 COc1cc(ccc1Br)NC[C@@H](O)CO 34a_100000765947_100009815848 [0,1,0,0,0,1|2,0,0]=4 3617 B15R1.4039 COc1cc(ccc1Br)OCC(O)CO 34a_100011827694_100011219619 [0,1,0,0,0,1|2,0,0]=4 3618 B15R1.4039 COc1cc(ccc1Br)OCC(O)CO 7a_100011827694_100011219619 [0,1,0,0,0,1|2,0,0]=4 3619 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](C)CO 34a_100011827694_100000059175 [0,1,0,0,0,1|2,0,0]=4 3620 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](C)CO 7a_100011827694_100000059175 [0,1,0,0,0,1|2,0,0]=4 3621 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](O)CF 34a_100011827694_100015614560 [0,1,0,0,0,1|2,0,0]=4 3622 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](O)CF 7a_100011827694_100015614560 [0,1,0,0,0,1|2,0,0]=4 3623 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](O)CO 34a_100011827694_100009815848 [0,1,0,0,0,1|2,0,0]=4 3624 B15R1.4039 COc1cc(ccc1Br)OC[C@@H](O)CO 7a_100011827694_100009815848 [0,1,0,0,0,1|2,0,0]=4 3625 B15R1.4039 COc1cc(ccc1Br)SCC(O)CO 62a_100011219619_100012353699 [0,1,0,0,0,1|2,0,0]=4 3626 B15R1.4039 COc1cc(ccc1Br)SCC(O)CO 62a_100012353699_100011219619 [0,1,0,0,0,1|2,0,0]=4 3627 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](C)CO 62a_100000059175_100012353699 [0,1,0,0,0,1|2,0,0]=4 3628 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](C)CO 62a_100012353699_100000059175 [0,1,0,0,0,1|2,0,0]=4 3629 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](O)CF 62a_100012353699_100015614560 [0,1,0,0,0,1|2,0,0]=4 3630 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](O)CF 62a_100015614560_100012353699 [0,1,0,0,0,1|2,0,0]=4 3631 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](O)CO 62a_100009815848_100012353699 [0,1,0,0,0,1|2,0,0]=4 3632 B15R1.4039 COc1cc(ccc1Br)SC[C@@H](O)CO 62a_100012353699_100009815848 [0,1,0,0,0,1|2,0,0]=4 3633 B15R1.4039 COc1cc(ccc1C)CN[C@H](C)CF 207a_100102880703_100000719150 [0,1,0,0,0,1|2,0,0]=4 3634 B15R1.4039 COc1cc(ccc1C)CN[C@H](C)CF 270004a_100102880703_100000719150 [0,1,0,0,0,1|2,0,0]=4 3635 B15R1.4039 COc1cc(ccc1C)CN[C@H](C)CO 207a_100000737577_100000719150 [0,1,0,0,0,1|2,0,0]=4 3636 B15R1.4039 COc1cc(ccc1C)CN[C@H](C)CO 270004a_100000737577_100000719150 [0,1,0,0,0,1|2,0,0]=4 3637 B15R1.4039 COc1cc(ccc1C)COC(C)C#N 7a_100000752651_100000703298 [0,1,0,0,0,1|1,0,1]=4 3638 B15R1.4039 COc1cc(ccc1C)COC(C)CO 34a_100000752651_100012180447 [0,1,0,0,0,1|2,0,0]=4 3639 B15R1.4039 COc1cc(ccc1C)COC(C)CO 7a_100000752651_100012180447 [0,1,0,0,0,1|2,0,0]=4 3640 B15R1.4039 COc1cc(ccc1C)NCC(O)CO 2230a_100011279678_100011219619 [0,1,0,0,0,1|2,0,0]=4 3641 B15R1.4039 COc1cc(ccc1C)NCC(O)CO 34a_100011279678_100011219619 [0,1,0,0,0,1|2,0,0]=4 3642 B15R1.4039 COc1cc(ccc1C)NC[C@@H](C)CO 2230a_100011279678_100000059175 [0,1,0,0,0,1|2,0,0]=4 3643 B15R1.4039 COc1cc(ccc1C)NC[C@@H](C)CO 34a_100011279678_100000059175 [0,1,0,0,0,1|2,0,0]=4 3644 B15R1.4039 COc1cc(ccc1C)NC[C@@H](O)CF 2230a_100011279678_100015614560 [0,1,0,0,0,1|2,0,0]=4 3645 B15R1.4039 COc1cc(ccc1C)NC[C@@H](O)CF 34a_100011279678_100015614560 [0,1,0,0,0,1|2,0,0]=4 3646 B15R1.4039 COc1cc(ccc1C)NC[C@@H](O)CO 2230a_100011279678_100009815848 [0,1,0,0,0,1|2,0,0]=4 3647 B15R1.4039 COc1cc(ccc1C)NC[C@@H](O)CO 34a_100011279678_100009815848 [0,1,0,0,0,1|2,0,0]=4 3648 B15R1.4039 COc1cc(ccc1C)OCC(O)CO 34a_100009865632_100011219619 [0,1,0,0,0,1|2,0,0]=4 3649 B15R1.4039 COc1cc(ccc1C)OCC(O)CO 7a_100009865632_100011219619 [0,1,0,0,0,1|2,0,0]=4 3650 B15R1.4039 COc1cc(ccc1C)OC[C@@H](C)CO 34a_100009865632_100000059175 [0,1,0,0,0,1|2,0,0]=4 3651 B15R1.4039 COc1cc(ccc1C)OC[C@@H](C)CO 7a_100009865632_100000059175 [0,1,0,0,0,1|2,0,0]=4 3652 B15R1.4039 COc1cc(ccc1C)OC[C@@H](O)CF 34a_100009865632_100015614560 [0,1,0,0,0,1|2,0,0]=4 3653 B15R1.4039 COc1cc(ccc1C)OC[C@@H](O)CF 7a_100009865632_100015614560 [0,1,0,0,0,1|2,0,0]=4 3654 B15R1.4039 COc1cc(ccc1C)OC[C@@H](O)CO 34a_100009865632_100009815848 [0,1,0,0,0,1|2,0,0]=4 3655 B15R1.4039 COc1cc(ccc1C)OC[C@@H](O)CO 7a_100009865632_100009815848 [0,1,0,0,0,1|2,0,0]=4 3656 B15R1.4039 COc1cc(ccc1C)SCC(O)CO 62a_100011219619_100011830276 [0,1,0,0,0,1|2,0,0]=4 3657 B15R1.4039 COc1cc(ccc1C)SCC(O)CO 62a_100011830276_100011219619 [0,1,0,0,0,1|2,0,0]=4 3658 B15R1.4039 COc1cc(ccc1C)SC[C@@H](C)CO 62a_100000059175_100011830276 [0,1,0,0,0,1|2,0,0]=4 3659 B15R1.4039 COc1cc(ccc1C)SC[C@@H](C)CO 62a_100011830276_100000059175 [0,1,0,0,0,1|2,0,0]=4 3660 B15R1.4039 COc1cc(ccc1C)SC[C@@H](O)CF 62a_100011830276_100015614560 [0,1,0,0,0,1|2,0,0]=4 3661 B15R1.4039 COc1cc(ccc1C)SC[C@@H](O)CF 62a_100015614560_100011830276 [0,1,0,0,0,1|2,0,0]=4 3662 B15R1.4039 COc1cc(ccc1C)SC[C@@H](O)CO 62a_100009815848_100011830276 [0,1,0,0,0,1|2,0,0]=4 3663 B15R1.4039 COc1cc(ccc1C)SC[C@@H](O)CO 62a_100011830276_100009815848 [0,1,0,0,0,1|2,0,0]=4 3664 B15R1.4039 COc1cc(ccc1Cl)CNC(C)C#N 2230a_100000737613_200010214485 [0,1,0,0,0,1|1,0,1]=4 3665 B15R1.4039 COc1cc(ccc1Cl)CNC(C)C#N 2230a_100015204853_100000184139 [0,1,0,0,0,1|1,0,1]=4 3666 B15R1.4039 COc1cc(ccc1Cl)CNC(C)CO 2230a_100015204853_100012180447 [0,1,0,0,0,1|2,0,0]=4 3667 B15R1.4039 COc1cc(ccc1Cl)CNC(C)CO 34a_100015204853_100012180447 [0,1,0,0,0,1|2,0,0]=4 3668 B15R1.4039 COc1cc(ccc1Cl)CN[C@H](C)CF 207a_100102880703_100011998524 [0,1,0,0,0,1|2,0,0]=4 3669 B15R1.4039 COc1cc(ccc1Cl)CN[C@H](C)CF 270004a_100102880703_100011998524 [0,1,0,0,0,1|2,0,0]=4 3670 B15R1.4039 COc1cc(ccc1Cl)CN[C@H](C)CO 207a_100000737577_100011998524 [0,1,0,0,0,1|2,0,0]=4 3671 B15R1.4039 COc1cc(ccc1Cl)CN[C@H](C)CO 2230a_100000737577_200010214485 [0,1,0,0,0,1|2,0,0]=4 3672 B15R1.4039 COc1cc(ccc1Cl)CN[C@H](C)CO 270004a_100000737577_100011998524 [0,1,0,0,0,1|2,0,0]=4 3673 B15R1.4039 COc1cc(ccc1Cl)COC(C)C#N 34a_100011218135_200010214485 [0,1,0,0,0,1|1,0,1]=4 3674 B15R1.4039 COc1cc(ccc1Cl)COC(C)CF 34a_100016041109_200010214485 [0,1,0,0,0,1|2,0,0]=4 3675 B15R1.4039 COc1cc(ccc1Cl)COC(C)CF 7a_100016041109_200010214485 [0,1,0,0,0,1|2,0,0]=4 3676 B15R1.4039 COc1cc(ccc1Cl)COC(C)CN 34a_100000210904_200010214485 [0,1,0,0,0,1|1,0,0]=3 3677 B15R1.4039 COc1cc(ccc1Cl)COC(C)CO 34a_100012179228_100012180447 [0,1,0,0,0,1|2,0,0]=4 3678 B15R1.4039 COc1cc(ccc1Cl)CSC(C)C#N 62a_100000703298_200010214485 [0,1,0,0,0,1|1,0,1]=4 3679 B15R1.4039 COc1cc(ccc1Cl)CSC(C)C#N 62a_200010214485_100000703298 [0,1,0,0,0,1|1,0,1]=4 3680 B15R1.4039 COc1cc(ccc1Cl)CSC(C)CO 62a_100012180447_200010214485 [0,1,0,0,0,1|2,0,0]=4 3681 B15R1.4039 COc1cc(ccc1Cl)CSC(C)OC 62a_100009879195_200010214485 [0,1,0,0,0,1|2,0,0]=4 3682 B15R1.4039 COc1cc(ccc1Cl)CSC(C)OC 62a_200010214485_100009879195 [0,1,0,0,0,1|2,0,0]=4 3683 B15R1.4039 COc1cc(ccc1Cl)CS[C@H](C)CO 62a_100016084084_200010214485 [0,1,0,0,0,1|2,0,0]=4 3684 B15R1.4039 COc1cc(ccc1Cl)CS[C@H](C)CO 62a_200010214485_100016084084 [0,1,0,0,0,1|2,0,0]=4 3685 B15R1.4039 COc1cc(ccc1Cl)NCC(O)CO 2230a_100000742311_100011219619 [0,1,0,0,0,1|2,0,0]=4 3686 B15R1.4039 COc1cc(ccc1Cl)NCC(O)CO 34a_100000742311_100011219619 [0,1,0,0,0,1|2,0,0]=4 3687 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](C)CO 2230a_100000742311_100000059175 [0,1,0,0,0,1|2,0,0]=4 3688 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](C)CO 34a_100000742311_100000059175 [0,1,0,0,0,1|2,0,0]=4 3689 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](O)CF 2230a_100000742311_100015614560 [0,1,0,0,0,1|2,0,0]=4 3690 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](O)CF 34a_100000742311_100015614560 [0,1,0,0,0,1|2,0,0]=4 3691 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](O)CO 2230a_100000742311_100009815848 [0,1,0,0,0,1|2,0,0]=4 3692 B15R1.4039 COc1cc(ccc1Cl)NC[C@@H](O)CO 34a_100000742311_100009815848 [0,1,0,0,0,1|2,0,0]=4 3693 B15R1.4039 COc1cc(ccc1Cl)OCC(O)CO 34a_100012186310_100011219619 [0,1,0,0,0,1|2,0,0]=4 3694 B15R1.4039 COc1cc(ccc1Cl)OCC(O)CO 7a_100012186310_100011219619 [0,1,0,0,0,1|2,0,0]=4 3695 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](C)CO 34a_100012186310_100000059175 [0,1,0,0,0,1|2,0,0]=4 3696 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](C)CO 7a_100012186310_100000059175 [0,1,0,0,0,1|2,0,0]=4 3697 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](O)CF 34a_100012186310_100015614560 [0,1,0,0,0,1|2,0,0]=4 3698 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](O)CF 7a_100012186310_100015614560 [0,1,0,0,0,1|2,0,0]=4 3699 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](O)CO 34a_100012186310_100009815848 [0,1,0,0,0,1|2,0,0]=4 3700 B15R1.4039 COc1cc(ccc1Cl)OC[C@@H](O)CO 7a_100012186310_100009815848 [0,1,0,0,0,1|2,0,0]=4 3701 B15R1.4039 COc1cc(ccc1Cl)SCC(O)CO 62a_100011219619_100011356853 [0,1,0,0,0,1|2,0,0]=4 3702 B15R1.4039 COc1cc(ccc1Cl)SCC(O)CO 62a_100011356853_100011219619 [0,1,0,0,0,1|2,0,0]=4 3703 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](C)CO 62a_100000059175_100011356853 [0,1,0,0,0,1|2,0,0]=4 3704 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](C)CO 62a_100011356853_100000059175 [0,1,0,0,0,1|2,0,0]=4 3705 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](O)CF 62a_100011356853_100015614560 [0,1,0,0,0,1|2,0,0]=4 3706 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](O)CF 62a_100015614560_100011356853 [0,1,0,0,0,1|2,0,0]=4 3707 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](O)CO 62a_100009815848_100011356853 [0,1,0,0,0,1|2,0,0]=4 3708 B15R1.4039 COc1cc(ccc1Cl)SC[C@@H](O)CO 62a_100011356853_100009815848 [0,1,0,0,0,1|2,0,0]=4 3709 B15R1.4039 COc1cc(ccc1F)CNC(C)C#N 2230a_100000737613_100012349856 [0,1,0,0,0,1|1,0,1]=4 3710 B15R1.4039 COc1cc(ccc1F)CNC(C)C#N 2230a_100020626639_100000184139 [0,1,0,0,0,1|1,0,1]=4 3711 B15R1.4039 COc1cc(ccc1F)CNC(C)CO 2230a_100020626639_100012180447 [0,1,0,0,0,1|2,0,0]=4 3712 B15R1.4039 COc1cc(ccc1F)CNC(C)CO 34a_100020626639_100012180447 [0,1,0,0,0,1|2,0,0]=4 3713 B15R1.4039 COc1cc(ccc1F)CN[C@H](C)CF 207a_100102880703_100000692873 [0,1,0,0,0,1|2,0,0]=4 3714 B15R1.4039 COc1cc(ccc1F)CN[C@H](C)CF 270004a_100102880703_100000692873 [0,1,0,0,0,1|2,0,0]=4 3715 B15R1.4039 COc1cc(ccc1F)CN[C@H](C)CO 207a_100000737577_100000692873 [0,1,0,0,0,1|2,0,0]=4 3716 B15R1.4039 COc1cc(ccc1F)CN[C@H](C)CO 2230a_100000737577_100012349856 [0,1,0,0,0,1|2,0,0]=4 3717 B15R1.4039 COc1cc(ccc1F)CN[C@H](C)CO 270004a_100000737577_100000692873 [0,1,0,0,0,1|2,0,0]=4 3718 B15R1.4039 COc1cc(ccc1F)COC(C)C#N 34a_100011218135_100012349856 [0,1,0,0,0,1|1,0,1]=4 3719 B15R1.4039 COc1cc(ccc1F)COC(C)C#N 7a_100000692429_100000703298 [0,1,0,0,0,1|1,0,1]=4 3720 B15R1.4039 COc1cc(ccc1F)COC(C)CF 34a_100016041109_100012349856 [0,1,0,0,0,1|2,0,0]=4 3721 B15R1.4039 COc1cc(ccc1F)COC(C)CF 7a_100016041109_100012349856 [0,1,0,0,0,1|2,0,0]=4 3722 B15R1.4039 COc1cc(ccc1F)COC(C)CN 34a_100000210904_100012349856 [0,1,0,0,0,1|1,0,0]=3 3723 B15R1.4039 COc1cc(ccc1F)COC(C)CO 34a_100000692429_100012180447 [0,1,0,0,0,1|2,0,0]=4 3724 B15R1.4039 COc1cc(ccc1F)COC(C)CO 7a_100000692429_100012180447 [0,1,0,0,0,1|2,0,0]=4 3725 B15R1.4039 COc1cc(ccc1F)CSC(C)C#N 62a_100000703298_100012349856 [0,1,0,0,0,1|1,0,1]=4 3726 B15R1.4039 COc1cc(ccc1F)CSC(C)C#N 62a_100012349856_100000703298 [0,1,0,0,0,1|1,0,1]=4 3727 B15R1.4039 COc1cc(ccc1F)CSC(C)CO 62a_100012180447_100012349856 [0,1,0,0,0,1|2,0,0]=4 3728 B15R1.4039 COc1cc(ccc1F)CSC(C)OC 62a_100009879195_100012349856 [0,1,0,0,0,1|2,0,0]=4 3729 B15R1.4039 COc1cc(ccc1F)CSC(C)OC 62a_100012349856_100009879195 [0,1,0,0,0,1|2,0,0]=4 3730 B15R1.4039 COc1cc(ccc1F)CS[C@H](C)CO 62a_100012349856_100016084084 [0,1,0,0,0,1|2,0,0]=4 3731 B15R1.4039 COc1cc(ccc1F)CS[C@H](C)CO 62a_100016084084_100012349856 [0,1,0,0,0,1|2,0,0]=4 3732 B15R1.4039 COc1cc(ccc1F)NCC(O)CO 2230a_100000701188_100011219619 [0,1,0,0,0,1|2,0,0]=4 3733 B15R1.4039 COc1cc(ccc1F)NCC(O)CO 34a_100000701188_100011219619 [0,1,0,0,0,1|2,0,0]=4 3734 B15R1.4039 COc1cc(ccc1F)NC[C@@H](C)CO 2230a_100000701188_100000059175 [0,1,0,0,0,1|2,0,0]=4 3735 B15R1.4039 COc1cc(ccc1F)NC[C@@H](C)CO 34a_100000701188_100000059175 [0,1,0,0,0,1|2,0,0]=4 3736 B15R1.4039 COc1cc(ccc1F)NC[C@@H](O)CF 2230a_100000701188_100015614560 [0,1,0,0,0,1|2,0,0]=4 3737 B15R1.4039 COc1cc(ccc1F)NC[C@@H](O)CF 34a_100000701188_100015614560 [0,1,0,0,0,1|2,0,0]=4 3738 B15R1.4039 COc1cc(ccc1F)NC[C@@H](O)CO 2230a_100000701188_100009815848 [0,1,0,0,0,1|2,0,0]=4 3739 B15R1.4039 COc1cc(ccc1F)NC[C@@H](O)CO 34a_100000701188_100009815848 [0,1,0,0,0,1|2,0,0]=4 3740 B15R1.4039 COc1cc(ccc1F)OCC(O)CO 34a_100012001760_100011219619 [0,1,0,0,0,1|2,0,0]=4 3741 B15R1.4039 COc1cc(ccc1F)OCC(O)CO 7a_100012001760_100011219619 [0,1,0,0,0,1|2,0,0]=4 3742 B15R1.4039 COc1cc(ccc1F)OC[C@@H](C)CO 34a_100012001760_100000059175 [0,1,0,0,0,1|2,0,0]=4 3743 B15R1.4039 COc1cc(ccc1F)OC[C@@H](C)CO 7a_100012001760_100000059175 [0,1,0,0,0,1|2,0,0]=4 3744 B15R1.4039 COc1cc(ccc1F)OC[C@@H](O)CF 34a_100012001760_100015614560 [0,1,0,0,0,1|2,0,0]=4 3745 B15R1.4039 COc1cc(ccc1F)OC[C@@H](O)CF 7a_100012001760_100015614560 [0,1,0,0,0,1|2,0,0]=4 3746 B15R1.4039 COc1cc(ccc1F)OC[C@@H](O)CO 34a_100012001760_100009815848 [0,1,0,0,0,1|2,0,0]=4 3747 B15R1.4039 COc1cc(ccc1F)OC[C@@H](O)CO 7a_100012001760_100009815848 [0,1,0,0,0,1|2,0,0]=4 3748 B15R1.4039 COc1cc(ccc1F)SCC(O)CO 62a_100011219619_100011934186 [0,1,0,0,0,1|2,0,0]=4 3749 B15R1.4039 COc1cc(ccc1F)SCC(O)CO 62a_100011934186_100011219619 [0,1,0,0,0,1|2,0,0]=4 3750 B15R1.4039 COc1cc(ccc1F)SC[C@@H](C)CO 62a_100000059175_100011934186 [0,1,0,0,0,1|2,0,0]=4 3751 B15R1.4039 COc1cc(ccc1F)SC[C@@H](C)CO 62a_100011934186_100000059175 [0,1,0,0,0,1|2,0,0]=4 3752 B15R1.4039 COc1cc(ccc1F)SC[C@@H](O)CF 62a_100011934186_100015614560 [0,1,0,0,0,1|2,0,0]=4 3753 B15R1.4039 COc1cc(ccc1F)SC[C@@H](O)CF 62a_100015614560_100011934186 [0,1,0,0,0,1|2,0,0]=4 3754 B15R1.4039 COc1cc(ccc1F)SC[C@@H](O)CO 62a_100009815848_100011934186 [0,1,0,0,0,1|2,0,0]=4 3755 B15R1.4039 COc1cc(ccc1F)SC[C@@H](O)CO 62a_100011934186_100009815848 [0,1,0,0,0,1|2,0,0]=4 3756 B15R1.4039 COc1cc(ccc1I)NCC(O)CO 34a_100000746945_100011219619 [0,1,0,0,0,1|2,0,0]=4 3757 B15R1.4039 COc1cc(ccc1I)NC[C@@H](C)CO 34a_100000746945_100000059175 [0,1,0,0,0,1|2,0,0]=4 3758 B15R1.4039 COc1cc(ccc1I)NC[C@@H](O)CF 34a_100000746945_100015614560 [0,1,0,0,0,1|2,0,0]=4 3759 B15R1.4039 COc1cc(ccc1I)NC[C@@H](O)CO 34a_100000746945_100009815848 [0,1,0,0,0,1|2,0,0]=4 3760 B15R1.4039 COc1cc(ccc1N)COC(C)CO 34a_100000087641_100012180447 [0,1,0,0,0,1|2,0,0]=4 3761 B15R1.4039 COc1cc(ccc1N)OCC(O)CO 34a_100015326901_100011219619 [0,1,0,0,0,1|2,0,0]=4 3762 B15R1.4039 COc1cc(ccc1N)OCC(O)CO 7a_100015326901_100011219619 [0,1,0,0,0,1|2,0,0]=4 3763 B15R1.4039 COc1cc(ccc1N)OC[C@@H](C)CO 34a_100015326901_100000059175 [0,1,0,0,0,1|2,0,0]=4 3764 B15R1.4039 COc1cc(ccc1N)OC[C@@H](C)CO 7a_100015326901_100000059175 [0,1,0,0,0,1|2,0,0]=4 3765 B15R1.4039 COc1cc(ccc1N)OC[C@@H](O)CF 34a_100015326901_100015614560 [0,1,0,0,0,1|2,0,0]=4 3766 B15R1.4039 COc1cc(ccc1N)OC[C@@H](O)CF 7a_100015326901_100015614560 [0,1,0,0,0,1|2,0,0]=4 3767 B15R1.4039 COc1cc(ccc1N)OC[C@@H](O)CO 34a_100015326901_100009815848 [0,1,0,0,0,1|2,0,0]=4 3768 B15R1.4039 COc1cc(ccc1N)OC[C@@H](O)CO 7a_100015326901_100009815848 [0,1,0,0,0,1|2,0,0]=4 3769 B15R1.4039 COc1cc(ccc1N)SCC(O)CO 62a_100011219619_100015196925 [0,1,0,0,0,1|2,0,0]=4 3770 B15R1.4039 COc1cc(ccc1N)SCC(O)CO 62a_100011279103_100011219619 [0,1,0,0,0,1|2,0,0]=4 3771 B15R1.4039 COc1cc(ccc1N)SC[C@@H](C)CO 62a_100000059175_100015196925 [0,1,0,0,0,1|2,0,0]=4 3772 B15R1.4039 COc1cc(ccc1N)SC[C@@H](C)CO 62a_100011279103_100000059175 [0,1,0,0,0,1|2,0,0]=4 3773 B15R1.4039 COc1cc(ccc1N)SC[C@@H](O)CF 62a_100011279103_100015614560 [0,1,0,0,0,1|2,0,0]=4 3774 B15R1.4039 COc1cc(ccc1N)SC[C@@H](O)CF 62a_100015614560_100015196925 [0,1,0,0,0,1|2,0,0]=4 3775 B15R1.4039 COc1cc(ccc1N)SC[C@@H](O)CO 62a_100009815848_100015196925 [0,1,0,0,0,1|2,0,0]=4 3776 B15R1.4039 COc1cc(ccc1N)SC[C@@H](O)CO 62a_100011279103_100009815848 [0,1,0,0,0,1|2,0,0]=4 3777 B15R1.4039 COc1cc(ccc1O)CCC(=O)CF 1458a_100011216321_100015361967 [0,1,0,0,0,1|1,0,1]=4 3778 B15R1.4039 COc1cc(ccc1O)CCC(=O)CO 1458a_100000210174_100010741665 [0,1,0,0,0,1|1,0,1]=4 3779 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 240690a_100000185554_100000210174 [0,1,0,0,0,1|1,0,1]=4 3780 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 527a_100000185554_100000210174 [0,1,0,0,0,1|1,0,1]=4 3781 B15R1.4039 COc1cc(ccc1O)CNC(C)CO 34a_100000185554_100012180447 [0,1,0,0,0,1|1,0,0]=3 3782 B15R1.4039 COc1cc(ccc1O)NCC(O)CO 34a_100000726020_100011219619 [0,1,0,0,0,1|1,0,0]=3 3783 B15R1.4039 COc1cc(ccc1O)NC[C@@H](C)CO 34a_100000726020_100000059175 [0,1,0,0,0,1|1,0,0]=3 3784 B15R1.4039 COc1cc(ccc1O)NC[C@@H](O)CF 34a_100000726020_100015614560 [0,1,0,0,0,1|1,0,0]=3 3785 B15R1.4039 COc1cc(ccc1O)NC[C@@H](O)CO 34a_100000726020_100009815848 [0,1,0,0,0,1|1,0,0]=3 3786 B15R1.4039 COc1cc(ccc1O)SCC(O)CO 62a_100011219619_100000694246 [0,1,0,0,0,1|1,0,0]=3 3787 B15R1.4039 COc1cc(ccc1O)SC[C@@H](C)CO 62a_100000059175_100000694246 [0,1,0,0,0,1|1,0,0]=3 3788 B15R1.4039 COc1cc(ccc1O)SC[C@@H](O)CF 62a_100015614560_100000694246 [0,1,0,0,0,1|1,0,0]=3 3789 B15R1.4039 COc1cc(ccc1O)SC[C@@H](O)CO 62a_100009815848_100000694246 [0,1,0,0,0,1|1,0,0]=3 3790 B15R1.4039 COc1nc(ccc1Br)COC(C)CN 34a_100000210904_200010066506 [0,1,0,0,0,1|2,0,0]=4 3791 B15R1.4039 COc1nc(ccc1O)SCC(O)CO 62a_100011219619_100010893133 [0,1,0,0,0,1|2,0,0]=4 3792 B15R1.4039 COc1nc(ccc1O)SC[C@@H](C)CO 62a_100000059175_100010893133 [0,1,0,0,0,1|2,0,0]=4 3793 B15R1.4039 COc1nc(ccc1O)SC[C@@H](O)CF 62a_100015614560_100010893133 [0,1,0,0,0,1|2,0,0]=4 3794 B15R1.4039 COc1nc(ccc1O)SC[C@@H](O)CO 62a_100009815848_100010893133 [0,1,0,0,0,1|2,0,0]=4 3795 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)Br 207a_100138425928_200010981996 [0,1,0,0,0,1|2,0,0]=4 3796 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)Cl 207a_100138425928_100009889114 [0,1,0,0,0,1|2,0,0]=4 3797 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)Cl 2230a_100138425928_100010116237 [0,1,0,0,0,1|2,0,0]=4 3798 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)Cl 34a_100138425928_100010116237 [0,1,0,0,0,1|2,0,0]=4 3799 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)Cl 34a_200009889119_100000210206 [0,1,0,0,0,1|2,0,0]=4 3800 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)F 207a_100138425928_100000050928 [0,1,0,0,0,1|2,0,0]=4 3801 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)F 2230a_100138425928_100009814548 [0,1,0,0,0,1|2,0,0]=4 3802 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)F 34a_100138425928_100009814548 [0,1,0,0,0,1|2,0,0]=4 3803 B15R1.5194 COc1c(ccc(c1F)CNC(C)C)F 34a_115082355467_100000210206 [0,1,0,0,0,1|2,0,0]=4 3804 B15R1.5194 COc1c(ccc(c1F)COC(C)C)Cl 34a_100000212225_100010116237 [0,1,0,0,0,1|2,0,0]=4 3805 B15R1.5194 COc1c(ccc(c1F)COC(C)C)Cl 34a_100009889115_100000210206 [0,1,0,0,0,1|2,0,0]=4 3806 B15R1.5194 COc1c(ccc(c1F)COC(C)C)Cl 7a_100009889115_100000210206 [0,1,0,0,0,1|2,0,0]=4 3807 B15R1.5194 COc1c(ccc(c1F)COC(C)C)F 34a_100000081355_100000210206 [0,1,0,0,0,1|2,0,0]=4 3808 B15R1.5194 COc1c(ccc(c1F)COC(C)C)F 34a_100000212225_100009814548 [0,1,0,0,0,1|2,0,0]=4 3809 B15R1.5194 COc1c(ccc(c1F)COC(C)C)F 7a_100000081355_100000210206 [0,1,0,0,0,1|2,0,0]=4 3810 B15R1.5194 COc1c(ccc(c1F)CSC(C)C)Cl 62a_100000210206_100010116237 [0,1,0,0,0,1|2,0,0]=4 3811 B15R1.5194 COc1c(ccc(c1F)CSC(C)C)Cl 62a_100010116237_100000210206 [0,1,0,0,0,1|2,0,0]=4 3812 B15R1.5194 COc1c(ccc(c1F)CSC(C)C)F 62a_100000210206_100009814548 [0,1,0,0,0,1|2,0,0]=4 3813 B15R1.5194 COc1c(ccc(c1F)CSC(C)C)F 62a_100009814548_100000210206 [0,1,0,0,0,1|2,0,0]=4 3814 B15R1.5194 COc1c(ccc(c1F)NCC(C)C)F 34a_100137314619_100000210624 [0,1,0,0,0,1|2,0,0]=4 3815 B15R1.5194 COc1c(ccc(c1F)NCC(C)O)F 34a_100137314619_100011218427 [0,1,0,0,0,1|2,0,0]=4 3816 B15R1.5194 COc1c(ccc(c1F)NC[C@@H](C)O)F 34a_100137314619_100009817552 [0,1,0,0,0,1|2,0,0]=4 3817 B15R1.5194 COc1c(ccc(c1F)OCC(C)C)F 34a_100000062073_100000210624 [0,1,0,0,0,1|2,0,0]=4 3818 B15R1.5194 COc1c(ccc(c1F)OCC(C)C)F 7a_100000062073_100000210760 [0,1,0,0,0,1|2,0,0]=4 3819 B15R1.5194 COc1c(ccc(c1F)OCC(C)O)F 34a_100000062073_100011218427 [0,1,0,0,0,1|2,0,0]=4 3820 B15R1.5194 COc1c(ccc(c1F)OCC(C)O)F 7a_100000062073_100011218427 [0,1,0,0,0,1|2,0,0]=4 3821 B15R1.5194 COc1c(ccc(c1F)OC[C@@H](C)O)F 34a_100000062073_100009817552 [0,1,0,0,0,1|2,0,0]=4 3822 B15R1.5194 COc1c(ccc(c1F)OC[C@@H](C)O)F 7a_100000062073_100009817552 [0,1,0,0,0,1|2,0,0]=4 3823 B15R1.5194 COc1c(ccc(c1F)SCC(C)C)Cl 62a_100000210624_200135222481 [0,1,0,0,0,1|2,0,0]=4 3824 B15R1.5194 COc1c(ccc(c1F)SCC(C)C)Cl 62a_200135222481_100000210760 [0,1,0,0,0,1|2,0,0]=4 3825 B15R1.5194 COc1c(ccc(c1F)SCC(C)C)N 62a_100000210624_100010734149 [0,1,0,0,0,1|2,0,0]=4 3826 B15R1.5194 COc1c(ccc(c1F)SCC(C)C)N 62a_100010734149_100000210760 [0,1,0,0,0,1|2,0,0]=4 3827 B15R1.5194 COc1c(ccc(c1F)SCC(C)O)Cl 62a_100011218427_200135222481 [0,1,0,0,0,1|2,0,0]=4 3828 B15R1.5194 COc1c(ccc(c1F)SCC(C)O)Cl 62a_200135222481_100011218427 [0,1,0,0,0,1|2,0,0]=4 3829 B15R1.5194 COc1c(ccc(c1F)SCC(C)O)N 62a_100010734149_100011218427 [0,1,0,0,0,1|2,0,0]=4 3830 B15R1.5194 COc1c(ccc(c1F)SCC(C)O)N 62a_100011218427_100010734149 [0,1,0,0,0,1|2,0,0]=4 3831 B15R1.5194 COc1c(ccc(c1F)SC[C@@H](C)O)Cl 62a_100009817552_200135222481 [0,1,0,0,0,1|2,0,0]=4 3832 B15R1.5194 COc1c(ccc(c1F)SC[C@@H](C)O)Cl 62a_200135222481_100009817552 [0,1,0,0,0,1|2,0,0]=4 3833 B15R1.5194 COc1c(ccc(c1F)SC[C@@H](C)O)N 62a_100009817552_100010734149 [0,1,0,0,0,1|2,0,0]=4 3834 B15R1.5194 COc1c(ccc(c1F)SC[C@@H](C)O)N 62a_100010734149_100009817552 [0,1,0,0,0,1|2,0,0]=4 3835 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000748629 [0,1,0,0,0,1|1,0,1]=4 3836 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000748629 [0,1,0,0,0,1|1,0,1]=4 3837 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)CO 34a_200000116926_100000748629 [0,1,0,0,0,1|1,0,1]=4 3838 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)OC 34a_100000039706_100000748629 [0,1,0,0,0,1|1,0,1]=4 3839 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100000748629_100011277633 [0,1,0,0,0,1|1,0,1]=4 3840 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000211660 [0,1,0,0,0,1|1,0,1]=4 3841 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)OC 62a_100000748629_100011356967 [0,1,0,0,0,1|1,0,1]=4 3842 B15R1.12854 CCc1cc(ccc1OC)SCC(C)C 62a_100000210624_200010179862 [0,1,0,0,0,1|2,0,0]=4 3843 B15R1.12854 CCc1cc(ccc1OC)SCC(C)C 62a_200010179862_100000210760 [0,1,0,0,0,1|2,0,0]=4 3844 B15R1.12854 CCc1cc(ccc1OC)SCC(C)O 62a_100011218427_200010179862 [0,1,0,0,0,1|2,0,0]=4 3845 B15R1.12854 CCc1cc(ccc1OC)SCC(C)O 62a_200010179862_100011218427 [0,1,0,0,0,1|2,0,0]=4 3846 B15R1.12854 CCc1cc(ccc1OC)SC[C@@H](C)O 62a_100009817552_200010179862 [0,1,0,0,0,1|2,0,0]=4 3847 B15R1.12854 CCc1cc(ccc1OC)SC[C@@H](C)O 62a_200010179862_100009817552 [0,1,0,0,0,1|2,0,0]=4 3848 B15R1.12854 CCc1ccc(cc1OC)SCC(C)C 62a_100000210624_200010710398 [0,1,0,0,0,1|2,0,0]=4 3849 B15R1.12854 CCc1ccc(cc1OC)SCC(C)C 62a_200010710398_100000210760 [0,1,0,0,0,1|2,0,0]=4 3850 B15R1.12854 CCc1ccc(cc1OC)SCC(C)O 62a_100011218427_200010710398 [0,1,0,0,0,1|2,0,0]=4 3851 B15R1.12854 CCc1ccc(cc1OC)SCC(C)O 62a_200010710398_100011218427 [0,1,0,0,0,1|2,0,0]=4 3852 B15R1.12854 CCc1ccc(cc1OC)SC[C@@H](C)O 62a_100009817552_200010710398 [0,1,0,0,0,1|2,0,0]=4 3853 B15R1.12854 CCc1ccc(cc1OC)SC[C@@H](C)O 62a_200010710398_100009817552 [0,1,0,0,0,1|2,0,0]=4 3854 B15R1.12854 COc1cc(ccc1C#N)CNC(C)C 207a_100138425928_100000726430 [0,1,0,0,0,1|2,0,0]=4 3855 B15R1.12854 COc1cc(ccc1C#N)NCC(C)C 34a_100011999456_100000210624 [0,1,0,0,0,1|2,0,0]=4 3856 B15R1.12854 COc1cc(ccc1C#N)NCC(C)O 34a_100011999456_100011218427 [0,1,0,0,0,1|2,0,0]=4 3857 B15R1.12854 COc1cc(ccc1C#N)NC[C@@H](C)O 34a_100011999456_100009817552 [0,1,0,0,0,1|2,0,0]=4 3858 B15R1.12854 COc1cc(ccc1C#N)SCC(C)C 62a_100000210624_100000694671 [0,1,0,0,0,1|2,0,0]=4 3859 B15R1.12854 COc1cc(ccc1C#N)SCC(C)O 62a_100011218427_100000694671 [0,1,0,0,0,1|2,0,0]=4 3860 B15R1.12854 COc1cc(ccc1C#N)SC[C@@H](C)O 62a_100009817552_100000694671 [0,1,0,0,0,1|2,0,0]=4 3861 B15R1.12854 COc1cc(ccc1C=O)SCC(C)C 62a_100000210624_100010290300 [0,1,0,0,0,1|1,0,1]=4 3862 B15R1.12854 COc1cc(ccc1C=O)SCC(C)C 62a_100000697075_100000210760 [0,1,0,0,0,1|1,0,1]=4 3863 B15R1.12854 COc1cc(ccc1C=O)SCC(C)O 62a_100000697075_100011218427 [0,1,0,0,0,1|1,0,1]=4 3864 B15R1.12854 COc1cc(ccc1C=O)SCC(C)O 62a_100011218427_100010290300 [0,1,0,0,0,1|1,0,1]=4 3865 B15R1.12854 COc1cc(ccc1C=O)SC[C@@H](C)O 62a_100000697075_100009817552 [0,1,0,0,0,1|1,0,1]=4 3866 B15R1.12854 COc1cc(ccc1C=O)SC[C@@H](C)O 62a_100009817552_100010290300 [0,1,0,0,0,1|1,0,1]=4 3867 B15R1.12854 COc1cc(ccc1CO)C=CC(C)C 271570a_100016257149_100011277633 [0,1,0,0,0,1|1,0,1]=4 3868 B15R1.12854 COc1cc(ccc1CO)C=CC(C)O 271570a_200011019289_100011277633 [0,1,0,0,0,1|1,0,1]=4 3869 B15R1.12854 COc1cc(ccc1CO)NCC(=O)N 34a_100012183141_100000187820 [0,1,0,0,0,1|1,0,1]=4 3870 B15R1.12854 COc1cc(ccc1CO)NCC(C)C 34a_100012183141_100000210624 [0,1,0,0,0,1|1,0,0]=3 3871 B15R1.12854 COc1cc(ccc1CO)NCC(C)O 34a_100012183141_100011218427 [0,1,0,0,0,1|1,0,0]=3 3872 B15R1.12854 COc1cc(ccc1CO)NCC(F)F 34a_100012183141_100011934356 [0,1,0,0,0,1|2,0,0]=4 3873 B15R1.12854 COc1cc(ccc1CO)NC[C@@H](C)O 34a_100012183141_100009817552 [0,1,0,0,0,1|1,0,0]=3 3874 B15R1.12854 COc1cc(ccc1CO)OCC(=O)C 1458a_200000048963_200000210301 [0,1,0,0,0,1|1,0,1]=4 3875 B15R1.12854 COc1cc(ccc1CO)OCC(=O)N 34a_200000116926_100000187820 [0,1,0,0,0,1|1,0,1]=4 3876 B15R1.12854 COc1cc(ccc1CO)OCC(=O)[13CH3] 1458a_200000048963_200025704644 [0,1,0,0,0,1|1,0,1]=4 3877 B15R1.12854 COc1cc(ccc1CO)OCC(C)C 34a_200000116926_100000210624 [0,1,0,0,0,1|1,0,0]=3 3878 B15R1.12854 COc1cc(ccc1CO)OCC(C)O 34a_200000116926_100011218427 [0,1,0,0,0,1|1,0,0]=3 3879 B15R1.12854 COc1cc(ccc1CO)OCC(F)F 34a_200000116926_100011934356 [0,1,0,0,0,1|2,0,0]=4 3880 B15R1.12854 COc1cc(ccc1CO)OC[C@@H](C)O 34a_200000116926_100009817552 [0,1,0,0,0,1|1,0,0]=3 3881 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100000747473_100011277633 [0,1,0,0,0,1|1,0,1]=4 3882 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100011277633_100000747473 [0,1,0,0,0,1|1,0,1]=4 3883 B15R1.12854 COc1cc(ccc1CO)SCC(C)C 62a_100000210624_100011277633 [0,1,0,0,0,1|1,0,0]=3 3884 B15R1.12854 COc1cc(ccc1CO)SCC(C)C 62a_100011277633_100000210760 [0,1,0,0,0,1|1,0,0]=3 3885 B15R1.12854 COc1cc(ccc1CO)SCC(C)O 62a_100011218427_100011277633 [0,1,0,0,0,1|1,0,0]=3 3886 B15R1.12854 COc1cc(ccc1CO)SCC(C)O 62a_100011277633_100011218427 [0,1,0,0,0,1|1,0,0]=3 3887 B15R1.12854 COc1cc(ccc1CO)SCC(F)F 62a_100011277633_100011934356 [0,1,0,0,0,1|2,0,0]=4 3888 B15R1.12854 COc1cc(ccc1CO)SCC(F)F 62a_100011934356_100011277633 [0,1,0,0,0,1|2,0,0]=4 3889 B15R1.12854 COc1cc(ccc1CO)SC[C@@H](C)O 62a_100009817552_100011277633 [0,1,0,0,0,1|1,0,0]=3 3890 B15R1.12854 COc1cc(ccc1CO)SC[C@@H](C)O 62a_100011277633_100009817552 [0,1,0,0,0,1|1,0,0]=3 3891 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 34a_100011290831_200025704644 [0,1,0,0,0,1|1,0,1]=4 3892 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 7a_100011290831_200025704644 [0,1,0,0,0,1|1,0,1]=4 3893 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 34a_100000046322_200025704644 [0,1,0,0,0,1|1,0,1]=4 3894 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 7a_100000046322_200025704644 [0,1,0,0,0,1|1,0,1]=4 3895 B15R1.12854 COc1cc(ccc1SC)CNC(C)C 207a_100138425928_100000050949 [0,1,0,0,0,1|1,1,0]=4 3896 B15R1.12854 COc1cc(ccc1SC)SCC(C)C 62a_200011001119_100000210760 [0,1,0,0,0,1|1,1,0]=4 3897 B15R1.12854 COc1cc(ccc1SC)SCC(C)O 62a_200011001119_100011218427 [0,1,0,0,0,1|1,1,0]=4 3898 B15R1.12854 COc1cc(ccc1SC)SC[C@@H](C)O 62a_200011001119_100009817552 [0,1,0,0,0,1|1,1,0]=4 3899 B15R1.12854 COc1cc(cnc1CO)SCC(C)C 62a_100000210624_200010246159 [0,1,0,0,0,1|2,0,0]=4 3900 B15R1.12854 COc1cc(cnc1CO)SCC(C)C 62a_200010246159_100000210760 [0,1,0,0,0,1|2,0,0]=4 3901 B15R1.12854 COc1cc(cnc1CO)SCC(C)O 62a_100011218427_200010246159 [0,1,0,0,0,1|2,0,0]=4 3902 B15R1.12854 COc1cc(cnc1CO)SCC(C)O 62a_200010246159_100011218427 [0,1,0,0,0,1|2,0,0]=4 3903 B15R1.12854 COc1cc(cnc1CO)SC[C@@H](C)O 62a_100009817552_200010246159 [0,1,0,0,0,1|2,0,0]=4 3904 B15R1.12854 COc1cc(cnc1CO)SC[C@@H](C)O 62a_200010246159_100009817552 [0,1,0,0,0,1|2,0,0]=4 3905 B15R1.12854 COc1cc(cnc1OC)CNC(C)C 207a_100138425928_100000117638 [0,1,0,0,0,1|2,0,0]=4 3906 B15R1.12854 COc1cc(cnc1OC)SCC(C)C 62a_100000210624_100010234541 [0,1,0,0,0,1|2,0,0]=4 3907 B15R1.12854 COc1cc(cnc1OC)SCC(C)O 62a_100011218427_100010234541 [0,1,0,0,0,1|2,0,0]=4 3908 B15R1.12854 COc1cc(cnc1OC)SC[C@@H](C)O 62a_100009817552_100010234541 [0,1,0,0,0,1|2,0,0]=4 3909 B15R1.12854 COc1cc(ncc1CO)SCC(C)C 62a_100000210624_100010714672 [0,1,0,0,0,1|2,0,0]=4 3910 B15R1.12854 COc1cc(ncc1CO)SCC(C)C 62a_100010714672_100000210760 [0,1,0,0,0,1|2,0,0]=4 3911 B15R1.12854 COc1cc(ncc1CO)SCC(C)O 62a_100010714672_100011218427 [0,1,0,0,0,1|2,0,0]=4 3912 B15R1.12854 COc1cc(ncc1CO)SCC(C)O 62a_100011218427_100010714672 [0,1,0,0,0,1|2,0,0]=4 3913 B15R1.12854 COc1cc(ncc1CO)SC[C@@H](C)O 62a_100009817552_100010714672 [0,1,0,0,0,1|2,0,0]=4 3914 B15R1.12854 COc1cc(ncc1CO)SC[C@@H](C)O 62a_100010714672_100009817552 [0,1,0,0,0,1|2,0,0]=4 3915 B15R1.12854 COc1ccc(cc1OC)C=CC(C)C 271570a_100016257149_100000187503 [0,1,0,0,0,1|1,0,1]=4 3916 B15R1.12854 COc1ccc(cc1OC)C=CC(C)O 271570a_200011019289_100000187503 [0,1,0,0,0,1|1,0,1]=4 3917 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000070787_100011740610 [0,1,0,0,0,1|1,0,1]=4 3918 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000187252_200000210301 [0,1,0,0,0,1|1,0,1]=4 3919 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 34a_100011290831_200000210301 [0,1,0,0,0,1|1,0,1]=4 3920 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 7a_100011290831_200000210301 [0,1,0,0,0,1|1,0,1]=4 3921 B15R1.12854 COc1ccc(cc1OC)CCC(=O)[13CH3] 1458a_100000187252_200025704644 [0,1,0,0,0,1|1,0,1]=4 3922 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 2230a_100000211294_200000210301 [0,1,0,0,0,1|2,0,0]=4 3923 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 2230a_100102631434_100011273988 [0,1,0,0,0,1|2,0,0]=4 3924 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 269982a_100000211294_200000210301 [0,1,0,0,0,1|2,0,0]=4 3925 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 269982a_100102631434_100011273988 [0,1,0,0,0,1|2,0,0]=4 3926 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 270004a_100102631434_100011754369 [0,1,0,0,0,1|2,0,0]=4 3927 B15R1.12854 COc1ccc(cc1OC)CCN(C)[13CH3] 2230a_100000211294_200025704644 [0,1,0,0,0,1|2,0,0]=4 3928 B15R1.12854 COc1ccc(cc1OC)CCN(C)[13CH3] 269982a_100000211294_200025704644 [0,1,0,0,0,1|2,0,0]=4 3929 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 11a_100000185555_100015343762 [0,1,0,0,0,1|1,0,1]=4 3930 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 1626a_100000185555_100015343762 [0,1,0,0,0,1|1,0,1]=4 3931 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 240690a_100000185555_100015343762 [0,1,0,0,0,1|1,0,1]=4 3932 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 34a_100000046322_200000210301 [0,1,0,0,0,1|1,0,1]=4 3933 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 527a_100000185555_100103153847 [0,1,0,0,0,1|1,0,1]=4 3934 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 7a_100000046322_200000210301 [0,1,0,0,0,1|1,0,1]=4 3935 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 207a_100138425928_100000170513 [0,1,0,0,0,1|1,0,0]=3 3936 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 2230a_100138425928_100011233839 [0,1,0,0,0,1|1,0,0]=3 3937 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 34a_100000185555_100000210206 [0,1,0,0,0,1|1,0,0]=3 3938 B15R1.12854 COc1ccc(cc1OC)COC(C)C 34a_100000210929_100000210206 [0,1,0,0,0,1|1,0,0]=3 3939 B15R1.12854 COc1ccc(cc1OC)CSC(C)C 62a_100000210206_100011233839 [0,1,0,0,0,1|1,0,0]=3 3940 B15R1.12854 COc1ccc(cc1OC)NCC(=O)N 34a_100000187404_100000187820 [0,1,0,0,0,1|1,0,1]=4 3941 B15R1.12854 COc1ccc(cc1OC)NCC(C)C 34a_100000187404_100000210624 [0,1,0,0,0,1|1,0,0]=3 3942 B15R1.12854 COc1ccc(cc1OC)NCC(C)O 34a_100000187404_100011218427 [0,1,0,0,0,1|1,0,0]=3 3943 B15R1.12854 COc1ccc(cc1OC)NCC(F)F 34a_100000187404_100011934356 [0,1,0,0,0,1|2,0,0]=4 3944 B15R1.12854 COc1ccc(cc1OC)NC[C@@H](C)O 34a_100000187404_100009817552 [0,1,0,0,0,1|1,0,0]=3 3945 B15R1.12854 COc1ccc(cc1OC)OCC(=O)N 34a_100000039706_100000187820 [0,1,0,0,0,1|1,0,1]=4 3946 B15R1.12854 COc1ccc(cc1OC)OCC(C)C 34a_100000039706_100000210624 [0,1,0,0,0,1|1,0,0]=3 3947 B15R1.12854 COc1ccc(cc1OC)OCC(C)O 34a_100000039706_100011218427 [0,1,0,0,0,1|1,0,0]=3 3948 B15R1.12854 COc1ccc(cc1OC)OCC(F)F 34a_100000039706_100011934356 [0,1,0,0,0,1|2,0,0]=4 3949 B15R1.12854 COc1ccc(cc1OC)OC[C@@H](C)O 34a_100000039706_100009817552 [0,1,0,0,0,1|1,0,0]=3 3950 B15R1.12854 COc1ccc(cc1OC)SCC(=O)N 62a_100000747473_100011356967 [0,1,0,0,0,1|1,0,1]=4 3951 B15R1.12854 COc1ccc(cc1OC)SCC(C)C 62a_100000210624_100011356967 [0,1,0,0,0,1|1,0,0]=3 3952 B15R1.12854 COc1ccc(cc1OC)SCC(C)O 62a_100011218427_100011356967 [0,1,0,0,0,1|1,0,0]=3 3953 B15R1.12854 COc1ccc(cc1OC)SCC(F)F 62a_100011934356_100011356967 [0,1,0,0,0,1|2,0,0]=4 3954 B15R1.12854 COc1ccc(cc1OC)SC[C@@H](C)O 62a_100009817552_100011356967 [0,1,0,0,0,1|1,0,0]=3 3955 B15R1.12854 COc1ccc(cc1SC)SCC(C)C 62a_200009892704_100000210760 [0,1,0,0,0,1|1,1,0]=4 3956 B15R1.12854 COc1ccc(cc1SC)SCC(C)O 62a_200009892704_100011218427 [0,1,0,0,0,1|1,1,0]=4 3957 B15R1.12854 COc1ccc(cc1SC)SC[C@@H](C)O 62a_200009892704_100009817552 [0,1,0,0,0,1|1,1,0]=4 3958 B15R1.12854 COc1ccc(nc1OC)SCC(C)C 62a_100000210624_100010214848 [0,1,0,0,0,1|2,0,0]=4 3959 B15R1.12854 