0 B11R1.509 CC(C)(C)Nc1ccccc1 34a_100000106764_100000210625 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.509 CC(C)(C)Oc1cccnc1 34a_100000210849_100000210625 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.509 CC(C)(C)Oc1ccncc1 34a_100000212176_100000210625 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.509 CC(C)(C)Oc1ccnnc1 34a_100015204005_100000210625 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000211941_100000041952 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.509 CC(C)(C)Sc1ccccc1 62a_100000719477_100000211941 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.509 CC(C)(C)Sc1ccccn1 62a_100000211941_100011216584 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.509 CC(C)(C)Sc1ccccn1 62a_100011216584_100000211941 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.509 CC(C)(C)Sc1cccnc1 62a_100000210063_100000211941 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.509 CC(C)(C)Sc1cccnc1 62a_100000211941_100000210063 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.509 CC(C)(C)Sc1cccnn1 62a_100000211941_100016991348 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.509 CC(C)(C)Sc1cccnn1 62a_100016991348_100000211941 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.509 CC(C)(C)Sc1ccncc1 62a_100000211941_100000728582 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.509 CC(C)(C)Sc1ccncc1 62a_100000728582_100000211941 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.509 CC(C)(C)Sc1ccncn1 62a_100000211941_100000703185 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.509 CC(C)(C)Sc1ccncn1 62a_100000703185_100000211941 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.509 CC(C)(C)Sc1ccnnc1 62a_100000211941_100000732662 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.509 CC(C)(C)Sc1ccnnc1 62a_100000732662_100000211941 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.509 CC(C)(C)Sc1cnccn1 62a_100000211759_100000211941 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.509 CC(C)(C)Sc1cnccn1 62a_100000211941_100000211759 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.509 CC(C)(C)Sc1cncnc1 62a_100000211941_100011206942 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.509 CC(C)(C)Sc1cncnc1 62a_100011206942_100000211941 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.509 CC(C)(C)Sc1ncccn1 62a_100000211032_100000211941 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.509 CC(C)(C)Sc1ncccn1 62a_100000211941_100000211032 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.509 CC(C)(O)CN1CC=CCC1 34a_100000698166_100000764493 [0,0,0,0,0,0|1,0,3]=4 26 B11R1.509 FC(F)(F)Nc1ccccc1 34a_100000106764_200103152311 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.509 FC(F)(F)Oc1ccccc1 34a_100000210340_200103152311 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.509 FC(F)(F)Oc1ccccc1 7a_100000210340_200000243211 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.509 FC(F)(F)Sc1ccccc1 62a_100000719477_200103152311 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.509 FC(F)(F)Sc1ccccc1 62a_200000243211_100000041952 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,0,0,0,0|0,0,2]=3 32 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,0,0,0,0,0|1,0,2]=4 33 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,0,0,0,0|1,0,2]=4 34 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,0,0,0,0,0|1,0,2]=4 36 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,0|0,0,2]=3 37 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,0,0,0,0,0|1,0,2]=4 38 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,0,0,0,0,0|1,0,2]=4 39 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,0,0,0,0,0|1,0,2]=4 40 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,0,0,0,0,0|1,0,2]=4 41 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,0,0,0,0,0|1,0,2]=4 42 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,0|1,0,2]=4 44 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,0|1,0,2]=4 45 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,0|1,0,2]=4 46 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,0,0,0,0,0|1,0,0]=2 47 B10R1.18 CC(C)Nc1cccnn1 27a_100138425928_100016991348 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.18 CC(C)Nc1ccncn1 27a_100138425928_100000703185 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.18 CC(C)Nc1cnccn1 27a_100138425928_100000211759 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.18 CC(C)Nc1ncccn1 27a_100138425928_100000211032 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.18 CC(C)Oc1ccnnc1 34a_100015204005_100000210206 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.18 CC(C)Oc1cncnc1 7a_100000754086_100000210206 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.18 CC(C)Sc1ccccn1 62a_100000210206_100011216584 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.18 CC(C)Sc1ccccn1 62a_100011216584_100000210206 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.18 CC(C)Sc1cccnc1 62a_100000210063_100000210206 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.18 CC(C)Sc1cccnc1 62a_100000210206_100000210063 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.18 CC(C)Sc1cccnn1 62a_100000210206_100016991348 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.18 CC(C)Sc1cccnn1 62a_100016991348_100000210206 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.18 CC(C)Sc1ccncc1 62a_100000210206_100000728582 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.18 CC(C)Sc1ccncc1 62a_100000728582_100000210206 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.18 CC(C)Sc1ccncn1 62a_100000210206_100000703185 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.18 CC(C)Sc1ccncn1 62a_100000703185_100000210206 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.18 CC(C)Sc1ccnnc1 62a_100000210206_100000732662 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.18 CC(C)Sc1ccnnc1 62a_100000732662_100000210206 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.18 CC(C)Sc1cnccn1 62a_100000210206_100000211759 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.18 CC(C)Sc1cnccn1 62a_100000211759_100000210206 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.18 CC(C)Sc1cncnc1 62a_100000210206_100011206942 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.18 CC(C)Sc1cncnc1 62a_100011206942_100000210206 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.18 CC(C)Sc1ncccn1 62a_100000210206_100000211032 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.18 CC(C)Sc1ncccn1 62a_100000211032_100000210206 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,0,0,0,0,0|1,0,0]=2 80 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,0,0,0,0,0|1,0,0]=2 81 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,0,0,0,0,0|1,0,0]=2 82 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.18 CN(C)Cc1ccccn1 2230a_100000207498_200000210301 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.18 CN(C)Cc1ccccn1 2230a_100102631434_100000721315 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.18 CN(C)Cc1ccccn1 269982a_100000207498_200000210301 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.18 CN(C)Cc1ccccn1 269982a_100102631434_100000721315 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.18 CN(C)Cc1ccccn1 270004a_100102631434_100000209966 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.18 CN(C)Cc1cccnc1 2230a_100000184577_200000210301 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.18 CN(C)Cc1cccnc1 2230a_100102631434_100000741622 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.18 CN(C)Cc1cccnc1 269982a_100000184577_200000210301 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.18 CN(C)Cc1cccnc1 269982a_100102631434_100000733263 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.18 CN(C)Cc1cccnc1 270004a_100102631434_100000209961 [1,0,0,0,0,0|2,0,0]=3 93 B10R1.18 CN(C)Cc1cccnn1 2230a_100102631434_100016990269 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.18 CN(C)Cc1ccncc1 2230a_100000187231_200000210301 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.18 CN(C)Cc1ccncc1 2230a_100102631434_100015193705 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.18 CN(C)Cc1ccncc1 269982a_100000187231_200000210301 [1,0,0,0,0,0|2,0,0]=3 97 B10R1.18 CN(C)Cc1ccncc1 269982a_100102631434_100015193705 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.18 CN(C)Cc1ccnnc1 270004a_100102631434_100011934578 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.18 CN(C)Cc1cnccn1 2230a_100011269079_200000210301 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.18 CN(C)Cc1cnccn1 2230a_100102631434_100016995436 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.18 CN(C)Cc1cnccn1 269982a_100011269079_200000210301 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.18 CN(C)Cc1cnccn1 269982a_100102631434_100016995436 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.18 CN(C)Cc1cnccn1 270004a_100102631434_100000749867 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.18 CN(C)Cc1cncnc1 2230a_100102631434_100015196519 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.18 CN(C)Cc1cncnc1 269982a_100102631434_100016991940 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.18 CN(C)Cc1cncnc1 270004a_100102631434_100000749868 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.18 CN(C)Cc1ncccn1 2230a_100025716638_200000210301 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.18 CN(C)Cc1ncccn1 2230a_100102631434_100000703007 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.18 CN(C)Cc1ncccn1 269982a_100025716638_200000210301 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.18 CN(C)Cc1ncccn1 269982a_100102631434_100000703007 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.18 CN(C)Cc1ncccn1 270004a_100102631434_100011532527 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,0,0,0,0,0|1,0,0]=2 113 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,0,0,0,0,0|1,0,0]=2 114 B10R1.18 CN([13CH3])Cc1ccccn1 2230a_100000207498_200025704644 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.18 CN([13CH3])Cc1ccccn1 269982a_100000207498_200025704644 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.18 CN([13CH3])Cc1cccnc1 2230a_100000184577_200025704644 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.18 CN([13CH3])Cc1cccnc1 269982a_100000184577_200025704644 [1,0,0,0,0,0|2,0,0]=3 118 B10R1.18 CN([13CH3])Cc1ccncc1 2230a_100000187231_200025704644 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.18 CN([13CH3])Cc1ccncc1 269982a_100000187231_200025704644 [1,0,0,0,0,0|2,0,0]=3 120 B10R1.18 CN([13CH3])Cc1cnccn1 2230a_100011269079_200025704644 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.18 CN([13CH3])Cc1cnccn1 269982a_100011269079_200025704644 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.18 CN([13CH3])Cc1ncccn1 2230a_100025716638_200025704644 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.18 CN([13CH3])Cc1ncccn1 269982a_100025716638_200025704644 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,0,0,0,0,0|1,0,2]=4 125 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,0,0,0,0,0|1,0,2]=4 126 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,0,0,0,0,0|1,0,2]=4 127 B12R1.106 CC(C)(C)Nc1ccc(cc1)Br 34a_100000210018_100000210625 [0,1,0,0,0,0|2,0,0]=3 128 B12R1.106 CC(C)(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210625 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.106 CC(C)(C)Nc1ccc(cc1)F 34a_100000185862_100000210625 [0,1,0,0,0,0|2,0,0]=3 130 B12R1.106 CC(C)(C)Nc1ccc(cc1)I 34a_100000185761_100000210625 [0,1,0,0,0,0|2,0,0]=3 131 B12R1.106 CC(C)(C)Nc1ccc(cc1)O 34a_100000185829_100000210625 [0,1,0,0,0,0|2,0,0]=3 132 B12R1.106 CC(C)(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100000210625 [0,1,0,0,0,0|3,0,0]=4 133 B12R1.106 CC(C)(C)Oc1ccc(cc1)Br 34a_100000185759_100000210625 [0,1,0,0,0,0|2,0,0]=3 134 B12R1.106 CC(C)(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210625 [0,1,0,0,0,0|2,0,0]=3 135 B12R1.106 CC(C)(C)Oc1ccc(cc1)F 34a_100000210339_100000210625 [0,1,0,0,0,0|2,0,0]=3 136 B12R1.106 CC(C)(C)Oc1ccc(cc1)I 34a_100000212066_100000210625 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.106 CC(C)(C)Oc1ccc(cc1)N 34a_100000185829_100000210625 [0,1,0,0,0,0|2,0,0]=3 138 B12R1.106 CC(C)(C)Oc1ccc(cc1)O 271570a_203496583355_100000701926 [0,1,0,0,0,0|2,0,0]=3 139 B12R1.106 CC(C)(C)Oc1ccc(cn1)Cl 34a_100011215309_100000210625 [0,1,0,0,0,0|3,0,0]=4 140 B12R1.106 CC(C)(C)Oc1ccc(cn1)F 34a_100000742473_100000210625 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.106 CC(C)(C)Oc1ccc(cn1)N 34a_100000729260_100000210625 [0,1,0,0,0,0|3,0,0]=4 142 B12R1.106 CC(C)(C)Oc1ccc(cn1)O 271570a_203496583355_200000688780 [0,1,0,0,0,0|3,0,0]=4 143 B12R1.106 CC(C)(C)Oc1ccc(nc1)Br 34a_100000685995_100000210625 [0,1,0,0,0,0|3,0,0]=4 144 B12R1.106 CC(C)(C)Oc1ccc(nc1)Cl 34a_100000744096_100000210625 [0,1,0,0,0,0|3,0,0]=4 145 B12R1.106 CC(C)(C)Oc1ccc(nc1)F 34a_100000688820_100000210625 [0,1,0,0,0,0|3,0,0]=4 146 B12R1.106 CC(C)(C)Oc1ccc(nc1)I 34a_100000687607_100000210625 [0,1,0,0,0,0|3,0,0]=4 147 B12R1.106 CC(C)(C)Oc1ccc(nc1)N 34a_100015188713_100000210625 [0,1,0,0,0,0|3,0,0]=4 148 B12R1.106 CC(C)(C)Sc1cc[n+](cc1)[O-] 62a_100000211941_100000039755 [0,1,0,0,0,0|3,0,0]=4 149 B12R1.106 CC(C)(C)Sc1ccc(=O)[nH]c1 62a_100000211941_100000212171 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.106 CC(C)(C)Sc1ccc(=O)[nH]c1 62a_100000212171_100000211941 [0,1,0,0,0,0|3,0,0]=4 151 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000211941_100000752885 [0,1,0,0,0,0|2,0,0]=3 152 B12R1.106 CC(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000211941 [0,1,0,0,0,0|2,0,0]=3 153 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000211941_100000755918 [0,1,0,0,0,0|2,0,0]=3 154 B12R1.106 CC(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000211941 [0,1,0,0,0,0|2,0,0]=3 155 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000211941 [0,1,0,0,0,0|2,0,0]=3 156 B12R1.106 CC(C)(C)Sc1ccc(cc1)F 62a_100000211941_100000211213 [0,1,0,0,0,0|2,0,0]=3 157 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000211941 [0,1,0,0,0,0|2,0,0]=3 158 B12R1.106 CC(C)(C)Sc1ccc(cc1)N 62a_100000211941_100000185761 [0,1,0,0,0,0|2,0,0]=3 159 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 271570a_203496583355_200009816747 [0,1,0,0,0,0|2,0,0]=3 160 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 62a_100000211941_100000185759 [0,1,0,0,0,0|2,0,0]=3 161 B12R1.106 CC(C)(C)Sc1ccc(cn1)Br 62a_100000211941_100000686858 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.106 CC(C)(C)Sc1ccc(cn1)Br 62a_100000686858_100000211941 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.106 CC(C)(C)Sc1ccc(cn1)Cl 62a_100000211941_100011356976 [0,1,0,0,0,0|3,0,0]=4 164 B12R1.106 CC(C)(C)Sc1ccc(cn1)Cl 62a_100011356976_100000211941 [0,1,0,0,0,0|3,0,0]=4 165 B12R1.106 CC(C)(C)Sc1ccc(cn1)F 62a_100000211941_100000744514 [0,1,0,0,0,0|3,0,0]=4 166 B12R1.106 CC(C)(C)Sc1ccc(cn1)F 62a_100000744514_100000211941 [0,1,0,0,0,0|3,0,0]=4 167 B12R1.106 CC(C)(C)Sc1ccc(cn1)N 62a_100000211941_100000737798 [0,1,0,0,0,0|3,0,0]=4 168 B12R1.106 CC(C)(C)Sc1ccc(cn1)N 62a_100000737798_100000211941 [0,1,0,0,0,0|3,0,0]=4 169 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000211941_100000744096 [0,1,0,0,0,0|3,0,0]=4 170 B12R1.106 CC(C)(C)Sc1ccc(cn1)O 62a_100000685995_100000211941 [0,1,0,0,0,0|3,0,0]=4 171 B12R1.106 CC(C)(C)Sc1ccc(nc1)Br 62a_100000211941_100009814638 [0,1,0,0,0,0|3,0,0]=4 172 B12R1.106 CC(C)(C)Sc1ccc(nc1)Br 62a_100009814638_100000211941 [0,1,0,0,0,0|3,0,0]=4 173 B12R1.106 CC(C)(C)Sc1ccc(nc1)Cl 62a_100000034144_100000211941 [0,1,0,0,0,0|3,0,0]=4 174 B12R1.106 CC(C)(C)Sc1ccc(nc1)Cl 62a_100000211941_100000034144 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.106 CC(C)(C)Sc1ccc(nc1)F 62a_100000042367_100000211941 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.106 CC(C)(C)Sc1ccc(nc1)F 62a_100000211941_100000042367 [0,1,0,0,0,0|3,0,0]=4 177 B12R1.106 CC(C)(C)Sc1ccc(nc1)N 62a_100000187370_100000211941 [0,1,0,0,0,0|3,0,0]=4 178 B12R1.106 CC(C)(C)Sc1ccc(nc1)N 62a_100000211941_100000187370 [0,1,0,0,0,0|3,0,0]=4 179 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [0,1,0,0,0,0|2,0,0]=3 180 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [0,1,0,0,0,0|2,0,1]=4 181 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [0,1,0,0,0,0|1,1,0]=3 182 B12R1.106 C[Si](C)(C)Oc1ccc(cc1)O 271570a_203496583355_100009813852 [0,1,0,0,0,0|2,1,0]=4 183 B12R1.106 Cc1ccc(cc1)NC(C)(C)C 34a_100000124888_100000210625 [0,1,0,0,0,0|2,0,0]=3 184 B12R1.106 Cc1ccc(cc1)OC(C)(C)C 34a_100000210336_100000210625 [0,1,0,0,0,0|2,0,0]=3 185 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000186775_100000211941 [0,1,0,0,0,0|2,0,0]=3 186 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000186775 [0,1,0,0,0,0|2,0,0]=3 187 B12R1.106 Cc1ccc(cn1)OC(C)(C)C 34a_100000745506_100000210625 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.106 Cc1ccc(cn1)SC(C)(C)C 62a_100000211941_100000751577 [0,1,0,0,0,0|3,0,0]=4 189 B12R1.106 Cc1ccc(cn1)SC(C)(C)C 62a_100000751577_100000211941 [0,1,0,0,0,0|3,0,0]=4 190 B12R1.106 Cc1ccc(nc1)OC(C)(C)C 34a_100000759353_100000210625 [0,1,0,0,0,0|3,0,0]=4 191 B12R1.106 Cc1ccc(nc1)SC(C)(C)C 62a_100000211941_100000754016 [0,1,0,0,0,0|3,0,0]=4 192 B12R1.106 Cc1ccc(nc1)SC(C)(C)C 62a_100011192072_100000211941 [0,1,0,0,0,0|3,0,0]=4 193 B12R1.106 Oc1ccc(cc1)CC(F)(F)F 271570a_203496583355_100000723781 [0,1,0,0,0,0|3,0,0]=4 194 B12R1.119 CC(C)(C)Nc1cccc(c1)Br 34a_100000210019_100000210625 [0,1,0,0,0,0|2,0,0]=3 195 B12R1.119 CC(C)(C)Nc1cccc(c1)Cl 34a_100000185859_100000210625 [0,1,0,0,0,0|2,0,0]=3 196 B12R1.119 CC(C)(C)Nc1cccc(c1)F 34a_100000210047_100000210625 [0,1,0,0,0,0|2,0,0]=3 197 B12R1.119 CC(C)(C)Nc1cccc(c1)I 34a_100000211102_100000210625 [0,1,0,0,0,0|2,0,0]=3 198 B12R1.119 CC(C)(C)Nc1cccc(c1)O 34a_100000210217_100000210625 [0,1,0,0,0,0|2,0,0]=3 199 B12R1.119 CC(C)(C)Oc1cc(ccn1)O 271570a_203496583355_200010237921 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.119 CC(C)(C)Oc1cc[nH]c(=O)c1 34a_100000032262_100000210625 [0,1,0,0,0,0|3,0,0]=4 201 B12R1.119 CC(C)(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000210625 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.119 CC(C)(C)Oc1cccc(=O)[nH]1 34a_100000033347_100000210625 [0,1,0,0,0,0|3,0,0]=4 203 B12R1.119 CC(C)(C)Oc1cccc(c1)Br 34a_100000210342_100000210625 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.119 CC(C)(C)Oc1cccc(c1)Cl 34a_100000210295_100000210625 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.119 CC(C)(C)Oc1cccc(c1)F 34a_100000210426_100000210625 [0,1,0,0,0,0|2,0,0]=3 206 B12R1.119 CC(C)(C)Oc1cccc(c1)I 34a_100000211634_100000210625 [0,1,0,0,0,0|2,0,0]=3 207 B12R1.119 CC(C)(C)Oc1cccc(c1)N 34a_100000210217_100000210625 [0,1,0,0,0,0|2,0,0]=3 208 B12R1.119 CC(C)(C)Oc1cccc(c1)O 271570a_203496583355_100010078498 [0,1,0,0,0,0|2,0,0]=3 209 B12R1.119 CC(C)(C)Oc1cccc(n1)F 34a_100011432558_100000210625 [0,1,0,0,0,0|3,0,0]=4 210 B12R1.119 CC(C)(C)Oc1cccc(n1)O 271570a_203496583355_100011960237 [0,1,0,0,0,0|3,0,0]=4 211 B12R1.119 CC(C)(C)Oc1ccnc(c1)Cl 34a_100000762945_100000210625 [0,1,0,0,0,0|3,0,0]=4 212 B12R1.119 CC(C)(C)Oc1ccnc(c1)F 34a_100000732698_100000210625 [0,1,0,0,0,0|3,0,0]=4 213 B12R1.119 CC(C)(C)Oc1ccnc(c1)N 34a_100011834064_100000210625 [0,1,0,0,0,0|3,0,0]=4 214 B12R1.119 CC(C)(C)Oc1cncc(c1)Br 34a_100000754920_100000210625 [0,1,0,0,0,0|3,0,0]=4 215 B12R1.119 CC(C)(C)Oc1cncc(c1)F 34a_100011830296_100000210625 [0,1,0,0,0,0|3,0,0]=4 216 B12R1.119 CC(C)(C)Oc1cncc(c1)N 34a_100011997051_100000210625 [0,1,0,0,0,0|3,0,0]=4 217 B12R1.119 CC(C)(C)Sc1cc(=O)cc[nH]1 62a_100009817434_100000211941 [0,1,0,0,0,0|3,0,0]=4 218 B12R1.119 CC(C)(C)Sc1cc(ccn1)Cl 62a_100000211941_100010167805 [0,1,0,0,0,0|3,0,0]=4 219 B12R1.119 CC(C)(C)Sc1cc(ccn1)Cl 62a_100010167805_100000211941 [0,1,0,0,0,0|3,0,0]=4 220 B12R1.119 CC(C)(C)Sc1cc(ccn1)F 62a_100000211941_100000764206 [0,1,0,0,0,0|3,0,0]=4 221 B12R1.119 CC(C)(C)Sc1cc(ccn1)F 62a_100000764206_100000211941 [0,1,0,0,0,0|3,0,0]=4 222 B12R1.119 CC(C)(C)Sc1cc(ccn1)N 62a_100000211941_100009814236 [0,1,0,0,0,0|3,0,0]=4 223 B12R1.119 CC(C)(C)Sc1cc(ccn1)N 62a_100009814236_100000211941 [0,1,0,0,0,0|3,0,0]=4 224 B12R1.119 CC(C)(C)Sc1cc(ccn1)O 62a_100000211941_100000762945 [0,1,0,0,0,0|3,0,0]=4 225 B12R1.119 CC(C)(C)Sc1cc[nH]c(=O)c1 62a_100000211941_100009816521 [0,1,0,0,0,0|3,0,0]=4 226 B12R1.119 CC(C)(C)Sc1cc[nH]c(=O)c1 62a_100009816521_100000211941 [0,1,0,0,0,0|3,0,0]=4 227 B12R1.119 CC(C)(C)Sc1ccc[n+](c1)[O-] 62a_100000211941_100009815978 [0,1,0,0,0,0|3,0,0]=4 228 B12R1.119 CC(C)(C)Sc1cccc(=O)[nH]1 62a_100000211941_100000752884 [0,1,0,0,0,0|3,0,0]=4 229 B12R1.119 CC(C)(C)Sc1cccc(c1)Br 62a_100000211941_100000691529 [0,1,0,0,0,0|2,0,0]=3 230 B12R1.119 CC(C)(C)Sc1cccc(c1)Br 62a_100000691529_100000211941 [0,1,0,0,0,0|2,0,0]=3 231 B12R1.119 CC(C)(C)Sc1cccc(c1)Cl 62a_100000211941_100000699651 [0,1,0,0,0,0|2,0,0]=3 232 B12R1.119 CC(C)(C)Sc1cccc(c1)Cl 62a_100000699651_100000211941 [0,1,0,0,0,0|2,0,0]=3 233 B12R1.119 CC(C)(C)Sc1cccc(c1)F 62a_100000211941_100000685547 [0,1,0,0,0,0|2,0,0]=3 234 B12R1.119 CC(C)(C)Sc1cccc(c1)F 62a_100000685547_100000211941 [0,1,0,0,0,0|2,0,0]=3 235 B12R1.119 CC(C)(C)Sc1cccc(c1)N 62a_100000210019_100000211941 [0,1,0,0,0,0|2,0,0]=3 236 B12R1.119 CC(C)(C)Sc1cccc(c1)N 62a_100000211941_100000210019 [0,1,0,0,0,0|2,0,0]=3 237 B12R1.119 CC(C)(C)Sc1cccc(c1)O 62a_100000211941_100000211634 [0,1,0,0,0,0|2,0,0]=3 238 B12R1.119 CC(C)(C)Sc1cccc(c1)[S] 62a_100000211941_114929384022 [0,1,0,0,0,0|2,0,0]=3 239 B12R1.119 CC(C)(C)Sc1cccc(c1)[S] 62a_114929384022_100000211941 [0,1,0,0,0,0|2,0,0]=3 240 B12R1.119 CC(C)(C)Sc1cccc(n1)Br 62a_100000211941_100000684672 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.119 CC(C)(C)Sc1cccc(n1)Br 62a_100000684672_100000211941 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.119 CC(C)(C)Sc1cccc(n1)Cl 62a_100000051397_100000211941 [0,1,0,0,0,0|3,0,0]=4 243 B12R1.119 CC(C)(C)Sc1cccc(n1)Cl 62a_100000211941_100000051397 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.119 CC(C)(C)Sc1cccc(n1)F 62a_100000211941_100009815982 [0,1,0,0,0,0|3,0,0]=4 245 B12R1.119 CC(C)(C)Sc1cccc(n1)F 62a_100009815982_100000211941 [0,1,0,0,0,0|3,0,0]=4 246 B12R1.119 CC(C)(C)Sc1cccc(n1)N 62a_100000211941_100000740741 [0,1,0,0,0,0|3,0,0]=4 247 B12R1.119 CC(C)(C)Sc1cccc(n1)N 62a_100000740741_100000211941 [0,1,0,0,0,0|3,0,0]=4 248 B12R1.119 CC(C)(C)Sc1ccnc(c1)Br 62a_100000211941_100009814637 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.119 CC(C)(C)Sc1ccnc(c1)Br 62a_100009814637_100000211941 [0,1,0,0,0,0|3,0,0]=4 250 B12R1.119 CC(C)(C)Sc1ccnc(c1)Cl 62a_100000035001_100000211941 [0,1,0,0,0,0|3,0,0]=4 251 B12R1.119 CC(C)(C)Sc1ccnc(c1)Cl 62a_100000211941_100000035001 [0,1,0,0,0,0|3,0,0]=4 252 B12R1.119 CC(C)(C)Sc1ccnc(c1)F 62a_100000211941_100009816116 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.119 CC(C)(C)Sc1ccnc(c1)F 62a_100009816116_100000211941 [0,1,0,0,0,0|3,0,0]=4 254 B12R1.119 CC(C)(C)Sc1ccnc(c1)N 62a_100000049665_100000211941 [0,1,0,0,0,0|3,0,0]=4 255 B12R1.119 CC(C)(C)Sc1ccnc(c1)N 62a_100000211941_100000049665 [0,1,0,0,0,0|3,0,0]=4 256 B12R1.119 CC(C)(C)Sc1cncc(c1)Br 62a_100000211941_100000728054 [0,1,0,0,0,0|3,0,0]=4 257 B12R1.119 CC(C)(C)Sc1cncc(c1)Br 62a_100000728054_100000211941 [0,1,0,0,0,0|3,0,0]=4 258 B12R1.119 CC(C)(C)Sc1cncc(c1)Cl 62a_100000049639_100000211941 [0,1,0,0,0,0|3,0,0]=4 259 B12R1.119 CC(C)(C)Sc1cncc(c1)Cl 62a_100000211941_100000049639 [0,1,0,0,0,0|3,0,0]=4 260 B12R1.119 CC(C)(C)Sc1cncc(c1)F 62a_100000211941_100000744099 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.119 CC(C)(C)Sc1cncc(c1)F 62a_100000744099_100000211941 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.119 CC(C)(C)Sc1cncc(c1)N 62a_100000211941_100000687067 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.119 CC(C)(C)Sc1cncc(c1)N 62a_100000687067_100000211941 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.119 CC(C)(C)Sc1cncc(c1)O 62a_100000211941_100000754920 [0,1,0,0,0,0|3,0,0]=4 265 B12R1.119 CC(C)(C)Sc1cncc(c1)O 62a_100000754920_100000211941 [0,1,0,0,0,0|3,0,0]=4 266 B12R1.119 CC(C)(O)Cc1cccc(n1)O 271570a_203496583355_100010253926 [0,1,0,0,0,0|1,0,0]=2 267 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [0,1,0,0,0,0|2,0,1]=4 268 B12R1.119 C[Si](C)(C)Oc1cccc(c1)O 271570a_203496583355_200009816539 [0,1,0,0,0,0|2,1,0]=4 269 B12R1.119 C[n+]1cccc(c1)SC(C)(C)C 62a_100000211941_100009996589 [0,1,0,0,0,0|3,0,0]=4 270 B12R1.119 C[n+]1cccc(c1)SC(C)(C)C 62a_100009996589_100000211941 [0,1,0,0,0,0|3,0,0]=4 271 B12R1.119 Cc1cc(ccn1)OC(C)(C)C 34a_100000688365_100000210625 [0,1,0,0,0,0|3,0,0]=4 272 B12R1.119 Cc1cc(ccn1)SC(C)(C)C 62a_100000211941_100000758586 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.119 Cc1cc(ccn1)SC(C)(C)C 62a_100000758586_100000211941 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.119 Cc1cccc(c1)NC(C)(C)C 34a_100000188690_100000210625 [0,1,0,0,0,0|2,0,0]=3 275 B12R1.119 Cc1cccc(c1)OC(C)(C)C 34a_100000210337_100000210625 [0,1,0,0,0,0|2,0,0]=3 276 B12R1.119 Cc1cccc(c1)SC(C)(C)C 62a_100000211941_100011215228 [0,1,0,0,0,0|2,0,0]=3 277 B12R1.119 Cc1cccc(c1)SC(C)(C)C 62a_100011215228_100000211941 [0,1,0,0,0,0|2,0,0]=3 278 B12R1.119 Cc1cccc(n1)SC(C)(C)C 62a_100000211941_100000742759 [0,1,0,0,0,0|3,0,0]=4 279 B12R1.119 Cc1cccc(n1)SC(C)(C)C 62a_100000742759_100000211941 [0,1,0,0,0,0|3,0,0]=4 280 B12R1.119 Cc1ccnc(c1)SC(C)(C)C 62a_100000211941_100000750283 [0,1,0,0,0,0|3,0,0]=4 281 B12R1.119 Cc1ccnc(c1)SC(C)(C)C 62a_100000750283_100000211941 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.119 Cc1cncc(c1)OC(C)(C)C 34a_100011830280_100000210625 [0,1,0,0,0,0|3,0,0]=4 283 B12R1.119 Cc1cncc(c1)SC(C)(C)C 62a_100000211941_100000760492 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.119 Cc1cncc(c1)SC(C)(C)C 62a_100000760492_100000211941 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.119 Oc1cccc(c1)CC(F)(F)F 271570a_203496583355_100010231778 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.151 CC(C)(C)Nc1ccccc1Br 34a_100000210017_100000210625 [0,1,0,0,0,0|2,0,0]=3 287 B12R1.151 CC(C)(C)Nc1ccccc1Cl 34a_100000185783_100000210625 [0,1,0,0,0,0|2,0,0]=3 288 B12R1.151 CC(C)(C)Nc1ccccc1F 34a_100000210422_100000210625 [0,1,0,0,0,0|2,0,0]=3 289 B12R1.151 CC(C)(C)Nc1ccccc1I 34a_100000210053_100000210625 [0,1,0,0,0,0|2,0,0]=3 290 B12R1.151 CC(C)(C)Nc1ccccc1O 34a_100000185747_100000210625 [0,1,0,0,0,0|2,0,0]=3 291 B12R1.151 CC(C)(C)Oc1ccccc1Br 34a_100000181306_100000210625 [0,1,0,0,0,0|2,0,0]=3 292 B12R1.151 CC(C)(C)Oc1ccccc1Cl 34a_100000210172_100000210625 [0,1,0,0,0,0|2,0,0]=3 293 B12R1.151 CC(C)(C)Oc1ccccc1F 34a_100000210171_100000210625 [0,1,0,0,0,0|2,0,0]=3 294 B12R1.151 CC(C)(C)Oc1ccccc1I 34a_100000739446_100000210625 [0,1,0,0,0,0|2,0,0]=3 295 B12R1.151 CC(C)(C)Oc1ccccc1N 34a_100000185747_100000210625 [0,1,0,0,0,0|2,0,0]=3 296 B12R1.151 CC(C)(C)Oc1ccccc1O 271570a_203496583355_100010078496 [0,1,0,0,0,0|2,0,0]=3 297 B12R1.151 CC(C)(C)Oc1cccnc1Br 34a_100000744436_100000210625 [0,1,0,0,0,0|3,0,0]=4 298 B12R1.151 CC(C)(C)Oc1cccnc1Cl 34a_100000757616_100000210625 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.151 CC(C)(C)Oc1cccnc1F 34a_100000061740_100000210625 [0,1,0,0,0,0|3,0,0]=4 300 B12R1.151 CC(C)(C)Oc1cccnc1I 34a_100000034122_100000210625 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.151 CC(C)(C)Oc1cccnc1N 34a_100000211975_100000210625 [0,1,0,0,0,0|3,0,0]=4 302 B12R1.151 CC(C)(C)Oc1cccoc1=O 34a_100000077404_100000210625 [0,1,0,0,0,0|3,0,0]=4 303 B12R1.151 CC(C)(C)Oc1ccncc1Br 34a_100011996408_100000210625 [0,1,0,0,0,0|3,0,0]=4 304 B12R1.151 CC(C)(C)Oc1ccncc1Cl 34a_100011997054_100000210625 [0,1,0,0,0,0|3,0,0]=4 305 B12R1.151 CC(C)(C)Oc1ccncc1F 34a_200000081243_100000210625 [0,1,0,0,0,0|3,0,0]=4 306 B12R1.151 CC(C)(C)Oc1cnccc1Cl 34a_100011996695_100000210625 [0,1,0,0,0,0|3,0,0]=4 307 B12R1.151 CC(C)(C)Oc1cnccc1I 34a_100000050107_100000210625 [0,1,0,0,0,0|3,0,0]=4 308 B12R1.151 CC(C)(C)Oc1cnccc1N 34a_100000753702_100000210625 [0,1,0,0,0,0|3,0,0]=4 309 B12R1.151 CC(C)(C)Oc1coccc1=O 34a_100000060831_100000210625 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.151 CC(C)(C)Oc1ncccc1Cl 34a_100011290957_100000210625 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.151 CC(C)(C)Oc1ncccc1F 34a_100011219419_100000210625 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.151 CC(C)(C)Oc1ncccc1N 34a_100000746358_100000210625 [0,1,0,0,0,0|3,0,0]=4 313 B12R1.151 CC(C)(C)Oc1ncccc1O 271570a_203496583355_100011465193 [0,1,0,0,0,0|3,0,0]=4 314 B12R1.151 CC(C)(C)Sc1c[nH]ccc1=O 62a_100000211941_100009998708 [0,1,0,0,0,0|3,0,0]=4 315 B12R1.151 CC(C)(C)Sc1c[nH]ccc1=O 62a_100009998708_100000211941 [0,1,0,0,0,0|3,0,0]=4 316 B12R1.151 CC(C)(C)Sc1c[nH]ccc1=S 62a_100000211941_200012280681 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.151 CC(C)(C)Sc1c[nH]ccc1=S 62a_200012280681_100000211941 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.151 CC(C)(C)Sc1cccc[n+]1[O-] 62a_100000211941_200000042595 [0,1,0,0,0,0|3,0,0]=4 319 B12R1.151 CC(C)(C)Sc1ccccc1Br 62a_100000211941_100000695589 [0,1,0,0,0,0|2,0,0]=3 320 B12R1.151 CC(C)(C)Sc1ccccc1Br 62a_100000695589_100000211941 [0,1,0,0,0,0|2,0,0]=3 321 B12R1.151 CC(C)(C)Sc1ccccc1Cl 62a_100000211941_100000764095 [0,1,0,0,0,0|2,0,0]=3 322 B12R1.151 CC(C)(C)Sc1ccccc1Cl 62a_100000764095_100000211941 [0,1,0,0,0,0|2,0,0]=3 323 B12R1.151 CC(C)(C)Sc1ccccc1F 62a_100000211941_100011215700 [0,1,0,0,0,0|2,0,0]=3 324 B12R1.151 CC(C)(C)Sc1ccccc1F 62a_100011215700_100000211941 [0,1,0,0,0,0|2,0,0]=3 325 B12R1.151 CC(C)(C)Sc1ccccc1N 62a_100000210017_100000211941 [0,1,0,0,0,0|2,0,0]=3 326 B12R1.151 CC(C)(C)Sc1ccccc1N 62a_100000211941_100000210017 [0,1,0,0,0,0|2,0,0]=3 327 B12R1.151 CC(C)(C)Sc1ccccc1O 62a_100000211941_100000739446 [0,1,0,0,0,0|2,0,0]=3 328 B12R1.151 CC(C)(C)Sc1ccccc1O 62a_100000739446_100000211941 [0,1,0,0,0,0|2,0,0]=3 329 B12R1.151 CC(C)(C)Sc1cccnc1Br 62a_100000211941_100010202626 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.151 CC(C)(C)Sc1cccnc1Br 62a_100010202626_100000211941 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.151 CC(C)(C)Sc1cccnc1Cl 62a_100000036424_100000211941 [0,1,0,0,0,0|3,0,0]=4 332 B12R1.151 CC(C)(C)Sc1cccnc1Cl 62a_100000211941_100000036424 [0,1,0,0,0,0|3,0,0]=4 333 B12R1.151 CC(C)(C)Sc1cccnc1F 62a_100000211941_100009816115 [0,1,0,0,0,0|3,0,0]=4 334 B12R1.151 CC(C)(C)Sc1cccnc1F 62a_100009816115_100000211941 [0,1,0,0,0,0|3,0,0]=4 335 B12R1.151 CC(C)(C)Sc1cccnc1N 62a_100000045569_100000211941 [0,1,0,0,0,0|3,0,0]=4 336 B12R1.151 CC(C)(C)Sc1cccnc1N 62a_100000211941_100000045569 [0,1,0,0,0,0|3,0,0]=4 337 B12R1.151 CC(C)(C)Sc1cccnc1O 62a_100000211941_100000760158 [0,1,0,0,0,0|3,0,0]=4 338 B12R1.151 CC(C)(C)Sc1cccnc1O 62a_100000760158_100000211941 [0,1,0,0,0,0|3,0,0]=4 339 B12R1.151 CC(C)(C)Sc1ccncc1Br 62a_100000211941_100000726257 [0,1,0,0,0,0|3,0,0]=4 340 B12R1.151 CC(C)(C)Sc1ccncc1Br 62a_100000726257_100000211941 [0,1,0,0,0,0|3,0,0]=4 341 B12R1.151 CC(C)(C)Sc1ccncc1Cl 62a_100000211941_100000708259 [0,1,0,0,0,0|3,0,0]=4 342 B12R1.151 CC(C)(C)Sc1ccncc1Cl 62a_100000708259_100000211941 [0,1,0,0,0,0|3,0,0]=4 343 B12R1.151 CC(C)(C)Sc1ccncc1F 62a_100000047030_100000211941 [0,1,0,0,0,0|3,0,0]=4 344 B12R1.151 CC(C)(C)Sc1ccncc1F 62a_100000211941_100000047030 [0,1,0,0,0,0|3,0,0]=4 345 B12R1.151 CC(C)(C)Sc1ccncc1N 62a_100000211941_100000756074 [0,1,0,0,0,0|3,0,0]=4 346 B12R1.151 CC(C)(C)Sc1ccncc1N 62a_100000756074_100000211941 [0,1,0,0,0,0|3,0,0]=4 347 B12R1.151 CC(C)(C)Sc1ccncc1O 62a_100000211941_100009817591 [0,1,0,0,0,0|3,0,0]=4 348 B12R1.151 CC(C)(C)Sc1ccncc1O 62a_100009817591_100000211941 [0,1,0,0,0,0|3,0,0]=4 349 B12R1.151 CC(C)(C)Sc1cnccc1Br 62a_100000211941_100010138639 [0,1,0,0,0,0|3,0,0]=4 350 B12R1.151 CC(C)(C)Sc1cnccc1Br 62a_100010138639_100000211941 [0,1,0,0,0,0|3,0,0]=4 351 B12R1.151 CC(C)(C)Sc1cnccc1Cl 62a_100000211941_100009995489 [0,1,0,0,0,0|3,0,0]=4 352 B12R1.151 CC(C)(C)Sc1cnccc1Cl 62a_100009995489_100000211941 [0,1,0,0,0,0|3,0,0]=4 353 B12R1.151 CC(C)(C)Sc1cnccc1F 62a_100000211941_100009820683 [0,1,0,0,0,0|3,0,0]=4 354 B12R1.151 CC(C)(C)Sc1cnccc1F 62a_100009820683_100000211941 [0,1,0,0,0,0|3,0,0]=4 355 B12R1.151 CC(C)(C)Sc1cnccc1N 62a_100000047001_100000211941 [0,1,0,0,0,0|3,0,0]=4 356 B12R1.151 CC(C)(C)Sc1cnccc1N 62a_100000211941_100000047001 [0,1,0,0,0,0|3,0,0]=4 357 B12R1.151 CC(C)(C)Sc1ncccc1Br 62a_100000211941_100000696092 [0,1,0,0,0,0|3,0,0]=4 358 B12R1.151 CC(C)(C)Sc1ncccc1Br 62a_100000696092_100000211941 [0,1,0,0,0,0|3,0,0]=4 359 B12R1.151 CC(C)(C)Sc1ncccc1Cl 62a_100000211941_100011356963 [0,1,0,0,0,0|3,0,0]=4 360 B12R1.151 CC(C)(C)Sc1ncccc1Cl 62a_100011356963_100000211941 [0,1,0,0,0,0|3,0,0]=4 361 B12R1.151 CC(C)(C)Sc1ncccc1F 62a_100000211941_100000685392 [0,1,0,0,0,0|3,0,0]=4 362 B12R1.151 CC(C)(C)Sc1ncccc1F 62a_100000685392_100000211941 [0,1,0,0,0,0|3,0,0]=4 363 B12R1.151 CC(C)(C)Sc1ncccc1N 62a_100000211941_100000688686 [0,1,0,0,0,0|3,0,0]=4 364 B12R1.151 CC(C)(C)Sc1ncccc1N 62a_100000688686_100000211941 [0,1,0,0,0,0|3,0,0]=4 365 B12R1.151 CC(C)(C)Sc1ncccc1O 62a_100000034122_100000211941 [0,1,0,0,0,0|3,0,0]=4 366 B12R1.151 CC(C)(C)Sc1ncccc1O 62a_100000211941_100000034122 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.151 CC(C)(N)Cc1ccccc1O 271570a_203496583355_100161000475 [0,1,0,0,0,0|1,0,0]=2 368 B12R1.151 CS(=O)(=O)Cc1ccccc1O 271570a_203496583355_100009814642 [0,1,0,0,0,0|2,0,1]=4 369 B12R1.151 C[n+]1ccccc1SC(C)(C)C 62a_100000211941_100000212160 [0,1,0,0,0,0|3,0,0]=4 370 B12R1.151 Cc1ccccc1NC(C)(C)C 34a_100015192222_100000210625 [0,1,0,0,0,0|2,0,0]=3 371 B12R1.151 Cc1ccccc1OC(C)(C)C 34a_100000210338_100000210625 [0,1,0,0,0,0|2,0,0]=3 372 B12R1.151 Cc1ccccc1SC(C)(C)C 62a_100000210755_100000211941 [0,1,0,0,0,0|2,0,0]=3 373 B12R1.151 Cc1ccccc1SC(C)(C)C 62a_100000211941_100000210755 [0,1,0,0,0,0|2,0,0]=3 374 B12R1.151 Cc1cccnc1SC(C)(C)C 62a_100000211941_100000751373 [0,1,0,0,0,0|3,0,0]=4 375 B12R1.151 Cc1cccnc1SC(C)(C)C 62a_100000751373_100000211941 [0,1,0,0,0,0|3,0,0]=4 376 B12R1.151 Cc1ccncc1OC(C)(C)C 34a_100011997053_100000210625 [0,1,0,0,0,0|3,0,0]=4 377 B12R1.151 Cc1ccncc1SC(C)(C)C 62a_100000211941_100000761580 [0,1,0,0,0,0|3,0,0]=4 378 B12R1.151 Cc1ccncc1SC(C)(C)C 62a_100000761580_100000211941 [0,1,0,0,0,0|3,0,0]=4 379 B12R1.151 Cc1cnccc1OC(C)(C)C 34a_100000694293_100000210625 [0,1,0,0,0,0|3,0,0]=4 380 B12R1.151 Cc1cnccc1SC(C)(C)C 62a_100000211941_100000765111 [0,1,0,0,0,0|3,0,0]=4 381 B12R1.151 Cc1cnccc1SC(C)(C)C 62a_100000765111_100000211941 [0,1,0,0,0,0|3,0,0]=4 382 B12R1.151 Cc1ncccc1OC(C)(C)C 34a_100000745507_100000210625 [0,1,0,0,0,0|3,0,0]=4 383 B12R1.151 Cc1ncccc1SC(C)(C)C 62a_100000211941_100000751574 [0,1,0,0,0,0|3,0,0]=4 384 B12R1.151 Cc1ncccc1SC(C)(C)C 62a_100000751574_100000211941 [0,1,0,0,0,0|3,0,0]=4 385 B12R1.151 Oc1ccccc1CC(F)(F)F 271570a_203496583355_100010220485 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.194 C#CC(C)(C)Nc1ccccc1 34a_100000106764_100000038118 [0,1,0,0,0,0|2,0,0]=3 387 B12R1.194 C#CC(C)(C)Oc1ccccc1 34a_100000210340_100000038118 [0,1,0,0,0,0|2,0,0]=3 388 B12R1.194 C#CC(C)(C)Oc1cccnc1 34a_100000210849_100000038118 [0,1,0,0,0,0|3,0,0]=4 389 B12R1.194 C#CC(C)(C)Oc1ccncc1 34a_100000212176_100000038118 [0,1,0,0,0,0|3,0,0]=4 390 B12R1.194 C#CC(C)(C)Sc1ccccc1 62a_100000038118_100000041952 [0,1,0,0,0,0|2,0,0]=3 391 B12R1.194 C#CC(C)(C)Sc1ccccc1 62a_100000719477_100000038118 [0,1,0,0,0,0|2,0,0]=3 392 B12R1.194 C#CC(C)(C)Sc1ccccn1 62a_100000038118_100011216584 [0,1,0,0,0,0|3,0,0]=4 393 B12R1.194 C#CC(C)(C)Sc1ccccn1 62a_100011216584_100000038118 [0,1,0,0,0,0|3,0,0]=4 394 B12R1.194 C#CC(C)(C)Sc1cccnc1 62a_100000038118_100000210063 [0,1,0,0,0,0|3,0,0]=4 395 B12R1.194 C#CC(C)(C)Sc1cccnc1 62a_100000210063_100000038118 [0,1,0,0,0,0|3,0,0]=4 396 B12R1.194 C#CC(C)(C)Sc1ccncc1 62a_100000038118_100000728582 [0,1,0,0,0,0|3,0,0]=4 397 B12R1.194 C#CC(C)(C)Sc1ccncc1 62a_100000728582_100000038118 [0,1,0,0,0,0|3,0,0]=4 398 B12R1.194 CC(C)(C#N)Nc1ccccc1 34a_100000106764_100011162410 [0,1,0,0,0,0|2,0,0]=3 399 B12R1.194 CC(C)(C#N)Oc1ccccc1 34a_100000210340_100011162410 [0,1,0,0,0,0|2,0,0]=3 400 B12R1.194 CC(C)(C#N)Oc1ccccc1 7a_100000210340_100011162410 [0,1,0,0,0,0|2,0,0]=3 401 B12R1.194 CC(C)(C#N)Oc1cccnc1 34a_100000210849_100011162410 [0,1,0,0,0,0|3,0,0]=4 402 B12R1.194 CC(C)(C#N)Oc1cccnc1 7a_100000210849_100011162410 [0,1,0,0,0,0|3,0,0]=4 403 B12R1.194 CC(C)(C#N)Oc1ccncc1 34a_100000212176_100011162410 [0,1,0,0,0,0|3,0,0]=4 404 B12R1.194 CC(C)(C#N)Sc1ccccc1 62a_100000719477_100011162410 [0,1,0,0,0,0|2,0,0]=3 405 B12R1.194 CC(C)(C#N)Sc1ccccc1 62a_100011162410_100000041952 [0,1,0,0,0,0|2,0,0]=3 406 B12R1.194 CC(C)(C#N)Sc1ccccn1 62a_100011162410_100011216584 [0,1,0,0,0,0|3,0,0]=4 407 B12R1.194 CC(C)(C#N)Sc1ccccn1 62a_100011216584_100011162410 [0,1,0,0,0,0|3,0,0]=4 408 B12R1.194 CC(C)(C#N)Sc1cccnc1 62a_100000210063_100011162410 [0,1,0,0,0,0|3,0,0]=4 409 B12R1.194 CC(C)(C#N)Sc1cccnc1 62a_100011162410_100000210063 [0,1,0,0,0,0|3,0,0]=4 410 B12R1.194 CC(C)(C#N)Sc1ccncc1 62a_100000728582_100011162410 [0,1,0,0,0,0|3,0,0]=4 411 B12R1.194 CC(C)(C#N)Sc1ccncc1 62a_100011162410_100000728582 [0,1,0,0,0,0|3,0,0]=4 412 B12R1.194 CC(C)(CO)Nc1cccnn1 27a_100000210608_100016991348 [0,1,0,0,0,0|3,0,0]=4 413 B12R1.194 CC(C)(CO)Nc1ccncn1 27a_100000210608_100000703185 [0,1,0,0,0,0|3,0,0]=4 414 B12R1.194 CC(C)(CO)Nc1cnccn1 27a_100000210608_100000211759 [0,1,0,0,0,0|3,0,0]=4 415 B12R1.194 CC(C)(CO)Nc1ncccn1 27a_100000210608_100000211032 [0,1,0,0,0,0|3,0,0]=4 416 B12R1.194 CC(C)(Cc1ccccc1)O[13CH3] 7a_100011215222_200025704644 [0,1,0,0,0,0|0,0,0]=1 417 B12R1.194 CCC(C)(C)Oc1ccccc1 7a_100000210340_100000210677 [0,1,0,0,0,0|2,0,0]=3 418 B12R1.194 CCC(C)(C)Oc1cccnc1 7a_100000210849_100000210677 [0,1,0,0,0,0|3,0,0]=4 419 B12R1.194 CCC(C)(C)Sc1ccccc1 62a_100000032637_100000041952 [0,1,0,0,0,0|2,0,0]=3 420 B12R1.194 CCC(C)(C)Sc1ccccc1 62a_100000719477_100000032637 [0,1,0,0,0,0|2,0,0]=3 421 B12R1.194 CCC(C)(C)Sc1ccccn1 62a_100000032637_100011216584 [0,1,0,0,0,0|3,0,0]=4 422 B12R1.194 CCC(C)(C)Sc1ccccn1 62a_100011216584_100000032637 [0,1,0,0,0,0|3,0,0]=4 423 B12R1.194 CCC(C)(C)Sc1cccnc1 62a_100000032637_100000210063 [0,1,0,0,0,0|3,0,0]=4 424 B12R1.194 CCC(C)(C)Sc1cccnc1 62a_100000210063_100000032637 [0,1,0,0,0,0|3,0,0]=4 425 B12R1.194 CCC(C)(C)Sc1ccncc1 62a_100000032637_100000728582 [0,1,0,0,0,0|3,0,0]=4 426 B12R1.194 CCC(C)(C)Sc1ccncc1 62a_100000728582_100000032637 [0,1,0,0,0,0|3,0,0]=4 427 B12R1.194 CNC(F)(F)Oc1ccccc1 7a_106832991635_200000057402 [0,1,0,0,0,0|3,0,0]=4 428 B12R1.194 CNS(=O)(=O)Cc1ccccc1 270084a_100102657272_100000211737 [0,1,0,0,0,0|2,0,1]=4 429 B12R1.194 CNS(=O)(=O)Cc1ccccc1 274078a_100102657272_100000211737 [0,1,0,0,0,0|2,0,1]=4 430 B12R1.194 CNS(=O)(=O)Cc1ccccc1 40a_100102657272_100000235865 [0,1,0,0,0,0|2,0,1]=4 431 B12R1.194 COC(C)(C)Cc1ccccc1 7a_100011215222_200000210301 [0,1,0,0,0,0|0,0,0]=1 432 B12R1.194 CSC(F)(F)Oc1ccccc1 62a_200000057402_200000210301 [0,1,0,0,0,0|3,0,0]=4 433 B12R1.194 CSC(F)(F)Oc1ccccc1 62a_200000210301_200000057402 [0,1,0,0,0,0|3,0,0]=4 434 B12R1.194 OCC(F)(F)Sc1ccccc1 62a_100000719477_100011217949 [0,1,0,0,0,0|3,0,0]=4 435 B12R1.194 OCC(F)(F)Sc1ccccc1 62a_100011217949_100000041952 [0,1,0,0,0,0|3,0,0]=4 436 B12R1.194 [13CH3]SC(F)(F)Oc1ccccc1 62a_200000057402_200025704644 [0,1,0,0,0,0|3,0,0]=4 437 B12R1.194 [13CH3]SC(F)(F)Oc1ccccc1 62a_200025704644_200000057402 [0,1,0,0,0,0|3,0,0]=4 438 B12R1.564 CN(c1ccccc1)C(C)(C)C 269982a_100000210012_100000210625 [0,1,0,0,0,0|2,0,0]=3 439 B12R1.564 CN(c1ccccc1)C(C)(C)C 34a_100000210012_100000210625 [0,1,0,0,0,0|2,0,0]=3 440 B10R0.28 C/C=C/CC(=O)CC(C)(C)O 1458a_100000693243_100102629194 [0,0,1,0,0,0|1,0,2]=4 441 B10R0.28 C=CC=CC(=O)C[Si](C)(C)C 1458a_100016291481_100000233785 [0,0,1,0,0,0|2,1,0]=4 442 B10R0.28 C=CC=CC(=O)NC(C)(C)C 1626a_100000715429_100016291481 [0,0,1,0,0,0|3,0,0]=4 443 B10R0.28 C=CCCC(=O)CC(C)(C)O 1458a_100000693243_100000754431 [0,0,1,0,0,0|1,0,2]=4 444 B10R0.28 C=CCNC(=O)CC(C)(C)O 527a_100020586998_100000693243 [0,0,1,0,0,0|2,0,1]=4 445 B10R0.28 CC=CCC(=O)CC(C)(C)O 1458a_100000693243_100000070051 [0,0,1,0,0,0|1,0,2]=4 446 B10R1.281 CC(C)(C)Oc1ccsc1 34a_100000106738_100000210625 [0,0,0,0,1,0|3,0,0]=4 447 B10R1.281 CC(C)(C)Sc1ccco1 62a_100000211941_100009814098 [0,0,0,0,1,0|3,0,0]=4 448 B10R1.281 CC(C)(C)Sc1ccco1 62a_100009814098_100000211941 [0,0,0,0,1,0|3,0,0]=4 449 B10R1.281 CC(C)(C)Sc1cccs1 62a_100000211941_100011215356 [0,0,0,0,1,0|3,0,0]=4 450 B10R1.281 CC(C)(C)Sc1cccs1 62a_100011215356_100000211941 [0,0,0,0,1,0|3,0,0]=4 451 B10R1.281 CC(C)(C)Sc1ccoc1 62a_100000211941_100011215275 [0,0,0,0,1,0|3,0,0]=4 452 B10R1.281 CC(C)(C)Sc1ccoc1 62a_100011215275_100000211941 [0,0,0,0,1,0|3,0,0]=4 453 B10R1.281 CC(C)(C)Sc1ccsc1 62a_100000211941_100000738268 [0,0,0,0,1,0|3,0,0]=4 454 B10R1.281 CC(C)(C)Sc1ccsc1 62a_100000738268_100000211941 [0,0,0,0,1,0|3,0,0]=4 455 B12R1.891 CC(C)(C)C=Cc1ccccc1 271570a_100102527731_100000210277 [0,0,0,0,0,1|1,0,1]=3 456 B12R1.891 CC(C)(C)C=Cc1ccccn1 271570a_100102527731_100011216584 [0,0,0,0,0,1|2,0,1]=4 457 B12R1.891 CC(C)(C)C=Cc1cccnc1 271570a_100102527731_100000752921 [0,0,0,0,0,1|2,0,1]=4 458 B12R1.891 CC(C)(C)C=Cc1ccncc1 271570a_100102527731_100000035832 [0,0,0,0,0,1|2,0,1]=4 459 B12R1.891 CC(C)(C)CNc1ccccc1 34a_100000106764_100011219605 [0,0,0,0,0,1|1,0,0]=2 460 B12R1.891 CC(C)(C)CNc1cccnn1 27a_100000743828_100016991348 [0,0,0,0,0,1|3,0,0]=4 461 B12R1.891 CC(C)(C)CNc1ccncn1 27a_100000743828_100000703185 [0,0,0,0,0,1|3,0,0]=4 462 B12R1.891 CC(C)(C)CNc1cnccn1 27a_100000743828_100000211759 [0,0,0,0,0,1|3,0,0]=4 463 B12R1.891 CC(C)(C)CNc1ncccn1 27a_100000743828_100000211032 [0,0,0,0,0,1|3,0,0]=4 464 B12R1.891 CC(C)(C)COc1ccccc1 34a_100000210340_100011219605 [0,0,0,0,0,1|1,0,0]=2 465 B12R1.891 CC(C)(C)COc1cccnc1 34a_100000210849_100011219605 [0,0,0,0,0,1|2,0,0]=3 466 B12R1.891 CC(C)(C)COc1ccncc1 34a_100000212176_100011219605 [0,0,0,0,0,1|2,0,0]=3 467 B12R1.891 CC(C)(C)COc1ccnnc1 34a_100015204005_100011219605 [0,0,0,0,0,1|3,0,0]=4 468 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100000719477_100011219605 [0,0,0,0,0,1|1,0,0]=2 469 B12R1.891 CC(C)(C)CSc1ccccc1 62a_100011219605_100000041952 [0,0,0,0,0,1|1,0,0]=2 470 B12R1.891 CC(C)(C)CSc1ccccn1 62a_100011216584_100011219605 [0,0,0,0,0,1|2,0,0]=3 471 B12R1.891 CC(C)(C)CSc1ccccn1 62a_100011219605_100011216584 [0,0,0,0,0,1|2,0,0]=3 472 B12R1.891 CC(C)(C)CSc1cccnc1 62a_100000210063_100011219605 [0,0,0,0,0,1|2,0,0]=3 473 B12R1.891 CC(C)(C)CSc1cccnc1 62a_100011219605_100000210063 [0,0,0,0,0,1|2,0,0]=3 474 B12R1.891 CC(C)(C)CSc1cccnn1 62a_100011219605_100016991348 [0,0,0,0,0,1|3,0,0]=4 475 B12R1.891 CC(C)(C)CSc1cccnn1 62a_100016991348_100011219605 [0,0,0,0,0,1|3,0,0]=4 476 B12R1.891 CC(C)(C)CSc1ccncc1 62a_100000728582_100011219605 [0,0,0,0,0,1|2,0,0]=3 477 B12R1.891 CC(C)(C)CSc1ccncc1 62a_100011219605_100000728582 [0,0,0,0,0,1|2,0,0]=3 478 B12R1.891 CC(C)(C)CSc1ccncn1 62a_100000703185_100011219605 [0,0,0,0,0,1|3,0,0]=4 479 B12R1.891 CC(C)(C)CSc1ccncn1 62a_100011219605_100000703185 [0,0,0,0,0,1|3,0,0]=4 480 B12R1.891 CC(C)(C)CSc1ccnnc1 62a_100000732662_100011219605 [0,0,0,0,0,1|3,0,0]=4 481 B12R1.891 CC(C)(C)CSc1ccnnc1 62a_100011219605_100000732662 [0,0,0,0,0,1|3,0,0]=4 482 B12R1.891 CC(C)(C)CSc1cnccn1 62a_100000211759_100011219605 [0,0,0,0,0,1|3,0,0]=4 483 B12R1.891 CC(C)(C)CSc1cnccn1 62a_100011219605_100000211759 [0,0,0,0,0,1|3,0,0]=4 484 B12R1.891 CC(C)(C)CSc1cncnc1 62a_100011206942_100011219605 [0,0,0,0,0,1|3,0,0]=4 485 B12R1.891 CC(C)(C)CSc1cncnc1 62a_100011219605_100011206942 [0,0,0,0,0,1|3,0,0]=4 486 B12R1.891 CC(C)(C)CSc1ncccn1 62a_100000211032_100011219605 [0,0,0,0,0,1|3,0,0]=4 487 B12R1.891 CC(C)(C)CSc1ncccn1 62a_100011219605_100000211032 [0,0,0,0,0,1|3,0,0]=4 488 B12R1.891 CC(C)(C)NCc1ccccc1 207a_100000715429_100015611070 [0,0,0,0,0,1|1,0,0]=2 489 B12R1.891 CC(C)(C)NCc1ccccc1 2230a_100000715429_100015291786 [0,0,0,0,0,1|1,0,0]=2 490 B12R1.891 CC(C)(C)NCc1ccccc1 34a_100015324214_100000210625 [0,0,0,0,0,1|1,0,0]=2 491 B12R1.891 CC(C)(C)NCc1ccccn1 207a_100000715429_100000209966 [0,0,0,0,0,1|2,0,0]=3 492 B12R1.891 CC(C)(C)NCc1ccccn1 2230a_100000715429_100000721315 [0,0,0,0,0,1|2,0,0]=3 493 B12R1.891 CC(C)(C)NCc1cccnc1 207a_100000715429_100000209961 [0,0,0,0,0,1|2,0,0]=3 494 B12R1.891 CC(C)(C)NCc1cccnc1 2230a_100000715429_100000741622 [0,0,0,0,0,1|2,0,0]=3 495 B12R1.891 CC(C)(C)NCc1cccnn1 2230a_100000715429_100016990269 [0,0,0,0,0,1|3,0,0]=4 496 B12R1.891 CC(C)(C)NCc1ccncc1 207a_100000715429_100000186114 [0,0,0,0,0,1|2,0,0]=3 497 B12R1.891 CC(C)(C)NCc1ccncc1 2230a_100000715429_100015193705 [0,0,0,0,0,1|2,0,0]=3 498 B12R1.891 CC(C)(C)NCc1cnccn1 2230a_100000715429_100016995436 [0,0,0,0,0,1|3,0,0]=4 499 B12R1.891 CC(C)(C)NCc1cncnc1 2230a_100000715429_100015196519 [0,0,0,0,0,1|3,0,0]=4 500 B12R1.891 CC(C)(C)NCc1ncccn1 2230a_100000715429_100000703007 [0,0,0,0,0,1|3,0,0]=4 501 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100000210790_100000210625 [0,0,0,0,0,1|1,0,0]=2 502 B12R1.891 CC(C)(C)OCc1ccccc1 34a_100015890283_100015291786 [0,0,0,0,0,1|1,0,0]=2 503 B12R1.891 CC(C)(C)OCc1ccccc1 7a_100015890283_100000211182 [0,0,0,0,0,1|1,0,0]=2 504 B12R1.891 CC(C)(C)OCc1ccccn1 34a_100015890283_100000721315 [0,0,0,0,0,1|2,0,0]=3 505 B12R1.891 CC(C)(C)OCc1ccccn1 7a_100015890283_100000721315 [0,0,0,0,0,1|2,0,0]=3 506 B12R1.891 CC(C)(C)OCc1cccnc1 34a_100015890283_100000733263 [0,0,0,0,0,1|2,0,0]=3 507 B12R1.891 CC(C)(C)OCc1cccnc1 7a_100015890283_100000741622 [0,0,0,0,0,1|2,0,0]=3 508 B12R1.891 CC(C)(C)OCc1cccnn1 34a_100015890283_100016990269 [0,0,0,0,0,1|3,0,0]=4 509 B12R1.891 CC(C)(C)OCc1cccnn1 7a_100015890283_100016990269 [0,0,0,0,0,1|3,0,0]=4 510 B12R1.891 CC(C)(C)OCc1ccncc1 7a_100015890283_100015193705 [0,0,0,0,0,1|2,0,0]=3 511 B12R1.891 CC(C)(C)OCc1cnccn1 34a_100015890283_100016995436 [0,0,0,0,0,1|3,0,0]=4 512 B12R1.891 CC(C)(C)OCc1cnccn1 7a_100015890283_100016995436 [0,0,0,0,0,1|3,0,0]=4 513 B12R1.891 CC(C)(C)OCc1cncnc1 34a_100015890283_100015196519 [0,0,0,0,0,1|3,0,0]=4 514 B12R1.891 CC(C)(C)OCc1cncnc1 7a_100015890283_100015196519 [0,0,0,0,0,1|3,0,0]=4 515 B12R1.891 CC(C)(C)OCc1ncccn1 34a_100015890283_100000703007 [0,0,0,0,0,1|3,0,0]=4 516 B12R1.891 CC(C)(C)OCc1ncccn1 7a_100015890283_100000703007 [0,0,0,0,0,1|3,0,0]=4 517 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211182_100000211941 [0,0,0,0,0,1|1,0,0]=2 518 B12R1.891 CC(C)(C)SCc1ccccc1 62a_100000211941_100015291786 [0,0,0,0,0,1|1,0,0]=2 519 B12R1.891 CC(C)(C)SCc1ccccn1 62a_100000211941_100000721315 [0,0,0,0,0,1|2,0,0]=3 520 B12R1.891 CC(C)(C)SCc1ccccn1 62a_100000721315_100000211941 [0,0,0,0,0,1|2,0,0]=3 521 B12R1.891 CC(C)(C)SCc1cccnc1 62a_100000211941_100000741622 [0,0,0,0,0,1|2,0,0]=3 522 B12R1.891 CC(C)(C)SCc1cccnc1 62a_100000741622_100000211941 [0,0,0,0,0,1|2,0,0]=3 523 B12R1.891 CC(C)(C)SCc1cccnn1 62a_100000211941_100016990269 [0,0,0,0,0,1|3,0,0]=4 524 B12R1.891 CC(C)(C)SCc1cccnn1 62a_100016990269_100000211941 [0,0,0,0,0,1|3,0,0]=4 525 B12R1.891 CC(C)(C)SCc1ccncc1 62a_100000211941_100015193705 [0,0,0,0,0,1|2,0,0]=3 526 B12R1.891 CC(C)(C)SCc1ccncc1 62a_100015193705_100000211941 [0,0,0,0,0,1|2,0,0]=3 527 B12R1.891 CC(C)(C)SCc1cnccn1 62a_100000211941_100016995436 [0,0,0,0,0,1|3,0,0]=4 528 B12R1.891 CC(C)(C)SCc1cnccn1 62a_100016995436_100000211941 [0,0,0,0,0,1|3,0,0]=4 529 B12R1.891 CC(C)(C)SCc1cncnc1 62a_100000211941_100015196519 [0,0,0,0,0,1|3,0,0]=4 530 B12R1.891 CC(C)(C)SCc1cncnc1 62a_100015196519_100000211941 [0,0,0,0,0,1|3,0,0]=4 531 B12R1.891 CC(C)(C)SCc1ncccn1 62a_100000211941_100000703007 [0,0,0,0,0,1|3,0,0]=4 532 B12R1.891 CC(C)(C)SCc1ncccn1 62a_100000703007_100000211941 [0,0,0,0,0,1|3,0,0]=4 533 B12R1.891 CC(C)(F)CNc1ccccc1 34a_100000106764_100011997219 [0,0,0,0,0,1|1,0,0]=2 534 B12R1.891 CC(C)(F)CNc1cccnn1 27a_100020643315_100016991348 [0,0,0,0,0,1|3,0,0]=4 535 B12R1.891 CC(C)(F)CNc1ccncn1 27a_100020643315_100000703185 [0,0,0,0,0,1|3,0,0]=4 536 B12R1.891 CC(C)(F)CNc1cnccn1 27a_100020643315_100000211759 [0,0,0,0,0,1|3,0,0]=4 537 B12R1.891 CC(C)(F)CNc1ncccn1 27a_100020643315_100000211032 [0,0,0,0,0,1|3,0,0]=4 538 B12R1.891 CC(C)(F)COc1ccccc1 34a_100000210340_100011997219 [0,0,0,0,0,1|1,0,0]=2 539 B12R1.891 CC(C)(F)COc1cccnc1 34a_100000210849_100011997219 [0,0,0,0,0,1|2,0,0]=3 540 B12R1.891 CC(C)(F)COc1ccncc1 34a_100000212176_100011997219 [0,0,0,0,0,1|2,0,0]=3 541 B12R1.891 CC(C)(F)COc1ccnnc1 34a_100015204005_100011997219 [0,0,0,0,0,1|3,0,0]=4 542 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100000719477_100011997219 [0,0,0,0,0,1|1,0,0]=2 543 B12R1.891 CC(C)(F)CSc1ccccc1 62a_100011997219_100000041952 [0,0,0,0,0,1|1,0,0]=2 544 B12R1.891 CC(C)(F)CSc1ccccn1 62a_100011216584_100011997219 [0,0,0,0,0,1|2,0,0]=3 545 B12R1.891 CC(C)(F)CSc1ccccn1 62a_100011997219_100011216584 [0,0,0,0,0,1|2,0,0]=3 546 B12R1.891 CC(C)(F)CSc1cccnc1 62a_100000210063_100011997219 [0,0,0,0,0,1|2,0,0]=3 547 B12R1.891 CC(C)(F)CSc1cccnc1 62a_100011997219_100000210063 [0,0,0,0,0,1|2,0,0]=3 548 B12R1.891 CC(C)(F)CSc1cccnn1 62a_100011997219_100016991348 [0,0,0,0,0,1|3,0,0]=4 549 B12R1.891 CC(C)(F)CSc1cccnn1 62a_100016991348_100011997219 [0,0,0,0,0,1|3,0,0]=4 550 B12R1.891 CC(C)(F)CSc1ccncc1 62a_100000728582_100011997219 [0,0,0,0,0,1|2,0,0]=3 551 B12R1.891 CC(C)(F)CSc1ccncc1 62a_100011997219_100000728582 [0,0,0,0,0,1|2,0,0]=3 552 B12R1.891 CC(C)(F)CSc1ccncn1 62a_100000703185_100011997219 [0,0,0,0,0,1|3,0,0]=4 553 B12R1.891 CC(C)(F)CSc1ccncn1 62a_100011997219_100000703185 [0,0,0,0,0,1|3,0,0]=4 554 B12R1.891 CC(C)(F)CSc1ccnnc1 62a_100000732662_100011997219 [0,0,0,0,0,1|3,0,0]=4 555 B12R1.891 CC(C)(F)CSc1ccnnc1 62a_100011997219_100000732662 [0,0,0,0,0,1|3,0,0]=4 556 B12R1.891 CC(C)(F)CSc1cnccn1 62a_100000211759_100011997219 [0,0,0,0,0,1|3,0,0]=4 557 B12R1.891 CC(C)(F)CSc1cnccn1 62a_100011997219_100000211759 [0,0,0,0,0,1|3,0,0]=4 558 B12R1.891 CC(C)(F)CSc1cncnc1 62a_100011206942_100011997219 [0,0,0,0,0,1|3,0,0]=4 559 B12R1.891 CC(C)(F)CSc1cncnc1 62a_100011997219_100011206942 [0,0,0,0,0,1|3,0,0]=4 560 B12R1.891 CC(C)(F)CSc1ncccn1 62a_100000211032_100011997219 [0,0,0,0,0,1|3,0,0]=4 561 B12R1.891 CC(C)(F)CSc1ncccn1 62a_100011997219_100000211032 [0,0,0,0,0,1|3,0,0]=4 562 B12R1.891 CC(C)(O)C=Cc1ccccc1 271570a_200016258132_100000210277 [0,0,0,0,0,1|0,0,1]=2 563 B12R1.891 CC(C)(O)C=Cc1ccccn1 271570a_200016258132_100011216584 [0,0,0,0,0,1|1,0,1]=3 564 B12R1.891 CC(C)(O)C=Cc1cccnc1 271570a_200016258132_100000752921 [0,0,0,0,0,1|1,0,1]=3 565 B12R1.891 CC(C)(O)C=Cc1cccnn1 271570a_200016258132_100016991348 [0,0,0,0,0,1|2,0,1]=4 566 B12R1.891 CC(C)(O)C=Cc1ccncc1 271570a_200016258132_100000035832 [0,0,0,0,0,1|1,0,1]=3 567 B12R1.891 CC(C)(O)C=Cc1ccncn1 271570a_200016258132_100000703185 [0,0,0,0,0,1|2,0,1]=4 568 B12R1.891 CC(C)(O)C=Cc1ccnnc1 271570a_200016258132_100000732662 [0,0,0,0,0,1|2,0,1]=4 569 B12R1.891 CC(C)(O)C=Cc1cnccn1 271570a_200016258132_100000758340 [0,0,0,0,0,1|2,0,1]=4 570 B12R1.891 CC(C)(O)C=Cc1cncnc1 271570a_200016258132_100011206942 [0,0,0,0,0,1|2,0,1]=4 571 B12R1.891 CC(C)(O)C=Cc1ncccn1 271570a_200016258132_100000211032 [0,0,0,0,0,1|2,0,1]=4 572 B12R1.891 CC(C)(O)CNc1ccccc1 34a_100000106764_100000764493 [0,0,0,0,0,1|0,0,0]=1 573 B12R1.891 CC(C)(O)CNc1cccnn1 27a_100000751335_100016991348 [0,0,0,0,0,1|2,0,0]=3 574 B12R1.891 CC(C)(O)CNc1ccncn1 27a_100000751335_100000703185 [0,0,0,0,0,1|2,0,0]=3 575 B12R1.891 CC(C)(O)CNc1cnccn1 27a_100000751335_100000211759 [0,0,0,0,0,1|2,0,0]=3 576 B12R1.891 CC(C)(O)CNc1ncccn1 27a_100000751335_100000211032 [0,0,0,0,0,1|2,0,0]=3 577 B12R1.891 CC(C)(O)COc1ccccc1 34a_100000210340_100000764493 [0,0,0,0,0,1|0,0,0]=1 578 B12R1.891 CC(C)(O)COc1ccccc1 7a_100000210340_100000764493 [0,0,0,0,0,1|0,0,0]=1 579 B12R1.891 CC(C)(O)COc1cccnc1 34a_100000210849_100000764493 [0,0,0,0,0,1|1,0,0]=2 580 B12R1.891 CC(C)(O)COc1cccnc1 7a_100000210849_100000764493 [0,0,0,0,0,1|1,0,0]=2 581 B12R1.891 CC(C)(O)COc1ccncc1 34a_100000212176_100000764493 [0,0,0,0,0,1|1,0,0]=2 582 B12R1.891 CC(C)(O)COc1ccnnc1 34a_100015204005_100000764493 [0,0,0,0,0,1|2,0,0]=3 583 B12R1.891 CC(C)(O)COc1cncnc1 7a_100000754086_100000764493 [0,0,0,0,0,1|2,0,0]=3 584 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000719477_100000764493 [0,0,0,0,0,1|0,0,0]=1 585 B12R1.891 CC(C)(O)CSc1ccccc1 62a_100000764493_100000041952 [0,0,0,0,0,1|0,0,0]=1 586 B12R1.891 CC(C)(O)CSc1ccccn1 62a_100000764493_100011216584 [0,0,0,0,0,1|1,0,0]=2 587 B12R1.891 CC(C)(O)CSc1ccccn1 62a_100011216584_100000764493 [0,0,0,0,0,1|1,0,0]=2 588 B12R1.891 CC(C)(O)CSc1cccnc1 62a_100000210063_100000764493 [0,0,0,0,0,1|1,0,0]=2 589 B12R1.891 CC(C)(O)CSc1cccnc1 62a_100000764493_100000210063 [0,0,0,0,0,1|1,0,0]=2 590 B12R1.891 CC(C)(O)CSc1cccnn1 62a_100000764493_100016991348 [0,0,0,0,0,1|2,0,0]=3 591 B12R1.891 CC(C)(O)CSc1cccnn1 62a_100016991348_100000764493 [0,0,0,0,0,1|2,0,0]=3 592 B12R1.891 CC(C)(O)CSc1ccncc1 62a_100000728582_100000764493 [0,0,0,0,0,1|1,0,0]=2 593 B12R1.891 CC(C)(O)CSc1ccncc1 62a_100000764493_100000728582 [0,0,0,0,0,1|1,0,0]=2 594 B12R1.891 CC(C)(O)CSc1ccncn1 62a_100000703185_100000764493 [0,0,0,0,0,1|2,0,0]=3 595 B12R1.891 CC(C)(O)CSc1ccncn1 62a_100000764493_100000703185 [0,0,0,0,0,1|2,0,0]=3 596 B12R1.891 CC(C)(O)CSc1ccnnc1 62a_100000732662_100000764493 [0,0,0,0,0,1|2,0,0]=3 597 B12R1.891 CC(C)(O)CSc1ccnnc1 62a_100000764493_100000732662 [0,0,0,0,0,1|2,0,0]=3 598 B12R1.891 CC(C)(O)CSc1cnccn1 62a_100000211759_100000764493 [0,0,0,0,0,1|2,0,0]=3 599 B12R1.891 CC(C)(O)CSc1cnccn1 62a_100000764493_100000211759 [0,0,0,0,0,1|2,0,0]=3 600 B12R1.891 CC(C)(O)CSc1cncnc1 62a_100000764493_100011206942 [0,0,0,0,0,1|2,0,0]=3 601 B12R1.891 CC(C)(O)CSc1cncnc1 62a_100011206942_100000764493 [0,0,0,0,0,1|2,0,0]=3 602 B12R1.891 CC(C)(O)CSc1cnnnc1 62a_100000764493_100009846058 [0,0,0,0,0,1|3,0,0]=4 603 B12R1.891 CC(C)(O)CSc1cnnnc1 62a_100009846058_100000764493 [0,0,0,0,0,1|3,0,0]=4 604 B12R1.891 CC(C)(O)CSc1ncccn1 62a_100000211032_100000764493 [0,0,0,0,0,1|2,0,0]=3 605 B12R1.891 CC(C)(O)CSc1ncccn1 62a_100000764493_100000211032 [0,0,0,0,0,1|2,0,0]=3 606 B12R1.891 CS(=O)(=O)NCc1ccccc1 40a_100015324214_100000738038 [0,0,0,0,0,1|2,0,1]=4 607 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_100000719477_200000036245 [0,0,0,0,0,1|2,0,0]=3 608 B12R1.891 C[N+](C)(C)CSc1ccccc1 62a_200000036245_100000041952 [0,0,0,0,0,1|2,0,0]=3 609 B12R1.891 C[N+](C)(C)CSc1ccccn1 62a_100011216584_200000036245 [0,0,0,0,0,1|3,0,0]=4 610 B12R1.891 C[N+](C)(C)CSc1ccccn1 62a_200000036245_100011216584 [0,0,0,0,0,1|3,0,0]=4 611 B12R1.891 C[N+](C)(C)CSc1cccnc1 62a_100000210063_200000036245 [0,0,0,0,0,1|3,0,0]=4 612 B12R1.891 C[N+](C)(C)CSc1cccnc1 62a_200000036245_100000210063 [0,0,0,0,0,1|3,0,0]=4 613 B12R1.891 C[N+](C)(C)CSc1ccncc1 62a_100000728582_200000036245 [0,0,0,0,0,1|3,0,0]=4 614 B12R1.891 C[N+](C)(C)CSc1ccncc1 62a_200000036245_100000728582 [0,0,0,0,0,1|3,0,0]=4 615 B12R1.891 C[Si](C)(C)C#Cc1ccccc1 271570a_100010171944_100000210277 [0,0,0,0,0,1|1,1,1]=4 616 B12R1.891 C[Si](C)(C)COc1ccccc1 7a_100000210340_100000233785 [0,0,0,0,0,1|1,1,0]=3 617 B12R1.891 C[Si](C)(C)COc1cccnc1 7a_100000210849_100000233785 [0,0,0,0,0,1|2,1,0]=4 618 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000037933_100000041952 [0,0,0,0,0,1|1,1,0]=3 619 B12R1.891 C[Si](C)(C)CSc1ccccc1 62a_100000719477_100000037933 [0,0,0,0,0,1|1,1,0]=3 620 B12R1.891 C[Si](C)(C)CSc1ccccn1 62a_100000037933_100011216584 [0,0,0,0,0,1|2,1,0]=4 621 B12R1.891 C[Si](C)(C)CSc1ccccn1 62a_100011216584_100000037933 [0,0,0,0,0,1|2,1,0]=4 622 B12R1.891 C[Si](C)(C)CSc1cccnc1 62a_100000037933_100000210063 [0,0,0,0,0,1|2,1,0]=4 623 B12R1.891 C[Si](C)(C)CSc1cccnc1 62a_100000210063_100000037933 [0,0,0,0,0,1|2,1,0]=4 624 B12R1.891 C[Si](C)(C)CSc1ccncc1 62a_100000037933_100000728582 [0,0,0,0,0,1|2,1,0]=4 625 B12R1.891 C[Si](C)(C)CSc1ccncc1 62a_100000728582_100000037933 [0,0,0,0,0,1|2,1,0]=4 626 B12R1.891 FC(F)(F)CSc1ccccc1 62a_100000719477_100000763148 [0,0,0,0,0,1|3,0,0]=4 627 B12R1.891 FC(F)(F)CSc1ccccc1 62a_100000763148_100000041952 [0,0,0,0,0,1|3,0,0]=4 628 B12R1.891 FC(F)(F)NCc1ccccc1 34a_100015324214_200103152311 [0,0,0,0,0,1|3,0,0]=4 629 B12R1.891 FC(F)(F)OCc1ccccc1 34a_100000210790_200103152311 [0,0,0,0,0,1|3,0,0]=4 630 B12R1.891 FC(F)(F)OCc1ccccc1 7a_100000210790_200000243211 [0,0,0,0,0,1|3,0,0]=4 631 B12R1.891 FC(F)(F)SCc1ccccc1 62a_100000211182_200103152311 [0,0,0,0,0,1|3,0,0]=4 632 B12R1.891 FC(F)(F)SCc1ccccc1 62a_200000243211_100015291786 [0,0,0,0,0,1|3,0,0]=4 633 B9R0.44 C=CCC(=O)CC(C)(C)O 1458a_100000693243_100000210623 [1,0,1,0,0,0|1,0,1]=4 634 B9R0.4 C=CC=CC(=O)CC(C)C 1458a_100016291481_100000210624 [1,0,1,0,0,0|1,0,0]=3 635 B9R0.4 C=CC=CC(=O)CC(C)O 1458a_100016291481_100011218427 [1,0,1,0,0,0|1,0,0]=3 636 B9R0.4 C=CC=CC(=O)NC(C)C 1626a_100138425928_100016291481 [1,0,1,0,0,0|2,0,0]=4 637 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [2,0,0,0,0,0|0,0,2]=4 638 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [2,0,0,0,0,0|1,0,0]=3 639 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|1,0,0]=3 640 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|1,0,0]=3 641 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [2,0,0,0,0,0|2,0,0]=4 642 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [2,0,0,0,0,0|2,0,0]=4 643 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [2,0,0,0,0,0|2,0,0]=4 644 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [2,0,0,0,0,0|1,0,0]=3 645 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [2,0,0,0,0,0|1,0,0]=3 646 B9R1.8 CCSc1ccccn1 62a_100000210202_100011216584 [2,0,0,0,0,0|2,0,0]=4 647 B9R1.8 CCSc1ccccn1 62a_100011216584_100000210202 [2,0,0,0,0,0|2,0,0]=4 648 B9R1.8 CCSc1cccnc1 62a_100000210063_100000210202 [2,0,0,0,0,0|2,0,0]=4 649 B9R1.8 CCSc1cccnc1 62a_100000210202_100000210063 [2,0,0,0,0,0|2,0,0]=4 650 B9R1.8 CCSc1ccncc1 62a_100000210202_100000728582 [2,0,0,0,0,0|2,0,0]=4 651 B9R1.8 CCSc1ccncc1 62a_100000728582_100000210202 [2,0,0,0,0,0|2,0,0]=4 652 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|1,0,0]=3 653 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|1,0,0]=3 654 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|1,0,0]=3 655 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|1,0,0]=3 656 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|1,0,0]=3 657 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|1,0,0]=3 658 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|1,0,0]=3 659 B9R1.8 CNCc1ccccn1 207a_100102657272_100000209966 [2,0,0,0,0,0|2,0,0]=4 660 B9R1.8 CNCc1ccccn1 2230a_106832991635_100000721315 [2,0,0,0,0,0|2,0,0]=4 661 B9R1.8 CNCc1ccccn1 270004a_106832991635_100000209966 [2,0,0,0,0,0|2,0,0]=4 662 B9R1.8 CNCc1ccccn1 34a_100102657272_100000721315 [2,0,0,0,0,0|2,0,0]=4 663 B9R1.8 CNCc1ccccn1 7a_106832991635_100000721315 [2,0,0,0,0,0|2,0,0]=4 664 B9R1.8 CNCc1cccnc1 207a_100102657272_100000209961 [2,0,0,0,0,0|2,0,0]=4 665 B9R1.8 CNCc1cccnc1 2230a_106832991635_100000741622 [2,0,0,0,0,0|2,0,0]=4 666 B9R1.8 CNCc1cccnc1 270004a_106832991635_100000209961 [2,0,0,0,0,0|2,0,0]=4 667 B9R1.8 CNCc1cccnc1 34a_100102657272_100000733263 [2,0,0,0,0,0|2,0,0]=4 668 B9R1.8 CNCc1cccnc1 7a_106832991635_100000741622 [2,0,0,0,0,0|2,0,0]=4 669 B9R1.8 CNCc1ccncc1 207a_100102657272_100000186114 [2,0,0,0,0,0|2,0,0]=4 670 B9R1.8 CNCc1ccncc1 2230a_106832991635_100015193705 [2,0,0,0,0,0|2,0,0]=4 671 B9R1.8 CNCc1ccncc1 7a_106832991635_100015193705 [2,0,0,0,0,0|2,0,0]=4 672 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|1,0,0]=3 673 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|1,0,0]=3 674 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|1,0,0]=3 675 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [2,0,0,0,0,0|2,0,0]=4 676 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [2,0,0,0,0,0|2,0,0]=4 677 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|1,0,0]=3 678 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|1,0,0]=3 679 B9R1.8 CSCc1ccccn1 62a_100000721315_200000210301 [2,0,0,0,0,0|2,0,0]=4 680 B9R1.8 CSCc1ccccn1 62a_200000210301_100000721315 [2,0,0,0,0,0|2,0,0]=4 681 B9R1.8 CSCc1cccnc1 62a_100000741622_200000210301 [2,0,0,0,0,0|2,0,0]=4 682 B9R1.8 CSCc1cccnc1 62a_200000210301_100000741622 [2,0,0,0,0,0|2,0,0]=4 683 B9R1.8 CSCc1ccncc1 62a_100015193705_200000210301 [2,0,0,0,0,0|2,0,0]=4 684 B9R1.8 CSCc1ccncc1 62a_200000210301_100015193705 [2,0,0,0,0,0|2,0,0]=4 685 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [2,0,0,0,0,0|2,0,0]=4 686 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 687 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [2,0,0,0,0,0|2,0,0]=4 688 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [2,0,0,0,0,0|2,0,0]=4 689 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [2,0,0,0,0,0|2,0,0]=4 690 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|1,0,0]=3 691 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|1,0,0]=3 692 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|1,0,0]=3 693 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|1,0,0]=3 694 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|1,0,0]=3 695 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|1,0,0]=3 696 B9R1.8 [13CH3]SCc1ccccn1 62a_100000721315_200025704644 [2,0,0,0,0,0|2,0,0]=4 697 B9R1.8 [13CH3]SCc1ccccn1 62a_200025704644_100000721315 [2,0,0,0,0,0|2,0,0]=4 698 B9R1.8 [13CH3]SCc1cccnc1 62a_100000741622_200025704644 [2,0,0,0,0,0|2,0,0]=4 699 B9R1.8 [13CH3]SCc1cccnc1 62a_200025704644_100000741622 [2,0,0,0,0,0|2,0,0]=4 700 B9R1.8 [13CH3]SCc1ccncc1 62a_100015193705_200025704644 [2,0,0,0,0,0|2,0,0]=4 701 B9R1.8 [13CH3]SCc1ccncc1 62a_200025704644_100015193705 [2,0,0,0,0,0|2,0,0]=4 702 B11R0.82 C=CC=CC(=O)CCC(C)(C)C 1458a_100016291481_100000755188 [0,1,1,0,0,0|1,0,1]=4 703 B11R0.82 C=CC=CC(=O)NCC(C)(C)C 1626a_100000743828_100016291481 [0,1,1,0,0,0|2,0,0]=4 704 B11R0.82 C=CC=CC(=O)NCC(C)(C)F 1626a_100020643315_100016291481 [0,1,1,0,0,0|2,0,0]=4 705 B11R0.82 C=CC=CC(=O)NCC(C)(C)O 1626a_100000751335_100016291481 [0,1,1,0,0,0|1,0,0]=3 706 B11R0.159 C/C=C/C=C/COCC(C)(C)O 34a_100016283227_100000764493 [0,1,1,0,0,0|0,0,2]=4 707 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [1,1,0,0,0,0|0,0,2]=4 708 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [1,1,0,0,0,0|0,0,2]=4 709 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [1,1,0,0,0,0|0,0,2]=4 710 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [1,1,0,0,0,0|0,0,2]=4 711 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [1,1,0,0,0,0|0,0,2]=4 712 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,1,0,0,0,0|0,0,2]=4 713 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [1,1,0,0,0,0|0,0,2]=4 714 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [1,1,0,0,0,0|0,0,2]=4 715 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [1,1,0,0,0,0|0,0,2]=4 716 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [1,1,0,0,0,0|0,0,2]=4 717 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [1,1,0,0,0,0|0,0,2]=4 718 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [1,1,0,0,0,0|0,0,2]=4 719 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [1,1,0,0,0,0|0,0,2]=4 720 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [1,1,0,0,0,0|0,0,2]=4 721 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [1,1,0,0,0,0|0,0,2]=4 722 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [1,1,0,0,0,0|0,0,2]=4 723 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,1,0,0,0,0|0,0,2]=4 724 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,1,0,0,0,0|0,0,2]=4 725 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [1,1,0,0,0,0|0,0,0]=2 726 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [1,1,0,0,0,0|1,0,0]=3 727 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [1,1,0,0,0,0|1,0,0]=3 728 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [1,1,0,0,0,0|1,0,0]=3 729 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [1,1,0,0,0,0|1,0,0]=3 730 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [1,1,0,0,0,0|1,0,0]=3 731 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [1,1,0,0,0,0|1,0,0]=3 732 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [1,1,0,0,0,0|1,0,0]=3 733 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [1,1,0,0,0,0|1,0,0]=3 734 B11R1.20 CC(C)Nc1ccc(cn1)Br 27a_100138425928_100000686858 [1,1,0,0,0,0|2,0,0]=4 735 B11R1.20 CC(C)Oc1ccc(=O)[nH]c1 34a_100000075641_100000210206 [1,1,0,0,0,0|2,0,0]=4 736 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [1,1,0,0,0,0|1,0,0]=3 737 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [1,1,0,0,0,0|1,0,0]=3 738 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [1,1,0,0,0,0|1,0,0]=3 739 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [1,1,0,0,0,0|1,0,0]=3 740 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [1,1,0,0,0,0|1,0,0]=3 741 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [1,1,0,0,0,0|1,0,0]=3 742 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [1,1,0,0,0,0|1,0,0]=3 743 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [1,1,0,0,0,0|1,0,0]=3 744 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,1,0,0,0,0|1,0,0]=3 745 B11R1.20 CC(C)Oc1ccc(cn1)Cl 34a_100011215309_100000210206 [1,1,0,0,0,0|2,0,0]=4 746 B11R1.20 CC(C)Oc1ccc(cn1)F 34a_100000742473_100000210206 [1,1,0,0,0,0|2,0,0]=4 747 B11R1.20 CC(C)Oc1ccc(cn1)N 34a_100000729260_100000210206 [1,1,0,0,0,0|2,0,0]=4 748 B11R1.20 CC(C)Oc1ccc(cn1)O 271570a_203496583355_100000688564 [1,1,0,0,0,0|2,0,0]=4 749 B11R1.20 CC(C)Oc1ccc(nc1)Br 34a_100000685995_100000210206 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.20 CC(C)Oc1ccc(nc1)Br 7a_100000685995_100000210206 [1,1,0,0,0,0|2,0,0]=4 751 B11R1.20 CC(C)Oc1ccc(nc1)Cl 34a_100000744096_100000210206 [1,1,0,0,0,0|2,0,0]=4 752 B11R1.20 CC(C)Oc1ccc(nc1)Cl 7a_100000744096_100000210206 [1,1,0,0,0,0|2,0,0]=4 753 B11R1.20 CC(C)Oc1ccc(nc1)F 34a_100000688820_100000210206 [1,1,0,0,0,0|2,0,0]=4 754 B11R1.20 CC(C)Oc1ccc(nc1)F 7a_100000688820_100000210206 [1,1,0,0,0,0|2,0,0]=4 755 B11R1.20 CC(C)Oc1ccc(nc1)I 34a_100000687607_100000210206 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.20 CC(C)Oc1ccc(nc1)I 7a_100000687607_100000210206 [1,1,0,0,0,0|2,0,0]=4 757 B11R1.20 CC(C)Oc1ccc(nc1)N 34a_100015188713_100000210206 [1,1,0,0,0,0|2,0,0]=4 758 B11R1.20 CC(C)Oc1ccc(nc1)N 7a_100015188713_100000210206 [1,1,0,0,0,0|2,0,0]=4 759 B11R1.20 CC(C)Oc1ccc(nc1)O 271570a_203496583355_100012354243 [1,1,0,0,0,0|2,0,0]=4 760 B11R1.20 CC(C)Sc1cc[n+](cc1)[O-] 62a_100000210206_100000039755 [1,1,0,0,0,0|2,0,0]=4 761 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000210206_100000212171 [1,1,0,0,0,0|2,0,0]=4 762 B11R1.20 CC(C)Sc1ccc(=O)[nH]c1 62a_100000212171_100000210206 [1,1,0,0,0,0|2,0,0]=4 763 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [1,1,0,0,0,0|1,0,0]=3 764 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [1,1,0,0,0,0|1,0,0]=3 765 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [1,1,0,0,0,0|1,0,0]=3 766 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [1,1,0,0,0,0|1,0,0]=3 767 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [1,1,0,0,0,0|1,0,0]=3 768 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [1,1,0,0,0,0|1,0,0]=3 769 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [1,1,0,0,0,0|1,0,0]=3 770 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [1,1,0,0,0,0|1,0,0]=3 771 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [1,1,0,0,0,0|1,0,0]=3 772 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [1,1,0,0,0,0|1,0,0]=3 773 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000210206_100000686858 [1,1,0,0,0,0|2,0,0]=4 774 B11R1.20 CC(C)Sc1ccc(cn1)Br 62a_100000686858_100000210206 [1,1,0,0,0,0|2,0,0]=4 775 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100000210206_100011356976 [1,1,0,0,0,0|2,0,0]=4 776 B11R1.20 CC(C)Sc1ccc(cn1)Cl 62a_100011356976_100000210206 [1,1,0,0,0,0|2,0,0]=4 777 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000210206_100000744514 [1,1,0,0,0,0|2,0,0]=4 778 B11R1.20 CC(C)Sc1ccc(cn1)F 62a_100000744514_100000210206 [1,1,0,0,0,0|2,0,0]=4 779 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000210206_100000737798 [1,1,0,0,0,0|2,0,0]=4 780 B11R1.20 CC(C)Sc1ccc(cn1)N 62a_100000737798_100000210206 [1,1,0,0,0,0|2,0,0]=4 781 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000210206_100000744096 [1,1,0,0,0,0|2,0,0]=4 782 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000685995_100000210206 [1,1,0,0,0,0|2,0,0]=4 783 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100000210206_100009814638 [1,1,0,0,0,0|2,0,0]=4 784 B11R1.20 CC(C)Sc1ccc(nc1)Br 62a_100009814638_100000210206 [1,1,0,0,0,0|2,0,0]=4 785 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000034144_100000210206 [1,1,0,0,0,0|2,0,0]=4 786 B11R1.20 CC(C)Sc1ccc(nc1)Cl 62a_100000210206_100000034144 [1,1,0,0,0,0|2,0,0]=4 787 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000042367_100000210206 [1,1,0,0,0,0|2,0,0]=4 788 B11R1.20 CC(C)Sc1ccc(nc1)F 62a_100000210206_100000042367 [1,1,0,0,0,0|2,0,0]=4 789 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000187370_100000210206 [1,1,0,0,0,0|2,0,0]=4 790 B11R1.20 CC(C)Sc1ccc(nc1)N 62a_100000210206_100000187370 [1,1,0,0,0,0|2,0,0]=4 791 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [1,1,0,0,0,0|1,0,0]=3 792 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [1,1,0,0,0,0|1,0,0]=3 793 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [1,1,0,0,0,0|1,0,0]=3 794 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [1,1,0,0,0,0|1,0,0]=3 795 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [1,1,0,0,0,0|1,0,0]=3 796 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [1,1,0,0,0,0|1,0,0]=3 797 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [1,1,0,0,0,0|1,0,0]=3 798 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [1,1,0,0,0,0|1,0,0]=3 799 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [1,1,0,0,0,0|1,0,0]=3 800 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [1,1,0,0,0,0|1,0,0]=3 801 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [1,1,0,0,0,0|1,0,0]=3 802 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [1,1,0,0,0,0|1,0,0]=3 803 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [1,1,0,0,0,0|1,0,0]=3 804 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [1,1,0,0,0,0|1,0,0]=3 805 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [1,1,0,0,0,0|1,0,0]=3 806 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [1,1,0,0,0,0|1,0,0]=3 807 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [1,1,0,0,0,0|1,0,0]=3 808 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [1,1,0,0,0,0|1,0,0]=3 809 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [1,1,0,0,0,0|1,0,0]=3 810 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,1,0,0,0,0|1,0,0]=3 811 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,1,0,0,0,0|1,0,0]=3 812 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,1,0,0,0,0|1,0,0]=3 813 B11R1.20 CN(C)Cc1ccc(cn1)Br 2230a_100102631434_100000702658 [1,1,0,0,0,0|2,0,0]=4 814 B11R1.20 CN(C)Cc1ccc(cn1)Br 269982a_100102631434_100000702658 [1,1,0,0,0,0|2,0,0]=4 815 B11R1.20 CN(C)Cc1ccc(cn1)Br 270004a_100102631434_100000754260 [1,1,0,0,0,0|2,0,0]=4 816 B11R1.20 CN(C)Cc1ccc(cn1)Cl 2230a_100102631434_100012066911 [1,1,0,0,0,0|2,0,0]=4 817 B11R1.20 CN(C)Cc1ccc(cn1)Cl 269982a_100102631434_100000697101 [1,1,0,0,0,0|2,0,0]=4 818 B11R1.20 CN(C)Cc1ccc(cn1)Cl 270004a_100102631434_100011361569 [1,1,0,0,0,0|2,0,0]=4 819 B11R1.20 CN(C)Cc1ccc(cn1)F 2230a_100102631434_100000703193 [1,1,0,0,0,0|2,0,0]=4 820 B11R1.20 CN(C)Cc1ccc(cn1)F 269982a_100102631434_100000703193 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.20 CN(C)Cc1ccc(cn1)F 270004a_100102631434_100011934744 [1,1,0,0,0,0|2,0,0]=4 822 B11R1.20 CN(C)Cc1ccc(nc1)Br 2230a_100102631434_100009831999 [1,1,0,0,0,0|2,0,0]=4 823 B11R1.20 CN(C)Cc1ccc(nc1)Br 269982a_100102631434_100009831999 [1,1,0,0,0,0|2,0,0]=4 824 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100000026953_200000210301 [1,1,0,0,0,0|2,0,0]=4 825 B11R1.20 CN(C)Cc1ccc(nc1)Cl 2230a_100102631434_100000735431 [1,1,0,0,0,0|2,0,0]=4 826 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100000026953_200000210301 [1,1,0,0,0,0|2,0,0]=4 827 B11R1.20 CN(C)Cc1ccc(nc1)Cl 269982a_100102631434_100000735431 [1,1,0,0,0,0|2,0,0]=4 828 B11R1.20 CN(C)Cc1ccc(nc1)Cl 34a_100000026953_200000210301 [1,1,0,0,0,0|2,0,0]=4 829 B11R1.20 CN(C)Cc1ccc(nc1)F 2230a_100102631434_100009820150 [1,1,0,0,0,0|2,0,0]=4 830 B11R1.20 CN(C)Cc1ccc(nc1)F 269982a_100102631434_100009820150 [1,1,0,0,0,0|2,0,0]=4 831 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [1,1,0,0,0,0|2,0,0]=4 832 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [1,1,0,0,0,0|1,0,0]=3 833 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [1,1,0,0,0,0|1,0,0]=3 834 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [1,1,0,0,0,0|1,0,0]=3 835 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [1,1,0,0,0,0|1,0,0]=3 836 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [1,1,0,0,0,0|1,0,0]=3 837 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [1,1,0,0,0,0|1,0,0]=3 838 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [1,1,0,0,0,0|1,0,0]=3 839 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [1,1,0,0,0,0|1,0,0]=3 840 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,1,0,0,0,0|1,0,0]=3 841 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,1,0,0,0,0|1,0,0]=3 842 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 2230a_100000026953_200025704644 [1,1,0,0,0,0|2,0,0]=4 843 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 269982a_100000026953_200025704644 [1,1,0,0,0,0|2,0,0]=4 844 B11R1.20 CN([13CH3])Cc1ccc(nc1)Cl 34a_100000026953_200025704644 [1,1,0,0,0,0|2,0,0]=4 845 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [1,1,0,0,0,0|0,0,2]=4 846 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [1,1,0,0,0,0|1,0,0]=3 847 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [1,1,0,0,0,0|1,0,0]=3 848 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [1,1,0,0,0,0|1,0,0]=3 849 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [1,1,0,0,0,0|1,0,0]=3 850 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [1,1,0,0,0,0|1,0,0]=3 851 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [1,1,0,0,0,0|1,0,0]=3 852 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [1,1,0,0,0,0|1,0,0]=3 853 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [1,1,0,0,0,0|1,0,0]=3 854 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [1,1,0,0,0,0|1,0,0]=3 855 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [1,1,0,0,0,0|1,0,0]=3 856 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [1,1,0,0,0,0|1,0,0]=3 857 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [1,1,0,0,0,0|1,0,0]=3 858 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [1,1,0,0,0,0|1,0,0]=3 859 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [1,1,0,0,0,0|1,0,0]=3 860 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_100102631434_100016987292 [1,1,0,0,0,0|2,0,0]=4 861 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_106623407658_200000210301 [1,1,0,0,0,0|2,0,0]=4 862 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_100102631434_100016987292 [1,1,0,0,0,0|2,0,0]=4 863 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_106623407658_200000210301 [1,1,0,0,0,0|2,0,0]=4 864 B11R1.20 Cc1ccc(cn1)CN(C)C 270004a_100102631434_100000743784 [1,1,0,0,0,0|2,0,0]=4 865 B11R1.20 Cc1ccc(cn1)CN(C)C 34a_106623407658_200000210301 [1,1,0,0,0,0|2,0,0]=4 866 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 2230a_106623407658_200025704644 [1,1,0,0,0,0|2,0,0]=4 867 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 269982a_106623407658_200025704644 [1,1,0,0,0,0|2,0,0]=4 868 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 34a_106623407658_200025704644 [1,1,0,0,0,0|2,0,0]=4 869 B11R1.20 Cc1ccc(cn1)OC(C)C 34a_100000745506_100000210206 [1,1,0,0,0,0|2,0,0]=4 870 B11R1.20 Cc1ccc(cn1)OC(C)C 7a_100000745506_100000210206 [1,1,0,0,0,0|2,0,0]=4 871 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000210206_100000751577 [1,1,0,0,0,0|2,0,0]=4 872 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000751577_100000210206 [1,1,0,0,0,0|2,0,0]=4 873 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_100102631434_100000691093 [1,1,0,0,0,0|2,0,0]=4 874 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_200000717808_200000210301 [1,1,0,0,0,0|2,0,0]=4 875 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_100102631434_100000691093 [1,1,0,0,0,0|2,0,0]=4 876 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_200000717808_200000210301 [1,1,0,0,0,0|2,0,0]=4 877 B11R1.20 Cc1ccc(nc1)CN(C)C 270004a_100102631434_100000050478 [1,1,0,0,0,0|2,0,0]=4 878 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 2230a_200000717808_200025704644 [1,1,0,0,0,0|2,0,0]=4 879 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 269982a_200000717808_200025704644 [1,1,0,0,0,0|2,0,0]=4 880 B11R1.20 Cc1ccc(nc1)OC(C)C 34a_100000759353_100000210206 [1,1,0,0,0,0|2,0,0]=4 881 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100000210206_100000754016 [1,1,0,0,0,0|2,0,0]=4 882 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100011192072_100000210206 [1,1,0,0,0,0|2,0,0]=4 883 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [1,1,0,0,0,0|0,0,2]=4 884 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [1,1,0,0,0,0|0,0,2]=4 885 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [1,1,0,0,0,0|0,0,2]=4 886 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [1,1,0,0,0,0|0,0,2]=4 887 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,1,0,0,0,0|0,0,2]=4 888 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [1,1,0,0,0,0|0,0,2]=4 889 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [1,1,0,0,0,0|0,0,2]=4 890 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [1,1,0,0,0,0|0,0,2]=4 891 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [1,1,0,0,0,0|0,0,2]=4 892 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,1,0,0,0,0|0,0,2]=4 893 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [1,1,0,0,0,0|0,0,1]=3 894 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [1,1,0,0,0,0|1,0,0]=3 895 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [1,1,0,0,0,0|1,0,0]=3 896 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [1,1,0,0,0,0|1,0,0]=3 897 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [1,1,0,0,0,0|1,0,0]=3 898 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [1,1,0,0,0,0|1,0,0]=3 899 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [1,1,0,0,0,0|1,0,0]=3 900 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [1,1,0,0,0,0|1,0,0]=3 901 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [1,1,0,0,0,0|1,0,0]=3 902 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [1,1,0,0,0,0|1,0,0]=3 903 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [1,1,0,0,0,0|1,0,0]=3 904 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [1,1,0,0,0,0|1,0,0]=3 905 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [1,1,0,0,0,0|1,0,0]=3 906 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [1,1,0,0,0,0|1,0,0]=3 907 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [1,1,0,0,0,0|1,0,0]=3 908 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [1,1,0,0,0,0|1,0,0]=3 909 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [1,1,0,0,0,0|1,0,0]=3 910 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [1,1,0,0,0,0|1,0,0]=3 911 B11R1.36 CC(c1ccccn1)N(C)C 2230a_100000231138_200000210301 [1,1,0,0,0,0|2,0,0]=4 912 B11R1.36 CC(c1ccccn1)N(C)C 269982a_100000231138_200000210301 [1,1,0,0,0,0|2,0,0]=4 913 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 2230a_100000231138_200025704644 [1,1,0,0,0,0|2,0,0]=4 914 B11R1.36 CC(c1ccccn1)N(C)[13CH3] 269982a_100000231138_200025704644 [1,1,0,0,0,0|2,0,0]=4 915 B11R1.36 CC(c1cccnc1)N(C)C 2230a_100000232774_200000210301 [1,1,0,0,0,0|2,0,0]=4 916 B11R1.36 CC(c1cccnc1)N(C)C 269982a_100000232774_200000210301 [1,1,0,0,0,0|2,0,0]=4 917 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 2230a_100000232774_200025704644 [1,1,0,0,0,0|2,0,0]=4 918 B11R1.36 CC(c1cccnc1)N(C)[13CH3] 269982a_100000232774_200025704644 [1,1,0,0,0,0|2,0,0]=4 919 B11R1.36 CC(c1ccncc1)N(C)C 2230a_100000231139_200000210301 [1,1,0,0,0,0|2,0,0]=4 920 B11R1.36 CC(c1ccncc1)N(C)C 269982a_100000231139_200000210301 [1,1,0,0,0,0|2,0,0]=4 921 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 2230a_100000231139_200025704644 [1,1,0,0,0,0|2,0,0]=4 922 B11R1.36 CC(c1ccncc1)N(C)[13CH3] 269982a_100000231139_200025704644 [1,1,0,0,0,0|2,0,0]=4 923 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [1,1,0,0,0,0|1,0,1]=4 924 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [1,1,0,0,0,0|1,0,1]=4 925 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [1,1,0,0,0,0|1,0,1]=4 926 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [1,1,0,0,0,0|1,0,1]=4 927 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [1,1,0,0,0,0|0,0,2]=4 928 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [1,1,0,0,0,0|0,0,2]=4 929 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,1,0,0,0,0|0,0,2]=4 930 B11R1.40 C#CC(C)Nc1ccccc1 34a_100000106764_200000035995 [1,1,0,0,0,0|1,0,1]=4 931 B11R1.40 C#CC(C)Oc1ccccc1 34a_100000210340_200000035995 [1,1,0,0,0,0|1,0,1]=4 932 B11R1.40 C#CC(C)Sc1ccccc1 62a_200000035995_100000041952 [1,1,0,0,0,0|1,0,1]=4 933 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [1,1,0,0,0,0|1,0,1]=4 934 B11R1.40 CC(C#N)Oc1ccccc1 7a_100000210340_100000703298 [1,1,0,0,0,0|1,0,1]=4 935 B11R1.40 CC(C#N)Sc1ccccc1 62a_100000703298_100000041952 [1,1,0,0,0,0|1,0,1]=4 936 B11R1.40 CC(C#N)Sc1ccccc1 62a_100000719477_100000703298 [1,1,0,0,0,0|1,0,1]=4 937 B11R1.40 CC(CO)Nc1ccccc1 34a_100000106764_100012180447 [1,1,0,0,0,0|1,0,0]=3 938 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [1,1,0,0,0,0|1,0,0]=3 939 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [1,1,0,0,0,0|1,0,0]=3 940 B11R1.40 CC(CO)Oc1cccnc1 34a_100000210849_100012180447 [1,1,0,0,0,0|2,0,0]=4 941 B11R1.40 CC(CO)Oc1cccnc1 7a_100000210849_100012180447 [1,1,0,0,0,0|2,0,0]=4 942 B11R1.40 CC(CO)Oc1ccncc1 34a_100000212176_100012180447 [1,1,0,0,0,0|2,0,0]=4 943 B11R1.40 CC(CO)Sc1ccccc1 62a_100012180447_100000041952 [1,1,0,0,0,0|1,0,0]=3 944 B11R1.40 CC(CO)Sc1ccccn1 62a_100012180447_100011216584 [1,1,0,0,0,0|2,0,0]=4 945 B11R1.40 CC(CO)Sc1cccnc1 62a_100012180447_100000210063 [1,1,0,0,0,0|2,0,0]=4 946 B11R1.40 CC(CO)Sc1ccncc1 62a_100012180447_100000728582 [1,1,0,0,0,0|2,0,0]=4 947 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [1,1,0,0,0,0|0,0,0]=2 948 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [1,1,0,0,0,0|0,0,0]=2 949 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200011218536_200025704644 [1,1,0,0,0,0|0,0,0]=2 950 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200025704644_200011218536 [1,1,0,0,0,0|0,0,0]=2 951 B11R1.40 CC(Cc1ccccn1)N[13CH3] 2230a_100000238496_200025704644 [1,1,0,0,0,0|1,0,0]=3 952 B11R1.40 CC(Cc1cccnc1)N[13CH3] 2230a_100011207255_200025704644 [1,1,0,0,0,0|1,0,0]=3 953 B11R1.40 CC(Cc1cnccn1)N[13CH3] 2230a_100011277835_200025704644 [1,1,0,0,0,0|2,0,0]=4 954 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [1,1,0,0,0,0|0,0,2]=4 