COc1ccc(nc1OC)SCC(C)O 62a_100011218427_100010214848 [0,1,0,0,0,1|2,0,0]=4 3960 B15R1.12854 COc1ccc(nc1OC)SC[C@@H](C)O 62a_100009817552_100010214848 [0,1,0,0,0,1|2,0,0]=4 3961 B15R1.12854 COc1nc(ccc1CO)SCC(C)C 62a_100000210624_100010988397 [0,1,0,0,0,1|2,0,0]=4 3962 B15R1.12854 COc1nc(ccc1CO)SCC(C)C 62a_100010988397_100000210760 [0,1,0,0,0,1|2,0,0]=4 3963 B15R1.12854 COc1nc(ccc1CO)SCC(C)O 62a_100010988397_100011218427 [0,1,0,0,0,1|2,0,0]=4 3964 B15R1.12854 COc1nc(ccc1CO)SCC(C)O 62a_100011218427_100010988397 [0,1,0,0,0,1|2,0,0]=4 3965 B15R1.12854 COc1nc(ccc1CO)SC[C@@H](C)O 62a_100009817552_100010988397 [0,1,0,0,0,1|2,0,0]=4 3966 B15R1.12854 COc1nc(ccc1CO)SC[C@@H](C)O 62a_100010988397_100009817552 [0,1,0,0,0,1|2,0,0]=4 3967 B15R1.391 COc1cc(cc(c1O)Cl)C(=O)C(C)C 1458a_100000209947_100000210206 [0,2,0,0,0,0|1,0,1]=4 3968 B15R1.391 COc1cc(cc(c1O)O)C(=O)C(C)C 1458a_100000061230_100000210206 [0,2,0,0,0,0|1,0,1]=4 3969 B15R1.530 CCOc1cc(ccc1O)C(=O)C(C)C 1458a_100011260950_100000210206 [0,2,0,0,0,0|1,0,1]=4 3970 B15R1.4029 C#CC(C)C(=O)c1ccc(c(c1)OC)O 1458a_100000687070_200000035995 [0,2,0,0,0,0|1,0,1]=4 3971 B15R1.4029 CCC(=O)C(O)c1ccc(c(c1)OC)O 1458a_100000036414_100000210202 [0,2,0,0,0,0|1,0,1]=4 3972 B15R1.4029 CCC(C)C(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000758301 [0,2,0,0,0,0|1,0,1]=4 3973 B15R1.4029 CNC(=O)C(O)c1ccc(c(c1)OC)O 240690a_100102657272_100000036414 [0,2,0,0,0,0|1,0,1]=4 3974 B15R1.4029 COc1cc(ccc1O)C(=O)C(C)C#N 1458a_100000687070_100000703298 [0,2,0,0,0,0|0,0,2]=4 3975 B15R1.4029 COc1cc(ccc1O)C(O)C(=O)CF 1458a_100000036414_100015361967 [0,2,0,0,0,0|1,0,1]=4 3976 B15R1.12853 COc1ccc(cc1OC)C(=O)C(C)C 1458a_100000211223_100000210206 [0,2,0,0,0,0|1,0,1]=4 3977 B15R1.369 COc1cc(cc(c1OC)Br)CN(C)C 270004a_100102631434_100000183470 [0,2,0,0,0,0|2,0,0]=4 3978 B15R1.369 COc1cc(cc(c1OC)Cl)CC(=O)C 34a_200010006941_200000210301 [0,2,0,0,0,0|1,0,1]=4 3979 B15R1.369 COc1cc(cc(c1OC)Cl)CC(=O)C 7a_200010006941_200000210301 [0,2,0,0,0,0|1,0,1]=4 3980 B15R1.369 COc1cc(cc(c1OC)Cl)CN(C)C 270004a_100102631434_100000184546 [0,2,0,0,0,0|2,0,0]=4 3981 B15R1.369 COc1cc(cc(c1OC)I)CN(C)C 270004a_100102631434_100000188315 [0,2,0,0,0,0|2,0,0]=4 3982 B15R1.369 COc1cc(cc(c1O[13CH3])Cl)CC(=O)C 34a_200010006941_200025704644 [0,2,0,0,0,0|1,0,1]=4 3983 B15R1.369 COc1cc(cc(c1O[13CH3])Cl)CC(=O)C 7a_200010006941_200025704644 [0,2,0,0,0,0|1,0,1]=4 3984 B15R1.370 COc1cc(cc(c1O)O)SC(C)(C)C 62a_100000211941_200159242197 [0,2,0,0,0,0|2,0,0]=4 3985 B15R1.371 C#CC(C)Sc1cc(c(c(c1)OC)O)O 62a_200000035995_200159242197 [0,2,0,0,0,0|2,0,0]=4 3986 B15R1.371 C=CC(C)Sc1cc(c(c(c1)OC)O)O 62a_100011215867_200159242197 [0,2,0,0,0,0|2,0,0]=4 3987 B15R1.371 CCC(=O)Cc1cc(c(c(c1)OC)O)Br 1458a_100009814412_100000210202 [0,2,0,0,0,0|1,0,1]=4 3988 B15R1.371 CCC(C)Sc1cc(c(c(c1)OC)O)O 62a_100000758301_200159242197 [0,2,0,0,0,0|2,0,0]=4 3989 B15R1.371 CNC(=O)Cc1cc(c(c(c1)OC)O)Br 240690a_100102657272_100009814412 [0,2,0,0,0,0|1,0,1]=4 3990 B15R1.371 CNC(=O)Cc1cc(c(c(c1)OC)O)Br 527a_100102657272_100009814412 [0,2,0,0,0,0|1,0,1]=4 3991 B15R1.371 COc1cc(cc(c1O)Br)CC(=O)CF 1458a_100009814412_100015361967 [0,2,0,0,0,0|1,0,1]=4 3992 B15R1.371 COc1cc(cc(c1O)O)SC(C)C#N 62a_100000703298_200159242197 [0,2,0,0,0,0|1,0,1]=4 3993 B15R1.371 COc1cc(cc(c1O)O)SC(C)CO 62a_100012180447_200159242197 [0,2,0,0,0,0|2,0,0]=4 3994 B15R1.371 COc1cc(cc(c1O)O)SC(C)OC 62a_100009879195_200159242197 [0,2,0,0,0,0|2,0,0]=4 3995 B15R1.371 COc1cc(cc(c1O)O)S[C@H](C)CO 62a_100016084084_200159242197 [0,2,0,0,0,0|2,0,0]=4 3996 B15R1.390 COc1cc(cc(c1O)C=O)SC(C)C 62a_100000210206_100000047136 [0,2,0,0,0,0|2,0,0]=4 3997 B15R1.390 COc1cc(cc(c1O)CO)SC(C)C 62a_100000210206_100000185604 [0,2,0,0,0,0|2,0,0]=4 3998 B15R1.390 COc1cc(cc(c1O)OC)CC(=O)C 1458a_100000043605_200000210301 [0,2,0,0,0,0|1,0,1]=4 3999 B15R1.390 COc1cc(cc(c1O)OC)CC(=O)[13CH3] 1458a_100000043605_200025704644 [0,2,0,0,0,0|1,0,1]=4 4000 B15R1.529 CCOc1cc(ccc1OC)CC(=O)C 34a_200000075426_200000210301 [0,2,0,0,0,0|1,0,1]=4 4001 B15R1.529 CCOc1cc(ccc1OC)CC(=O)C 7a_200000075426_200000210301 [0,2,0,0,0,0|1,0,1]=4 4002 B15R1.529 CCOc1cc(ccc1OC)CN(C)C 2230a_100015183996_200000210301 [0,2,0,0,0,0|2,0,0]=4 4003 B15R1.529 CCOc1cc(ccc1OC)CN(C)C 269982a_100015183996_200000210301 [0,2,0,0,0,0|2,0,0]=4 4004 B15R1.529 CCOc1cc(ccc1OC)CN(C)C 270004a_100102631434_100000170514 [0,2,0,0,0,0|2,0,0]=4 4005 B15R1.529 CCOc1cc(ccc1OC)CN(C)[13CH3] 2230a_100015183996_200025704644 [0,2,0,0,0,0|2,0,0]=4 4006 B15R1.529 CCOc1cc(ccc1OC)CN(C)[13CH3] 269982a_100015183996_200025704644 [0,2,0,0,0,0|2,0,0]=4 4007 B15R1.529 CCOc1cc(ccc1O[13CH3])CC(=O)C 34a_200000075426_200025704644 [0,2,0,0,0,0|1,0,1]=4 4008 B15R1.529 CCOc1cc(ccc1O[13CH3])CC(=O)C 7a_200000075426_200025704644 [0,2,0,0,0,0|1,0,1]=4 4009 B15R1.529 COCc1cc(ccc1OC)CN(C)C 270004a_100102631434_100000708483 [0,2,0,0,0,0|2,0,0]=4 4010 B15R1.529 COCc1cc(ccc1OC)SC(C)C 62a_100000210206_200011493686 [0,2,0,0,0,0|2,0,0]=4 4011 B15R1.529 COCc1cc(ccc1OC)SC(C)C 62a_200011493686_100000210206 [0,2,0,0,0,0|2,0,0]=4 4012 B15R1.926 COC(=O)c1cc(ccc1O)SC(C)C 62a_100000210206_100000149868 [0,2,0,0,0,0|2,0,0]=4 4013 B15R1.1006 COCSc1cc(ccc1O)CC(=O)C 62a_100000766300_100010141077 [0,2,0,0,0,0|1,0,1]=4 4014 B15R1.1006 COCSc1cc(ccc1O)CC(=O)C 62a_100010141077_100000766300 [0,2,0,0,0,0|1,0,1]=4 4015 B15R1.9222 CCOc1cc(ccc1O)CC(=O)CC 1458a_200000048972_100000210202 [0,2,0,0,0,0|1,0,1]=4 4016 B15R1.9222 CCOc1cc(ccc1O)CC(=O)CF 1458a_200000048972_100015361967 [0,2,0,0,0,0|1,0,1]=4 4017 B15R1.9222 CCOc1cc(ccc1O)CC(=O)NC 240690a_100102657272_200000048972 [0,2,0,0,0,0|1,0,1]=4 4018 B15R1.9222 CCOc1cc(ccc1O)CC(=O)NC 527a_100102657272_200000048972 [0,2,0,0,0,0|1,0,1]=4 4019 B15R1.1788 COc1cc(c(cc1O)C=O)SC(C)C 62a_100000210206_100000183646 [0,2,0,0,0,0|2,0,0]=4 4020 B15R1.1793 COc1cc(c(cc1O)F)SC(C)(C)C 62a_100000211941_100010189133 [0,2,0,0,0,0|2,0,0]=4 4021 B15R1.1794 C#CC(C)Sc1cc(c(cc1F)O)OC 62a_200000035995_100010189133 [0,2,0,0,0,0|2,0,0]=4 4022 B15R1.1794 C=CC(C)Sc1cc(c(cc1F)O)OC 62a_100011215867_100010189133 [0,2,0,0,0,0|2,0,0]=4 4023 B15R1.1794 CCC(=O)Cc1cc(c(cc1Br)O)OC 1458a_100009814189_100000210202 [0,2,0,0,0,0|1,0,1]=4 4024 B15R1.1794 CCC(C)Sc1cc(c(cc1F)O)OC 62a_100000758301_100010189133 [0,2,0,0,0,0|2,0,0]=4 4025 B15R1.1794 CNC(=O)Cc1cc(c(cc1Br)O)OC 240690a_100102657272_100009814189 [0,2,0,0,0,0|1,0,1]=4 4026 B15R1.1794 COc1cc(c(cc1O)Br)CC(=O)CF 1458a_100009814189_100015361967 [0,2,0,0,0,0|1,0,1]=4 4027 B15R1.1794 COc1cc(c(cc1O)F)SC(C)C#N 62a_100000703298_100010189133 [0,2,0,0,0,0|1,0,1]=4 4028 B15R1.1794 COc1cc(c(cc1O)F)SC(C)CO 62a_100012180447_100010189133 [0,2,0,0,0,0|2,0,0]=4 4029 B15R1.1794 COc1cc(c(cc1O)F)SC(C)OC 62a_100009879195_100010189133 [0,2,0,0,0,0|2,0,0]=4 4030 B15R1.1794 COc1cc(c(cc1O)F)S[C@H](C)CO 62a_100016084084_100010189133 [0,2,0,0,0,0|2,0,0]=4 4031 B15R1.1799 COc1cc(c(cc1OC)CC(=O)C)Br 1458a_100000070787_100011375086 [0,2,0,0,0,0|1,0,1]=4 4032 B15R1.1799 COc1cc(c(cc1OC)CC(=O)C)Br 1458a_100000204571_200000210301 [0,2,0,0,0,0|1,0,1]=4 4033 B15R1.1799 COc1cc(c(cc1OC)CC(=O)C)I 1458a_200010005243_200000210301 [0,2,0,0,0,0|1,0,1]=4 4034 B15R1.1799 COc1cc(c(cc1OC)CC(=O)C)O 271570a_203496583355_200009994825 [0,2,0,0,0,0|1,0,1]=4 4035 B15R1.1799 COc1cc(c(cc1OC)CC(=O)[13CH3])Br 1458a_100000204571_200025704644 [0,2,0,0,0,0|1,0,1]=4 4036 B15R1.1799 COc1cc(c(cc1OC)CC(=O)[13CH3])I 1458a_200010005243_200025704644 [0,2,0,0,0,0|1,0,1]=4 4037 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)Br 269982a_100102631434_100011375086 [0,2,0,0,0,0|2,0,0]=4 4038 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)Br 270004a_100102631434_100000170863 [0,2,0,0,0,0|2,0,0]=4 4039 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)C 270004a_100102631434_100000685059 [0,2,0,0,0,0|2,0,0]=4 4040 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)Cl 270004a_100102631434_100000186741 [0,2,0,0,0,0|2,0,0]=4 4041 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)F 270004a_100102631434_100011218750 [0,2,0,0,0,0|2,0,0]=4 4042 B15R1.1799 COc1cc(c(cc1OC)CN(C)C)I 270004a_100102631434_100010174930 [0,2,0,0,0,0|2,0,0]=4 4043 B15R1.1799 COc1cc(c(cc1OC)NC(C)C)C 34a_100000183460_100000210206 [0,2,0,0,0,0|2,0,0]=4 4044 B15R1.1799 COc1cc(c(cc1OC)NC(C)C)F 34a_100000753170_100000210206 [0,2,0,0,0,0|2,0,0]=4 4045 B15R1.1799 COc1cc(c(cc1OC)SC(C)C)F 62a_200011765842_100000210206 [0,2,0,0,0,0|2,0,0]=4 4046 B15R1.1277 C#CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000184674 [0,2,0,0,0,0|1,0,1]=4 4047 B15R1.1277 C=CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210623 [0,2,0,0,0,0|1,0,1]=4 4048 B15R1.1277 CCCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210303 [0,2,0,0,0,0|1,0,1]=4 4049 B15R1.1277 CCCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000766640 [0,2,0,0,0,0|2,0,0]=4 4050 B15R1.1277 CCCC(C)Sc1ccc(c(c1)OC)O 62a_100000766640_100000694246 [0,2,0,0,0,0|2,0,0]=4 4051 B15R1.1277 CCNC(=O)Cc1ccc(c(c1)OC)O 240690a_100015525214_100000032101 [0,2,0,0,0,0|1,0,1]=4 4052 B15R1.1277 CCNC(=O)Cc1ccc(c(c1)OC)O 527a_100015525214_100000032101 [0,2,0,0,0,0|1,0,1]=4 4053 B15R1.1277 CCNC(C)Cc1ccc(c(c1)OC)C 270004a_100015525214_200000081148 [0,2,0,0,0,0|1,0,0]=3 4054 B15R1.1277 CCNC(C)Cc1ccc(c(c1)OC)F 270004a_100015525214_200000078651 [0,2,0,0,0,0|1,0,0]=3 4055 B15R1.1277 CNNC(=O)Cc1ccc(c(c1)OC)O 22a_100016993582_100000032101 [0,2,0,0,0,0|1,0,1]=4 4056 B15R1.1277 COCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000765312 [0,2,0,0,0,0|2,0,0]=4 4057 B15R1.1277 COCC(C)Sc1ccc(c(c1)OC)O 62a_100000765312_100000694246 [0,2,0,0,0,0|2,0,0]=4 4058 B15R1.1277 COc1cc(ccc1O)CC(=O)CC#N 1458a_100000032101_100011214920 [0,2,0,0,0,0|1,0,1]=4 4059 B15R1.1277 COc1cc(ccc1O)CC(=O)CCF 1458a_100000032101_100011217306 [0,2,0,0,0,0|1,0,1]=4 4060 B15R1.1277 COc1cc(ccc1O)CC(=O)CCO 1458a_100000032101_100000211926 [0,2,0,0,0,0|1,0,1]=4 4061 B15R1.1277 COc1cc(ccc1O)NC(C)CCO 34a_100000726020_100009893172 [0,2,0,0,0,0|2,0,0]=4 4062 B15R1.1277 COc1cc(ccc1O)SC(C)CC#N 62a_100009813641_100000694246 [0,2,0,0,0,0|1,0,1]=4 4063 B15R1.1277 COc1cc(ccc1O)SC(C)CCO 62a_100009893172_100000694246 [0,2,0,0,0,0|2,0,0]=4 4064 B15R1.3769 C#CC(C)Nc1ccc(c(c1)OC)CO 34a_100012183141_200000035995 [0,2,0,0,0,0|2,0,0]=4 4065 B15R1.3769 C#CC(C)Nc1ccc(c(c1)OC)OC 34a_100000187404_200000035995 [0,2,0,0,0,0|2,0,0]=4 4066 B15R1.3769 C#CC(C)Oc1ccc(c(c1)OC)CO 34a_200000116926_200000035995 [0,2,0,0,0,0|2,0,0]=4 4067 B15R1.3769 C#CC(C)Oc1ccc(c(c1)OC)OC 34a_100000039706_200000035995 [0,2,0,0,0,0|2,0,0]=4 4068 B15R1.3769 C#CC(C)Sc1ccc(c(c1)OC)CO 62a_200000035995_100011277633 [0,2,0,0,0,0|2,0,0]=4 4069 B15R1.3769 C#CC(C)Sc1ccc(c(c1)OC)OC 62a_200000035995_100011356967 [0,2,0,0,0,0|2,0,0]=4 4070 B15R1.3769 C=CC(C)Sc1ccc(c(c1)OC)CO 62a_100011215867_100011277633 [0,2,0,0,0,0|2,0,0]=4 4071 B15R1.3769 C=CC(C)Sc1ccc(c(c1)OC)OC 62a_100011215867_100011356967 [0,2,0,0,0,0|2,0,0]=4 4072 B15R1.3769 CCC(=O)Cc1ccc(c(c1)OC)OC 1458a_100000184093_100000210202 [0,2,0,0,0,0|1,0,1]=4 4073 B15R1.3769 CCC(C)Nc1ccc(c(c1)OC)CO 34a_100012183141_100011215416 [0,2,0,0,0,0|2,0,0]=4 4074 B15R1.3769 CCC(C)Nc1ccc(c(c1)OC)OC 34a_100000187404_100011215416 [0,2,0,0,0,0|2,0,0]=4 4075 B15R1.3769 CCC(C)Oc1ccc(c(c1)OC)CO 34a_200000116926_100011215416 [0,2,0,0,0,0|2,0,0]=4 4076 B15R1.3769 CCC(C)Oc1ccc(c(c1)OC)OC 34a_100000039706_100011215416 [0,2,0,0,0,0|2,0,0]=4 4077 B15R1.3769 CCC(C)Sc1ccc(c(c1)OC)CO 62a_100000758301_100011277633 [0,2,0,0,0,0|2,0,0]=4 4078 B15R1.3769 CCC(C)Sc1ccc(c(c1)OC)CO 62a_100011277633_100000758301 [0,2,0,0,0,0|2,0,0]=4 4079 B15R1.3769 CCC(C)Sc1ccc(c(c1)OC)OC 62a_100000758301_100011356967 [0,2,0,0,0,0|2,0,0]=4 4080 B15R1.3769 CCN(C)Cc1ccc(c(c1)OC)OC 2230a_100000180827_100000210202 [0,2,0,0,0,0|2,0,0]=4 4081 B15R1.3769 CCN(C)Cc1ccc(c(c1)OC)OC 2230a_100000225621_100011233839 [0,2,0,0,0,0|2,0,0]=4 4082 B15R1.3769 CCN(C)Cc1ccc(c(c1)OC)OC 269982a_100000180827_100000204670 [0,2,0,0,0,0|2,0,0]=4 4083 B15R1.3769 CCN(C)Cc1ccc(c(c1)OC)OC 269982a_100000225621_100011233839 [0,2,0,0,0,0|2,0,0]=4 4084 B15R1.3769 CNC(=O)Cc1ccc(c(c1)OC)OC 11a_106832991635_100000184093 [0,2,0,0,0,0|1,0,1]=4 4085 B15R1.3769 CNC(=O)Cc1ccc(c(c1)OC)OC 240690a_100102657272_100000184093 [0,2,0,0,0,0|1,0,1]=4 4086 B15R1.3769 CNC(=O)Cc1ccc(c(c1)OC)OC 527a_100102657272_100000184093 [0,2,0,0,0,0|1,0,1]=4 4087 B15R1.3769 CNC(C)Cc1ccc(c(c1)OC)OC 270004a_106832991635_100000211454 [0,2,0,0,0,0|0,0,0]=2 4088 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100000074908_200000210301 [0,2,0,0,0,0|1,0,1]=4 4089 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100009869222_200000210301 [0,2,0,0,0,0|1,0,1]=4 4090 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)O[13CH3] 34a_100000074908_200025704644 [0,2,0,0,0,0|1,0,1]=4 4091 B15R1.3769 COC(=O)Cc1ccc(c(c1)O[13CH3])OC 34a_100009869222_200025704644 [0,2,0,0,0,0|1,0,1]=4 4092 B15R1.3769 COc1cc(ccc1CO)NC(C)CO 34a_100012183141_100012180447 [0,2,0,0,0,0|2,0,0]=4 4093 B15R1.3769 COc1cc(ccc1CO)OC(C)CO 34a_200000116926_100012180447 [0,2,0,0,0,0|2,0,0]=4 4094 B15R1.3769 COc1cc(ccc1CO)SC(C)C#N 62a_100000703298_100011277633 [0,2,0,0,0,0|1,0,1]=4 4095 B15R1.3769 COc1cc(ccc1CO)SC(C)C#N 62a_100011277633_100000703298 [0,2,0,0,0,0|1,0,1]=4 4096 B15R1.3769 COc1cc(ccc1CO)SC(C)CO 62a_100012180447_100011277633 [0,2,0,0,0,0|2,0,0]=4 4097 B15R1.3769 COc1cc(ccc1CO)SC(C)OC 62a_100009879195_100011277633 [0,2,0,0,0,0|2,0,0]=4 4098 B15R1.3769 COc1cc(ccc1CO)SC(C)OC 62a_100011277633_100009879195 [0,2,0,0,0,0|2,0,0]=4 4099 B15R1.3769 COc1cc(ccc1CO)S[C@H](C)CO 62a_100011277633_100016084084 [0,2,0,0,0,0|2,0,0]=4 4100 B15R1.3769 COc1cc(ccc1CO)S[C@H](C)CO 62a_100016084084_100011277633 [0,2,0,0,0,0|2,0,0]=4 4101 B15R1.3769 COc1ccc(cc1OC)CC(=O)CF 1458a_100000184093_100015361967 [0,2,0,0,0,0|1,0,1]=4 4102 B15R1.3769 COc1ccc(cc1OC)CC(C)OC 34a_100011303635_200000210301 [0,2,0,0,0,0|1,0,0]=3 4103 B15R1.3769 COc1ccc(cc1OC)CC(C)OC 7a_100011303635_200000210301 [0,2,0,0,0,0|1,0,0]=3 4104 B15R1.3769 COc1ccc(cc1OC)CC(C)O[13CH3] 34a_100011303635_200025704644 [0,2,0,0,0,0|1,0,0]=3 4105 B15R1.3769 COc1ccc(cc1OC)CC(C)O[13CH3] 7a_100011303635_200025704644 [0,2,0,0,0,0|1,0,0]=3 4106 B15R1.3769 COc1ccc(cc1OC)CN(C)CF 269982a_100000180827_100015361967 [0,2,0,0,0,0|2,0,0]=4 4107 B15R1.3769 COc1ccc(cc1OC)NC(C)CO 34a_100000187404_100012180447 [0,2,0,0,0,0|2,0,0]=4 4108 B15R1.3769 COc1ccc(cc1OC)OC(C)CO 34a_100000039706_100012180447 [0,2,0,0,0,0|2,0,0]=4 4109 B15R1.3769 COc1ccc(cc1OC)SC(C)C#N 62a_100000703298_100011356967 [0,2,0,0,0,0|1,0,1]=4 4110 B15R1.3769 COc1ccc(cc1OC)SC(C)CO 62a_100012180447_100011356967 [0,2,0,0,0,0|2,0,0]=4 4111 B15R1.3769 COc1ccc(cc1OC)SC(C)OC 62a_100009879195_100011356967 [0,2,0,0,0,0|2,0,0]=4 4112 B15R1.3769 COc1ccc(cc1OC)S[C@H](C)CO 62a_100016084084_100011356967 [0,2,0,0,0,0|2,0,0]=4 4113 B15R1.4040 CCC(CC)Sc1ccc(c(c1)OC)O 62a_100000210505_100000694246 [0,2,0,0,0,0|2,0,0]=4 4114 B15R1.17595 C#CC(C)(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000038118 [0,2,0,0,0,0|2,0,0]=4 4115 B15R1.17595 C#CC(C)(C)Sc1ccc(c(c1)OC)O 62a_100000038118_100000694246 [0,2,0,0,0,0|2,0,0]=4 4116 B15R1.17595 CCC(C)(C)Sc1ccc(c(c1)OC)O 62a_100000032637_100000694246 [0,2,0,0,0,0|2,0,0]=4 4117 B15R1.17595 COc1cc(ccc1O)NC(C)(C)C#N 34a_100000726020_100011162410 [0,2,0,0,0,0|1,0,1]=4 4118 B15R1.17595 COc1cc(ccc1O)SC(C)(C)C#N 62a_100011162410_100000694246 [0,2,0,0,0,0|1,0,1]=4 4119 B15R1.17595 COc1cc(ccc1O)SC(F)(F)CO 62a_100011217949_100000694246 [0,2,0,0,0,0|2,0,0]=4 4120 B15R1.3768 COc1cc(ccc1CO)NC(C)(C)C 34a_100012183141_100000210625 [0,2,0,0,0,0|2,0,0]=4 4121 B15R1.3768 COc1cc(ccc1CO)OC(C)(C)C 34a_200000116926_100000210625 [0,2,0,0,0,0|2,0,0]=4 4122 B15R1.3768 COc1cc(ccc1CO)SC(C)(C)C 62a_100000211941_100011277633 [0,2,0,0,0,0|2,0,0]=4 4123 B15R1.3768 COc1cc(ccc1CO)SC(C)(C)C 62a_100011277633_100000211941 [0,2,0,0,0,0|2,0,0]=4 4124 B15R1.3768 COc1ccc(cc1OC)NC(C)(C)C 34a_100000187404_100000210625 [0,2,0,0,0,0|2,0,0]=4 4125 B15R1.3768 COc1ccc(cc1OC)OC(C)(C)C 34a_100000039706_100000210625 [0,2,0,0,0,0|2,0,0]=4 4126 B15R1.3768 COc1ccc(cc1OC)SC(C)(C)C 62a_100000211941_100011356967 [0,2,0,0,0,0|2,0,0]=4 4127 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)C 1458a_100000061229_200000210301 [0,2,0,0,0,0|1,0,1]=4 4128 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)C 34a_200000039568_100000210202 [0,2,0,0,0,0|1,0,1]=4 4129 B15R1.9548 CCOc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000061229_200025704644 [0,2,0,0,0,0|1,0,1]=4 4130 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 2230a_100025772790_200000210301 [0,2,0,0,0,0|2,0,0]=4 4131 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 269982a_100025772790_200000210301 [0,2,0,0,0,0|2,0,0]=4 4132 B15R1.9548 CCOc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000169853 [0,2,0,0,0,0|2,0,0]=4 4133 B15R1.9548 