955 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [1,1,0,0,0,0|1,0,0]=3 956 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [1,1,0,0,0,0|1,0,0]=3 957 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [1,1,0,0,0,0|1,0,0]=3 958 B11R1.40 CCC(C)Oc1cccnc1 34a_100000210849_100011215416 [1,1,0,0,0,0|2,0,0]=4 959 B11R1.40 CCC(C)Oc1cccnc1 7a_100000210849_100000758301 [1,1,0,0,0,0|2,0,0]=4 960 B11R1.40 CCC(C)Oc1ccncc1 34a_100000212176_100011215416 [1,1,0,0,0,0|2,0,0]=4 961 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [1,1,0,0,0,0|1,0,0]=3 962 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [1,1,0,0,0,0|1,0,0]=3 963 B11R1.40 CCC(C)Sc1ccccn1 62a_100000758301_100011216584 [1,1,0,0,0,0|2,0,0]=4 964 B11R1.40 CCC(C)Sc1ccccn1 62a_100011216584_100000758301 [1,1,0,0,0,0|2,0,0]=4 965 B11R1.40 CCC(C)Sc1cccnc1 62a_100000210063_100000758301 [1,1,0,0,0,0|2,0,0]=4 966 B11R1.40 CCC(C)Sc1cccnc1 62a_100000758301_100000210063 [1,1,0,0,0,0|2,0,0]=4 967 B11R1.40 CCC(C)Sc1ccncc1 62a_100000728582_100000758301 [1,1,0,0,0,0|2,0,0]=4 968 B11R1.40 CCC(C)Sc1ccncc1 62a_100000758301_100000728582 [1,1,0,0,0,0|2,0,0]=4 969 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186898_100000210202 [1,1,0,0,0,0|1,0,0]=3 970 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186914_200000210301 [1,1,0,0,0,0|1,0,0]=3 971 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000225621_100015291786 [1,1,0,0,0,0|1,0,0]=3 972 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186898_100000204670 [1,1,0,0,0,0|1,0,0]=3 973 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186914_200000210301 [1,1,0,0,0,0|1,0,0]=3 974 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000225621_100000211182 [1,1,0,0,0,0|1,0,0]=3 975 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000201164_200000210301 [1,1,0,0,0,0|2,0,0]=4 976 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000207498_100000210202 [1,1,0,0,0,0|2,0,0]=4 977 B11R1.40 CCN(C)Cc1ccccn1 2230a_100000225621_100000721315 [1,1,0,0,0,0|2,0,0]=4 978 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000201164_200000210301 [1,1,0,0,0,0|2,0,0]=4 979 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000207498_100000204670 [1,1,0,0,0,0|2,0,0]=4 980 B11R1.40 CCN(C)Cc1ccccn1 269982a_100000225621_100000721315 [1,1,0,0,0,0|2,0,0]=4 981 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000184577_100000210202 [1,1,0,0,0,0|2,0,0]=4 982 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000186920_200000210301 [1,1,0,0,0,0|2,0,0]=4 983 B11R1.40 CCN(C)Cc1cccnc1 2230a_100000225621_100000741622 [1,1,0,0,0,0|2,0,0]=4 984 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000184577_100000204670 [1,1,0,0,0,0|2,0,0]=4 985 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000186920_200000210301 [1,1,0,0,0,0|2,0,0]=4 986 B11R1.40 CCN(C)Cc1cccnc1 269982a_100000225621_100000733263 [1,1,0,0,0,0|2,0,0]=4 987 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000186919_200000210301 [1,1,0,0,0,0|2,0,0]=4 988 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000187231_100000210202 [1,1,0,0,0,0|2,0,0]=4 989 B11R1.40 CCN(C)Cc1ccncc1 2230a_100000225621_100015193705 [1,1,0,0,0,0|2,0,0]=4 990 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000186919_200000210301 [1,1,0,0,0,0|2,0,0]=4 991 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000187231_100000204670 [1,1,0,0,0,0|2,0,0]=4 992 B11R1.40 CCN(C)Cc1ccncc1 269982a_100000225621_100015193705 [1,1,0,0,0,0|2,0,0]=4 993 B11R1.40 CCN([13CH3])Cc1ccccc1 2230a_100000186914_200025704644 [1,1,0,0,0,0|1,0,0]=3 994 B11R1.40 CCN([13CH3])Cc1ccccc1 269982a_100000186914_200025704644 [1,1,0,0,0,0|1,0,0]=3 995 B11R1.40 CCN([13CH3])Cc1ccccn1 2230a_100000201164_200025704644 [1,1,0,0,0,0|2,0,0]=4 996 B11R1.40 CCN([13CH3])Cc1ccccn1 269982a_100000201164_200025704644 [1,1,0,0,0,0|2,0,0]=4 997 B11R1.40 CCN([13CH3])Cc1cccnc1 2230a_100000186920_200025704644 [1,1,0,0,0,0|2,0,0]=4 998 B11R1.40 CCN([13CH3])Cc1cccnc1 269982a_100000186920_200025704644 [1,1,0,0,0,0|2,0,0]=4 999 B11R1.40 CCN([13CH3])Cc1ccncc1 2230a_100000186919_200025704644 [1,1,0,0,0,0|2,0,0]=4 1000 B11R1.40 CCN([13CH3])Cc1ccncc1 269982a_100000186919_200025704644 [1,1,0,0,0,0|2,0,0]=4 1001 B11R1.40 CN(CF)Cc1ccccc1 269982a_100000186898_100015361967 [1,1,0,0,0,0|1,0,0]=3 1002 B11R1.40 CN(CF)Cc1ccccn1 269982a_100000207498_100015361967 [1,1,0,0,0,0|2,0,0]=4 1003 B11R1.40 CN(CF)Cc1cccnc1 269982a_100000184577_100015361967 [1,1,0,0,0,0|2,0,0]=4 1004 B11R1.40 CN(CF)Cc1ccncc1 269982a_100000187231_100015361967 [1,1,0,0,0,0|2,0,0]=4 1005 B11R1.40 CNC(C)C[n+]1ccccc1 270004a_106832991635_100000034229 [1,1,0,0,0,0|1,0,0]=3 1006 B11R1.40 CNC(C)Cc1ccccc1 34a_100102657272_200011218536 [1,1,0,0,0,0|0,0,0]=2 1007 B11R1.40 CNC(C)Cc1ccccc1 7a_106832991635_200011218536 [1,1,0,0,0,0|0,0,0]=2 1008 B11R1.40 CNC(C)Cc1ccccn1 2230a_100000238496_200000210301 [1,1,0,0,0,0|1,0,0]=3 1009 B11R1.40 CNC(C)Cc1cccnc1 2230a_100011207255_200000210301 [1,1,0,0,0,0|1,0,0]=3 1010 B11R1.40 CNC(C)Cc1cccnc1 270004a_106832991635_100015187140 [1,1,0,0,0,0|1,0,0]=3 1011 B11R1.40 CNC(C)Cc1ccncc1 270004a_106832991635_100000238508 [1,1,0,0,0,0|1,0,0]=3 1012 B11R1.40 CNC(C)Cc1cnccn1 2230a_100011277835_200000210301 [1,1,0,0,0,0|2,0,0]=4 1013 B11R1.40 CNC(C)Cc1cnccn1 270004a_106832991635_100015184882 [1,1,0,0,0,0|2,0,0]=4 1014 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [1,1,0,0,0,0|0,0,0]=2 1015 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [1,1,0,0,0,0|0,0,0]=2 1016 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [1,1,0,0,0,0|0,0,0]=2 1017 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [1,1,0,0,0,0|1,0,0]=3 1018 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [1,1,0,0,0,0|1,0,0]=3 1019 B11R1.40 COC(C)Sc1ccccn1 62a_100009879195_100011216584 [1,1,0,0,0,0|2,0,0]=4 1020 B11R1.40 COC(C)Sc1ccccn1 62a_100011216584_100009879195 [1,1,0,0,0,0|2,0,0]=4 1021 B11R1.40 COC(C)Sc1cccnc1 62a_100000210063_100009879195 [1,1,0,0,0,0|2,0,0]=4 1022 B11R1.40 COC(C)Sc1cccnc1 62a_100009879195_100000210063 [1,1,0,0,0,0|2,0,0]=4 1023 B11R1.40 COC(C)Sc1ccncc1 62a_100000728582_100009879195 [1,1,0,0,0,0|2,0,0]=4 1024 B11R1.40 COC(C)Sc1ccncc1 62a_100009879195_100000728582 [1,1,0,0,0,0|2,0,0]=4 1025 B11R1.40 CSC(C)Cc1ccccc1 62a_200000210301_200011218536 [1,1,0,0,0,0|0,0,0]=2 1026 B11R1.40 CSC(C)Cc1ccccc1 62a_200011218536_200000210301 [1,1,0,0,0,0|0,0,0]=2 1027 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100000719477_100016084084 [1,1,0,0,0,0|1,0,0]=3 1028 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100016084084_100000041952 [1,1,0,0,0,0|1,0,0]=3 1029 B11R1.40 C[C@H](CO)Sc1ccccn1 62a_100011216584_100016084084 [1,1,0,0,0,0|2,0,0]=4 1030 B11R1.40 C[C@H](CO)Sc1ccccn1 62a_100016084084_100011216584 [1,1,0,0,0,0|2,0,0]=4 1031 B11R1.40 C[C@H](CO)Sc1cccnc1 62a_100000210063_100016084084 [1,1,0,0,0,0|2,0,0]=4 1032 B11R1.40 C[C@H](CO)Sc1cccnc1 62a_100016084084_100000210063 [1,1,0,0,0,0|2,0,0]=4 1033 B11R1.40 C[C@H](CO)Sc1ccncc1 62a_100000728582_100016084084 [1,1,0,0,0,0|2,0,0]=4 1034 B11R1.40 C[C@H](CO)Sc1ccncc1 62a_100016084084_100000728582 [1,1,0,0,0,0|2,0,0]=4 1035 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [1,1,0,0,0,0|0,0,2]=4 1036 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [1,1,0,0,0,0|0,0,2]=4 1037 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [1,1,0,0,0,0|0,0,2]=4 1038 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [1,1,0,0,0,0|0,0,2]=4 1039 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [1,1,0,0,0,0|0,0,2]=4 1040 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [1,1,0,0,0,0|0,0,2]=4 1041 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [1,1,0,0,0,0|0,0,2]=4 1042 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [1,1,0,0,0,0|0,0,2]=4 1043 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [1,1,0,0,0,0|0,0,2]=4 1044 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [1,1,0,0,0,0|0,0,2]=4 1045 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [1,1,0,0,0,0|0,0,2]=4 1046 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [1,1,0,0,0,0|0,0,2]=4 1047 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [1,1,0,0,0,0|0,0,2]=4 1048 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [1,1,0,0,0,0|0,0,2]=4 1049 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [1,1,0,0,0,0|0,0,2]=4 1050 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [1,1,0,0,0,0|0,0,2]=4 1051 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [1,1,0,0,0,0|0,0,2]=4 1052 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [1,1,0,0,0,0|0,0,2]=4 1053 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [1,1,0,0,0,0|0,0,2]=4 1054 B11R1.86 CC(C)Nc1ccccc1Br 34a_100000210017_100000210206 [1,1,0,0,0,0|1,0,0]=3 1055 B11R1.86 CC(C)Nc1ccccc1Cl 34a_100000185783_100000210206 [1,1,0,0,0,0|1,0,0]=3 1056 B11R1.86 CC(C)Nc1ccccc1F 34a_100000210422_100000210206 [1,1,0,0,0,0|1,0,0]=3 1057 B11R1.86 CC(C)Nc1ccccc1I 34a_100000210053_100000210206 [1,1,0,0,0,0|1,0,0]=3 1058 B11R1.86 CC(C)Nc1ccccc1O 271570a_203496583355_100000219599 [1,1,0,0,0,0|1,0,0]=3 1059 B11R1.86 CC(C)Nc1ccccc1O 34a_100000185747_100000210206 [1,1,0,0,0,0|1,0,0]=3 1060 B11R1.86 CC(C)Nc1ccncc1Br 27a_100138425928_100000726257 [1,1,0,0,0,0|2,0,0]=4 1061 B11R1.86 CC(C)Nc1ccncc1F 27a_100138425928_100000035921 [1,1,0,0,0,0|2,0,0]=4 1062 B11R1.86 CC(C)Nc1ncccc1Br 27a_100138425928_100000696092 [1,1,0,0,0,0|2,0,0]=4 1063 B11R1.86 CC(C)Oc1cccc[n+]1[O-] 7a_100000211761_100000210206 [1,1,0,0,0,0|2,0,0]=4 1064 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [1,1,0,0,0,0|1,0,0]=3 1065 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [1,1,0,0,0,0|1,0,0]=3 1066 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [1,1,0,0,0,0|1,0,0]=3 1067 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [1,1,0,0,0,0|1,0,0]=3 1068 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [1,1,0,0,0,0|1,0,0]=3 1069 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [1,1,0,0,0,0|1,0,0]=3 1070 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [1,1,0,0,0,0|1,0,0]=3 1071 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [1,1,0,0,0,0|1,0,0]=3 1072 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [1,1,0,0,0,0|1,0,0]=3 1073 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [1,1,0,0,0,0|1,0,0]=3 1074 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [1,1,0,0,0,0|1,0,0]=3 1075 B11R1.86 CC(C)Oc1cccnc1Br 34a_100000744436_100000210206 [1,1,0,0,0,0|2,0,0]=4 1076 B11R1.86 CC(C)Oc1cccnc1Br 7a_100000744436_100000210206 [1,1,0,0,0,0|2,0,0]=4 1077 B11R1.86 CC(C)Oc1cccnc1Cl 34a_100000757616_100000210206 [1,1,0,0,0,0|2,0,0]=4 1078 B11R1.86 CC(C)Oc1cccnc1Cl 7a_100000757616_100000210206 [1,1,0,0,0,0|2,0,0]=4 1079 B11R1.86 CC(C)Oc1cccnc1F 34a_100000061740_100000210206 [1,1,0,0,0,0|2,0,0]=4 1080 B11R1.86 CC(C)Oc1cccnc1F 7a_100000061740_100000210206 [1,1,0,0,0,0|2,0,0]=4 1081 B11R1.86 CC(C)Oc1cccnc1I 34a_100000034122_100000210206 [1,1,0,0,0,0|2,0,0]=4 1082 B11R1.86 CC(C)Oc1cccnc1I 7a_100000034122_100000210206 [1,1,0,0,0,0|2,0,0]=4 1083 B11R1.86 CC(C)Oc1cccnc1N 34a_100000211975_100000210206 [1,1,0,0,0,0|2,0,0]=4 1084 B11R1.86 CC(C)Oc1cccnc1N 7a_100000211975_100000210206 [1,1,0,0,0,0|2,0,0]=4 1085 B11R1.86 CC(C)Oc1cccoc1=O 34a_100000077404_100000210206 [1,1,0,0,0,0|2,0,0]=4 1086 B11R1.86 CC(C)Oc1cccoc1=O 7a_100000077404_100000210206 [1,1,0,0,0,0|2,0,0]=4 1087 B11R1.86 CC(C)Oc1ccncc1Br 34a_100011996408_100000210206 [1,1,0,0,0,0|2,0,0]=4 1088 B11R1.86 CC(C)Oc1ccncc1Cl 34a_100011997054_100000210206 [1,1,0,0,0,0|2,0,0]=4 1089 B11R1.86 CC(C)Oc1ccncc1F 34a_200000081243_100000210206 [1,1,0,0,0,0|2,0,0]=4 1090 B11R1.86 CC(C)Oc1cnccc1Cl 34a_100011996695_100000210206 [1,1,0,0,0,0|2,0,0]=4 1091 B11R1.86 CC(C)Oc1cnccc1I 34a_100000050107_100000210206 [1,1,0,0,0,0|2,0,0]=4 1092 B11R1.86 CC(C)Oc1cnccc1N 34a_100000753702_100000210206 [1,1,0,0,0,0|2,0,0]=4 1093 B11R1.86 CC(C)Oc1coccc1=O 34a_100000060831_100000210206 [1,1,0,0,0,0|2,0,0]=4 1094 B11R1.86 CC(C)Oc1ncccc1Cl 34a_100011290957_100000210206 [1,1,0,0,0,0|2,0,0]=4 1095 B11R1.86 CC(C)Oc1ncccc1F 34a_100011219419_100000210206 [1,1,0,0,0,0|2,0,0]=4 1096 B11R1.86 CC(C)Oc1ncccc1N 34a_100000746358_100000210206 [1,1,0,0,0,0|2,0,0]=4 1097 B11R1.86 CC(C)Oc1ncccc1O 271570a_203496583355_200011465186 [1,1,0,0,0,0|2,0,0]=4 1098 B11R1.86 CC(C)Sc1c[nH]ccc1=O 62a_100000210206_100009998708 [1,1,0,0,0,0|2,0,0]=4 1099 B11R1.86 CC(C)Sc1c[nH]ccc1=O 62a_100009998708_100000210206 [1,1,0,0,0,0|2,0,0]=4 1100 B11R1.86 CC(C)Sc1c[nH]ccc1=S 62a_100000210206_200012280681 [1,1,0,0,0,0|2,0,0]=4 1101 B11R1.86 CC(C)Sc1c[nH]ccc1=S 62a_200012280681_100000210206 [1,1,0,0,0,0|2,0,0]=4 1102 B11R1.86 CC(C)Sc1cccc[n+]1C 62a_100000210206_100000212160 [1,1,0,0,0,0|2,0,0]=4 1103 B11R1.86 CC(C)Sc1cccc[n+]1[O-] 62a_100000210206_200000042595 [1,1,0,0,0,0|2,0,0]=4 1104 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000210206_100000695589 [1,1,0,0,0,0|1,0,0]=3 1105 B11R1.86 CC(C)Sc1ccccc1Br 62a_100000695589_100000210206 [1,1,0,0,0,0|1,0,0]=3 1106 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000210206_100000764095 [1,1,0,0,0,0|1,0,0]=3 1107 B11R1.86 CC(C)Sc1ccccc1Cl 62a_100000764095_100000210206 [1,1,0,0,0,0|1,0,0]=3 1108 B11R1.86 CC(C)Sc1ccccc1F 62a_100000210206_100011215700 [1,1,0,0,0,0|1,0,0]=3 1109 B11R1.86 CC(C)Sc1ccccc1F 62a_100011215700_100000210206 [1,1,0,0,0,0|1,0,0]=3 1110 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210017_100000210206 [1,1,0,0,0,0|1,0,0]=3 1111 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210206_100000210017 [1,1,0,0,0,0|1,0,0]=3 1112 B11R1.86 CC(C)Sc1ccccc1O 62a_100000210206_100000739446 [1,1,0,0,0,0|1,0,0]=3 1113 B11R1.86 CC(C)Sc1ccccc1O 62a_100000739446_100000210206 [1,1,0,0,0,0|1,0,0]=3 1114 B11R1.86 CC(C)Sc1cccnc1Br 62a_100000210206_100010202626 [1,1,0,0,0,0|2,0,0]=4 1115 B11R1.86 CC(C)Sc1cccnc1Br 62a_100010202626_100000210206 [1,1,0,0,0,0|2,0,0]=4 1116 B11R1.86 CC(C)Sc1cccnc1Cl 62a_100000036424_100000210206 [1,1,0,0,0,0|2,0,0]=4 1117 B11R1.86 CC(C)Sc1cccnc1Cl 62a_100000210206_100000036424 [1,1,0,0,0,0|2,0,0]=4 1118 B11R1.86 CC(C)Sc1cccnc1F 62a_100000210206_100009816115 [1,1,0,0,0,0|2,0,0]=4 1119 B11R1.86 CC(C)Sc1cccnc1F 62a_100009816115_100000210206 [1,1,0,0,0,0|2,0,0]=4 1120 B11R1.86 CC(C)Sc1cccnc1N 62a_100000045569_100000210206 [1,1,0,0,0,0|2,0,0]=4 1121 B11R1.86 CC(C)Sc1cccnc1N 62a_100000210206_100000045569 [1,1,0,0,0,0|2,0,0]=4 1122 B11R1.86 CC(C)Sc1cccnc1O 62a_100000210206_100000760158 [1,1,0,0,0,0|2,0,0]=4 1123 B11R1.86 CC(C)Sc1cccnc1O 62a_100000760158_100000210206 [1,1,0,0,0,0|2,0,0]=4 1124 B11R1.86 CC(C)Sc1ccncc1Br 62a_100000210206_100000726257 [1,1,0,0,0,0|2,0,0]=4 1125 B11R1.86 CC(C)Sc1ccncc1Br 62a_100000726257_100000210206 [1,1,0,0,0,0|2,0,0]=4 1126 B11R1.86 CC(C)Sc1ccncc1Cl 62a_100000210206_100000708259 [1,1,0,0,0,0|2,0,0]=4 1127 B11R1.86 CC(C)Sc1ccncc1Cl 62a_100000708259_100000210206 [1,1,0,0,0,0|2,0,0]=4 1128 B11R1.86 CC(C)Sc1ccncc1F 62a_100000047030_100000210206 [1,1,0,0,0,0|2,0,0]=4 1129 B11R1.86 CC(C)Sc1ccncc1F 62a_100000210206_100000047030 [1,1,0,0,0,0|2,0,0]=4 1130 B11R1.86 CC(C)Sc1ccncc1N 62a_100000210206_100000756074 [1,1,0,0,0,0|2,0,0]=4 1131 B11R1.86 CC(C)Sc1ccncc1N 62a_100000756074_100000210206 [1,1,0,0,0,0|2,0,0]=4 1132 B11R1.86 CC(C)Sc1ccncc1O 62a_100000210206_100009817591 [1,1,0,0,0,0|2,0,0]=4 1133 B11R1.86 CC(C)Sc1ccncc1O 62a_100009817591_100000210206 [1,1,0,0,0,0|2,0,0]=4 1134 B11R1.86 CC(C)Sc1cnccc1Br 62a_100000210206_100010138639 [1,1,0,0,0,0|2,0,0]=4 1135 B11R1.86 CC(C)Sc1cnccc1Br 62a_100010138639_100000210206 [1,1,0,0,0,0|2,0,0]=4 1136 B11R1.86 CC(C)Sc1cnccc1Cl 62a_100000210206_100009995489 [1,1,0,0,0,0|2,0,0]=4 1137 B11R1.86 CC(C)Sc1cnccc1Cl 62a_100009995489_100000210206 [1,1,0,0,0,0|2,0,0]=4 1138 B11R1.86 CC(C)Sc1cnccc1F 62a_100000210206_100009820683 [1,1,0,0,0,0|2,0,0]=4 1139 B11R1.86 CC(C)Sc1cnccc1F 62a_100009820683_100000210206 [1,1,0,0,0,0|2,0,0]=4 1140 B11R1.86 CC(C)Sc1cnccc1N 62a_100000047001_100000210206 [1,1,0,0,0,0|2,0,0]=4 1141 B11R1.86 CC(C)Sc1cnccc1N 62a_100000210206_100000047001 [1,1,0,0,0,0|2,0,0]=4 1142 B11R1.86 CC(C)Sc1ncccc1Br 62a_100000210206_100000696092 [1,1,0,0,0,0|2,0,0]=4 1143 B11R1.86 CC(C)Sc1ncccc1Br 62a_100000696092_100000210206 [1,1,0,0,0,0|2,0,0]=4 1144 B11R1.86 CC(C)Sc1ncccc1Cl 62a_100000210206_100011356963 [1,1,0,0,0,0|2,0,0]=4 1145 B11R1.86 CC(C)Sc1ncccc1Cl 62a_100011356963_100000210206 [1,1,0,0,0,0|2,0,0]=4 1146 B11R1.86 CC(C)Sc1ncccc1F 62a_100000210206_100000685392 [1,1,0,0,0,0|2,0,0]=4 1147 B11R1.86 CC(C)Sc1ncccc1F 62a_100000685392_100000210206 [1,1,0,0,0,0|2,0,0]=4 1148 B11R1.86 CC(C)Sc1ncccc1N 62a_100000210206_100000688686 [1,1,0,0,0,0|2,0,0]=4 1149 B11R1.86 CC(C)Sc1ncccc1N 62a_100000688686_100000210206 [1,1,0,0,0,0|2,0,0]=4 1150 B11R1.86 CC(C)Sc1ncccc1O 62a_100000034122_100000210206 [1,1,0,0,0,0|2,0,0]=4 1151 B11R1.86 CC(C)Sc1ncccc1O 62a_100000210206_100000034122 [1,1,0,0,0,0|2,0,0]=4 1152 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100000184654_200000210301 [1,1,0,0,0,0|1,0,0]=3 1153 B11R1.86 CN(C)Cc1ccccc1Br 2230a_100102631434_100000184730 [1,1,0,0,0,0|1,0,0]=3 1154 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100000184654_200000210301 [1,1,0,0,0,0|1,0,0]=3 1155 B11R1.86 CN(C)Cc1ccccc1Br 269982a_100102631434_100000184730 [1,1,0,0,0,0|1,0,0]=3 1156 B11R1.86 CN(C)Cc1ccccc1Br 270004a_100102631434_100000211189 [1,1,0,0,0,0|1,0,0]=3 1157 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100000184507_200000210301 [1,1,0,0,0,0|1,0,0]=3 1158 B11R1.86 CN(C)Cc1ccccc1Cl 2230a_100102631434_100000187162 [1,1,0,0,0,0|1,0,0]=3 1159 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100000184507_200000210301 [1,1,0,0,0,0|1,0,0]=3 1160 B11R1.86 CN(C)Cc1ccccc1Cl 269982a_100102631434_100000187162 [1,1,0,0,0,0|1,0,0]=3 1161 B11R1.86 CN(C)Cc1ccccc1Cl 270004a_100102631434_100000210073 [1,1,0,0,0,0|1,0,0]=3 1162 B11R1.86 CN(C)Cc1ccccc1F 2230a_100000742528_200000210301 [1,1,0,0,0,0|1,0,0]=3 1163 B11R1.86 CN(C)Cc1ccccc1F 2230a_100102631434_100000211605 [1,1,0,0,0,0|1,0,0]=3 1164 B11R1.86 CN(C)Cc1ccccc1F 269982a_100000742528_200000210301 [1,1,0,0,0,0|1,0,0]=3 1165 B11R1.86 CN(C)Cc1ccccc1F 269982a_100102631434_100000211605 [1,1,0,0,0,0|1,0,0]=3 1166 B11R1.86 CN(C)Cc1ccccc1F 270004a_100102631434_100000210811 [1,1,0,0,0,0|1,0,0]=3 1167 B11R1.86 CN(C)Cc1ccccc1F 34a_100000742528_200000210301 [1,1,0,0,0,0|1,0,0]=3 1168 B11R1.86 CN(C)Cc1ccccc1I 2230a_100102631434_100011215278 [1,1,0,0,0,0|1,0,0]=3 1169 B11R1.86 CN(C)Cc1ccccc1I 269982a_100102631434_100011215278 [1,1,0,0,0,0|1,0,0]=3 1170 B11R1.86 CN(C)Cc1ccccc1I 270004a_100102631434_100000010305 [1,1,0,0,0,0|1,0,0]=3 1171 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [1,1,0,0,0,0|1,0,0]=3 1172 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [1,1,0,0,0,0|1,0,0]=3 1173 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [1,1,0,0,0,0|1,0,0]=3 1174 B11R1.86 CN(C)Cc1cccnc1Br 2230a_100102631434_100010140945 [1,1,0,0,0,0|2,0,0]=4 1175 B11R1.86 CN(C)Cc1cccnc1Br 269982a_100102631434_100010140945 [1,1,0,0,0,0|2,0,0]=4 1176 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_100102631434_100000045678 [1,1,0,0,0,0|2,0,0]=4 1177 B11R1.86 CN(C)Cc1cccnc1Cl 2230a_103496529121_200000210301 [1,1,0,0,0,0|2,0,0]=4 1178 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_100102631434_100000045678 [1,1,0,0,0,0|2,0,0]=4 1179 B11R1.86 CN(C)Cc1cccnc1Cl 269982a_103496529121_200000210301 [1,1,0,0,0,0|2,0,0]=4 1180 B11R1.86 CN(C)Cc1cccnc1F 2230a_100102631434_100000099810 [1,1,0,0,0,0|2,0,0]=4 1181 B11R1.86 CN(C)Cc1cccnc1F 269982a_100102631434_100000099810 [1,1,0,0,0,0|2,0,0]=4 1182 B11R1.86 CN(C)Cc1cccnc1O 270004a_100102631434_100011998315 [1,1,0,0,0,0|2,0,0]=4 1183 B11R1.86 CN(C)Cc1ccncc1Br 270004a_100102631434_100000755692 [1,1,0,0,0,0|2,0,0]=4 1184 B11R1.86 CN(C)Cc1ccncc1Cl 2230a_100102631434_100000763264 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.86 CN(C)Cc1ccncc1Cl 269982a_100102631434_100000763264 [1,1,0,0,0,0|2,0,0]=4 1186 B11R1.86 CN(C)Cc1ccncc1Cl 270004a_100102631434_100011934409 [1,1,0,0,0,0|2,0,0]=4 1187 B11R1.86 CN(C)Cc1cnccc1Br 270004a_100102631434_100009816821 [1,1,0,0,0,0|2,0,0]=4 1188 B11R1.86 CN(C)Cc1cnccc1Cl 270004a_100102631434_100000050567 [1,1,0,0,0,0|2,0,0]=4 1189 B11R1.86 CN(C)Cc1ncccc1Br 2230a_100102631434_100025702911 [1,1,0,0,0,0|2,0,0]=4 1190 B11R1.86 CN(C)Cc1ncccc1Br 270004a_100102631434_100011934733 [1,1,0,0,0,0|2,0,0]=4 1191 B11R1.86 CN(C)Cc1ncccc1Cl 2230a_100102631434_100000099807 [1,1,0,0,0,0|2,0,0]=4 1192 B11R1.86 CN(C)Cc1ncccc1Cl 269982a_100102631434_100000099807 [1,1,0,0,0,0|2,0,0]=4 1193 B11R1.86 CN(C)Cc1ncccc1Cl 270004a_100102631434_100012001307 [1,1,0,0,0,0|2,0,0]=4 1194 B11R1.86 CN(C)Cc1ncccc1F 2230a_100102631434_100000104219 [1,1,0,0,0,0|2,0,0]=4 1195 B11R1.86 CN(C)Cc1ncccc1F 269982a_100102631434_100000104219 [1,1,0,0,0,0|2,0,0]=4 1196 B11R1.86 CN(C)Cc1ncccc1F 270004a_100102631434_100011934734 [1,1,0,0,0,0|2,0,0]=4 1197 B11R1.86 CN([13CH3])Cc1ccccc1Br 2230a_100000184654_200025704644 [1,1,0,0,0,0|1,0,0]=3 1198 B11R1.86 CN([13CH3])Cc1ccccc1Br 269982a_100000184654_200025704644 [1,1,0,0,0,0|1,0,0]=3 1199 B11R1.86 CN([13CH3])Cc1ccccc1Cl 2230a_100000184507_200025704644 [1,1,0,0,0,0|1,0,0]=3 1200 B11R1.86 CN([13CH3])Cc1ccccc1Cl 269982a_100000184507_200025704644 [1,1,0,0,0,0|1,0,0]=3 1201 B11R1.86 CN([13CH3])Cc1ccccc1F 2230a_100000742528_200025704644 [1,1,0,0,0,0|1,0,0]=3 1202 B11R1.86 CN([13CH3])Cc1ccccc1F 269982a_100000742528_200025704644 [1,1,0,0,0,0|1,0,0]=3 1203 B11R1.86 CN([13CH3])Cc1ccccc1F 34a_100000742528_200025704644 [1,1,0,0,0,0|1,0,0]=3 1204 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [1,1,0,0,0,0|1,0,0]=3 1205 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [1,1,0,0,0,0|1,0,0]=3 1206 B11R1.86 CN([13CH3])Cc1cccnc1Cl 2230a_103496529121_200025704644 [1,1,0,0,0,0|2,0,0]=4 1207 B11R1.86 CN([13CH3])Cc1cccnc1Cl 269982a_103496529121_200025704644 [1,1,0,0,0,0|2,0,0]=4 1208 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [1,1,0,0,0,0|0,0,2]=4 1209 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [1,1,0,0,0,0|1,0,0]=3 1210 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [1,1,0,0,0,0|1,0,0]=3 1211 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [1,1,0,0,0,0|1,0,0]=3 1212 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [1,1,0,0,0,0|1,0,0]=3 1213 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [1,1,0,0,0,0|1,0,0]=3 1214 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [1,1,0,0,0,0|1,0,0]=3 1215 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [1,1,0,0,0,0|1,0,0]=3 1216 B11R1.86 Cc1ccccc1NC(C)C 34a_100015192222_100000210206 [1,1,0,0,0,0|1,0,0]=3 1217 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [1,1,0,0,0,0|1,0,0]=3 1218 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [1,1,0,0,0,0|1,0,0]=3 1219 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210206_100000210755 [1,1,0,0,0,0|1,0,0]=3 1220 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210755_100000210206 [1,1,0,0,0,0|1,0,0]=3 1221 B11R1.86 Cc1cccnc1CN(C)C 2230a_100102631434_100000696600 [1,1,0,0,0,0|2,0,0]=4 1222 B11R1.86 Cc1cccnc1CN(C)C 269982a_100102631434_100000696600 [1,1,0,0,0,0|2,0,0]=4 1223 B11R1.86 Cc1cccnc1CN(C)C 270004a_100102631434_100000698913 [1,1,0,0,0,0|2,0,0]=4 1224 B11R1.86 Cc1cccnc1SC(C)C 62a_100000210206_100000751373 [1,1,0,0,0,0|2,0,0]=4 1225 B11R1.86 Cc1cccnc1SC(C)C 62a_100000751373_100000210206 [1,1,0,0,0,0|2,0,0]=4 1226 B11R1.86 Cc1ccncc1CN(C)C 2230a_100102631434_100000690890 [1,1,0,0,0,0|2,0,0]=4 1227 B11R1.86 Cc1ccncc1CN(C)C 269982a_100102631434_100000690890 [1,1,0,0,0,0|2,0,0]=4 1228 B11R1.86 Cc1ccncc1CN(C)C 270004a_100102631434_100000685662 [1,1,0,0,0,0|2,0,0]=4 1229 B11R1.86 Cc1ccncc1OC(C)C 34a_100011997053_100000210206 [1,1,0,0,0,0|2,0,0]=4 1230 B11R1.86 Cc1ccncc1OC(C)C 7a_100011997053_100000210206 [1,1,0,0,0,0|2,0,0]=4 1231 B11R1.86 Cc1ccncc1SC(C)C 62a_100000210206_100000761580 [1,1,0,0,0,0|2,0,0]=4 1232 B11R1.86 Cc1ccncc1SC(C)C 62a_100000761580_100000210206 [1,1,0,0,0,0|2,0,0]=4 1233 B11R1.86 Cc1cnccc1CN(C)C 2230a_100015187836_200000210301 [1,1,0,0,0,0|2,0,0]=4 1234 B11R1.86 Cc1cnccc1CN(C)C 2230a_100102631434_100020672808 [1,1,0,0,0,0|2,0,0]=4 1235 B11R1.86 Cc1cnccc1CN(C)C 269982a_100015187836_200000210301 [1,1,0,0,0,0|2,0,0]=4 1236 B11R1.86 Cc1cnccc1CN(C)C 269982a_100102631434_100020672808 [1,1,0,0,0,0|2,0,0]=4 1237 B11R1.86 Cc1cnccc1CN(C)[13CH3] 2230a_100015187836_200025704644 [1,1,0,0,0,0|2,0,0]=4 1238 B11R1.86 Cc1cnccc1CN(C)[13CH3] 269982a_100015187836_200025704644 [1,1,0,0,0,0|2,0,0]=4 1239 B11R1.86 Cc1cnccc1NC(C)C 27a_100138425928_100000765111 [1,1,0,0,0,0|2,0,0]=4 1240 B11R1.86 Cc1cnccc1OC(C)C 34a_100000694293_100000210206 [1,1,0,0,0,0|2,0,0]=4 1241 B11R1.86 Cc1cnccc1SC(C)C 62a_100000210206_100000765111 [1,1,0,0,0,0|2,0,0]=4 1242 B11R1.86 Cc1cnccc1SC(C)C 62a_100000765111_100000210206 [1,1,0,0,0,0|2,0,0]=4 1243 B11R1.86 Cc1ncccc1CN(C)C 2230a_100102631434_100000732876 [1,1,0,0,0,0|2,0,0]=4 1244 B11R1.86 Cc1ncccc1CN(C)C 2230a_200011875998_200000210301 [1,1,0,0,0,0|2,0,0]=4 1245 B11R1.86 Cc1ncccc1CN(C)C 269982a_100102631434_100000732876 [1,1,0,0,0,0|2,0,0]=4 1246 B11R1.86 Cc1ncccc1CN(C)C 269982a_200011875998_200000210301 [1,1,0,0,0,0|2,0,0]=4 1247 B11R1.86 Cc1ncccc1CN(C)C 270004a_100102631434_100000751968 [1,1,0,0,0,0|2,0,0]=4 1248 B11R1.86 Cc1ncccc1CN(C)[13CH3] 2230a_200011875998_200025704644 [1,1,0,0,0,0|2,0,0]=4 1249 B11R1.86 Cc1ncccc1CN(C)[13CH3] 269982a_200011875998_200025704644 [1,1,0,0,0,0|2,0,0]=4 1250 B11R1.86 Cc1ncccc1OC(C)C 34a_100000745507_100000210206 [1,1,0,0,0,0|2,0,0]=4 1251 B11R1.86 Cc1ncccc1OC(C)C 7a_100000745507_100000210206 [1,1,0,0,0,0|2,0,0]=4 1252 B11R1.86 Cc1ncccc1SC(C)C 62a_100000210206_100000751574 [1,1,0,0,0,0|2,0,0]=4 1253 B11R1.86 Cc1ncccc1SC(C)C 62a_100000751574_100000210206 [1,1,0,0,0,0|2,0,0]=4 1254 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [1,1,0,0,0,0|0,0,2]=4 1255 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [1,1,0,0,0,0|0,0,2]=4 1256 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [1,1,0,0,0,0|0,0,2]=4 1257 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [1,1,0,0,0,0|0,0,2]=4 1258 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [1,1,0,0,0,0|0,0,2]=4 1259 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [1,1,0,0,0,0|0,0,2]=4 1260 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [1,1,0,0,0,0|0,0,2]=4 1261 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [1,1,0,0,0,0|0,0,2]=4 1262 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [1,1,0,0,0,0|0,0,2]=4 1263 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [1,1,0,0,0,0|0,0,2]=4 1264 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [1,1,0,0,0,0|0,0,2]=4 1265 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [1,1,0,0,0,0|0,0,2]=4 1266 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [1,1,0,0,0,0|0,0,2]=4 1267 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [1,1,0,0,0,0|0,0,2]=4 1268 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [1,1,0,0,0,0|0,0,2]=4 1269 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [1,1,0,0,0,0|0,0,2]=4 1270 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [1,1,0,0,0,0|0,0,2]=4 1271 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [1,1,0,0,0,0|0,0,2]=4 1272 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [1,1,0,0,0,0|0,0,2]=4 1273 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [1,1,0,0,0,0|0,0,2]=4 1274 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [1,1,0,0,0,0|0,0,2]=4 1275 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [1,1,0,0,0,0|0,0,2]=4 1276 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,1,0,0,0,0|0,0,2]=4 1277 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,1,0,0,0,0|0,0,2]=4 1278 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,1,0,0,0,0|0,0,2]=4 1279 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [1,1,0,0,0,0|0,0,0]=2 1280 B11R1.157 CC(C)Nc1cc(ccn1)F 27a_100138425928_100000764206 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.157 CC(C)Nc1cc(ccn1)O 271570a_203496583355_200012354261 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.157 CC(C)Nc1cc[nH]c(=O)c1 27a_100138425928_100000061649 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.157 CC(C)Nc1cccc(c1)Br 34a_100000210019_100000210206 [1,1,0,0,0,0|1,0,0]=3 1284 B11R1.157 CC(C)Nc1cccc(c1)Cl 34a_100000185859_100000210206 [1,1,0,0,0,0|1,0,0]=3 1285 B11R1.157 CC(C)Nc1cccc(c1)F 34a_100000210047_100000210206 [1,1,0,0,0,0|1,0,0]=3 1286 B11R1.157 CC(C)Nc1cccc(c1)I 34a_100000211102_100000210206 [1,1,0,0,0,0|1,0,0]=3 1287 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [1,1,0,0,0,0|1,0,0]=3 1288 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [1,1,0,0,0,0|1,0,0]=3 1289 B11R1.157 CC(C)Nc1cccc(n1)F 27a_100138425928_100009815982 [1,1,0,0,0,0|2,0,0]=4 1290 B11R1.157 CC(C)Nc1ccnc(c1)F 27a_100138425928_100009816116 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.157 CC(C)Oc1cc(ccn1)O 271570a_203496583355_100010247003 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.157 CC(C)Oc1cc[nH]c(=O)c1 34a_100000032262_100000210206 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000210206 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000210206 [1,1,0,0,0,0|2,0,0]=4 1295 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 34a_100000033347_100000210206 [1,1,0,0,0,0|2,0,0]=4 1296 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [1,1,0,0,0,0|1,0,0]=3 1297 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [1,1,0,0,0,0|1,0,0]=3 1298 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [1,1,0,0,0,0|1,0,0]=3 1299 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [1,1,0,0,0,0|1,0,0]=3 1300 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [1,1,0,0,0,0|1,0,0]=3 1301 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [1,1,0,0,0,0|1,0,0]=3 1302 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [1,1,0,0,0,0|1,0,0]=3 1303 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [1,1,0,0,0,0|1,0,0]=3 1304 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [1,1,0,0,0,0|1,0,0]=3 1305 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [1,1,0,0,0,0|1,0,0]=3 1306 B11R1.157 CC(C)Oc1cccc(n1)F 34a_100011432558_100000210206 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.157 CC(C)Oc1cccc(n1)O 271570a_203496583355_100000703025 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.157 CC(C)Oc1ccnc(c1)Cl 34a_100000762945_100000210206 [1,1,0,0,0,0|2,0,0]=4 1309 B11R1.157 CC(C)Oc1ccnc(c1)F 34a_100000732698_100000210206 [1,1,0,0,0,0|2,0,0]=4 1310 B11R1.157 CC(C)Oc1ccnc(c1)N 34a_100011834064_100000210206 [1,1,0,0,0,0|2,0,0]=4 1311 B11R1.157 CC(C)Oc1cncc(c1)Br 34a_100000754920_100000210206 [1,1,0,0,0,0|2,0,0]=4 1312 B11R1.157 CC(C)Oc1cncc(c1)Br 7a_100000754920_100000210206 [1,1,0,0,0,0|2,0,0]=4 1313 B11R1.157 CC(C)Oc1cncc(c1)Cl 7a_100000032511_100000210206 [1,1,0,0,0,0|2,0,0]=4 1314 B11R1.157 CC(C)Oc1cncc(c1)F 34a_100011830296_100000210206 [1,1,0,0,0,0|2,0,0]=4 1315 B11R1.157 CC(C)Oc1cncc(c1)F 7a_100011830296_100000210206 [1,1,0,0,0,0|2,0,0]=4 1316 B11R1.157 CC(C)Oc1cncc(c1)N 34a_100011997051_100000210206 [1,1,0,0,0,0|2,0,0]=4 1317 B11R1.157 CC(C)Oc1cncc(c1)O 271570a_203496583355_100012029599 [1,1,0,0,0,0|2,0,0]=4 1318 B11R1.157 CC(C)Sc1cc(=O)cc[nH]1 62a_100009817434_100000210206 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.157 CC(C)Sc1cc(ccn1)Cl 62a_100000210206_100010167805 [1,1,0,0,0,0|2,0,0]=4 1320 B11R1.157 CC(C)Sc1cc(ccn1)Cl 62a_100010167805_100000210206 [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.157 CC(C)Sc1cc(ccn1)F 62a_100000210206_100000764206 [1,1,0,0,0,0|2,0,0]=4 1322 B11R1.157 CC(C)Sc1cc(ccn1)F 62a_100000764206_100000210206 [1,1,0,0,0,0|2,0,0]=4 1323 B11R1.157 CC(C)Sc1cc(ccn1)N 62a_100000210206_100009814236 [1,1,0,0,0,0|2,0,0]=4 1324 B11R1.157 CC(C)Sc1cc(ccn1)N 62a_100009814236_100000210206 [1,1,0,0,0,0|2,0,0]=4 1325 B11R1.157 CC(C)Sc1cc(ccn1)O 62a_100000210206_100000762945 [1,1,0,0,0,0|2,0,0]=4 1326 B11R1.157 CC(C)Sc1cc[nH]c(=O)c1 62a_100000210206_100009816521 [1,1,0,0,0,0|2,0,0]=4 1327 B11R1.157 CC(C)Sc1cc[nH]c(=O)c1 62a_100009816521_100000210206 [1,1,0,0,0,0|2,0,0]=4 1328 B11R1.157 CC(C)Sc1ccc[n+](c1)C 62a_100000210206_100009996589 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.157 CC(C)Sc1ccc[n+](c1)C 62a_100009996589_100000210206 [1,1,0,0,0,0|2,0,0]=4 1330 B11R1.157 CC(C)Sc1ccc[n+](c1)[O-] 62a_100000210206_100009815978 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.157 CC(C)Sc1cccc(=O)[nH]1 62a_100000210206_100000752884 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000210206_100000691529 [1,1,0,0,0,0|1,0,0]=3 1333 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000691529_100000210206 [1,1,0,0,0,0|1,0,0]=3 1334 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000210206_100000699651 [1,1,0,0,0,0|1,0,0]=3 1335 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000699651_100000210206 [1,1,0,0,0,0|1,0,0]=3 1336 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000210206_100000685547 [1,1,0,0,0,0|1,0,0]=3 1337 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000685547_100000210206 [1,1,0,0,0,0|1,0,0]=3 1338 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210019_100000210206 [1,1,0,0,0,0|1,0,0]=3 1339 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210206_100000210019 [1,1,0,0,0,0|1,0,0]=3 1340 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [1,1,0,0,0,0|1,0,0]=3 1341 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [1,1,0,0,0,0|1,0,0]=3 1342 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_100000210206_114929384022 [1,1,0,0,0,0|1,0,0]=3 1343 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_114929384022_100000210206 [1,1,0,0,0,0|1,0,0]=3 1344 B11R1.157 CC(C)Sc1cccc(n1)Br 62a_100000210206_100000684672 [1,1,0,0,0,0|2,0,0]=4 1345 B11R1.157 CC(C)Sc1cccc(n1)Br 62a_100000684672_100000210206 [1,1,0,0,0,0|2,0,0]=4 1346 B11R1.157 CC(C)Sc1cccc(n1)Cl 62a_100000051397_100000210206 [1,1,0,0,0,0|2,0,0]=4 1347 B11R1.157 CC(C)Sc1cccc(n1)Cl 62a_100000210206_100000051397 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.157 CC(C)Sc1cccc(n1)F 62a_100000210206_100009815982 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.157 CC(C)Sc1cccc(n1)F 62a_100009815982_100000210206 [1,1,0,0,0,0|2,0,0]=4 1350 B11R1.157 CC(C)Sc1cccc(n1)N 62a_100000210206_100000740741 [1,1,0,0,0,0|2,0,0]=4 1351 B11R1.157 CC(C)Sc1cccc(n1)N 62a_100000740741_100000210206 [1,1,0,0,0,0|2,0,0]=4 1352 B11R1.157 CC(C)Sc1ccnc(c1)Br 62a_100000210206_100009814637 [1,1,0,0,0,0|2,0,0]=4 1353 B11R1.157 CC(C)Sc1ccnc(c1)Br 62a_100009814637_100000210206 [1,1,0,0,0,0|2,0,0]=4 1354 B11R1.157 CC(C)Sc1ccnc(c1)Cl 62a_100000035001_100000210206 [1,1,0,0,0,0|2,0,0]=4 1355 B11R1.157 CC(C)Sc1ccnc(c1)Cl 62a_100000210206_100000035001 [1,1,0,0,0,0|2,0,0]=4 1356 B11R1.157 CC(C)Sc1ccnc(c1)F 62a_100000210206_100009816116 [1,1,0,0,0,0|2,0,0]=4 1357 B11R1.157 CC(C)Sc1ccnc(c1)F 62a_100009816116_100000210206 [1,1,0,0,0,0|2,0,0]=4 1358 B11R1.157 CC(C)Sc1ccnc(c1)N 62a_100000049665_100000210206 [1,1,0,0,0,0|2,0,0]=4 1359 B11R1.157 CC(C)Sc1ccnc(c1)N 62a_100000210206_100000049665 [1,1,0,0,0,0|2,0,0]=4 1360 B11R1.157 CC(C)Sc1cncc(c1)Br 62a_100000210206_100000728054 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.157 CC(C)Sc1cncc(c1)Br 62a_100000728054_100000210206 [1,1,0,0,0,0|2,0,0]=4 1362 B11R1.157 CC(C)Sc1cncc(c1)Cl 62a_100000049639_100000210206 [1,1,0,0,0,0|2,0,0]=4 1363 B11R1.157 CC(C)Sc1cncc(c1)Cl 62a_100000210206_100000049639 [1,1,0,0,0,0|2,0,0]=4 1364 B11R1.157 CC(C)Sc1cncc(c1)F 62a_100000210206_100000744099 [1,1,0,0,0,0|2,0,0]=4 1365 B11R1.157 CC(C)Sc1cncc(c1)F 62a_100000744099_100000210206 [1,1,0,0,0,0|2,0,0]=4 1366 B11R1.157 CC(C)Sc1cncc(c1)N 62a_100000210206_100000687067 [1,1,0,0,0,0|2,0,0]=4 1367 B11R1.157 CC(C)Sc1cncc(c1)N 62a_100000687067_100000210206 [1,1,0,0,0,0|2,0,0]=4 1368 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000210206_100000754920 [1,1,0,0,0,0|2,0,0]=4 1369 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000754920_100000210206 [1,1,0,0,0,0|2,0,0]=4 1370 B11R1.157 CN(C)Cc1cc(ccn1)Br 2230a_100102631434_100010173614 [1,1,0,0,0,0|2,0,0]=4 1371 B11R1.157 CN(C)Cc1cc(ccn1)Br 269982a_100102631434_100010173614 [1,1,0,0,0,0|2,0,0]=4 1372 B11R1.157 CN(C)Cc1cc(ccn1)Br 270004a_100102631434_100009818557 [1,1,0,0,0,0|2,0,0]=4 1373 B11R1.157 CN(C)Cc1cc(ccn1)Cl 2230a_100102631434_100016988179 [1,1,0,0,0,0|2,0,0]=4 1374 B11R1.157 CN(C)Cc1cc(ccn1)Cl 2230a_100102954512_200000210301 [1,1,0,0,0,0|2,0,0]=4 1375 B11R1.157 CN(C)Cc1cc(ccn1)Cl 269982a_100102631434_100016988179 [1,1,0,0,0,0|2,0,0]=4 1376 B11R1.157 CN(C)Cc1cc(ccn1)Cl 269982a_100102954512_200000210301 [1,1,0,0,0,0|2,0,0]=4 1377 B11R1.157 CN(C)Cc1cc(ccn1)Cl 270004a_100102631434_100011998288 [1,1,0,0,0,0|2,0,0]=4 1378 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [1,1,0,0,0,0|1,0,0]=3 1379 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [1,1,0,0,0,0|1,0,0]=3 1380 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [1,1,0,0,0,0|1,0,0]=3 1381 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [1,1,0,0,0,0|1,0,0]=3 1382 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [1,1,0,0,0,0|1,0,0]=3 1383 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [1,1,0,0,0,0|1,0,0]=3 1384 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [1,1,0,0,0,0|1,0,0]=3 1385 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [1,1,0,0,0,0|1,0,0]=3 1386 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [1,1,0,0,0,0|1,0,0]=3 1387 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [1,1,0,0,0,0|1,0,0]=3 1388 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [1,1,0,0,0,0|1,0,0]=3 1389 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [1,1,0,0,0,0|1,0,0]=3 1390 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [1,1,0,0,0,0|1,0,0]=3 1391 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [1,1,0,0,0,0|1,0,0]=3 1392 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [1,1,0,0,0,0|1,0,0]=3 1393 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [1,1,0,0,0,0|1,0,0]=3 1394 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [1,1,0,0,0,0|1,0,0]=3 1395 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [1,1,0,0,0,0|1,0,0]=3 1396 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [1,1,0,0,0,0|1,0,0]=3 1397 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [1,1,0,0,0,0|1,0,0]=3 1398 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [1,1,0,0,0,0|1,0,0]=3 1399 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [1,1,0,0,0,0|1,0,0]=3 1400 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [1,1,0,0,0,0|1,0,0]=3 1401 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [1,1,0,0,0,0|1,0,0]=3 1402 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [1,1,0,0,0,0|1,0,0]=3 1403 B11R1.157 CN(C)Cc1cccc(n1)Br 2230a_100102631434_100009889011 [1,1,0,0,0,0|2,0,0]=4 1404 B11R1.157 CN(C)Cc1cccc(n1)Br 2230a_106354212997_200000210301 [1,1,0,0,0,0|2,0,0]=4 1405 B11R1.157 CN(C)Cc1cccc(n1)Br 269982a_100102631434_100009889011 [1,1,0,0,0,0|2,0,0]=4 1406 B11R1.157 CN(C)Cc1cccc(n1)Br 269982a_106354212997_200000210301 [1,1,0,0,0,0|2,0,0]=4 1407 B11R1.157 CN(C)Cc1cccc(n1)Br 270004a_100102631434_100000688028 [1,1,0,0,0,0|2,0,0]=4 1408 B11R1.157 CN(C)Cc1cccc(n1)Cl 2230a_100102631434_100000086093 [1,1,0,0,0,0|2,0,0]=4 1409 B11R1.157 CN(C)Cc1cccc(n1)Cl 269982a_100102631434_100000086093 [1,1,0,0,0,0|2,0,0]=4 1410 B11R1.157 CN(C)Cc1cccc(n1)Cl 270004a_100102631434_100011361687 [1,1,0,0,0,0|2,0,0]=4 1411 B11R1.157 CN(C)Cc1cccc(n1)F 2230a_100102631434_100009819644 [1,1,0,0,0,0|2,0,0]=4 1412 B11R1.157 CN(C)Cc1cccc(n1)F 269982a_100102631434_100009819644 [1,1,0,0,0,0|2,0,0]=4 1413 B11R1.157 CN(C)Cc1cccc(n1)F 270004a_100102631434_100000050434 [1,1,0,0,0,0|2,0,0]=4 1414 B11R1.157 CN(C)Cc1ccnc(c1)Br 2230a_100102631434_100010243470 [1,1,0,0,0,0|2,0,0]=4 1415 B11R1.157 CN(C)Cc1ccnc(c1)Br 269982a_100102631434_100010254460 [1,1,0,0,0,0|2,0,0]=4 1416 B11R1.157 CN(C)Cc1ccnc(c1)Br 270004a_100102631434_100009814634 [1,1,0,0,0,0|2,0,0]=4 1417 B11R1.157 CN(C)Cc1ccnc(c1)Cl 2230a_100102631434_100000764220 [1,1,0,0,0,0|2,0,0]=4 1418 B11R1.157 CN(C)Cc1ccnc(c1)Cl 269982a_100102631434_100000764220 [1,1,0,0,0,0|2,0,0]=4 1419 B11R1.157 CN(C)Cc1ccnc(c1)Cl 270004a_100102631434_100011290808 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.157 CN(C)Cc1ccnc(c1)F 270004a_100102631434_100000068331 [1,1,0,0,0,0|2,0,0]=4 1421 B11R1.157 CN(C)Cc1cncc(c1)Br 2230a_100102631434_100000738771 [1,1,0,0,0,0|2,0,0]=4 1422 B11R1.157 CN(C)Cc1cncc(c1)Br 2230a_103549770560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1423 B11R1.157 CN(C)Cc1cncc(c1)Br 269982a_100102631434_100000738771 [1,1,0,0,0,0|2,0,0]=4 1424 B11R1.157 CN(C)Cc1cncc(c1)Br 269982a_103549770560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1425 B11R1.157 CN(C)Cc1cncc(c1)Br 270004a_100102631434_100000687066 [1,1,0,0,0,0|2,0,0]=4 1426 B11R1.157 CN(C)Cc1cncc(c1)Cl 2230a_100102631434_100016992070 [1,1,0,0,0,0|2,0,0]=4 1427 B11R1.157 CN(C)Cc1cncc(c1)Cl 269982a_100102631434_100016992070 [1,1,0,0,0,0|2,0,0]=4 1428 B11R1.157 CN(C)Cc1cncc(c1)Cl 270004a_100102631434_100000088910 [1,1,0,0,0,0|2,0,0]=4 1429 B11R1.157 CN(C)Cc1cncc(c1)F 2230a_100102631434_100000725299 [1,1,0,0,0,0|2,0,0]=4 1430 B11R1.157 CN(C)Cc1cncc(c1)F 269982a_100102631434_100000725299 [1,1,0,0,0,0|2,0,0]=4 1431 B11R1.157 CN(C)Cc1cncc(c1)F 270004a_100102631434_100011361476 [1,1,0,0,0,0|2,0,0]=4 1432 B11R1.157 CN(C)Cc1cncc(c1)O 270004a_100102631434_100012187055 [1,1,0,0,0,0|2,0,0]=4 1433 B11R1.157 CN([13CH3])Cc1cc(ccn1)Cl 2230a_100102954512_200025704644 [1,1,0,0,0,0|2,0,0]=4 1434 B11R1.157 CN([13CH3])Cc1cc(ccn1)Cl 