CCOc1ccc(cc1OC)CN(C)[13CH3] 2230a_100025772790_200025704644 [0,2,0,0,0,0|2,0,0]=4 4134 B15R1.9548 CCOc1ccc(cc1OC)CN(C)[13CH3] 269982a_100025772790_200025704644 [0,2,0,0,0,0|2,0,0]=4 4135 B15R1.9548 CCOc1ccc(cc1OC)NC(C)C 2230a_100000184985_100000210206 [0,2,0,0,0,0|2,0,0]=4 4136 B15R1.9548 CCOc1ccc(cc1OC)NC(C)C 34a_100000184985_100000210206 [0,2,0,0,0,0|2,0,0]=4 4137 B15R1.9548 COc1cc(ccc1OCF)CC(=O)C 34a_200000039568_100015361967 [0,2,0,0,0,0|1,0,1]=4 4138 B15R1.12449 COc1cc(ccc1B(O)O)SC(C)C 62a_100010245881_100000210206 [0,2,0,0,0,0|2,0,0]=4 4139 B15R1.13088 COc1ccc(c(c1OC)Br)CN(C)C 270004a_100102631434_100009814707 [0,2,0,0,0,0|2,0,0]=4 4140 B15R1.13088 COc1ccc(c(c1OC)C)CN(C)C 270004a_100102631434_100000050322 [0,2,0,0,0,0|2,0,0]=4 4141 B15R1.13088 COc1ccc(c(c1OC)C)SC(C)C 62a_100000210206_100010000156 [0,2,0,0,0,0|2,0,0]=4 4142 B15R1.13088 COc1ccc(c(c1OC)Cl)CC(=O)C 1458a_100000070787_100011890039 [0,2,0,0,0,0|1,0,1]=4 4143 B15R1.13088 COc1ccc(c(c1OC)Cl)CC(=O)C 1458a_100012648522_200000210301 [0,2,0,0,0,0|1,0,1]=4 4144 B15R1.13088 COc1ccc(c(c1OC)Cl)CC(=O)[13CH3] 1458a_100012648522_200025704644 [0,2,0,0,0,0|1,0,1]=4 4145 B15R1.13088 COc1ccc(c(c1OC)Cl)CN(C)C 2230a_100102631434_100011890039 [0,2,0,0,0,0|2,0,0]=4 4146 B15R1.13088 COc1ccc(c(c1OC)Cl)CN(C)C 269982a_100102631434_100011890039 [0,2,0,0,0,0|2,0,0]=4 4147 B15R1.13088 COc1ccc(c(c1OC)Cl)CN(C)C 270004a_100102631434_100000033805 [0,2,0,0,0,0|2,0,0]=4 4148 B15R1.13088 COc1ccc(c(c1OC)F)CC(=O)C 1458a_200010293705_200000210301 [0,2,0,0,0,0|1,0,1]=4 4149 B15R1.13088 COc1ccc(c(c1OC)F)CC(=O)[13CH3] 1458a_200010293705_200025704644 [0,2,0,0,0,0|1,0,1]=4 4150 B15R1.13088 COc1ccc(c(c1OC)F)CN(C)C 270004a_100102631434_100009852382 [0,2,0,0,0,0|2,0,0]=4 4151 B15R1.13088 COc1ccc(c(c1OC)I)CN(C)C 270004a_100102631434_100010191550 [0,2,0,0,0,0|2,0,0]=4 4152 B13R2.521 Cc1cc(ccc1O)NC2CC2 34a_100011218179_100000211595 [1,0,0,1,0,0|2,0,0]=4 4153 B13R2.521 Oc1ccc(cc1O)NC2CC2 34a_100102946323_100000211595 [1,0,0,1,0,0|2,0,0]=4 4154 B13R2.121 CNc1c(ccc2c1CCC2)Br 2230a_202495424074_200000210301 [1,0,0,1,0,0|2,0,0]=4 4155 B13R2.121 CNc1c(ccc2c1CCC2)Br 34a_202495424074_200000210301 [1,0,0,1,0,0|2,0,0]=4 4156 B13R2.121 CNc1c(ccc2c1CCC2)C 2230a_202495413831_200000210301 [1,0,0,1,0,0|2,0,0]=4 4157 B13R2.121 CNc1c(ccc2c1CCC2)C 34a_202495413831_200000210301 [1,0,0,1,0,0|2,0,0]=4 4158 B13R2.121 COc1c(ccc2c1CCC2)Br 34a_100010662108_200000210301 [1,0,0,1,0,0|1,0,0]=3 4159 B13R2.121 COc1c(ccc2c1CCC2)Br 7a_100010662108_200000210301 [1,0,0,1,0,0|1,0,0]=3 4160 B13R2.121 Cc1ccc2c(c1N[13CH3])CCC2 2230a_202495413831_200025704644 [1,0,0,1,0,0|2,0,0]=4 4161 B13R2.121 Cc1ccc2c(c1N[13CH3])CCC2 34a_202495413831_200025704644 [1,0,0,1,0,0|2,0,0]=4 4162 B13R2.121 [13CH3]Nc1c(ccc2c1CCC2)Br 2230a_202495424074_200025704644 [1,0,0,1,0,0|2,0,0]=4 4163 B13R2.121 [13CH3]Nc1c(ccc2c1CCC2)Br 34a_202495424074_200025704644 [1,0,0,1,0,0|2,0,0]=4 4164 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 34a_100010662108_200025704644 [1,0,0,1,0,0|1,0,0]=3 4165 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 7a_100010662108_200025704644 [1,0,0,1,0,0|1,0,0]=3 4166 B13R2.449 CC=Cc1ccc2c(c1)OCO2 271570a_100016259895_100000688060 [1,0,0,1,0,0|0,0,2]=4 4167 B13R2.449 CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210202 [1,0,0,1,0,0|2,0,0]=4 4168 B13R2.449 CCNc1ccc2c(c1)CCO2 34a_100000736984_100000210202 [1,0,0,1,0,0|2,0,0]=4 4169 B13R2.449 CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210202 [1,0,0,1,0,0|1,0,0]=3 4170 B13R2.449 CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210202 [1,0,0,1,0,0|1,0,0]=3 4171 B13R2.449 CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210202 [1,0,0,1,0,0|1,0,0]=3 4172 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000210202_100000729065 [1,0,0,1,0,0|2,0,0]=4 4173 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210202 [1,0,0,1,0,0|2,0,0]=4 4174 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100000210202_100009818566 [1,0,0,1,0,0|2,0,0]=4 4175 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210202 [1,0,0,1,0,0|2,0,0]=4 4176 B13R2.449 CNCc1ccc2c(c1)CCO2 207a_100102657272_100011218456 [1,0,0,1,0,0|2,0,0]=4 4177 B13R2.449 CNCc1ccc2c(c1)CCO2 2230a_100011219410_200000210301 [1,0,0,1,0,0|2,0,0]=4 4178 B13R2.449 CNCc1ccc2c(c1)CCO2 270004a_106832991635_100011218456 [1,0,0,1,0,0|2,0,0]=4 4179 B13R2.449 CNCc1ccc2c(c1)CCO2 34a_100011219410_200000210301 [1,0,0,1,0,0|2,0,0]=4 4180 B13R2.449 CNCc1ccc2c(c1)OCO2 2230a_100000210006_200000210301 [1,0,0,1,0,0|1,0,0]=3 4181 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100000210006_200000210301 [1,0,0,1,0,0|1,0,0]=3 4182 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100102657272_100000189651 [1,0,0,1,0,0|1,0,0]=3 4183 B13R2.449 CNCc1ccc2c(c1)OCO2 7a_106832991635_100000189651 [1,0,0,1,0,0|1,0,0]=3 4184 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [1,0,0,1,0,0|2,0,0]=4 4185 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [1,0,0,1,0,0|2,0,0]=4 4186 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [1,0,0,1,0,0|1,0,0]=3 4187 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [1,0,0,1,0,0|1,0,0]=3 4188 B13R2.449 FCNc1ccc2c(c1)OCO2 34a_100000209953_100015361967 [1,0,0,1,0,0|2,0,0]=4 4189 B13R2.449 FCOc1ccc2c(c1)OCO2 34a_100000210298_100015361967 [1,0,0,1,0,0|2,0,0]=4 4190 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 2230a_100011219410_200025704644 [1,0,0,1,0,0|2,0,0]=4 4191 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 34a_100011219410_200025704644 [1,0,0,1,0,0|2,0,0]=4 4192 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 2230a_100000210006_200025704644 [1,0,0,1,0,0|1,0,0]=3 4193 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 34a_100000210006_200025704644 [1,0,0,1,0,0|1,0,0]=3 4194 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [1,0,0,1,0,0|2,0,0]=4 4195 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [1,0,0,1,0,0|2,0,0]=4 4196 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [1,0,0,1,0,0|1,0,0]=3 4197 B13R2.599 C=Cc1cc2c(cc1O)CCC2 271570a_100011290941_200010659162 [1,0,0,1,0,0|1,0,1]=4 4198 B13R2.599 COc1cc2c(cc1Br)CCC2 34a_200010659162_200000210301 [1,0,0,1,0,0|1,0,0]=3 4199 B13R2.599 COc1cc2c(cc1Br)CCC2 7a_200010659162_200000210301 [1,0,0,1,0,0|1,0,0]=3 4200 B13R2.599 COc1cc2c(cc1F)CCC2 34a_200000146645_200000210301 [1,0,0,1,0,0|1,0,0]=3 4201 B13R2.599 COc1cc2c(cc1F)CCC2 7a_200000146645_200000210301 [1,0,0,1,0,0|1,0,0]=3 4202 B13R2.599 COc1cc2cc[nH]c2cc1O 271570a_203496583355_100010245486 [1,0,0,1,0,0|0,0,2]=4 4203 B13R2.599 COc1cc2cn[nH]c2cc1O 271570a_203496583355_100010074698 [1,0,0,1,0,0|1,0,1]=4 4204 B13R2.599 CSc1cc2c(cc1F)NCC2 62a_100012771920_200000210301 [1,0,0,1,0,0|1,1,0]=4 4205 B13R2.599 CSc1cc2c(cc1F)NCC2 62a_200000210301_100012771920 [1,0,0,1,0,0|1,1,0]=4 4206 B13R2.599 CSc1cc2c(cc1O)CCC2 62a_200000210301_200010659162 [1,0,0,1,0,0|0,1,0]=3 4207 B13R2.599 CSc1cc2c(cc1O)CCC2 62a_200010659162_200000210301 [1,0,0,1,0,0|0,1,0]=3 4208 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 34a_200010659162_200025704644 [1,0,0,1,0,0|1,0,0]=3 4209 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 7a_200010659162_200025704644 [1,0,0,1,0,0|1,0,0]=3 4210 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 34a_200000146645_200025704644 [1,0,0,1,0,0|1,0,0]=3 4211 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 7a_200000146645_200025704644 [1,0,0,1,0,0|1,0,0]=3 4212 B13R2.599 [13CH3]Sc1cc2c(cc1F)NCC2 62a_100012771920_200025704644 [1,0,0,1,0,0|1,1,0]=4 4213 B13R2.599 [13CH3]Sc1cc2c(cc1F)NCC2 62a_200025704644_100012771920 [1,0,0,1,0,0|1,1,0]=4 4214 B13R2.599 [13CH3]Sc1cc2c(cc1O)CCC2 62a_200010659162_200025704644 [1,0,0,1,0,0|0,1,0]=3 4215 B13R2.599 [13CH3]Sc1cc2c(cc1O)CCC2 62a_200025704644_200010659162 [1,0,0,1,0,0|0,1,0]=3 4216 B13R2.2461 C=Cc1cc(ccc1O)C2CC2 271570a_100011290941_100135415898 [1,0,0,1,0,0|1,0,1]=4 4217 B13R2.2461 CCc1cc(ccc1Br)C2CC2 271570a_100011220607_100010244631 [1,0,0,1,0,0|2,0,0]=4 4218 B13R2.2461 CCc1cc(ccc1F)C2CC2 271570a_100011220607_100010244625 [1,0,0,1,0,0|2,0,0]=4 4219 B13R2.2461 CCc1cc(ccc1N)C2CC2 271570a_100011220607_100000686106 [1,0,0,1,0,0|2,0,0]=4 4220 B13R2.2461 CCc1cc(ccc1O)C2CC2 271570a_100011220607_100012338938 [1,0,0,1,0,0|1,0,0]=3 4221 B13R2.2461 CNc1cc(ccc1C)C2CC2 271570a_100011220607_100020629602 [1,0,0,1,0,0|2,0,0]=4 4222 B13R2.2461 CNc1cc(ccc1F)C2CC2 271570a_100011220607_100011314990 [1,0,0,1,0,0|2,0,0]=4 4223 B13R2.2461 CNc1cc(ccc1F)C2CC2 34a_102516457221_200000210301 [1,0,0,1,0,0|2,0,0]=4 4224 B13R2.2461 CNc1cc(ccc1F)C2CC2 7a_102516457221_200000210301 [1,0,0,1,0,0|2,0,0]=4 4225 B13R2.2461 CNc1cc(ccc1N)C2CC2 271570a_100011220607_100000694363 [1,0,0,1,0,0|2,0,0]=4 4226 B13R2.2461 COc1cc(c[nH]c1=O)C2CC2 271570a_100011220607_100010125397 [1,0,0,1,0,0|1,0,1]=4 4227 B13R2.2461 COc1cc(ccc1Br)C2CC2 271570a_100011220607_100012353699 [1,0,0,1,0,0|1,0,0]=3 4228 B13R2.2461 COc1cc(ccc1C)C2CC2 271570a_100011220607_100011830276 [1,0,0,1,0,0|1,0,0]=3 4229 B13R2.2461 COc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356853 [1,0,0,1,0,0|1,0,0]=3 4230 B13R2.2461 COc1cc(ccc1F)C2CC2 271570a_100011220607_100011934186 [1,0,0,1,0,0|1,0,0]=3 4231 B13R2.2461 COc1cc(ccc1F)C2CC2 34a_100118380312_200000210301 [1,0,0,1,0,0|1,0,0]=3 4232 B13R2.2461 COc1cc(ccc1F)C2CC2 7a_100118380312_200000210301 [1,0,0,1,0,0|1,0,0]=3 4233 B13R2.2461 COc1cc(ccc1N)C2CC2 271570a_100011220607_100011279103 [1,0,0,1,0,0|1,0,0]=3 4234 B13R2.2461 COc1cc(ccc1O)C2CC2 271570a_100011220607_100000694246 [1,0,0,1,0,0|0,0,0]=2 4235 B13R2.2461 COc1cc(cnc1C)C2CC2 271570a_100011220607_100010254219 [1,0,0,1,0,0|2,0,0]=4 4236 B13R2.2461 COc1cc(cnc1F)C2CC2 271570a_100011220607_100010214931 [1,0,0,1,0,0|2,0,0]=4 4237 B13R2.2461 COc1cc(cnc1N)C2CC2 271570a_100011220607_106354213024 [1,0,0,1,0,0|2,0,0]=4 4238 B13R2.2461 COc1cc(ncc1C)C2CC2 271570a_100011220607_100010067687 [1,0,0,1,0,0|2,0,0]=4 4239 B13R2.2461 COc1cc(ncc1F)C2CC2 271570a_100011220607_200010136270 [1,0,0,1,0,0|2,0,0]=4 4240 B13R2.2461 COc1cc(ncc1N)C2CC2 271570a_100011220607_100009887741 [1,0,0,1,0,0|2,0,0]=4 4241 B13R2.2461 COc1nc(ccc1N)C2CC2 271570a_100011220607_100000687816 [1,0,0,1,0,0|2,0,0]=4 4242 B13R2.2461 COc1nc(ccc1O)C2CC2 271570a_100011220607_100010893133 [1,0,0,1,0,0|1,0,0]=3 4243 B13R2.2461 COc1nc(cnc1O)C2CC2 271570a_100011220607_200010365344 [1,0,0,1,0,0|2,0,0]=4 4244 B13R2.2461 CSc1cc(ccc1F)C2CC2 271570a_100011220607_100010341305 [1,0,0,1,0,0|1,1,0]=4 4245 B13R2.2461 CSc1cc(ccc1F)C2CC2 62a_100010281199_200000210301 [1,0,0,1,0,0|1,1,0]=4 4246 B13R2.2461 CSc1cc(ccc1F)C2CC2 62a_200000210301_100010281199 [1,0,0,1,0,0|1,1,0]=4 4247 B13R2.2461 CSc1cc(ccc1O)C2CC2 62a_200000210301_100135415898 [1,0,0,1,0,0|0,1,0]=3 4248 B13R2.2461 N#Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000687585 [1,0,0,1,0,0|2,0,0]=4 4249 B13R2.2461 NCc1cc(ccc1O)C2CC2 271570a_100011220607_100000730032 [1,0,0,1,0,0|2,0,0]=4 4250 B13R2.2461 O=Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186750 [1,0,0,1,0,0|2,0,0]=4 4251 B13R2.2461 OCc1cc(ccc1O)C2CC2 271570a_100011220607_100000184703 [1,0,0,1,0,0|2,0,0]=4 4252 B13R2.2461 [13CH3]Nc1cc(ccc1F)C2CC2 34a_102516457221_200025704644 [1,0,0,1,0,0|2,0,0]=4 4253 B13R2.2461 [13CH3]Nc1cc(ccc1F)C2CC2 7a_102516457221_200025704644 [1,0,0,1,0,0|2,0,0]=4 4254 B13R2.2461 [13CH3]Oc1cc(ccc1F)C2CC2 34a_100118380312_200025704644 [1,0,0,1,0,0|1,0,0]=3 4255 B13R2.2461 [13CH3]Oc1cc(ccc1F)C2CC2 7a_100118380312_200025704644 [1,0,0,1,0,0|1,0,0]=3 4256 B13R2.2461 [13CH3]Sc1cc(ccc1F)C2CC2 62a_100010281199_200025704644 [1,0,0,1,0,0|1,1,0]=4 4257 B13R2.2461 [13CH3]Sc1cc(ccc1F)C2CC2 62a_200025704644_100010281199 [1,0,0,1,0,0|1,1,0]=4 4258 B13R2.2461 [13CH3]Sc1cc(ccc1O)C2CC2 62a_200025704644_100135415898 [1,0,0,1,0,0|0,1,0]=3 4259 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 2230a_100000124160_200025704644 [1,0,0,1,0,0|2,0,0]=4 4260 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 34a_100000124160_200025704644 [1,0,0,1,0,0|2,0,0]=4 4261 B13R2.581 CNc1cccc2c1OC(C2)C 2230a_100000124160_200000210301 [1,0,0,1,0,0|2,0,0]=4 4262 B13R2.581 CNc1cccc2c1OC(C2)C 34a_100000124160_200000210301 [1,0,0,1,0,0|2,0,0]=4 4263 B13R2.581 COc1cccc2c1CN(C2)C 2230a_100016991506_200000210301 [1,0,0,1,0,0|2,0,0]=4 4264 B13R2.581 COc1cccc2c1CN(C2)C 269982a_100016991506_200000210301 [1,0,0,1,0,0|2,0,0]=4 4265 B13R2.581 COc1cccc2c1CN(C2)C 34a_100016991506_200000210301 [1,0,0,1,0,0|2,0,0]=4 4266 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 2230a_100016991506_200025704644 [1,0,0,1,0,0|2,0,0]=4 4267 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 269982a_100016991506_200025704644 [1,0,0,1,0,0|2,0,0]=4 4268 B13R2.581 COc1cccc2c1CN(C2)[13CH3] 34a_100016991506_200025704644 [1,0,0,1,0,0|2,0,0]=4 4269 B13R2.581 CSc1cccc2c1CC(C2)O 62a_100010752598_200000210301 [1,0,0,1,0,0|1,1,0]=4 4270 B13R2.581 CSc1cccc2c1CC(C2)O 62a_200000210301_100010752598 [1,0,0,1,0,0|1,1,0]=4 4271 B13R2.581 [13CH3]Sc1cccc2c1CC(C2)O 62a_100010752598_200025704644 [1,0,0,1,0,0|1,1,0]=4 4272 B13R2.581 [13CH3]Sc1cccc2c1CC(C2)O 62a_200025704644_100010752598 [1,0,0,1,0,0|1,1,0]=4 4273 B13R2.2038 COc1cccc(c1)NC2CC2 34a_100000210024_100000211595 [1,0,0,1,0,0|2,0,0]=4 4274 B13R2.2038 COc1cccc(c1)OC2CC2 34a_100000211255_100000211595 [1,0,0,1,0,0|2,0,0]=4 4275 B13R2.2121 C=Cc1ccc2c(c1)CC(C2)N 271570a_100011290941_100015193702 [1,0,0,1,0,0|1,0,1]=4 4276 B13R2.2121 CC1Cc2cc(ccc2O1)N[13CH3] 2230a_100102713350_200025704644 [1,0,0,1,0,0|2,0,0]=4 4277 B13R2.2121 CC1Cc2cc(ccc2O1)N[13CH3] 34a_100102713350_200025704644 [1,0,0,1,0,0|2,0,0]=4 4278 B13R2.2121 CNc1ccc2c(c1)CC(O2)C 2230a_100102713350_200000210301 [1,0,0,1,0,0|2,0,0]=4 4279 B13R2.2121 CNc1ccc2c(c1)CC(O2)C 34a_100102713350_200000210301 [1,0,0,1,0,0|2,0,0]=4 4280 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [1,0,0,1,0,0|0,0,2]=4 4281 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [1,0,0,1,0,0|0,0,2]=4 4282 B13R2.2121 COc1ccc2c(c1)CN(C2)C 269982a_100000051402_200000210301 [1,0,0,1,0,0|2,0,0]=4 4283 B13R2.2121 COc1ccc2c(c1)CN(C2)C 34a_100000051402_200000210301 [1,0,0,1,0,0|2,0,0]=4 4284 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 269982a_100000051402_200025704644 [1,0,0,1,0,0|2,0,0]=4 4285 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 34a_100000051402_200025704644 [1,0,0,1,0,0|2,0,0]=4 4286 B13R2.2121 CSc1ccc2c(c1)CC(C2)N 62a_100015193702_200000210301 [1,0,0,1,0,0|0,1,0]=3 4287 B13R2.2121 CSc1ccc2c(c1)CC(C2)N 62a_200000210301_100015193702 [1,0,0,1,0,0|0,1,0]=3 4288 B13R2.2121 CSc1ccc2c(c1)CC(C2)O 62a_100010161096_200000210301 [1,0,0,1,0,0|1,1,0]=4 4289 B13R2.2121 CSc1ccc2c(c1)CC(C2)O 62a_200000210301_100010161096 [1,0,0,1,0,0|1,1,0]=4 4290 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [1,0,0,1,0,0|0,0,2]=4 4291 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [1,0,0,1,0,0|0,0,2]=4 4292 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)N 62a_100015193702_200025704644 [1,0,0,1,0,0|0,1,0]=3 4293 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)N 62a_200025704644_100015193702 [1,0,0,1,0,0|0,1,0]=3 4294 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)O 62a_100010161096_200025704644 [1,0,0,1,0,0|1,1,0]=4 4295 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)O 62a_200025704644_100010161096 [1,0,0,1,0,0|1,1,0]=4 4296 B13R2.430 C=C(C)c1ccc2c(c1)OCO2 271570a_100000694244_100000688060 [0,0,0,1,1,0|1,0,1]=4 4297 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000210301 [0,0,0,1,1,0|1,0,1]=4 4298 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200025704644 [0,0,0,1,1,0|1,0,1]=4 4299 B15R2.4522 CCc1cc(ccc1O)SCC2CC2 62a_100000756562_100012338938 [0,0,0,1,0,1|2,0,0]=4 4300 B15R2.4522 CCc1cc(ccc1O)SCC2CO2 62a_102125554688_100012338938 [0,0,0,1,0,1|2,0,0]=4 4301 B15R2.4522 CCc1cc(ccc1O)SCC2CS2 62a_100000031435_100012338938 [0,0,0,1,0,1|2,0,0]=4 4302 B15R2.4522 CCc1cc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100012338938 [0,0,0,1,0,1|2,0,0]=4 4303 B15R2.4522 COc1cc(ccc1Br)CNC2CC2 34a_100000212008_100010110085 [0,0,0,1,0,1|2,0,0]=4 4304 B15R2.4522 COc1cc(ccc1Br)COC2CC2 34a_100010234685_100000211595 [0,0,0,1,0,1|2,0,0]=4 4305 B15R2.4522 COc1cc(ccc1Br)CSC2CC2 62a_100010110085_100000211595 [0,0,0,1,0,1|2,0,0]=4 4306 B15R2.4522 COc1cc(ccc1Br)NCC2CC2 2230a_100000765947_100000742324 [0,0,0,1,0,1|2,0,0]=4 4307 B15R2.4522 COc1cc(ccc1Br)NCC2CC2 34a_100000765947_100000742324 [0,0,0,1,0,1|2,0,0]=4 4308 B15R2.4522 COc1cc(ccc1Br)NCC2CO2 2230a_100000765947_100011216344 [0,0,0,1,0,1|2,0,0]=4 4309 B15R2.4522 COc1cc(ccc1Br)NCC2CO2 34a_100000765947_102125554688 [0,0,0,1,0,1|2,0,0]=4 4310 B15R2.4522 COc1cc(ccc1Br)OCC2CC2 34a_100011827694_100000742324 [0,0,0,1,0,1|2,0,0]=4 4311 B15R2.4522 COc1cc(ccc1Br)OCC2CC2 7a_100011827694_100000742324 [0,0,0,1,0,1|2,0,0]=4 4312 B15R2.4522 COc1cc(ccc1Br)OCC2CO2 34a_100011827694_102125554688 [0,0,0,1,0,1|2,0,0]=4 4313 B15R2.4522 COc1cc(ccc1Br)OCC2CO2 7a_100011827694_102125554688 [0,0,0,1,0,1|2,0,0]=4 4314 B15R2.4522 COc1cc(ccc1Br)OCC2CS2 7a_100011827694_100000031435 [0,0,0,1,0,1|2,0,0]=4 4315 B15R2.4522 COc1cc(ccc1Br)OC[C@@H]2CO2 7a_100011827694_100000745022 [0,0,0,1,0,1|2,0,0]=4 4316 B15R2.4522 COc1cc(ccc1Br)SCC2CC2 62a_100000756562_100012353699 [0,0,0,1,0,1|2,0,0]=4 4317 B15R2.4522 COc1cc(ccc1Br)SCC2CC2 62a_100012353699_100000742324 [0,0,0,1,0,1|2,0,0]=4 4318 B15R2.4522 COc1cc(ccc1Br)SCC2CO2 62a_100012353699_102125554688 [0,0,0,1,0,1|2,0,0]=4 4319 B15R2.4522 COc1cc(ccc1Br)SCC2CO2 62a_102125554688_100012353699 [0,0,0,1,0,1|2,0,0]=4 4320 B15R2.4522 COc1cc(ccc1Br)SCC2CS2 62a_100000031435_100012353699 [0,0,0,1,0,1|2,0,0]=4 4321 B15R2.4522 COc1cc(ccc1Br)SCC2CS2 62a_100012353699_100000031435 [0,0,0,1,0,1|2,0,0]=4 4322 B15R2.4522 COc1cc(ccc1Br)SC[C@@H]2CO2 62a_100000745022_100012353699 [0,0,0,1,0,1|2,0,0]=4 4323 B15R2.4522 COc1cc(ccc1Br)SC[C@@H]2CO2 62a_100012353699_100000745022 [0,0,0,1,0,1|2,0,0]=4 4324 B15R2.4522 COc1cc(ccc1C)COC2CC2 34a_100000752651_100000211595 [0,0,0,1,0,1|2,0,0]=4 4325 B15R2.4522 COc1cc(ccc1C)NCC2CC2 2230a_100011279678_100000742324 [0,0,0,1,0,1|2,0,0]=4 4326 B15R2.4522 COc1cc(ccc1C)NCC2CC2 34a_100011279678_100000742324 [0,0,0,1,0,1|2,0,0]=4 4327 B15R2.4522 COc1cc(ccc1C)NCC2CO2 2230a_100011279678_100011216344 [0,0,0,1,0,1|2,0,0]=4 4328 B15R2.4522 COc1cc(ccc1C)NCC2CO2 34a_100011279678_102125554688 [0,0,0,1,0,1|2,0,0]=4 4329 B15R2.4522 COc1cc(ccc1C)OCC2CC2 34a_100009865632_100000742324 [0,0,0,1,0,1|2,0,0]=4 4330 B15R2.4522 COc1cc(ccc1C)OCC2CC2 7a_100009865632_100000742324 [0,0,0,1,0,1|2,0,0]=4 4331 B15R2.4522 COc1cc(ccc1C)OCC2CO2 34a_100009865632_102125554688 [0,0,0,1,0,1|2,0,0]=4 4332 B15R2.4522 COc1cc(ccc1C)OCC2CO2 7a_100009865632_102125554688 [0,0,0,1,0,1|2,0,0]=4 4333 B15R2.4522 COc1cc(ccc1C)OCC2CS2 7a_100009865632_100000031435 [0,0,0,1,0,1|2,0,0]=4 4334 B15R2.4522 COc1cc(ccc1C)OC[C@@H]2CO2 7a_100009865632_100000745022 [0,0,0,1,0,1|2,0,0]=4 4335 B15R2.4522 COc1cc(ccc1C)SCC2CC2 62a_100000756562_100011830276 [0,0,0,1,0,1|2,0,0]=4 4336 B15R2.4522 COc1cc(ccc1C)SCC2CC2 62a_100011830276_100000742324 [0,0,0,1,0,1|2,0,0]=4 4337 B15R2.4522 COc1cc(ccc1C)SCC2CO2 62a_100011830276_102125554688 [0,0,0,1,0,1|2,0,0]=4 4338 B15R2.4522 COc1cc(ccc1C)SCC2CO2 62a_102125554688_100011830276 [0,0,0,1,0,1|2,0,0]=4 4339 B15R2.4522 COc1cc(ccc1C)SCC2CS2 62a_100000031435_100011830276 [0,0,0,1,0,1|2,0,0]=4 4340 B15R2.4522 COc1cc(ccc1C)SCC2CS2 62a_100011830276_100000031435 [0,0,0,1,0,1|2,0,0]=4 4341 B15R2.4522 COc1cc(ccc1C)SC[C@@H]2CO2 62a_100000745022_100011830276 [0,0,0,1,0,1|2,0,0]=4 4342 B15R2.4522 COc1cc(ccc1C)SC[C@@H]2CO2 62a_100011830276_100000745022 [0,0,0,1,0,1|2,0,0]=4 4343 B15R2.4522 COc1cc(ccc1Cl)CNC2CC2 34a_100000212008_200010214485 [0,0,0,1,0,1|2,0,0]=4 4344 B15R2.4522 COc1cc(ccc1Cl)CNC2CC2 34a_100015204853_100000211595 [0,0,0,1,0,1|2,0,0]=4 4345 B15R2.4522 COc1cc(ccc1Cl)COC2CC2 34a_100012179228_100000211595 [0,0,0,1,0,1|2,0,0]=4 4346 B15R2.4522 COc1cc(ccc1Cl)CSC2CC2 62a_200010214485_100000211595 [0,0,0,1,0,1|2,0,0]=4 4347 B15R2.4522 COc1cc(ccc1Cl)NCC2CC2 2230a_100000742311_100000742324 [0,0,0,1,0,1|2,0,0]=4 4348 B15R2.4522 COc1cc(ccc1Cl)NCC2CC2 34a_100000742311_100000742324 [0,0,0,1,0,1|2,0,0]=4 4349 B15R2.4522 COc1cc(ccc1Cl)NCC2CO2 2230a_100000742311_100011216344 [0,0,0,1,0,1|2,0,0]=4 4350 B15R2.4522 COc1cc(ccc1Cl)NCC2CO2 34a_100000742311_102125554688 [0,0,0,1,0,1|2,0,0]=4 4351 B15R2.4522 COc1cc(ccc1Cl)OCC2CC2 34a_100012186310_100000742324 [0,0,0,1,0,1|2,0,0]=4 4352 B15R2.4522 COc1cc(ccc1Cl)OCC2CC2 7a_100012186310_100000742324 [0,0,0,1,0,1|2,0,0]=4 4353 B15R2.4522 COc1cc(ccc1Cl)OCC2CO2 34a_100012186310_102125554688 [0,0,0,1,0,1|2,0,0]=4 4354 B15R2.4522 COc1cc(ccc1Cl)OCC2CO2 7a_100012186310_102125554688 [0,0,0,1,0,1|2,0,0]=4 4355 B15R2.4522 COc1cc(ccc1Cl)OCC2CS2 7a_100012186310_100000031435 [0,0,0,1,0,1|2,0,0]=4 4356 B15R2.4522 COc1cc(ccc1Cl)OC[C@@H]2CO2 7a_100012186310_100000745022 [0,0,0,1,0,1|2,0,0]=4 4357 B15R2.4522 COc1cc(ccc1Cl)SCC2CC2 62a_100000756562_100011356853 [0,0,0,1,0,1|2,0,0]=4 4358 B15R2.4522 COc1cc(ccc1Cl)SCC2CC2 62a_100011356853_100000742324 [0,0,0,1,0,1|2,0,0]=4 4359 B15R2.4522 COc1cc(ccc1Cl)SCC2CO2 62a_100011356853_102125554688 [0,0,0,1,0,1|2,0,0]=4 4360 B15R2.4522 COc1cc(ccc1Cl)SCC2CO2 62a_102125554688_100011356853 [0,0,0,1,0,1|2,0,0]=4 4361 B15R2.4522 COc1cc(ccc1Cl)SCC2CS2 62a_100000031435_100011356853 [0,0,0,1,0,1|2,0,0]=4 4362 B15R2.4522 COc1cc(ccc1Cl)SCC2CS2 62a_100011356853_100000031435 [0,0,0,1,0,1|2,0,0]=4 4363 B15R2.4522 COc1cc(ccc1Cl)SC[C@@H]2CO2 62a_100000745022_100011356853 [0,0,0,1,0,1|2,0,0]=4 4364 B15R2.4522 COc1cc(ccc1Cl)SC[C@@H]2CO2 62a_100011356853_100000745022 [0,0,0,1,0,1|2,0,0]=4 4365 B15R2.4522 COc1cc(ccc1F)CNC2CC2 34a_100000212008_100012349856 [0,0,0,1,0,1|2,0,0]=4 4366 B15R2.4522 COc1cc(ccc1F)CNC2CC2 34a_100020626639_100000211595 [0,0,0,1,0,1|2,0,0]=4 4367 B15R2.4522 COc1cc(ccc1F)COC2CC2 34a_100000692429_100000211595 [0,0,0,1,0,1|2,0,0]=4 4368 B15R2.4522 COc1cc(ccc1F)CSC2CC2 62a_100012349856_100000211595 [0,0,0,1,0,1|2,0,0]=4 4369 B15R2.4522 COc1cc(ccc1F)NCC2CC2 2230a_100000701188_100000742324 [0,0,0,1,0,1|2,0,0]=4 4370 B15R2.4522 COc1cc(ccc1F)NCC2CC2 34a_100000701188_100000742324 [0,0,0,1,0,1|2,0,0]=4 4371 B15R2.4522 COc1cc(ccc1F)NCC2CO2 2230a_100000701188_100011216344 [0,0,0,1,0,1|2,0,0]=4 4372 B15R2.4522 COc1cc(ccc1F)NCC2CO2 34a_100000701188_102125554688 [0,0,0,1,0,1|2,0,0]=4 4373 B15R2.4522 COc1cc(ccc1F)OCC2CC2 34a_100012001760_100000742324 [0,0,0,1,0,1|2,0,0]=4 4374 B15R2.4522 COc1cc(ccc1F)OCC2CC2 7a_100012001760_100000742324 [0,0,0,1,0,1|2,0,0]=4 4375 B15R2.4522 COc1cc(ccc1F)OCC2CO2 34a_100012001760_102125554688 [0,0,0,1,0,1|2,0,0]=4 4376 B15R2.4522 COc1cc(ccc1F)OCC2CO2 7a_100012001760_102125554688 [0,0,0,1,0,1|2,0,0]=4 4377 B15R2.4522 COc1cc(ccc1F)OCC2CS2 7a_100012001760_100000031435 [0,0,0,1,0,1|2,0,0]=4 4378 B15R2.4522 COc1cc(ccc1F)OC[C@@H]2CO2 7a_100012001760_100000745022 [0,0,0,1,0,1|2,0,0]=4 4379 B15R2.4522 COc1cc(ccc1F)SCC2CC2 62a_100000756562_100011934186 [0,0,0,1,0,1|2,0,0]=4 4380 B15R2.4522 COc1cc(ccc1F)SCC2CC2 62a_100011934186_100000742324 [0,0,0,1,0,1|2,0,0]=4 4381 B15R2.4522 COc1cc(ccc1F)SCC2CO2 62a_100011934186_102125554688 [0,0,0,1,0,1|2,0,0]=4 4382 B15R2.4522 COc1cc(ccc1F)SCC2CO2 62a_102125554688_100011934186 [0,0,0,1,0,1|2,0,0]=4 4383 B15R2.4522 COc1cc(ccc1F)SCC2CS2 62a_100000031435_100011934186 [0,0,0,1,0,1|2,0,0]=4 4384 B15R2.4522 COc1cc(ccc1F)SCC2CS2 62a_100011934186_100000031435 [0,0,0,1,0,1|2,0,0]=4 4385 B15R2.4522 COc1cc(ccc1F)SC[C@@H]2CO2 62a_100000745022_100011934186 [0,0,0,1,0,1|2,0,0]=4 4386 B15R2.4522 COc1cc(ccc1F)SC[C@@H]2CO2 62a_100011934186_100000745022 [0,0,0,1,0,1|2,0,0]=4 4387 B15R2.4522 COc1cc(ccc1I)NCC2CC2 34a_100000746945_100000742324 [0,0,0,1,0,1|2,0,0]=4 4388 B15R2.4522 COc1cc(ccc1I)NCC2CO2 34a_100000746945_102125554688 [0,0,0,1,0,1|2,0,0]=4 4389 B15R2.4522 COc1cc(ccc1N)COC2CC2 34a_100000087641_100000211595 [0,0,0,1,0,1|2,0,0]=4 4390 B15R2.4522 COc1cc(ccc1N)OCC2CC2 34a_100015326901_100000742324 [0,0,0,1,0,1|2,0,0]=4 4391 B15R2.4522 COc1cc(ccc1N)OCC2CC2 7a_100015326901_100000742324 [0,0,0,1,0,1|2,0,0]=4 4392 B15R2.4522 COc1cc(ccc1N)OCC2CO2 34a_100015326901_102125554688 [0,0,0,1,0,1|2,0,0]=4 4393 B15R2.4522 COc1cc(ccc1N)OCC2CO2 7a_100015326901_102125554688 [0,0,0,1,0,1|2,0,0]=4 4394 B15R2.4522 COc1cc(ccc1N)OCC2CS2 7a_100015326901_100000031435 [0,0,0,1,0,1|2,0,0]=4 4395 B15R2.4522 COc1cc(ccc1N)OC[C@@H]2CO2 7a_100015326901_100000745022 [0,0,0,1,0,1|2,0,0]=4 4396 B15R2.4522 COc1cc(ccc1N)SCC2CC2 62a_100000756562_100015196925 [0,0,0,1,0,1|2,0,0]=4 4397 B15R2.4522 COc1cc(ccc1N)SCC2CC2 62a_100011279103_100000742324 [0,0,0,1,0,1|2,0,0]=4 4398 B15R2.4522 COc1cc(ccc1N)SCC2CO2 62a_100011279103_102125554688 [0,0,0,1,0,1|2,0,0]=4 4399 B15R2.4522 COc1cc(ccc1N)SCC2CO2 62a_102125554688_100015196925 [0,0,0,1,0,1|2,0,0]=4 4400 B15R2.4522 COc1cc(ccc1N)SCC2CS2 62a_100000031435_100015196925 [0,0,0,1,0,1|2,0,0]=4 4401 B15R2.4522 COc1cc(ccc1N)SCC2CS2 62a_100011279103_100000031435 [0,0,0,1,0,1|2,0,0]=4 4402 B15R2.4522 COc1cc(ccc1N)SC[C@@H]2CO2 62a_100000745022_100015196925 [0,0,0,1,0,1|2,0,0]=4 4403 B15R2.4522 COc1cc(ccc1N)SC[C@@H]2CO2 62a_100011279103_100000745022 [0,0,0,1,0,1|2,0,0]=4 4404 B15R2.4522 COc1cc(ccc1O)C#CC2CC2 271570a_200009880635_100000694246 [0,0,0,1,0,1|1,0,1]=4 4405 B15R2.4522 COc1cc(ccc1O)C=CC2CC2 271570a_100102526188_100000694246 [0,0,0,1,0,1|1,0,1]=4 4406 B15R2.4522 COc1cc(ccc1O)CNC2CC2 34a_100000185554_100000211595 [0,0,0,1,0,1|1,0,0]=3 4407 B15R2.4522 COc1cc(ccc1O)NCC2CC2 34a_100000726020_100000742324 [0,0,0,1,0,1|1,0,0]=3 4408 B15R2.4522 COc1cc(ccc1O)NCC2CO2 34a_100000726020_102125554688 [0,0,0,1,0,1|1,0,0]=3 4409 B15R2.4522 COc1cc(ccc1O)SCC2CC2 62a_100000756562_100000694246 [0,0,0,1,0,1|1,0,0]=3 4410 B15R2.4522 COc1cc(ccc1O)SCC2CO2 62a_102125554688_100000694246 [0,0,0,1,0,1|1,0,0]=3 4411 B15R2.4522 COc1cc(ccc1O)SCC2CS2 62a_100000031435_100000694246 [0,0,0,1,0,1|1,0,0]=3 4412 B15R2.4522 COc1cc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100000694246 [0,0,0,1,0,1|1,0,0]=3 4413 B15R2.4522 COc1nc(ccc1O)SCC2CC2 62a_100000756562_100010893133 [0,0,0,1,0,1|2,0,0]=4 4414 B15R2.4522 COc1nc(ccc1O)SCC2CO2 62a_102125554688_100010893133 [0,0,0,1,0,1|2,0,0]=4 4415 B15R2.4522 COc1nc(ccc1O)SCC2CS2 62a_100000031435_100010893133 [0,0,0,1,0,1|2,0,0]=4 4416 B15R2.4522 COc1nc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100010893133 [0,0,0,1,0,1|2,0,0]=4 4417 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748629 [0,0,0,1,0,1|1,0,1]=4 4418 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748629 [0,0,0,1,0,1|1,0,1]=4 4419 B15R2.7688 C=C(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748629 [0,0,0,1,0,1|1,0,1]=4 4420 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [0,0,0,1,0,1|1,0,1]=4 4421 B15R2.7688 CC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200000210301 [0,0,0,1,0,1|1,0,1]=4 4422 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100015343762 [0,0,0,1,0,1|1,0,1]=4 4423 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100015343762 [0,0,0,1,0,1|1,0,1]=4 4424 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100015343762 [0,0,0,1,0,1|1,0,1]=4 4425 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100103153847 [0,0,0,1,0,1|1,0,1]=4 4426 B15R2.7688 CC(C)C=Cc1ccc2c(c1)OCO2 271570a_100016257149_100000688060 [0,0,0,1,0,1|1,0,1]=4 4427 B15R2.7688 CC(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000210760 [0,0,0,1,0,1|2,0,0]=4 4428 B15R2.7688 CC(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000210624 [0,0,0,1,0,1|2,0,0]=4 4429 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000210760 [0,0,0,1,0,1|1,0,0]=3 4430 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000210624 [0,0,0,1,0,1|1,0,0]=3 4431 B15R2.7688 CC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000210624 [0,0,0,1,0,1|1,0,0]=3 4432 B15R2.7688 CC(C)CSc1ccc2c(c1)CCO2 62a_100000210624_100000729065 [0,0,0,1,0,1|2,0,0]=4 4433 B15R2.7688 CC(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000210760 [0,0,0,1,0,1|2,0,0]=4 4434 B15R2.7688 CC(C)CSc1ccc2c(c1)OCC2 62a_100000210624_100009818566 [0,0,0,1,0,1|2,0,0]=4 4435 B15R2.7688 CC(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000210760 [0,0,0,1,0,1|2,0,0]=4 4436 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 207a_100138425928_100011218456 [0,0,0,1,0,1|2,0,0]=4 4437 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000210206 [0,0,0,1,0,1|2,0,0]=4 4438 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_100000210206 [0,0,0,1,0,1|2,0,0]=4 4439 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000210206 [0,0,0,1,0,1|1,0,0]=3 4440 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000210206 [0,0,0,1,0,1|1,0,0]=3 4441 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100138425928_100000189651 [0,0,0,1,0,1|1,0,0]=3 4442 B15R2.7688 CC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_100000210206 [0,0,0,1,0,1|2,0,0]=4 4443 B15R2.7688 CC(C)OCc1ccc2c(c1)CCO2 7a_100011219353_100000210206 [0,0,0,1,0,1|2,0,0]=4 4444 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000210206 [0,0,0,1,0,1|1,0,0]=3 4445 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000212225_100000189651 [0,0,0,1,0,1|1,0,0]=3 4446 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCO2 271570a_200011019289_100000688060 [0,0,0,1,0,1|1,0,1]=4 4447 B15R2.7688 CC(O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100011218427 [0,0,0,1,0,1|2,0,0]=4 4448 B15R2.7688 CC(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100011218427 [0,0,0,1,0,1|2,0,0]=4 4449 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011218427 [0,0,0,1,0,1|1,0,0]=3 4450 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011218427 [0,0,0,1,0,1|1,0,0]=3 4451 B15R2.7688 CC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011218427 [0,0,0,1,0,1|1,0,0]=3 4452 B15R2.7688 CC(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100011218427 [0,0,0,1,0,1|2,0,0]=4 4453 B15R2.7688 CC(O)CSc1ccc2c(c1)CCO2 62a_100011218427_100000729065 [0,0,0,1,0,1|2,0,0]=4 4454 B15R2.7688 CC(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100011218427 [0,0,0,1,0,1|2,0,0]=4 4455 B15R2.7688 CC(O)CSc1ccc2c(c1)OCC2 62a_100011218427_100009818566 [0,0,0,1,0,1|2,0,0]=4 4456 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100009817552 [0,0,0,1,0,1|2,0,0]=4 4457 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCO2 34a_100000736984_100009817552 [0,0,0,1,0,1|2,0,0]=4 4458 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009817552 [0,0,0,1,0,1|1,0,0]=3 4459 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 34a_100000209953_100009817552 [0,0,0,1,0,1|1,0,0]=3 4460 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)OCO2 34a_100000210298_100009817552 [0,0,0,1,0,1|1,0,0]=3 4461 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCO2 62a_100000729065_100009817552 [0,0,0,1,0,1|2,0,0]=4 4462 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCO2 62a_100009817552_100000729065 [0,0,0,1,0,1|2,0,0]=4 4463 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)OCC2 62a_100009817552_100009818566 [0,0,0,1,0,1|2,0,0]=4 4464 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)OCC2 62a_100009818566_100009817552 [0,0,0,1,0,1|2,0,0]=4 4465 B15R2.7688 FC(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011934356 [0,0,0,1,0,1|2,0,0]=4 4466 B15R2.7688 FC(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100011934356 [0,0,0,1,0,1|2,0,0]=4 4467 B15R2.7688 FC(F)COc1ccc2c(c1)OCO2 34a_100000210298_100011934356 [0,0,0,1,0,1|2,0,0]=4 4468 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747473 [0,0,0,1,0,1|1,0,1]=4 4469 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000187820 [0,0,0,1,0,1|1,0,1]=4 4470 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000187820 [0,0,0,1,0,1|1,0,1]=4 4471 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [0,0,0,1,0,1|1,0,1]=4 4472 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200025704644 [0,0,0,1,0,1|1,0,1]=4 4473 B15R2.4239 CC(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200000210301 [0,1,0,1,0,0|1,0,1]=4 4474 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210206 [0,1,0,1,0,0|1,0,1]=4 4475 B15R2.4239 [13CH3]C(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200025704644 [0,1,0,1,0,0|1,0,1]=4 4476 B15R2.4509 C=C(c1ccc(c(c1)OC)O)C2CC2 271570a_100010895485_100000694246 [0,1,0,1,0,0|1,0,1]=4 4477 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Br 270004a_100102631434_100000682445 [0,1,0,1,0,0|2,0,0]=4 4478 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Cl 270004a_100102631434_100000016197 [0,1,0,1,0,0|2,0,0]=4 4479 B15R2.1668 CC(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200000210301 [0,1,0,1,0,0|1,0,1]=4 4480 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000210206 [0,1,0,1,0,0|2,0,0]=4 4481 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100000210206 [0,1,0,1,0,0|2,0,0]=4 4482 B15R2.1668 CC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100000210206 [0,1,0,1,0,0|2,0,0]=4 4483 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100000210206_100011216881 [0,1,0,1,0,0|2,0,0]=4 4484 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000210206 [0,1,0,1,0,0|2,0,0]=4 4485 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_200000210301 [0,1,0,1,0,0|2,0,0]=4 4486 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_200000210301 [0,1,0,1,0,0|2,0,0]=4 4487 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 270004a_100102631434_100000184955 [0,1,0,1,0,0|2,0,0]=4 4488 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 2230a_100000684720_200025704644 [0,1,0,1,0,0|2,0,0]=4 4489 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 269982a_100000684720_200025704644 [0,1,0,1,0,0|2,0,0]=4 4490 B15R2.1668 [13CH3]C(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200025704644 [0,1,0,1,0,0|1,0,1]=4 4491 B15R2.964 CC(=O)Cc1cc2c(cc1Br)OCO2 1458a_100000070787_100009995336 [0,1,0,1,0,0|1,0,1]=4 4492 B15R2.964 CC(=O)Cc1cc2c(cc1Cl)OCO2 1458a_100000070787_100000043460 [0,1,0,1,0,0|1,0,1]=4 4493 B15R2.964 CC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210206 [0,1,0,1,0,0|2,0,0]=4 4494 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100000210206 [0,1,0,1,0,0|2,0,0]=4 4495 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000210206 [0,1,0,1,0,0|2,0,0]=4 4496 B15R2.964 CC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000210206 [0,1,0,1,0,0|2,0,0]=4 4497 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 2230a_100102631434_100009995336 [0,1,0,1,0,0|2,0,0]=4 4498 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 269982a_100102631434_100009995336 [0,1,0,1,0,0|2,0,0]=4 4499 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 270004a_100102631434_100000186749 [0,1,0,1,0,0|2,0,0]=4 4500 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100102631434_100000043460 [0,1,0,1,0,0|2,0,0]=4 4501 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 270004a_100102631434_100000015535 [0,1,0,1,0,0|2,0,0]=4 4502 B15R2.964 Cc1cc2c(cc1CN(C)C)OCO2 269982a_100102631434_200000112958 [0,1,0,1,0,0|2,0,0]=4 4503 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 2230a_100000066439_100000210206 [0,1,0,1,0,0|2,0,0]=4 4504 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 34a_100000066439_100000210206 [0,1,0,1,0,0|2,0,0]=4 4505 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 34a_100000145572_100000210206 [0,1,0,1,0,0|2,0,0]=4 4506 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 7a_100000145572_100000210206 [0,1,0,1,0,0|2,0,0]=4 4507 B15R2.4343 C#CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_200000035995 [0,1,0,1,0,0|2,0,0]=4 4508 B15R2.4343 C#CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_200000035995 [0,1,0,1,0,0|2,0,0]=4 4509 B15R2.4343 CC(C#N)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000184139 [0,1,0,1,0,0|1,0,1]=4 4510 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 2230a_100000209953_100012180447 [0,1,0,1,0,0|2,0,0]=4 4511 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 34a_100000209953_100012180447 [0,1,0,1,0,0|2,0,0]=4 4512 B15R2.4343 CC(CO)Oc1ccc2c(c1)OCO2 34a_100000210298_100012180447 [0,1,0,1,0,0|2,0,0]=4 4513 B15R2.4343 CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210202 [0,1,0,1,0,0|1,0,1]=4 4514 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000758301 [0,1,0,1,0,0|2,0,0]=4 4515 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100011215416 [0,1,0,1,0,0|2,0,0]=4 4516 B15R2.4343 CCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100011215416 [0,1,0,1,0,0|2,0,0]=4 4517 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210202 [0,1,0,1,0,0|2,0,0]=4 4518 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000204670 [0,1,0,1,0,0|2,0,0]=4 4519 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000225621_100000189651 [0,1,0,1,0,0|2,0,0]=4 4520 B15R2.4343 CN(CF)Cc1ccc2c(c1)OCO2 269982a_100000186720_100015361967 [0,1,0,1,0,0|2,0,0]=4 4521 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 11a_106832991635_100000743733 [0,1,0,1,0,0|1,0,1]=4 4522 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 240690a_100102657272_100000743733 [0,1,0,1,0,0|1,0,1]=4 4523 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 527a_100102657272_100000743733 [0,1,0,1,0,0|1,0,1]=4 4524 B15R2.4343 O=C(CF)Cc1ccc2c(c1)OCO2 1458a_100000743733_100015361967 [0,1,0,1,0,0|1,0,1]=4 4525 B15R2.30442 COc1cc(ccc1O)NC2CCC2 34a_100000726020_100000749161 [0,1,0,1,0,0|2,0,0]=4 4526 B15R2.30442 COc1cc(ccc1O)NC2COC2 34a_100000726020_100009818527 [0,1,0,1,0,0|2,0,0]=4 4527 B15R2.42998 CC(C)(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210625 [0,1,0,1,0,0|2,0,0]=4 4528 B15R2.42998 CC(C)(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210625 [0,1,0,1,0,0|2,0,0]=4 4529 B15R2.31888 COc1cc(ccc1CO)NC2CC2 34a_100012183141_100000211595 [0,1,0,1,0,0|2,0,0]=4 4530 B15R2.31888 COc1cc(ccc1CO)OC2CC2 34a_200000116926_100000211595 [0,1,0,1,0,0|2,0,0]=4 4531 B15R2.31888 COc1cc(ccc1CO)SC2CC2 62a_100011277633_100000211595 [0,1,0,1,0,0|2,0,0]=4 4532 B15R2.31888 COc1ccc(cc1OC)NC2CC2 34a_100000187404_100000211595 [0,1,0,1,0,0|2,0,0]=4 4533 B15R2.31888 COc1ccc(cc1OC)OC2CC2 34a_100000039706_100000211595 [0,1,0,1,0,0|2,0,0]=4 4534 B15R2.43323 CC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000210206 [0,1,0,1,0,0|2,0,0]=4 4535 B15R2.43323 Cc1c(ccc2c1OCO2)SC(C)C 62a_100010335860_100000210206 [0,1,0,1,0,0|2,0,0]=4 4536 B15R3.4379 c1cc2c(cc1NC3CC3)OCO2 34a_100000209953_100000211595 [0,0,0,2,0,0|2,0,0]=4 4537 B15R3.4379 c1cc2c(cc1OC3CC3)OCO2 34a_100000210298_100000211595 [0,0,0,2,0,0|2,0,0]=4 4538 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [1,0,0,0,1,0|1,0,1]=4 4539 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [1,0,0,0,1,0|1,0,1]=4 4540 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [1,0,0,0,1,0|1,0,1]=4 4541 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [1,0,0,0,1,0|1,0,1]=4 4542 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [1,0,0,0,1,0|1,0,1]=4 4543 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [1,0,0,0,1,0|1,0,1]=4 4544 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [1,0,0,0,1,0|2,0,0]=4 4545 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [1,0,0,0,1,0|2,0,0]=4 4546 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [1,0,0,0,1,0|2,0,0]=4 4547 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [1,0,0,0,1,0|1,0,0]=3 4548 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [1,0,0,0,1,0|1,0,0]=3 4549 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,0,0,0,1,0|1,0,1]=4 4550 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [1,0,0,0,1,0|1,0,1]=4 4551 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [1,0,0,0,1,0|2,0,0]=4 4552 B11R1.21 Cc1cc(ncc1O)C(C)C 271570a_203496583355_100021475462 [1,0,0,0,1,0|2,0,0]=4 4553 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [1,0,0,0,1,0|1,0,1]=4 4554 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [1,0,0,0,1,0|1,0,1]=4 4555 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [1,0,0,0,1,0|1,0,1]=4 4556 B11R1.266 C=Cc1cccc(c1)C(C)N 271570a_100011290941_100020642005 [1,0,0,0,1,0|1,0,1]=4 4557 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [1,0,0,0,1,0|1,0,1]=4 4558 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [1,0,0,0,1,0|1,0,1]=4 4559 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 2230a_100000211879_200025704644 [1,0,0,0,1,0|2,0,0]=4 4560 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 34a_100000211879_200025704644 [1,0,0,0,1,0|2,0,0]=4 4561 B11R1.266 CC(C)c1cccc(c1)N[13CH3] 7a_100000211879_200025704644 [1,0,0,0,1,0|2,0,0]=4 4562 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [1,0,0,0,1,0|1,0,0]=3 4563 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [1,0,0,0,1,0|1,0,0]=3 4564 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_100011214899_200025704644 [1,0,0,0,1,0|1,1,0]=4 4565 B11R1.266 CC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100011214899 [1,0,0,0,1,0|1,1,0]=4 4566 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [1,0,0,0,1,0|0,0,0]=2 4567 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [1,0,0,0,1,0|0,0,0]=2 4568 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [1,0,0,0,1,0|0,1,0]=3 4569 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [1,0,0,0,1,0|0,1,0]=3 4570 B11R1.266 CC(N)c1cccc(n1)S[13CH3] 62a_200010173468_200025704644 [1,0,0,0,1,0|1,1,0]=4 4571 B11R1.266 CC(N)c1cccc(n1)S[13CH3] 62a_200025704644_200010173468 [1,0,0,0,1,0|1,1,0]=4 4572 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 2230a_100011217120_200025704644 [1,0,0,0,1,0|2,0,0]=4 4573 B11R1.266 CC(O)c1cccc(c1)N[13CH3] 34a_100011217120_200025704644 [1,0,0,0,1,0|2,0,0]=4 4574 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [1,0,0,0,1,0|1,0,0]=3 4575 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [1,0,0,0,1,0|1,0,0]=3 4576 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_100000246457_200025704644 [1,0,0,0,1,0|1,1,0]=4 4577 B11R1.266 CC(O)c1cccc(c1)S[13CH3] 62a_200025704644_100000246457 [1,0,0,0,1,0|1,1,0]=4 4578 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [1,0,0,0,1,0|2,0,0]=4 4579 B11R1.266 CNc1cccc(c1)C(C)C 2230a_100000211879_200000210301 [1,0,0,0,1,0|2,0,0]=4 4580 B11R1.266 CNc1cccc(c1)C(C)C 34a_100000211879_200000210301 [1,0,0,0,1,0|2,0,0]=4 4581 B11R1.266 CNc1cccc(c1)C(C)C 7a_100000211879_200000210301 [1,0,0,0,1,0|2,0,0]=4 4582 B11R1.266 CNc1cccc(c1)C(C)O 2230a_100011217120_200000210301 [1,0,0,0,1,0|2,0,0]=4 4583 B11R1.266 CNc1cccc(c1)C(C)O 34a_100011217120_200000210301 [1,0,0,0,1,0|2,0,0]=4 4584 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [1,0,0,0,1,0|1,0,1]=4 4585 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [1,0,0,0,1,0|1,0,1]=4 4586 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [1,0,0,0,1,0|1,0,1]=4 4587 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [1,0,0,0,1,0|1,0,1]=4 4588 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [1,0,0,0,1,0|1,0,1]=4 4589 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [1,0,0,0,1,0|1,0,1]=4 4590 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [1,0,0,0,1,0|1,0,1]=4 4591 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [1,0,0,0,1,0|1,0,0]=3 4592 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [1,0,0,0,1,0|1,0,0]=3 4593 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [1,0,0,0,1,0|0,0,0]=2 4594 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [1,0,0,0,1,0|0,0,0]=2 4595 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [1,0,0,0,1,0|1,0,0]=3 4596 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [1,0,0,0,1,0|1,0,0]=3 4597 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [1,0,0,0,1,0|2,0,0]=4 4598 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [1,0,0,0,1,0|2,0,0]=4 4599 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [1,0,0,0,1,0|2,0,0]=4 4600 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [1,0,0,0,1,0|2,0,0]=4 4601 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [1,0,0,0,1,0|2,0,0]=4 4602 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [1,0,0,0,1,0|2,0,0]=4 4603 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [1,0,0,0,1,0|2,0,0]=4 4604 B11R1.266 CSc1cccc(c1)C(C)C 62a_100011214899_200000210301 [1,0,0,0,1,0|1,1,0]=4 4605 B11R1.266 CSc1cccc(c1)C(C)C 62a_200000210301_100011214899 [1,0,0,0,1,0|1,1,0]=4 4606 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [1,0,0,0,1,0|0,1,0]=3 4607 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [1,0,0,0,1,0|0,1,0]=3 4608 B11R1.266 CSc1cccc(c1)C(C)O 62a_100000246457_200000210301 [1,0,0,0,1,0|1,1,0]=4 4609 B11R1.266 CSc1cccc(c1)C(C)O 62a_200000210301_100000246457 [1,0,0,0,1,0|1,1,0]=4 4610 B11R1.266 CSc1cccc(n1)C(C)N 62a_200000210301_200010173468 [1,0,0,0,1,0|1,1,0]=4 4611 B11R1.266 CSc1cccc(n1)C(C)N 62a_200010173468_200000210301 [1,0,0,0,1,0|1,1,0]=4 4612 B11R1.266 CSc1cncc(c1)[C@@H](C)N 62a_100012350620_200000210301 [1,0,0,0,1,0|1,1,0]=4 4613 B11R1.266 CSc1cncc(c1)[C@@H](C)N 62a_200000210301_100012350620 [1,0,0,0,1,0|1,1,0]=4 4614 B11R1.266 C[C@@H](N)c1cncc(c1)S[13CH3] 62a_100012350620_200025704644 [1,0,0,0,1,0|1,1,0]=4 4615 B11R1.266 C[C@@H](N)c1cncc(c1)S[13CH3] 62a_200025704644_100012350620 [1,0,0,0,1,0|1,1,0]=4 4616 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [1,0,0,0,1,0|1,0,1]=4 4617 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [1,0,0,0,1,0|1,0,1]=4 4618 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [1,0,0,0,1,0|1,0,1]=4 4619 B13R1.643 C=C(C)CNc1cccc(c1)OC 34a_100000210024_100000748629 [1,0,0,0,0,1|1,0,1]=4 4620 B13R1.643 C=C(C)COc1cccc(c1)OC 34a_100000211255_100000748629 [1,0,0,0,0,1|1,0,1]=4 4621 B13R1.643 C=C(C)COc1cccc(c1)OC 7a_100000211255_100000748629 [1,0,0,0,0,1|1,0,1]=4 4622 B13R1.643 C=C(C)CSc1cccc(c1)OC 62a_100000748629_100000170001 [1,0,0,0,0,1|1,0,1]=4 4623 B13R1.643 CC(C)COc1cccc(c1)S[13CH3] 62a_200000170005_200025704644 [1,0,0,0,0,1|1,1,0]=4 4624 B13R1.643 CC(C)COc1cccc(c1)S[13CH3] 62a_200025704644_200000170005 [1,0,0,0,0,1|1,1,0]=4 4625 B13R1.643 CC(C)NCc1cccc(c1)S[13CH3] 62a_100000195767_200025704644 [1,0,0,0,0,1|1,1,0]=4 4626 B13R1.643 CC(C)NCc1cccc(c1)S[13CH3] 62a_200025704644_100000195767 [1,0,0,0,0,1|1,1,0]=4 4627 B13R1.643 CCc1cccc(c1)CNC(C)C 207a_100138425928_100011999841 [1,0,0,0,0,1|2,0,0]=4 4628 B13R1.643 CCc1cccc(c1)NCC(C)C 2230a_100000211250_100000210760 [1,0,0,0,0,1|2,0,0]=4 4629 B13R1.643 CCc1cccc(c1)NCC(C)C 34a_100000211250_100000210624 [1,0,0,0,0,1|2,0,0]=4 4630 B13R1.643 CCc1cccc(c1)NCC(C)C 7a_100000211250_100000210760 [1,0,0,0,0,1|2,0,0]=4 4631 B13R1.643 CCc1cccc(c1)NCC(C)O 2230a_100000211250_100011218427 [1,0,0,0,0,1|2,0,0]=4 4632 B13R1.643 CCc1cccc(c1)NCC(C)O 34a_100000211250_100011218427 [1,0,0,0,0,1|2,0,0]=4 4633 B13R1.643 CCc1cccc(c1)NCC(C)O 7a_100000211250_100011218427 [1,0,0,0,0,1|2,0,0]=4 4634 B13R1.643 CCc1cccc(c1)NC[C@@H](C)O 2230a_100000211250_100009817552 [1,0,0,0,0,1|2,0,0]=4 4635 B13R1.643 CCc1cccc(c1)NC[C@@H](C)O 34a_100000211250_100009817552 [1,0,0,0,0,1|2,0,0]=4 4636 B13R1.643 CCc1cccc(c1)NC[C@@H](C)O 7a_100000211250_100009817552 [1,0,0,0,0,1|2,0,0]=4 4637 B13R1.643 CCc1cccc(c1)OCC(C)C 34a_100000211550_100000210624 [1,0,0,0,0,1|2,0,0]=4 4638 B13R1.643 CCc1cccc(c1)OCC(C)C 7a_100000211550_100000210760 [1,0,0,0,0,1|2,0,0]=4 4639 B13R1.643 CCc1cccc(c1)OCC(C)O 34a_100000211550_100011218427 [1,0,0,0,0,1|2,0,0]=4 4640 B13R1.643 CCc1cccc(c1)OCC(C)O 7a_100000211550_100011218427 [1,0,0,0,0,1|2,0,0]=4 4641 B13R1.643 CCc1cccc(c1)OC[C@@H](C)O 34a_100000211550_100009817552 [1,0,0,0,0,1|2,0,0]=4 4642 B13R1.643 CCc1cccc(c1)OC[C@@H](C)O 7a_100000211550_100009817552 [1,0,0,0,0,1|2,0,0]=4 4643 B13R1.643 CCc1cccc(c1)SCC(C)C 62a_100000210624_100011263222 [1,0,0,0,0,1|2,0,0]=4 4644 B13R1.643 CCc1cccc(c1)SCC(C)C 62a_100011263222_100000210760 [1,0,0,0,0,1|2,0,0]=4 4645 B13R1.643 CCc1cccc(c1)SCC(C)O 62a_100011218427_100011263222 [1,0,0,0,0,1|2,0,0]=4 4646 B13R1.643 CCc1cccc(c1)SCC(C)O 62a_100011263222_100011218427 [1,0,0,0,0,1|2,0,0]=4 4647 B13R1.643 CCc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011263222 [1,0,0,0,0,1|2,0,0]=4 4648 B13R1.643 CCc1cccc(c1)SC[C@@H](C)O 62a_100011263222_100009817552 [1,0,0,0,0,1|2,0,0]=4 4649 B13R1.643 CNc1cccc(c1)OCC(C)C 27a_100102657272_200000170005 [1,0,0,0,0,1|2,0,0]=4 4650 B13R1.643 CNc1cccc(c1)OCC(C)C 34a_100000756613_100000210624 [1,0,0,0,0,1|2,0,0]=4 4651 B13R1.643 CNc1cccc(c1)OCC(C)C 7a_100000756613_100000210760 [1,0,0,0,0,1|2,0,0]=4 4652 B13R1.643 CNc1cccc(c1)OCC(C)O 34a_100000756613_100011218427 [1,0,0,0,0,1|2,0,0]=4 4653 B13R1.643 CNc1cccc(c1)OCC(C)O 7a_100000756613_100011218427 [1,0,0,0,0,1|2,0,0]=4 4654 B13R1.643 CNc1cccc(c1)OC[C@@H](C)O 34a_100000756613_100009817552 [1,0,0,0,0,1|2,0,0]=4 4655 B13R1.643 CNc1cccc(c1)OC[C@@H](C)O 7a_100000756613_100009817552 [1,0,0,0,0,1|2,0,0]=4 4656 B13R1.643 CNc1cccc(c1)SCC(C)C 62a_100000210624_100000219648 [1,0,0,0,0,1|2,0,0]=4 4657 B13R1.643 CNc1cccc(c1)SCC(C)C 62a_100000219648_100000210760 [1,0,0,0,0,1|2,0,0]=4 4658 B13R1.643 CNc1cccc(c1)SCC(C)O 62a_100000219648_100011218427 [1,0,0,0,0,1|2,0,0]=4 4659 B13R1.643 CNc1cccc(c1)SCC(C)O 62a_100011218427_100000219648 [1,0,0,0,0,1|2,0,0]=4 4660 B13R1.643 CNc1cccc(c1)SC[C@@H](C)O 62a_100000219648_100009817552 [1,0,0,0,0,1|2,0,0]=4 4661 B13R1.643 CNc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100000219648 [1,0,0,0,0,1|2,0,0]=4 4662 B13R1.643 COc1cc(ccn1)CNC(C)C 207a_100138425928_100000050969 [1,0,0,0,0,1|2,0,0]=4 4663 B13R1.643 COc1cc(ccn1)CNC(C)C 2230a_100138425928_100103152439 [1,0,0,0,0,1|2,0,0]=4 4664 B13R1.643 COc1cc(ccn1)CNC(C)C 34a_100138425928_100103152439 [1,0,0,0,0,1|2,0,0]=4 4665 B13R1.643 COc1cc(ccn1)COC(C)C 34a_100000212225_100103152439 [1,0,0,0,0,1|2,0,0]=4 4666 B13R1.643 COc1cc(ccn1)CSC(C)C 62a_100000210206_100103152439 [1,0,0,0,0,1|2,0,0]=4 4667 B13R1.643 COc1cc(ccn1)CSC(C)C 62a_100103152439_100000210206 [1,0,0,0,0,1|2,0,0]=4 4668 B13R1.643 COc1cc(ccn1)OCC(C)C 34a_100012181050_100000210624 [1,0,0,0,0,1|2,0,0]=4 4669 B13R1.643 COc1cc(ccn1)OCC(C)O 34a_100012181050_100011218427 [1,0,0,0,0,1|2,0,0]=4 4670 B13R1.643 COc1cc(ccn1)OC[C@@H](C)O 34a_100012181050_100009817552 [1,0,0,0,0,1|2,0,0]=4 4671 B13R1.643 COc1cc(ccn1)SCC(C)C 62a_100000117307_100000210760 [1,0,0,0,0,1|2,0,0]=4 4672 B13R1.643 COc1cc(ccn1)SCC(C)C 62a_100000210624_100000117307 [1,0,0,0,0,1|2,0,0]=4 