269982a_100102954512_200025704644 [1,1,0,0,0,0|2,0,0]=4 1435 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [1,1,0,0,0,0|1,0,0]=3 1436 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [1,1,0,0,0,0|1,0,0]=3 1437 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [1,1,0,0,0,0|1,0,0]=3 1438 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [1,1,0,0,0,0|1,0,0]=3 1439 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [1,1,0,0,0,0|1,0,0]=3 1440 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [1,1,0,0,0,0|1,0,0]=3 1441 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [1,1,0,0,0,0|1,0,0]=3 1442 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [1,1,0,0,0,0|1,0,0]=3 1443 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [1,1,0,0,0,0|1,0,0]=3 1444 B11R1.157 CN([13CH3])Cc1cccc(n1)Br 2230a_106354212997_200025704644 [1,1,0,0,0,0|2,0,0]=4 1445 B11R1.157 CN([13CH3])Cc1cccc(n1)Br 269982a_106354212997_200025704644 [1,1,0,0,0,0|2,0,0]=4 1446 B11R1.157 CN([13CH3])Cc1cncc(c1)Br 2230a_103549770560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1447 B11R1.157 CN([13CH3])Cc1cncc(c1)Br 269982a_103549770560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1448 B11R1.157 Cc1cc(ccn1)CN(C)C 2230a_100102631434_200020672517 [1,1,0,0,0,0|2,0,0]=4 1449 B11R1.157 Cc1cc(ccn1)CN(C)C 269982a_100102631434_200020672517 [1,1,0,0,0,0|2,0,0]=4 1450 B11R1.157 Cc1cc(ccn1)CN(C)C 270004a_100102631434_100011361630 [1,1,0,0,0,0|2,0,0]=4 1451 B11R1.157 Cc1cc(ccn1)NC(C)C 27a_100138425928_100000758586 [1,1,0,0,0,0|2,0,0]=4 1452 B11R1.157 Cc1cc(ccn1)OC(C)C 34a_100000688365_100000210206 [1,1,0,0,0,0|2,0,0]=4 1453 B11R1.157 Cc1cc(ccn1)SC(C)C 62a_100000210206_100000758586 [1,1,0,0,0,0|2,0,0]=4 1454 B11R1.157 Cc1cc(ccn1)SC(C)C 62a_100000758586_100000210206 [1,1,0,0,0,0|2,0,0]=4 1455 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [1,1,0,0,0,0|0,0,2]=4 1456 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [1,1,0,0,0,0|1,0,0]=3 1457 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [1,1,0,0,0,0|1,0,0]=3 1458 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [1,1,0,0,0,0|1,0,0]=3 1459 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [1,1,0,0,0,0|1,0,0]=3 1460 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [1,1,0,0,0,0|1,0,0]=3 1461 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [1,1,0,0,0,0|1,0,0]=3 1462 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [1,1,0,0,0,0|1,0,0]=3 1463 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [1,1,0,0,0,0|1,0,0]=3 1464 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [1,1,0,0,0,0|1,0,0]=3 1465 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [1,1,0,0,0,0|1,0,0]=3 1466 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [1,1,0,0,0,0|1,0,0]=3 1467 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [1,1,0,0,0,0|1,0,0]=3 1468 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [1,1,0,0,0,0|1,0,0]=3 1469 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [1,1,0,0,0,0|1,0,0]=3 1470 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [1,1,0,0,0,0|1,0,0]=3 1471 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100000687132_200000210301 [1,1,0,0,0,0|2,0,0]=4 1472 B11R1.157 Cc1cccc(n1)CN(C)C 2230a_100102631434_100000757606 [1,1,0,0,0,0|2,0,0]=4 1473 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100000687132_200000210301 [1,1,0,0,0,0|2,0,0]=4 1474 B11R1.157 Cc1cccc(n1)CN(C)C 269982a_100102631434_100000757606 [1,1,0,0,0,0|2,0,0]=4 1475 B11R1.157 Cc1cccc(n1)CN(C)C 270004a_100102631434_100011215050 [1,1,0,0,0,0|2,0,0]=4 1476 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 2230a_100000687132_200025704644 [1,1,0,0,0,0|2,0,0]=4 1477 B11R1.157 Cc1cccc(n1)CN(C)[13CH3] 269982a_100000687132_200025704644 [1,1,0,0,0,0|2,0,0]=4 1478 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000210206_100000742759 [1,1,0,0,0,0|2,0,0]=4 1479 B11R1.157 Cc1cccc(n1)SC(C)C 62a_100000742759_100000210206 [1,1,0,0,0,0|2,0,0]=4 1480 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_100102631434_100000718516 [1,1,0,0,0,0|2,0,0]=4 1481 B11R1.157 Cc1ccnc(c1)CN(C)C 2230a_106354213154_200000210301 [1,1,0,0,0,0|2,0,0]=4 1482 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_100102631434_100000718516 [1,1,0,0,0,0|2,0,0]=4 1483 B11R1.157 Cc1ccnc(c1)CN(C)C 269982a_106354213154_200000210301 [1,1,0,0,0,0|2,0,0]=4 1484 B11R1.157 Cc1ccnc(c1)CN(C)C 270004a_100102631434_100011361488 [1,1,0,0,0,0|2,0,0]=4 1485 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 2230a_106354213154_200025704644 [1,1,0,0,0,0|2,0,0]=4 1486 B11R1.157 Cc1ccnc(c1)CN(C)[13CH3] 269982a_106354213154_200025704644 [1,1,0,0,0,0|2,0,0]=4 1487 B11R1.157 Cc1ccnc(c1)SC(C)C 62a_100000210206_100000750283 [1,1,0,0,0,0|2,0,0]=4 1488 B11R1.157 Cc1ccnc(c1)SC(C)C 62a_100000750283_100000210206 [1,1,0,0,0,0|2,0,0]=4 1489 B11R1.157 Cc1cncc(c1)CN(C)C 2230a_100102631434_100000716715 [1,1,0,0,0,0|2,0,0]=4 1490 B11R1.157 Cc1cncc(c1)CN(C)C 269982a_100102631434_100000716715 [1,1,0,0,0,0|2,0,0]=4 1491 B11R1.157 Cc1cncc(c1)CN(C)C 270004a_100102631434_100011998712 [1,1,0,0,0,0|2,0,0]=4 1492 B11R1.157 Cc1cncc(c1)OC(C)C 34a_100011830280_100000210206 [1,1,0,0,0,0|2,0,0]=4 1493 B11R1.157 Cc1cncc(c1)OC(C)C 7a_100011830280_100000210206 [1,1,0,0,0,0|2,0,0]=4 1494 B11R1.157 Cc1cncc(c1)SC(C)C 62a_100000210206_100000760492 [1,1,0,0,0,0|2,0,0]=4 1495 B11R1.157 Cc1cncc(c1)SC(C)C 62a_100000760492_100000210206 [1,1,0,0,0,0|2,0,0]=4 1496 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [1,1,0,0,0,0|0,0,2]=4 1497 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [1,1,0,0,0,0|0,0,2]=4 1498 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [1,1,0,0,0,0|0,0,2]=4 1499 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [1,1,0,0,0,0|0,0,2]=4 1500 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,1,0,0,0,0|0,0,2]=4 1501 B11R1.7 CC(C)(N[13CH3])c1ccccc1 2230a_100011218174_200025704644 [0,1,0,0,1,0|1,0,0]=3 1502 B11R1.7 CC(C)(N[13CH3])c1ccccn1 2230a_100011999416_200025704644 [0,1,0,0,1,0|2,0,0]=4 1503 B11R1.7 CC(C)(N[13CH3])c1cccnc1 2230a_100011376175_200025704644 [0,1,0,0,1,0|2,0,0]=4 1504 B11R1.7 CC(C)(O[13CH3])c1ccccc1 7a_100000694644_200025704644 [0,1,0,0,1,0|0,0,0]=2 1505 B11R1.7 CC(C)(O[13CH3])c1ccccn1 7a_100000041474_200025704644 [0,1,0,0,1,0|1,0,0]=3 1506 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_100000034625_200025704644 [0,1,0,0,1,0|0,1,0]=3 1507 B11R1.7 CC(C)(S[13CH3])c1ccccc1 62a_200025704644_100000034625 [0,1,0,0,1,0|0,1,0]=3 1508 B11R1.7 CNC(C)(C)c1ccccc1 2230a_100011218174_200000210301 [0,1,0,0,1,0|1,0,0]=3 1509 B11R1.7 CNC(C)(C)c1ccccc1 2230a_106832991635_100000034625 [0,1,0,0,1,0|1,0,0]=3 1510 B11R1.7 CNC(C)(C)c1ccccn1 2230a_100011999416_200000210301 [0,1,0,0,1,0|2,0,0]=4 1511 B11R1.7 CNC(C)(C)c1cccnc1 2230a_100011376175_200000210301 [0,1,0,0,1,0|2,0,0]=4 1512 B11R1.7 CNC(F)(F)c1ccccc1 7a_106832991635_100000036403 [0,1,0,0,1,0|2,0,0]=4 1513 B11R1.7 COC(C)(C)c1ccccc1 7a_100000694644_200000210301 [0,1,0,0,1,0|0,0,0]=2 1514 B11R1.7 COC(C)(C)c1ccccn1 7a_100000041474_200000210301 [0,1,0,0,1,0|1,0,0]=3 1515 B11R1.7 CSC(C)(C)c1ccccc1 62a_100000034625_200000210301 [0,1,0,0,1,0|0,1,0]=3 1516 B11R1.7 CSC(C)(C)c1ccccc1 62a_200000210301_100000034625 [0,1,0,0,1,0|0,1,0]=3 1517 B11R1.7 CSC(F)(F)c1ccccc1 62a_200000210301_100000036403 [0,1,0,0,1,0|2,0,0]=4 1518 B11R1.7 [13CH3]SC(F)(F)c1ccccc1 62a_200025704644_100000036403 [0,1,0,0,1,0|2,0,0]=4 1519 B11R1.19 CC(C)(C)c1ccc(cc1)O 271570a_203496583355_100011215385 [0,1,0,0,1,0|1,0,0]=3 1520 B11R1.19 CC(C)(C)c1ccc(cn1)O 271570a_203496583355_100010245212 [0,1,0,0,1,0|2,0,0]=4 1521 B11R1.19 CC(C)(C)c1ccc(nc1)O 271570a_203496583355_100000686854 [0,1,0,0,1,0|2,0,0]=4 1522 B11R1.19 CC(C)(N)c1ccc(cc1)O 271570a_203496583355_100000739617 [0,1,0,0,1,0|1,0,0]=3 1523 B11R1.19 CC(C)(O)c1ccc(cc1)O 271570a_203496583355_100000753367 [0,1,0,0,1,0|0,0,0]=2 1524 B11R1.19 CC(C)(O)c1ccc(cn1)O 271570a_203496583355_100010246419 [0,1,0,0,1,0|1,0,0]=3 1525 B11R1.19 CC(C)(O)c1ccc(nc1)O 271570a_203496583355_100010080785 [0,1,0,0,1,0|1,0,0]=3 1526 B11R1.19 CC(C)(O)c1ncc(cn1)O 271570a_203496583355_100010115376 [0,1,0,0,1,0|2,0,0]=4 1527 B11R1.19 CC(F)(F)c1ccc(cc1)O 271570a_203496583355_100009817129 [0,1,0,0,1,0|2,0,0]=4 1528 B11R1.19 C[Si](C)(C)c1ccc(cc1)O 271570a_203496583355_100009813420 [0,1,0,0,1,0|1,1,0]=4 1529 B11R1.87 CC(C)(C)c1ccccc1O 271570a_203496583355_100012339570 [0,1,0,0,1,0|1,0,0]=3 1530 B11R1.87 CC(C)(N)c1ccccc1O 271570a_203496583355_100020606264 [0,1,0,0,1,0|1,0,0]=3 1531 B11R1.87 CC(C)(O)c1ccccc1O 271570a_203496583355_100011346021 [0,1,0,0,1,0|0,0,0]=2 1532 B11R1.87 CC(C)(O)c1cccnc1O 271570a_203496583355_100010080783 [0,1,0,0,1,0|1,0,0]=3 1533 B11R1.87 CC(C)(O)c1ncccc1O 271570a_203496583355_200010080787 [0,1,0,0,1,0|1,0,0]=3 1534 B11R1.87 CC(F)(F)c1ccccc1O 271570a_203496583355_100010220483 [0,1,0,0,1,0|2,0,0]=4 1535 B11R1.155 CC(C)(C)c1cc(ccn1)O 271570a_203496583355_100010237918 [0,1,0,0,1,0|2,0,0]=4 1536 B11R1.155 CC(C)(C)c1cccc(c1)O 271570a_203496583355_100009816526 [0,1,0,0,1,0|1,0,0]=3 1537 B11R1.155 CC(C)(C)c1cccc(n1)O 271570a_203496583355_100010205033 [0,1,0,0,1,0|2,0,0]=4 1538 B11R1.155 CC(C)(C)c1ccnc(c1)O 271570a_203496583355_100009878675 [0,1,0,0,1,0|2,0,0]=4 1539 B11R1.155 CC(C)(C)c1cncc(c1)O 271570a_203496583355_100010191215 [0,1,0,0,1,0|2,0,0]=4 1540 B11R1.155 CC(C)(F)c1cc(ccn1)O 271570a_203496583355_100015973028 [0,1,0,0,1,0|2,0,0]=4 1541 B11R1.155 CC(C)(N)c1cccc(c1)O 271570a_203496583355_100016995529 [0,1,0,0,1,0|1,0,0]=3 1542 B11R1.155 CC(C)(O)c1cc(ccn1)O 271570a_203496583355_100010174121 [0,1,0,0,1,0|1,0,0]=3 1543 B11R1.155 CC(C)(O)c1cccc(c1)O 271570a_203496583355_100011346009 [0,1,0,0,1,0|0,0,0]=2 1544 B11R1.155 CC(C)(O)c1cccc(n1)O 271570a_203496583355_100010074359 [0,1,0,0,1,0|1,0,0]=3 1545 B11R1.155 CC(C)(O)c1cncc(c1)O 271570a_203496583355_100010080784 [0,1,0,0,1,0|1,0,0]=3 1546 B11R1.155 CC(C)(O)c1cncc(n1)O 271570a_203496583355_106818305711 [0,1,0,0,1,0|2,0,0]=4 1547 B11R1.155 CC(F)(F)c1cccc(c1)O 271570a_203496583355_100010232180 [0,1,0,0,1,0|2,0,0]=4 1548 B11R1.155 C[Si](C)(C)c1cccc(c1)O 271570a_203496583355_100009816414 [0,1,0,0,1,0|1,1,0]=4 1549 B13R1.157 CC(C)(C)C=Cc1ccccc1Br 271570a_100102527731_100000695589 [0,1,0,0,0,1|1,0,1]=4 1550 B13R1.157 CC(C)(C)C=Cc1ccccc1Cl 271570a_100102527731_100000764095 [0,1,0,0,0,1|1,0,1]=4 1551 B13R1.157 CC(C)(C)C=Cc1ccccc1F 271570a_100102527731_100011215700 [0,1,0,0,0,1|1,0,1]=4 1552 B13R1.157 CC(C)(C)C=Cc1ccccc1N 271570a_100102527731_100000210017 [0,1,0,0,0,1|1,0,1]=4 1553 B13R1.157 CC(C)(C)C=Cc1ccccc1O 271570a_100102527731_100000739446 [0,1,0,0,0,1|1,0,1]=4 1554 B13R1.157 CC(C)(C)CNc1ccccc1Br 34a_100000210017_100011219605 [0,1,0,0,0,1|1,0,0]=3 1555 B13R1.157 CC(C)(C)CNc1ccccc1Cl 34a_100000185783_100011219605 [0,1,0,0,0,1|1,0,0]=3 1556 B13R1.157 CC(C)(C)CNc1ccccc1F 34a_100000210422_100011219605 [0,1,0,0,0,1|1,0,0]=3 1557 B13R1.157 CC(C)(C)CNc1ccccc1I 34a_100000210053_100011219605 [0,1,0,0,0,1|1,0,0]=3 1558 B13R1.157 CC(C)(C)CNc1ccccc1O 34a_100000185747_100011219605 [0,1,0,0,0,1|1,0,0]=3 1559 B13R1.157 CC(C)(C)CNc1ccncc1Br 27a_100000743828_100000726257 [0,1,0,0,0,1|2,0,0]=4 1560 B13R1.157 CC(C)(C)CNc1ccncc1F 27a_100000743828_100000035921 [0,1,0,0,0,1|2,0,0]=4 1561 B13R1.157 CC(C)(C)CNc1ncccc1Br 27a_100000743828_100000696092 [0,1,0,0,0,1|2,0,0]=4 1562 B13R1.157 CC(C)(C)COc1ccccc1Br 34a_100000181306_100011219605 [0,1,0,0,0,1|1,0,0]=3 1563 B13R1.157 CC(C)(C)COc1ccccc1Cl 34a_100000210172_100011219605 [0,1,0,0,0,1|1,0,0]=3 1564 B13R1.157 CC(C)(C)COc1ccccc1F 34a_100000210171_100011219605 [0,1,0,0,0,1|1,0,0]=3 1565 B13R1.157 CC(C)(C)COc1ccccc1I 34a_100000739446_100011219605 [0,1,0,0,0,1|1,0,0]=3 1566 B13R1.157 CC(C)(C)COc1ccccc1N 34a_100000185747_100011219605 [0,1,0,0,0,1|1,0,0]=3 1567 B13R1.157 CC(C)(C)COc1cccnc1Br 34a_100000744436_100011219605 [0,1,0,0,0,1|2,0,0]=4 1568 B13R1.157 CC(C)(C)COc1cccnc1Cl 34a_100000757616_100011219605 [0,1,0,0,0,1|2,0,0]=4 1569 B13R1.157 CC(C)(C)COc1cccnc1F 34a_100000061740_100011219605 [0,1,0,0,0,1|2,0,0]=4 1570 B13R1.157 CC(C)(C)COc1cccnc1I 34a_100000034122_100011219605 [0,1,0,0,0,1|2,0,0]=4 1571 B13R1.157 CC(C)(C)COc1cccnc1N 34a_100000211975_100011219605 [0,1,0,0,0,1|2,0,0]=4 1572 B13R1.157 CC(C)(C)COc1cccoc1=O 34a_100000077404_100011219605 [0,1,0,0,0,1|2,0,0]=4 1573 B13R1.157 CC(C)(C)COc1ccncc1Br 34a_100011996408_100011219605 [0,1,0,0,0,1|2,0,0]=4 1574 B13R1.157 CC(C)(C)COc1ccncc1Cl 34a_100011997054_100011219605 [0,1,0,0,0,1|2,0,0]=4 1575 B13R1.157 CC(C)(C)COc1ccncc1F 34a_200000081243_100011219605 [0,1,0,0,0,1|2,0,0]=4 1576 B13R1.157 CC(C)(C)COc1cnccc1Cl 34a_100011996695_100011219605 [0,1,0,0,0,1|2,0,0]=4 1577 B13R1.157 CC(C)(C)COc1cnccc1I 34a_100000050107_100011219605 [0,1,0,0,0,1|2,0,0]=4 1578 B13R1.157 CC(C)(C)COc1cnccc1N 34a_100000753702_100011219605 [0,1,0,0,0,1|2,0,0]=4 1579 B13R1.157 CC(C)(C)COc1coccc1=O 34a_100000060831_100011219605 [0,1,0,0,0,1|2,0,0]=4 1580 B13R1.157 CC(C)(C)COc1ncccc1Cl 34a_100011290957_100011219605 [0,1,0,0,0,1|2,0,0]=4 1581 B13R1.157 CC(C)(C)COc1ncccc1F 34a_100011219419_100011219605 [0,1,0,0,0,1|2,0,0]=4 1582 B13R1.157 CC(C)(C)COc1ncccc1N 34a_100000746358_100011219605 [0,1,0,0,0,1|2,0,0]=4 1583 B13R1.157 CC(C)(C)CSc1c[nH]ccc1=O 62a_100009998708_100011219605 [0,1,0,0,0,1|2,0,0]=4 1584 B13R1.157 CC(C)(C)CSc1c[nH]ccc1=O 62a_100011219605_100009998708 [0,1,0,0,0,1|2,0,0]=4 1585 B13R1.157 CC(C)(C)CSc1c[nH]ccc1=S 62a_100011219605_200012280681 [0,1,0,0,0,1|2,0,0]=4 1586 B13R1.157 CC(C)(C)CSc1c[nH]ccc1=S 62a_200012280681_100011219605 [0,1,0,0,0,1|2,0,0]=4 1587 B13R1.157 CC(C)(C)CSc1cccc[n+]1[O-] 62a_100011219605_200000042595 [0,1,0,0,0,1|2,0,0]=4 1588 B13R1.157 CC(C)(C)CSc1ccccc1Br 62a_100000695589_100011219605 [0,1,0,0,0,1|1,0,0]=3 1589 B13R1.157 CC(C)(C)CSc1ccccc1Br 62a_100011219605_100000695589 [0,1,0,0,0,1|1,0,0]=3 1590 B13R1.157 CC(C)(C)CSc1ccccc1Cl 62a_100000764095_100011219605 [0,1,0,0,0,1|1,0,0]=3 1591 B13R1.157 CC(C)(C)CSc1ccccc1Cl 62a_100011219605_100000764095 [0,1,0,0,0,1|1,0,0]=3 1592 B13R1.157 CC(C)(C)CSc1ccccc1F 62a_100011215700_100011219605 [0,1,0,0,0,1|1,0,0]=3 1593 B13R1.157 CC(C)(C)CSc1ccccc1F 62a_100011219605_100011215700 [0,1,0,0,0,1|1,0,0]=3 1594 B13R1.157 CC(C)(C)CSc1ccccc1N 62a_100000210017_100011219605 [0,1,0,0,0,1|1,0,0]=3 1595 B13R1.157 CC(C)(C)CSc1ccccc1N 62a_100011219605_100000210017 [0,1,0,0,0,1|1,0,0]=3 1596 B13R1.157 CC(C)(C)CSc1ccccc1O 62a_100000739446_100011219605 [0,1,0,0,0,1|1,0,0]=3 1597 B13R1.157 CC(C)(C)CSc1ccccc1O 62a_100011219605_100000739446 [0,1,0,0,0,1|1,0,0]=3 1598 B13R1.157 CC(C)(C)CSc1cccnc1Br 62a_100010202626_100011219605 [0,1,0,0,0,1|2,0,0]=4 1599 B13R1.157 CC(C)(C)CSc1cccnc1Br 62a_100011219605_100010202626 [0,1,0,0,0,1|2,0,0]=4 1600 B13R1.157 CC(C)(C)CSc1cccnc1Cl 62a_100000036424_100011219605 [0,1,0,0,0,1|2,0,0]=4 1601 B13R1.157 CC(C)(C)CSc1cccnc1Cl 62a_100011219605_100000036424 [0,1,0,0,0,1|2,0,0]=4 1602 B13R1.157 CC(C)(C)CSc1cccnc1F 62a_100009816115_100011219605 [0,1,0,0,0,1|2,0,0]=4 1603 B13R1.157 CC(C)(C)CSc1cccnc1F 62a_100011219605_100009816115 [0,1,0,0,0,1|2,0,0]=4 1604 B13R1.157 CC(C)(C)CSc1cccnc1N 62a_100000045569_100011219605 [0,1,0,0,0,1|2,0,0]=4 1605 B13R1.157 CC(C)(C)CSc1cccnc1N 62a_100011219605_100000045569 [0,1,0,0,0,1|2,0,0]=4 1606 B13R1.157 CC(C)(C)CSc1cccnc1O 62a_100000760158_100011219605 [0,1,0,0,0,1|2,0,0]=4 1607 B13R1.157 CC(C)(C)CSc1cccnc1O 62a_100011219605_100000760158 [0,1,0,0,0,1|2,0,0]=4 1608 B13R1.157 CC(C)(C)CSc1ccncc1Br 62a_100000726257_100011219605 [0,1,0,0,0,1|2,0,0]=4 1609 B13R1.157 CC(C)(C)CSc1ccncc1Br 62a_100011219605_100000726257 [0,1,0,0,0,1|2,0,0]=4 1610 B13R1.157 CC(C)(C)CSc1ccncc1Cl 62a_100000708259_100011219605 [0,1,0,0,0,1|2,0,0]=4 1611 B13R1.157 CC(C)(C)CSc1ccncc1Cl 62a_100011219605_100000708259 [0,1,0,0,0,1|2,0,0]=4 1612 B13R1.157 CC(C)(C)CSc1ccncc1F 62a_100000047030_100011219605 [0,1,0,0,0,1|2,0,0]=4 1613 B13R1.157 CC(C)(C)CSc1ccncc1F 62a_100011219605_100000047030 [0,1,0,0,0,1|2,0,0]=4 1614 B13R1.157 CC(C)(C)CSc1ccncc1N 62a_100000756074_100011219605 [0,1,0,0,0,1|2,0,0]=4 1615 B13R1.157 CC(C)(C)CSc1ccncc1N 62a_100011219605_100000756074 [0,1,0,0,0,1|2,0,0]=4 1616 B13R1.157 CC(C)(C)CSc1ccncc1O 62a_100009817591_100011219605 [0,1,0,0,0,1|2,0,0]=4 1617 B13R1.157 CC(C)(C)CSc1ccncc1O 62a_100011219605_100009817591 [0,1,0,0,0,1|2,0,0]=4 1618 B13R1.157 CC(C)(C)CSc1cnccc1Br 62a_100010138639_100011219605 [0,1,0,0,0,1|2,0,0]=4 1619 B13R1.157 CC(C)(C)CSc1cnccc1Br 62a_100011219605_100010138639 [0,1,0,0,0,1|2,0,0]=4 1620 B13R1.157 CC(C)(C)CSc1cnccc1Cl 62a_100009995489_100011219605 [0,1,0,0,0,1|2,0,0]=4 1621 B13R1.157 CC(C)(C)CSc1cnccc1Cl 62a_100011219605_100009995489 [0,1,0,0,0,1|2,0,0]=4 1622 B13R1.157 CC(C)(C)CSc1cnccc1F 62a_100009820683_100011219605 [0,1,0,0,0,1|2,0,0]=4 1623 B13R1.157 CC(C)(C)CSc1cnccc1F 62a_100011219605_100009820683 [0,1,0,0,0,1|2,0,0]=4 1624 B13R1.157 CC(C)(C)CSc1cnccc1N 62a_100000047001_100011219605 [0,1,0,0,0,1|2,0,0]=4 1625 B13R1.157 CC(C)(C)CSc1cnccc1N 62a_100011219605_100000047001 [0,1,0,0,0,1|2,0,0]=4 1626 B13R1.157 CC(C)(C)CSc1ncccc1Br 62a_100000696092_100011219605 [0,1,0,0,0,1|2,0,0]=4 1627 B13R1.157 CC(C)(C)CSc1ncccc1Br 62a_100011219605_100000696092 [0,1,0,0,0,1|2,0,0]=4 1628 B13R1.157 CC(C)(C)CSc1ncccc1Cl 62a_100011219605_100011356963 [0,1,0,0,0,1|2,0,0]=4 1629 B13R1.157 CC(C)(C)CSc1ncccc1Cl 62a_100011356963_100011219605 [0,1,0,0,0,1|2,0,0]=4 1630 B13R1.157 CC(C)(C)CSc1ncccc1F 62a_100000685392_100011219605 [0,1,0,0,0,1|2,0,0]=4 1631 B13R1.157 CC(C)(C)CSc1ncccc1F 62a_100011219605_100000685392 [0,1,0,0,0,1|2,0,0]=4 1632 B13R1.157 CC(C)(C)CSc1ncccc1N 62a_100000688686_100011219605 [0,1,0,0,0,1|2,0,0]=4 1633 B13R1.157 CC(C)(C)CSc1ncccc1N 62a_100011219605_100000688686 [0,1,0,0,0,1|2,0,0]=4 1634 B13R1.157 CC(C)(C)CSc1ncccc1O 62a_100000034122_100011219605 [0,1,0,0,0,1|2,0,0]=4 1635 B13R1.157 CC(C)(C)CSc1ncccc1O 62a_100011219605_100000034122 [0,1,0,0,0,1|2,0,0]=4 1636 B13R1.157 CC(C)(C)NCc1ccccc1Br 207a_100000715429_100000211189 [0,1,0,0,0,1|1,0,0]=3 1637 B13R1.157 CC(C)(C)NCc1ccccc1Br 2230a_100000715429_100000184730 [0,1,0,0,0,1|1,0,0]=3 1638 B13R1.157 CC(C)(C)NCc1ccccc1Br 34a_100000689332_100000210625 [0,1,0,0,0,1|1,0,0]=3 1639 B13R1.157 CC(C)(C)NCc1ccccc1Cl 207a_100000715429_100000210073 [0,1,0,0,0,1|1,0,0]=3 1640 B13R1.157 CC(C)(C)NCc1ccccc1Cl 2230a_100000715429_100000187162 [0,1,0,0,0,1|1,0,0]=3 1641 B13R1.157 CC(C)(C)NCc1ccccc1Cl 34a_100000174879_100000210625 [0,1,0,0,0,1|1,0,0]=3 1642 B13R1.157 CC(C)(C)NCc1ccccc1F 207a_100000715429_100000210811 [0,1,0,0,0,1|1,0,0]=3 1643 B13R1.157 CC(C)(C)NCc1ccccc1F 2230a_100000715429_100000211605 [0,1,0,0,0,1|1,0,0]=3 1644 B13R1.157 CC(C)(C)NCc1ccccc1F 34a_100000174869_100000210625 [0,1,0,0,0,1|1,0,0]=3 1645 B13R1.157 CC(C)(C)NCc1ccccc1I 207a_100000715429_100000010305 [0,1,0,0,0,1|1,0,0]=3 1646 B13R1.157 CC(C)(C)NCc1ccccc1I 2230a_100000715429_100011215278 [0,1,0,0,0,1|1,0,0]=3 1647 B13R1.157 CC(C)(C)NCc1ccccc1O 271570a_203496583355_100000740897 [0,1,0,0,0,1|1,0,0]=3 1648 B13R1.157 CC(C)(C)NCc1ccccc1O 34a_100000185550_100000210625 [0,1,0,0,0,1|1,0,0]=3 1649 B13R1.157 CC(C)(C)NCc1cccnc1Br 2230a_100000715429_100010140945 [0,1,0,0,0,1|2,0,0]=4 1650 B13R1.157 CC(C)(C)NCc1cccnc1Br 34a_100009818023_100000210625 [0,1,0,0,0,1|2,0,0]=4 1651 B13R1.157 CC(C)(C)NCc1cccnc1Cl 2230a_100000715429_100000045678 [0,1,0,0,0,1|2,0,0]=4 1652 B13R1.157 CC(C)(C)NCc1cccnc1Cl 34a_100015189234_100000210625 [0,1,0,0,0,1|2,0,0]=4 1653 B13R1.157 CC(C)(C)NCc1cccnc1F 2230a_100000715429_100000099810 [0,1,0,0,0,1|2,0,0]=4 1654 B13R1.157 CC(C)(C)NCc1cccnc1F 34a_100000724633_100000210625 [0,1,0,0,0,1|2,0,0]=4 1655 B13R1.157 CC(C)(C)NCc1cccnc1O 207a_100000715429_100011998315 [0,1,0,0,0,1|2,0,0]=4 1656 B13R1.157 CC(C)(C)NCc1ccncc1Cl 207a_100000715429_100011934409 [0,1,0,0,0,1|2,0,0]=4 1657 B13R1.157 CC(C)(C)NCc1ccncc1Cl 2230a_100000715429_100000763264 [0,1,0,0,0,1|2,0,0]=4 1658 B13R1.157 CC(C)(C)NCc1ccncc1F 34a_100011935246_100000210625 [0,1,0,0,0,1|2,0,0]=4 1659 B13R1.157 CC(C)(C)NCc1ncccc1Br 207a_100000715429_100011934733 [0,1,0,0,0,1|2,0,0]=4 1660 B13R1.157 CC(C)(C)NCc1ncccc1Br 2230a_100000715429_100025702911 [0,1,0,0,0,1|2,0,0]=4 1661 B13R1.157 CC(C)(C)NCc1ncccc1Cl 207a_100000715429_100012001307 [0,1,0,0,0,1|2,0,0]=4 1662 B13R1.157 CC(C)(C)NCc1ncccc1Cl 2230a_100000715429_100000099807 [0,1,0,0,0,1|2,0,0]=4 1663 B13R1.157 CC(C)(C)NCc1ncccc1F 207a_100000715429_100011934734 [0,1,0,0,0,1|2,0,0]=4 1664 B13R1.157 CC(C)(C)NCc1ncccc1F 2230a_100000715429_100000104219 [0,1,0,0,0,1|2,0,0]=4 1665 B13R1.157 CC(C)(C)NCc1ncccc1F 34a_100000690088_100000210625 [0,1,0,0,0,1|2,0,0]=4 1666 B13R1.157 CC(C)(C)OCc1ccccc1Br 34a_100000756307_100000210625 [0,1,0,0,0,1|1,0,0]=3 1667 B13R1.157 CC(C)(C)OCc1ccccc1Br 34a_100015890283_100000184730 [0,1,0,0,0,1|1,0,0]=3 1668 B13R1.157 CC(C)(C)OCc1ccccc1Br 7a_100015890283_100000184730 [0,1,0,0,0,1|1,0,0]=3 1669 B13R1.157 CC(C)(C)OCc1ccccc1Cl 34a_100000210847_100000210625 [0,1,0,0,0,1|1,0,0]=3 1670 B13R1.157 CC(C)(C)OCc1ccccc1Cl 34a_100015890283_100000187162 [0,1,0,0,0,1|1,0,0]=3 1671 B13R1.157 CC(C)(C)OCc1ccccc1Cl 7a_100015890283_100000187162 [0,1,0,0,0,1|1,0,0]=3 1672 B13R1.157 CC(C)(C)OCc1ccccc1F 34a_100000211962_100000210625 [0,1,0,0,0,1|1,0,0]=3 1673 B13R1.157 CC(C)(C)OCc1ccccc1F 34a_100015890283_100000211605 [0,1,0,0,0,1|1,0,0]=3 1674 B13R1.157 CC(C)(C)OCc1ccccc1F 7a_100015890283_100000211605 [0,1,0,0,0,1|1,0,0]=3 1675 B13R1.157 CC(C)(C)OCc1ccccc1I 34a_100000187465_100000210625 [0,1,0,0,0,1|1,0,0]=3 1676 B13R1.157 CC(C)(C)OCc1ccccc1I 34a_100015890283_100011215278 [0,1,0,0,0,1|1,0,0]=3 1677 B13R1.157 CC(C)(C)OCc1ccccc1I 7a_100015890283_100011215278 [0,1,0,0,0,1|1,0,0]=3 1678 B13R1.157 CC(C)(C)OCc1ccccc1N 34a_100000212039_100000210625 [0,1,0,0,0,1|1,0,0]=3 1679 B13R1.157 CC(C)(C)OCc1cccnc1Br 34a_100000719692_100000210625 [0,1,0,0,0,1|2,0,0]=4 1680 B13R1.157 CC(C)(C)OCc1cccnc1Br 34a_100015890283_100010140945 [0,1,0,0,0,1|2,0,0]=4 1681 B13R1.157 CC(C)(C)OCc1cccnc1Br 7a_100015890283_100010140945 [0,1,0,0,0,1|2,0,0]=4 1682 B13R1.157 CC(C)(C)OCc1cccnc1Cl 34a_100000748726_100000210625 [0,1,0,0,0,1|2,0,0]=4 1683 B13R1.157 CC(C)(C)OCc1cccnc1Cl 34a_100015890283_100000045678 [0,1,0,0,0,1|2,0,0]=4 1684 B13R1.157 CC(C)(C)OCc1cccnc1Cl 7a_100015890283_100000045678 [0,1,0,0,0,1|2,0,0]=4 1685 B13R1.157 CC(C)(C)OCc1cccnc1F 34a_100000079888_100000210625 [0,1,0,0,0,1|2,0,0]=4 1686 B13R1.157 CC(C)(C)OCc1cccnc1F 34a_100015890283_100000099810 [0,1,0,0,0,1|2,0,0]=4 1687 B13R1.157 CC(C)(C)OCc1cccnc1F 7a_100015890283_100000099810 [0,1,0,0,0,1|2,0,0]=4 1688 B13R1.157 CC(C)(C)OCc1ccncc1Cl 7a_100015890283_100000763264 [0,1,0,0,0,1|2,0,0]=4 1689 B13R1.157 CC(C)(C)OCc1ccncc1F 34a_100012172863_100000210625 [0,1,0,0,0,1|2,0,0]=4 1690 B13R1.157 CC(C)(C)OCc1cnccc1Cl 34a_100000117392_100000210625 [0,1,0,0,0,1|2,0,0]=4 1691 B13R1.157 CC(C)(C)OCc1ncccc1Br 34a_100011996772_100000210625 [0,1,0,0,0,1|2,0,0]=4 1692 B13R1.157 CC(C)(C)OCc1ncccc1Br 34a_100015890283_100025702911 [0,1,0,0,0,1|2,0,0]=4 1693 B13R1.157 CC(C)(C)OCc1ncccc1Br 7a_100015890283_100025702911 [0,1,0,0,0,1|2,0,0]=4 1694 B13R1.157 CC(C)(C)OCc1ncccc1Cl 34a_100012002383_100000210625 [0,1,0,0,0,1|2,0,0]=4 1695 B13R1.157 CC(C)(C)OCc1ncccc1Cl 7a_100015890283_100000099807 [0,1,0,0,0,1|2,0,0]=4 1696 B13R1.157 CC(C)(C)OCc1ncccc1F 34a_100011934865_100000210625 [0,1,0,0,0,1|2,0,0]=4 1697 B13R1.157 CC(C)(C)OCc1ncccc1F 34a_100015890283_100000104219 [0,1,0,0,0,1|2,0,0]=4 1698 B13R1.157 CC(C)(C)OCc1ncccc1F 7a_100015890283_100000104219 [0,1,0,0,0,1|2,0,0]=4 1699 B13R1.157 CC(C)(C)OCc1ncccc1N 34a_114873767017_100000210625 [0,1,0,0,0,1|2,0,0]=4 1700 B13R1.157 CC(C)(C)OCc1ncccc1O 34a_100015890283_200020655725 [0,1,0,0,0,1|2,0,0]=4 1701 B13R1.157 CC(C)(C)OCc1ncccc1O 7a_100015890283_200020655725 [0,1,0,0,0,1|2,0,0]=4 1702 B13R1.157 CC(C)(C)SCc1ccccc1Br 62a_100000184730_100000211941 [0,1,0,0,0,1|1,0,0]=3 1703 B13R1.157 CC(C)(C)SCc1ccccc1Br 62a_100000211941_100000184730 [0,1,0,0,0,1|1,0,0]=3 1704 B13R1.157 CC(C)(C)SCc1ccccc1Cl 62a_100000187162_100000211941 [0,1,0,0,0,1|1,0,0]=3 1705 B13R1.157 CC(C)(C)SCc1ccccc1Cl 62a_100000211941_100000187162 [0,1,0,0,0,1|1,0,0]=3 1706 B13R1.157 CC(C)(C)SCc1ccccc1F 62a_100000211605_100000211941 [0,1,0,0,0,1|1,0,0]=3 1707 B13R1.157 CC(C)(C)SCc1ccccc1F 62a_100000211941_100000211605 [0,1,0,0,0,1|1,0,0]=3 1708 B13R1.157 CC(C)(C)SCc1ccccc1I 62a_100000211941_100011216222 [0,1,0,0,0,1|1,0,0]=3 1709 B13R1.157 CC(C)(C)SCc1ccccc1I 62a_100011216222_100000211941 [0,1,0,0,0,1|1,0,0]=3 1710 B13R1.157 CC(C)(C)SCc1cccnc1Br 62a_100000211941_100010140945 [0,1,0,0,0,1|2,0,0]=4 1711 B13R1.157 CC(C)(C)SCc1cccnc1Br 62a_100010140945_100000211941 [0,1,0,0,0,1|2,0,0]=4 1712 B13R1.157 CC(C)(C)SCc1cccnc1Cl 62a_100000045678_100000211941 [0,1,0,0,0,1|2,0,0]=4 1713 B13R1.157 CC(C)(C)SCc1cccnc1Cl 62a_100000211941_100000045678 [0,1,0,0,0,1|2,0,0]=4 1714 B13R1.157 CC(C)(C)SCc1cccnc1F 62a_100000099810_100000211941 [0,1,0,0,0,1|2,0,0]=4 1715 B13R1.157 CC(C)(C)SCc1cccnc1F 62a_100000211941_100000099810 [0,1,0,0,0,1|2,0,0]=4 1716 B13R1.157 CC(C)(C)SCc1ccncc1Cl 62a_100000211941_100000763264 [0,1,0,0,0,1|2,0,0]=4 1717 B13R1.157 CC(C)(C)SCc1ccncc1Cl 62a_100000763264_100000211941 [0,1,0,0,0,1|2,0,0]=4 1718 B13R1.157 CC(C)(C)SCc1ncccc1Br 62a_100000211941_100025702911 [0,1,0,0,0,1|2,0,0]=4 1719 B13R1.157 CC(C)(C)SCc1ncccc1Br 62a_100025702911_100000211941 [0,1,0,0,0,1|2,0,0]=4 1720 B13R1.157 CC(C)(C)SCc1ncccc1Cl 62a_100000099807_100000211941 [0,1,0,0,0,1|2,0,0]=4 1721 B13R1.157 CC(C)(C)SCc1ncccc1Cl 62a_100000211941_100000099807 [0,1,0,0,0,1|2,0,0]=4 1722 B13R1.157 CC(C)(C)SCc1ncccc1F 62a_100000104219_100000211941 [0,1,0,0,0,1|2,0,0]=4 1723 B13R1.157 CC(C)(C)SCc1ncccc1F 62a_100000211941_100000104219 [0,1,0,0,0,1|2,0,0]=4 1724 B13R1.157 CC(C)(C)SCc1ncccc1O 62a_100000211941_200020655725 [0,1,0,0,0,1|2,0,0]=4 1725 B13R1.157 CC(C)(C)SCc1ncccc1O 62a_200020655725_100000211941 [0,1,0,0,0,1|2,0,0]=4 1726 B13R1.157 CC(C)(F)CNc1ccccc1Br 34a_100000210017_100011997219 [0,1,0,0,0,1|1,0,0]=3 1727 B13R1.157 CC(C)(F)CNc1ccccc1Cl 34a_100000185783_100011997219 [0,1,0,0,0,1|1,0,0]=3 1728 B13R1.157 CC(C)(F)CNc1ccccc1F 34a_100000210422_100011997219 [0,1,0,0,0,1|1,0,0]=3 1729 B13R1.157 CC(C)(F)CNc1ccccc1I 34a_100000210053_100011997219 [0,1,0,0,0,1|1,0,0]=3 1730 B13R1.157 CC(C)(F)CNc1ccccc1O 34a_100000185747_100011997219 [0,1,0,0,0,1|1,0,0]=3 1731 B13R1.157 CC(C)(F)CNc1ccncc1Br 27a_100020643315_100000726257 [0,1,0,0,0,1|2,0,0]=4 1732 B13R1.157 CC(C)(F)CNc1ccncc1F 27a_100020643315_100000035921 [0,1,0,0,0,1|2,0,0]=4 1733 B13R1.157 CC(C)(F)CNc1ncccc1Br 27a_100020643315_100000696092 [0,1,0,0,0,1|2,0,0]=4 1734 B13R1.157 CC(C)(F)COc1ccccc1Br 34a_100000181306_100011997219 [0,1,0,0,0,1|1,0,0]=3 1735 B13R1.157 CC(C)(F)COc1ccccc1Cl 34a_100000210172_100011997219 [0,1,0,0,0,1|1,0,0]=3 1736 B13R1.157 CC(C)(F)COc1ccccc1F 34a_100000210171_100011997219 [0,1,0,0,0,1|1,0,0]=3 1737 B13R1.157 CC(C)(F)COc1ccccc1I 34a_100000739446_100011997219 [0,1,0,0,0,1|1,0,0]=3 1738 B13R1.157 CC(C)(F)COc1ccccc1N 34a_100000185747_100011997219 [0,1,0,0,0,1|1,0,0]=3 1739 B13R1.157 CC(C)(F)COc1cccnc1Br 34a_100000744436_100011997219 [0,1,0,0,0,1|2,0,0]=4 1740 B13R1.157 CC(C)(F)COc1cccnc1Cl 34a_100000757616_100011997219 [0,1,0,0,0,1|2,0,0]=4 1741 B13R1.157 CC(C)(F)COc1cccnc1F 34a_100000061740_100011997219 [0,1,0,0,0,1|2,0,0]=4 1742 B13R1.157 CC(C)(F)COc1cccnc1I 34a_100000034122_100011997219 [0,1,0,0,0,1|2,0,0]=4 1743 B13R1.157 CC(C)(F)COc1cccnc1N 34a_100000211975_100011997219 [0,1,0,0,0,1|2,0,0]=4 1744 B13R1.157 CC(C)(F)COc1cccoc1=O 34a_100000077404_100011997219 [0,1,0,0,0,1|2,0,0]=4 1745 B13R1.157 CC(C)(F)COc1ccncc1Br 34a_100011996408_100011997219 [0,1,0,0,0,1|2,0,0]=4 1746 B13R1.157 CC(C)(F)COc1ccncc1Cl 34a_100011997054_100011997219 [0,1,0,0,0,1|2,0,0]=4 1747 B13R1.157 CC(C)(F)COc1ccncc1F 34a_200000081243_100011997219 [0,1,0,0,0,1|2,0,0]=4 1748 B13R1.157 CC(C)(F)COc1cnccc1Cl 34a_100011996695_100011997219 [0,1,0,0,0,1|2,0,0]=4 1749 B13R1.157 CC(C)(F)COc1cnccc1I 34a_100000050107_100011997219 [0,1,0,0,0,1|2,0,0]=4 1750 B13R1.157 CC(C)(F)COc1cnccc1N 34a_100000753702_100011997219 [0,1,0,0,0,1|2,0,0]=4 1751 B13R1.157 CC(C)(F)COc1coccc1=O 34a_100000060831_100011997219 [0,1,0,0,0,1|2,0,0]=4 1752 B13R1.157 CC(C)(F)COc1ncccc1Cl 34a_100011290957_100011997219 [0,1,0,0,0,1|2,0,0]=4 1753 B13R1.157 CC(C)(F)COc1ncccc1F 34a_100011219419_100011997219 [0,1,0,0,0,1|2,0,0]=4 1754 B13R1.157 CC(C)(F)COc1ncccc1N 34a_100000746358_100011997219 [0,1,0,0,0,1|2,0,0]=4 1755 B13R1.157 CC(C)(F)CSc1c[nH]ccc1=O 62a_100009998708_100011997219 [0,1,0,0,0,1|2,0,0]=4 1756 B13R1.157 CC(C)(F)CSc1c[nH]ccc1=O 62a_100011997219_100009998708 [0,1,0,0,0,1|2,0,0]=4 1757 B13R1.157 CC(C)(F)CSc1c[nH]ccc1=S 62a_100011997219_200012280681 [0,1,0,0,0,1|2,0,0]=4 1758 B13R1.157 CC(C)(F)CSc1c[nH]ccc1=S 62a_200012280681_100011997219 [0,1,0,0,0,1|2,0,0]=4 1759 B13R1.157 CC(C)(F)CSc1cccc[n+]1[O-] 62a_100011997219_200000042595 [0,1,0,0,0,1|2,0,0]=4 1760 B13R1.157 CC(C)(F)CSc1ccccc1Br 62a_100000695589_100011997219 [0,1,0,0,0,1|1,0,0]=3 1761 B13R1.157 CC(C)(F)CSc1ccccc1Br 62a_100011997219_100000695589 [0,1,0,0,0,1|1,0,0]=3 1762 B13R1.157 CC(C)(F)CSc1ccccc1Cl 62a_100000764095_100011997219 [0,1,0,0,0,1|1,0,0]=3 1763 B13R1.157 CC(C)(F)CSc1ccccc1Cl 62a_100011997219_100000764095 [0,1,0,0,0,1|1,0,0]=3 1764 B13R1.157 CC(C)(F)CSc1ccccc1F 62a_100011215700_100011997219 [0,1,0,0,0,1|1,0,0]=3 1765 B13R1.157 CC(C)(F)CSc1ccccc1F 62a_100011997219_100011215700 [0,1,0,0,0,1|1,0,0]=3 1766 B13R1.157 CC(C)(F)CSc1ccccc1N 62a_100000210017_100011997219 [0,1,0,0,0,1|1,0,0]=3 1767 B13R1.157 CC(C)(F)CSc1ccccc1N 62a_100011997219_100000210017 [0,1,0,0,0,1|1,0,0]=3 1768 B13R1.157 CC(C)(F)CSc1ccccc1O 62a_100000739446_100011997219 [0,1,0,0,0,1|1,0,0]=3 1769 B13R1.157 CC(C)(F)CSc1ccccc1O 62a_100011997219_100000739446 [0,1,0,0,0,1|1,0,0]=3 1770 B13R1.157 CC(C)(F)CSc1cccnc1Br 62a_100010202626_100011997219 [0,1,0,0,0,1|2,0,0]=4 1771 B13R1.157 CC(C)(F)CSc1cccnc1Br 62a_100011997219_100010202626 [0,1,0,0,0,1|2,0,0]=4 1772 B13R1.157 CC(C)(F)CSc1cccnc1Cl 62a_100000036424_100011997219 [0,1,0,0,0,1|2,0,0]=4 1773 B13R1.157 CC(C)(F)CSc1cccnc1Cl 62a_100011997219_100000036424 [0,1,0,0,0,1|2,0,0]=4 1774 B13R1.157 CC(C)(F)CSc1cccnc1F 62a_100009816115_100011997219 [0,1,0,0,0,1|2,0,0]=4 1775 B13R1.157 CC(C)(F)CSc1cccnc1F 62a_100011997219_100009816115 [0,1,0,0,0,1|2,0,0]=4 1776 B13R1.157 CC(C)(F)CSc1cccnc1N 62a_100000045569_100011997219 [0,1,0,0,0,1|2,0,0]=4 1777 B13R1.157 CC(C)(F)CSc1cccnc1N 62a_100011997219_100000045569 [0,1,0,0,0,1|2,0,0]=4 1778 B13R1.157 CC(C)(F)CSc1cccnc1O 62a_100000760158_100011997219 [0,1,0,0,0,1|2,0,0]=4 1779 B13R1.157 CC(C)(F)CSc1cccnc1O 62a_100011997219_100000760158 [0,1,0,0,0,1|2,0,0]=4 1780 B13R1.157 CC(C)(F)CSc1ccncc1Br 62a_100000726257_100011997219 [0,1,0,0,0,1|2,0,0]=4 1781 B13R1.157 CC(C)(F)CSc1ccncc1Br 62a_100011997219_100000726257 [0,1,0,0,0,1|2,0,0]=4 1782 B13R1.157 CC(C)(F)CSc1ccncc1Cl 62a_100000708259_100011997219 [0,1,0,0,0,1|2,0,0]=4 1783 B13R1.157 CC(C)(F)CSc1ccncc1Cl 62a_100011997219_100000708259 [0,1,0,0,0,1|2,0,0]=4 1784 B13R1.157 CC(C)(F)CSc1ccncc1F 62a_100000047030_100011997219 [0,1,0,0,0,1|2,0,0]=4 1785 B13R1.157 CC(C)(F)CSc1ccncc1F 62a_100011997219_100000047030 [0,1,0,0,0,1|2,0,0]=4 1786 B13R1.157 CC(C)(F)CSc1ccncc1N 62a_100000756074_100011997219 [0,1,0,0,0,1|2,0,0]=4 1787 B13R1.157 CC(C)(F)CSc1ccncc1N 62a_100011997219_100000756074 [0,1,0,0,0,1|2,0,0]=4 1788 B13R1.157 CC(C)(F)CSc1ccncc1O 62a_100009817591_100011997219 [0,1,0,0,0,1|2,0,0]=4 1789 B13R1.157 CC(C)(F)CSc1ccncc1O 62a_100011997219_100009817591 [0,1,0,0,0,1|2,0,0]=4 1790 B13R1.157 CC(C)(F)CSc1cnccc1Br 62a_100010138639_100011997219 [0,1,0,0,0,1|2,0,0]=4 1791 B13R1.157 CC(C)(F)CSc1cnccc1Br 62a_100011997219_100010138639 [0,1,0,0,0,1|2,0,0]=4 1792 B13R1.157 CC(C)(F)CSc1cnccc1Cl 62a_100009995489_100011997219 [0,1,0,0,0,1|2,0,0]=4 1793 B13R1.157 CC(C)(F)CSc1cnccc1Cl 62a_100011997219_100009995489 [0,1,0,0,0,1|2,0,0]=4 1794 B13R1.157 CC(C)(F)CSc1cnccc1F 62a_100009820683_100011997219 [0,1,0,0,0,1|2,0,0]=4 1795 B13R1.157 CC(C)(F)CSc1cnccc1F 62a_100011997219_100009820683 [0,1,0,0,0,1|2,0,0]=4 1796 B13R1.157 CC(C)(F)CSc1cnccc1N 62a_100000047001_100011997219 [0,1,0,0,0,1|2,0,0]=4 1797 B13R1.157 CC(C)(F)CSc1cnccc1N 62a_100011997219_100000047001 [0,1,0,0,0,1|2,0,0]=4 1798 B13R1.157 CC(C)(F)CSc1ncccc1Br 62a_100000696092_100011997219 [0,1,0,0,0,1|2,0,0]=4 1799 B13R1.157 CC(C)(F)CSc1ncccc1Br 62a_100011997219_100000696092 [0,1,0,0,0,1|2,0,0]=4 1800 B13R1.157 CC(C)(F)CSc1ncccc1Cl 62a_100011356963_100011997219 [0,1,0,0,0,1|2,0,0]=4 1801 B13R1.157 CC(C)(F)CSc1ncccc1Cl 62a_100011997219_100011356963 [0,1,0,0,0,1|2,0,0]=4 1802 B13R1.157 CC(C)(F)CSc1ncccc1F 62a_100000685392_100011997219 [0,1,0,0,0,1|2,0,0]=4 1803 B13R1.157 CC(C)(F)CSc1ncccc1F 62a_100011997219_100000685392 [0,1,0,0,0,1|2,0,0]=4 1804 B13R1.157 CC(C)(F)CSc1ncccc1N 62a_100000688686_100011997219 [0,1,0,0,0,1|2,0,0]=4 1805 B13R1.157 CC(C)(F)CSc1ncccc1N 62a_100011997219_100000688686 [0,1,0,0,0,1|2,0,0]=4 1806 B13R1.157 CC(C)(F)CSc1ncccc1O 62a_100000034122_100011997219 [0,1,0,0,0,1|2,0,0]=4 1807 B13R1.157 CC(C)(F)CSc1ncccc1O 62a_100011997219_100000034122 [0,1,0,0,0,1|2,0,0]=4 1808 B13R1.157 CC(C)(O)C=Cc1c[nH]ccc1=O 271570a_200016258132_100009998708 [0,1,0,0,0,1|1,0,1]=4 1809 B13R1.157 CC(C)(O)C=Cc1c[nH]ccc1=S 271570a_200016258132_200012280681 [0,1,0,0,0,1|1,0,1]=4 1810 B13R1.157 CC(C)(O)C=Cc1ccc[nH]c1=O 271570a_200016258132_100000050042 [0,1,0,0,0,1|1,0,1]=4 1811 B13R1.157 CC(C)(O)C=Cc1cccc[n+]1[O-] 271570a_200016258132_200000042595 [0,1,0,0,0,1|1,0,1]=4 1812 B13R1.157 CC(C)(O)C=Cc1ccccc1Br 271570a_200016258132_100000695589 [0,1,0,0,0,1|0,0,1]=3 1813 B13R1.157 CC(C)(O)C=Cc1ccccc1Cl 271570a_200016258132_100000764095 [0,1,0,0,0,1|0,0,1]=3 1814 B13R1.157 CC(C)(O)C=Cc1ccccc1F 271570a_200016258132_100011215700 [0,1,0,0,0,1|0,0,1]=3 1815 B13R1.157 CC(C)(O)C=Cc1ccccc1N 271570a_200016258132_100000210017 [0,1,0,0,0,1|0,0,1]=3 1816 B13R1.157 CC(C)(O)C=Cc1ccccc1O 271570a_200016258132_100000739446 [0,1,0,0,0,1|0,0,1]=3 1817 B13R1.157 CC(C)(O)C=Cc1cccnc1Br 271570a_200016258132_100010202626 [0,1,0,0,0,1|1,0,1]=4 1818 B13R1.157 CC(C)(O)C=Cc1cccnc1Cl 271570a_200016258132_100000036424 [0,1,0,0,0,1|1,0,1]=4 1819 B13R1.157 CC(C)(O)C=Cc1cccnc1F 271570a_200016258132_100009816115 [0,1,0,0,0,1|1,0,1]=4 1820 B13R1.157 CC(C)(O)C=Cc1cccnc1N 271570a_200016258132_100000045569 [0,1,0,0,0,1|1,0,1]=4 1821 B13R1.157 CC(C)(O)C=Cc1ccncc1Br 271570a_200016258132_100000726257 [0,1,0,0,0,1|1,0,1]=4 1822 B13R1.157 CC(C)(O)C=Cc1ccncc1Cl 271570a_200016258132_100000708259 [0,1,0,0,0,1|1,0,1]=4 1823 B13R1.157 CC(C)(O)C=Cc1ccncc1F 271570a_200016258132_100000047030 [0,1,0,0,0,1|1,0,1]=4 1824 B13R1.157 CC(C)(O)C=Cc1ccncc1N 271570a_200016258132_100009815883 [0,1,0,0,0,1|1,0,1]=4 1825 B13R1.157 CC(C)(O)C=Cc1ccncc1O 271570a_200016258132_100009817591 [0,1,0,0,0,1|1,0,1]=4 1826 B13R1.157 CC(C)(O)C=Cc1cnccc1Br 271570a_200016258132_100010138639 [0,1,0,0,0,1|1,0,1]=4 1827 B13R1.157 CC(C)(O)C=Cc1cnccc1Cl 271570a_200016258132_100009995489 [0,1,0,0,0,1|1,0,1]=4 1828 B13R1.157 CC(C)(O)C=Cc1cnccc1F 271570a_200016258132_100009820683 [0,1,0,0,0,1|1,0,1]=4 1829 B13R1.157 CC(C)(O)C=Cc1cnccc1N 271570a_200016258132_100000047001 [0,1,0,0,0,1|1,0,1]=4 1830 B13R1.157 CC(C)(O)C=Cc1ncccc1Br 271570a_200016258132_100000696092 [0,1,0,0,0,1|1,0,1]=4 1831 B13R1.157 CC(C)(O)C=Cc1ncccc1Cl 271570a_200016258132_100011356963 [0,1,0,0,0,1|1,0,1]=4 1832 B13R1.157 CC(C)(O)C=Cc1ncccc1F 271570a_200016258132_100000685392 [0,1,0,0,0,1|1,0,1]=4 1833 B13R1.157 CC(C)(O)C=Cc1ncccc1N 271570a_200016258132_100000688686 [0,1,0,0,0,1|1,0,1]=4 1834 B13R1.157 CC(C)(O)C=Cc1ncccc1O 271570a_200016258132_100000034122 [0,1,0,0,0,1|1,0,1]=4 1835 B13R1.157 CC(C)(O)CNc1ccccc1Br 34a_100000210017_100000764493 [0,1,0,0,0,1|0,0,0]=2 1836 B13R1.157 CC(C)(O)CNc1ccccc1Cl 34a_100000185783_100000764493 [0,1,0,0,0,1|0,0,0]=2 1837 B13R1.157 CC(C)(O)CNc1ccccc1F 34a_100000210422_100000764493 [0,1,0,0,0,1|0,0,0]=2 1838 B13R1.157 CC(C)(O)CNc1ccccc1I 34a_100000210053_100000764493 [0,1,0,0,0,1|0,0,0]=2 1839 B13R1.157 CC(C)(O)CNc1ccccc1O 34a_100000185747_100000764493 [0,1,0,0,0,1|0,0,0]=2 1840 B13R1.157 CC(C)(O)CNc1ccn[nH]c1=O 27a_100000751335_100000087129 [0,1,0,0,0,1|2,0,0]=4 1841 B13R1.157 CC(C)(O)CNc1ccncc1Br 27a_100000751335_100000726257 [0,1,0,0,0,1|1,0,0]=3 1842 B13R1.157 CC(C)(O)CNc1ccncc1F 27a_100000751335_100000035921 [0,1,0,0,0,1|1,0,0]=3 1843 B13R1.157 CC(C)(O)CNc1ncccc1Br 27a_100000751335_100000696092 [0,1,0,0,0,1|1,0,0]=3 1844 B13R1.157 CC(C)(O)CNc1nccnc1F 27a_100000751335_200010125657 [0,1,0,0,0,1|2,0,0]=4 1845 B13R1.157 CC(C)(O)CNc1ncncc1F 27a_100000751335_100000069762 [0,1,0,0,0,1|2,0,0]=4 1846 B13R1.157 CC(C)(O)CNc1ncncc1N 27a_100000751335_100000709731 [0,1,0,0,0,1|2,0,0]=4 1847 B13R1.157 CC(C)(O)COc1cccc[n+]1[O-] 7a_100000211761_100000764493 [0,1,0,0,0,1|1,0,0]=3 1848 B13R1.157 CC(C)(O)COc1ccccc1Br 34a_100000181306_100000764493 [0,1,0,0,0,1|0,0,0]=2 1849 B13R1.157 CC(C)(O)COc1ccccc1Br 7a_100000181306_100000764493 [0,1,0,0,0,1|0,0,0]=2 1850 B13R1.157 CC(C)(O)COc1ccccc1Cl 34a_100000210172_100000764493 [0,1,0,0,0,1|0,0,0]=2 1851 B13R1.157 CC(C)(O)COc1ccccc1Cl 7a_100000210172_100000764493 [0,1,0,0,0,1|0,0,0]=2 1852 B13R1.157 CC(C)(O)COc1ccccc1F 34a_100000210171_100000764493 [0,1,0,0,0,1|0,0,0]=2 1853 B13R1.157 CC(C)(O)COc1ccccc1F 7a_100000210171_100000764493 [0,1,0,0,0,1|0,0,0]=2 1854 B13R1.157 CC(C)(O)COc1ccccc1I 34a_100000739446_100000764493 [0,1,0,0,0,1|0,0,0]=2 1855 B13R1.157 CC(C)(O)COc1ccccc1I 7a_100000739446_100000764493 [0,1,0,0,0,1|0,0,0]=2 1856 B13R1.157 CC(C)(O)COc1ccccc1N 34a_100000185747_100000764493 [0,1,0,0,0,1|0,0,0]=2 1857 B13R1.157 CC(C)(O)COc1ccccc1N 7a_100000185747_100000764493 [0,1,0,0,0,1|0,0,0]=2 1858 B13R1.157 CC(C)(O)COc1cccnc1Br 34a_100000744436_100000764493 [0,1,0,0,0,1|1,0,0]=3 1859 B13R1.157 CC(C)(O)COc1cccnc1Br 7a_100000744436_100000764493 [0,1,0,0,0,1|1,0,0]=3 1860 B13R1.157 CC(C)(O)COc1cccnc1Cl 34a_100000757616_100000764493 [0,1,0,0,0,1|1,0,0]=3 1861 B13R1.157 CC(C)(O)COc1cccnc1Cl 7a_100000757616_100000764493 [0,1,0,0,0,1|1,0,0]=3 1862 B13R1.157 CC(C)(O)COc1cccnc1F 34a_100000061740_100000764493 [0,1,0,0,0,1|1,0,0]=3 1863 B13R1.157 CC(C)(O)COc1cccnc1F 7a_100000061740_100000764493 [0,1,0,0,0,1|1,0,0]=3 1864 B13R1.157 CC(C)(O)COc1cccnc1I 34a_100000034122_100000764493 [0,1,0,0,0,1|1,0,0]=3 1865 B13R1.157 CC(C)(O)COc1cccnc1I 7a_100000034122_100000764493 [0,1,0,0,0,1|1,0,0]=3 1866 B13R1.157 CC(C)(O)COc1cccnc1N 34a_100000211975_100000764493 [0,1,0,0,0,1|1,0,0]=3 1867 B13R1.157 CC(C)(O)COc1cccnc1N 7a_100000211975_100000764493 [0,1,0,0,0,1|1,0,0]=3 1868 B13R1.157 CC(C)(O)COc1cccoc1=O 34a_100000077404_100000764493 [0,1,0,0,0,1|1,0,0]=3 1869 B13R1.157 CC(C)(O)COc1cccoc1=O 7a_100000077404_100000764493 [0,1,0,0,0,1|1,0,0]=3 1870 B13R1.157 CC(C)(O)COc1ccncc1Br 34a_100011996408_100000764493 [0,1,0,0,0,1|1,0,0]=3 1871 B13R1.157 CC(C)(O)COc1ccncc1Cl 34a_100011997054_100000764493 [0,1,0,0,0,1|1,0,0]=3 1872 B13R1.157 CC(C)(O)COc1ccncc1F 34a_200000081243_100000764493 [0,1,0,0,0,1|1,0,0]=3 1873 B13R1.157 CC(C)(O)COc1cnccc1Cl 34a_100011996695_100000764493 [0,1,0,0,0,1|1,0,0]=3 1874 B13R1.157 CC(C)(O)COc1cnccc1I 34a_100000050107_100000764493 [0,1,0,0,0,1|1,0,0]=3 1875 B13R1.157 CC(C)(O)COc1cnccc1N 34a_100000753702_100000764493 [0,1,0,0,0,1|1,0,0]=3 1876 B13R1.157 CC(C)(O)COc1cncnc1N 7a_100000112926_100000764493 [0,1,0,0,0,1|2,0,0]=4 1877 B13R1.157 CC(C)(O)COc1coccc1=O 34a_100000060831_100000764493 [0,1,0,0,0,1|1,0,0]=3 1878 B13R1.157 CC(C)(O)COc1ncccc1Cl 34a_100011290957_100000764493 [0,1,0,0,0,1|1,0,0]=3 1879 B13R1.157 CC(C)(O)COc1ncccc1F 34a_100011219419_100000764493 [0,1,0,0,0,1|1,0,0]=3 1880 B13R1.157 CC(C)(O)COc1ncccc1N 34a_100000746358_100000764493 [0,1,0,0,0,1|1,0,0]=3 1881 B13R1.157 CC(C)(O)CSc1c[nH]ccc1=O 62a_100000764493_100009998708 [0,1,0,0,0,1|1,0,0]=3 1882 B13R1.157 CC(C)(O)CSc1c[nH]ccc1=O 62a_100009998708_100000764493 [0,1,0,0,0,1|1,0,0]=3 1883 B13R1.157 CC(C)(O)CSc1c[nH]ccc1=S 62a_100000764493_200012280681 [0,1,0,0,0,1|1,0,0]=3 1884 B13R1.157 CC(C)(O)CSc1c[nH]ccc1=S 62a_200012280681_100000764493 [0,1,0,0,0,1|1,0,0]=3 1885 B13R1.157 CC(C)(O)CSc1cccc[n+]1[O-] 62a_100000764493_200000042595 [0,1,0,0,0,1|1,0,0]=3 1886 B13R1.157 CC(C)(O)CSc1ccccc1Br 62a_100000695589_100000764493 [0,1,0,0,0,1|0,0,0]=2 1887 B13R1.157 CC(C)(O)CSc1ccccc1Br 62a_100000764493_100000695589 [0,1,0,0,0,1|0,0,0]=2 1888 B13R1.157 CC(C)(O)CSc1ccccc1Cl 62a_100000764095_100000764493 [0,1,0,0,0,1|0,0,0]=2 1889 B13R1.157 CC(C)(O)CSc1ccccc1Cl 62a_100000764493_100000764095 [0,1,0,0,0,1|0,0,0]=2 1890 B13R1.157 CC(C)(O)CSc1ccccc1F 62a_100000764493_100011215700 [0,1,0,0,0,1|0,0,0]=2 1891 B13R1.157 CC(C)(O)CSc1ccccc1F 62a_100011215700_100000764493 [0,1,0,0,0,1|0,0,0]=2 1892 B13R1.157 CC(C)(O)CSc1ccccc1N 62a_100000210017_100000764493 [0,1,0,0,0,1|0,0,0]=2 1893 B13R1.157 CC(C)(O)CSc1ccccc1N 62a_100000764493_100000210017 [0,1,0,0,0,1|0,0,0]=2 1894 B13R1.157 CC(C)(O)CSc1ccccc1O 62a_100000739446_100000764493 [0,1,0,0,0,1|0,0,0]=2 1895 B13R1.157 CC(C)(O)CSc1ccccc1O 62a_100000764493_100000739446 [0,1,0,0,0,1|0,0,0]=2 1896 B13R1.157 CC(C)(O)CSc1cccnc1Br 62a_100000764493_100010202626 [0,1,0,0,0,1|1,0,0]=3 1897 B13R1.157 CC(C)(O)CSc1cccnc1Br 62a_100010202626_100000764493 [0,1,0,0,0,1|1,0,0]=3 1898 B13R1.157 CC(C)(O)CSc1cccnc1Cl 62a_100000036424_100000764493 [0,1,0,0,0,1|1,0,0]=3 1899 B13R1.157 CC(C)(O)CSc1cccnc1Cl 62a_100000764493_100000036424 [0,1,0,0,0,1|1,0,0]=3 1900 B13R1.157 CC(C)(O)CSc1cccnc1F 62a_100000764493_100009816115 [0,1,0,0,0,1|1,0,0]=3 1901 B13R1.157 CC(C)(O)CSc1cccnc1F 62a_100009816115_100000764493 [0,1,0,0,0,1|1,0,0]=3 1902 B13R1.157 CC(C)(O)CSc1cccnc1N 62a_100000045569_100000764493 [0,1,0,0,0,1|1,0,0]=3 1903 B13R1.157 CC(C)(O)CSc1cccnc1N 62a_100000764493_100000045569 [0,1,0,0,0,1|1,0,0]=3 1904 B13R1.157 CC(C)(O)CSc1cccnc1O 62a_100000760158_100000764493 [0,1,0,0,0,1|1,0,0]=3 1905 B13R1.157 CC(C)(O)CSc1cccnc1O 62a_100000764493_100000760158 [0,1,0,0,0,1|1,0,0]=3 1906 B13R1.157 CC(C)(O)CSc1ccn[nH]c1=O 62a_100000764493_100000087129 [0,1,0,0,0,1|2,0,0]=4 1907 B13R1.157 CC(C)(O)CSc1ccncc1Br 62a_100000726257_100000764493 [0,1,0,0,0,1|1,0,0]=3 1908 B13R1.157 CC(C)(O)CSc1ccncc1Br 62a_100000764493_100000726257 [0,1,0,0,0,1|1,0,0]=3 1909 B13R1.157 CC(C)(O)CSc1ccncc1Cl 62a_100000708259_100000764493 [0,1,0,0,0,1|1,0,0]=3 1910 B13R1.157 CC(C)(O)CSc1ccncc1Cl 62a_100000764493_100000708259 [0,1,0,0,0,1|1,0,0]=3 1911 B13R1.157 CC(C)(O)CSc1ccncc1F 62a_100000047030_100000764493 [0,1,0,0,0,1|1,0,0]=3 1912 B13R1.157 CC(C)(O)CSc1ccncc1F 62a_100000764493_100000047030 [0,1,0,0,0,1|1,0,0]=3 1913 B13R1.157 CC(C)(O)CSc1ccncc1N 62a_100000756074_100000764493 [0,1,0,0,0,1|1,0,0]=3 1914 B13R1.157 CC(C)(O)CSc1ccncc1N 62a_100000764493_100000756074 [0,1,0,0,0,1|1,0,0]=3 1915 B13R1.157 CC(C)(O)CSc1ccncc1O 62a_100000764493_100009817591 [0,1,0,0,0,1|1,0,0]=3 1916 B13R1.157 CC(C)(O)CSc1ccncc1O 62a_100009817591_100000764493 [0,1,0,0,0,1|1,0,0]=3 1917 B13R1.157 CC(C)(O)CSc1cnccc1Br 62a_100000764493_100010138639 [0,1,0,0,0,1|1,0,0]=3 1918 B13R1.157 CC(C)(O)CSc1cnccc1Br 62a_100010138639_100000764493 [0,1,0,0,0,1|1,0,0]=3 1919 B13R1.157 CC(C)(O)CSc1cnccc1Cl 62a_100000764493_100009995489 [0,1,0,0,0,1|1,0,0]=3 1920 B13R1.157 CC(C)(O)CSc1cnccc1Cl 62a_100009995489_100000764493 [0,1,0,0,0,1|1,0,0]=3 1921 B13R1.157 CC(C)(O)CSc1cnccc1F 62a_100000764493_100009820683 [0,1,0,0,0,1|1,0,0]=3 1922 B13R1.157 CC(C)(O)CSc1cnccc1F 62a_100009820683_100000764493 [0,1,0,0,0,1|1,0,0]=3 1923 B13R1.157 CC(C)(O)CSc1cnccc1N 62a_100000047001_100000764493 [0,1,0,0,0,1|1,0,0]=3 1924 B13R1.157 CC(C)(O)CSc1cnccc1N 62a_100000764493_100000047001 [0,1,0,0,0,1|1,0,0]=3 1925 B13R1.157 CC(C)(O)CSc1cncnc1Br 62a_100000764493_200012461658 [0,1,0,0,0,1|2,0,0]=4 1926 B13R1.157 CC(C)(O)CSc1cncnc1Br 62a_200012461658_100000764493 [0,1,0,0,0,1|2,0,0]=4 1927 B13R1.157 CC(C)(O)CSc1cncnc1Cl 62a_100000758962_100000764493 [0,1,0,0,0,1|2,0,0]=4 1928 B13R1.157 CC(C)(O)CSc1cncnc1Cl 62a_100000764493_100000758962 [0,1,0,0,0,1|2,0,0]=4 1929 B13R1.157 CC(C)(O)CSc1cncnc1N 62a_100000764493_100011996079 [0,1,0,0,0,1|2,0,0]=4 1930 B13R1.157 CC(C)(O)CSc1cncnc1N 62a_100011996079_100000764493 [0,1,0,0,0,1|2,0,0]=4 1931 B13R1.157 CC(C)(O)CSc1cncnc1O 62a_100000751107_100000764493 [0,1,0,0,0,1|2,0,0]=4 1932 B13R1.157 CC(C)(O)CSc1cncnc1O 62a_100000764493_100000751107 [0,1,0,0,0,1|2,0,0]=4 1933 B13R1.157 CC(C)(O)CSc1cnncc1N 62a_100000764493_100009829405 [0,1,0,0,0,1|2,0,0]=4 1934 B13R1.157 CC(C)(O)CSc1cnncc1N 62a_100009829405_100000764493 [0,1,0,0,0,1|2,0,0]=4 1935 B13R1.157 CC(C)(O)CSc1ncc[nH]c1=O 62a_100000764493_100000763361 [0,1,0,0,0,1|2,0,0]=4 1936 B13R1.157 CC(C)(O)CSc1ncccc1Br 62a_100000696092_100000764493 [0,1,0,0,0,1|1,0,0]=3 1937 B13R1.157 CC(C)(O)CSc1ncccc1Br 62a_100000764493_100000696092 [0,1,0,0,0,1|1,0,0]=3 1938 B13R1.157 CC(C)(O)CSc1ncccc1Cl 62a_100000764493_100011356963 [0,1,0,0,0,1|1,0,0]=3 1939 B13R1.157 CC(C)(O)CSc1ncccc1Cl 62a_100011356963_100000764493 [0,1,0,0,0,1|1,0,0]=3 1940 B13R1.157 CC(C)(O)CSc1ncccc1F 62a_100000685392_100000764493 [0,1,0,0,0,1|1,0,0]=3 1941 B13R1.157 CC(C)(O)CSc1ncccc1F 62a_100000764493_100000685392 [0,1,0,0,0,1|1,0,0]=3 1942 B13R1.157 CC(C)(O)CSc1ncccc1N 62a_100000688686_100000764493 [0,1,0,0,0,1|1,0,0]=3 1943 B13R1.157 CC(C)(O)CSc1ncccc1N 62a_100000764493_100000688686 [0,1,0,0,0,1|1,0,0]=3 1944 B13R1.157 CC(C)(O)CSc1ncccc1O 62a_100000034122_100000764493 [0,1,0,0,0,1|1,0,0]=3 1945 B13R1.157 CC(C)(O)CSc1ncccc1O 62a_100000764493_100000034122 [0,1,0,0,0,1|1,0,0]=3 1946 B13R1.157 CC(C)(O)CSc1nccnc1Cl 62a_100000764493_100010886584 [0,1,0,0,0,1|2,0,0]=4 1947 B13R1.157 CC(C)(O)CSc1nccnc1Cl 62a_100010886584_100000764493 [0,1,0,0,0,1|2,0,0]=4 1948 B13R1.157 CC(C)(O)CSc1nccnc1F 62a_100000764493_200010125657 [0,1,0,0,0,1|2,0,0]=4 1949 B13R1.157 CC(C)(O)CSc1nccnc1F 62a_200010125657_100000764493 [0,1,0,0,0,1|2,0,0]=4 1950 B13R1.157 CC(C)(O)CSc1nccnc1N 62a_100000747729_100000764493 [0,1,0,0,0,1|2,0,0]=4 1951 B13R1.157 CC(C)(O)CSc1nccnc1N 62a_100000764493_100000747729 [0,1,0,0,0,1|2,0,0]=4 1952 B13R1.157 CC(C)(O)CSc1ncncc1F 62a_100000069762_100000764493 [0,1,0,0,0,1|2,0,0]=4 1953 B13R1.157 CC(C)(O)CSc1ncncc1F 62a_100000764493_100000069762 [0,1,0,0,0,1|2,0,0]=4 1954 B13R1.157 CC(C)(O)CSc1ncncc1N 62a_100000709731_100000764493 [0,1,0,0,0,1|2,0,0]=4 1955 B13R1.157 CC(C)(O)CSc1ncncc1N 62a_100000764493_100000709731 [0,1,0,0,0,1|2,0,0]=4 1956 B13R1.157 C[N+](C)(C)CSc1ccccc1Br 62a_100000695589_200000036245 [0,1,0,0,0,1|2,0,0]=4 1957 B13R1.157 C[N+](C)(C)CSc1ccccc1Br 62a_200000036245_100000695589 [0,1,0,0,0,1|2,0,0]=4 1958 B13R1.157 C[N+](C)(C)CSc1ccccc1Cl 62a_100000764095_200000036245 [0,1,0,0,0,1|2,0,0]=4 1959 B13R1.157 C[N+](C)(C)CSc1ccccc1Cl 62a_200000036245_100000764095 [0,1,0,0,0,1|2,0,0]=4 1960 B13R1.157 C[N+](C)(C)CSc1ccccc1F 62a_100011215700_200000036245 [0,1,0,0,0,1|2,0,0]=4 1961 B13R1.157 C[N+](C)(C)CSc1ccccc1F 62a_200000036245_100011215700 [0,1,0,0,0,1|2,0,0]=4 1962 B13R1.157 C[N+](C)(C)CSc1ccccc1N 62a_100000210017_200000036245 [0,1,0,0,0,1|2,0,0]=4 1963 B13R1.157 C[N+](C)(C)CSc1ccccc1N 62a_200000036245_100000210017 [0,1,0,0,0,1|2,0,0]=4 1964 B13R1.157 C[N+](C)(C)CSc1ccccc1O 62a_100000739446_200000036245 [0,1,0,0,0,1|2,0,0]=4 1965 B13R1.157 C[N+](C)(C)CSc1ccccc1O 62a_200000036245_100000739446 [0,1,0,0,0,1|2,0,0]=4 1966 B13R1.157 C[Si](C)(C)COc1ccccc1Br 7a_100000181306_100000233785 [0,1,0,0,0,1|1,1,0]=4 1967 B13R1.157 C[Si](C)(C)COc1ccccc1Cl 7a_100000210172_100000233785 [0,1,0,0,0,1|1,1,0]=4 1968 B13R1.157 C[Si](C)(C)COc1ccccc1F 7a_100000210171_100000233785 [0,1,0,0,0,1|1,1,0]=4 1969 B13R1.157 C[Si](C)(C)COc1ccccc1I 7a_100000739446_100000233785 [0,1,0,0,0,1|1,1,0]=4 1970 B13R1.157 C[Si](C)(C)COc1ccccc1N 7a_100000185747_100000233785 [0,1,0,0,0,1|1,1,0]=4 1971 B13R1.157 C[Si](C)(C)CSc1ccccc1Br 62a_100000037933_100000695589 [0,1,0,0,0,1|1,1,0]=4 1972 B13R1.157 C[Si](C)(C)CSc1ccccc1Br 62a_100000695589_100000037933 [0,1,0,0,0,1|1,1,0]=4 1973 B13R1.157 C[Si](C)(C)CSc1ccccc1Cl 62a_100000037933_100000764095 [0,1,0,0,0,1|1,1,0]=4 1974 B13R1.157 C[Si](C)(C)CSc1ccccc1Cl 62a_100000764095_100000037933 [0,1,0,0,0,1|1,1,0]=4 1975 B13R1.157 C[Si](C)(C)CSc1ccccc1F 62a_100000037933_100011215700 [0,1,0,0,0,1|1,1,0]=4 1976 B13R1.157 C[Si](C)(C)CSc1ccccc1F 62a_100011215700_100000037933 [0,1,0,0,0,1|1,1,0]=4 1977 B13R1.157 C[Si](C)(C)CSc1ccccc1N 62a_100000037933_100000210017 [0,1,0,0,0,1|1,1,0]=4 1978 B13R1.157 C[Si](C)(C)CSc1ccccc1N 62a_100000210017_100000037933 [0,1,0,0,0,1|1,1,0]=4 1979 B13R1.157 C[Si](C)(C)CSc1ccccc1O 62a_100000037933_100000739446 [0,1,0,0,0,1|1,1,0]=4 1980 B13R1.157 C[Si](C)(C)CSc1ccccc1O 62a_100000739446_100000037933 [0,1,0,0,0,1|1,1,0]=4 1981 B13R1.157 C[n+]1ccccc1C=CC(C)(C)O 271570a_200016258132_100000212160 [0,1,0,0,0,1|1,0,1]=4 1982 B13R1.157 C[n+]1ccccc1SCC(C)(C)C 62a_100011219605_100000212160 [0,1,0,0,0,1|2,0,0]=4 1983 B13R1.157 C[n+]1ccccc1SCC(C)(C)F 62a_100011997219_100000212160 [0,1,0,0,0,1|2,0,0]=4 1984 B13R1.157 C[n+]1ccccc1SCC(C)(C)O 62a_100000764493_100000212160 [0,1,0,0,0,1|1,0,0]=3 1985 B13R1.157 Cc1ccccc1C=CC(C)(C)C 271570a_100102527731_100000210755 [0,1,0,0,0,1|1,0,1]=4 1986 B13R1.157 Cc1ccccc1C=CC(C)(C)O 271570a_200016258132_100000210755 [0,1,0,0,0,1|0,0,1]=3 1987 B13R1.157 Cc1ccccc1CNC(C)(C)C 207a_100000715429_100000211143 [0,1,0,0,0,1|1,0,0]=3 1988 B13R1.157 Cc1ccccc1CNC(C)(C)C 2230a_100000715429_100000211839 [0,1,0,0,0,1|1,0,0]=3 1989 B13R1.157 Cc1ccccc1CNC(C)(C)C 34a_100000174972_100000210625 [0,1,0,0,0,1|1,0,0]=3 1990 B13R1.157 Cc1ccccc1COC(C)(C)C 34a_100000698903_100000210625 [0,1,0,0,0,1|1,0,0]=3 1991 B13R1.157 Cc1ccccc1COC(C)(C)C 34a_100015890283_100000211839 [0,1,0,0,0,1|1,0,0]=3 1992 B13R1.157 Cc1ccccc1COC(C)(C)C 7a_100015890283_100000211839 [0,1,0,0,0,1|1,0,0]=3 1993 B13R1.157 Cc1ccccc1CSC(C)(C)C 62a_100000211839_100000211941 [0,1,0,0,0,1|1,0,0]=3 1994 B13R1.157 Cc1ccccc1CSC(C)(C)C 62a_100000211941_100000211839 [0,1,0,0,0,1|1,0,0]=3 1995 B13R1.157 Cc1ccccc1NCC(C)(C)C 34a_100015192222_100011219605 [0,1,0,0,0,1|1,0,0]=3 1996 B13R1.157 Cc1ccccc1NCC(C)(C)F 34a_100015192222_100011997219 [0,1,0,0,0,1|1,0,0]=3 1997 B13R1.157 Cc1ccccc1NCC(C)(C)O 34a_100015192222_100000764493 [0,1,0,0,0,1|0,0,0]=2 1998 B13R1.157 Cc1ccccc1OCC(C)(C)C 34a_100000210338_100011219605 [0,1,0,0,0,1|1,0,0]=3 1999 B13R1.157 Cc1ccccc1OCC(C)(C)F 34a_100000210338_100011997219 [0,1,0,0,0,1|1,0,0]=3 2000 B13R1.157 Cc1ccccc1OCC(C)(C)O 34a_100000210338_100000764493 [0,1,0,0,0,1|0,0,0]=2 2001 B13R1.157 Cc1ccccc1OCC(C)(C)O 7a_100000210338_100000764493 [0,1,0,0,0,1|0,0,0]=2 2002 B13R1.157 Cc1ccccc1OC[Si](C)(C)C 7a_100000210338_100000233785 [0,1,0,0,0,1|1,1,0]=4 2003 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100000210755_100011219605 [0,1,0,0,0,1|1,0,0]=3 2004 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100011219605_100000210755 [0,1,0,0,0,1|1,0,0]=3 2005 B13R1.157 Cc1ccccc1SCC(C)(C)F 62a_100000210755_100011997219 [0,1,0,0,0,1|1,0,0]=3 2006 B13R1.157 Cc1ccccc1SCC(C)(C)F 62a_100011997219_100000210755 [0,1,0,0,0,1|1,0,0]=3 2007 B13R1.157 Cc1ccccc1SCC(C)(C)O 62a_100000210755_100000764493 [0,1,0,0,0,1|0,0,0]=2 2008 B13R1.157 Cc1ccccc1SCC(C)(C)O 62a_100000764493_100000210755 [0,1,0,0,0,1|0,0,0]=2 2009 B13R1.157 Cc1ccccc1SC[N+](C)(C)C 62a_100000210755_200000036245 [0,1,0,0,0,1|2,0,0]=4 2010 B13R1.157 Cc1ccccc1SC[N+](C)(C)C 62a_200000036245_100000210755 [0,1,0,0,0,1|2,0,0]=4 2011 B13R1.157 Cc1ccccc1SC[Si](C)(C)C 62a_100000037933_100000210755 [0,1,0,0,0,1|1,1,0]=4 2012 B13R1.157 Cc1ccccc1SC[Si](C)(C)C 62a_100000210755_100000037933 [0,1,0,0,0,1|1,1,0]=4 2013 B13R1.157 Cc1cccnc1C=CC(C)(C)O 271570a_200016258132_100000751373 [0,1,0,0,0,1|1,0,1]=4 2014 B13R1.157 Cc1cccnc1CNC(C)(C)C 207a_100000715429_100000698913 [0,1,0,0,0,1|2,0,0]=4 2015 B13R1.157 Cc1cccnc1CNC(C)(C)C 2230a_100000715429_100000696600 [0,1,0,0,0,1|2,0,0]=4 2016 B13R1.157 Cc1cccnc1CNC(C)(C)C 34a_100011223789_100000210625 [0,1,0,0,0,1|2,0,0]=4 2017 B13R1.157 Cc1cccnc1COC(C)(C)C 34a_100000698912_100000210625 [0,1,0,0,0,1|2,0,0]=4 2018 B13R1.157 Cc1cccnc1COC(C)(C)C 34a_100015890283_100000696600 [0,1,0,0,0,1|2,0,0]=4 2019 B13R1.157 Cc1cccnc1COC(C)(C)C 7a_100015890283_100000696600 [0,1,0,0,0,1|2,0,0]=4 2020 B13R1.157 Cc1cccnc1CSC(C)(C)C 62a_100000211941_100000696600 [0,1,0,0,0,1|2,0,0]=4 2021 B13R1.157 Cc1cccnc1CSC(C)(C)C 62a_100000696600_100000211941 [0,1,0,0,0,1|2,0,0]=4 2022 B13R1.157 Cc1cccnc1SCC(C)(C)C 62a_100000751373_100011219605 [0,1,0,0,0,1|2,0,0]=4 2023 B13R1.157 Cc1cccnc1SCC(C)(C)C 62a_100011219605_100000751373 [0,1,0,0,0,1|2,0,0]=4 2024 B13R1.157 Cc1cccnc1SCC(C)(C)F 62a_100000751373_100011997219 [0,1,0,0,0,1|2,0,0]=4 2025 B13R1.157 Cc1cccnc1SCC(C)(C)F 62a_100011997219_100000751373 [0,1,0,0,0,1|2,0,0]=4 2026 B13R1.157 Cc1cccnc1SCC(C)(C)O 62a_100000751373_100000764493 [0,1,0,0,0,1|1,0,0]=3 2027 B13R1.157 Cc1cccnc1SCC(C)(C)O 62a_100000764493_100000751373 [0,1,0,0,0,1|1,0,0]=3 2028 B13R1.157 Cc1ccncc1C=CC(C)(C)O 271570a_200016258132_100000761580 [0,1,0,0,0,1|1,0,1]=4 2029 B13R1.157 Cc1ccncc1CNC(C)(C)C 207a_100000715429_100000685662 [0,1,0,0,0,1|2,0,0]=4 2030 B13R1.157 Cc1ccncc1CNC(C)(C)C 2230a_100000715429_100000690890 [0,1,0,0,0,1|2,0,0]=4 2031 B13R1.157 Cc1ccncc1COC(C)(C)C 34a_100011996381_100000210625 [0,1,0,0,0,1|2,0,0]=4 2032 B13R1.157 Cc1ccncc1COC(C)(C)C 34a_100015890283_100000690890 [0,1,0,0,0,1|2,0,0]=4 2033 B13R1.157 Cc1ccncc1COC(C)(C)C 7a_100015890283_100000690890 [0,1,0,0,0,1|2,0,0]=4 2034 B13R1.157 Cc1ccncc1CSC(C)(C)C 62a_100000211941_100000690890 [0,1,0,0,0,1|2,0,0]=4 2035 B13R1.157 Cc1ccncc1CSC(C)(C)C 62a_100000690890_100000211941 [0,1,0,0,0,1|2,0,0]=4 2036 B13R1.157 Cc1ccncc1OCC(C)(C)C 34a_100011997053_100011219605 [0,1,0,0,0,1|2,0,0]=4 2037 B13R1.157 Cc1ccncc1OCC(C)(C)F 34a_100011997053_100011997219 [0,1,0,0,0,1|2,0,0]=4 2038 B13R1.157 Cc1ccncc1OCC(C)(C)O 34a_100011997053_100000764493 [0,1,0,0,0,1|1,0,0]=3 2039 B13R1.157 Cc1ccncc1OCC(C)(C)O 7a_100011997053_100000764493 [0,1,0,0,0,1|1,0,0]=3 2040 B13R1.157 Cc1ccncc1SCC(C)(C)C 62a_100000761580_100011219605 [0,1,0,0,0,1|2,0,0]=4 2041 B13R1.157 Cc1ccncc1SCC(C)(C)C 62a_100011219605_100000761580 [0,1,0,0,0,1|2,0,0]=4 2042 B13R1.157 Cc1ccncc1SCC(C)(C)F 62a_100000761580_100011997219 [0,1,0,0,0,1|2,0,0]=4 2043 B13R1.157 Cc1ccncc1SCC(C)(C)F 62a_100011997219_100000761580 [0,1,0,0,0,1|2,0,0]=4 2044 B13R1.157 Cc1ccncc1SCC(C)(C)O 62a_100000761580_100000764493 [0,1,0,0,0,1|1,0,0]=3 2045 B13R1.157 Cc1ccncc1SCC(C)(C)O 62a_100000764493_100000761580 [0,1,0,0,0,1|1,0,0]=3 2046 B13R1.157 Cc1ccnnc1NCC(C)(C)O 27a_100000751335_100000089043 [0,1,0,0,0,1|2,0,0]=4 2047 B13R1.157 Cc1ccnnc1SCC(C)(C)O 62a_100000764493_100000089043 [0,1,0,0,0,1|2,0,0]=4 2048 B13R1.157 Cc1cnccc1C=CC(C)(C)O 271570a_200016258132_100015191297 [0,1,0,0,0,1|1,0,1]=4 2049 B13R1.157 Cc1cnccc1CNC(C)(C)C 2230a_100000715429_100020672808 [0,1,0,0,0,1|2,0,0]=4 2050 B13R1.157 Cc1cnccc1COC(C)(C)C 34a_100011997032_100000210625 [0,1,0,0,0,1|2,0,0]=4 2051 B13R1.157 Cc1cnccc1COC(C)(C)C 34a_100015890283_100020672809 [0,1,0,0,0,1|2,0,0]=4 2052 B13R1.157 Cc1cnccc1COC(C)(C)C 7a_100015890283_100020672808 [0,1,0,0,0,1|2,0,0]=4 2053 B13R1.157 Cc1cnccc1CSC(C)(C)C 62a_100000211941_100020672808 [0,1,0,0,0,1|2,0,0]=4 2054 B13R1.157 Cc1cnccc1CSC(C)(C)C 62a_100020672808_100000211941 [0,1,0,0,0,1|2,0,0]=4 2055 B13R1.157 Cc1cnccc1NCC(C)(C)C 27a_100000743828_100000765111 [0,1,0,0,0,1|2,0,0]=4 2056 B13R1.157 Cc1cnccc1NCC(C)(C)F 27a_100020643315_100000765111 [0,1,0,0,0,1|2,0,0]=4 2057 B13R1.157 Cc1cnccc1NCC(C)(C)O 27a_100000751335_100000765111 [0,1,0,0,0,1|1,0,0]=3 2058 B13R1.157 Cc1cnccc1OCC(C)(C)C 34a_100000694293_100011219605 [0,1,0,0,0,1|2,0,0]=4 2059 B13R1.157 Cc1cnccc1OCC(C)(C)F 34a_100000694293_100011997219 [0,1,0,0,0,1|2,0,0]=4 2060 B13R1.157 Cc1cnccc1OCC(C)(C)O 34a_100000694293_100000764493 [0,1,0,0,0,1|1,0,0]=3 2061 B13R1.157 Cc1cnccc1SCC(C)(C)C 62a_100000765111_100011219605 [0,1,0,0,0,1|2,0,0]=4 2062 B13R1.157 Cc1cnccc1SCC(C)(C)C 62a_100011219605_100000765111 [0,1,0,0,0,1|2,0,0]=4 2063 B13R1.157 Cc1cnccc1SCC(C)(C)F 62a_100000765111_100011997219 [0,1,0,0,0,1|2,0,0]=4 2064 B13R1.157 Cc1cnccc1SCC(C)(C)F 62a_100011997219_100000765111 [0,1,0,0,0,1|2,0,0]=4 2065 B13R1.157 Cc1cnccc1SCC(C)(C)O 62a_100000764493_100000765111 [0,1,0,0,0,1|1,0,0]=3 2066 B13R1.157 Cc1cnccc1SCC(C)(C)O 62a_100000765111_100000764493 [0,1,0,0,0,1|1,0,0]=3 2067 B13R1.157 Cc1cncnc1NCC(C)(C)O 27a_100000751335_100011998708 [0,1,0,0,0,1|2,0,0]=4 2068 B13R1.157 Cc1cncnc1SCC(C)(C)O 62a_100000764493_100011998708 [0,1,0,0,0,1|2,0,0]=4 2069 B13R1.157 Cc1cncnc1SCC(C)(C)O 62a_100011998708_100000764493 [0,1,0,0,0,1|2,0,0]=4 2070 B13R1.157 Cc1ncccc1C=CC(C)(C)O 271570a_200016258132_100000751574 [0,1,0,0,0,1|1,0,1]=4 2071 B13R1.157 Cc1ncccc1CNC(C)(C)C 207a_100000715429_100000751968 [0,1,0,0,0,1|2,0,0]=4 2072 B13R1.157 Cc1ncccc1CNC(C)(C)C 2230a_100000715429_100000732876 [0,1,0,0,0,1|2,0,0]=4 2073 B13R1.157 Cc1ncccc1COC(C)(C)C 34a_100000729262_100000210625 [0,1,0,0,0,1|2,0,0]=4 2074 B13R1.157 Cc1ncccc1COC(C)(C)C 34a_100015890283_100000732876 [0,1,0,0,0,1|2,0,0]=4 2075 B13R1.157 Cc1ncccc1COC(C)(C)C 7a_100015890283_100000732876 [0,1,0,0,0,1|2,0,0]=4 2076 B13R1.157 Cc1ncccc1CSC(C)(C)C 62a_100000211941_100000732876 [0,1,0,0,0,1|2,0,0]=4 2077 B13R1.157 Cc1ncccc1CSC(C)(C)C 62a_100000732876_100000211941 [0,1,0,0,0,1|2,0,0]=4 2078 B13R1.157 Cc1ncccc1OCC(C)(C)C 34a_100000745507_100011219605 [0,1,0,0,0,1|2,0,0]=4 2079 B13R1.157 Cc1ncccc1OCC(C)(C)F 34a_100000745507_100011997219 [0,1,0,0,0,1|2,0,0]=4 2080 B13R1.157 Cc1ncccc1OCC(C)(C)O 34a_100000745507_100000764493 [0,1,0,0,0,1|1,0,0]=3 2081 B13R1.157 Cc1ncccc1OCC(C)(C)O 7a_100000745507_100000764493 [0,1,0,0,0,1|1,0,0]=3 2082 B13R1.157 Cc1ncccc1SCC(C)(C)C 62a_100000751574_100011219605 [0,1,0,0,0,1|2,0,0]=4 2083 B13R1.157 Cc1ncccc1SCC(C)(C)C 62a_100011219605_100000751574 [0,1,0,0,0,1|2,0,0]=4 2084 B13R1.157 Cc1ncccc1SCC(C)(C)F 62a_100000751574_100011997219 [0,1,0,0,0,1|2,0,0]=4 2085 B13R1.157 Cc1ncccc1SCC(C)(C)F 62a_100011997219_100000751574 [0,1,0,0,0,1|2,0,0]=4 2086 B13R1.157 Cc1ncccc1SCC(C)(C)O 62a_100000751574_100000764493 [0,1,0,0,0,1|1,0,0]=3 2087 B13R1.157 Cc1ncccc1SCC(C)(C)O 62a_100000764493_100000751574 [0,1,0,0,0,1|1,0,0]=3 2088 B13R1.157 Cc1nccnc1NCC(C)(C)O 27a_100000751335_100011999405 [0,1,0,0,0,1|2,0,0]=4 2089 B13R1.157 Cc1nccnc1OCC(C)(C)O 34a_100000766352_100000764493 [0,1,0,0,0,1|2,0,0]=4 2090 B13R1.157 Cc1nccnc1SCC(C)(C)O 62a_100000764493_100011999405 [0,1,0,0,0,1|2,0,0]=4 2091 B13R1.157 Cc1nccnc1SCC(C)(C)O 62a_100011999405_100000764493 [0,1,0,0,0,1|2,0,0]=4 2092 B13R1.157 Cc1ncncc1SCC(C)(C)O 62a_100000764493_100009819671 [0,1,0,0,0,1|2,0,0]=4 2093 B13R1.157 Cc1ncncc1SCC(C)(C)O 62a_100009819671_100000764493 [0,1,0,0,0,1|2,0,0]=4 2094 B13R1.254 C#CC(C)(C)NCc1ccccc1 270004a_100000054563_100015611070 [0,1,0,0,0,1|1,0,0]=3 2095 B13R1.254 C#CC(C)(C)NCc1ccccc1 34a_100000054563_100015291786 [0,1,0,0,0,1|1,0,0]=3 2096 B13R1.254 C#CC(C)(C)NCc1ccccc1 34a_100015324214_100000038118 [0,1,0,0,0,1|1,0,0]=3 2097 B13R1.254 C#CC(C)(C)NCc1ccccn1 270004a_100000054563_100000209966 [0,1,0,0,0,1|2,0,0]=4 2098 B13R1.254 C#CC(C)(C)NCc1ccccn1 34a_100000054563_100000721315 [0,1,0,0,0,1|2,0,0]=4 2099 B13R1.254 C#CC(C)(C)NCc1cccnc1 270004a_100000054563_100000209961 [0,1,0,0,0,1|2,0,0]=4 2100 B13R1.254 C#CC(C)(C)NCc1cccnc1 34a_100000054563_100000733263 [0,1,0,0,0,1|2,0,0]=4 2101 B13R1.254 C#CC(C)(C)OCc1ccccc1 34a_100000189450_100015291786 [0,1,0,0,0,1|1,0,0]=3 2102 B13R1.254 C#CC(C)(C)OCc1ccccc1 34a_100000210790_100000038118 [0,1,0,0,0,1|1,0,0]=3 2103 B13R1.254 C#CC(C)(C)OCc1ccccc1 7a_100000189450_100000211182 [0,1,0,0,0,1|1,0,0]=3 2104 B13R1.254 C#CC(C)(C)OCc1ccccn1 34a_100000189450_100000721315 [0,1,0,0,0,1|2,0,0]=4 2105 B13R1.254 C#CC(C)(C)OCc1ccccn1 7a_100000189450_100000721315 [0,1,0,0,0,1|2,0,0]=4 2106 B13R1.254 C#CC(C)(C)OCc1cccnc1 34a_100000189450_100000733263 [0,1,0,0,0,1|2,0,0]=4 2107 B13R1.254 C#CC(C)(C)OCc1cccnc1 7a_100000189450_100000741622 [0,1,0,0,0,1|2,0,0]=4 2108 B13R1.254 C#CC(C)(C)OCc1ccncc1 7a_100000189450_100015193705 [0,1,0,0,0,1|2,0,0]=4 2109 B13R1.254 C#CC(C)(C)SCc1ccccc1 62a_100000038118_100015291786 [0,1,0,0,0,1|1,0,0]=3 2110 B13R1.254 C#CC(C)(C)SCc1ccccc1 62a_100000211182_100000038118 [0,1,0,0,0,1|1,0,0]=3 2111 B13R1.254 C#CC(C)(C)SCc1ccccn1 62a_100000038118_100000721315 [0,1,0,0,0,1|2,0,0]=4 2112 B13R1.254 C#CC(C)(C)SCc1ccccn1 62a_100000721315_100000038118 [0,1,0,0,0,1|2,0,0]=4 2113 B13R1.254 C#CC(C)(C)SCc1cccnc1 62a_100000038118_100000741622 [0,1,0,0,0,1|2,0,0]=4 2114 B13R1.254 C#CC(C)(C)SCc1cccnc1 62a_100000741622_100000038118 [0,1,0,0,0,1|2,0,0]=4 2115 B13R1.254 C#CC(C)(C)SCc1ccncc1 62a_100000038118_100015193705 [0,1,0,0,0,1|2,0,0]=4 2116 B13R1.254 C#CC(C)(C)SCc1ccncc1 62a_100015193705_100000038118 [0,1,0,0,0,1|2,0,0]=4 2117 B13R1.254 C=CC(C)(C)OCc1ccccc1 34a_100011215311_100015291786 [0,1,0,0,0,1|1,0,0]=3 2118 B13R1.254 C=CC(C)(C)OCc1ccccc1 7a_100011215311_100000211182 [0,1,0,0,0,1|1,0,0]=3 2119 B13R1.254 C=CC(C)(C)OCc1ccccn1 34a_100011215311_100000721315 [0,1,0,0,0,1|2,0,0]=4 2120 B13R1.254 C=CC(C)(C)OCc1ccccn1 7a_100011215311_100000721315 [0,1,0,0,0,1|2,0,0]=4 2121 B13R1.254 C=CC(C)(C)OCc1cccnc1 34a_100011215311_100000733263 [0,1,0,0,0,1|2,0,0]=4 2122 B13R1.254 C=CC(C)(C)OCc1cccnc1 7a_100011215311_100000741622 [0,1,0,0,0,1|2,0,0]=4 2123 B13R1.254 C=CC(C)(C)OCc1ccncc1 7a_100011215311_100015193705 [0,1,0,0,0,1|2,0,0]=4 2124 B13R1.254 C=C[Si](C)(C)CSc1ccccc1 62a_100000038793_100000041952 [0,1,0,0,0,1|1,1,0]=4 2125 B13R1.254 C=C[Si](C)(C)CSc1ccccc1 62a_100000719477_100000038793 [0,1,0,0,0,1|1,1,0]=4 2126 B13R1.254 CC(C)(C#Cc1ccccc1)O[13CH3] 34a_100011204173_200025704644 [0,1,0,0,0,1|0,0,1]=3 2127 B13R1.254 CC(C)(C#Cc1ccccc1)O[13CH3] 7a_100011204173_200025704644 [0,1,0,0,0,1|0,0,1]=3 2128 B13R1.254 CC(C)(C#Cc1ccccn1)O[13CH3] 34a_200011216249_200025704644 [0,1,0,0,0,1|1,0,1]=4 2129 B13R1.254 CC(C)(C#Cc1ccccn1)O[13CH3] 7a_200011216249_200025704644 [0,1,0,0,0,1|1,0,1]=4 2130 B13R1.254 CC(C)(C#N)NCc1ccccc1 34a_100015324214_100011162410 [0,1,0,0,0,1|1,0,0]=3 2131 B13R1.254 CC(C)(C#N)OCc1ccccc1 34a_100000210790_100011162410 [0,1,0,0,0,1|1,0,0]=3 2132 B13R1.254 CC(C)(C#N)OCc1ccccc1 34a_200015195151_100015291786 [0,1,0,0,0,1|1,0,0]=3 2133 B13R1.254 CC(C)(C#N)OCc1ccccc1 7a_100000210790_100011162410 [0,1,0,0,0,1|1,0,0]=3 2134 B13R1.254 CC(C)(C#N)OCc1ccccn1 34a_200015195151_100000721315 [0,1,0,0,0,1|2,0,0]=4 2135 B13R1.254 CC(C)(C#N)OCc1cccnc1 34a_200015195151_100000733263 [0,1,0,0,0,1|2,0,0]=4 2136 B13R1.254 CC(C)(C#N)SCc1ccccc1 62a_100000211182_100011162410 [0,1,0,0,0,1|1,0,0]=3 2137 B13R1.254 CC(C)(C#N)SCc1ccccc1 62a_100011162410_100015291786 [0,1,0,0,0,1|1,0,0]=3 2138 B13R1.254 CC(C)(C#N)SCc1ccccn1 62a_100000721315_100011162410 [0,1,0,0,0,1|2,0,0]=4 2139 B13R1.254 CC(C)(C#N)SCc1ccccn1 62a_100011162410_100000721315 [0,1,0,0,0,1|2,0,0]=4 2140 B13R1.254 CC(C)(C#N)SCc1cccnc1 62a_100000741622_100011162410 [0,1,0,0,0,1|2,0,0]=4 2141 B13R1.254 CC(C)(C#N)SCc1cccnc1 62a_100011162410_100000741622 [0,1,0,0,0,1|2,0,0]=4 2142 B13R1.254 CC(C)(C#N)SCc1ccncc1 62a_100011162410_100015193705 [0,1,0,0,0,1|2,0,0]=4 2143 B13R1.254 CC(C)(C#N)SCc1ccncc1 62a_100015193705_100011162410 [0,1,0,0,0,1|2,0,0]=4 2144 B13R1.254 CC(C)(CCc1ccccc1)O[13CH3] 7a_100000750528_200025704644 [0,1,0,0,0,1|0,0,0]=2 2145 B13R1.254 CC(C)(CCl)OCc1ccccc1 7a_100000764493_100000211182 [0,1,0,0,0,1|1,0,0]=3 2146 B13R1.254 CC(C)(CCl)OCc1ccccn1 7a_100000764493_100000721315 [0,1,0,0,0,1|2,0,0]=4 2147 B13R1.254 CC(C)(CCl)OCc1cccnc1 7a_100000764493_100000741622 [0,1,0,0,0,1|2,0,0]=4 2148 B13R1.254 CC(C)(CCl)OCc1ccncc1 7a_100000764493_100015193705 [0,1,0,0,0,1|2,0,0]=4 2149 B13R1.254 CC(C)(CO)CNc1ccccc1 34a_100000106764_100009813988 [0,1,0,0,0,1|0,0,0]=2 2150 B13R1.254 CC(C)(CO)CNc1cccnn1 27a_100020635058_100016991348 [0,1,0,0,0,1|2,0,0]=4 2151 B13R1.254 CC(C)(CO)CNc1ccncn1 27a_100020635058_100000703185 [0,1,0,0,0,1|2,0,0]=4 2152 B13R1.254 CC(C)(CO)CNc1cnccn1 27a_100020635058_100000211759 [0,1,0,0,0,1|2,0,0]=4 2153 B13R1.254 CC(C)(CO)CNc1ncccn1 27a_100020635058_100000211032 [0,1,0,0,0,1|2,0,0]=4 2154 B13R1.254 CC(C)(CO)COc1ccccc1 34a_100000210340_100009813988 [0,1,0,0,0,1|0,0,0]=2 2155 B13R1.254 CC(C)(CO)COc1ccccc1 7a_100000210340_100009813988 [0,1,0,0,0,1|0,0,0]=2 2156 B13R1.254 CC(C)(CO)COc1cccnc1 34a_100000210849_100009813988 [0,1,0,0,0,1|1,0,0]=3 2157 B13R1.254 CC(C)(CO)COc1cccnc1 7a_100000210849_100009813988 [0,1,0,0,0,1|1,0,0]=3 2158 B13R1.254 CC(C)(CO)COc1ccncc1 34a_100000212176_100009813988 [0,1,0,0,0,1|1,0,0]=3 2159 B13R1.254 CC(C)(CO)COc1ccnnc1 34a_100015204005_100009813988 [0,1,0,0,0,1|2,0,0]=4 2160 B13R1.254 CC(C)(CO)COc1cncnc1 7a_100000754086_100009813988 [0,1,0,0,0,1|2,0,0]=4 2161 B13R1.254 CC(C)(CO)CSc1ccccc1 62a_100000719477_100009813988 [0,1,0,0,0,1|0,0,0]=2 2162 B13R1.254 CC(C)(CO)CSc1ccccc1 62a_100009813988_100000041952 [0,1,0,0,0,1|0,0,0]=2 2163 B13R1.254 CC(C)(CO)CSc1ccccn1 62a_100009813988_100011216584 [0,1,0,0,0,1|1,0,0]=3 2164 B13R1.254 CC(C)(CO)CSc1ccccn1 62a_100011216584_100009813988 [0,1,0,0,0,1|1,0,0]=3 2165 B13R1.254 CC(C)(CO)CSc1cccnc1 62a_100000210063_100009813988 [0,1,0,0,0,1|1,0,0]=3 2166 B13R1.254 CC(C)(CO)CSc1cccnc1 62a_100009813988_100000210063 [0,1,0,0,0,1|1,0,0]=3 2167 B13R1.254 CC(C)(CO)CSc1cccnn1 62a_100009813988_100016991348 [0,1,0,0,0,1|2,0,0]=4 2168 B13R1.254 CC(C)(CO)CSc1cccnn1 62a_100016991348_100009813988 [0,1,0,0,0,1|2,0,0]=4 2169 B13R1.254 CC(C)(CO)CSc1ccncc1 62a_100000728582_100009813988 [0,1,0,0,0,1|1,0,0]=3 2170 B13R1.254 CC(C)(CO)CSc1ccncc1 62a_100009813988_100000728582 [0,1,0,0,0,1|1,0,0]=3 2171 B13R1.254 CC(C)(CO)CSc1ccncn1 62a_100000703185_100009813988 [0,1,0,0,0,1|2,0,0]=4 2172 B13R1.254 CC(C)(CO)CSc1ccncn1 62a_100009813988_100000703185 [0,1,0,0,0,1|2,0,0]=4 2173 B13R1.254 CC(C)(CO)CSc1ccnnc1 62a_100000732662_100009813988 [0,1,0,0,0,1|2,0,0]=4 2174 B13R1.254 CC(C)(CO)CSc1ccnnc1 62a_100009813988_100000732662 [0,1,0,0,0,1|2,0,0]=4 2175 B13R1.254 CC(C)(CO)CSc1cnccn1 62a_100000211759_100009813988 [0,1,0,0,0,1|2,0,0]=4 2176 B13R1.254 CC(C)(CO)CSc1cnccn1 62a_100009813988_100000211759 [0,1,0,0,0,1|2,0,0]=4 2177 B13R1.254 CC(C)(CO)CSc1cncnc1 62a_100009813988_100011206942 [0,1,0,0,0,1|2,0,0]=4 2178 B13R1.254 CC(C)(CO)CSc1cncnc1 62a_100011206942_100009813988 [0,1,0,0,0,1|2,0,0]=4 2179 B13R1.254 CC(C)(CO)CSc1ncccn1 62a_100000211032_100009813988 [0,1,0,0,0,1|2,0,0]=4 2180 B13R1.254 CC(C)(CO)CSc1ncccn1 62a_100009813988_100000211032 [0,1,0,0,0,1|2,0,0]=4 2181 B13R1.254 CC(C)(CO)NCc1ccccc1 207a_100000210608_100015611070 [0,1,0,0,0,1|0,0,0]=2 2182 B13R1.254 CC(C)(CO)NCc1ccccc1 2230a_100000210608_100015291786 [0,1,0,0,0,1|0,0,0]=2 2183 B13R1.254 CC(C)(CO)NCc1ccccc1 270004a_100000210608_100015611070 [0,1,0,0,0,1|0,0,0]=2 2184 B13R1.254 CC(C)(CO)NCc1ccccn1 207a_100000210608_100000209966 [0,1,0,0,0,1|1,0,0]=3 2185 B13R1.254 CC(C)(CO)NCc1ccccn1 2230a_100000210608_100000721315 [0,1,0,0,0,1|1,0,0]=3 2186 B13R1.254 CC(C)(CO)NCc1ccccn1 270004a_100000210608_100000209966 [0,1,0,0,0,1|1,0,0]=3 2187 B13R1.254 CC(C)(CO)NCc1cccnc1 207a_100000210608_100000209961 [0,1,0,0,0,1|1,0,0]=3 2188 B13R1.254 CC(C)(CO)NCc1cccnc1 2230a_100000210608_100000741622 [0,1,0,0,0,1|1,0,0]=3 2189 B13R1.254 CC(C)(CO)NCc1cccnc1 270004a_100000210608_100000209961 [0,1,0,0,0,1|1,0,0]=3 2190 B13R1.254 CC(C)(CO)NCc1cccnn1 2230a_100000210608_100016990269 [0,1,0,0,0,1|2,0,0]=4 2191 B13R1.254 CC(C)(CO)NCc1ccncc1 207a_100000210608_100000186114 [0,1,0,0,0,1|1,0,0]=3 2192 B13R1.254 CC(C)(CO)NCc1ccncc1 2230a_100000210608_100015193705 [0,1,0,0,0,1|1,0,0]=3 2193 B13R1.254 CC(C)(CO)NCc1ccnnc1 270004a_100000210608_100011934578 [0,1,0,0,0,1|2,0,0]=4 2194 B13R1.254 CC(C)(CO)NCc1cnccn1 2230a_100000210608_100016995436 [0,1,0,0,0,1|2,0,0]=4 2195 B13R1.254 CC(C)(CO)NCc1cnccn1 270004a_100000210608_100000749867 [0,1,0,0,0,1|2,0,0]=4 2196 B13R1.254 CC(C)(CO)NCc1cncnc1 2230a_100000210608_100015196519 [0,1,0,0,0,1|2,0,0]=4 2197 B13R1.254 CC(C)(CO)NCc1cncnc1 270004a_100000210608_100000749868 [0,1,0,0,0,1|2,0,0]=4 2198 B13R1.254 CC(C)(CO)NCc1ncccn1 2230a_100000210608_100000703007 [0,1,0,0,0,1|2,0,0]=4 2199 B13R1.254 CC(C)(CO)NCc1ncccn1 270004a_100000210608_100011532527 [0,1,0,0,0,1|2,0,0]=4 2200 B13R1.254 CCC(C)(C)NCc1ccccc1 207a_100000211385_100015611070 [0,1,0,0,0,1|1,0,0]=3 2201 B13R1.254 CCC(C)(C)NCc1ccccc1 2230a_100000211385_100015291786 [0,1,0,0,0,1|1,0,0]=3 2202 B13R1.254 CCC(C)(C)NCc1ccccc1 270004a_100000211385_100015611070 [0,1,0,0,0,1|1,0,0]=3 2203 B13R1.254 CCC(C)(C)NCc1ccccn1 207a_100000211385_100000209966 [0,1,0,0,0,1|2,0,0]=4 2204 B13R1.254 CCC(C)(C)NCc1ccccn1 2230a_100000211385_100000721315 [0,1,0,0,0,1|2,0,0]=4 2205 B13R1.254 CCC(C)(C)NCc1ccccn1 270004a_100000211385_100000209966 [0,1,0,0,0,1|2,0,0]=4 2206 B13R1.254 CCC(C)(C)NCc1cccnc1 207a_100000211385_100000209961 [0,1,0,0,0,1|2,0,0]=4 2207 B13R1.254 CCC(C)(C)NCc1cccnc1 2230a_100000211385_100000741622 [0,1,0,0,0,1|2,0,0]=4 2208 B13R1.254 CCC(C)(C)NCc1cccnc1 270004a_100000211385_100000209961 [0,1,0,0,0,1|2,0,0]=4 2209 B13R1.254 CCC(C)(C)NCc1ccncc1 207a_100000211385_100000186114 [0,1,0,0,0,1|2,0,0]=4 2210 B13R1.254 CCC(C)(C)NCc1ccncc1 2230a_100000211385_100015193705 [0,1,0,0,0,1|2,0,0]=4 2211 B13R1.254 CCC(C)(C)OCc1ccccc1 7a_100000210230_100000211182 [0,1,0,0,0,1|1,0,0]=3 2212 B13R1.254 CCC(C)(C)OCc1ccccc1 7a_100000210790_100000210677 [0,1,0,0,0,1|1,0,0]=3 2213 B13R1.254 CCC(C)(C)OCc1ccccn1 7a_100000210230_100000721315 [0,1,0,0,0,1|2,0,0]=4 2214 B13R1.254 CCC(C)(C)OCc1cccnc1 7a_100000210230_100000741622 [0,1,0,0,0,1|2,0,0]=4 2215 B13R1.254 CCC(C)(C)OCc1ccncc1 7a_100000210230_100015193705 [0,1,0,0,0,1|2,0,0]=4 2216 B13R1.254 CCC(C)(C)SCc1ccccc1 62a_100000032637_100015291786 [0,1,0,0,0,1|1,0,0]=3 2217 B13R1.254 CCC(C)(C)SCc1ccccc1 62a_100000211182_100000032637 [0,1,0,0,0,1|1,0,0]=3 2218 B13R1.254 CCC(C)(C)SCc1ccccn1 62a_100000032637_100000721315 [0,1,0,0,0,1|2,0,0]=4 2219 B13R1.254 CCC(C)(C)SCc1ccccn1 62a_100000721315_100000032637 [0,1,0,0,0,1|2,0,0]=4 2220 B13R1.254 CCC(C)(C)SCc1cccnc1 62a_100000032637_100000741622 [0,1,0,0,0,1|2,0,0]=4 2221 B13R1.254 CCC(C)(C)SCc1cccnc1 62a_100000741622_100000032637 [0,1,0,0,0,1|2,0,0]=4 2222 B13R1.254 CCC(C)(C)SCc1ccncc1 62a_100000032637_100015193705 [0,1,0,0,0,1|2,0,0]=4 2223 B13R1.254 CCC(C)(C)SCc1ccncc1 62a_100015193705_100000032637 [0,1,0,0,0,1|2,0,0]=4 2224 B13R1.254 COC(C)(C)C#Cc1ccccc1 34a_100011204173_200000210301 [0,1,0,0,0,1|0,0,1]=3 2225 B13R1.254 COC(C)(C)C#Cc1ccccc1 7a_100011204173_200000210301 [0,1,0,0,0,1|0,0,1]=3 2226 B13R1.254 COC(C)(C)C#Cc1ccccn1 34a_200011216249_200000210301 [0,1,0,0,0,1|1,0,1]=4 2227 B13R1.254 COC(C)(C)C#Cc1ccccn1 7a_200011216249_200000210301 [0,1,0,0,0,1|1,0,1]=4 2228 B13R1.254 COC(C)(C)CCc1ccccc1 7a_100000750528_200000210301 [0,1,0,0,0,1|0,0,0]=2 2229 B13R1.254 COC(C)(C)CNc1ccccc1 34a_100000106764_100000701081 [0,1,0,0,0,1|0,0,0]=2 2230 B13R1.254 COC(C)(C)CNc1cccnn1 27a_100000763424_100016991348 [0,1,0,0,0,1|2,0,0]=4 2231 B13R1.254 COC(C)(C)CNc1ccncn1 27a_100000763424_100000703185 [0,1,0,0,0,1|2,0,0]=4 2232 B13R1.254 COC(C)(C)CNc1cnccn1 27a_100000763424_100000211759 [0,1,0,0,0,1|2,0,0]=4 2233 B13R1.254 COC(C)(C)CNc1ncccn1 27a_100000763424_100000211032 [0,1,0,0,0,1|2,0,0]=4 2234 B13R1.254 COC(C)(C)COc1ccccc1 34a_100000210340_100000701081 [0,1,0,0,0,1|0,0,0]=2 2235 B13R1.254 COC(C)(C)COc1cccnc1 34a_100000210849_100000701081 [0,1,0,0,0,1|1,0,0]=3 2236 B13R1.254 COC(C)(C)COc1ccncc1 34a_100000212176_100000701081 [0,1,0,0,0,1|1,0,0]=3 2237 B13R1.254 COC(C)(C)COc1ccnnc1 34a_100015204005_100000701081 [0,1,0,0,0,1|2,0,0]=4 2238 B13R1.254 COC(C)(C)CSc1ccccc1 62a_100000701081_100000041952 [0,1,0,0,0,1|0,0,0]=2 2239 B13R1.254 COC(C)(C)CSc1ccccc1 62a_100000719477_100000701081 [0,1,0,0,0,1|0,0,0]=2 2240 B13R1.254 COC(C)(C)CSc1ccccn1 62a_100000701081_100011216584 [0,1,0,0,0,1|1,0,0]=3 2241 B13R1.254 COC(C)(C)CSc1ccccn1 62a_100011216584_100000701081 [0,1,0,0,0,1|1,0,0]=3 2242 B13R1.254 COC(C)(C)CSc1cccnc1 62a_100000210063_100000701081 [0,1,0,0,0,1|1,0,0]=3 2243 B13R1.254 COC(C)(C)CSc1cccnc1 62a_100000701081_100000210063 [0,1,0,0,0,1|1,0,0]=3 2244 B13R1.254 COC(C)(C)CSc1cccnn1 62a_100000701081_100016991348 [0,1,0,0,0,1|2,0,0]=4 2245 B13R1.254 COC(C)(C)CSc1cccnn1 62a_100016991348_100000701081 [0,1,0,0,0,1|2,0,0]=4 2246 B13R1.254 COC(C)(C)CSc1ccncc1 62a_100000701081_100000728582 [0,1,0,0,0,1|1,0,0]=3 2247 B13R1.254 COC(C)(C)CSc1ccncc1 62a_100000728582_100000701081 [0,1,0,0,0,1|1,0,0]=3 2248 B13R1.254 COC(C)(C)CSc1ccncn1 62a_100000701081_100000703185 [0,1,0,0,0,1|2,0,0]=4 2249 B13R1.254 COC(C)(C)CSc1ccncn1 62a_100000703185_100000701081 [0,1,0,0,0,1|2,0,0]=4 2250 B13R1.254 COC(C)(C)CSc1ccnnc1 62a_100000701081_100000732662 [0,1,0,0,0,1|2,0,0]=4 2251 B13R1.254 COC(C)(C)CSc1ccnnc1 62a_100000732662_100000701081 [0,1,0,0,0,1|2,0,0]=4 2252 B13R1.254 COC(C)(C)CSc1cnccn1 62a_100000211759_100000701081 [0,1,0,0,0,1|2,0,0]=4 2253 B13R1.254 COC(C)(C)CSc1cnccn1 62a_100000701081_100000211759 [0,1,0,0,0,1|2,0,0]=4 2254 B13R1.254 COC(C)(C)CSc1cncnc1 62a_100000701081_100011206942 [0,1,0,0,0,1|2,0,0]=4 2255 B13R1.254 COC(C)(C)CSc1cncnc1 62a_100011206942_100000701081 [0,1,0,0,0,1|2,0,0]=4 2256 B13R1.254 COC(C)(C)CSc1ncccn1 62a_100000211032_100000701081 [0,1,0,0,0,1|2,0,0]=4 2257 B13R1.254 COC(C)(C)CSc1ncccn1 62a_100000701081_100000211032 [0,1,0,0,0,1|2,0,0]=4 2258 B13R1.254 OCC(F)(F)SCc1ccccc1 62a_100000211182_100011217949 [0,1,0,0,0,1|2,0,0]=4 2259 B13R1.254 OCC(F)(F)SCc1ccccc1 62a_100011217949_100015291786 [0,1,0,0,0,1|2,0,0]=4 2260 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 11a_100000715429_100000185807 [0,1,0,0,0,1|1,0,1]=4 2261 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 1626a_100000715429_100000185807 [0,1,0,0,0,1|1,0,1]=4 2262 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 240690a_100000715429_100000185807 [0,1,0,0,0,1|1,0,1]=4 2263 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 527a_100000715429_100000185807 [0,1,0,0,0,1|1,0,1]=4 2264 B13R1.352 CC(NC(C)(C)C)c1ccccc1 2230a_100000715429_100000230085 [0,1,0,0,0,1|1,0,0]=3 2265 B13R1.352 CC(OC(C)(C)C)c1ccccc1 34a_100015890283_100000211855 [0,1,0,0,0,1|1,0,0]=3 2266 B13R1.352 CC(OC(C)(C)C)c1ccccc1 7a_100015890283_100000230085 [0,1,0,0,0,1|1,0,0]=3 2267 B13R1.352 CC(SC(C)(C)C)c1ccccc1 62a_100000211941_100000230085 [0,1,0,0,0,1|1,0,0]=3 2268 B13R1.352 CC(SC(C)(C)C)c1ccccc1 62a_100000230085_100000211941 [0,1,0,0,0,1|1,0,0]=3 2269 B13R1.352 CN(CC(C)(C)C)c1ccccc1 34a_100000210012_100011219605 [0,1,0,0,0,1|1,0,0]=3 2270 B13R1.352 CN(CC(C)(C)F)c1ccccc1 34a_100000210012_100011997219 [0,1,0,0,0,1|1,0,0]=3 2271 B13R1.352 CN(CC(C)(C)O)c1ccccc1 34a_100000210012_100000764493 [0,1,0,0,0,1|0,0,0]=2 2272 B13R1.352 CN(CC(C)(C)O)c1cccnn1 27a_100000755907_100016991348 [0,1,0,0,0,1|2,0,0]=4 2273 B13R1.352 CN(CC(C)(C)O)c1ccncn1 27a_100000755907_100000703185 [0,1,0,0,0,1|2,0,0]=4 2274 B13R1.352 CN(CC(C)(C)O)c1cnccn1 27a_100000755907_100000211759 [0,1,0,0,0,1|2,0,0]=4 2275 B13R1.352 CN(CC(C)(C)O)c1ncccn1 27a_100000755907_100000211032 [0,1,0,0,0,1|2,0,0]=4 2276 B13R1.352 CN(C[N+](C)(C)C)c1ccccc1 269982a_100000210012_200000036245 [0,1,0,0,0,1|2,0,0]=4 2277 B13R1.352 CN(C[Si](C)(C)C)c1ccccc1 2230a_100000210012_100000037933 [0,1,0,0,0,1|1,1,0]=4 2278 B13R1.352 C[C@@H](OC(C)(C)C)c1ccccc1 34a_100000761318_100000210625 [0,1,0,0,0,1|1,0,0]=3 2279 B13R1.352 C[Si](C)(C)CC(=O)c1ccccc1 1458a_100000185807_100000233785 [0,1,0,0,0,1|1,1,0]=4 2280 B13R1.353 CC(C)(C)C(=O)Cc1ccccc1 1458a_106744555173_100015291786 [0,1,0,0,0,1|1,0,0]=3 2281 B13R1.353 CC(C)(C)C(=O)Cc1ccccn1 1458a_106744555173_100000721315 [0,1,0,0,0,1|2,0,0]=4 2282 B13R1.353 CC(C)(C)C(=O)Cc1cccnc1 1458a_106744555173_100000733263 [0,1,0,0,0,1|2,0,0]=4 2283 B13R1.353 CC(C)(C)C(=O)Cc1ccncc1 1458a_106744555173_100000705612 [0,1,0,0,0,1|2,0,0]=4 2284 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 11a_100000106764_106744555173 [0,1,0,0,0,1|1,0,1]=4 2285 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 1626a_100000106764_106744555173 [0,1,0,0,0,1|1,0,1]=4 2286 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 22a_100000106764_106744555173 [0,1,0,0,0,1|1,0,1]=4 2287 B13R1.353 CC(C)(C)C(=O)Nc1ccccc1 527a_100000106764_106744555173 [0,1,0,0,0,1|1,0,1]=4 2288 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccc1 2230a_100000180882_200025704644 [0,1,0,0,0,1|1,0,0]=3 2289 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccc1 269982a_100000180882_200025704644 [0,1,0,0,0,1|1,0,0]=3 2290 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccn1 2230a_100000216239_200025704644 [0,1,0,0,0,1|2,0,0]=4 2291 B13R1.353 CC(C)(C)N([13CH3])Cc1ccccn1 269982a_100000216239_200025704644 [0,1,0,0,0,1|2,0,0]=4 2292 B13R1.353 CC(C)(C)N([13CH3])Cc1cccnc1 2230a_100000180883_200025704644 [0,1,0,0,0,1|2,0,0]=4 2293 B13R1.353 CC(C)(C)N([13CH3])Cc1cccnc1 269982a_100000180883_200025704644 [0,1,0,0,0,1|2,0,0]=4 2294 B13R1.353 CC(C)(C)N([13CH3])Cc1ccncc1 269982a_200000187487_200025704644 [0,1,0,0,0,1|2,0,0]=4 2295 B13R1.353 CC(C)(F)C(=O)Cc1ccccc1 1458a_100000765255_100015291786 [0,1,0,0,0,1|1,0,0]=3 2296 B13R1.353 CC(C)(F)C(=O)Cc1ccccn1 1458a_100000765255_100000721315 [0,1,0,0,0,1|2,0,0]=4 2297 B13R1.353 CC(C)(F)C(=O)Cc1cccnc1 1458a_100000765255_100000733263 [0,1,0,0,0,1|2,0,0]=4 2298 B13R1.353 CC(C)(F)C(=O)Cc1ccncc1 1458a_100000765255_100000705612 [0,1,0,0,0,1|2,0,0]=4 2299 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 11a_100000106764_100000765255 [0,1,0,0,0,1|1,0,1]=4 2300 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 1626a_100000106764_100000765255 [0,1,0,0,0,1|1,0,1]=4 2301 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 22a_100000106764_100000765255 [0,1,0,0,0,1|1,0,1]=4 2302 B13R1.353 CC(C)(F)C(=O)Nc1ccccc1 527a_100000106764_100000765255 [0,1,0,0,0,1|1,0,1]=4 2303 B13R1.353 CC(C)(O)C(=O)Cc1ccccc1 1458a_100000242741_100015291786 [0,1,0,0,0,1|0,0,0]=2 2304 B13R1.353 CC(C)(O)C(=O)Cc1ccccn1 1458a_100000242741_100000721315 [0,1,0,0,0,1|1,0,0]=3 2305 B13R1.353 CC(C)(O)C(=O)Cc1cccnc1 1458a_100000242741_100000733263 [0,1,0,0,0,1|1,0,0]=3 2306 B13R1.353 CC(C)(O)C(=O)Cc1cccnn1 1458a_100000242741_100016990269 [0,1,0,0,0,1|2,0,0]=4 2307 B13R1.353 CC(C)(O)C(=O)Cc1ccncc1 1458a_100000242741_100000705612 [0,1,0,0,0,1|1,0,0]=3 2308 B13R1.353 CC(C)(O)C(=O)Cc1cnccn1 1458a_100000242741_100016995436 [0,1,0,0,0,1|2,0,0]=4 2309 B13R1.353 CC(C)(O)C(=O)Cc1cncnc1 1458a_100000242741_100015196519 [0,1,0,0,0,1|2,0,0]=4 2310 B13R1.353 CC(C)(O)C(=O)Cc1ncccn1 1458a_100000242741_100000703007 [0,1,0,0,0,1|2,0,0]=4 2311 B13R1.353 CC(C)(O)C(=O)Nc1ccccc1 22a_100000106764_100000242741 [0,1,0,0,0,1|0,0,1]=3 2312 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 2230a_100000180882_200000210301 [0,1,0,0,0,1|1,0,0]=3 2313 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100000180882_200000210301 [0,1,0,0,0,1|1,0,0]=3 2314 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100000186898_100000210625 [0,1,0,0,0,1|1,0,0]=3 2315 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 269982a_100011215553_100000211182 [0,1,0,0,0,1|1,0,0]=3 2316 B13R1.353 CN(Cc1ccccc1)C(C)(C)C 270004a_100011215553_100015611070 [0,1,0,0,0,1|1,0,0]=3 2317 B13R1.353 CN(Cc1ccccn1)C(C)(C)C 2230a_100000216239_200000210301 [0,1,0,0,0,1|2,0,0]=4 2318 B13R1.353 CN(Cc1ccccn1)C(C)(C)C 269982a_100000207498_100000210625 [0,1,0,0,0,1|2,0,0]=4 2319 B13R1.353 CN(Cc1ccccn1)C(C)(C)C 269982a_100000216239_200000210301 [0,1,0,0,0,1|2,0,0]=4 2320 B13R1.353 CN(Cc1ccccn1)C(C)(C)C 269982a_100011215553_100000721315 [0,1,0,0,0,1|2,0,0]=4 2321 B13R1.353 CN(Cc1ccccn1)C(C)(C)C 270004a_100011215553_100000209966 [0,1,0,0,0,1|2,0,0]=4 2322 B13R1.353 CN(Cc1cccnc1)C(C)(C)C 2230a_100000180883_200000210301 [0,1,0,0,0,1|2,0,0]=4 2323 B13R1.353 CN(Cc1cccnc1)C(C)(C)C 269982a_100000180883_200000210301 [0,1,0,0,0,1|2,0,0]=4 2324 B13R1.353 CN(Cc1cccnc1)C(C)(C)C 269982a_100000184577_100000210625 [0,1,0,0,0,1|2,0,0]=4 2325 B13R1.353 CN(Cc1cccnc1)C(C)(C)C 269982a_100011215553_100000733263 [0,1,0,0,0,1|2,0,0]=4 2326 B13R1.353 CN(Cc1cccnc1)C(C)(C)C 270004a_100011215553_100000209961 [0,1,0,0,0,1|2,0,0]=4 2327 B13R1.353 CN(Cc1ccncc1)C(C)(C)C 269982a_100000187231_100000210625 [0,1,0,0,0,1|2,0,0]=4 2328 B13R1.353 CN(Cc1ccncc1)C(C)(C)C 269982a_100011215553_100015193705 [0,1,0,0,0,1|2,0,0]=4 2329 B13R1.353 CN(Cc1ccncc1)C(C)(C)C 269982a_200000187487_200000210301 [0,1,0,0,0,1|2,0,0]=4 2330 B13R1.353 C[C@H](Nc1cccnn1)C(C)(C)O 27a_100025708725_100016991348 [0,1,0,0,0,1|2,0,0]=4 2331 B13R1.353 C[C@H](Nc1ccncn1)C(C)(C)O 27a_100025708725_100000703185 [0,1,0,0,0,1|2,0,0]=4 2332 B13R1.353 C[C@H](Nc1cnccn1)C(C)(C)O 27a_100025708725_100000211759 [0,1,0,0,0,1|2,0,0]=4 2333 B13R1.353 C[C@H](Nc1ncccn1)C(C)(C)O 27a_100025708725_100000211032 [0,1,0,0,0,1|2,0,0]=4 2334 B13R1.512 CC(C)(C)C=Cc1ccc(cc1)Br 271570a_100102527731_100000752885 [0,1,0,0,0,1|1,0,1]=4 2335 B13R1.512 CC(C)(C)C=Cc1ccc(cc1)Cl 271570a_100102527731_100000755918 [0,1,0,0,0,1|1,0,1]=4 2336 B13R1.512 CC(C)(C)C=Cc1ccc(cc1)F 271570a_100102527731_100000211213 [0,1,0,0,0,1|1,0,1]=4 2337 B13R1.512 CC(C)(C)C=Cc1ccc(cc1)N 271570a_100102527731_100000185761 [0,1,0,0,0,1|1,0,1]=4 2338 B13R1.512 CC(C)(C)C=Cc1ccc(cc1)O 271570a_100102527731_100000185759 [0,1,0,0,0,1|1,0,1]=4 2339 B13R1.512 CC(C)(C)CNc1ccc(cc1)Br 34a_100000210018_100011219605 [0,1,0,0,0,1|1,0,0]=3 2340 B13R1.512 CC(C)(C)CNc1ccc(cc1)Cl 34a_100000210052_100011219605 [0,1,0,0,0,1|1,0,0]=3 2341 B13R1.512 CC(C)(C)CNc1ccc(cc1)F 34a_100000185862_100011219605 [0,1,0,0,0,1|1,0,0]=3 2342 B13R1.512 CC(C)(C)CNc1ccc(cc1)I 34a_100000185761_100011219605 [0,1,0,0,0,1|1,0,0]=3 2343 B13R1.512 CC(C)(C)CNc1ccc(cc1)O 34a_100000185829_100011219605 [0,1,0,0,0,1|1,0,0]=3 2344 B13R1.512 CC(C)(C)CNc1ccc(cn1)Br 27a_100000743828_100000686858 [0,1,0,0,0,1|2,0,0]=4 2345 B13R1.512 CC(C)(C)COc1ccc(=O)[nH]c1 34a_100000075641_100011219605 [0,1,0,0,0,1|2,0,0]=4 2346 B13R1.512 CC(C)(C)COc1ccc(cc1)Br 34a_100000185759_100011219605 [0,1,0,0,0,1|1,0,0]=3 2347 B13R1.512 CC(C)(C)COc1ccc(cc1)Cl 34a_100000210216_100011219605 [0,1,0,0,0,1|1,0,0]=3 2348 B13R1.512 CC(C)(C)COc1ccc(cc1)F 34a_100000210339_100011219605 [0,1,0,0,0,1|1,0,0]=3 2349 B13R1.512 CC(C)(C)COc1ccc(cc1)I 34a_100000212066_100011219605 [0,1,0,0,0,1|1,0,0]=3 2350 B13R1.512 CC(C)(C)COc1ccc(cc1)N 34a_100000185829_100011219605 [0,1,0,0,0,1|1,0,0]=3 2351 B13R1.512 CC(C)(C)COc1ccc(cc1)O 271570a_203496583355_200010229346 [0,1,0,0,0,1|1,0,0]=3 2352 B13R1.512 CC(C)(C)COc1ccc(cn1)Cl 34a_100011215309_100011219605 [0,1,0,0,0,1|2,0,0]=4 2353 B13R1.512 CC(C)(C)COc1ccc(cn1)F 34a_100000742473_100011219605 [0,1,0,0,0,1|2,0,0]=4 2354 B13R1.512 CC(C)(C)COc1ccc(cn1)N 34a_100000729260_100011219605 [0,1,0,0,0,1|2,0,0]=4 2355 B13R1.512 CC(C)(C)COc1ccc(nc1)Br 34a_100000685995_100011219605 [0,1,0,0,0,1|2,0,0]=4 2356 B13R1.512 CC(C)(C)COc1ccc(nc1)Cl 34a_100000744096_100011219605 [0,1,0,0,0,1|2,0,0]=4 2357 B13R1.512 CC(C)(C)COc1ccc(nc1)F 34a_100000688820_100011219605 [0,1,0,0,0,1|2,0,0]=4 2358 B13R1.512 CC(C)(C)COc1ccc(nc1)I 34a_100000687607_100011219605 [0,1,0,0,0,1|2,0,0]=4 2359 B13R1.512 CC(C)(C)COc1ccc(nc1)N 34a_100015188713_100011219605 [0,1,0,0,0,1|2,0,0]=4 2360 B13R1.512 CC(C)(C)CSc1cc[n+](cc1)[O-] 62a_100011219605_100000039755 [0,1,0,0,0,1|2,0,0]=4 2361 B13R1.512 CC(C)(C)CSc1ccc(=O)[nH]c1 62a_100000212171_100011219605 [0,1,0,0,0,1|2,0,0]=4 2362 B13R1.512 CC(C)(C)CSc1ccc(=O)[nH]c1 62a_100011219605_100000212171 [0,1,0,0,0,1|2,0,0]=4 2363 B13R1.512 CC(C)(C)CSc1ccc(cc1)Br 62a_100000752885_100011219605 [0,1,0,0,0,1|1,0,0]=3 2364 B13R1.512 CC(C)(C)CSc1ccc(cc1)Br 62a_100011219605_100000752885 [0,1,0,0,0,1|1,0,0]=3 2365 B13R1.512 