4673 B13R1.643 COc1cc(ccn1)SCC(C)O 62a_100000117307_100011218427 [1,0,0,0,0,1|2,0,0]=4 4674 B13R1.643 COc1cc(ccn1)SCC(C)O 62a_100011218427_100000117307 [1,0,0,0,0,1|2,0,0]=4 4675 B13R1.643 COc1cc(ccn1)SC[C@@H](C)O 62a_100000117307_100009817552 [1,0,0,0,0,1|2,0,0]=4 4676 B13R1.643 COc1cc(ccn1)SC[C@@H](C)O 62a_100009817552_100000117307 [1,0,0,0,0,1|2,0,0]=4 4677 B13R1.643 COc1cccc(c1)C=CC(C)C 271570a_100016257149_100000170001 [1,0,0,0,0,1|1,0,1]=4 4678 B13R1.643 COc1cccc(c1)C=CC(C)O 271570a_200011019289_100000170001 [1,0,0,0,0,1|1,0,1]=4 4679 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000070787_100011713679 [1,0,0,0,0,1|1,0,1]=4 4680 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000234931_200000210301 [1,0,0,0,0,1|1,0,1]=4 4681 B13R1.643 COc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234931_200025704644 [1,0,0,0,0,1|1,0,1]=4 4682 B13R1.643 COc1cccc(c1)CCN(C)C 2230a_100011269071_200000210301 [1,0,0,0,0,1|2,0,0]=4 4683 B13R1.643 COc1cccc(c1)CCN(C)C 2230a_100102631434_100011713679 [1,0,0,0,0,1|2,0,0]=4 4684 B13R1.643 COc1cccc(c1)CCN(C)C 269982a_100011269071_200000210301 [1,0,0,0,0,1|2,0,0]=4 4685 B13R1.643 COc1cccc(c1)CCN(C)C 269982a_100102631434_100011713679 [1,0,0,0,0,1|2,0,0]=4 4686 B13R1.643 COc1cccc(c1)CCN(C)C 34a_100011269071_200000210301 [1,0,0,0,0,1|2,0,0]=4 4687 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 2230a_100011269071_200025704644 [1,0,0,0,0,1|2,0,0]=4 4688 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 269982a_100011269071_200025704644 [1,0,0,0,0,1|2,0,0]=4 4689 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 34a_100011269071_200025704644 [1,0,0,0,0,1|2,0,0]=4 4690 B13R1.643 COc1cccc(c1)CNC(=O)C 11a_100000174954_100015343762 [1,0,0,0,0,1|1,0,1]=4 4691 B13R1.643 COc1cccc(c1)CNC(=O)C 1626a_100000174954_100015343762 [1,0,0,0,0,1|1,0,1]=4 4692 B13R1.643 COc1cccc(c1)CNC(=O)C 240690a_100000174954_100015343762 [1,0,0,0,0,1|1,0,1]=4 4693 B13R1.643 COc1cccc(c1)CNC(=O)C 527a_100000174954_100103153847 [1,0,0,0,0,1|1,0,1]=4 4694 B13R1.643 COc1cccc(c1)CNC(C)C 207a_100138425928_100000170238 [1,0,0,0,0,1|1,0,0]=3 4695 B13R1.643 COc1cccc(c1)CNC(C)C 2230a_100000174954_100000210206 [1,0,0,0,0,1|1,0,0]=3 4696 B13R1.643 COc1cccc(c1)CNC(C)C 2230a_100138425928_100000211672 [1,0,0,0,0,1|1,0,0]=3 4697 B13R1.643 COc1cccc(c1)CNC(C)C 34a_100000174954_100000210206 [1,0,0,0,0,1|1,0,0]=3 4698 B13R1.643 COc1cccc(c1)CNC(C)C 34a_100138425928_100000688526 [1,0,0,0,0,1|1,0,0]=3 4699 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000198976_100000210206 [1,0,0,0,0,1|1,0,0]=3 4700 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000212225_100000688526 [1,0,0,0,0,1|1,0,0]=3 4701 B13R1.643 COc1cccc(c1)CSC(C)C 62a_100000210206_100000211672 [1,0,0,0,0,1|1,0,0]=3 4702 B13R1.643 COc1cccc(c1)CSC(C)C 62a_100000688526_100000210206 [1,0,0,0,0,1|1,0,0]=3 4703 B13R1.643 COc1cccc(c1)NCC(=O)N 34a_100000210024_100000187820 [1,0,0,0,0,1|1,0,1]=4 4704 B13R1.643 COc1cccc(c1)NCC(C)C 34a_100000210024_100000210624 [1,0,0,0,0,1|1,0,0]=3 4705 B13R1.643 COc1cccc(c1)NCC(C)O 34a_100000210024_100011218427 [1,0,0,0,0,1|1,0,0]=3 4706 B13R1.643 COc1cccc(c1)NCC(F)F 34a_100000210024_100011934356 [1,0,0,0,0,1|2,0,0]=4 4707 B13R1.643 COc1cccc(c1)NC[C@@H](C)O 34a_100000210024_100009817552 [1,0,0,0,0,1|1,0,0]=3 4708 B13R1.643 COc1cccc(c1)OCC(=O)C 1458a_100000182123_200000210301 [1,0,0,0,0,1|1,0,1]=4 4709 B13R1.643 COc1cccc(c1)OCC(=O)N 34a_100000211255_100000187820 [1,0,0,0,0,1|1,0,1]=4 4710 B13R1.643 COc1cccc(c1)OCC(=O)N 7a_100000211255_100000187820 [1,0,0,0,0,1|1,0,1]=4 4711 B13R1.643 COc1cccc(c1)OCC(=O)[13CH3] 1458a_100000182123_200025704644 [1,0,0,0,0,1|1,0,1]=4 4712 B13R1.643 COc1cccc(c1)OCC(C)C 34a_100000211255_100000210624 [1,0,0,0,0,1|1,0,0]=3 4713 B13R1.643 COc1cccc(c1)OCC(C)C 7a_100000211255_100000210760 [1,0,0,0,0,1|1,0,0]=3 4714 B13R1.643 COc1cccc(c1)OCC(C)O 34a_100000211255_100011218427 [1,0,0,0,0,1|1,0,0]=3 4715 B13R1.643 COc1cccc(c1)OCC(C)O 7a_100000211255_100011218427 [1,0,0,0,0,1|1,0,0]=3 4716 B13R1.643 COc1cccc(c1)OCC(F)F 34a_100000211255_100011934356 [1,0,0,0,0,1|2,0,0]=4 4717 B13R1.643 COc1cccc(c1)OCC(F)F 7a_100000211255_100011934356 [1,0,0,0,0,1|2,0,0]=4 4718 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 34a_100000211255_100009817552 [1,0,0,0,0,1|1,0,0]=3 4719 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 7a_100000211255_100009817552 [1,0,0,0,0,1|1,0,0]=3 4720 B13R1.643 COc1cccc(c1)SCC(=O)C 1458a_100000741315_200000210301 [1,0,0,0,0,1|1,0,1]=4 4721 B13R1.643 COc1cccc(c1)SCC(=O)N 62a_100000747473_100000170001 [1,0,0,0,0,1|1,0,1]=4 4722 B13R1.643 COc1cccc(c1)SCC(=O)[13CH3] 1458a_100000741315_200025704644 [1,0,0,0,0,1|1,0,1]=4 4723 B13R1.643 COc1cccc(c1)SCC(C)C 62a_100000210624_100000170001 [1,0,0,0,0,1|1,0,0]=3 4724 B13R1.643 COc1cccc(c1)SCC(C)O 62a_100011218427_100000170001 [1,0,0,0,0,1|1,0,0]=3 4725 B13R1.643 COc1cccc(c1)SCC(F)F 62a_100011934356_100000170001 [1,0,0,0,0,1|2,0,0]=4 4726 B13R1.643 COc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100000170001 [1,0,0,0,0,1|1,0,0]=3 4727 B13R1.643 COc1cccc(n1)CNC(C)C 207a_100138425928_100000694346 [1,0,0,0,0,1|2,0,0]=4 4728 B13R1.643 COc1cccc(n1)CNC(C)C 2230a_100000746380_100000210206 [1,0,0,0,0,1|2,0,0]=4 4729 B13R1.643 COc1cccc(n1)CNC(C)C 2230a_100138425928_100000755263 [1,0,0,0,0,1|2,0,0]=4 4730 B13R1.643 COc1cccc(n1)CNC(C)C 34a_100138425928_100000755263 [1,0,0,0,0,1|2,0,0]=4 4731 B13R1.643 COc1cccc(n1)COC(C)C 34a_100000212225_100000755263 [1,0,0,0,0,1|2,0,0]=4 4732 B13R1.643 COc1cccc(n1)CSC(C)C 62a_100000210206_100000755263 [1,0,0,0,0,1|2,0,0]=4 4733 B13R1.643 COc1cccc(n1)CSC(C)C 62a_100000755263_100000210206 [1,0,0,0,0,1|2,0,0]=4 4734 B13R1.643 COc1cccc(n1)SCC(C)C 62a_100000210624_100000760917 [1,0,0,0,0,1|2,0,0]=4 4735 B13R1.643 COc1cccc(n1)SCC(C)C 62a_100000760917_100000210760 [1,0,0,0,0,1|2,0,0]=4 4736 B13R1.643 COc1cccc(n1)SCC(C)O 62a_100000760917_100011218427 [1,0,0,0,0,1|2,0,0]=4 4737 B13R1.643 COc1cccc(n1)SCC(C)O 62a_100011218427_100000760917 [1,0,0,0,0,1|2,0,0]=4 4738 B13R1.643 COc1cccc(n1)SC[C@@H](C)O 62a_100000760917_100009817552 [1,0,0,0,0,1|2,0,0]=4 4739 B13R1.643 COc1cccc(n1)SC[C@@H](C)O 62a_100009817552_100000760917 [1,0,0,0,0,1|2,0,0]=4 4740 B13R1.643 COc1ccnc(c1)CNC(C)C 207a_100138425928_100000087537 [1,0,0,0,0,1|2,0,0]=4 4741 B13R1.643 COc1ccnc(c1)CNC(C)C 2230a_100138425928_100000752681 [1,0,0,0,0,1|2,0,0]=4 4742 B13R1.643 COc1ccnc(c1)CNC(C)C 34a_100138425928_100000752681 [1,0,0,0,0,1|2,0,0]=4 4743 B13R1.643 COc1ccnc(c1)COC(C)C 34a_100000212225_100000752681 [1,0,0,0,0,1|2,0,0]=4 4744 B13R1.643 COc1ccnc(c1)COC(C)C 34a_100000749536_100000210206 [1,0,0,0,0,1|2,0,0]=4 4745 B13R1.643 COc1ccnc(c1)CSC(C)C 62a_100000210206_100000752681 [1,0,0,0,0,1|2,0,0]=4 4746 B13R1.643 COc1ccnc(c1)CSC(C)C 62a_100000752681_100000210206 [1,0,0,0,0,1|2,0,0]=4 4747 B13R1.643 COc1ccnc(c1)SCC(C)C 62a_100000210624_100011216251 [1,0,0,0,0,1|2,0,0]=4 4748 B13R1.643 COc1ccnc(c1)SCC(C)C 62a_100009817693_100000210760 [1,0,0,0,0,1|2,0,0]=4 4749 B13R1.643 COc1ccnc(c1)SCC(C)O 62a_100009817693_100011218427 [1,0,0,0,0,1|2,0,0]=4 4750 B13R1.643 COc1ccnc(c1)SCC(C)O 62a_100011218427_100011216251 [1,0,0,0,0,1|2,0,0]=4 4751 B13R1.643 COc1ccnc(c1)SC[C@@H](C)O 62a_100009817552_100011216251 [1,0,0,0,0,1|2,0,0]=4 4752 B13R1.643 COc1ccnc(c1)SC[C@@H](C)O 62a_100009817693_100009817552 [1,0,0,0,0,1|2,0,0]=4 4753 B13R1.643 COc1cncc(c1)CNC(C)C 207a_100138425928_100011361638 [1,0,0,0,0,1|2,0,0]=4 4754 B13R1.643 COc1cncc(c1)CNC(C)C 2230a_100020589029_100000210206 [1,0,0,0,0,1|2,0,0]=4 4755 B13R1.643 COc1cncc(c1)CNC(C)C 34a_100020589029_100000210206 [1,0,0,0,0,1|2,0,0]=4 4756 B13R1.643 COc1cncc(c1)COC(C)C 34a_100000732071_100000210206 [1,0,0,0,0,1|2,0,0]=4 4757 B13R1.643 COc1cncc(c1)OCC(C)C 34a_100000084572_100000210624 [1,0,0,0,0,1|2,0,0]=4 4758 B13R1.643 COc1cncc(c1)OCC(C)C 7a_100000084572_100000210760 [1,0,0,0,0,1|2,0,0]=4 4759 B13R1.643 COc1cncc(c1)OCC(C)O 34a_100000084572_100011218427 [1,0,0,0,0,1|2,0,0]=4 4760 B13R1.643 COc1cncc(c1)OCC(C)O 7a_100000084572_100011218427 [1,0,0,0,0,1|2,0,0]=4 4761 B13R1.643 COc1cncc(c1)OC[C@@H](C)O 34a_100000084572_100009817552 [1,0,0,0,0,1|2,0,0]=4 4762 B13R1.643 COc1cncc(c1)OC[C@@H](C)O 7a_100000084572_100009817552 [1,0,0,0,0,1|2,0,0]=4 4763 B13R1.643 COc1cncc(c1)SCC(C)C 62a_100000050176_100000210760 [1,0,0,0,0,1|2,0,0]=4 4764 B13R1.643 COc1cncc(c1)SCC(C)C 62a_100000210624_100000050176 [1,0,0,0,0,1|2,0,0]=4 4765 B13R1.643 COc1cncc(c1)SCC(C)O 62a_100000050176_100011218427 [1,0,0,0,0,1|2,0,0]=4 4766 B13R1.643 COc1cncc(c1)SCC(C)O 62a_100011218427_100000050176 [1,0,0,0,0,1|2,0,0]=4 4767 B13R1.643 COc1cncc(c1)SC[C@@H](C)O 62a_100000050176_100009817552 [1,0,0,0,0,1|2,0,0]=4 4768 B13R1.643 COc1cncc(c1)SC[C@@H](C)O 62a_100009817552_100000050176 [1,0,0,0,0,1|2,0,0]=4 4769 B13R1.643 CSc1cccc(c1)CNC(C)C 207a_100138425928_100011935093 [1,0,0,0,0,1|1,1,0]=4 4770 B13R1.643 CSc1cccc(c1)CNC(C)C 62a_100000195767_200000210301 [1,0,0,0,0,1|1,1,0]=4 4771 B13R1.643 CSc1cccc(c1)CNC(C)C 62a_200000210301_100000195767 [1,0,0,0,0,1|1,1,0]=4 4772 B13R1.643 CSc1cccc(c1)NCC(C)C 2230a_100000210049_100000210760 [1,0,0,0,0,1|1,1,0]=4 4773 B13R1.643 CSc1cccc(c1)NCC(C)C 34a_100000210049_100000210624 [1,0,0,0,0,1|1,1,0]=4 4774 B13R1.643 CSc1cccc(c1)NCC(C)O 2230a_100000210049_100011218427 [1,0,0,0,0,1|1,1,0]=4 4775 B13R1.643 CSc1cccc(c1)NCC(C)O 34a_100000210049_100011218427 [1,0,0,0,0,1|1,1,0]=4 4776 B13R1.643 CSc1cccc(c1)NC[C@@H](C)O 2230a_100000210049_100009817552 [1,0,0,0,0,1|1,1,0]=4 4777 B13R1.643 CSc1cccc(c1)NC[C@@H](C)O 34a_100000210049_100009817552 [1,0,0,0,0,1|1,1,0]=4 4778 B13R1.643 CSc1cccc(c1)OCC(C)C 34a_100011265683_100000210624 [1,0,0,0,0,1|1,1,0]=4 4779 B13R1.643 CSc1cccc(c1)OCC(C)C 62a_200000170005_200000210301 [1,0,0,0,0,1|1,1,0]=4 4780 B13R1.643 CSc1cccc(c1)OCC(C)C 62a_200000210301_200000170005 [1,0,0,0,0,1|1,1,0]=4 4781 B13R1.643 CSc1cccc(c1)OCC(C)C 7a_100011265683_100000210760 [1,0,0,0,0,1|1,1,0]=4 4782 B13R1.643 CSc1cccc(c1)OCC(C)O 34a_100011265683_100011218427 [1,0,0,0,0,1|1,1,0]=4 4783 B13R1.643 CSc1cccc(c1)OCC(C)O 7a_100011265683_100011218427 [1,0,0,0,0,1|1,1,0]=4 4784 B13R1.643 CSc1cccc(c1)OC[C@@H](C)O 34a_100011265683_100009817552 [1,0,0,0,0,1|1,1,0]=4 4785 B13R1.643 CSc1cccc(c1)OC[C@@H](C)O 7a_100011265683_100009817552 [1,0,0,0,0,1|1,1,0]=4 4786 B13R1.643 CSc1cccc(c1)SCC(C)C 62a_100000210624_100011215954 [1,0,0,0,0,1|1,1,0]=4 4787 B13R1.643 CSc1cccc(c1)SCC(C)C 62a_100011215954_100000210760 [1,0,0,0,0,1|1,1,0]=4 4788 B13R1.643 CSc1cccc(c1)SCC(C)O 62a_100011215954_100011218427 [1,0,0,0,0,1|1,1,0]=4 4789 B13R1.643 CSc1cccc(c1)SCC(C)O 62a_100011218427_100011215954 [1,0,0,0,0,1|1,1,0]=4 4790 B13R1.643 CSc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100011215954 [1,0,0,0,0,1|1,1,0]=4 4791 B13R1.643 CSc1cccc(c1)SC[C@@H](C)O 62a_100011215954_100009817552 [1,0,0,0,0,1|1,1,0]=4 4792 B13R1.51 COc1cc(ccc1NC(C)C)O 34a_100015326901_100000210206 [0,0,0,0,1,1|2,0,0]=4 4793 B13R1.51 COc1cc(ccc1OC(C)C)O 271570a_203496583355_100012354883 [0,0,0,0,1,1|2,0,0]=4 4794 B13R1.51 COc1cc(ccc1SC(C)C)O 62a_100000210206_100011827694 [0,0,0,0,1,1|2,0,0]=4 4795 B13R1.115 COc1c(cccc1SC(C)C)O 62a_100000210206_100010234590 [0,0,0,0,1,1|2,0,0]=4 4796 B13R1.115 COc1c(ccnc1SC(C)C)O 62a_100000210206_100000104430 [0,0,0,0,1,1|2,0,0]=4 4797 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)O 34a_100000726020_100000730704 [0,0,0,0,0,2|1,0,1]=4 4798 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)O 62a_100000730704_100000694246 [0,0,0,0,0,2|1,0,1]=4 4799 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000748629 [0,0,0,0,0,2|1,0,1]=4 4800 B15R1.4030 CCc1cc(ccc1O)C=CCC(C)C 271570a_100016259101_100012338938 [0,0,0,0,0,2|2,0,0]=4 4801 B15R1.4030 CCc1cc(ccc1O)SCCC(C)C 62a_100000210312_100012338938 [0,0,0,0,0,2|2,0,0]=4 4802 B15R1.4030 CCc1cc(ccc1O)SCCC(C)O 62a_100012276601_100012338938 [0,0,0,0,0,2|2,0,0]=4 4803 B15R1.4030 CCc1cc(ccc1O)SCOC(C)C 62a_100000709892_100012338938 [0,0,0,0,0,2|2,0,0]=4 4804 B15R1.4030 COc1cc(ccc1Br)C=CCC(C)C 271570a_100016259101_100012353699 [0,0,0,0,0,2|2,0,0]=4 4805 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 207a_100000210953_100010244714 [0,0,0,0,0,2|2,0,0]=4 4806 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 2230a_100000210953_100010110085 [0,0,0,0,0,2|2,0,0]=4 4807 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 26a_100000210953_100011827694 [0,0,0,0,0,2|2,0,0]=4 4808 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 270004a_100000210953_100010244714 [0,0,0,0,0,2|2,0,0]=4 4809 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 34a_100000210953_100010110085 [0,0,0,0,0,2|2,0,0]=4 4810 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 207a_100000210904_100010244714 [0,0,0,0,0,2|2,0,0]=4 4811 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 2230a_100000210904_100010110085 [0,0,0,0,0,2|2,0,0]=4 4812 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 270004a_100000210904_100010244714 [0,0,0,0,0,2|2,0,0]=4 4813 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 34a_100000210904_100010110085 [0,0,0,0,0,2|2,0,0]=4 4814 B15R1.4030 COc1cc(ccc1Br)COCC(C)Br 34a_100012180447_100010110085 [0,0,0,0,0,2|2,0,0]=4 4815 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 34a_100000210257_100010110085 [0,0,0,0,0,2|2,0,0]=4 4816 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 34a_100010234685_100000210624 [0,0,0,0,0,2|2,0,0]=4 4817 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 7a_100010234685_100000210760 [0,0,0,0,0,2|2,0,0]=4 4818 B15R1.4030 COc1cc(ccc1Br)COCC(C)F 34a_100015925927_100010110085 [0,0,0,0,0,2|2,0,0]=4 4819 B15R1.4030 COc1cc(ccc1Br)COCC(C)O 34a_100010234685_100011218427 [0,0,0,0,0,2|2,0,0]=4 4820 B15R1.4030 COc1cc(ccc1Br)COCC(C)O 7a_100010234685_100011218427 [0,0,0,0,0,2|2,0,0]=4 4821 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)Cl 34a_100016084084_100010110085 [0,0,0,0,0,2|2,0,0]=4 4822 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)N 34a_100000737577_100010110085 [0,0,0,0,0,2|1,0,0]=3 4823 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)O 34a_100010234685_100009817552 [0,0,0,0,0,2|2,0,0]=4 4824 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)O 7a_100010234685_100009817552 [0,0,0,0,0,2|2,0,0]=4 4825 B15R1.4030 COc1cc(ccc1Br)CSCC(C)C 62a_100000210624_100010110085 [0,0,0,0,0,2|2,0,0]=4 4826 B15R1.4030 COc1cc(ccc1Br)CSCC(C)C 62a_100010110085_100000210760 [0,0,0,0,0,2|2,0,0]=4 4827 B15R1.4030 COc1cc(ccc1Br)CSCC(C)O 62a_100010110085_100011218427 [0,0,0,0,0,2|2,0,0]=4 4828 B15R1.4030 COc1cc(ccc1Br)CSCC(C)O 62a_100011218427_100010110085 [0,0,0,0,0,2|2,0,0]=4 4829 B15R1.4030 COc1cc(ccc1Br)CSC[C@@H](C)O 62a_100009817552_100010110085 [0,0,0,0,0,2|2,0,0]=4 4830 B15R1.4030 COc1cc(ccc1Br)CSC[C@@H](C)O 62a_100010110085_100009817552 [0,0,0,0,0,2|2,0,0]=4 4831 B15R1.4030 COc1cc(ccc1Br)NCCC(C)C 2230a_100000765947_100000210312 [0,0,0,0,0,2|2,0,0]=4 4832 B15R1.4030 COc1cc(ccc1Br)NCCC(C)C 34a_100000765947_100000210312 [0,0,0,0,0,2|2,0,0]=4 4833 B15R1.4030 COc1cc(ccc1Br)NCCC(C)O 2230a_100000765947_100012276601 [0,0,0,0,0,2|2,0,0]=4 4834 B15R1.4030 COc1cc(ccc1Br)NCCC(C)O 34a_100000765947_100012276601 [0,0,0,0,0,2|2,0,0]=4 4835 B15R1.4030 COc1cc(ccc1Br)NCOC(C)C 2230a_100000765947_100000709892 [0,0,0,0,0,2|2,0,0]=4 4836 B15R1.4030 COc1cc(ccc1Br)NCOC(C)C 34a_100000765947_100000709892 [0,0,0,0,0,2|2,0,0]=4 4837 B15R1.4030 COc1cc(ccc1Br)OCCC(C)C 34a_100011827694_100000210312 [0,0,0,0,0,2|2,0,0]=4 4838 B15R1.4030 COc1cc(ccc1Br)OCCC(C)C 7a_100011827694_100000210626 [0,0,0,0,0,2|2,0,0]=4 4839 B15R1.4030 COc1cc(ccc1Br)OCCC(C)O 34a_100011827694_100012276601 [0,0,0,0,0,2|2,0,0]=4 4840 B15R1.4030 COc1cc(ccc1Br)OCCC(C)O 7a_100011827694_100012276601 [0,0,0,0,0,2|2,0,0]=4 4841 B15R1.4030 COc1cc(ccc1Br)OCOC(C)C 34a_100011827694_100000709892 [0,0,0,0,0,2|2,0,0]=4 4842 B15R1.4030 COc1cc(ccc1Br)SCCC(C)C 62a_100000210312_100012353699 [0,0,0,0,0,2|2,0,0]=4 4843 B15R1.4030 COc1cc(ccc1Br)SCCC(C)C 62a_100012353699_100000210312 [0,0,0,0,0,2|2,0,0]=4 4844 B15R1.4030 COc1cc(ccc1Br)SCCC(C)O 62a_100012276601_100012353699 [0,0,0,0,0,2|2,0,0]=4 4845 B15R1.4030 COc1cc(ccc1Br)SCCC(C)O 62a_100012353699_100012276601 [0,0,0,0,0,2|2,0,0]=4 4846 B15R1.4030 COc1cc(ccc1Br)SCOC(C)C 62a_100000709892_100012353699 [0,0,0,0,0,2|2,0,0]=4 4847 B15R1.4030 COc1cc(ccc1Br)SCOC(C)C 62a_100012353699_100000709892 [0,0,0,0,0,2|2,0,0]=4 4848 B15R1.4030 COc1cc(ccc1C)C=CCC(C)C 271570a_100016259101_100011830276 [0,0,0,0,0,2|2,0,0]=4 4849 B15R1.4030 COc1cc(ccc1C)CNCC(C)C 207a_100000210953_100000719150 [0,0,0,0,0,2|2,0,0]=4 4850 B15R1.4030 COc1cc(ccc1C)CNCC(C)C 270004a_100000210953_100000719150 [0,0,0,0,0,2|2,0,0]=4 4851 B15R1.4030 COc1cc(ccc1C)CNCC(C)O 207a_100000210904_100000719150 [0,0,0,0,0,2|2,0,0]=4 4852 B15R1.4030 COc1cc(ccc1C)CNCC(C)O 270004a_100000210904_100000719150 [0,0,0,0,0,2|2,0,0]=4 4853 B15R1.4030 COc1cc(ccc1C)COCC(C)C 34a_100000752651_100000210624 [0,0,0,0,0,2|2,0,0]=4 4854 B15R1.4030 COc1cc(ccc1C)COCC(C)C 7a_100000752651_100000210760 [0,0,0,0,0,2|2,0,0]=4 4855 B15R1.4030 COc1cc(ccc1C)COCC(C)O 34a_100000752651_100011218427 [0,0,0,0,0,2|2,0,0]=4 4856 B15R1.4030 COc1cc(ccc1C)COCC(C)O 7a_100000752651_100011218427 [0,0,0,0,0,2|2,0,0]=4 4857 B15R1.4030 COc1cc(ccc1C)COC[C@@H](C)O 34a_100000752651_100009817552 [0,0,0,0,0,2|2,0,0]=4 4858 B15R1.4030 COc1cc(ccc1C)COC[C@@H](C)O 7a_100000752651_100009817552 [0,0,0,0,0,2|2,0,0]=4 4859 B15R1.4030 COc1cc(ccc1C)NCCC(C)C 2230a_100011279678_100000210312 [0,0,0,0,0,2|2,0,0]=4 4860 B15R1.4030 COc1cc(ccc1C)NCCC(C)C 34a_100011279678_100000210312 [0,0,0,0,0,2|2,0,0]=4 4861 B15R1.4030 COc1cc(ccc1C)NCCC(C)O 2230a_100011279678_100012276601 [0,0,0,0,0,2|2,0,0]=4 4862 B15R1.4030 COc1cc(ccc1C)NCCC(C)O 34a_100011279678_100012276601 [0,0,0,0,0,2|2,0,0]=4 4863 B15R1.4030 COc1cc(ccc1C)NCOC(C)C 2230a_100011279678_100000709892 [0,0,0,0,0,2|2,0,0]=4 4864 B15R1.4030 COc1cc(ccc1C)NCOC(C)C 34a_100011279678_100000709892 [0,0,0,0,0,2|2,0,0]=4 4865 B15R1.4030 COc1cc(ccc1C)OCCC(C)C 34a_100009865632_100000210312 [0,0,0,0,0,2|2,0,0]=4 4866 B15R1.4030 COc1cc(ccc1C)OCCC(C)C 7a_100009865632_100000210626 [0,0,0,0,0,2|2,0,0]=4 4867 B15R1.4030 COc1cc(ccc1C)OCCC(C)O 34a_100009865632_100012276601 [0,0,0,0,0,2|2,0,0]=4 4868 B15R1.4030 COc1cc(ccc1C)OCCC(C)O 7a_100009865632_100012276601 [0,0,0,0,0,2|2,0,0]=4 4869 B15R1.4030 COc1cc(ccc1C)OCOC(C)C 34a_100009865632_100000709892 [0,0,0,0,0,2|2,0,0]=4 4870 B15R1.4030 COc1cc(ccc1C)SCCC(C)C 62a_100000210312_100011830276 [0,0,0,0,0,2|2,0,0]=4 4871 B15R1.4030 COc1cc(ccc1C)SCCC(C)C 62a_100011830276_100000210312 [0,0,0,0,0,2|2,0,0]=4 4872 B15R1.4030 COc1cc(ccc1C)SCCC(C)O 62a_100011830276_100012276601 [0,0,0,0,0,2|2,0,0]=4 4873 B15R1.4030 COc1cc(ccc1C)SCCC(C)O 62a_100012276601_100011830276 [0,0,0,0,0,2|2,0,0]=4 4874 B15R1.4030 COc1cc(ccc1C)SCOC(C)C 62a_100000709892_100011830276 [0,0,0,0,0,2|2,0,0]=4 4875 B15R1.4030 COc1cc(ccc1C)SCOC(C)C 62a_100011830276_100000709892 [0,0,0,0,0,2|2,0,0]=4 4876 B15R1.4030 COc1cc(ccc1Cl)C=CCC(C)C 271570a_100016259101_100011356853 [0,0,0,0,0,2|2,0,0]=4 4877 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 207a_100000210953_100011998524 [0,0,0,0,0,2|2,0,0]=4 4878 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 2230a_100000210953_200010214485 [0,0,0,0,0,2|2,0,0]=4 4879 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 2230a_100015204853_100000210760 [0,0,0,0,0,2|2,0,0]=4 4880 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 26a_100000210953_100012186310 [0,0,0,0,0,2|2,0,0]=4 4881 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 270004a_100000210953_100011998524 [0,0,0,0,0,2|2,0,0]=4 4882 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 270004a_100015204853_100000210432 [0,0,0,0,0,2|2,0,0]=4 4883 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 34a_100000210953_200010214485 [0,0,0,0,0,2|2,0,0]=4 4884 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 34a_100015204853_100000210624 [0,0,0,0,0,2|2,0,0]=4 4885 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 207a_100000210904_100011998524 [0,0,0,0,0,2|2,0,0]=4 4886 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 2230a_100000210904_200010214485 [0,0,0,0,0,2|2,0,0]=4 4887 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 2230a_100015204853_100011218427 [0,0,0,0,0,2|2,0,0]=4 4888 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 270004a_100000210904_100011998524 [0,0,0,0,0,2|2,0,0]=4 4889 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 34a_100000210904_200010214485 [0,0,0,0,0,2|2,0,0]=4 4890 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 34a_100015204853_100011218427 [0,0,0,0,0,2|2,0,0]=4 4891 B15R1.4030 COc1cc(ccc1Cl)CNC[C@@H](C)O 2230a_100015204853_100009817552 [0,0,0,0,0,2|2,0,0]=4 4892 B15R1.4030 COc1cc(ccc1Cl)CNC[C@@H](C)O 34a_100015204853_100009817552 [0,0,0,0,0,2|2,0,0]=4 4893 B15R1.4030 COc1cc(ccc1Cl)COCC(C)Br 34a_100012180447_200010214485 [0,0,0,0,0,2|2,0,0]=4 4894 B15R1.4030 COc1cc(ccc1Cl)COCC(C)C 34a_100000210257_200010214485 [0,0,0,0,0,2|2,0,0]=4 4895 B15R1.4030 COc1cc(ccc1Cl)COCC(C)C 34a_100012179228_100000210624 [0,0,0,0,0,2|2,0,0]=4 4896 B15R1.4030 COc1cc(ccc1Cl)COCC(C)F 34a_100015925927_200010214485 [0,0,0,0,0,2|2,0,0]=4 4897 B15R1.4030 COc1cc(ccc1Cl)COCC(C)O 34a_100012179228_100011218427 [0,0,0,0,0,2|2,0,0]=4 4898 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)Cl 34a_100016084084_200010214485 [0,0,0,0,0,2|2,0,0]=4 4899 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)N 34a_100000737577_200010214485 [0,0,0,0,0,2|1,0,0]=3 4900 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)O 34a_100012179228_100009817552 [0,0,0,0,0,2|2,0,0]=4 4901 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)C 62a_100000210624_200010214485 [0,0,0,0,0,2|2,0,0]=4 4902 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)C 62a_200010214485_100000210760 [0,0,0,0,0,2|2,0,0]=4 4903 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)O 62a_100011218427_200010214485 [0,0,0,0,0,2|2,0,0]=4 4904 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)O 62a_200010214485_100011218427 [0,0,0,0,0,2|2,0,0]=4 4905 B15R1.4030 COc1cc(ccc1Cl)CSC[C@@H](C)O 62a_100009817552_200010214485 [0,0,0,0,0,2|2,0,0]=4 4906 B15R1.4030 COc1cc(ccc1Cl)CSC[C@@H](C)O 62a_200010214485_100009817552 [0,0,0,0,0,2|2,0,0]=4 4907 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)C 2230a_100000742311_100000210312 [0,0,0,0,0,2|2,0,0]=4 4908 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)C 34a_100000742311_100000210312 [0,0,0,0,0,2|2,0,0]=4 4909 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)O 2230a_100000742311_100012276601 [0,0,0,0,0,2|2,0,0]=4 4910 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)O 34a_100000742311_100012276601 [0,0,0,0,0,2|2,0,0]=4 4911 B15R1.4030 COc1cc(ccc1Cl)NCOC(C)C 2230a_100000742311_100000709892 [0,0,0,0,0,2|2,0,0]=4 4912 B15R1.4030 COc1cc(ccc1Cl)NCOC(C)C 34a_100000742311_100000709892 [0,0,0,0,0,2|2,0,0]=4 4913 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)C 34a_100012186310_100000210312 [0,0,0,0,0,2|2,0,0]=4 4914 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)C 7a_100012186310_100000210626 [0,0,0,0,0,2|2,0,0]=4 4915 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)O 34a_100012186310_100012276601 [0,0,0,0,0,2|2,0,0]=4 4916 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)O 7a_100012186310_100012276601 [0,0,0,0,0,2|2,0,0]=4 4917 B15R1.4030 COc1cc(ccc1Cl)OCOC(C)C 34a_100012186310_100000709892 [0,0,0,0,0,2|2,0,0]=4 4918 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)C 62a_100000210312_100011356853 [0,0,0,0,0,2|2,0,0]=4 4919 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)C 62a_100011356853_100000210312 [0,0,0,0,0,2|2,0,0]=4 4920 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)O 62a_100011356853_100012276601 [0,0,0,0,0,2|2,0,0]=4 4921 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)O 62a_100012276601_100011356853 [0,0,0,0,0,2|2,0,0]=4 4922 B15R1.4030 COc1cc(ccc1Cl)SCOC(C)C 62a_100000709892_100011356853 [0,0,0,0,0,2|2,0,0]=4 4923 B15R1.4030 COc1cc(ccc1Cl)SCOC(C)C 62a_100011356853_100000709892 [0,0,0,0,0,2|2,0,0]=4 4924 B15R1.4030 COc1cc(ccc1F)C=CCC(C)C 271570a_100016259101_100011934186 [0,0,0,0,0,2|2,0,0]=4 4925 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 207a_100000210953_100000692873 [0,0,0,0,0,2|2,0,0]=4 4926 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 2230a_100000210953_100012349856 [0,0,0,0,0,2|2,0,0]=4 4927 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 2230a_100020626639_100000210760 [0,0,0,0,0,2|2,0,0]=4 4928 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 270004a_100000210953_100000692873 [0,0,0,0,0,2|2,0,0]=4 4929 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 270004a_100020626639_100000210432 [0,0,0,0,0,2|2,0,0]=4 4930 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 34a_100000210953_100012349856 [0,0,0,0,0,2|2,0,0]=4 4931 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 34a_100020626639_100000210624 [0,0,0,0,0,2|2,0,0]=4 4932 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 207a_100000210904_100000692873 [0,0,0,0,0,2|2,0,0]=4 4933 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 2230a_100000210904_100012349856 [0,0,0,0,0,2|2,0,0]=4 4934 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 2230a_100020626639_100011218427 [0,0,0,0,0,2|2,0,0]=4 4935 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 270004a_100000210904_100000692873 [0,0,0,0,0,2|2,0,0]=4 4936 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 34a_100000210904_100012349856 [0,0,0,0,0,2|2,0,0]=4 4937 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 34a_100020626639_100011218427 [0,0,0,0,0,2|2,0,0]=4 4938 B15R1.4030 COc1cc(ccc1F)CNC[C@@H](C)O 2230a_100020626639_100009817552 [0,0,0,0,0,2|2,0,0]=4 4939 B15R1.4030 COc1cc(ccc1F)CNC[C@@H](C)O 34a_100020626639_100009817552 [0,0,0,0,0,2|2,0,0]=4 4940 B15R1.4030 COc1cc(ccc1F)COCC(C)Br 34a_100012180447_100012349856 [0,0,0,0,0,2|2,0,0]=4 4941 B15R1.4030 COc1cc(ccc1F)COCC(C)C 34a_100000210257_100012349856 [0,0,0,0,0,2|2,0,0]=4 4942 B15R1.4030 COc1cc(ccc1F)COCC(C)C 34a_100000692429_100000210624 [0,0,0,0,0,2|2,0,0]=4 4943 B15R1.4030 COc1cc(ccc1F)COCC(C)C 7a_100000692429_100000210760 [0,0,0,0,0,2|2,0,0]=4 4944 B15R1.4030 COc1cc(ccc1F)COCC(C)F 34a_100015925927_100012349856 [0,0,0,0,0,2|2,0,0]=4 4945 B15R1.4030 COc1cc(ccc1F)COCC(C)O 34a_100000692429_100011218427 [0,0,0,0,0,2|2,0,0]=4 4946 B15R1.4030 COc1cc(ccc1F)COCC(C)O 7a_100000692429_100011218427 [0,0,0,0,0,2|2,0,0]=4 4947 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)Cl 34a_100016084084_100012349856 [0,0,0,0,0,2|2,0,0]=4 4948 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)N 34a_100000737577_100012349856 [0,0,0,0,0,2|1,0,0]=3 4949 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)O 34a_100000692429_100009817552 [0,0,0,0,0,2|2,0,0]=4 4950 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)O 7a_100000692429_100009817552 [0,0,0,0,0,2|2,0,0]=4 4951 B15R1.4030 COc1cc(ccc1F)CSCC(C)C 62a_100000210624_100012349856 [0,0,0,0,0,2|2,0,0]=4 4952 B15R1.4030 COc1cc(ccc1F)CSCC(C)C 62a_100012349856_100000210760 [0,0,0,0,0,2|2,0,0]=4 4953 B15R1.4030 COc1cc(ccc1F)CSCC(C)O 62a_100011218427_100012349856 [0,0,0,0,0,2|2,0,0]=4 4954 B15R1.4030 COc1cc(ccc1F)CSCC(C)O 62a_100012349856_100011218427 [0,0,0,0,0,2|2,0,0]=4 4955 B15R1.4030 COc1cc(ccc1F)CSC[C@@H](C)O 62a_100009817552_100012349856 [0,0,0,0,0,2|2,0,0]=4 4956 B15R1.4030 COc1cc(ccc1F)CSC[C@@H](C)O 62a_100012349856_100009817552 [0,0,0,0,0,2|2,0,0]=4 4957 B15R1.4030 COc1cc(ccc1F)NCCC(C)C 2230a_100000701188_100000210312 [0,0,0,0,0,2|2,0,0]=4 4958 B15R1.4030 COc1cc(ccc1F)NCCC(C)C 34a_100000701188_100000210312 [0,0,0,0,0,2|2,0,0]=4 4959 B15R1.4030 COc1cc(ccc1F)NCCC(C)O 2230a_100000701188_100012276601 [0,0,0,0,0,2|2,0,0]=4 4960 B15R1.4030 COc1cc(ccc1F)NCCC(C)O 34a_100000701188_100012276601 [0,0,0,0,0,2|2,0,0]=4 4961 B15R1.4030 COc1cc(ccc1F)NCOC(C)C 2230a_100000701188_100000709892 [0,0,0,0,0,2|2,0,0]=4 4962 B15R1.4030 COc1cc(ccc1F)NCOC(C)C 34a_100000701188_100000709892 [0,0,0,0,0,2|2,0,0]=4 4963 B15R1.4030 COc1cc(ccc1F)OCCC(C)C 34a_100012001760_100000210312 [0,0,0,0,0,2|2,0,0]=4 4964 B15R1.4030 COc1cc(ccc1F)OCCC(C)C 7a_100012001760_100000210626 [0,0,0,0,0,2|2,0,0]=4 4965 B15R1.4030 COc1cc(ccc1F)OCCC(C)O 34a_100012001760_100012276601 [0,0,0,0,0,2|2,0,0]=4 4966 B15R1.4030 COc1cc(ccc1F)OCCC(C)O 7a_100012001760_100012276601 [0,0,0,0,0,2|2,0,0]=4 4967 B15R1.4030 COc1cc(ccc1F)OCOC(C)C 34a_100012001760_100000709892 [0,0,0,0,0,2|2,0,0]=4 4968 B15R1.4030 COc1cc(ccc1F)SCCC(C)C 62a_100000210312_100011934186 [0,0,0,0,0,2|2,0,0]=4 4969 B15R1.4030 COc1cc(ccc1F)SCCC(C)C 62a_100011934186_100000210312 [0,0,0,0,0,2|2,0,0]=4 4970 B15R1.4030 COc1cc(ccc1F)SCCC(C)O 62a_100011934186_100012276601 [0,0,0,0,0,2|2,0,0]=4 4971 B15R1.4030 COc1cc(ccc1F)SCCC(C)O 62a_100012276601_100011934186 [0,0,0,0,0,2|2,0,0]=4 4972 B15R1.4030 COc1cc(ccc1F)SCOC(C)C 62a_100000709892_100011934186 [0,0,0,0,0,2|2,0,0]=4 4973 B15R1.4030 COc1cc(ccc1F)SCOC(C)C 62a_100011934186_100000709892 [0,0,0,0,0,2|2,0,0]=4 4974 B15R1.4030 COc1cc(ccc1I)NCCC(C)C 34a_100000746945_100000210312 [0,0,0,0,0,2|2,0,0]=4 4975 B15R1.4030 COc1cc(ccc1I)NCCC(C)O 34a_100000746945_100012276601 [0,0,0,0,0,2|2,0,0]=4 4976 B15R1.4030 COc1cc(ccc1I)NCOC(C)C 34a_100000746945_100000709892 [0,0,0,0,0,2|2,0,0]=4 4977 B15R1.4030 COc1cc(ccc1N)C=CCC(C)C 271570a_100016259101_100011279103 [0,0,0,0,0,2|2,0,0]=4 4978 B15R1.4030 COc1cc(ccc1N)COCC(C)C 34a_100000087641_100000210624 [0,0,0,0,0,2|2,0,0]=4 4979 B15R1.4030 COc1cc(ccc1N)COCC(C)O 34a_100000087641_100011218427 [0,0,0,0,0,2|2,0,0]=4 4980 B15R1.4030 COc1cc(ccc1N)COC[C@@H](C)O 34a_100000087641_100009817552 [0,0,0,0,0,2|2,0,0]=4 4981 B15R1.4030 COc1cc(ccc1N)OCCC(C)C 34a_100015326901_100000210312 [0,0,0,0,0,2|2,0,0]=4 4982 B15R1.4030 COc1cc(ccc1N)OCCC(C)C 7a_100015326901_100000210626 [0,0,0,0,0,2|2,0,0]=4 4983 B15R1.4030 COc1cc(ccc1N)OCCC(C)O 34a_100015326901_100012276601 [0,0,0,0,0,2|2,0,0]=4 4984 B15R1.4030 COc1cc(ccc1N)OCCC(C)O 7a_100015326901_100012276601 [0,0,0,0,0,2|2,0,0]=4 4985 B15R1.4030 COc1cc(ccc1N)OCOC(C)C 34a_100015326901_100000709892 [0,0,0,0,0,2|2,0,0]=4 4986 B15R1.4030 COc1cc(ccc1N)SCCC(C)C 62a_100000210312_100015196925 [0,0,0,0,0,2|2,0,0]=4 4987 B15R1.4030 COc1cc(ccc1N)SCCC(C)C 62a_100011279103_100000210312 [0,0,0,0,0,2|2,0,0]=4 4988 B15R1.4030 COc1cc(ccc1N)SCCC(C)O 62a_100011279103_100012276601 [0,0,0,0,0,2|2,0,0]=4 4989 B15R1.4030 COc1cc(ccc1N)SCCC(C)O 62a_100012276601_100015196925 [0,0,0,0,0,2|2,0,0]=4 4990 B15R1.4030 COc1cc(ccc1N)SCOC(C)C 62a_100000709892_100015196925 [0,0,0,0,0,2|2,0,0]=4 4991 B15R1.4030 COc1cc(ccc1N)SCOC(C)C 62a_100011279103_100000709892 [0,0,0,0,0,2|2,0,0]=4 4992 B15R1.4030 COc1cc(ccc1O)C=CCC(C)C 271570a_100016259101_100000694246 [0,0,0,0,0,2|1,0,0]=3 4993 B15R1.4030 COc1cc(ccc1O)C=NNC(C)C 4a_100000741168_100000188322 [0,0,0,0,0,2|1,0,1]=4 4994 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 240690a_100000756042_100015343762 [0,0,0,0,0,2|1,0,1]=4 4995 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 527a_100000756042_100103153847 [0,0,0,0,0,2|1,0,1]=4 4996 B15R1.4030 COc1cc(ccc1O)CCNC(C)C 2230a_100138425928_100010741665 [0,0,0,0,0,2|1,0,0]=3 4997 B15R1.4030 COc1cc(ccc1O)CCNC(C)C 34a_100000756042_100000210206 [0,0,0,0,0,2|1,0,0]=3 4998 B15R1.4030 COc1cc(ccc1O)CCSC(C)C 62a_100000210206_100010741665 [0,0,0,0,0,2|1,0,0]=3 4999 B15R1.4030 COc1cc(ccc1O)CNCC(=O)N 34a_100000185554_100000187820 [0,0,0,0,0,2|1,0,1]=4 5000 B15R1.4030 COc1cc(ccc1O)CNCC(C)C 34a_100000185554_100000210624 [0,0,0,0,0,2|1,0,0]=3 5001 B15R1.4030 COc1cc(ccc1O)CNCC(C)O 34a_100000185554_100011218427 [0,0,0,0,0,2|1,0,0]=3 5002 B15R1.4030 COc1cc(ccc1O)CNCC(F)F 34a_100000185554_100011934356 [0,0,0,0,0,2|2,0,0]=4 5003 B15R1.4030 COc1cc(ccc1O)CNC[C@@H](C)O 34a_100000185554_100009817552 [0,0,0,0,0,2|1,0,0]=3 5004 B15R1.4030 COc1cc(ccc1O)NCC=C(C)C 34a_100000726020_100000761012 [0,0,0,0,0,2|1,0,1]=4 5005 B15R1.4030 COc1cc(ccc1O)NCCC(=O)N 34a_100000726020_100000731001 [0,0,0,0,0,2|1,0,1]=4 5006 B15R1.4030 COc1cc(ccc1O)NCCC(C)C 34a_100000726020_100000210312 [0,0,0,0,0,2|1,0,0]=3 5007 B15R1.4030 COc1cc(ccc1O)NCCC(C)O 34a_100000726020_100012276601 [0,0,0,0,0,2|1,0,0]=3 5008 B15R1.4030 COc1cc(ccc1O)NCOC(=O)C 34a_100000726020_100009813279 [0,0,0,0,0,2|1,0,1]=4 5009 B15R1.4030 COc1cc(ccc1O)NCOC(C)C 34a_100000726020_100000709892 [0,0,0,0,0,2|1,0,0]=3 5010 B15R1.4030 COc1cc(ccc1O)SCC=C(C)C 62a_100000761012_100000694246 [0,0,0,0,0,2|1,0,1]=4 5011 B15R1.4030 COc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100000694246 [0,0,0,0,0,2|1,0,1]=4 5012 B15R1.4030 COc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000694246 [0,0,0,0,0,2|1,0,1]=4 5013 B15R1.4030 COc1cc(ccc1O)SCCC(C)C 62a_100000210312_100000694246 [0,0,0,0,0,2|1,0,0]=3 5014 B15R1.4030 COc1cc(ccc1O)SCCC(C)O 62a_100012276601_100000694246 [0,0,0,0,0,2|1,0,0]=3 5015 B15R1.4030 COc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100000694246 [0,0,0,0,0,2|1,0,1]=4 5016 B15R1.4030 COc1cc(ccc1O)SCOC(C)C 62a_100000709892_100000694246 [0,0,0,0,0,2|1,0,0]=3 5017 B15R1.4030 COc1nc(ccc1Br)COC[C@@H](C)N 34a_100000737577_200010066506 [0,0,0,0,0,2|2,0,0]=4 5018 B15R1.4030 COc1nc(ccc1O)C=CCC(C)C 271570a_100016259101_100010893133 [0,0,0,0,0,2|2,0,0]=4 5019 B15R1.4030 COc1nc(ccc1O)SCCC(C)C 62a_100000210312_100010893133 [0,0,0,0,0,2|2,0,0]=4 5020 B15R1.4030 COc1nc(ccc1O)SCCC(C)O 62a_100012276601_100010893133 [0,0,0,0,0,2|2,0,0]=4 5021 B15R1.4030 COc1nc(ccc1O)SCOC(C)C 62a_100000709892_100010893133 [0,0,0,0,0,2|2,0,0]=4