CC(C)(C)CSc1ccc(cc1)Cl 62a_100000755918_100011219605 [0,1,0,0,0,1|1,0,0]=3 2366 B13R1.512 CC(C)(C)CSc1ccc(cc1)Cl 62a_100011219605_100000755918 [0,1,0,0,0,1|1,0,0]=3 2367 B13R1.512 CC(C)(C)CSc1ccc(cc1)F 62a_100000211213_100011219605 [0,1,0,0,0,1|1,0,0]=3 2368 B13R1.512 CC(C)(C)CSc1ccc(cc1)F 62a_100011219605_100000211213 [0,1,0,0,0,1|1,0,0]=3 2369 B13R1.512 CC(C)(C)CSc1ccc(cc1)N 62a_100000185761_100011219605 [0,1,0,0,0,1|1,0,0]=3 2370 B13R1.512 CC(C)(C)CSc1ccc(cc1)N 62a_100011219605_100000185761 [0,1,0,0,0,1|1,0,0]=3 2371 B13R1.512 CC(C)(C)CSc1ccc(cc1)O 62a_100011219605_100000185759 [0,1,0,0,0,1|1,0,0]=3 2372 B13R1.512 CC(C)(C)CSc1ccc(cn1)Br 62a_100000686858_100011219605 [0,1,0,0,0,1|2,0,0]=4 2373 B13R1.512 CC(C)(C)CSc1ccc(cn1)Br 62a_100011219605_100000686858 [0,1,0,0,0,1|2,0,0]=4 2374 B13R1.512 CC(C)(C)CSc1ccc(cn1)Cl 62a_100011219605_100011356976 [0,1,0,0,0,1|2,0,0]=4 2375 B13R1.512 CC(C)(C)CSc1ccc(cn1)Cl 62a_100011356976_100011219605 [0,1,0,0,0,1|2,0,0]=4 2376 B13R1.512 CC(C)(C)CSc1ccc(cn1)F 62a_100000744514_100011219605 [0,1,0,0,0,1|2,0,0]=4 2377 B13R1.512 CC(C)(C)CSc1ccc(cn1)F 62a_100011219605_100000744514 [0,1,0,0,0,1|2,0,0]=4 2378 B13R1.512 CC(C)(C)CSc1ccc(cn1)N 62a_100000737798_100011219605 [0,1,0,0,0,1|2,0,0]=4 2379 B13R1.512 CC(C)(C)CSc1ccc(cn1)N 62a_100011219605_100000737798 [0,1,0,0,0,1|2,0,0]=4 2380 B13R1.512 CC(C)(C)CSc1ccc(cn1)O 62a_100000685995_100011219605 [0,1,0,0,0,1|2,0,0]=4 2381 B13R1.512 CC(C)(C)CSc1ccc(cn1)O 62a_100011219605_100000744096 [0,1,0,0,0,1|2,0,0]=4 2382 B13R1.512 CC(C)(C)CSc1ccc(nc1)Br 62a_100009814638_100011219605 [0,1,0,0,0,1|2,0,0]=4 2383 B13R1.512 CC(C)(C)CSc1ccc(nc1)Br 62a_100011219605_100009814638 [0,1,0,0,0,1|2,0,0]=4 2384 B13R1.512 CC(C)(C)CSc1ccc(nc1)Cl 62a_100000034144_100011219605 [0,1,0,0,0,1|2,0,0]=4 2385 B13R1.512 CC(C)(C)CSc1ccc(nc1)Cl 62a_100011219605_100000034144 [0,1,0,0,0,1|2,0,0]=4 2386 B13R1.512 CC(C)(C)CSc1ccc(nc1)F 62a_100000042367_100011219605 [0,1,0,0,0,1|2,0,0]=4 2387 B13R1.512 CC(C)(C)CSc1ccc(nc1)F 62a_100011219605_100000042367 [0,1,0,0,0,1|2,0,0]=4 2388 B13R1.512 CC(C)(C)CSc1ccc(nc1)N 62a_100000187370_100011219605 [0,1,0,0,0,1|2,0,0]=4 2389 B13R1.512 CC(C)(C)CSc1ccc(nc1)N 62a_100011219605_100000187370 [0,1,0,0,0,1|2,0,0]=4 2390 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 207a_100000715429_100000186029 [0,1,0,0,0,1|1,0,0]=3 2391 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 2230a_100000715429_100011217064 [0,1,0,0,0,1|1,0,0]=3 2392 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 34a_100000174875_100000210625 [0,1,0,0,0,1|1,0,0]=3 2393 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 207a_100000715429_100000189385 [0,1,0,0,0,1|1,0,0]=3 2394 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 2230a_100000715429_100000694040 [0,1,0,0,0,1|1,0,0]=3 2395 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210625 [0,1,0,0,0,1|1,0,0]=3 2396 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 207a_100000715429_100000210084 [0,1,0,0,0,1|1,0,0]=3 2397 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 2230a_100000715429_100000198546 [0,1,0,0,0,1|1,0,0]=3 2398 B13R1.512 CC(C)(C)NCc1ccc(cc1)F 34a_100000174882_100000210625 [0,1,0,0,0,1|1,0,0]=3 2399 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 207a_100000715429_100000188517 [0,1,0,0,0,1|1,0,0]=3 2400 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 2230a_100000715429_100000189116 [0,1,0,0,0,1|1,0,0]=3 2401 B13R1.512 CC(C)(C)NCc1ccc(cc1)I 34a_100016989417_100000210625 [0,1,0,0,0,1|1,0,0]=3 2402 B13R1.512 CC(C)(C)NCc1ccc(cc1)O 271570a_203496583355_100000189139 [0,1,0,0,0,1|1,0,0]=3 2403 B13R1.512 CC(C)(C)NCc1ccc(cc1)O 34a_100000185549_100000210625 [0,1,0,0,0,1|1,0,0]=3 2404 B13R1.512 CC(C)(C)NCc1ccc(cn1)Br 207a_100000715429_100000754260 [0,1,0,0,0,1|2,0,0]=4 2405 B13R1.512 CC(C)(C)NCc1ccc(cn1)Br 2230a_100000715429_100000702658 [0,1,0,0,0,1|2,0,0]=4 2406 B13R1.512 CC(C)(C)NCc1ccc(cn1)Br 34a_100015188789_100000210625 [0,1,0,0,0,1|2,0,0]=4 2407 B13R1.512 CC(C)(C)NCc1ccc(cn1)Cl 207a_100000715429_100011361569 [0,1,0,0,0,1|2,0,0]=4 2408 B13R1.512 CC(C)(C)NCc1ccc(cn1)Cl 2230a_100000715429_100012066911 [0,1,0,0,0,1|2,0,0]=4 2409 B13R1.512 CC(C)(C)NCc1ccc(cn1)Cl 34a_100000697193_100000210625 [0,1,0,0,0,1|2,0,0]=4 2410 B13R1.512 CC(C)(C)NCc1ccc(cn1)F 207a_100000715429_100011934744 [0,1,0,0,0,1|2,0,0]=4 2411 B13R1.512 CC(C)(C)NCc1ccc(cn1)F 2230a_100000715429_100000703193 [0,1,0,0,0,1|2,0,0]=4 2412 B13R1.512 CC(C)(C)NCc1ccc(cn1)F 34a_100020620131_100000210625 [0,1,0,0,0,1|2,0,0]=4 2413 B13R1.512 CC(C)(C)NCc1ccc(nc1)Br 2230a_100000715429_100009831999 [0,1,0,0,0,1|2,0,0]=4 2414 B13R1.512 CC(C)(C)NCc1ccc(nc1)Br 34a_100009817727_100000210625 [0,1,0,0,0,1|2,0,0]=4 2415 B13R1.512 CC(C)(C)NCc1ccc(nc1)Cl 2230a_100000715429_100000735431 [0,1,0,0,0,1|2,0,0]=4 2416 B13R1.512 CC(C)(C)NCc1ccc(nc1)Cl 34a_100000735879_100000210625 [0,1,0,0,0,1|2,0,0]=4 2417 B13R1.512 CC(C)(C)NCc1ccc(nc1)F 2230a_100000715429_100009820150 [0,1,0,0,0,1|2,0,0]=4 2418 B13R1.512 CC(C)(C)NCc1ccc(nc1)F 34a_100000101913_100000210625 [0,1,0,0,0,1|2,0,0]=4 2419 B13R1.512 CC(C)(C)NCc1ccc(nc1)O 207a_100000715429_100011361521 [0,1,0,0,0,1|2,0,0]=4 2420 B13R1.512 CC(C)(C)OCc1cc[n+](cc1)[O-] 34a_100000031831_100000210625 [0,1,0,0,0,1|2,0,0]=4 2421 B13R1.512 CC(C)(C)OCc1ccc(=O)[nH]c1 34a_100011999846_100000210625 [0,1,0,0,0,1|2,0,0]=4 2422 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 34a_100000695286_100000210625 [0,1,0,0,0,1|1,0,0]=3 2423 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 34a_100015890283_100000189115 [0,1,0,0,0,1|1,0,0]=3 2424 B13R1.512 CC(C)(C)OCc1ccc(cc1)Br 7a_100015890283_100011217064 [0,1,0,0,0,1|1,0,0]=3 2425 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210625 [0,1,0,0,0,1|1,0,0]=3 2426 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 34a_100015890283_100000694040 [0,1,0,0,0,1|1,0,0]=3 2427 B13R1.512 CC(C)(C)OCc1ccc(cc1)Cl 7a_100015890283_100000187161 [0,1,0,0,0,1|1,0,0]=3 2428 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 34a_100000210977_100000210625 [0,1,0,0,0,1|1,0,0]=3 2429 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 34a_100015890283_100000198546 [0,1,0,0,0,1|1,0,0]=3 2430 B13R1.512 CC(C)(C)OCc1ccc(cc1)F 7a_100015890283_100000198546 [0,1,0,0,0,1|1,0,0]=3 2431 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 34a_100000690907_100000210625 [0,1,0,0,0,1|1,0,0]=3 2432 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 34a_100015890283_100000189116 [0,1,0,0,0,1|1,0,0]=3 2433 B13R1.512 CC(C)(C)OCc1ccc(cc1)I 7a_100015890283_100000189116 [0,1,0,0,0,1|1,0,0]=3 2434 B13R1.512 CC(C)(C)OCc1ccc(cc1)N 34a_100011215238_100000210625 [0,1,0,0,0,1|1,0,0]=3 2435 B13R1.512 CC(C)(C)OCc1ccc(cc1)O 271570a_203496583355_100011493771 [0,1,0,0,0,1|1,0,0]=3 2436 B13R1.512 CC(C)(C)OCc1ccc(cn1)Br 34a_100000754261_100000210625 [0,1,0,0,0,1|2,0,0]=4 2437 B13R1.512 CC(C)(C)OCc1ccc(cn1)Br 34a_100015890283_100000702658 [0,1,0,0,0,1|2,0,0]=4 2438 B13R1.512 CC(C)(C)OCc1ccc(cn1)Br 7a_100015890283_100000702658 [0,1,0,0,0,1|2,0,0]=4 2439 B13R1.512 CC(C)(C)OCc1ccc(cn1)Cl 34a_100000703999_100000210625 [0,1,0,0,0,1|2,0,0]=4 2440 B13R1.512 CC(C)(C)OCc1ccc(cn1)Cl 34a_100015890283_100012066911 [0,1,0,0,0,1|2,0,0]=4 2441 B13R1.512 CC(C)(C)OCc1ccc(cn1)Cl 7a_100015890283_100012066911 [0,1,0,0,0,1|2,0,0]=4 2442 B13R1.512 CC(C)(C)OCc1ccc(cn1)F 34a_100011999454_100000210625 [0,1,0,0,0,1|2,0,0]=4 2443 B13R1.512 CC(C)(C)OCc1ccc(cn1)F 34a_100015890283_100000703193 [0,1,0,0,0,1|2,0,0]=4 2444 B13R1.512 CC(C)(C)OCc1ccc(cn1)F 7a_100015890283_100000703193 [0,1,0,0,0,1|2,0,0]=4 2445 B13R1.512 CC(C)(C)OCc1ccc(cn1)N 34a_100011998161_100000210625 [0,1,0,0,0,1|2,0,0]=4 2446 B13R1.512 CC(C)(C)OCc1ccc(nc1)Br 34a_100009816760_100000210625 [0,1,0,0,0,1|2,0,0]=4 2447 B13R1.512 CC(C)(C)OCc1ccc(nc1)Br 34a_100015890283_100009831999 [0,1,0,0,0,1|2,0,0]=4 2448 B13R1.512 CC(C)(C)OCc1ccc(nc1)Br 7a_100015890283_100009831999 [0,1,0,0,0,1|2,0,0]=4 2449 B13R1.512 CC(C)(C)OCc1ccc(nc1)Cl 34a_100000755211_100000210625 [0,1,0,0,0,1|2,0,0]=4 2450 B13R1.512 CC(C)(C)OCc1ccc(nc1)Cl 34a_100015890283_100000735431 [0,1,0,0,0,1|2,0,0]=4 2451 B13R1.512 CC(C)(C)OCc1ccc(nc1)Cl 7a_100015890283_100000735431 [0,1,0,0,0,1|2,0,0]=4 2452 B13R1.512 CC(C)(C)OCc1ccc(nc1)F 34a_100000079959_100000210625 [0,1,0,0,0,1|2,0,0]=4 2453 B13R1.512 CC(C)(C)OCc1ccc(nc1)F 34a_100015890283_100000099788 [0,1,0,0,0,1|2,0,0]=4 2454 B13R1.512 CC(C)(C)OCc1ccc(nc1)F 7a_100015890283_100009820150 [0,1,0,0,0,1|2,0,0]=4 2455 B13R1.512 CC(C)(C)OCc1ccc(nc1)N 34a_100000704267_100000210625 [0,1,0,0,0,1|2,0,0]=4 2456 B13R1.512 CC(C)(C)SCc1ccc(cc1)Br 62a_100000189115_100000211941 [0,1,0,0,0,1|1,0,0]=3 2457 B13R1.512 CC(C)(C)SCc1ccc(cc1)Br 62a_100000211941_100000189115 [0,1,0,0,0,1|1,0,0]=3 2458 B13R1.512 CC(C)(C)SCc1ccc(cc1)Cl 62a_100000187161_100000211941 [0,1,0,0,0,1|1,0,0]=3 2459 B13R1.512 CC(C)(C)SCc1ccc(cc1)Cl 62a_100000211941_100000187161 [0,1,0,0,0,1|1,0,0]=3 2460 B13R1.512 CC(C)(C)SCc1ccc(cc1)F 62a_100000198546_100000211941 [0,1,0,0,0,1|1,0,0]=3 2461 B13R1.512 CC(C)(C)SCc1ccc(cc1)F 62a_100000211941_100000187164 [0,1,0,0,0,1|1,0,0]=3 2462 B13R1.512 CC(C)(C)SCc1ccc(cc1)I 62a_100000189116_100000211941 [0,1,0,0,0,1|1,0,0]=3 2463 B13R1.512 CC(C)(C)SCc1ccc(cc1)I 62a_100000211941_100000189116 [0,1,0,0,0,1|1,0,0]=3 2464 B13R1.512 CC(C)(C)SCc1ccc(cn1)Br 62a_100000211941_100000702658 [0,1,0,0,0,1|2,0,0]=4 2465 B13R1.512 CC(C)(C)SCc1ccc(cn1)Br 62a_100000702658_100000211941 [0,1,0,0,0,1|2,0,0]=4 2466 B13R1.512 CC(C)(C)SCc1ccc(cn1)Cl 62a_100000211941_100000697101 [0,1,0,0,0,1|2,0,0]=4 2467 B13R1.512 CC(C)(C)SCc1ccc(cn1)Cl 62a_100012066911_100000211941 [0,1,0,0,0,1|2,0,0]=4 2468 B13R1.512 CC(C)(C)SCc1ccc(cn1)F 62a_100000211941_100000703193 [0,1,0,0,0,1|2,0,0]=4 2469 B13R1.512 CC(C)(C)SCc1ccc(cn1)F 62a_100000703193_100000211941 [0,1,0,0,0,1|2,0,0]=4 2470 B13R1.512 CC(C)(C)SCc1ccc(nc1)Br 62a_100000211941_100009831999 [0,1,0,0,0,1|2,0,0]=4 2471 B13R1.512 CC(C)(C)SCc1ccc(nc1)Br 62a_100009831999_100000211941 [0,1,0,0,0,1|2,0,0]=4 2472 B13R1.512 CC(C)(C)SCc1ccc(nc1)Cl 62a_100000211941_100000735431 [0,1,0,0,0,1|2,0,0]=4 2473 B13R1.512 CC(C)(C)SCc1ccc(nc1)Cl 62a_100000735431_100000211941 [0,1,0,0,0,1|2,0,0]=4 2474 B13R1.512 CC(C)(C)SCc1ccc(nc1)F 62a_100000211941_100000099788 [0,1,0,0,0,1|2,0,0]=4 2475 B13R1.512 CC(C)(C)SCc1ccc(nc1)F 62a_100009820150_100000211941 [0,1,0,0,0,1|2,0,0]=4 2476 B13R1.512 CC(C)(F)CNc1ccc(cc1)Br 34a_100000210018_100011997219 [0,1,0,0,0,1|1,0,0]=3 2477 B13R1.512 CC(C)(F)CNc1ccc(cc1)Cl 34a_100000210052_100011997219 [0,1,0,0,0,1|1,0,0]=3 2478 B13R1.512 CC(C)(F)CNc1ccc(cc1)F 34a_100000185862_100011997219 [0,1,0,0,0,1|1,0,0]=3 2479 B13R1.512 CC(C)(F)CNc1ccc(cc1)I 34a_100000185761_100011997219 [0,1,0,0,0,1|1,0,0]=3 2480 B13R1.512 CC(C)(F)CNc1ccc(cc1)O 34a_100000185829_100011997219 [0,1,0,0,0,1|1,0,0]=3 2481 B13R1.512 CC(C)(F)CNc1ccc(cn1)Br 27a_100020643315_100000686858 [0,1,0,0,0,1|2,0,0]=4 2482 B13R1.512 CC(C)(F)COc1ccc(=O)[nH]c1 34a_100000075641_100011997219 [0,1,0,0,0,1|2,0,0]=4 2483 B13R1.512 CC(C)(F)COc1ccc(cc1)Br 34a_100000185759_100011997219 [0,1,0,0,0,1|1,0,0]=3 2484 B13R1.512 CC(C)(F)COc1ccc(cc1)Cl 34a_100000210216_100011997219 [0,1,0,0,0,1|1,0,0]=3 2485 B13R1.512 CC(C)(F)COc1ccc(cc1)F 34a_100000210339_100011997219 [0,1,0,0,0,1|1,0,0]=3 2486 B13R1.512 CC(C)(F)COc1ccc(cc1)I 34a_100000212066_100011997219 [0,1,0,0,0,1|1,0,0]=3 2487 B13R1.512 CC(C)(F)COc1ccc(cc1)N 34a_100000185829_100011997219 [0,1,0,0,0,1|1,0,0]=3 2488 B13R1.512 CC(C)(F)COc1ccc(cn1)Cl 34a_100011215309_100011997219 [0,1,0,0,0,1|2,0,0]=4 2489 B13R1.512 CC(C)(F)COc1ccc(cn1)F 34a_100000742473_100011997219 [0,1,0,0,0,1|2,0,0]=4 2490 B13R1.512 CC(C)(F)COc1ccc(cn1)N 34a_100000729260_100011997219 [0,1,0,0,0,1|2,0,0]=4 2491 B13R1.512 CC(C)(F)COc1ccc(nc1)Br 34a_100000685995_100011997219 [0,1,0,0,0,1|2,0,0]=4 2492 B13R1.512 CC(C)(F)COc1ccc(nc1)Cl 34a_100000744096_100011997219 [0,1,0,0,0,1|2,0,0]=4 2493 B13R1.512 CC(C)(F)COc1ccc(nc1)F 34a_100000688820_100011997219 [0,1,0,0,0,1|2,0,0]=4 2494 B13R1.512 CC(C)(F)COc1ccc(nc1)I 34a_100000687607_100011997219 [0,1,0,0,0,1|2,0,0]=4 2495 B13R1.512 CC(C)(F)COc1ccc(nc1)N 34a_100015188713_100011997219 [0,1,0,0,0,1|2,0,0]=4 2496 B13R1.512 CC(C)(F)CSc1cc[n+](cc1)[O-] 62a_100011997219_100000039755 [0,1,0,0,0,1|2,0,0]=4 2497 B13R1.512 CC(C)(F)CSc1ccc(=O)[nH]c1 62a_100000212171_100011997219 [0,1,0,0,0,1|2,0,0]=4 2498 B13R1.512 CC(C)(F)CSc1ccc(=O)[nH]c1 62a_100011997219_100000212171 [0,1,0,0,0,1|2,0,0]=4 2499 B13R1.512 CC(C)(F)CSc1ccc(cc1)Br 62a_100000752885_100011997219 [0,1,0,0,0,1|1,0,0]=3 2500 B13R1.512 CC(C)(F)CSc1ccc(cc1)Br 62a_100011997219_100000752885 [0,1,0,0,0,1|1,0,0]=3 2501 B13R1.512 CC(C)(F)CSc1ccc(cc1)Cl 62a_100000755918_100011997219 [0,1,0,0,0,1|1,0,0]=3 2502 B13R1.512 CC(C)(F)CSc1ccc(cc1)Cl 62a_100011997219_100000755918 [0,1,0,0,0,1|1,0,0]=3 2503 B13R1.512 CC(C)(F)CSc1ccc(cc1)F 62a_100000211213_100011997219 [0,1,0,0,0,1|1,0,0]=3 2504 B13R1.512 CC(C)(F)CSc1ccc(cc1)F 62a_100011997219_100000211213 [0,1,0,0,0,1|1,0,0]=3 2505 B13R1.512 CC(C)(F)CSc1ccc(cc1)N 62a_100000185761_100011997219 [0,1,0,0,0,1|1,0,0]=3 2506 B13R1.512 CC(C)(F)CSc1ccc(cc1)N 62a_100011997219_100000185761 [0,1,0,0,0,1|1,0,0]=3 2507 B13R1.512 CC(C)(F)CSc1ccc(cc1)O 62a_100011997219_100000185759 [0,1,0,0,0,1|1,0,0]=3 2508 B13R1.512 CC(C)(F)CSc1ccc(cn1)Br 62a_100000686858_100011997219 [0,1,0,0,0,1|2,0,0]=4 2509 B13R1.512 CC(C)(F)CSc1ccc(cn1)Br 62a_100011997219_100000686858 [0,1,0,0,0,1|2,0,0]=4 2510 B13R1.512 CC(C)(F)CSc1ccc(cn1)Cl 62a_100011356976_100011997219 [0,1,0,0,0,1|2,0,0]=4 2511 B13R1.512 CC(C)(F)CSc1ccc(cn1)Cl 62a_100011997219_100011356976 [0,1,0,0,0,1|2,0,0]=4 2512 B13R1.512 CC(C)(F)CSc1ccc(cn1)F 62a_100000744514_100011997219 [0,1,0,0,0,1|2,0,0]=4 2513 B13R1.512 CC(C)(F)CSc1ccc(cn1)F 62a_100011997219_100000744514 [0,1,0,0,0,1|2,0,0]=4 2514 B13R1.512 CC(C)(F)CSc1ccc(cn1)N 62a_100000737798_100011997219 [0,1,0,0,0,1|2,0,0]=4 2515 B13R1.512 CC(C)(F)CSc1ccc(cn1)N 62a_100011997219_100000737798 [0,1,0,0,0,1|2,0,0]=4 2516 B13R1.512 CC(C)(F)CSc1ccc(cn1)O 62a_100000685995_100011997219 [0,1,0,0,0,1|2,0,0]=4 2517 B13R1.512 CC(C)(F)CSc1ccc(cn1)O 62a_100011997219_100000744096 [0,1,0,0,0,1|2,0,0]=4 2518 B13R1.512 CC(C)(F)CSc1ccc(nc1)Br 62a_100009814638_100011997219 [0,1,0,0,0,1|2,0,0]=4 2519 B13R1.512 CC(C)(F)CSc1ccc(nc1)Br 62a_100011997219_100009814638 [0,1,0,0,0,1|2,0,0]=4 2520 B13R1.512 CC(C)(F)CSc1ccc(nc1)Cl 62a_100000034144_100011997219 [0,1,0,0,0,1|2,0,0]=4 2521 B13R1.512 CC(C)(F)CSc1ccc(nc1)Cl 62a_100011997219_100000034144 [0,1,0,0,0,1|2,0,0]=4 2522 B13R1.512 CC(C)(F)CSc1ccc(nc1)F 62a_100000042367_100011997219 [0,1,0,0,0,1|2,0,0]=4 2523 B13R1.512 CC(C)(F)CSc1ccc(nc1)F 62a_100011997219_100000042367 [0,1,0,0,0,1|2,0,0]=4 2524 B13R1.512 CC(C)(F)CSc1ccc(nc1)N 62a_100000187370_100011997219 [0,1,0,0,0,1|2,0,0]=4 2525 B13R1.512 CC(C)(F)CSc1ccc(nc1)N 62a_100011997219_100000187370 [0,1,0,0,0,1|2,0,0]=4 2526 B13R1.512 CC(C)(O)C#Cc1ccc(cc1)O 271570a_203496583355_200009994073 [0,1,0,0,0,1|0,0,1]=3 2527 B13R1.512 CC(C)(O)C=Cc1cc[n+](cc1)[O-] 271570a_200016258132_100000039755 [0,1,0,0,0,1|1,0,1]=4 2528 B13R1.512 CC(C)(O)C=Cc1ccc(=O)[nH]c1 271570a_200016258132_100000212171 [0,1,0,0,0,1|1,0,1]=4 2529 B13R1.512 CC(C)(O)C=Cc1ccc(cc1)Br 271570a_200016258132_100000752885 [0,1,0,0,0,1|0,0,1]=3 2530 B13R1.512 CC(C)(O)C=Cc1ccc(cc1)Cl 271570a_200016258132_100000755918 [0,1,0,0,0,1|0,0,1]=3 2531 B13R1.512 CC(C)(O)C=Cc1ccc(cc1)F 271570a_200016258132_100000211213 [0,1,0,0,0,1|0,0,1]=3 2532 B13R1.512 CC(C)(O)C=Cc1ccc(cc1)N 271570a_200016258132_100000185761 [0,1,0,0,0,1|0,0,1]=3 2533 B13R1.512 CC(C)(O)C=Cc1ccc(cc1)O 271570a_200016258132_100000185759 [0,1,0,0,0,1|0,0,1]=3 2534 B13R1.512 CC(C)(O)C=Cc1ccc(cn1)Br 271570a_200016258132_100000686858 [0,1,0,0,0,1|1,0,1]=4 2535 B13R1.512 CC(C)(O)C=Cc1ccc(cn1)Cl 271570a_200016258132_100011356976 [0,1,0,0,0,1|1,0,1]=4 2536 B13R1.512 CC(C)(O)C=Cc1ccc(cn1)F 271570a_200016258132_100000744514 [0,1,0,0,0,1|1,0,1]=4 2537 B13R1.512 CC(C)(O)C=Cc1ccc(cn1)N 271570a_200016258132_100000744251 [0,1,0,0,0,1|1,0,1]=4 2538 B13R1.512 CC(C)(O)C=Cc1ccc(cn1)O 271570a_200016258132_100000685995 [0,1,0,0,0,1|1,0,1]=4 2539 B13R1.512 CC(C)(O)C=Cc1ccc(nc1)Br 271570a_200016258132_100009814638 [0,1,0,0,0,1|1,0,1]=4 2540 B13R1.512 CC(C)(O)C=Cc1ccc(nc1)Cl 271570a_200016258132_100000034144 [0,1,0,0,0,1|1,0,1]=4 2541 B13R1.512 CC(C)(O)C=Cc1ccc(nc1)F 271570a_200016258132_100000748661 [0,1,0,0,0,1|1,0,1]=4 2542 B13R1.512 CC(C)(O)C=Cc1ccc(nc1)N 271570a_200016258132_100000187370 [0,1,0,0,0,1|1,0,1]=4 2543 B13R1.512 CC(C)(O)CNc1ccc(cc1)Br 34a_100000210018_100000764493 [0,1,0,0,0,1|0,0,0]=2 2544 B13R1.512 CC(C)(O)CNc1ccc(cc1)Cl 34a_100000210052_100000764493 [0,1,0,0,0,1|0,0,0]=2 2545 B13R1.512 CC(C)(O)CNc1ccc(cc1)F 34a_100000185862_100000764493 [0,1,0,0,0,1|0,0,0]=2 2546 B13R1.512 CC(C)(O)CNc1ccc(cc1)I 34a_100000185761_100000764493 [0,1,0,0,0,1|0,0,0]=2 2547 B13R1.512 CC(C)(O)CNc1ccc(cc1)O 34a_100000185829_100000764493 [0,1,0,0,0,1|0,0,0]=2 2548 B13R1.512 CC(C)(O)CNc1ccc(cn1)Br 27a_100000751335_100000686858 [0,1,0,0,0,1|1,0,0]=3 2549 B13R1.512 CC(C)(O)CNc1cnc(cn1)Br 27a_100000751335_100010187541 [0,1,0,0,0,1|2,0,0]=4 2550 B13R1.512 CC(C)(O)CNc1cnc(cn1)F 27a_100000751335_100009856528 [0,1,0,0,0,1|2,0,0]=4 2551 B13R1.512 CC(C)(O)CNc1ncc(cn1)Br 27a_100000751335_100000690281 [0,1,0,0,0,1|2,0,0]=4 2552 B13R1.512 CC(C)(O)CNc1ncc(cn1)Cl 27a_100000751335_100011356929 [0,1,0,0,0,1|2,0,0]=4 2553 B13R1.512 CC(C)(O)CNc1ncc(cn1)F 27a_100000751335_100000685220 [0,1,0,0,0,1|2,0,0]=4 2554 B13R1.512 CC(C)(O)COc1ccc(=O)[nH]c1 34a_100000075641_100000764493 [0,1,0,0,0,1|1,0,0]=3 2555 B13R1.512 CC(C)(O)COc1ccc(cc1)Br 34a_100000185759_100000764493 [0,1,0,0,0,1|0,0,0]=2 2556 B13R1.512 CC(C)(O)COc1ccc(cc1)Br 7a_100000185759_100000764493 [0,1,0,0,0,1|0,0,0]=2 2557 B13R1.512 CC(C)(O)COc1ccc(cc1)Cl 34a_100000210216_100000764493 [0,1,0,0,0,1|0,0,0]=2 2558 B13R1.512 CC(C)(O)COc1ccc(cc1)Cl 7a_100000210216_100000764493 [0,1,0,0,0,1|0,0,0]=2 2559 B13R1.512 CC(C)(O)COc1ccc(cc1)F 34a_100000210339_100000764493 [0,1,0,0,0,1|0,0,0]=2 2560 B13R1.512 CC(C)(O)COc1ccc(cc1)I 34a_100000212066_100000764493 [0,1,0,0,0,1|0,0,0]=2 2561 B13R1.512 CC(C)(O)COc1ccc(cc1)I 7a_100000212066_100000764493 [0,1,0,0,0,1|0,0,0]=2 2562 B13R1.512 CC(C)(O)COc1ccc(cc1)N 34a_100000185829_100000764493 [0,1,0,0,0,1|0,0,0]=2 2563 B13R1.512 CC(C)(O)COc1ccc(cn1)Cl 34a_100011215309_100000764493 [0,1,0,0,0,1|1,0,0]=3 2564 B13R1.512 CC(C)(O)COc1ccc(cn1)F 34a_100000742473_100000764493 [0,1,0,0,0,1|1,0,0]=3 2565 B13R1.512 CC(C)(O)COc1ccc(cn1)N 34a_100000729260_100000764493 [0,1,0,0,0,1|1,0,0]=3 2566 B13R1.512 CC(C)(O)COc1ccc(nc1)Br 34a_100000685995_100000764493 [0,1,0,0,0,1|1,0,0]=3 2567 B13R1.512 CC(C)(O)COc1ccc(nc1)Br 7a_100000685995_100000764493 [0,1,0,0,0,1|1,0,0]=3 2568 B13R1.512 CC(C)(O)COc1ccc(nc1)Cl 34a_100000744096_100000764493 [0,1,0,0,0,1|1,0,0]=3 2569 B13R1.512 CC(C)(O)COc1ccc(nc1)Cl 7a_100000744096_100000764493 [0,1,0,0,0,1|1,0,0]=3 2570 B13R1.512 CC(C)(O)COc1ccc(nc1)F 34a_100000688820_100000764493 [0,1,0,0,0,1|1,0,0]=3 2571 B13R1.512 CC(C)(O)COc1ccc(nc1)F 7a_100000688820_100000764493 [0,1,0,0,0,1|1,0,0]=3 2572 B13R1.512 CC(C)(O)COc1ccc(nc1)I 34a_100000687607_100000764493 [0,1,0,0,0,1|1,0,0]=3 2573 B13R1.512 CC(C)(O)COc1ccc(nc1)I 7a_100000687607_100000764493 [0,1,0,0,0,1|1,0,0]=3 2574 B13R1.512 CC(C)(O)COc1ccc(nc1)N 34a_100015188713_100000764493 [0,1,0,0,0,1|1,0,0]=3 2575 B13R1.512 CC(C)(O)COc1ccc(nc1)N 7a_100015188713_100000764493 [0,1,0,0,0,1|1,0,0]=3 2576 B13R1.512 CC(C)(O)COc1cnc(cn1)Br 34a_100011934580_100000764493 [0,1,0,0,0,1|2,0,0]=4 2577 B13R1.512 CC(C)(O)COc1cnc(cn1)Cl 34a_100015839800_100000764493 [0,1,0,0,0,1|2,0,0]=4 2578 B13R1.512 CC(C)(O)COc1cnc(nc1)Br 34a_100000730009_100000764493 [0,1,0,0,0,1|2,0,0]=4 2579 B13R1.512 CC(C)(O)COc1cnc(nc1)Br 7a_100000730009_100000764493 [0,1,0,0,0,1|2,0,0]=4 2580 B13R1.512 CC(C)(O)COc1cnc(nc1)Cl 34a_100000092845_100000764493 [0,1,0,0,0,1|2,0,0]=4 2581 B13R1.512 CC(C)(O)COc1cnc(nc1)Cl 7a_100000092845_100000764493 [0,1,0,0,0,1|2,0,0]=4 2582 B13R1.512 CC(C)(O)COc1cnc(nc1)F 34a_200009874573_100000764493 [0,1,0,0,0,1|2,0,0]=4 2583 B13R1.512 CC(C)(O)COc1cnc(nc1)F 7a_200009874573_100000764493 [0,1,0,0,0,1|2,0,0]=4 2584 B13R1.512 CC(C)(O)COc1cnc(nc1)N 34a_100000087137_100000764493 [0,1,0,0,0,1|2,0,0]=4 2585 B13R1.512 CC(C)(O)COc1cnc(nc1)N 7a_100000087137_100000764493 [0,1,0,0,0,1|2,0,0]=4 2586 B13R1.512 CC(C)(O)COc1ncc(cn1)F 34a_100011934040_100000764493 [0,1,0,0,0,1|2,0,0]=4 2587 B13R1.512 CC(C)(O)CSc1cc[n+](cc1)[O-] 62a_100000764493_100000039755 [0,1,0,0,0,1|1,0,0]=3 2588 B13R1.512 CC(C)(O)CSc1ccc(=O)[nH]c1 62a_100000212171_100000764493 [0,1,0,0,0,1|1,0,0]=3 2589 B13R1.512 CC(C)(O)CSc1ccc(=O)[nH]c1 62a_100000764493_100000212171 [0,1,0,0,0,1|1,0,0]=3 2590 B13R1.512 CC(C)(O)CSc1ccc(=O)[nH]n1 62a_100000764493_100009820020 [0,1,0,0,0,1|2,0,0]=4 2591 B13R1.512 CC(C)(O)CSc1ccc(=O)[nH]n1 62a_100009820020_100000764493 [0,1,0,0,0,1|2,0,0]=4 2592 B13R1.512 CC(C)(O)CSc1ccc(cc1)Br 62a_100000752885_100000764493 [0,1,0,0,0,1|0,0,0]=2 2593 B13R1.512 CC(C)(O)CSc1ccc(cc1)Br 62a_100000764493_100000752885 [0,1,0,0,0,1|0,0,0]=2 2594 B13R1.512 CC(C)(O)CSc1ccc(cc1)Cl 62a_100000755918_100000764493 [0,1,0,0,0,1|0,0,0]=2 2595 B13R1.512 CC(C)(O)CSc1ccc(cc1)Cl 62a_100000764493_100000755918 [0,1,0,0,0,1|0,0,0]=2 2596 B13R1.512 CC(C)(O)CSc1ccc(cc1)F 62a_100000211213_100000764493 [0,1,0,0,0,1|0,0,0]=2 2597 B13R1.512 CC(C)(O)CSc1ccc(cc1)F 62a_100000764493_100000211213 [0,1,0,0,0,1|0,0,0]=2 2598 B13R1.512 CC(C)(O)CSc1ccc(cc1)N 62a_100000185761_100000764493 [0,1,0,0,0,1|0,0,0]=2 2599 B13R1.512 CC(C)(O)CSc1ccc(cc1)N 62a_100000764493_100000185761 [0,1,0,0,0,1|0,0,0]=2 2600 B13R1.512 CC(C)(O)CSc1ccc(cc1)O 62a_100000764493_100000185759 [0,1,0,0,0,1|0,0,0]=2 2601 B13R1.512 CC(C)(O)CSc1ccc(cn1)Br 62a_100000686858_100000764493 [0,1,0,0,0,1|1,0,0]=3 2602 B13R1.512 CC(C)(O)CSc1ccc(cn1)Br 62a_100000764493_100000686858 [0,1,0,0,0,1|1,0,0]=3 2603 B13R1.512 CC(C)(O)CSc1ccc(cn1)Cl 62a_100000764493_100011356976 [0,1,0,0,0,1|1,0,0]=3 2604 B13R1.512 CC(C)(O)CSc1ccc(cn1)Cl 62a_100011356976_100000764493 [0,1,0,0,0,1|1,0,0]=3 2605 B13R1.512 CC(C)(O)CSc1ccc(cn1)F 62a_100000744514_100000764493 [0,1,0,0,0,1|1,0,0]=3 2606 B13R1.512 CC(C)(O)CSc1ccc(cn1)F 62a_100000764493_100000744514 [0,1,0,0,0,1|1,0,0]=3 2607 B13R1.512 CC(C)(O)CSc1ccc(cn1)N 62a_100000737798_100000764493 [0,1,0,0,0,1|1,0,0]=3 2608 B13R1.512 CC(C)(O)CSc1ccc(cn1)N 62a_100000764493_100000737798 [0,1,0,0,0,1|1,0,0]=3 2609 B13R1.512 CC(C)(O)CSc1ccc(cn1)O 62a_100000685995_100000764493 [0,1,0,0,0,1|1,0,0]=3 2610 B13R1.512 CC(C)(O)CSc1ccc(cn1)O 62a_100000764493_100000744096 [0,1,0,0,0,1|1,0,0]=3 2611 B13R1.512 CC(C)(O)CSc1ccc(nc1)Br 62a_100000764493_100009814638 [0,1,0,0,0,1|1,0,0]=3 2612 B13R1.512 CC(C)(O)CSc1ccc(nc1)Br 62a_100009814638_100000764493 [0,1,0,0,0,1|1,0,0]=3 2613 B13R1.512 CC(C)(O)CSc1ccc(nc1)Cl 62a_100000034144_100000764493 [0,1,0,0,0,1|1,0,0]=3 2614 B13R1.512 CC(C)(O)CSc1ccc(nc1)Cl 62a_100000764493_100000034144 [0,1,0,0,0,1|1,0,0]=3 2615 B13R1.512 CC(C)(O)CSc1ccc(nc1)F 62a_100000042367_100000764493 [0,1,0,0,0,1|1,0,0]=3 2616 B13R1.512 CC(C)(O)CSc1ccc(nc1)F 62a_100000764493_100000042367 [0,1,0,0,0,1|1,0,0]=3 2617 B13R1.512 CC(C)(O)CSc1ccc(nc1)N 62a_100000187370_100000764493 [0,1,0,0,0,1|1,0,0]=3 2618 B13R1.512 CC(C)(O)CSc1ccc(nc1)N 62a_100000764493_100000187370 [0,1,0,0,0,1|1,0,0]=3 2619 B13R1.512 CC(C)(O)CSc1ccc(nn1)Cl 62a_100000068654_100000764493 [0,1,0,0,0,1|2,0,0]=4 2620 B13R1.512 CC(C)(O)CSc1ccc(nn1)Cl 62a_100000764493_100000068654 [0,1,0,0,0,1|2,0,0]=4 2621 B13R1.512 CC(C)(O)CSc1ccc(nn1)N 62a_100000764493_100010219413 [0,1,0,0,0,1|2,0,0]=4 2622 B13R1.512 CC(C)(O)CSc1ccc(nn1)N 62a_100010219413_100000764493 [0,1,0,0,0,1|2,0,0]=4 2623 B13R1.512 CC(C)(O)CSc1cnc(=O)[nH]c1 62a_100000764493_102495366499 [0,1,0,0,0,1|2,0,0]=4 2624 B13R1.512 CC(C)(O)CSc1cnc(=O)[nH]c1 62a_102495366499_100000764493 [0,1,0,0,0,1|2,0,0]=4 2625 B13R1.512 CC(C)(O)CSc1cnc(cn1)Br 62a_100000764493_100010187541 [0,1,0,0,0,1|2,0,0]=4 2626 B13R1.512 CC(C)(O)CSc1cnc(cn1)Br 62a_100010187541_100000764493 [0,1,0,0,0,1|2,0,0]=4 2627 B13R1.512 CC(C)(O)CSc1cnc(cn1)Cl 62a_100000764493_100010214907 [0,1,0,0,0,1|2,0,0]=4 2628 B13R1.512 CC(C)(O)CSc1cnc(cn1)Cl 62a_100010214907_100000764493 [0,1,0,0,0,1|2,0,0]=4 2629 B13R1.512 CC(C)(O)CSc1cnc(cn1)F 62a_100000764493_100009856528 [0,1,0,0,0,1|2,0,0]=4 2630 B13R1.512 CC(C)(O)CSc1cnc(cn1)F 62a_100009856528_100000764493 [0,1,0,0,0,1|2,0,0]=4 2631 B13R1.512 CC(C)(O)CSc1cnc(cn1)N 62a_100000744751_100000764493 [0,1,0,0,0,1|2,0,0]=4 2632 B13R1.512 CC(C)(O)CSc1cnc(cn1)N 62a_100000764493_100000744751 [0,1,0,0,0,1|2,0,0]=4 2633 B13R1.512 CC(C)(O)CSc1cnc(cn1)O 62a_100000764493_100015839800 [0,1,0,0,0,1|2,0,0]=4 2634 B13R1.512 CC(C)(O)CSc1cnc(cn1)O 62a_100011934580_100000764493 [0,1,0,0,0,1|2,0,0]=4 2635 B13R1.512 CC(C)(O)CSc1cnc(nc1)Br 62a_100000764493_200012349914 [0,1,0,0,0,1|2,0,0]=4 2636 B13R1.512 CC(C)(O)CSc1cnc(nc1)Br 62a_200012349914_100000764493 [0,1,0,0,0,1|2,0,0]=4 2637 B13R1.512 CC(C)(O)CSc1cnc(nc1)Cl 62a_100000059775_100000764493 [0,1,0,0,0,1|2,0,0]=4 2638 B13R1.512 CC(C)(O)CSc1cnc(nc1)Cl 62a_100000764493_100000059775 [0,1,0,0,0,1|2,0,0]=4 2639 B13R1.512 CC(C)(O)CSc1cnc(nc1)F 62a_100000685262_100000764493 [0,1,0,0,0,1|2,0,0]=4 2640 B13R1.512 CC(C)(O)CSc1cnc(nc1)F 62a_100000764493_100000685262 [0,1,0,0,0,1|2,0,0]=4 2641 B13R1.512 CC(C)(O)CSc1cnc(nc1)N 62a_100000764493_100000766020 [0,1,0,0,0,1|2,0,0]=4 2642 B13R1.512 CC(C)(O)CSc1cnc(nc1)N 62a_100000766020_100000764493 [0,1,0,0,0,1|2,0,0]=4 2643 B13R1.512 CC(C)(O)CSc1ncc(cn1)Br 62a_100000690281_100000764493 [0,1,0,0,0,1|2,0,0]=4 2644 B13R1.512 CC(C)(O)CSc1ncc(cn1)Br 62a_100000764493_100000690281 [0,1,0,0,0,1|2,0,0]=4 2645 B13R1.512 CC(C)(O)CSc1ncc(cn1)Cl 62a_100000764493_100011356929 [0,1,0,0,0,1|2,0,0]=4 2646 B13R1.512 CC(C)(O)CSc1ncc(cn1)Cl 62a_100011356929_100000764493 [0,1,0,0,0,1|2,0,0]=4 2647 B13R1.512 CC(C)(O)CSc1ncc(cn1)F 62a_100000685220_100000764493 [0,1,0,0,0,1|2,0,0]=4 2648 B13R1.512 CC(C)(O)CSc1ncc(cn1)F 62a_100000764493_100000685220 [0,1,0,0,0,1|2,0,0]=4 2649 B13R1.512 CC(C)(O)CSc1ncc(cn1)N 62a_100000068403_100000764493 [0,1,0,0,0,1|2,0,0]=4 2650 B13R1.512 CC(C)(O)CSc1ncc(cn1)N 62a_100000764493_100000068403 [0,1,0,0,0,1|2,0,0]=4 2651 B13R1.512 CC(C)(O)CSc1ncc(cn1)O 62a_100000730009_100000764493 [0,1,0,0,0,1|2,0,0]=4 2652 B13R1.512 CC(C)(O)CSc1ncc(cn1)O 62a_100000764493_100000092845 [0,1,0,0,0,1|2,0,0]=4 2653 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Br 62a_100000752885_200000036245 [0,1,0,0,0,1|2,0,0]=4 2654 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Br 62a_200000036245_100000752885 [0,1,0,0,0,1|2,0,0]=4 2655 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Cl 62a_100000755918_200000036245 [0,1,0,0,0,1|2,0,0]=4 2656 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)Cl 62a_200000036245_100000755918 [0,1,0,0,0,1|2,0,0]=4 2657 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)F 62a_100000211213_200000036245 [0,1,0,0,0,1|2,0,0]=4 2658 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)F 62a_200000036245_100000211213 [0,1,0,0,0,1|2,0,0]=4 2659 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)N 62a_100000185761_200000036245 [0,1,0,0,0,1|2,0,0]=4 2660 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)N 62a_200000036245_100000185761 [0,1,0,0,0,1|2,0,0]=4 2661 B13R1.512 C[N+](C)(C)CSc1ccc(cc1)O 62a_200000036245_100000185759 [0,1,0,0,0,1|2,0,0]=4 2662 B13R1.512 C[Si](C)(C)CNc1ccc(cc1)Br 2230a_100000210018_100000037933 [0,1,0,0,0,1|1,1,0]=4 2663 B13R1.512 C[Si](C)(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000037933 [0,1,0,0,0,1|1,1,0]=4 2664 B13R1.512 C[Si](C)(C)COc1ccc(cc1)Br 7a_100000185759_100000233785 [0,1,0,0,0,1|1,1,0]=4 2665 B13R1.512 C[Si](C)(C)COc1ccc(cc1)Cl 7a_100000210216_100000233785 [0,1,0,0,0,1|1,1,0]=4 2666 B13R1.512 C[Si](C)(C)COc1ccc(cc1)I 7a_100000212066_100000233785 [0,1,0,0,0,1|1,1,0]=4 2667 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Br 62a_100000037933_100000752885 [0,1,0,0,0,1|1,1,0]=4 2668 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Br 62a_100000752885_100000037933 [0,1,0,0,0,1|1,1,0]=4 2669 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Cl 62a_100000037933_100000755918 [0,1,0,0,0,1|1,1,0]=4 2670 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)Cl 62a_100000755918_100000037933 [0,1,0,0,0,1|1,1,0]=4 2671 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)F 62a_100000037933_100000211213 [0,1,0,0,0,1|1,1,0]=4 2672 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)F 62a_100000211213_100000037933 [0,1,0,0,0,1|1,1,0]=4 2673 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)N 62a_100000037933_100000185761 [0,1,0,0,0,1|1,1,0]=4 2674 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)N 62a_100000185761_100000037933 [0,1,0,0,0,1|1,1,0]=4 2675 B13R1.512 C[Si](C)(C)CSc1ccc(cc1)O 62a_100000037933_100000185759 [0,1,0,0,0,1|1,1,0]=4 2676 B13R1.512 C[n+]1ccc(cc1)COC(C)(C)C 34a_100009831711_100000210625 [0,1,0,0,0,1|2,0,0]=4 2677 B13R1.512 Cc1ccc(cc1)C=CC(C)(C)C 271570a_100102527731_100000186775 [0,1,0,0,0,1|1,0,1]=4 2678 B13R1.512 Cc1ccc(cc1)C=CC(C)(C)O 271570a_200016258132_100000186775 [0,1,0,0,0,1|0,0,1]=3 2679 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 207a_100000715429_100000211033 [0,1,0,0,0,1|1,0,0]=3 2680 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 2230a_100000715429_100000210814 [0,1,0,0,0,1|1,0,0]=3 2681 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C 34a_100000174908_100000210625 [0,1,0,0,0,1|1,0,0]=3 2682 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 34a_100011215236_100000210625 [0,1,0,0,0,1|1,0,0]=3 2683 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 34a_100015890283_100000210814 [0,1,0,0,0,1|1,0,0]=3 2684 B13R1.512 Cc1ccc(cc1)COC(C)(C)C 7a_100015890283_100000210814 [0,1,0,0,0,1|1,0,0]=3 2685 B13R1.512 Cc1ccc(cc1)CSC(C)(C)C 62a_100000210814_100000211941 [0,1,0,0,0,1|1,0,0]=3 2686 B13R1.512 Cc1ccc(cc1)CSC(C)(C)C 62a_100000211941_100000210814 [0,1,0,0,0,1|1,0,0]=3 2687 B13R1.512 Cc1ccc(cc1)NCC(C)(C)C 34a_100000124888_100011219605 [0,1,0,0,0,1|1,0,0]=3 2688 B13R1.512 Cc1ccc(cc1)NCC(C)(C)F 34a_100000124888_100011997219 [0,1,0,0,0,1|1,0,0]=3 2689 B13R1.512 Cc1ccc(cc1)NCC(C)(C)O 34a_100000124888_100000764493 [0,1,0,0,0,1|0,0,0]=2 2690 B13R1.512 Cc1ccc(cc1)OCC(C)(C)C 34a_100000210336_100011219605 [0,1,0,0,0,1|1,0,0]=3 2691 B13R1.512 Cc1ccc(cc1)OCC(C)(C)F 34a_100000210336_100011997219 [0,1,0,0,0,1|1,0,0]=3 2692 B13R1.512 Cc1ccc(cc1)OCC(C)(C)O 34a_100000210336_100000764493 [0,1,0,0,0,1|0,0,0]=2 2693 B13R1.512 Cc1ccc(cc1)OCC(C)(C)O 7a_100000210336_100000764493 [0,1,0,0,0,1|0,0,0]=2 2694 B13R1.512 Cc1ccc(cc1)OC[Si](C)(C)C 7a_100000210336_100000233785 [0,1,0,0,0,1|1,1,0]=4 2695 B13R1.512 Cc1ccc(cc1)SCC(C)(C)C 62a_100000186775_100011219605 [0,1,0,0,0,1|1,0,0]=3 2696 B13R1.512 Cc1ccc(cc1)SCC(C)(C)C 62a_100011219605_100000186775 [0,1,0,0,0,1|1,0,0]=3 2697 B13R1.512 Cc1ccc(cc1)SCC(C)(C)F 62a_100000186775_100011997219 [0,1,0,0,0,1|1,0,0]=3 2698 B13R1.512 Cc1ccc(cc1)SCC(C)(C)F 62a_100011997219_100000186775 [0,1,0,0,0,1|1,0,0]=3 2699 B13R1.512 Cc1ccc(cc1)SCC(C)(C)O 62a_100000186775_100000764493 [0,1,0,0,0,1|0,0,0]=2 2700 B13R1.512 Cc1ccc(cc1)SCC(C)(C)O 62a_100000764493_100000186775 [0,1,0,0,0,1|0,0,0]=2 2701 B13R1.512 Cc1ccc(cc1)SC[N+](C)(C)C 62a_100000186775_200000036245 [0,1,0,0,0,1|2,0,0]=4 2702 B13R1.512 Cc1ccc(cc1)SC[N+](C)(C)C 62a_200000036245_100000186775 [0,1,0,0,0,1|2,0,0]=4 2703 B13R1.512 Cc1ccc(cc1)SC[Si](C)(C)C 62a_100000037933_100000186775 [0,1,0,0,0,1|1,1,0]=4 2704 B13R1.512 Cc1ccc(cc1)SC[Si](C)(C)C 62a_100000186775_100000037933 [0,1,0,0,0,1|1,1,0]=4 2705 B13R1.512 Cc1ccc(cn1)C=CC(C)(C)O 271570a_200016258132_100000751577 [0,1,0,0,0,1|1,0,1]=4 2706 B13R1.512 Cc1ccc(cn1)CNC(C)(C)C 2230a_100000715429_100016987292 [0,1,0,0,0,1|2,0,0]=4 2707 B13R1.512 Cc1ccc(cn1)CNC(C)(C)C 34a_100000740942_100000210625 [0,1,0,0,0,1|2,0,0]=4 2708 B13R1.512 Cc1ccc(cn1)COC(C)(C)C 34a_100011248133_100000210625 [0,1,0,0,0,1|2,0,0]=4 2709 B13R1.512 Cc1ccc(cn1)COC(C)(C)C 34a_100015890283_100016987292 [0,1,0,0,0,1|2,0,0]=4 2710 B13R1.512 Cc1ccc(cn1)COC(C)(C)C 7a_100015890283_100016987292 [0,1,0,0,0,1|2,0,0]=4 2711 B13R1.512 Cc1ccc(cn1)CSC(C)(C)C 62a_100000211941_100016987292 [0,1,0,0,0,1|2,0,0]=4 2712 B13R1.512 Cc1ccc(cn1)CSC(C)(C)C 62a_100016987292_100000211941 [0,1,0,0,0,1|2,0,0]=4 2713 B13R1.512 Cc1ccc(cn1)OCC(C)(C)C 34a_100000745506_100011219605 [0,1,0,0,0,1|2,0,0]=4 2714 B13R1.512 Cc1ccc(cn1)OCC(C)(C)F 34a_100000745506_100011997219 [0,1,0,0,0,1|2,0,0]=4 2715 B13R1.512 Cc1ccc(cn1)OCC(C)(C)O 34a_100000745506_100000764493 [0,1,0,0,0,1|1,0,0]=3 2716 B13R1.512 Cc1ccc(cn1)OCC(C)(C)O 7a_100000745506_100000764493 [0,1,0,0,0,1|1,0,0]=3 2717 B13R1.512 Cc1ccc(cn1)SCC(C)(C)C 62a_100000751577_100011219605 [0,1,0,0,0,1|2,0,0]=4 2718 B13R1.512 Cc1ccc(cn1)SCC(C)(C)C 62a_100011219605_100000751577 [0,1,0,0,0,1|2,0,0]=4 2719 B13R1.512 Cc1ccc(cn1)SCC(C)(C)F 62a_100000751577_100011997219 [0,1,0,0,0,1|2,0,0]=4 2720 B13R1.512 Cc1ccc(cn1)SCC(C)(C)F 62a_100011997219_100000751577 [0,1,0,0,0,1|2,0,0]=4 2721 B13R1.512 Cc1ccc(cn1)SCC(C)(C)O 62a_100000751577_100000764493 [0,1,0,0,0,1|1,0,0]=3 2722 B13R1.512 Cc1ccc(cn1)SCC(C)(C)O 62a_100000764493_100000751577 [0,1,0,0,0,1|1,0,0]=3 2723 B13R1.512 Cc1ccc(nc1)C=CC(C)(C)O 271570a_200016258132_100000754016 [0,1,0,0,0,1|1,0,1]=4 2724 B13R1.512 Cc1ccc(nc1)CNC(C)(C)C 207a_100000715429_100000050478 [0,1,0,0,0,1|2,0,0]=4 2725 B13R1.512 Cc1ccc(nc1)CNC(C)(C)C 2230a_100000715429_100000691093 [0,1,0,0,0,1|2,0,0]=4 2726 B13R1.512 Cc1ccc(nc1)CNC(C)(C)C 34a_100015187455_100000210625 [0,1,0,0,0,1|2,0,0]=4 2727 B13R1.512 Cc1ccc(nc1)COC(C)(C)C 34a_100012001401_100000210625 [0,1,0,0,0,1|2,0,0]=4 2728 B13R1.512 Cc1ccc(nc1)COC(C)(C)C 34a_100015890283_100000691093 [0,1,0,0,0,1|2,0,0]=4 2729 B13R1.512 Cc1ccc(nc1)COC(C)(C)C 7a_100015890283_100000691093 [0,1,0,0,0,1|2,0,0]=4 2730 B13R1.512 Cc1ccc(nc1)CSC(C)(C)C 62a_100000211941_100000691093 [0,1,0,0,0,1|2,0,0]=4 2731 B13R1.512 Cc1ccc(nc1)CSC(C)(C)C 62a_100000691093_100000211941 [0,1,0,0,0,1|2,0,0]=4 2732 B13R1.512 Cc1ccc(nc1)OCC(C)(C)C 34a_100000759353_100011219605 [0,1,0,0,0,1|2,0,0]=4 2733 B13R1.512 Cc1ccc(nc1)OCC(C)(C)F 34a_100000759353_100011997219 [0,1,0,0,0,1|2,0,0]=4 2734 B13R1.512 Cc1ccc(nc1)OCC(C)(C)O 34a_100000759353_100000764493 [0,1,0,0,0,1|1,0,0]=3 2735 B13R1.512 Cc1ccc(nc1)SCC(C)(C)C 62a_100011192072_100011219605 [0,1,0,0,0,1|2,0,0]=4 2736 B13R1.512 Cc1ccc(nc1)SCC(C)(C)C 62a_100011219605_100000754016 [0,1,0,0,0,1|2,0,0]=4 2737 B13R1.512 Cc1ccc(nc1)SCC(C)(C)F 62a_100011192072_100011997219 [0,1,0,0,0,1|2,0,0]=4 2738 B13R1.512 Cc1ccc(nc1)SCC(C)(C)F 62a_100011997219_100000754016 [0,1,0,0,0,1|2,0,0]=4 2739 B13R1.512 Cc1ccc(nc1)SCC(C)(C)O 62a_100000764493_100000754016 [0,1,0,0,0,1|1,0,0]=3 2740 B13R1.512 Cc1ccc(nc1)SCC(C)(C)O 62a_100011192072_100000764493 [0,1,0,0,0,1|1,0,0]=3 2741 B13R1.512 Cc1ccc(nn1)NCC(C)(C)O 27a_100000751335_100000744512 [0,1,0,0,0,1|2,0,0]=4 2742 B13R1.512 Cc1ccc(nn1)SCC(C)(C)O 62a_100000744512_100000764493 [0,1,0,0,0,1|2,0,0]=4 2743 B13R1.512 Cc1ccc(nn1)SCC(C)(C)O 62a_100000764493_100000744512 [0,1,0,0,0,1|2,0,0]=4 2744 B13R1.512 Cc1cnc(cn1)NCC(C)(C)O 27a_100000751335_100000074397 [0,1,0,0,0,1|2,0,0]=4 2745 B13R1.512 Cc1cnc(cn1)SCC(C)(C)O 62a_100000764493_100011999403 [0,1,0,0,0,1|2,0,0]=4 2746 B13R1.512 Cc1cnc(cn1)SCC(C)(C)O 62a_100011999403_100000764493 [0,1,0,0,0,1|2,0,0]=4 2747 B13R1.512 Cc1cnc(nc1)NCC(C)(C)O 27a_100000751335_100000061069 [0,1,0,0,0,1|2,0,0]=4 2748 B13R1.512 Cc1cnc(nc1)SCC(C)(C)O 62a_100000061069_100000764493 [0,1,0,0,0,1|2,0,0]=4 2749 B13R1.512 Cc1cnc(nc1)SCC(C)(C)O 62a_100000764493_100000061069 [0,1,0,0,0,1|2,0,0]=4 2750 B13R1.512 Cc1ncc(cn1)OCC(C)(C)O 34a_100000062939_100000764493 [0,1,0,0,0,1|2,0,0]=4 2751 B13R1.512 Cc1ncc(cn1)OCC(C)(C)O 7a_100000062939_100000764493 [0,1,0,0,0,1|2,0,0]=4 2752 B13R1.512 Cc1ncc(cn1)SCC(C)(C)O 62a_100000686985_100000764493 [0,1,0,0,0,1|2,0,0]=4 2753 B13R1.512 Cc1ncc(cn1)SCC(C)(C)O 62a_100000764493_100000686985 [0,1,0,0,0,1|2,0,0]=4 2754 B13R1.838 CC(C)(C)C=Cc1cccc(c1)Br 271570a_100102527731_100000691529 [0,1,0,0,0,1|1,0,1]=4 2755 B13R1.838 CC(C)(C)C=Cc1cccc(c1)Cl 271570a_100102527731_100000699651 [0,1,0,0,0,1|1,0,1]=4 2756 B13R1.838 CC(C)(C)C=Cc1cccc(c1)F 271570a_100102527731_100000685547 [0,1,0,0,0,1|1,0,1]=4 2757 B13R1.838 CC(C)(C)C=Cc1cccc(c1)N 271570a_100102527731_100000210019 [0,1,0,0,0,1|1,0,1]=4 2758 B13R1.838 CC(C)(C)C=Cc1cccc(c1)O 271570a_100102527731_100000211634 [0,1,0,0,0,1|1,0,1]=4 2759 B13R1.838 CC(C)(C)C=Cc1cccc(c1)[S] 271570a_100102527731_114929384022 [0,1,0,0,0,1|1,0,1]=4 2760 B13R1.838 CC(C)(C)CNc1cc(ccn1)F 27a_100000743828_100000764206 [0,1,0,0,0,1|2,0,0]=4 2761 B13R1.838 CC(C)(C)CNc1cc[nH]c(=O)c1 27a_100000743828_100000061649 [0,1,0,0,0,1|2,0,0]=4 2762 B13R1.838 CC(C)(C)CNc1cccc(c1)Br 34a_100000210019_100011219605 [0,1,0,0,0,1|1,0,0]=3 2763 B13R1.838 CC(C)(C)CNc1cccc(c1)Cl 34a_100000185859_100011219605 [0,1,0,0,0,1|1,0,0]=3 2764 B13R1.838 CC(C)(C)CNc1cccc(c1)F 34a_100000210047_100011219605 [0,1,0,0,0,1|1,0,0]=3 2765 B13R1.838 CC(C)(C)CNc1cccc(c1)I 34a_100000211102_100011219605 [0,1,0,0,0,1|1,0,0]=3 2766 B13R1.838 CC(C)(C)CNc1cccc(c1)O 34a_100000210217_100011219605 [0,1,0,0,0,1|1,0,0]=3 2767 B13R1.838 CC(C)(C)CNc1cccc(n1)F 27a_100000743828_100009815982 [0,1,0,0,0,1|2,0,0]=4 2768 B13R1.838 CC(C)(C)CNc1ccnc(c1)F 27a_100000743828_100009816116 [0,1,0,0,0,1|2,0,0]=4 2769 B13R1.838 CC(C)(C)COc1cc[nH]c(=O)c1 34a_100000032262_100011219605 [0,1,0,0,0,1|2,0,0]=4 2770 B13R1.838 CC(C)(C)COc1ccc[n+](c1)[O-] 34a_100000039713_100011219605 [0,1,0,0,0,1|2,0,0]=4 2771 B13R1.838 CC(C)(C)COc1cccc(=O)[nH]1 34a_100000033347_100011219605 [0,1,0,0,0,1|2,0,0]=4 2772 B13R1.838 CC(C)(C)COc1cccc(c1)Br 34a_100000210342_100011219605 [0,1,0,0,0,1|1,0,0]=3 2773 B13R1.838 CC(C)(C)COc1cccc(c1)Cl 34a_100000210295_100011219605 [0,1,0,0,0,1|1,0,0]=3 2774 B13R1.838 CC(C)(C)COc1cccc(c1)F 34a_100000210426_100011219605 [0,1,0,0,0,1|1,0,0]=3 2775 B13R1.838 CC(C)(C)COc1cccc(c1)I 34a_100000211634_100011219605 [0,1,0,0,0,1|1,0,0]=3 2776 B13R1.838 CC(C)(C)COc1cccc(c1)N 34a_100000210217_100011219605 [0,1,0,0,0,1|1,0,0]=3 2777 B13R1.838 CC(C)(C)COc1cccc(c1)O 271570a_203496583355_200010229345 [0,1,0,0,0,1|1,0,0]=3 2778 B13R1.838 CC(C)(C)COc1cccc(n1)F 34a_100011432558_100011219605 [0,1,0,0,0,1|2,0,0]=4 2779 B13R1.838 CC(C)(C)COc1ccnc(c1)Cl 34a_100000762945_100011219605 [0,1,0,0,0,1|2,0,0]=4 2780 B13R1.838 CC(C)(C)COc1ccnc(c1)F 34a_100000732698_100011219605 [0,1,0,0,0,1|2,0,0]=4 2781 B13R1.838 CC(C)(C)COc1ccnc(c1)N 34a_100011834064_100011219605 [0,1,0,0,0,1|2,0,0]=4 2782 B13R1.838 CC(C)(C)COc1cncc(c1)Br 34a_100000754920_100011219605 [0,1,0,0,0,1|2,0,0]=4 2783 B13R1.838 CC(C)(C)COc1cncc(c1)F 34a_100011830296_100011219605 [0,1,0,0,0,1|2,0,0]=4 2784 B13R1.838 CC(C)(C)COc1cncc(c1)N 34a_100011997051_100011219605 [0,1,0,0,0,1|2,0,0]=4 2785 B13R1.838 CC(C)(C)CSc1cc(=O)cc[nH]1 62a_100009817434_100011219605 [0,1,0,0,0,1|2,0,0]=4 2786 B13R1.838 CC(C)(C)CSc1cc(ccn1)Cl 62a_100010167805_100011219605 [0,1,0,0,0,1|2,0,0]=4 2787 B13R1.838 CC(C)(C)CSc1cc(ccn1)Cl 62a_100011219605_100010167805 [0,1,0,0,0,1|2,0,0]=4 2788 B13R1.838 CC(C)(C)CSc1cc(ccn1)F 62a_100000764206_100011219605 [0,1,0,0,0,1|2,0,0]=4 2789 B13R1.838 CC(C)(C)CSc1cc(ccn1)F 62a_100011219605_100000764206 [0,1,0,0,0,1|2,0,0]=4 2790 B13R1.838 CC(C)(C)CSc1cc(ccn1)N 62a_100009814236_100011219605 [0,1,0,0,0,1|2,0,0]=4 2791 B13R1.838 CC(C)(C)CSc1cc(ccn1)N 62a_100011219605_100009814236 [0,1,0,0,0,1|2,0,0]=4 2792 B13R1.838 CC(C)(C)CSc1cc(ccn1)O 62a_100011219605_100000762945 [0,1,0,0,0,1|2,0,0]=4 2793 B13R1.838 CC(C)(C)CSc1cc[nH]c(=O)c1 62a_100009816521_100011219605 [0,1,0,0,0,1|2,0,0]=4 2794 B13R1.838 CC(C)(C)CSc1cc[nH]c(=O)c1 62a_100011219605_100009816521 [0,1,0,0,0,1|2,0,0]=4 2795 B13R1.838 CC(C)(C)CSc1ccc[n+](c1)[O-] 62a_100011219605_100009815978 [0,1,0,0,0,1|2,0,0]=4 2796 B13R1.838 CC(C)(C)CSc1cccc(=O)[nH]1 62a_100011219605_100000752884 [0,1,0,0,0,1|2,0,0]=4 2797 B13R1.838 CC(C)(C)CSc1cccc(c1)Br 62a_100000691529_100011219605 [0,1,0,0,0,1|1,0,0]=3 2798 B13R1.838 CC(C)(C)CSc1cccc(c1)Br 62a_100011219605_100000691529 [0,1,0,0,0,1|1,0,0]=3 2799 B13R1.838 CC(C)(C)CSc1cccc(c1)Cl 62a_100000699651_100011219605 [0,1,0,0,0,1|1,0,0]=3 2800 B13R1.838 CC(C)(C)CSc1cccc(c1)Cl 62a_100011219605_100000699651 [0,1,0,0,0,1|1,0,0]=3 2801 B13R1.838 CC(C)(C)CSc1cccc(c1)F 62a_100000685547_100011219605 [0,1,0,0,0,1|1,0,0]=3 2802 B13R1.838 CC(C)(C)CSc1cccc(c1)F 62a_100011219605_100000685547 [0,1,0,0,0,1|1,0,0]=3 2803 B13R1.838 CC(C)(C)CSc1cccc(c1)N 62a_100000210019_100011219605 [0,1,0,0,0,1|1,0,0]=3 2804 B13R1.838 CC(C)(C)CSc1cccc(c1)N 62a_100011219605_100000210019 [0,1,0,0,0,1|1,0,0]=3 2805 B13R1.838 CC(C)(C)CSc1cccc(c1)O 62a_100011219605_100000211634 [0,1,0,0,0,1|1,0,0]=3 2806 B13R1.838 CC(C)(C)CSc1cccc(c1)[S] 62a_100011219605_114929384022 [0,1,0,0,0,1|1,0,0]=3 2807 B13R1.838 CC(C)(C)CSc1cccc(c1)[S] 62a_114929384022_100011219605 [0,1,0,0,0,1|1,0,0]=3 2808 B13R1.838 CC(C)(C)CSc1cccc(n1)Br 62a_100000684672_100011219605 [0,1,0,0,0,1|2,0,0]=4 2809 B13R1.838 CC(C)(C)CSc1cccc(n1)Br 62a_100011219605_100000684672 [0,1,0,0,0,1|2,0,0]=4 2810 B13R1.838 CC(C)(C)CSc1cccc(n1)Cl 62a_100000051397_100011219605 [0,1,0,0,0,1|2,0,0]=4 2811 B13R1.838 CC(C)(C)CSc1cccc(n1)Cl 62a_100011219605_100000051397 [0,1,0,0,0,1|2,0,0]=4 2812 B13R1.838 CC(C)(C)CSc1cccc(n1)F 62a_100009815982_100011219605 [0,1,0,0,0,1|2,0,0]=4 2813 B13R1.838 CC(C)(C)CSc1cccc(n1)F 62a_100011219605_100009815982 [0,1,0,0,0,1|2,0,0]=4 2814 B13R1.838 CC(C)(C)CSc1cccc(n1)N 62a_100000740741_100011219605 [0,1,0,0,0,1|2,0,0]=4 2815 B13R1.838 CC(C)(C)CSc1cccc(n1)N 62a_100011219605_100000740741 [0,1,0,0,0,1|2,0,0]=4 2816 B13R1.838 CC(C)(C)CSc1ccnc(c1)Br 62a_100009814637_100011219605 [0,1,0,0,0,1|2,0,0]=4 2817 B13R1.838 CC(C)(C)CSc1ccnc(c1)Br 62a_100011219605_100009814637 [0,1,0,0,0,1|2,0,0]=4 2818 B13R1.838 CC(C)(C)CSc1ccnc(c1)Cl 62a_100000035001_100011219605 [0,1,0,0,0,1|2,0,0]=4 2819 B13R1.838 CC(C)(C)CSc1ccnc(c1)Cl 62a_100011219605_100000035001 [0,1,0,0,0,1|2,0,0]=4 2820 B13R1.838 CC(C)(C)CSc1ccnc(c1)F 62a_100009816116_100011219605 [0,1,0,0,0,1|2,0,0]=4 2821 B13R1.838 CC(C)(C)CSc1ccnc(c1)F 62a_100011219605_100009816116 [0,1,0,0,0,1|2,0,0]=4 2822 B13R1.838 CC(C)(C)CSc1ccnc(c1)N 62a_100000049665_100011219605 [0,1,0,0,0,1|2,0,0]=4 2823 B13R1.838 CC(C)(C)CSc1ccnc(c1)N 62a_100011219605_100000049665 [0,1,0,0,0,1|2,0,0]=4 2824 B13R1.838 CC(C)(C)CSc1cncc(c1)Br 62a_100000728054_100011219605 [0,1,0,0,0,1|2,0,0]=4 2825 B13R1.838 CC(C)(C)CSc1cncc(c1)Br 62a_100011219605_100000728054 [0,1,0,0,0,1|2,0,0]=4 2826 B13R1.838 CC(C)(C)CSc1cncc(c1)Cl 62a_100000049639_100011219605 [0,1,0,0,0,1|2,0,0]=4 2827 B13R1.838 CC(C)(C)CSc1cncc(c1)Cl 62a_100011219605_100000049639 [0,1,0,0,0,1|2,0,0]=4 2828 B13R1.838 CC(C)(C)CSc1cncc(c1)F 62a_100000744099_100011219605 [0,1,0,0,0,1|2,0,0]=4 2829 B13R1.838 CC(C)(C)CSc1cncc(c1)F 62a_100011219605_100000744099 [0,1,0,0,0,1|2,0,0]=4 2830 B13R1.838 CC(C)(C)CSc1cncc(c1)N 62a_100000687067_100011219605 [0,1,0,0,0,1|2,0,0]=4 2831 B13R1.838 CC(C)(C)CSc1cncc(c1)N 62a_100011219605_100000687067 [0,1,0,0,0,1|2,0,0]=4 2832 B13R1.838 CC(C)(C)CSc1cncc(c1)O 62a_100000754920_100011219605 [0,1,0,0,0,1|2,0,0]=4 2833 B13R1.838 CC(C)(C)CSc1cncc(c1)O 62a_100011219605_100000754920 [0,1,0,0,0,1|2,0,0]=4 2834 B13R1.838 CC(C)(C)NCc1cc(ccn1)Br 2230a_100000715429_100010173614 [0,1,0,0,0,1|2,0,0]=4 2835 B13R1.838 CC(C)(C)NCc1cc(ccn1)Cl 2230a_100000715429_100016988179 [0,1,0,0,0,1|2,0,0]=4 2836 B13R1.838 CC(C)(C)NCc1cccc(=O)[nH]1 207a_100000715429_100011935257 [0,1,0,0,0,1|2,0,0]=4 2837 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 207a_100000715429_100000210085 [0,1,0,0,0,1|1,0,0]=3 2838 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 2230a_100000715429_100000698116 [0,1,0,0,0,1|1,0,0]=3 2839 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 34a_100000174977_100000210625 [0,1,0,0,0,1|1,0,0]=3 2840 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 207a_100000715429_100000210801 [0,1,0,0,0,1|1,0,0]=3 2841 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 2230a_100000715429_100000181238 [0,1,0,0,0,1|1,0,0]=3 2842 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 34a_100000174878_100000210625 [0,1,0,0,0,1|1,0,0]=3 2843 B13R1.838 CC(C)(C)NCc1cccc(c1)F 207a_100000715429_100000210812 [0,1,0,0,0,1|1,0,0]=3 2844 B13R1.838 CC(C)(C)NCc1cccc(c1)F 2230a_100000715429_100000230114 [0,1,0,0,0,1|1,0,0]=3 2845 B13R1.838 CC(C)(C)NCc1cccc(c1)F 34a_100000174948_100000210625 [0,1,0,0,0,1|1,0,0]=3 2846 B13R1.838 CC(C)(C)NCc1cccc(c1)I 207a_100000715429_100000014684 [0,1,0,0,0,1|1,0,0]=3 2847 B13R1.838 CC(C)(C)NCc1cccc(c1)I 2230a_100000715429_100011218688 [0,1,0,0,0,1|1,0,0]=3 2848 B13R1.838 CC(C)(C)NCc1cccc(c1)I 34a_100000106179_100000210625 [0,1,0,0,0,1|1,0,0]=3 2849 B13R1.838 CC(C)(C)NCc1cccc(c1)O 207a_100000715429_100000188321 [0,1,0,0,0,1|1,0,0]=3 2850 B13R1.838 CC(C)(C)NCc1cccc(c1)O 2230a_100000715429_100011660834 [0,1,0,0,0,1|1,0,0]=3 2851 B13R1.838 CC(C)(C)NCc1cccc(c1)O 34a_100000743036_100000210625 [0,1,0,0,0,1|1,0,0]=3 2852 B13R1.838 CC(C)(C)NCc1cccc(n1)Br 2230a_100000715429_100009889011 [0,1,0,0,0,1|2,0,0]=4 2853 B13R1.838 CC(C)(C)NCc1cccc(n1)Cl 2230a_100000715429_100000086093 [0,1,0,0,0,1|2,0,0]=4 2854 B13R1.838 CC(C)(C)NCc1cccc(n1)F 2230a_100000715429_100009819644 [0,1,0,0,0,1|2,0,0]=4 2855 B13R1.838 CC(C)(C)NCc1cccc(n1)F 34a_100015188798_100000210625 [0,1,0,0,0,1|2,0,0]=4 2856 B13R1.838 CC(C)(C)NCc1ccnc(c1)Br 2230a_100000715429_100010243470 [0,1,0,0,0,1|2,0,0]=4 2857 B13R1.838 CC(C)(C)NCc1ccnc(c1)Br 34a_100025757509_100000210625 [0,1,0,0,0,1|2,0,0]=4 2858 B13R1.838 CC(C)(C)NCc1ccnc(c1)Cl 2230a_100000715429_100000764220 [0,1,0,0,0,1|2,0,0]=4 2859 B13R1.838 CC(C)(C)NCc1ccnc(c1)Cl 34a_100015205668_100000210625 [0,1,0,0,0,1|2,0,0]=4 2860 B13R1.838 CC(C)(C)NCc1ccnc(c1)F 34a_100015188774_100000210625 [0,1,0,0,0,1|2,0,0]=4 2861 B13R1.838 CC(C)(C)NCc1ccnc(c1)O 207a_100000715429_100000688113 [0,1,0,0,0,1|2,0,0]=4 2862 B13R1.838 CC(C)(C)NCc1cncc(c1)Br 207a_100000715429_100000687066 [0,1,0,0,0,1|2,0,0]=4 2863 B13R1.838 CC(C)(C)NCc1cncc(c1)Br 2230a_100000715429_100000738771 [0,1,0,0,0,1|2,0,0]=4 2864 B13R1.838 CC(C)(C)NCc1cncc(c1)Cl 207a_100000715429_100000088910 [0,1,0,0,0,1|2,0,0]=4 2865 B13R1.838 CC(C)(C)NCc1cncc(c1)Cl 2230a_100000715429_100016992070 [0,1,0,0,0,1|2,0,0]=4 2866 B13R1.838 CC(C)(C)NCc1cncc(c1)F 207a_100000715429_100011361476 [0,1,0,0,0,1|2,0,0]=4 2867 B13R1.838 CC(C)(C)NCc1cncc(c1)F 2230a_100000715429_100000725299 [0,1,0,0,0,1|2,0,0]=4 2868 B13R1.838 CC(C)(C)NCc1cncc(c1)F 34a_100011962886_100000210625 [0,1,0,0,0,1|2,0,0]=4 2869 B13R1.838 CC(C)(C)NCc1cncc(c1)O 207a_100000715429_100012187055 [0,1,0,0,0,1|2,0,0]=4 2870 B13R1.838 CC(C)(C)OCc1cc(ccn1)Br 34a_100015890283_100010173614 [0,1,0,0,0,1|2,0,0]=4 2871 B13R1.838 CC(C)(C)OCc1cc(ccn1)Br 7a_100015890283_100010173614 [0,1,0,0,0,1|2,0,0]=4 2872 B13R1.838 CC(C)(C)OCc1cc(ccn1)Cl 34a_100000748867_100000210625 [0,1,0,0,0,1|2,0,0]=4 2873 B13R1.838 CC(C)(C)OCc1cc(ccn1)Cl 34a_100015890283_100016988179 [0,1,0,0,0,1|2,0,0]=4 2874 B13R1.838 CC(C)(C)OCc1cc(ccn1)Cl 7a_100015890283_100016988179 [0,1,0,0,0,1|2,0,0]=4 2875 B13R1.838 CC(C)(C)OCc1cc(ccn1)N 34a_100000692640_100000210625 [0,1,0,0,0,1|2,0,0]=4 2876 B13R1.838 CC(C)(C)OCc1ccc[n+](c1)[O-] 34a_100000037817_100000210625 [0,1,0,0,0,1|2,0,0]=4 2877 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 34a_100000687537_100000210625 [0,1,0,0,0,1|1,0,0]=3 2878 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 34a_100015890283_100000698116 [0,1,0,0,0,1|1,0,0]=3 2879 B13R1.838 CC(C)(C)OCc1cccc(c1)Br 7a_100015890283_100000211773 [0,1,0,0,0,1|1,0,0]=3 2880 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 34a_100000241301_100000210625 [0,1,0,0,0,1|1,0,0]=3 2881 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 34a_100015890283_100000187163 [0,1,0,0,0,1|1,0,0]=3 2882 B13R1.838 CC(C)(C)OCc1cccc(c1)Cl 7a_100015890283_100000187163 [0,1,0,0,0,1|1,0,0]=3 2883 B13R1.838 CC(C)(C)OCc1cccc(c1)F 34a_100000210976_100000210625 [0,1,0,0,0,1|1,0,0]=3 2884 B13R1.838 CC(C)(C)OCc1cccc(c1)F 34a_100015890283_100000187166 [0,1,0,0,0,1|1,0,0]=3 2885 B13R1.838 CC(C)(C)OCc1cccc(c1)F 7a_100015890283_100000230114 [0,1,0,0,0,1|1,0,0]=3 2886 B13R1.838 CC(C)(C)OCc1cccc(c1)I 34a_100011215336_100000210625 [0,1,0,0,0,1|1,0,0]=3 2887 B13R1.838 CC(C)(C)OCc1cccc(c1)I 34a_100015890283_100011218688 [0,1,0,0,0,1|1,0,0]=3 2888 B13R1.838 CC(C)(C)OCc1cccc(c1)I 7a_100015890283_100011218688 [0,1,0,0,0,1|1,0,0]=3 2889 B13R1.838 CC(C)(C)OCc1cccc(c1)N 34a_100000211919_100000210625 [0,1,0,0,0,1|1,0,0]=3 2890 B13R1.838 CC(C)(C)OCc1cccc(c1)O 34a_100015890283_100011660834 [0,1,0,0,0,1|1,0,0]=3 2891 B13R1.838 CC(C)(C)OCc1cccc(c1)O 7a_100015890283_100000084143 [0,1,0,0,0,1|1,0,0]=3 2892 B13R1.838 CC(C)(C)OCc1cccc(n1)Br 34a_100000694195_100000210625 [0,1,0,0,0,1|2,0,0]=4 2893 B13R1.838 CC(C)(C)OCc1cccc(n1)Br 34a_100015890283_100009889011 [0,1,0,0,0,1|2,0,0]=4 2894 B13R1.838 CC(C)(C)OCc1cccc(n1)Br 7a_100015890283_100009889011 [0,1,0,0,0,1|2,0,0]=4 2895 B13R1.838 CC(C)(C)OCc1cccc(n1)Cl 34a_100011998359_100000210625 [0,1,0,0,0,1|2,0,0]=4 2896 B13R1.838 CC(C)(C)OCc1cccc(n1)Cl 34a_100015890283_100000086093 [0,1,0,0,0,1|2,0,0]=4 2897 B13R1.838 CC(C)(C)OCc1cccc(n1)Cl 7a_100015890283_100000086093 [0,1,0,0,0,1|2,0,0]=4 2898 B13R1.838 CC(C)(C)OCc1cccc(n1)F 34a_100000086748_100000210625 [0,1,0,0,0,1|2,0,0]=4 2899 B13R1.838 CC(C)(C)OCc1cccc(n1)F 34a_100015890283_100009819644 [0,1,0,0,0,1|2,0,0]=4 2900 B13R1.838 CC(C)(C)OCc1cccc(n1)F 7a_100015890283_100009819644 [0,1,0,0,0,1|2,0,0]=4 2901 B13R1.838 CC(C)(C)OCc1ccnc(c1)Br 34a_100009814636_100000210625 [0,1,0,0,0,1|2,0,0]=4 2902 B13R1.838 CC(C)(C)OCc1ccnc(c1)Br 34a_100015890283_100010243470 [0,1,0,0,0,1|2,0,0]=4 2903 B13R1.838 CC(C)(C)OCc1ccnc(c1)Br 7a_100015890283_100010254460 [0,1,0,0,0,1|2,0,0]=4 2904 B13R1.838 CC(C)(C)OCc1ccnc(c1)Cl 34a_100000748751_100000210625 [0,1,0,0,0,1|2,0,0]=4 2905 B13R1.838 CC(C)(C)OCc1ccnc(c1)Cl 34a_100015890283_100000764220 [0,1,0,0,0,1|2,0,0]=4 2906 B13R1.838 CC(C)(C)OCc1ccnc(c1)Cl 7a_100015890283_100000764220 [0,1,0,0,0,1|2,0,0]=4 2907 B13R1.838 CC(C)(C)OCc1ccnc(c1)F 34a_100000082451_100000210625 [0,1,0,0,0,1|2,0,0]=4 2908 B13R1.838 CC(C)(C)OCc1cncc(c1)Br 34a_100011259137_100000210625 [0,1,0,0,0,1|2,0,0]=4 2909 B13R1.838 CC(C)(C)OCc1cncc(c1)Br 34a_100015890283_100000738771 [0,1,0,0,0,1|2,0,0]=4 2910 B13R1.838 CC(C)(C)OCc1cncc(c1)Br 7a_100015890283_100000738771 [0,1,0,0,0,1|2,0,0]=4 2911 B13R1.838 CC(C)(C)OCc1cncc(c1)Cl 34a_100000092867_100000210625 [0,1,0,0,0,1|2,0,0]=4 2912 B13R1.838 CC(C)(C)OCc1cncc(c1)Cl 34a_100015890283_100016992070 [0,1,0,0,0,1|2,0,0]=4 2913 B13R1.838 CC(C)(C)OCc1cncc(c1)Cl 7a_100015890283_100016992070 [0,1,0,0,0,1|2,0,0]=4 2914 B13R1.838 CC(C)(C)OCc1cncc(c1)F 34a_100011962875_100000210625 [0,1,0,0,0,1|2,0,0]=4 2915 B13R1.838 CC(C)(C)OCc1cncc(c1)F 34a_100015890283_100000725299 [0,1,0,0,0,1|2,0,0]=4 2916 B13R1.838 CC(C)(C)OCc1cncc(c1)F 7a_100015890283_100000725299 [0,1,0,0,0,1|2,0,0]=4 2917 B13R1.838 CC(C)(C)OCc1cncc(c1)N 34a_100000085308_100000210625 [0,1,0,0,0,1|2,0,0]=4 2918 B13R1.838 CC(C)(C)SCc1cc(ccn1)Br 62a_100000211941_100010173614 [0,1,0,0,0,1|2,0,0]=4 2919 B13R1.838 CC(C)(C)SCc1cc(ccn1)Br 62a_100010173614_100000211941 [0,1,0,0,0,1|2,0,0]=4 2920 B13R1.838 CC(C)(C)SCc1cc(ccn1)Cl 62a_100000211941_100016988179 [0,1,0,0,0,1|2,0,0]=4 2921 B13R1.838 CC(C)(C)SCc1cc(ccn1)Cl 62a_100016988179_100000211941 [0,1,0,0,0,1|2,0,0]=4 2922 B13R1.838 CC(C)(C)SCc1cccc(c1)Br 62a_100000211773_100000211941 [0,1,0,0,0,1|1,0,0]=3 2923 B13R1.838 CC(C)(C)SCc1cccc(c1)Br 62a_100000211941_100000211773 [0,1,0,0,0,1|1,0,0]=3 2924 B13R1.838 CC(C)(C)SCc1cccc(c1)Cl 62a_100000187163_100000211941 [0,1,0,0,0,1|1,0,0]=3 2925 B13R1.838 CC(C)(C)SCc1cccc(c1)Cl 62a_100000211941_100000187163 [0,1,0,0,0,1|1,0,0]=3 2926 B13R1.838 CC(C)(C)SCc1cccc(c1)F 62a_100000211941_100000230114 [0,1,0,0,0,1|1,0,0]=3 2927 B13R1.838 CC(C)(C)SCc1cccc(c1)F 62a_100000230114_100000211941 [0,1,0,0,0,1|1,0,0]=3 2928 B13R1.838 CC(C)(C)SCc1cccc(c1)I 62a_100000211941_100011218688 [0,1,0,0,0,1|1,0,0]=3 2929 B13R1.838 CC(C)(C)SCc1cccc(c1)I 62a_100011218688_100000211941 [0,1,0,0,0,1|1,0,0]=3 2930 B13R1.838 CC(C)(C)SCc1cccc(c1)O 62a_100000211941_100011660834 [0,1,0,0,0,1|1,0,0]=3 2931 B13R1.838 CC(C)(C)SCc1cccc(c1)O 62a_100011660834_100000211941 [0,1,0,0,0,1|1,0,0]=3 2932 B13R1.838 CC(C)(C)SCc1cccc(n1)Br 62a_100000211941_100009889011 [0,1,0,0,0,1|2,0,0]=4 2933 B13R1.838 CC(C)(C)SCc1cccc(n1)Br 62a_100009889011_100000211941 [0,1,0,0,0,1|2,0,0]=4 2934 B13R1.838 CC(C)(C)SCc1cccc(n1)Cl 62a_100000086093_100000211941 [0,1,0,0,0,1|2,0,0]=4 2935 B13R1.838 CC(C)(C)SCc1cccc(n1)Cl 62a_100000211941_100000086093 [0,1,0,0,0,1|2,0,0]=4 2936 B13R1.838 CC(C)(C)SCc1cccc(n1)F 62a_100000211941_100009819644 [0,1,0,0,0,1|2,0,0]=4 2937 B13R1.838 CC(C)(C)SCc1cccc(n1)F 62a_100009819644_100000211941 [0,1,0,0,0,1|2,0,0]=4 2938 B13R1.838 CC(C)(C)SCc1ccnc(c1)Br 62a_100000211941_100010243470 [0,1,0,0,0,1|2,0,0]=4 2939 B13R1.838 CC(C)(C)SCc1ccnc(c1)Br 62a_100010254460_100000211941 [0,1,0,0,0,1|2,0,0]=4 2940 B13R1.838 CC(C)(C)SCc1ccnc(c1)Cl 62a_100000211941_100000764220 [0,1,0,0,0,1|2,0,0]=4 2941 B13R1.838 CC(C)(C)SCc1ccnc(c1)Cl 62a_100000764220_100000211941 [0,1,0,0,0,1|2,0,0]=4 2942 B13R1.838 CC(C)(C)SCc1cncc(c1)Br 62a_100000211941_100000738771 [0,1,0,0,0,1|2,0,0]=4 2943 B13R1.838 CC(C)(C)SCc1cncc(c1)Br 62a_100000738771_100000211941 [0,1,0,0,0,1|2,0,0]=4 2944 B13R1.838 CC(C)(C)SCc1cncc(c1)Cl 62a_100000211941_100016992070 [0,1,0,0,0,1|2,0,0]=4 2945 B13R1.838 CC(C)(C)SCc1cncc(c1)Cl 62a_100016992070_100000211941 [0,1,0,0,0,1|2,0,0]=4 2946 B13R1.838 CC(C)(C)SCc1cncc(c1)F 62a_100000211941_100000725299 [0,1,0,0,0,1|2,0,0]=4 2947 B13R1.838 CC(C)(C)SCc1cncc(c1)F 62a_100000725299_100000211941 [0,1,0,0,0,1|2,0,0]=4 2948 B13R1.838 CC(C)(F)CNc1cc(ccn1)F 27a_100020643315_100000764206 [0,1,0,0,0,1|2,0,0]=4 2949 B13R1.838 CC(C)(F)CNc1cc[nH]c(=O)c1 27a_100020643315_100000061649 [0,1,0,0,0,1|2,0,0]=4 2950 B13R1.838 CC(C)(F)CNc1cccc(c1)Br 34a_100000210019_100011997219 [0,1,0,0,0,1|1,0,0]=3 2951 B13R1.838 CC(C)(F)CNc1cccc(c1)Cl 34a_100000185859_100011997219 [0,1,0,0,0,1|1,0,0]=3 2952 B13R1.838 CC(C)(F)CNc1cccc(c1)F 34a_100000210047_100011997219 [0,1,0,0,0,1|1,0,0]=3 2953 B13R1.838 CC(C)(F)CNc1cccc(c1)I 34a_100000211102_100011997219 [0,1,0,0,0,1|1,0,0]=3 2954 B13R1.838 CC(C)(F)CNc1cccc(c1)O 34a_100000210217_100011997219 [0,1,0,0,0,1|1,0,0]=3 2955 B13R1.838 CC(C)(F)CNc1cccc(n1)F 27a_100020643315_100009815982 [0,1,0,0,0,1|2,0,0]=4 2956 B13R1.838 CC(C)(F)CNc1ccnc(c1)F 27a_100020643315_100009816116 [0,1,0,0,0,1|2,0,0]=4 2957 B13R1.838 CC(C)(F)COc1cc[nH]c(=O)c1 34a_100000032262_100011997219 [0,1,0,0,0,1|2,0,0]=4 2958 B13R1.838 CC(C)(F)COc1ccc[n+](c1)[O-] 34a_100000039713_100011997219 [0,1,0,0,0,1|2,0,0]=4 2959 B13R1.838 CC(C)(F)COc1cccc(=O)[nH]1 34a_100000033347_100011997219 [0,1,0,0,0,1|2,0,0]=4 2960 B13R1.838 CC(C)(F)COc1cccc(c1)Br 34a_100000210342_100011997219 [0,1,0,0,0,1|1,0,0]=3 2961 B13R1.838 CC(C)(F)COc1cccc(c1)Cl 34a_100000210295_100011997219 [0,1,0,0,0,1|1,0,0]=3 2962 B13R1.838 CC(C)(F)COc1cccc(c1)F 34a_100000210426_100011997219 [0,1,0,0,0,1|1,0,0]=3 2963 B13R1.838 CC(C)(F)COc1cccc(c1)I 34a_100000211634_100011997219 [0,1,0,0,0,1|1,0,0]=3 2964 B13R1.838 CC(C)(F)COc1cccc(c1)N 34a_100000210217_100011997219 [0,1,0,0,0,1|1,0,0]=3 2965 B13R1.838 CC(C)(F)COc1cccc(n1)F 34a_100011432558_100011997219 [0,1,0,0,0,1|2,0,0]=4 2966 B13R1.838 CC(C)(F)COc1ccnc(c1)Cl 34a_100000762945_100011997219 [0,1,0,0,0,1|2,0,0]=4 2967 B13R1.838 CC(C)(F)COc1ccnc(c1)F 34a_100000732698_100011997219 [0,1,0,0,0,1|2,0,0]=4 2968 B13R1.838 CC(C)(F)COc1ccnc(c1)N 34a_100011834064_100011997219 [0,1,0,0,0,1|2,0,0]=4 2969 B13R1.838 CC(C)(F)COc1cncc(c1)Br 34a_100000754920_100011997219 [0,1,0,0,0,1|2,0,0]=4 2970 B13R1.838 CC(C)(F)COc1cncc(c1)F 34a_100011830296_100011997219 [0,1,0,0,0,1|2,0,0]=4 2971 B13R1.838 CC(C)(F)COc1cncc(c1)N 34a_100011997051_100011997219 [0,1,0,0,0,1|2,0,0]=4 2972 B13R1.838 CC(C)(F)CSc1cc(=O)cc[nH]1 62a_100009817434_100011997219 [0,1,0,0,0,1|2,0,0]=4 2973 B13R1.838 CC(C)(F)CSc1cc(ccn1)Cl 62a_100010167805_100011997219 [0,1,0,0,0,1|2,0,0]=4 2974 B13R1.838 CC(C)(F)CSc1cc(ccn1)Cl 62a_100011997219_100010167805 [0,1,0,0,0,1|2,0,0]=4 2975 B13R1.838 CC(C)(F)CSc1cc(ccn1)F 62a_100000764206_100011997219 [0,1,0,0,0,1|2,0,0]=4 2976 B13R1.838 CC(C)(F)CSc1cc(ccn1)F 62a_100011997219_100000764206 [0,1,0,0,0,1|2,0,0]=4 2977 B13R1.838 CC(C)(F)CSc1cc(ccn1)N 62a_100009814236_100011997219 [0,1,0,0,0,1|2,0,0]=4 2978 B13R1.838 CC(C)(F)CSc1cc(ccn1)N 62a_100011997219_100009814236 [0,1,0,0,0,1|2,0,0]=4 2979 B13R1.838 CC(C)(F)CSc1cc(ccn1)O 62a_100011997219_100000762945 [0,1,0,0,0,1|2,0,0]=4 2980 B13R1.838 CC(C)(F)CSc1cc[nH]c(=O)c1 62a_100009816521_100011997219 [0,1,0,0,0,1|2,0,0]=4 2981 B13R1.838 CC(C)(F)CSc1cc[nH]c(=O)c1 62a_100011997219_100009816521 [0,1,0,0,0,1|2,0,0]=4 2982 B13R1.838 CC(C)(F)CSc1ccc[n+](c1)[O-] 62a_100011997219_100009815978 [0,1,0,0,0,1|2,0,0]=4 2983 B13R1.838 CC(C)(F)CSc1cccc(=O)[nH]1 62a_100011997219_100000752884 [0,1,0,0,0,1|2,0,0]=4 2984 B13R1.838 CC(C)(F)CSc1cccc(c1)Br 62a_100000691529_100011997219 [0,1,0,0,0,1|1,0,0]=3 2985 B13R1.838 CC(C)(F)CSc1cccc(c1)Br 62a_100011997219_100000691529 [0,1,0,0,0,1|1,0,0]=3 2986 B13R1.838 CC(C)(F)CSc1cccc(c1)Cl 62a_100000699651_100011997219 [0,1,0,0,0,1|1,0,0]=3 2987 B13R1.838 CC(C)(F)CSc1cccc(c1)Cl 62a_100011997219_100000699651 [0,1,0,0,0,1|1,0,0]=3 2988 B13R1.838 CC(C)(F)CSc1cccc(c1)F 62a_100000685547_100011997219 [0,1,0,0,0,1|1,0,0]=3 2989 B13R1.838 CC(C)(F)CSc1cccc(c1)F 62a_100011997219_100000685547 [0,1,0,0,0,1|1,0,0]=3 2990 B13R1.838 CC(C)(F)CSc1cccc(c1)N 62a_100000210019_100011997219 [0,1,0,0,0,1|1,0,0]=3 2991 B13R1.838 CC(C)(F)CSc1cccc(c1)N 62a_100011997219_100000210019 [0,1,0,0,0,1|1,0,0]=3 2992 B13R1.838 CC(C)(F)CSc1cccc(c1)O 62a_100011997219_100000211634 [0,1,0,0,0,1|1,0,0]=3 2993 B13R1.838 CC(C)(F)CSc1cccc(c1)[S] 62a_100011997219_114929384022 [0,1,0,0,0,1|1,0,0]=3 2994 B13R1.838 CC(C)(F)CSc1cccc(c1)[S] 62a_114929384022_100011997219 [0,1,0,0,0,1|1,0,0]=3 2995 B13R1.838 CC(C)(F)CSc1cccc(n1)Br 62a_100000684672_100011997219 [0,1,0,0,0,1|2,0,0]=4 2996 B13R1.838 CC(C)(F)CSc1cccc(n1)Br 62a_100011997219_100000684672 [0,1,0,0,0,1|2,0,0]=4 2997 B13R1.838 CC(C)(F)CSc1cccc(n1)Cl 62a_100000051397_100011997219 [0,1,0,0,0,1|2,0,0]=4 2998 B13R1.838 CC(C)(F)CSc1cccc(n1)Cl 62a_100011997219_100000051397 [0,1,0,0,0,1|2,0,0]=4 2999 B13R1.838 CC(C)(F)CSc1cccc(n1)F 62a_100009815982_100011997219 [0,1,0,0,0,1|2,0,0]=4 3000 B13R1.838 CC(C)(F)CSc1cccc(n1)F 62a_100011997219_100009815982 [0,1,0,0,0,1|2,0,0]=4 3001 B13R1.838 CC(C)(F)CSc1cccc(n1)N 62a_100000740741_100011997219 [0,1,0,0,0,1|2,0,0]=4 3002 B13R1.838 CC(C)(F)CSc1cccc(n1)N 62a_100011997219_100000740741 [0,1,0,0,0,1|2,0,0]=4 3003 B13R1.838 CC(C)(F)CSc1ccnc(c1)Br 62a_100009814637_100011997219 [0,1,0,0,0,1|2,0,0]=4 3004 B13R1.838 CC(C)(F)CSc1ccnc(c1)Br 62a_100011997219_100009814637 [0,1,0,0,0,1|2,0,0]=4 3005 B13R1.838 CC(C)(F)CSc1ccnc(c1)Cl 62a_100000035001_100011997219 [0,1,0,0,0,1|2,0,0]=4 3006 B13R1.838 CC(C)(F)CSc1ccnc(c1)Cl 62a_100011997219_100000035001 [0,1,0,0,0,1|2,0,0]=4 3007 B13R1.838 CC(C)(F)CSc1ccnc(c1)F 62a_100009816116_100011997219 [0,1,0,0,0,1|2,0,0]=4 3008 B13R1.838 CC(C)(F)CSc1ccnc(c1)F 62a_100011997219_100009816116 [0,1,0,0,0,1|2,0,0]=4 3009 B13R1.838 CC(C)(F)CSc1ccnc(c1)N 62a_100000049665_100011997219 [0,1,0,0,0,1|2,0,0]=4 3010 B13R1.838 CC(C)(F)CSc1ccnc(c1)N 62a_100011997219_100000049665 [0,1,0,0,0,1|2,0,0]=4 3011 B13R1.838 CC(C)(F)CSc1cncc(c1)Br 62a_100000728054_100011997219 [0,1,0,0,0,1|2,0,0]=4 3012 B13R1.838 CC(C)(F)CSc1cncc(c1)Br 62a_100011997219_100000728054 [0,1,0,0,0,1|2,0,0]=4 3013 B13R1.838 CC(C)(F)CSc1cncc(c1)Cl 62a_100000049639_100011997219 [0,1,0,0,0,1|2,0,0]=4 3014 B13R1.838 CC(C)(F)CSc1cncc(c1)Cl 62a_100011997219_100000049639 [0,1,0,0,0,1|2,0,0]=4 3015 B13R1.838 CC(C)(F)CSc1cncc(c1)F 62a_100000744099_100011997219 [0,1,0,0,0,1|2,0,0]=4 3016 B13R1.838 CC(C)(F)CSc1cncc(c1)F 62a_100011997219_100000744099 [0,1,0,0,0,1|2,0,0]=4 3017 B13R1.838 CC(C)(F)CSc1cncc(c1)N 62a_100000687067_100011997219 [0,1,0,0,0,1|2,0,0]=4 3018 B13R1.838 CC(C)(F)CSc1cncc(c1)N 62a_100011997219_100000687067 [0,1,0,0,0,1|2,0,0]=4 3019 B13R1.838 CC(C)(F)CSc1cncc(c1)O 62a_100000754920_100011997219 [0,1,0,0,0,1|2,0,0]=4 3020 B13R1.838 CC(C)(F)CSc1cncc(c1)O 62a_100011997219_100000754920 [0,1,0,0,0,1|2,0,0]=4 3021 B13R1.838 CC(C)(O)C=Cc1cc(ccn1)Cl 271570a_200016258132_100010167805 [0,1,0,0,0,1|1,0,1]=4 3022 B13R1.838 CC(C)(O)C=Cc1cc(ccn1)F 271570a_200016258132_100009817058 [0,1,0,0,0,1|1,0,1]=4 3023 B13R1.838 CC(C)(O)C=Cc1cc(ccn1)N 271570a_200016258132_100009814236 [0,1,0,0,0,1|1,0,1]=4 3024 B13R1.838 CC(C)(O)C=Cc1cc(ccn1)O 271570a_200016258132_100000762945 [0,1,0,0,0,1|1,0,1]=4 3025 B13R1.838 CC(C)(O)C=Cc1cc[nH]c(=O)c1 271570a_200016258132_100009816521 [0,1,0,0,0,1|1,0,1]=4 3026 B13R1.838 CC(C)(O)C=Cc1ccc[n+](c1)[O-] 271570a_200016258132_100009815978 [0,1,0,0,0,1|1,0,1]=4 3027 B13R1.838 CC(C)(O)C=Cc1cccc(=O)[nH]1 271570a_200016258132_100000761760 [0,1,0,0,0,1|1,0,1]=4 3028 B13R1.838 CC(C)(O)C=Cc1cccc(c1)Br 271570a_200016258132_100000691529 [0,1,0,0,0,1|0,0,1]=3 3029 B13R1.838 CC(C)(O)C=Cc1cccc(c1)Cl 271570a_200016258132_100000699651 [0,1,0,0,0,1|0,0,1]=3 3030 B13R1.838 CC(C)(O)C=Cc1cccc(c1)F 271570a_200016258132_100000685547 [0,1,0,0,0,1|0,0,1]=3 3031 B13R1.838 CC(C)(O)C=Cc1cccc(c1)N 271570a_200016258132_100000210019 [0,1,0,0,0,1|0,0,1]=3 3032 B13R1.838 CC(C)(O)C=Cc1cccc(c1)O 271570a_200016258132_100000211634 [0,1,0,0,0,1|0,0,1]=3 3033 B13R1.838 CC(C)(O)C=Cc1cccc(c1)[S] 271570a_200016258132_114929384022 [0,1,0,0,0,1|0,0,1]=3 3034 B13R1.838 CC(C)(O)C=Cc1cccc(n1)Br 271570a_200016258132_100000684672 [0,1,0,0,0,1|1,0,1]=4 3035 B13R1.838 CC(C)(O)C=Cc1cccc(n1)F 271570a_200016258132_100009815982 [0,1,0,0,0,1|1,0,1]=4 3036 B13R1.838 CC(C)(O)C=Cc1cccc(n1)N 271570a_200016258132_100000740741 [0,1,0,0,0,1|1,0,1]=4 3037 B13R1.838 CC(C)(O)C=Cc1ccnc(c1)Br 271570a_200016258132_100009814637 [0,1,0,0,0,1|1,0,1]=4 3038 B13R1.838 CC(C)(O)C=Cc1ccnc(c1)Cl 271570a_200016258132_100000035001 [0,1,0,0,0,1|1,0,1]=4 3039 B13R1.838 CC(C)(O)C=Cc1ccnc(c1)F 271570a_200016258132_100009816116 [0,1,0,0,0,1|1,0,1]=4 3040 B13R1.838 CC(C)(O)C=Cc1ccnc(c1)N 271570a_200016258132_100000744379 [0,1,0,0,0,1|1,0,1]=4 3041 B13R1.838 CC(C)(O)C=Cc1cncc(c1)Br 271570a_200016258132_100000728054 [0,1,0,0,0,1|1,0,1]=4 3042 B13R1.838 CC(C)(O)C=Cc1cncc(c1)Cl 271570a_200016258132_100000049639 [0,1,0,0,0,1|1,0,1]=4 3043 B13R1.838 CC(C)(O)C=Cc1cncc(c1)F 271570a_200016258132_100000744099 [0,1,0,0,0,1|1,0,1]=4 3044 B13R1.838 CC(C)(O)C=Cc1cncc(c1)N 271570a_200016258132_100000687067 [0,1,0,0,0,1|1,0,1]=4 3045 B13R1.838 CC(C)(O)C=Cc1cncc(c1)O 271570a_200016258132_100000754920 [0,1,0,0,0,1|1,0,1]=4 3046 B13R1.838 CC(C)(O)CNc1c[n+](ccn1)[O-] 27a_100000751335_100009880115 [0,1,0,0,0,1|2,0,0]=4 3047 B13R1.838 CC(C)(O)CNc1cc(ccn1)F 27a_100000751335_100000764206 [0,1,0,0,0,1|1,0,0]=3 3048 B13R1.838 CC(C)(O)CNc1cc(ncn1)F 27a_100000751335_200009880791 [0,1,0,0,0,1|2,0,0]=4 3049 B13R1.838 CC(C)(O)CNc1cc(ncn1)N 27a_100000751335_100000701291 [0,1,0,0,0,1|2,0,0]=4 3050 B13R1.838 CC(C)(O)CNc1cc(ncn1)O 27a_100000751335_100000765262 [0,1,0,0,0,1|2,0,0]=4 3051 B13R1.838 CC(C)(O)CNc1cc[nH]c(=O)c1 27a_100000751335_100000061649 [0,1,0,0,0,1|1,0,0]=3 3052 B13R1.838 CC(C)(O)CNc1cc[nH]c(=O)n1 27a_100000751335_200000134032 [0,1,0,0,0,1|2,0,0]=4 3053 B13R1.838 CC(C)(O)CNc1cccc(c1)Br 34a_100000210019_100000764493 [0,1,0,0,0,1|0,0,0]=2 3054 B13R1.838 CC(C)(O)CNc1cccc(c1)Cl 34a_100000185859_100000764493 [0,1,0,0,0,1|0,0,0]=2 3055 B13R1.838 CC(C)(O)CNc1cccc(c1)F 34a_100000210047_100000764493 [0,1,0,0,0,1|0,0,0]=2 3056 B13R1.838 CC(C)(O)CNc1cccc(c1)I 34a_100000211102_100000764493 [0,1,0,0,0,1|0,0,0]=2 3057 B13R1.838 CC(C)(O)CNc1cccc(c1)O 34a_100000210217_100000764493 [0,1,0,0,0,1|0,0,0]=2 3058 B13R1.838 CC(C)(O)CNc1cccc(n1)F 27a_100000751335_100009815982 [0,1,0,0,0,1|1,0,0]=3 3059 B13R1.838 CC(C)(O)CNc1ccnc(c1)F 27a_100000751335_100009816116 [0,1,0,0,0,1|1,0,0]=3 3060 B13R1.838 CC(C)(O)CNc1ccnc(n1)N 27a_100000751335_100000055538 [0,1,0,0,0,1|2,0,0]=4 3061 B13R1.838 CC(C)(O)CNc1cncc(n1)Cl 27a_100000751335_100010892449 [0,1,0,0,0,1|2,0,0]=4 3062 B13R1.838 CC(C)(O)CNc1cncc(n1)F 27a_100000751335_200009863489 [0,1,0,0,0,1|2,0,0]=4 3063 B13R1.838 CC(C)(O)CNc1nccc(n1)N 27a_100000751335_100000757536 [0,1,0,0,0,1|2,0,0]=4 3064 B13R1.838 CC(C)(O)CNc1nccc(n1)O 27a_100000751335_100011649813 [0,1,0,0,0,1|2,0,0]=4 3065 B13R1.838 CC(C)(O)COc1cc[nH]c(=O)c1 34a_100000032262_100000764493 [0,1,0,0,0,1|1,0,0]=3 3066 B13R1.838 CC(C)(O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000764493 [0,1,0,0,0,1|1,0,0]=3 3067 B13R1.838 CC(C)(O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000764493 [0,1,0,0,0,1|1,0,0]=3 3068 B13R1.838 CC(C)(O)COc1cccc(=O)[nH]1 34a_100000033347_100000764493 [0,1,0,0,0,1|1,0,0]=3 3069 B13R1.838 CC(C)(O)COc1cccc(c1)Br 34a_100000210342_100000764493 [0,1,0,0,0,1|0,0,0]=2 3070 B13R1.838 CC(C)(O)COc1cccc(c1)Br 7a_100000210342_100000764493 [0,1,0,0,0,1|0,0,0]=2 3071 B13R1.838 CC(C)(O)COc1cccc(c1)Cl 34a_100000210295_100000764493 [0,1,0,0,0,1|0,0,0]=2 3072 B13R1.838 CC(C)(O)COc1cccc(c1)Cl 7a_100000210295_100000764493 [0,1,0,0,0,1|0,0,0]=2 3073 B13R1.838 CC(C)(O)COc1cccc(c1)F 34a_100000210426_100000764493 [0,1,0,0,0,1|0,0,0]=2 3074 B13R1.838 CC(C)(O)COc1cccc(c1)F 7a_100000210426_100000764493 [0,1,0,0,0,1|0,0,0]=2 3075 B13R1.838 CC(C)(O)COc1cccc(c1)I 34a_100000211634_100000764493 [0,1,0,0,0,1|0,0,0]=2 3076 B13R1.838 CC(C)(O)COc1cccc(c1)I 7a_100000211634_100000764493 [0,1,0,0,0,1|0,0,0]=2 3077 B13R1.838 CC(C)(O)COc1cccc(c1)N 34a_100000210217_100000764493 [0,1,0,0,0,1|0,0,0]=2 3078 B13R1.838 CC(C)(O)COc1cccc(n1)F 34a_100011432558_100000764493 [0,1,0,0,0,1|1,0,0]=3 3079 B13R1.838 CC(C)(O)COc1ccnc(c1)Cl 34a_100000762945_100000764493 [0,1,0,0,0,1|1,0,0]=3 3080 B13R1.838 CC(C)(O)COc1ccnc(c1)F 34a_100000732698_100000764493 [0,1,0,0,0,1|1,0,0]=3 3081 B13R1.838 CC(C)(O)COc1ccnc(c1)N 34a_100011834064_100000764493 [0,1,0,0,0,1|1,0,0]=3 3082 B13R1.838 CC(C)(O)COc1cncc(c1)Br 34a_100000754920_100000764493 [0,1,0,0,0,1|1,0,0]=3 3083 B13R1.838 CC(C)(O)COc1cncc(c1)Br 7a_100000754920_100000764493 [0,1,0,0,0,1|1,0,0]=3 3084 B13R1.838 CC(C)(O)COc1cncc(c1)Cl 7a_100000032511_100000764493 [0,1,0,0,0,1|1,0,0]=3 3085 B13R1.838 CC(C)(O)COc1cncc(c1)F 34a_100011830296_100000764493 [0,1,0,0,0,1|1,0,0]=3 3086 B13R1.838 CC(C)(O)COc1cncc(c1)F 7a_100011830296_100000764493 [0,1,0,0,0,1|1,0,0]=3 3087 B13R1.838 CC(C)(O)COc1cncc(c1)N 34a_100011997051_100000764493 [0,1,0,0,0,1|1,0,0]=3 3088 B13R1.838 CC(C)(O)COc1cnnc(c1)Cl 34a_200010734679_100000764493 [0,1,0,0,0,1|2,0,0]=4 3089 B13R1.838 CC(C)(O)COc1cnnc(c1)N 34a_200015193112_100000764493 [0,1,0,0,0,1|2,0,0]=4 3090 B13R1.838 CC(C)(O)CSc1c[n+](ccn1)[O-] 62a_100000764493_100009880115 [0,1,0,0,0,1|2,0,0]=4 3091 B13R1.838 CC(C)(O)CSc1cc(=O)[nH]cn1 62a_100012002517_100000764493 [0,1,0,0,0,1|2,0,0]=4 3092 B13R1.838 CC(C)(O)CSc1cc(=O)cc[nH]1 62a_100009817434_100000764493 [0,1,0,0,0,1|1,0,0]=3 3093 B13R1.838 CC(C)(O)CSc1cc(ccn1)Cl 62a_100000764493_100010167805 [0,1,0,0,0,1|1,0,0]=3 3094 B13R1.838 CC(C)(O)CSc1cc(ccn1)Cl 62a_100010167805_100000764493 [0,1,0,0,0,1|1,0,0]=3 3095 B13R1.838 CC(C)(O)CSc1cc(ccn1)F 62a_100000764206_100000764493 [0,1,0,0,0,1|1,0,0]=3 3096 B13R1.838 CC(C)(O)CSc1cc(ccn1)F 62a_100000764493_100000764206 [0,1,0,0,0,1|1,0,0]=3 3097 B13R1.838 CC(C)(O)CSc1cc(ccn1)N 62a_100000764493_100009814236 [0,1,0,0,0,1|1,0,0]=3 3098 B13R1.838 CC(C)(O)CSc1cc(ccn1)N 62a_100009814236_100000764493 [0,1,0,0,0,1|1,0,0]=3 3099 B13R1.838 CC(C)(O)CSc1cc(ccn1)O 62a_100000764493_100000762945 [0,1,0,0,0,1|1,0,0]=3 3100 B13R1.838 CC(C)(O)CSc1cc(cnn1)N 62a_100000764493_100011996757 [0,1,0,0,0,1|2,0,0]=4 3101 B13R1.838 CC(C)(O)CSc1cc(cnn1)N 62a_100011996757_100000764493 [0,1,0,0,0,1|2,0,0]=4 3102 B13R1.838 CC(C)(O)CSc1cc(cnn1)O 62a_100000764493_200010734679 [0,1,0,0,0,1|2,0,0]=4 3103 B13R1.838 CC(C)(O)CSc1cc(ncn1)Cl 62a_100000764493_100010161198 [0,1,0,0,0,1|2,0,0]=4 3104 B13R1.838 CC(C)(O)CSc1cc(ncn1)Cl 62a_100010161198_100000764493 [0,1,0,0,0,1|2,0,0]=4 3105 B13R1.838 CC(C)(O)CSc1cc(ncn1)F 62a_100000764493_200009880791 [0,1,0,0,0,1|2,0,0]=4 3106 B13R1.838 CC(C)(O)CSc1cc(ncn1)F 62a_200009880791_100000764493 [0,1,0,0,0,1|2,0,0]=4 3107 B13R1.838 CC(C)(O)CSc1cc(ncn1)N 62a_100000701291_100000764493 [0,1,0,0,0,1|2,0,0]=4 3108 B13R1.838 CC(C)(O)CSc1cc(ncn1)N 62a_100000764493_100000701291 [0,1,0,0,0,1|2,0,0]=4 3109 B13R1.838 CC(C)(O)CSc1cc(ncn1)O 62a_100000764493_100000765262 [0,1,0,0,0,1|2,0,0]=4 3110 B13R1.838 CC(C)(O)CSc1cc[nH]c(=O)c1 62a_100000764493_100009816521 [0,1,0,0,0,1|1,0,0]=3 3111 B13R1.838 CC(C)(O)CSc1cc[nH]c(=O)c1 62a_100009816521_100000764493 [0,1,0,0,0,1|1,0,0]=3 3112 B13R1.838 CC(C)(O)CSc1cc[nH]c(=O)n1 62a_100000764493_200000134032 [0,1,0,0,0,1|2,0,0]=4 3113 B13R1.838 CC(C)(O)CSc1ccc[n+](c1)[O-] 62a_100000764493_100009815978 [0,1,0,0,0,1|1,0,0]=3 3114 B13R1.838 CC(C)(O)CSc1cccc(=O)[nH]1 62a_100000764493_100000752884 [0,1,0,0,0,1|1,0,0]=3 3115 B13R1.838 CC(C)(O)CSc1cccc(c1)Br 62a_100000691529_100000764493 [0,1,0,0,0,1|0,0,0]=2 3116 B13R1.838 CC(C)(O)CSc1cccc(c1)Br 62a_100000764493_100000691529 [0,1,0,0,0,1|0,0,0]=2 3117 B13R1.838 CC(C)(O)CSc1cccc(c1)Cl 62a_100000699651_100000764493 [0,1,0,0,0,1|0,0,0]=2 3118 B13R1.838 CC(C)(O)CSc1cccc(c1)Cl 62a_100000764493_100000699651 [0,1,0,0,0,1|0,0,0]=2 3119 B13R1.838 CC(C)(O)CSc1cccc(c1)F 62a_100000685547_100000764493 [0,1,0,0,0,1|0,0,0]=2 3120 B13R1.838 CC(C)(O)CSc1cccc(c1)F 62a_100000764493_100000685547 [0,1,0,0,0,1|0,0,0]=2 3121 B13R1.838 CC(C)(O)CSc1cccc(c1)N 62a_100000210019_100000764493 [0,1,0,0,0,1|0,0,0]=2 3122 B13R1.838 CC(C)(O)CSc1cccc(c1)N 62a_100000764493_100000210019 [0,1,0,0,0,1|0,0,0]=2 3123 B13R1.838 CC(C)(O)CSc1cccc(c1)O 62a_100000764493_100000211634 [0,1,0,0,0,1|0,0,0]=2 3124 B13R1.838 CC(C)(O)CSc1cccc(c1)[S] 62a_100000764493_114929384022 [0,1,0,0,0,1|0,0,0]=2 3125 B13R1.838 CC(C)(O)CSc1cccc(c1)[S] 62a_114929384022_100000764493 [0,1,0,0,0,1|0,0,0]=2 3126 B13R1.838 CC(C)(O)CSc1cccc(n1)Br 62a_100000684672_100000764493 [0,1,0,0,0,1|1,0,0]=3 3127 B13R1.838 CC(C)(O)CSc1cccc(n1)Br 62a_100000764493_100000684672 [0,1,0,0,0,1|1,0,0]=3 3128 B13R1.838 CC(C)(O)CSc1cccc(n1)Cl 62a_100000051397_100000764493 [0,1,0,0,0,1|1,0,0]=3 3129 B13R1.838 CC(C)(O)CSc1cccc(n1)Cl 62a_100000764493_100000051397 [0,1,0,0,0,1|1,0,0]=3 3130 B13R1.838 CC(C)(O)CSc1cccc(n1)F 62a_100000764493_100009815982 [0,1,0,0,0,1|1,0,0]=3 3131 B13R1.838 CC(C)(O)CSc1cccc(n1)F 62a_100009815982_100000764493 [0,1,0,0,0,1|1,0,0]=3 3132 B13R1.838 CC(C)(O)CSc1cccc(n1)N 62a_100000740741_100000764493 [0,1,0,0,0,1|1,0,0]=3 3133 B13R1.838 CC(C)(O)CSc1cccc(n1)N 62a_100000764493_100000740741 [0,1,0,0,0,1|1,0,0]=3 3134 B13R1.838 CC(C)(O)CSc1ccnc(c1)Br 62a_100000764493_100009814637 [0,1,0,0,0,1|1,0,0]=3 3135 B13R1.838 CC(C)(O)CSc1ccnc(c1)Br 62a_100009814637_100000764493 [0,1,0,0,0,1|1,0,0]=3 3136 B13R1.838 CC(C)(O)CSc1ccnc(c1)Cl 62a_100000035001_100000764493 [0,1,0,0,0,1|1,0,0]=3 3137 B13R1.838 CC(C)(O)CSc1ccnc(c1)Cl 62a_100000764493_100000035001 [0,1,0,0,0,1|1,0,0]=3 3138 B13R1.838 CC(C)(O)CSc1ccnc(c1)F 62a_100000764493_100009816116 [0,1,0,0,0,1|1,0,0]=3 3139 B13R1.838 CC(C)(O)CSc1ccnc(c1)F 62a_100009816116_100000764493 [0,1,0,0,0,1|1,0,0]=3 3140 B13R1.838 CC(C)(O)CSc1ccnc(c1)N 62a_100000049665_100000764493 [0,1,0,0,0,1|1,0,0]=3 3141 B13R1.838 CC(C)(O)CSc1ccnc(c1)N 62a_100000764493_100000049665 [0,1,0,0,0,1|1,0,0]=3 3142 B13R1.838 CC(C)(O)CSc1ccnc(n1)Cl 62a_100000764493_100010154678 [0,1,0,0,0,1|2,0,0]=4 3143 B13R1.838 CC(C)(O)CSc1ccnc(n1)Cl 62a_100010154678_100000764493 [0,1,0,0,0,1|2,0,0]=4 3144 B13R1.838 CC(C)(O)CSc1ccnc(n1)N 62a_100000055538_100000764493 [0,1,0,0,0,1|2,0,0]=4 3145 B13R1.838 CC(C)(O)CSc1ccnc(n1)N 62a_100000764493_100000055538 [0,1,0,0,0,1|2,0,0]=4 3146 B13R1.838 CC(C)(O)CSc1cn[nH]c(=O)c1 62a_100000764493_100010197405 [0,1,0,0,0,1|2,0,0]=4 3147 B13R1.838 CC(C)(O)CSc1cncc(c1)Br 62a_100000728054_100000764493 [0,1,0,0,0,1|1,0,0]=3 3148 B13R1.838 CC(C)(O)CSc1cncc(c1)Br 62a_100000764493_100000728054 [0,1,0,0,0,1|1,0,0]=3 3149 B13R1.838 CC(C)(O)CSc1cncc(c1)Cl 62a_100000049639_100000764493 [0,1,0,0,0,1|1,0,0]=3 3150 B13R1.838 CC(C)(O)CSc1cncc(c1)Cl 62a_100000764493_100000049639 [0,1,0,0,0,1|1,0,0]=3 3151 B13R1.838 CC(C)(O)CSc1cncc(c1)F 62a_100000744099_100000764493 [0,1,0,0,0,1|1,0,0]=3 3152 B13R1.838 CC(C)(O)CSc1cncc(c1)F 62a_100000764493_100000744099 [0,1,0,0,0,1|1,0,0]=3 3153 B13R1.838 CC(C)(O)CSc1cncc(c1)N 62a_100000687067_100000764493 [0,1,0,0,0,1|1,0,0]=3 3154 B13R1.838 CC(C)(O)CSc1cncc(c1)N 62a_100000764493_100000687067 [0,1,0,0,0,1|1,0,0]=3 3155 B13R1.838 CC(C)(O)CSc1cncc(c1)O 62a_100000754920_100000764493 [0,1,0,0,0,1|1,0,0]=3 3156 B13R1.838 CC(C)(O)CSc1cncc(c1)O 62a_100000764493_100000754920 [0,1,0,0,0,1|1,0,0]=3 3157 B13R1.838 CC(C)(O)CSc1cncc(n1)Cl 62a_100000764493_100010892449 [0,1,0,0,0,1|2,0,0]=4 3158 B13R1.838 CC(C)(O)CSc1cncc(n1)Cl 62a_100010892449_100000764493 [0,1,0,0,0,1|2,0,0]=4 3159 B13R1.838 CC(C)(O)CSc1cncc(n1)F 62a_100000764493_200009863489 [0,1,0,0,0,1|2,0,0]=4 3160 B13R1.838 CC(C)(O)CSc1cncc(n1)F 62a_200009863489_100000764493 [0,1,0,0,0,1|2,0,0]=4 3161 B13R1.838 CC(C)(O)CSc1cncc(n1)N 62a_100000747728_100000764493 [0,1,0,0,0,1|2,0,0]=4 3162 B13R1.838 CC(C)(O)CSc1cncc(n1)N 62a_100000764493_100000747728 [0,1,0,0,0,1|2,0,0]=4 3163 B13R1.838 CC(C)(O)CSc1cncc(n1)O 62a_100000764493_100011269956 [0,1,0,0,0,1|2,0,0]=4 3164 B13R1.838 CC(C)(O)CSc1cnnc(c1)N 62a_100000130277_100000764493 [0,1,0,0,0,1|2,0,0]=4 3165 B13R1.838 CC(C)(O)CSc1cnnc(c1)N 62a_100000764493_100000130277 [0,1,0,0,0,1|2,0,0]=4 3166 B13R1.838 CC(C)(O)CSc1nccc(n1)N 62a_100000757536_100000764493 [0,1,0,0,0,1|2,0,0]=4 3167 B13R1.838 CC(C)(O)CSc1nccc(n1)N 62a_100000764493_100000757536 [0,1,0,0,0,1|2,0,0]=4 3168 B13R1.838 CC(C)(O)CSc1nccc(n1)O 62a_100000764493_100011649813 [0,1,0,0,0,1|2,0,0]=4 3169 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Br 62a_100000691529_200000036245 [0,1,0,0,0,1|2,0,0]=4 3170 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Br 62a_200000036245_100000691529 [0,1,0,0,0,1|2,0,0]=4 3171 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Cl 62a_100000699651_200000036245 [0,1,0,0,0,1|2,0,0]=4 3172 B13R1.838 C[N+](C)(C)CSc1cccc(c1)Cl 62a_200000036245_100000699651 [0,1,0,0,0,1|2,0,0]=4 3173 B13R1.838 C[N+](C)(C)CSc1cccc(c1)F 62a_100000685547_200000036245 [0,1,0,0,0,1|2,0,0]=4 3174 B13R1.838 C[N+](C)(C)CSc1cccc(c1)F 62a_200000036245_100000685547 [0,1,0,0,0,1|2,0,0]=4 3175 B13R1.838 C[N+](C)(C)CSc1cccc(c1)N 62a_100000210019_200000036245 [0,1,0,0,0,1|2,0,0]=4 3176 B13R1.838 C[N+](C)(C)CSc1cccc(c1)N 62a_200000036245_100000210019 [0,1,0,0,0,1|2,0,0]=4 3177 B13R1.838 C[N+](C)(C)CSc1cccc(c1)O 62a_200000036245_100000211634 [0,1,0,0,0,1|2,0,0]=4 3178 B13R1.838 C[N+](C)(C)CSc1cccc(c1)[S] 62a_114929384022_200000036245 [0,1,0,0,0,1|2,0,0]=4 3179 B13R1.838 C[N+](C)(C)CSc1cccc(c1)[S] 62a_200000036245_114929384022 [0,1,0,0,0,1|2,0,0]=4 3180 B13R1.838 C[Si](C)(C)COc1cccc(c1)Br 7a_100000210342_100000233785 [0,1,0,0,0,1|1,1,0]=4 3181 B13R1.838 C[Si](C)(C)COc1cccc(c1)Cl 7a_100000210295_100000233785 [0,1,0,0,0,1|1,1,0]=4 3182 B13R1.838 C[Si](C)(C)COc1cccc(c1)F 7a_100000210426_100000233785 [0,1,0,0,0,1|1,1,0]=4 3183 B13R1.838 C[Si](C)(C)COc1cccc(c1)I 7a_100000211634_100000233785 [0,1,0,0,0,1|1,1,0]=4 3184 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Br 62a_100000037933_100000691529 [0,1,0,0,0,1|1,1,0]=4 3185 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Br 62a_100000691529_100000037933 [0,1,0,0,0,1|1,1,0]=4 3186 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Cl 62a_100000037933_100000699651 [0,1,0,0,0,1|1,1,0]=4 3187 B13R1.838 C[Si](C)(C)CSc1cccc(c1)Cl 62a_100000699651_100000037933 [0,1,0,0,0,1|1,1,0]=4 3188 B13R1.838 C[Si](C)(C)CSc1cccc(c1)F 62a_100000037933_100000685547 [0,1,0,0,0,1|1,1,0]=4 3189 B13R1.838 C[Si](C)(C)CSc1cccc(c1)F 62a_100000685547_100000037933 [0,1,0,0,0,1|1,1,0]=4 3190 B13R1.838 C[Si](C)(C)CSc1cccc(c1)N 62a_100000037933_100000210019 [0,1,0,0,0,1|1,1,0]=4 3191 B13R1.838 C[Si](C)(C)CSc1cccc(c1)N 62a_100000210019_100000037933 [0,1,0,0,0,1|1,1,0]=4 3192 B13R1.838 C[Si](C)(C)CSc1cccc(c1)O 62a_100000037933_100000211634 [0,1,0,0,0,1|1,1,0]=4 3193 B13R1.838 C[Si](C)(C)CSc1cccc(c1)[S] 62a_100000037933_114929384022 [0,1,0,0,0,1|1,1,0]=4 3194 B13R1.838 C[Si](C)(C)CSc1cccc(c1)[S] 62a_114929384022_100000037933 [0,1,0,0,0,1|1,1,0]=4 3195 B13R1.838 C[n+]1cccc(c1)C=CC(C)(C)O 271570a_200016258132_100009996589 [0,1,0,0,0,1|1,0,1]=4 3196 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)C 62a_100009996589_100011219605 [0,1,0,0,0,1|2,0,0]=4 3197 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)C 62a_100011219605_100009996589 [0,1,0,0,0,1|2,0,0]=4 3198 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)F 62a_100009996589_100011997219 [0,1,0,0,0,1|2,0,0]=4 3199 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)F 62a_100011997219_100009996589 [0,1,0,0,0,1|2,0,0]=4 3200 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)O 62a_100000764493_100009996589 [0,1,0,0,0,1|1,0,0]=3 3201 B13R1.838 C[n+]1cccc(c1)SCC(C)(C)O 62a_100009996589_100000764493 [0,1,0,0,0,1|1,0,0]=3 3202 B13R1.838 Cc1cc(ccn1)C=CC(C)(C)O 271570a_200016258132_100000758586 [0,1,0,0,0,1|1,0,1]=4 3203 B13R1.838 Cc1cc(ccn1)CNC(C)(C)C 207a_100000715429_100011361630 [0,1,0,0,0,1|2,0,0]=4 3204 B13R1.838 Cc1cc(ccn1)CNC(C)(C)C 2230a_100000715429_200020672517 [0,1,0,0,0,1|2,0,0]=4 3205 B13R1.838 Cc1cc(ccn1)CNC(C)(C)C 34a_100011934566_100000210625 [0,1,0,0,0,1|2,0,0]=4 3206 B13R1.838 Cc1cc(ccn1)COC(C)(C)C 34a_100011998630_100000210625 [0,1,0,0,0,1|2,0,0]=4 3207 B13R1.838 Cc1cc(ccn1)COC(C)(C)C 34a_100015890283_200020672517 [0,1,0,0,0,1|2,0,0]=4 3208 B13R1.838 Cc1cc(ccn1)COC(C)(C)C 7a_100015890283_200020672517 [0,1,0,0,0,1|2,0,0]=4 3209 B13R1.838 Cc1cc(ccn1)CSC(C)(C)C 62a_100000211941_200020672517 [0,1,0,0,0,1|2,0,0]=4 3210 B13R1.838 Cc1cc(ccn1)CSC(C)(C)C 62a_200020672517_100000211941 [0,1,0,0,0,1|2,0,0]=4 3211 B13R1.838 Cc1cc(ccn1)NCC(C)(C)C 27a_100000743828_100000758586 [0,1,0,0,0,1|2,0,0]=4 3212 B13R1.838 Cc1cc(ccn1)NCC(C)(C)F 27a_100020643315_100000758586 [0,1,0,0,0,1|2,0,0]=4 3213 B13R1.838 Cc1cc(ccn1)NCC(C)(C)O 27a_100000751335_100000758586 [0,1,0,0,0,1|1,0,0]=3 3214 B13R1.838 Cc1cc(ccn1)OCC(C)(C)C 34a_100000688365_100011219605 [0,1,0,0,0,1|2,0,0]=4 3215 B13R1.838 Cc1cc(ccn1)OCC(C)(C)F 34a_100000688365_100011997219 [0,1,0,0,0,1|2,0,0]=4 3216 B13R1.838 Cc1cc(ccn1)OCC(C)(C)O 34a_100000688365_100000764493 [0,1,0,0,0,1|1,0,0]=3 3217 B13R1.838 Cc1cc(ccn1)SCC(C)(C)C 62a_100000758586_100011219605 [0,1,0,0,0,1|2,0,0]=4 3218 B13R1.838 Cc1cc(ccn1)SCC(C)(C)C 62a_100011219605_100000758586 [0,1,0,0,0,1|2,0,0]=4 3219 B13R1.838 Cc1cc(ccn1)SCC(C)(C)F 62a_100000758586_100011997219 [0,1,0,0,0,1|2,0,0]=4 3220 B13R1.838 Cc1cc(ccn1)SCC(C)(C)F 62a_100011997219_100000758586 [0,1,0,0,0,1|2,0,0]=4 3221 B13R1.838 Cc1cc(ccn1)SCC(C)(C)O 62a_100000758586_100000764493 [0,1,0,0,0,1|1,0,0]=3 3222 B13R1.838 Cc1cc(ccn1)SCC(C)(C)O 62a_100000764493_100000758586 [0,1,0,0,0,1|1,0,0]=3 3223 B13R1.838 Cc1cc(ncn1)NCC(C)(C)O 27a_100000751335_100000744208 [0,1,0,0,0,1|2,0,0]=4 3224 B13R1.838 Cc1cc(ncn1)SCC(C)(C)O 62a_100000744208_100000764493 [0,1,0,0,0,1|2,0,0]=4 3225 B13R1.838 Cc1cc(ncn1)SCC(C)(C)O 62a_100000764493_100000744208 [0,1,0,0,0,1|2,0,0]=4 3226 B13R1.838 Cc1cccc(c1)C=CC(C)(C)C 271570a_100102527731_100011215228 [0,1,0,0,0,1|1,0,1]=4 3227 B13R1.838 Cc1cccc(c1)C=CC(C)(C)O 271570a_200016258132_100011215228 [0,1,0,0,0,1|0,0,1]=3 3228 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 207a_100000715429_100000211157 [0,1,0,0,0,1|1,0,0]=3 3229 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 2230a_100000715429_100000211840 [0,1,0,0,0,1|1,0,0]=3 3230 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 34a_100000185548_100000210625 [0,1,0,0,0,1|1,0,0]=3 3231 B13R1.838 Cc1cccc(c1)COC(C)(C)C 34a_100011217746_100000210625 [0,1,0,0,0,1|1,0,0]=3 3232 B13R1.838 Cc1cccc(c1)COC(C)(C)C 34a_100015890283_100000211840 [0,1,0,0,0,1|1,0,0]=3 3233 B13R1.838 Cc1cccc(c1)COC(C)(C)C 7a_100015890283_100000211840 [0,1,0,0,0,1|1,0,0]=3 3234 B13R1.838 Cc1cccc(c1)CSC(C)(C)C 62a_100000211840_100000211941 [0,1,0,0,0,1|1,0,0]=3 3235 B13R1.838 Cc1cccc(c1)CSC(C)(C)C 62a_100000211941_100000211840 [0,1,0,0,0,1|1,0,0]=3 3236 B13R1.838 Cc1cccc(c1)NCC(C)(C)C 34a_100000188690_100011219605 [0,1,0,0,0,1|1,0,0]=3 3237 B13R1.838 Cc1cccc(c1)NCC(C)(C)F 34a_100000188690_100011997219 [0,1,0,0,0,1|1,0,0]=3 3238 B13R1.838 Cc1cccc(c1)NCC(C)(C)O 34a_100000188690_100000764493 [0,1,0,0,0,1|0,0,0]=2 3239 B13R1.838 Cc1cccc(c1)NC[Si](C)(C)C 2230a_100000188690_100000037933 [0,1,0,0,0,1|1,1,0]=4 3240 B13R1.838 Cc1cccc(c1)OCC(C)(C)C 34a_100000210337_100011219605 [0,1,0,0,0,1|1,0,0]=3 3241 B13R1.838 Cc1cccc(c1)OCC(C)(C)F 34a_100000210337_100011997219 [0,1,0,0,0,1|1,0,0]=3 3242 B13R1.838 Cc1cccc(c1)OCC(C)(C)O 34a_100000210337_100000764493 [0,1,0,0,0,1|0,0,0]=2 3243 B13R1.838 Cc1cccc(c1)OCC(C)(C)O 7a_100000210337_100000764493 [0,1,0,0,0,1|0,0,0]=2 3244 B13R1.838 Cc1cccc(c1)OC[Si](C)(C)C 7a_100000210337_100000233785 [0,1,0,0,0,1|1,1,0]=4 3245 B13R1.838 Cc1cccc(c1)SCC(C)(C)C 62a_100011215228_100011219605 [0,1,0,0,0,1|1,0,0]=3 3246 B13R1.838 Cc1cccc(c1)SCC(C)(C)C 62a_100011219605_100011215228 [0,1,0,0,0,1|1,0,0]=3 3247 B13R1.838 Cc1cccc(c1)SCC(C)(C)F 62a_100011215228_100011997219 [0,1,0,0,0,1|1,0,0]=3 3248 B13R1.838 Cc1cccc(c1)SCC(C)(C)F 62a_100011997219_100011215228 [0,1,0,0,0,1|1,0,0]=3 3249 B13R1.838 Cc1cccc(c1)SCC(C)(C)O 62a_100000764493_100011215228 [0,1,0,0,0,1|0,0,0]=2 3250 B13R1.838 Cc1cccc(c1)SCC(C)(C)O 62a_100011215228_100000764493 [0,1,0,0,0,1|0,0,0]=2 3251 B13R1.838 Cc1cccc(c1)SC[N+](C)(C)C 62a_100011215228_200000036245 [0,1,0,0,0,1|2,0,0]=4 3252 B13R1.838 Cc1cccc(c1)SC[N+](C)(C)C 62a_200000036245_100011215228 [0,1,0,0,0,1|2,0,0]=4 3253 B13R1.838 Cc1cccc(c1)SC[Si](C)(C)C 62a_100000037933_100011215228 [0,1,0,0,0,1|1,1,0]=4 3254 B13R1.838 Cc1cccc(c1)SC[Si](C)(C)C 62a_100011215228_100000037933 [0,1,0,0,0,1|1,1,0]=4 3255 B13R1.838 Cc1cccc(n1)C=CC(C)(C)O 271570a_200016258132_100000742759 [0,1,0,0,0,1|1,0,1]=4 3256 B13R1.838 Cc1cccc(n1)CNC(C)(C)C 207a_100000715429_100011215050 [0,1,0,0,0,1|2,0,0]=4 3257 B13R1.838 Cc1cccc(n1)CNC(C)(C)C 2230a_100000715429_100000757606 [0,1,0,0,0,1|2,0,0]=4 3258 B13R1.838 Cc1cccc(n1)CNC(C)(C)C 34a_100000701342_100000210625 [0,1,0,0,0,1|2,0,0]=4 3259 B13R1.838 Cc1cccc(n1)COC(C)(C)C 34a_100000690600_100000210625 [0,1,0,0,0,1|2,0,0]=4 3260 B13R1.838 Cc1cccc(n1)COC(C)(C)C 34a_100015890283_100000757606 [0,1,0,0,0,1|2,0,0]=4 3261 B13R1.838 Cc1cccc(n1)COC(C)(C)C 7a_100015890283_100000757606 [0,1,0,0,0,1|2,0,0]=4 3262 B13R1.838 Cc1cccc(n1)CSC(C)(C)C 62a_100000211941_100000757606 [0,1,0,0,0,1|2,0,0]=4 3263 B13R1.838 Cc1cccc(n1)CSC(C)(C)C 62a_100000757606_100000211941 [0,1,0,0,0,1|2,0,0]=4 3264 B13R1.838 Cc1cccc(n1)SCC(C)(C)C 62a_100000742759_100011219605 [0,1,0,0,0,1|2,0,0]=4 3265 B13R1.838 Cc1cccc(n1)SCC(C)(C)C 62a_100011219605_100000742759 [0,1,0,0,0,1|2,0,0]=4 3266 B13R1.838 Cc1cccc(n1)SCC(C)(C)F 62a_100000742759_100011997219 [0,1,0,0,0,1|2,0,0]=4 3267 B13R1.838 Cc1cccc(n1)SCC(C)(C)F 62a_100011997219_100000742759 [0,1,0,0,0,1|2,0,0]=4 3268 B13R1.838 Cc1cccc(n1)SCC(C)(C)O 62a_100000742759_100000764493 [0,1,0,0,0,1|1,0,0]=3 3269 B13R1.838 Cc1cccc(n1)SCC(C)(C)O 62a_100000764493_100000742759 [0,1,0,0,0,1|1,0,0]=3 3270 B13R1.838 Cc1ccnc(c1)C=CC(C)(C)O 271570a_200016258132_100000750283 [0,1,0,0,0,1|1,0,1]=4 3271 B13R1.838 Cc1ccnc(c1)CNC(C)(C)C 207a_100000715429_100011361488 [0,1,0,0,0,1|2,0,0]=4 3272 B13R1.838 Cc1ccnc(c1)CNC(C)(C)C 2230a_100000715429_100000718516 [0,1,0,0,0,1|2,0,0]=4 3273 B13R1.838 Cc1ccnc(c1)COC(C)(C)C 34a_100011998357_100000210625 [0,1,0,0,0,1|2,0,0]=4 3274 B13R1.838 Cc1ccnc(c1)COC(C)(C)C 34a_100015890283_100000718516 [0,1,0,0,0,1|2,0,0]=4 3275 B13R1.838 Cc1ccnc(c1)COC(C)(C)C 7a_100015890283_100000718516 [0,1,0,0,0,1|2,0,0]=4 3276 B13R1.838 Cc1ccnc(c1)CSC(C)(C)C 62a_100000211941_100000718516 [0,1,0,0,0,1|2,0,0]=4 3277 B13R1.838 Cc1ccnc(c1)CSC(C)(C)C 62a_100000718516_100000211941 [0,1,0,0,0,1|2,0,0]=4 3278 B13R1.838 Cc1ccnc(c1)SCC(C)(C)C 62a_100000750283_100011219605 [0,1,0,0,0,1|2,0,0]=4 3279 B13R1.838 Cc1ccnc(c1)SCC(C)(C)C 62a_100011219605_100000750283 [0,1,0,0,0,1|2,0,0]=4 3280 B13R1.838 Cc1ccnc(c1)SCC(C)(C)F 62a_100000750283_100011997219 [0,1,0,0,0,1|2,0,0]=4 3281 B13R1.838 Cc1ccnc(c1)SCC(C)(C)F 62a_100011997219_100000750283 [0,1,0,0,0,1|2,0,0]=4 3282 B13R1.838 Cc1ccnc(c1)SCC(C)(C)O 62a_100000750283_100000764493 [0,1,0,0,0,1|1,0,0]=3 3283 B13R1.838 Cc1ccnc(c1)SCC(C)(C)O 62a_100000764493_100000750283 [0,1,0,0,0,1|1,0,0]=3 3284 B13R1.838 Cc1ccnc(n1)NCC(C)(C)O 27a_100000751335_100000750684 [0,1,0,0,0,1|2,0,0]=4 3285 B13R1.838 Cc1ccnc(n1)SCC(C)(C)O 62a_100000764493_100011243806 [0,1,0,0,0,1|2,0,0]=4 3286 B13R1.838 Cc1ccnc(n1)SCC(C)(C)O 62a_100011243806_100000764493 [0,1,0,0,0,1|2,0,0]=4 3287 B13R1.838 Cc1cncc(c1)C=CC(C)(C)O 271570a_200016258132_100000760492 [0,1,0,0,0,1|1,0,1]=4 3288 B13R1.838 Cc1cncc(c1)CNC(C)(C)C 207a_100000715429_100011998712 [0,1,0,0,0,1|2,0,0]=4 3289 B13R1.838 Cc1cncc(c1)CNC(C)(C)C 2230a_100000715429_100000716715 [0,1,0,0,0,1|2,0,0]=4 3290 B13R1.838 Cc1cncc(c1)CNC(C)(C)C 34a_100000692839_100000210625 [0,1,0,0,0,1|2,0,0]=4 3291 B13R1.838 Cc1cncc(c1)COC(C)(C)C 34a_100011998709_100000210625 [0,1,0,0,0,1|2,0,0]=4 3292 B13R1.838 Cc1cncc(c1)COC(C)(C)C 34a_100015890283_100000716715 [0,1,0,0,0,1|2,0,0]=4 3293 B13R1.838 Cc1cncc(c1)COC(C)(C)C 7a_100015890283_100000716715 [0,1,0,0,0,1|2,0,0]=4 3294 B13R1.838 Cc1cncc(c1)CSC(C)(C)C 62a_100000211941_100000716715 [0,1,0,0,0,1|2,0,0]=4 3295 B13R1.838 Cc1cncc(c1)CSC(C)(C)C 62a_100000716715_100000211941 [0,1,0,0,0,1|2,0,0]=4 3296 B13R1.838 Cc1cncc(c1)OCC(C)(C)C 34a_100011830280_100011219605 [0,1,0,0,0,1|2,0,0]=4 3297 B13R1.838 Cc1cncc(c1)OCC(C)(C)F 34a_100011830280_100011997219 [0,1,0,0,0,1|2,0,0]=4 3298 B13R1.838 Cc1cncc(c1)OCC(C)(C)O 34a_100011830280_100000764493 [0,1,0,0,0,1|1,0,0]=3 3299 B13R1.838 Cc1cncc(c1)OCC(C)(C)O 7a_100011830280_100000764493 [0,1,0,0,0,1|1,0,0]=3 3300 B13R1.838 Cc1cncc(c1)SCC(C)(C)C 62a_100000760492_100011219605 [0,1,0,0,0,1|2,0,0]=4 3301 B13R1.838 Cc1cncc(c1)SCC(C)(C)C 62a_100011219605_100000760492 [0,1,0,0,0,1|2,0,0]=4 3302 B13R1.838 Cc1cncc(c1)SCC(C)(C)F 62a_100000760492_100011997219 [0,1,0,0,0,1|2,0,0]=4 3303 B13R1.838 Cc1cncc(c1)SCC(C)(C)F 62a_100011997219_100000760492 [0,1,0,0,0,1|2,0,0]=4 3304 B13R1.838 Cc1cncc(c1)SCC(C)(C)O 62a_100000760492_100000764493 [0,1,0,0,0,1|1,0,0]=3 3305 B13R1.838 Cc1cncc(c1)SCC(C)(C)O 62a_100000764493_100000760492 [0,1,0,0,0,1|1,0,0]=3 3306 B13R1.838 Cc1cncc(n1)NCC(C)(C)O 27a_100000751335_100000754123 [0,1,0,0,0,1|2,0,0]=4 3307 B13R1.838 Cc1cncc(n1)SCC(C)(C)O 62a_100000754123_100000764493 [0,1,0,0,0,1|2,0,0]=4 3308 B13R1.838 Cc1cncc(n1)SCC(C)(C)O 62a_100000764493_100000754123 [0,1,0,0,0,1|2,0,0]=4 3309 B13R1.838 Cc1cnnc(c1)NCC(C)(C)O 27a_100000751335_100000070100 [0,1,0,0,0,1|2,0,0]=4 3310 B13R1.838 Cc1cnnc(c1)OCC(C)(C)O 34a_100000766097_100000764493 [0,1,0,0,0,1|2,0,0]=4 3311 B13R1.838 Cc1cnnc(c1)SCC(C)(C)O 62a_100000070100_100000764493 [0,1,0,0,0,1|2,0,0]=4 3312 B13R1.838 Cc1cnnc(c1)SCC(C)(C)O 62a_100000764493_100000070100 [0,1,0,0,0,1|2,0,0]=4 3313 B13R1.838 Cc1nccc(n1)NCC(C)(C)O 27a_100000751335_100000749937 [0,1,0,0,0,1|2,0,0]=4 3314 B13R1.838 Cc1nccc(n1)SCC(C)(C)O 62a_100000749937_100000764493 [0,1,0,0,0,1|2,0,0]=4 3315 B13R1.838 Cc1nccc(n1)SCC(C)(C)O 62a_100000764493_100000749937 [0,1,0,0,0,1|2,0,0]=4 3316 B13R1.281 CC(C)(C)Oc1cccccc1=O 34a_100000036025_100000210625 [0,1,0,0,0,1|2,0,0]=4 3317 B13R1.4 C#Cc1ccc(cc1)NC(C)(C)C 34a_100011215031_100000210625 [0,2,0,0,0,0|2,0,0]=4 3318 B13R1.4 C=Cc1ccc(cc1)CC(C)(F)F 271570a_100011290941_100010238340 [0,2,0,0,0,0|2,0,0]=4 3319 B13R1.4 C=Cc1ccc(cc1)C[Si](C)(C)C 271570a_100011290941_100009813299 [0,2,0,0,0,0|1,1,0]=4 3320 B13R1.4 C=Cc1ccc(cc1)NC(C)(C)C 34a_100011218248_100000210625 [0,2,0,0,0,0|2,0,0]=4 3321 B13R1.4 C=Cc1ccc(cc1)OC(C)(C)C 271570a_100011290941_100000701926 [0,2,0,0,0,0|2,0,0]=4 3322 B13R1.4 C=Cc1ccc(cc1)OC(C)(C)C 34a_100000189437_100000210625 [0,2,0,0,0,0|2,0,0]=4 3323 B13R1.4 C=Cc1ccc(cc1)SC(C)(C)C 271570a_100011290941_200009816747 [0,2,0,0,0,0|2,0,0]=4 3324 B13R1.4 C=Cc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000748128 [0,2,0,0,0,0|2,0,0]=4 3325 B13R1.4 C=Cc1ccc(cc1)SC(C)(C)C 62a_100000748128_100000211941 [0,2,0,0,0,0|2,0,0]=4 3326 B13R1.4 CC(C)(C)Nc1ccc(cc1)C#N 34a_100000185469_100000210625 [0,2,0,0,0,0|2,0,0]=4 3327 B13R1.4 CC(C)(C)Nc1ccc(cc1)CO 34a_100011215238_100000210625 [0,2,0,0,0,0|2,0,0]=4 3328 B13R1.4 CC(C)(C)Oc1ccc(cc1)C#N 34a_100000210344_100000210625 [0,2,0,0,0,0|2,0,0]=4 3329 B13R1.4 CC(C)(C)Oc1ccc(cc1)CN 34a_100000185549_100000210625 [0,2,0,0,0,0|2,0,0]=4 3330 B13R1.4 CC(C)(C)Oc1ccc(cc1)CO 34a_100000211755_100000210625 [0,2,0,0,0,0|2,0,0]=4 3331 B13R1.4 CC(C)(C)Oc1ccc(cc1)N[13CH3] 2230a_100000760240_200025704644 [0,2,0,0,0,0|2,0,0]=4 3332 B13R1.4 CC(C)(C)Oc1ccc(cc1)N[13CH3] 34a_100000760240_200025704644 [0,2,0,0,0,0|2,0,0]=4 3333 B13R1.4 CC(C)(C)Oc1ccc(cc1)O[13CH3] 34a_100000061920_200025704644 [0,2,0,0,0,0|2,0,0]=4 3334 B13R1.4 CC(C)(C)Oc1ccc(cc1)O[13CH3] 7a_100000061920_200025704644 [0,2,0,0,0,0|2,0,0]=4 3335 B13R1.4 CC(C)(C)Oc1ccc(cc1)S[13CH3] 62a_100000701926_200025704644 [0,2,0,0,0,0|2,0,0]=4 3336 B13R1.4 CC(C)(C)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000701926 [0,2,0,0,0,0|2,0,0]=4 3337 B13R1.4 CC(C)(C)Sc1ccc(cc1)C#N 62a_100000211941_100000184291 [0,2,0,0,0,0|2,0,0]=4 3338 B13R1.4 CC(C)(C)Sc1ccc(cc1)C=O 62a_100000188517_100000211941 [0,2,0,0,0,0|2,0,0]=4 3339 B13R1.4 CC(C)(C)Sc1ccc(cc1)C=O 62a_100000211941_100000188517 [0,2,0,0,0,0|2,0,0]=4 3340 B13R1.4 CC(C)(C)Sc1ccc(cc1)CF 62a_100000211941_100010268989 [0,2,0,0,0,0|2,0,0]=4 3341 B13R1.4 CC(C)(C)Sc1ccc(cc1)CF 62a_100010268989_100000211941 [0,2,0,0,0,0|2,0,0]=4 3342 B13R1.4 CC(C)(C)Sc1ccc(cc1)CN 62a_100000211941_100016989417 [0,2,0,0,0,0|2,0,0]=4 3343 B13R1.4 CC(C)(C)Sc1ccc(cc1)CN 62a_100016989417_100000211941 [0,2,0,0,0,0|2,0,0]=4 3344 B13R1.4 CC(C)(C)Sc1ccc(cc1)CO 62a_100000211941_100000690907 [0,2,0,0,0,0|2,0,0]=4 3345 B13R1.4 CC(C)(C)Sc1ccc(cc1)CO 62a_100000690907_100000211941 [0,2,0,0,0,0|2,0,0]=4 3346 B13R1.4 CC(C)(C)Sc1ccc(cc1)NN 62a_100000211941_100016988836 [0,2,0,0,0,0|2,0,0]=4 3347 B13R1.4 CC(C)(C)Sc1ccc(cc1)NN 62a_100016988836_100000211941 [0,2,0,0,0,0|2,0,0]=4 3348 B13R1.4 CC(C)(C)Sc1ccc(cc1)S[13CH3] 62a_200009816747_200025704644 [0,2,0,0,0,0|2,0,0]=4 3349 B13R1.4 CC(C)(C)Sc1ccc(cc1)S[13CH3] 62a_200025704644_200009816747 [0,2,0,0,0,0|2,0,0]=4 3350 B13R1.4 CC(F)(F)Cc1ccc(cc1)S[13CH3] 62a_100010238340_200025704644 [0,2,0,0,0,0|2,0,0]=4 3351 B13R1.4 CC(F)(F)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100010238340 [0,2,0,0,0,0|2,0,0]=4 3352 B13R1.4 CCc1ccc(cc1)NC(C)(C)C 34a_100000211069_100000210625 [0,2,0,0,0,0|2,0,0]=4 3353 B13R1.4 CCc1ccc(cc1)OC(C)(C)C 34a_100000211359_100000210625 [0,2,0,0,0,0|2,0,0]=4 3354 B13R1.4 CCc1ccc(cc1)SC(C)(C)C 62a_100000211941_100011215824 [0,2,0,0,0,0|2,0,0]=4 3355 B13R1.4 CCc1ccc(cc1)SC(C)(C)C 62a_100011215824_100000211941 [0,2,0,0,0,0|2,0,0]=4 3356 B13R1.4 CNc1ccc(cc1)OC(C)(C)C 2230a_100000760240_200000210301 [0,2,0,0,0,0|2,0,0]=4 3357 B13R1.4 CNc1ccc(cc1)OC(C)(C)C 34a_100000182112_100000210625 [0,2,0,0,0,0|2,0,0]=4 3358 B13R1.4 CNc1ccc(cc1)OC(C)(C)C 34a_100000760240_200000210301 [0,2,0,0,0,0|2,0,0]=4 3359 B13R1.4 CNc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000743151 [0,2,0,0,0,0|2,0,0]=4 3360 B13R1.4 CNc1ccc(cc1)SC(C)(C)C 62a_100000743151_100000211941 [0,2,0,0,0,0|2,0,0]=4 3361 B13R1.4 COc1ccc(cc1)NC(C)(C)C 34a_100000184247_100000210625 [0,2,0,0,0,0|2,0,0]=4 3362 B13R1.4 COc1ccc(cc1)OC(C)(C)C 34a_100000061920_200000210301 [0,2,0,0,0,0|2,0,0]=4 3363 B13R1.4 COc1ccc(cc1)OC(C)(C)C 34a_100000210503_100000210625 [0,2,0,0,0,0|2,0,0]=4 3364 B13R1.4 COc1ccc(cc1)OC(C)(C)C 7a_100000061920_200000210301 [0,2,0,0,0,0|2,0,0]=4 3365 B13R1.4 COc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000171711 [0,2,0,0,0,0|2,0,0]=4 3366 B13R1.4 CSc1ccc(cc1)CC(C)(F)F 62a_100010238340_200000210301 [0,2,0,0,0,0|2,0,0]=4 3367 B13R1.4 CSc1ccc(cc1)CC(C)(F)F 62a_200000210301_100010238340 [0,2,0,0,0,0|2,0,0]=4 3368 B13R1.4 CSc1ccc(cc1)C[Si](C)(C)C 62a_100009813299_200000210301 [0,2,0,0,0,0|1,1,0]=4 3369 B13R1.4 CSc1ccc(cc1)C[Si](C)(C)C 62a_200000210301_100009813299 [0,2,0,0,0,0|1,1,0]=4 3370 B13R1.4 CSc1ccc(cc1)NC(C)(C)C 34a_100000212337_100000210625 [0,2,0,0,0,0|2,0,0]=4 3371 B13R1.4 CSc1ccc(cc1)OC(C)(C)C 34a_100000211864_100000210625 [0,2,0,0,0,0|2,0,0]=4 3372 B13R1.4 CSc1ccc(cc1)OC(C)(C)C 62a_100000701926_200000210301 [0,2,0,0,0,0|2,0,0]=4 3373 B13R1.4 CSc1ccc(cc1)OC(C)(C)C 62a_200000210301_100000701926 [0,2,0,0,0,0|2,0,0]=4 3374 B13R1.4 CSc1ccc(cc1)SC(C)(C)C 62a_100000211941_100011263217 [0,2,0,0,0,0|2,0,0]=4 3375 B13R1.4 CSc1ccc(cc1)SC(C)(C)C 62a_100011263217_100000211941 [0,2,0,0,0,0|2,0,0]=4 3376 B13R1.4 CSc1ccc(cc1)SC(C)(C)C 62a_200000210301_200009816747 [0,2,0,0,0,0|2,0,0]=4 3377 B13R1.4 CSc1ccc(cc1)SC(C)(C)C 62a_200009816747_200000210301 [0,2,0,0,0,0|2,0,0]=4 3378 B13R1.4 C[Si](C)(C)Cc1ccc(cc1)S[13CH3] 62a_100009813299_200025704644 [0,2,0,0,0,0|1,1,0]=4 3379 B13R1.4 C[Si](C)(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100009813299 [0,2,0,0,0,0|1,1,0]=4 3380 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)Br 34a_100000210018_100000038118 [0,2,0,0,0,0|2,0,0]=4 3381 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)C 34a_100000124888_100000038118 [0,2,0,0,0,0|2,0,0]=4 3382 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)Cl 34a_100000210052_100000038118 [0,2,0,0,0,0|2,0,0]=4 3383 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)F 34a_100000185862_100000038118 [0,2,0,0,0,0|2,0,0]=4 3384 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)I 34a_100000185761_100000038118 [0,2,0,0,0,0|2,0,0]=4 3385 B13R1.249 C#CC(C)(C)Nc1ccc(cc1)O 34a_100000185829_100000038118 [0,2,0,0,0,0|2,0,0]=4 3386 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)Br 34a_100000185759_100000038118 [0,2,0,0,0,0|2,0,0]=4 3387 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)C 34a_100000210336_100000038118 [0,2,0,0,0,0|2,0,0]=4 3388 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)Cl 34a_100000210216_100000038118 [0,2,0,0,0,0|2,0,0]=4 3389 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)F 34a_100000210339_100000038118 [0,2,0,0,0,0|2,0,0]=4 3390 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)I 34a_100000212066_100000038118 [0,2,0,0,0,0|2,0,0]=4 3391 B13R1.249 C#CC(C)(C)Oc1ccc(cc1)N 34a_100000185829_100000038118 [0,2,0,0,0,0|2,0,0]=4 3392 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)Br 62a_100000038118_100000752885 [0,2,0,0,0,0|2,0,0]=4 3393 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000038118 [0,2,0,0,0,0|2,0,0]=4 3394 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)C 62a_100000038118_100000186775 [0,2,0,0,0,0|2,0,0]=4 3395 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)C 62a_100000186775_100000038118 [0,2,0,0,0,0|2,0,0]=4 3396 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)Cl 62a_100000038118_100000755918 [0,2,0,0,0,0|2,0,0]=4 3397 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000038118 [0,2,0,0,0,0|2,0,0]=4 3398 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)F 62a_100000038118_100000211213 [0,2,0,0,0,0|2,0,0]=4 3399 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000038118 [0,2,0,0,0,0|2,0,0]=4 3400 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)N 62a_100000038118_100000185761 [0,2,0,0,0,0|2,0,0]=4 3401 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000038118 [0,2,0,0,0,0|2,0,0]=4 3402 B13R1.249 C#CC(C)(C)Sc1ccc(cc1)O 62a_100000038118_100000185759 [0,2,0,0,0,0|2,0,0]=4 3403 B13R1.249 CC(C)(C#N)Nc1ccc(cc1)Br 34a_100000210018_100011162410 [0,2,0,0,0,0|2,0,0]=4 3404 B13R1.249 CC(C)(C#N)Nc1ccc(cc1)Cl 34a_100000210052_100011162410 [0,2,0,0,0,0|2,0,0]=4 3405 B13R1.249 CC(C)(C#N)Nc1ccc(cc1)F 34a_100000185862_100011162410 [0,2,0,0,0,0|2,0,0]=4 3406 B13R1.249 CC(C)(C#N)Nc1ccc(cc1)I 34a_100000185761_100011162410 [0,2,0,0,0,0|2,0,0]=4 3407 B13R1.249 CC(C)(C#N)Nc1ccc(cc1)O 34a_100000185829_100011162410 [0,2,0,0,0,0|2,0,0]=4 3408 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)Br 34a_100000185759_100011162410 [0,2,0,0,0,0|2,0,0]=4 3409 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)Br 7a_100000185759_100011162410 [0,2,0,0,0,0|2,0,0]=4 3410 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)Cl 34a_100000210216_100011162410 [0,2,0,0,0,0|2,0,0]=4 3411 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)Cl 7a_100000210216_100011162410 [0,2,0,0,0,0|2,0,0]=4 3412 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)F 34a_100000210339_100011162410 [0,2,0,0,0,0|2,0,0]=4 3413 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)I 34a_100000212066_100011162410 [0,2,0,0,0,0|2,0,0]=4 3414 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)I 7a_100000212066_100011162410 [0,2,0,0,0,0|2,0,0]=4 3415 B13R1.249 CC(C)(C#N)Oc1ccc(cc1)N 34a_100000185829_100011162410 [0,2,0,0,0,0|2,0,0]=4 3416 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)Br 62a_100000752885_100011162410 [0,2,0,0,0,0|2,0,0]=4 3417 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)Br 62a_100011162410_100000752885 [0,2,0,0,0,0|2,0,0]=4 3418 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)Cl 62a_100000755918_100011162410 [0,2,0,0,0,0|2,0,0]=4 3419 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)Cl 62a_100011162410_100000755918 [0,2,0,0,0,0|2,0,0]=4 3420 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)F 62a_100000211213_100011162410 [0,2,0,0,0,0|2,0,0]=4 3421 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)F 62a_100011162410_100000211213 [0,2,0,0,0,0|2,0,0]=4 3422 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)N 62a_100000185761_100011162410 [0,2,0,0,0,0|2,0,0]=4 3423 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)N 62a_100011162410_100000185761 [0,2,0,0,0,0|2,0,0]=4 3424 B13R1.249 CC(C)(C#N)Sc1ccc(cc1)O 62a_100011162410_100000185759 [0,2,0,0,0,0|2,0,0]=4 3425 B13R1.249 CC(C)(CO)Nc1ccc(cn1)Br 27a_100000210608_100000686858 [0,2,0,0,0,0|2,0,0]=4 3426 B13R1.249 CC(C)(Cc1ccc(cc1)Cl)O[13CH3] 34a_200011350411_200025704644 [0,2,0,0,0,0|0,0,0]=2 3427 B13R1.249 CC(C)(Cc1ccc(cc1)Cl)O[13CH3] 7a_200011350411_200025704644 [0,2,0,0,0,0|0,0,0]=2 3428 B13R1.249 CC(C)(Cc1ccc(cc1)F)N[13CH3] 2230a_100015243227_200025704644 [0,2,0,0,0,0|1,0,0]=3 3429 B13R1.249 CC(C)(Cc1ccc(cc1)F)N[13CH3] 34a_100015243227_200025704644 [0,2,0,0,0,0|1,0,0]=3 3430 B13R1.249 CC(C)(Cc1ccc(cc1)F)O[13CH3] 34a_200011350416_200025704644 [0,2,0,0,0,0|0,0,0]=2 3431 B13R1.249 CC(C)(Cc1ccc(cc1)F)O[13CH3] 7a_200011350416_200025704644 [0,2,0,0,0,0|0,0,0]=2 3432 B13R1.249 CCC(C)(C)Oc1ccc(cc1)Br 7a_100000185759_100000210677 [0,2,0,0,0,0|2,0,0]=4 3433 B13R1.249 CCC(C)(C)Oc1ccc(cc1)C 7a_100000210336_100000210677 [0,2,0,0,0,0|2,0,0]=4 3434 B13R1.249 CCC(C)(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210677 [0,2,0,0,0,0|2,0,0]=4 3435 B13R1.249 CCC(C)(C)Oc1ccc(cc1)I 7a_100000212066_100000210677 [0,2,0,0,0,0|2,0,0]=4 3436 B13R1.249 CCC(C)(C)Sc1ccc(cc1)Br 62a_100000032637_100000752885 [0,2,0,0,0,0|2,0,0]=4 3437 B13R1.249 CCC(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000032637 [0,2,0,0,0,0|2,0,0]=4 3438 B13R1.249 CCC(C)(C)Sc1ccc(cc1)C 62a_100000032637_100000186775 [0,2,0,0,0,0|2,0,0]=4 3439 B13R1.249 CCC(C)(C)Sc1ccc(cc1)C 62a_100000186775_100000032637 [0,2,0,0,0,0|2,0,0]=4 3440 B13R1.249 CCC(C)(C)Sc1ccc(cc1)Cl 62a_100000032637_100000755918 [0,2,0,0,0,0|2,0,0]=4 3441 B13R1.249 CCC(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000032637 [0,2,0,0,0,0|2,0,0]=4 3442 B13R1.249 CCC(C)(C)Sc1ccc(cc1)F 62a_100000032637_100000211213 [0,2,0,0,0,0|2,0,0]=4 3443 B13R1.249 CCC(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000032637 [0,2,0,0,0,0|2,0,0]=4 3444 B13R1.249 CCC(C)(C)Sc1ccc(cc1)N 62a_100000032637_100000185761 [0,2,0,0,0,0|2,0,0]=4 3445 B13R1.249 CCC(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000032637 [0,2,0,0,0,0|2,0,0]=4 3446 B13R1.249 CCC(C)(C)Sc1ccc(cc1)O 62a_100000032637_100000185759 [0,2,0,0,0,0|2,0,0]=4 3447 B13R1.249 CNC(C)(C)Cc1ccc(cc1)F 2230a_100015243227_200000210301 [0,2,0,0,0,0|1,0,0]=3 3448 B13R1.249 CNC(C)(C)Cc1ccc(cc1)F 34a_100015243227_200000210301 [0,2,0,0,0,0|1,0,0]=3 3449 B13R1.249 COC(C)(C)Cc1ccc(cc1)C 7a_200011350412_200000210301 [0,2,0,0,0,0|0,0,0]=2 3450 B13R1.249 COC(C)(C)Cc1ccc(cc1)Cl 34a_200011350411_200000210301 [0,2,0,0,0,0|0,0,0]=2 3451 B13R1.249 COC(C)(C)Cc1ccc(cc1)Cl 7a_200011350411_200000210301 [0,2,0,0,0,0|0,0,0]=2 3452 B13R1.249 COC(C)(C)Cc1ccc(cc1)F 34a_200011350416_200000210301 [0,2,0,0,0,0|0,0,0]=2 3453 B13R1.249 COC(C)(C)Cc1ccc(cc1)F 7a_200011350416_200000210301 [0,2,0,0,0,0|0,0,0]=2 3454 B13R1.249 Cc1ccc(cc1)CC(C)(C)O[13CH3] 7a_200011350412_200025704644 [0,2,0,0,0,0|0,0,0]=2 3455 B13R1.249 Cc1ccc(cc1)NC(C)(C)C#N 34a_100000124888_100011162410 [0,2,0,0,0,0|2,0,0]=4 3456 B13R1.249 Cc1ccc(cc1)OC(C)(C)C#N 34a_100000210336_100011162410 [0,2,0,0,0,0|2,0,0]=4 3457 B13R1.249 Cc1ccc(cc1)OC(C)(C)C#N 7a_100000210336_100011162410 [0,2,0,0,0,0|2,0,0]=4 3458 B13R1.249 Cc1ccc(cc1)SC(C)(C)C#N 62a_100000186775_100011162410 [0,2,0,0,0,0|2,0,0]=4 3459 B13R1.249 Cc1ccc(cc1)SC(C)(C)C#N 62a_100011162410_100000186775 [0,2,0,0,0,0|2,0,0]=4 3460 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Br)Br 34a_100011306057_100000210625 [0,2,0,0,0,0|2,0,0]=4 3461 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Br)Cl 34a_100000686031_100000210625 [0,2,0,0,0,0|2,0,0]=4 3462 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Br)F 34a_100000760356_100000210625 [0,2,0,0,0,0|2,0,0]=4 3463 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Br)I 34a_100000750458_100000210625 [0,2,0,0,0,0|2,0,0]=4 3464 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210625 [0,2,0,0,0,0|2,0,0]=4 3465 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Cl)Br 34a_100000687081_100000210625 [0,2,0,0,0,0|2,0,0]=4 3466 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210625 [0,2,0,0,0,0|2,0,0]=4 3467 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Cl)F 34a_100000211060_100000210625 [0,2,0,0,0,0|2,0,0]=4 3468 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Cl)I 34a_100000761885_100000210625 [0,2,0,0,0,0|2,0,0]=4 3469 B13R1.518 CC(C)(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210625 [0,2,0,0,0,0|2,0,0]=4 3470 B13R1.518 CC(C)(C)Nc1ccc(c(c1)F)Br 34a_100000759894_100000210625 [0,2,0,0,0,0|2,0,0]=4 3471 B13R1.518 CC(C)(C)Nc1ccc(c(c1)F)Cl 34a_100000739366_100000210625 [0,2,0,0,0,0|2,0,0]=4 3472 B13R1.518 CC(C)(C)Nc1ccc(c(c1)F)F 34a_100000210724_100000210625 [0,2,0,0,0,0|2,0,0]=4 3473 B13R1.518 CC(C)(C)Nc1ccc(c(c1)F)I 34a_100011356925_100000210625 [0,2,0,0,0,0|2,0,0]=4 3474 B13R1.518 CC(C)(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210625 [0,2,0,0,0,0|2,0,0]=4 3475 B13R1.518 CC(C)(C)Nc1ccc(c(c1)I)Br 34a_100000750459_100000210625 [0,2,0,0,0,0|2,0,0]=4 3476 B13R1.518 CC(C)(C)Nc1ccc(c(c1)I)Cl 34a_100012360549_100000210625 [0,2,0,0,0,0|2,0,0]=4 3477 B13R1.518 CC(C)(C)Nc1ccc(c(c1)I)F 34a_114828291077_100000210625 [0,2,0,0,0,0|2,0,0]=4 3478 B13R1.518 CC(C)(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210625 [0,2,0,0,0,0|2,0,0]=4 3479 B13R1.518 CC(C)(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210625 [0,2,0,0,0,0|2,0,0]=4 3480 B13R1.518 CC(C)(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210625 [0,2,0,0,0,0|2,0,0]=4 3481 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Br)Cl 34a_100011933957_100000210625 [0,2,0,0,0,0|2,0,0]=4 3482 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Br)F 34a_100000693481_100000210625 [0,2,0,0,0,0|2,0,0]=4 3483 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Br)I 34a_100000701344_100000210625 [0,2,0,0,0,0|2,0,0]=4 3484 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Br)N 34a_100012001276_100000210625 [0,2,0,0,0,0|2,0,0]=4 3485 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)Br 34a_100011215161_100000210625 [0,2,0,0,0,0|2,0,0]=4 3486 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210625 [0,2,0,0,0,0|2,0,0]=4 3487 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)F 34a_100000211030_100000210625 [0,2,0,0,0,0|2,0,0]=4 3488 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)I 34a_100000047559_100000210625 [0,2,0,0,0,0|2,0,0]=4 3489 B13R1.518 CC(C)(C)Oc1ccc(c(c1)Cl)N 34a_100011215599_100000210625 [0,2,0,0,0,0|2,0,0]=4 3490 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)Br 34a_100000755031_100000210625 [0,2,0,0,0,0|2,0,0]=4 3491 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)Cl 34a_100000691581_100000210625 [0,2,0,0,0,0|2,0,0]=4 3492 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)F 34a_100000181275_100000210625 [0,2,0,0,0,0|2,0,0]=4 3493 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)I 34a_100009990212_100000210625 [0,2,0,0,0,0|2,0,0]=4 3494 B13R1.518 CC(C)(C)Oc1ccc(c(c1)F)N 34a_100000759473_100000210625 [0,2,0,0,0,0|2,0,0]=4 3495 B13R1.518 CC(C)(C)Oc1ccc(c(c1)I)Br 34a_100012339312_100000210625 [0,2,0,0,0,0|2,0,0]=4 3496 B13R1.518 CC(C)(C)Oc1ccc(c(c1)I)Cl 34a_100000049588_100000210625 [0,2,0,0,0,0|2,0,0]=4 3497 B13R1.518 CC(C)(C)Oc1ccc(c(c1)I)N 34a_100010084370_100000210625 [0,2,0,0,0,0|2,0,0]=4 3498 B13R1.518 CC(C)(C)Oc1ccc(c(c1)N)Br 34a_100011999798_100000210625 [0,2,0,0,0,0|2,0,0]=4 3499 B13R1.518 CC(C)(C)Oc1ccc(c(c1)N)Cl 34a_100011934297_100000210625 [0,2,0,0,0,0|2,0,0]=4 3500 B13R1.518 CC(C)(C)Oc1ccc(c(c1)N)F 34a_100012017239_100000210625 [0,2,0,0,0,0|2,0,0]=4 3501 B13R1.518 CC(C)(C)Oc1ccc(c(c1)N)N 34a_100025771000_100000210625 [0,2,0,0,0,0|2,0,0]=4 3502 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)Br 62a_100000211941_100012356285 [0,2,0,0,0,0|2,0,0]=4 3503 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)Br 62a_100012356285_100000211941 [0,2,0,0,0,0|2,0,0]=4 3504 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)Cl 62a_100000211941_100012353702 [0,2,0,0,0,0|2,0,0]=4 3505 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)Cl 62a_100012353702_100000211941 [0,2,0,0,0,0|2,0,0]=4 3506 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)F 62a_100000211941_100012047266 [0,2,0,0,0,0|2,0,0]=4 3507 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)F 62a_100012047266_100000211941 [0,2,0,0,0,0|2,0,0]=4 3508 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)N 62a_100000211941_100000750455 [0,2,0,0,0,0|2,0,0]=4 3509 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)N 62a_100000750455_100000211941 [0,2,0,0,0,0|2,0,0]=4 3510 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)O 62a_100000211941_100012361655 [0,2,0,0,0,0|2,0,0]=4 3511 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000211941 [0,2,0,0,0,0|2,0,0]=4 3512 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)Br 62a_100000211941_100012047281 [0,2,0,0,0,0|2,0,0]=4 3513 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)Br 62a_100012047281_100000211941 [0,2,0,0,0,0|2,0,0]=4 3514 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)Cl 62a_100000211941_100011214914 [0,2,0,0,0,0|2,0,0]=4 3515 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)Cl 62a_100011214914_100000211941 [0,2,0,0,0,0|2,0,0]=4 3516 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)F 62a_100000211941_100011215976 [0,2,0,0,0,0|2,0,0]=4 3517 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)F 62a_100011215976_100000211941 [0,2,0,0,0,0|2,0,0]=4 3518 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)N 62a_100000211941_100011218065 [0,2,0,0,0,0|2,0,0]=4 3519 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)N 62a_100011218065_100000211941 [0,2,0,0,0,0|2,0,0]=4 3520 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)O 62a_100000211941_100012360047 [0,2,0,0,0,0|2,0,0]=4 3521 B13R1.518 CC(C)(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000211941 [0,2,0,0,0,0|2,0,0]=4 3522 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)Br 62a_100000211941_100000685389 [0,2,0,0,0,0|2,0,0]=4 3523 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)Br 62a_100000685389_100000211941 [0,2,0,0,0,0|2,0,0]=4 3524 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)Cl 62a_100000211941_100011216805 [0,2,0,0,0,0|2,0,0]=4 3525 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)Cl 62a_100011216805_100000211941 [0,2,0,0,0,0|2,0,0]=4 3526 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)F 62a_100000211941_100000703953 [0,2,0,0,0,0|2,0,0]=4 3527 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)F 62a_100000703953_100000211941 [0,2,0,0,0,0|2,0,0]=4 3528 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)N 62a_100000211941_100011215594 [0,2,0,0,0,0|2,0,0]=4 3529 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)N 62a_100011215594_100000211941 [0,2,0,0,0,0|2,0,0]=4 3530 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000211941 [0,2,0,0,0,0|2,0,0]=4 3531 B13R1.518 CC(C)(C)Sc1ccc(c(c1)F)O 62a_100000211941_100000185481 [0,2,0,0,0,0|2,0,0]=4 3532 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)Br 62a_100000211941_100000750456 [0,2,0,0,0,0|2,0,0]=4 3533 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)Br 62a_100000750456_100000211941 [0,2,0,0,0,0|2,0,0]=4 3534 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)Cl 62a_100000211941_200000761891 [0,2,0,0,0,0|2,0,0]=4 3535 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)Cl 62a_200000761891_100000211941 [0,2,0,0,0,0|2,0,0]=4 3536 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)F 62a_100000211941_100000740924 [0,2,0,0,0,0|2,0,0]=4 3537 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)F 62a_100000740924_100000211941 [0,2,0,0,0,0|2,0,0]=4 3538 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)N 62a_100000211941_100011534411 [0,2,0,0,0,0|2,0,0]=4 3539 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)N 62a_100000741789_100000211941 [0,2,0,0,0,0|2,0,0]=4 3540 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)O 62a_100000211941_100000752626 [0,2,0,0,0,0|2,0,0]=4 3541 B13R1.518 CC(C)(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000211941 [0,2,0,0,0,0|2,0,0]=4 3542 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)Br 62a_100000211941_100012356990 [0,2,0,0,0,0|2,0,0]=4 3543 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000211941 [0,2,0,0,0,0|2,0,0]=4 3544 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)Cl 62a_100000211941_100011356854 [0,2,0,0,0,0|2,0,0]=4 3545 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000211941 [0,2,0,0,0,0|2,0,0]=4 3546 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)F 62a_100000211941_100000686035 [0,2,0,0,0,0|2,0,0]=4 3547 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000211941 [0,2,0,0,0,0|2,0,0]=4 3548 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)N 62a_100000211941_100000739049 [0,2,0,0,0,0|2,0,0]=4 3549 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000211941 [0,2,0,0,0,0|2,0,0]=4 3550 B13R1.518 CC(C)(C)Sc1ccc(c(c1)O)O 62a_100000211941_100009813601 [0,2,0,0,0,0|2,0,0]=4 3551 B13R1.518 Cc1cc(ccc1Br)NC(C)(C)C 34a_100000210723_100000210625 [0,2,0,0,0,0|2,0,0]=4 3552 B13R1.518 Cc1cc(ccc1Br)OC(C)(C)C 34a_100000690111_100000210625 [0,2,0,0,0,0|2,0,0]=4 3553 B13R1.518 Cc1cc(ccc1Br)SC(C)(C)C 62a_100000211941_100009813585 [0,2,0,0,0,0|2,0,0]=4 3554 B13R1.518 Cc1cc(ccc1Br)SC(C)(C)C 62a_100009813585_100000211941 [0,2,0,0,0,0|2,0,0]=4 3555 B13R1.518 Cc1cc(ccc1Cl)NC(C)(C)C 34a_100000187808_100000210625 [0,2,0,0,0,0|2,0,0]=4 3556 B13R1.518 Cc1cc(ccc1Cl)OC(C)(C)C 34a_100000211092_100000210625 [0,2,0,0,0,0|2,0,0]=4 3557 B13R1.518 Cc1cc(ccc1Cl)SC(C)(C)C 62a_100000049509_100000211941 [0,2,0,0,0,0|2,0,0]=4 3558 B13R1.518 Cc1cc(ccc1Cl)SC(C)(C)C 62a_100000211941_100000049509 [0,2,0,0,0,0|2,0,0]=4 3559 B13R1.518 Cc1cc(ccc1F)NC(C)(C)C 34a_100000750164_100000210625 [0,2,0,0,0,0|2,0,0]=4 3560 B13R1.518 Cc1cc(ccc1F)OC(C)(C)C 34a_100000751312_100000210625 [0,2,0,0,0,0|2,0,0]=4 3561 B13R1.518 Cc1cc(ccc1F)SC(C)(C)C 62a_100000211941_100011218330 [0,2,0,0,0,0|2,0,0]=4 3562 B13R1.518 Cc1cc(ccc1F)SC(C)(C)C 62a_100011218330_100000211941 [0,2,0,0,0,0|2,0,0]=4 3563 B13R1.518 Cc1cc(ccc1I)NC(C)(C)C 34a_100000198070_100000210625 [0,2,0,0,0,0|2,0,0]=4 3564 B13R1.518 Cc1cc(ccc1I)OC(C)(C)C 34a_100000729255_100000210625 [0,2,0,0,0,0|2,0,0]=4 3565 B13R1.518 Cc1cc(ccc1N)OC(C)(C)C 34a_100000756630_100000210625 [0,2,0,0,0,0|2,0,0]=4 3566 B13R1.518 Cc1cc(ccc1N)SC(C)(C)C 62a_100000211769_100000211941 [0,2,0,0,0,0|2,0,0]=4 3567 B13R1.518 Cc1cc(ccc1N)SC(C)(C)C 62a_100000211941_100000211769 [0,2,0,0,0,0|2,0,0]=4 3568 B13R1.518 Cc1cc(ccc1O)NC(C)(C)C 34a_100011218179_100000210625 [0,2,0,0,0,0|2,0,0]=4 3569 B13R1.518 Cc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100000186361 [0,2,0,0,0,0|2,0,0]=4 3570 B13R1.518 Cc1ccc(cc1Br)NC(C)(C)C 34a_100000736455_100000210625 [0,2,0,0,0,0|2,0,0]=4 3571 B13R1.518 Cc1ccc(cc1Br)OC(C)(C)C 34a_100011380479_100000210625 [0,2,0,0,0,0|2,0,0]=4 3572 B13R1.518 Cc1ccc(cc1Br)SC(C)(C)C 62a_100000211941_100011847877 [0,2,0,0,0,0|2,0,0]=4 3573 B13R1.518 Cc1ccc(cc1Br)SC(C)(C)C 62a_100011847877_100000211941 [0,2,0,0,0,0|2,0,0]=4 3574 B13R1.518 Cc1ccc(cc1C)NC(C)(C)C 34a_100000724040_100000210625 [0,2,0,0,0,0|2,0,0]=4 3575 B13R1.518 Cc1ccc(cc1C)OC(C)(C)C 34a_100000210932_100000210625 [0,2,0,0,0,0|2,0,0]=4 3576 B13R1.518 Cc1ccc(cc1C)SC(C)(C)C 62a_100000211941_100011215607 [0,2,0,0,0,0|2,0,0]=4 3577 B13R1.518 Cc1ccc(cc1C)SC(C)(C)C 62a_100011215607_100000211941 [0,2,0,0,0,0|2,0,0]=4 3578 B13R1.518 Cc1ccc(cc1Cl)NC(C)(C)C 34a_100000188892_100000210625 [0,2,0,0,0,0|2,0,0]=4 3579 B13R1.518 Cc1ccc(cc1Cl)OC(C)(C)C 34a_100011265682_100000210625 [0,2,0,0,0,0|2,0,0]=4 3580 B13R1.518 Cc1ccc(cc1Cl)SC(C)(C)C 62a_100000211941_100011216363 [0,2,0,0,0,0|2,0,0]=4 3581 B13R1.518 Cc1ccc(cc1Cl)SC(C)(C)C 62a_100011216363_100000211941 [0,2,0,0,0,0|2,0,0]=4 3582 B13R1.518 Cc1ccc(cc1F)NC(C)(C)C 34a_100000210958_100000210625 [0,2,0,0,0,0|2,0,0]=4 3583 B13R1.518 Cc1ccc(cc1F)OC(C)(C)C 34a_100000722560_100000210625 [0,2,0,0,0,0|2,0,0]=4 3584 B13R1.518 Cc1ccc(cc1F)SC(C)(C)C 62a_100000211941_100000720648 [0,2,0,0,0,0|2,0,0]=4 3585 B13R1.518 Cc1ccc(cc1F)SC(C)(C)C 62a_100000720648_100000211941 [0,2,0,0,0,0|2,0,0]=4 3586 B13R1.518 Cc1ccc(cc1I)NC(C)(C)C 34a_100000184131_100000210625 [0,2,0,0,0,0|2,0,0]=4 3587 B13R1.518 Cc1ccc(cc1N)OC(C)(C)C 34a_100011216113_100000210625 [0,2,0,0,0,0|2,0,0]=4 3588 B13R1.518 Cc1ccc(cc1N)SC(C)(C)C 62a_100000211941_100000761890 [0,2,0,0,0,0|2,0,0]=4 3589 B13R1.518 Cc1ccc(cc1N)SC(C)(C)C 62a_100000761890_100000211941 [0,2,0,0,0,0|2,0,0]=4 3590 B13R1.518 Cc1ccc(cc1O)NC(C)(C)C 34a_100000759471_100000210625 [0,2,0,0,0,0|2,0,0]=4 3591 B13R1.518 Cc1ccc(cc1O)SC(C)(C)C 62a_100000211941_100000685420 [0,2,0,0,0,0|2,0,0]=4 3592 B13R1.518 Cc1ccc(cc1O)SC(C)(C)C 62a_100000685420_100000211941 [0,2,0,0,0,0|2,0,0]=4 3593 B13R1.525 CC(C)(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000701730 [0,2,0,0,0,0|1,0,1]=4 3594 B13R1.525 CN(c1ccc(cc1)Br)C(C)(C)C 269982a_100000219623_100000210625 [0,2,0,0,0,0|2,0,0]=4 3595 B13R1.525 CN(c1ccc(cc1)Br)C(C)(C)C 34a_100000219623_100000210625 [0,2,0,0,0,0|2,0,0]=4 3596 B13R1.525 CN(c1ccc(cc1)Cl)C(C)(C)C 269982a_100020629279_100000210625 [0,2,0,0,0,0|2,0,0]=4 3597 B13R1.525 CN(c1ccc(cc1)Cl)C(C)(C)C 34a_100020629279_100000210625 [0,2,0,0,0,0|2,0,0]=4 3598 B13R1.525 CN(c1ccc(cc1)F)C(C)(C)C 269982a_100000219829_100000210625 [0,2,0,0,0,0|2,0,0]=4 3599 B13R1.525 CN(c1ccc(cc1)F)C(C)(C)C 34a_100000219829_100000210625 [0,2,0,0,0,0|2,0,0]=4 3600 B13R1.525 CN(c1ccc(cc1)I)C(C)(C)C 269982a_100000743151_100000210625 [0,2,0,0,0,0|2,0,0]=4 3601 B13R1.525 CN(c1ccc(cc1)I)C(C)(C)C 34a_100000743151_100000210625 [0,2,0,0,0,0|2,0,0]=4 3602 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 269982a_100000182112_100000210625 [0,2,0,0,0,0|2,0,0]=4 3603 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 34a_100000182112_100000210625 [0,2,0,0,0,0|2,0,0]=4 3604 B13R1.525 Cc1ccc(cc1)N(C)C(C)(C)C 269982a_100000219977_100000210625 [0,2,0,0,0,0|2,0,0]=4 3605 B13R1.525 Cc1ccc(cc1)N(C)C(C)(C)C 34a_100000219977_100000210625 [0,2,0,0,0,0|2,0,0]=4 3606 B13R1.883 CC(C)(C)Nc1ccc(cc1Br)Br 34a_100000211012_100000210625 [0,2,0,0,0,0|2,0,0]=4 3607 B13R1.883 CC(C)(C)Nc1ccc(cc1Br)Cl 34a_100000752454_100000210625 [0,2,0,0,0,0|2,0,0]=4 3608 B13R1.883 CC(C)(C)Nc1ccc(cc1Br)F 34a_100000738039_100000210625 [0,2,0,0,0,0|2,0,0]=4 3609 B13R1.883 CC(C)(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210625 [0,2,0,0,0,0|2,0,0]=4 3610 B13R1.883 CC(C)(C)Nc1ccc(cc1Cl)Br 34a_100000211467_100000210625 [0,2,0,0,0,0|2,0,0]=4 3611 B13R1.883 CC(C)(C)Nc1ccc(cc1Cl)Cl 34a_100000185861_100000210625 [0,2,0,0,0,0|2,0,0]=4 3612 B13R1.883 CC(C)(C)Nc1ccc(cc1Cl)F 34a_100000212003_100000210625 [0,2,0,0,0,0|2,0,0]=4 3613 B13R1.883 CC(C)(C)Nc1ccc(cc1Cl)I 34a_100011218065_100000210625 [0,2,0,0,0,0|2,0,0]=4 3614 B13R1.883 CC(C)(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210625 [0,2,0,0,0,0|2,0,0]=4 3615 B13R1.883 CC(C)(C)Nc1ccc(cc1F)Br 34a_100000210722_100000210625 [0,2,0,0,0,0|2,0,0]=4 3616 B13R1.883 CC(C)(C)Nc1ccc(cc1F)Cl 34a_100000211020_100000210625 [0,2,0,0,0,0|2,0,0]=4 3617 B13R1.883 CC(C)(C)Nc1ccc(cc1F)F 34a_100000210720_100000210625 [0,2,0,0,0,0|2,0,0]=4 3618 B13R1.883 CC(C)(C)Nc1ccc(cc1F)I 34a_100011215594_100000210625 [0,2,0,0,0,0|2,0,0]=4 3619 B13R1.883 CC(C)(C)Nc1ccc(cc1F)O 34a_100000759473_100000210625 [0,2,0,0,0,0|2,0,0]=4 3620 B13R1.883 CC(C)(C)Nc1ccc(cc1I)Br 34a_100000187925_100000210625 [0,2,0,0,0,0|2,0,0]=4 3621 B13R1.883 CC(C)(C)Nc1ccc(cc1I)Cl 34a_100000761889_100000210625 [0,2,0,0,0,0|2,0,0]=4 3622 B13R1.883 CC(C)(C)Nc1ccc(cc1I)F 34a_100000760547_100000210625 [0,2,0,0,0,0|2,0,0]=4 3623 B13R1.883 CC(C)(C)Nc1ccc(cc1I)O 34a_100010084370_100000210625 [0,2,0,0,0,0|2,0,0]=4 3624 B13R1.883 CC(C)(C)Nc1ccc(cc1O)Br 34a_100000739049_100000210625 [0,2,0,0,0,0|2,0,0]=4 3625 B13R1.883 CC(C)(C)Nc1ccc(cc1O)Cl 34a_100000185728_100000210625 [0,2,0,0,0,0|2,0,0]=4 3626 B13R1.883 CC(C)(C)Nc1ccc(cc1O)F 34a_100000753323_100000210625 [0,2,0,0,0,0|2,0,0]=4 3627 B13R1.883 CC(C)(C)Nc1ccc(cc1O)O 34a_100000106777_100000210625 [0,2,0,0,0,0|2,0,0]=4 3628 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)Br 34a_100000188717_100000210625 [0,2,0,0,0,0|2,0,0]=4 3629 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)Cl 34a_100000211998_100000210625 [0,2,0,0,0,0|2,0,0]=4 3630 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)F 34a_100000211999_100000210625 [0,2,0,0,0,0|2,0,0]=4 3631 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)I 34a_100012361655_100000210625 [0,2,0,0,0,0|2,0,0]=4 3632 B13R1.883 CC(C)(C)Oc1ccc(cc1Br)N 34a_100011534360_100000210625 [0,2,0,0,0,0|2,0,0]=4 3633 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)Br 34a_100000186472_100000210625 [0,2,0,0,0,0|2,0,0]=4 3634 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)Cl 34a_100015191787_100000210625 [0,2,0,0,0,0|2,0,0]=4 3635 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)F 34a_100000212004_100000210625 [0,2,0,0,0,0|2,0,0]=4 3636 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)I 34a_100012360047_100000210625 [0,2,0,0,0,0|2,0,0]=4 3637 B13R1.883 CC(C)(C)Oc1ccc(cc1Cl)N 34a_100000744943_100000210625 [0,2,0,0,0,0|2,0,0]=4 3638 B13R1.883 CC(C)(C)Oc1ccc(cc1F)Br 34a_100000185481_100000210625 [0,2,0,0,0,0|2,0,0]=4 3639 B13R1.883 CC(C)(C)Oc1ccc(cc1F)Cl 34a_100000230166_100000210625 [0,2,0,0,0,0|2,0,0]=4 3640 B13R1.883 CC(C)(C)Oc1ccc(cc1F)F 34a_100000230127_100000210625 [0,2,0,0,0,0|2,0,0]=4 3641 B13R1.883 CC(C)(C)Oc1ccc(cc1F)I 34a_100011356965_100000210625 [0,2,0,0,0,0|2,0,0]=4 3642 B13R1.883 CC(C)(C)Oc1ccc(cc1F)N 34a_100011220035_100000210625 [0,2,0,0,0,0|2,0,0]=4 3643 B13R1.883 CC(C)(C)Oc1ccc(cc1I)Br 34a_100012355227_100000210625 [0,2,0,0,0,0|2,0,0]=4 3644 B13R1.883 CC(C)(C)Oc1ccc(cc1I)Cl 34a_100011356953_100000210625 [0,2,0,0,0,0|2,0,0]=4 3645 B13R1.883 CC(C)(C)Oc1ccc(cc1I)F 34a_100012355409_100000210625 [0,2,0,0,0,0|2,0,0]=4 3646 B13R1.883 CC(C)(C)Oc1ccc(cc1N)Br 34a_100000752626_100000210625 [0,2,0,0,0,0|2,0,0]=4 3647 B13R1.883 CC(C)(C)Oc1ccc(cc1N)Cl 34a_100000210500_100000210625 [0,2,0,0,0,0|2,0,0]=4 3648 B13R1.883 CC(C)(C)Oc1ccc(cc1N)F 34a_100000759472_100000210625 [0,2,0,0,0,0|2,0,0]=4 3649 B13R1.883 CC(C)(C)Oc1ccc(cc1N)I 34a_100000753495_100000210625 [0,2,0,0,0,0|2,0,0]=4 3650 B13R1.883 CC(C)(C)Oc1ccc(cc1N)N 34a_100000725306_100000210625 [0,2,0,0,0,0|2,0,0]=4 3651 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)Br 62a_100000211941_100011484698 [0,2,0,0,0,0|2,0,0]=4 3652 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)Br 62a_100011484698_100000211941 [0,2,0,0,0,0|2,0,0]=4 3653 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)Cl 62a_100000211941_100011219703 [0,2,0,0,0,0|2,0,0]=4 3654 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)Cl 62a_100011219703_100000211941 [0,2,0,0,0,0|2,0,0]=4 3655 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)F 62a_100000211941_100011217111 [0,2,0,0,0,0|2,0,0]=4 3656 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)F 62a_100011217111_100000211941 [0,2,0,0,0,0|2,0,0]=4 3657 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)N 62a_100000211941_100000750458 [0,2,0,0,0,0|2,0,0]=4 3658 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)N 62a_100000750458_100000211941 [0,2,0,0,0,0|2,0,0]=4 3659 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)O 62a_100000211941_100000701344 [0,2,0,0,0,0|2,0,0]=4 3660 B13R1.883 CC(C)(C)Sc1ccc(cc1Br)O 62a_100000701344_100000211941 [0,2,0,0,0,0|2,0,0]=4 3661 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)Br 62a_100000211941_100011216062 [0,2,0,0,0,0|2,0,0]=4 3662 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)Br 62a_100011216062_100000211941 [0,2,0,0,0,0|2,0,0]=4 3663 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)Cl 62a_100000211941_100000699841 [0,2,0,0,0,0|2,0,0]=4 3664 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)Cl 62a_100000699841_100000211941 [0,2,0,0,0,0|2,0,0]=4 3665 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)F 62a_100000211941_100000733362 [0,2,0,0,0,0|2,0,0]=4 3666 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)F 62a_100000733362_100000211941 [0,2,0,0,0,0|2,0,0]=4 3667 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)N 62a_100000211941_100000761885 [0,2,0,0,0,0|2,0,0]=4 3668 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)N 62a_100000761885_100000211941 [0,2,0,0,0,0|2,0,0]=4 3669 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000211941 [0,2,0,0,0,0|2,0,0]=4 3670 B13R1.883 CC(C)(C)Sc1ccc(cc1Cl)O 62a_100000211941_100000047559 [0,2,0,0,0,0|2,0,0]=4 3671 B13R1.883 CC(C)(C)Sc1ccc(cc1F)Br 62a_100000211941_100009814013 [0,2,0,0,0,0|2,0,0]=4 3672 B13R1.883 CC(C)(C)Sc1ccc(cc1F)Br 62a_100009814013_100000211941 [0,2,0,0,0,0|2,0,0]=4 3673 B13R1.883 CC(C)(C)Sc1ccc(cc1F)Cl 62a_100000211941_100011216042 [0,2,0,0,0,0|2,0,0]=4 3674 B13R1.883 CC(C)(C)Sc1ccc(cc1F)Cl 62a_100011216042_100000211941 [0,2,0,0,0,0|2,0,0]=4 3675 B13R1.883 CC(C)(C)Sc1ccc(cc1F)F 62a_100000211941_100000750030 [0,2,0,0,0,0|2,0,0]=4 3676 B13R1.883 CC(C)(C)Sc1ccc(cc1F)F 62a_100000750030_100000211941 [0,2,0,0,0,0|2,0,0]=4 3677 B13R1.883 CC(C)(C)Sc1ccc(cc1F)N 62a_100000211941_100011356925 [0,2,0,0,0,0|2,0,0]=4 3678 B13R1.883 CC(C)(C)Sc1ccc(cc1F)N 62a_100011356925_100000211941 [0,2,0,0,0,0|2,0,0]=4 3679 B13R1.883 CC(C)(C)Sc1ccc(cc1F)O 62a_100000211941_100000755031 [0,2,0,0,0,0|2,0,0]=4 3680 B13R1.883 CC(C)(C)Sc1ccc(cc1F)O 62a_100000755031_100000211941 [0,2,0,0,0,0|2,0,0]=4 3681 B13R1.883 CC(C)(C)Sc1ccc(cc1N)Br 62a_100000211941_100000743836 [0,2,0,0,0,0|2,0,0]=4 3682 B13R1.883 CC(C)(C)Sc1ccc(cc1N)Br 62a_100000743836_100000211941 [0,2,0,0,0,0|2,0,0]=4 3683 B13R1.883 CC(C)(C)Sc1ccc(cc1N)Cl 62a_100000211941_100000761886 [0,2,0,0,0,0|2,0,0]=4 3684 B13R1.883 CC(C)(C)Sc1ccc(cc1N)Cl 62a_100000761886_100000211941 [0,2,0,0,0,0|2,0,0]=4 3685 B13R1.883 CC(C)(C)Sc1ccc(cc1N)F 62a_100000211941_100000687223 [0,2,0,0,0,0|2,0,0]=4 3686 B13R1.883 CC(C)(C)Sc1ccc(cc1N)F 62a_100000687223_100000211941 [0,2,0,0,0,0|2,0,0]=4 3687 B13R1.883 CC(C)(C)Sc1ccc(cc1N)N 62a_100000211941_200012175722 [0,2,0,0,0,0|2,0,0]=4 3688 B13R1.883 CC(C)(C)Sc1ccc(cc1N)N 62a_200012175722_100000211941 [0,2,0,0,0,0|2,0,0]=4 3689 B13R1.883 CC(C)(C)Sc1ccc(cc1N)O 62a_100000211941_100011999798 [0,2,0,0,0,0|2,0,0]=4 3690 B13R1.883 CC(C)(C)Sc1ccc(cc1N)O 62a_100011999798_100000211941 [0,2,0,0,0,0|2,0,0]=4 3691 B13R1.883 CC(C)(C)Sc1ccc(cc1O)Br 62a_100000211941_100012344904 [0,2,0,0,0,0|2,0,0]=4 3692 B13R1.883 CC(C)(C)Sc1ccc(cc1O)Br 62a_100012344904_100000211941 [0,2,0,0,0,0|2,0,0]=4 3693 B13R1.883 CC(C)(C)Sc1ccc(cc1O)Cl 62a_100000050036_100000211941 [0,2,0,0,0,0|2,0,0]=4 3694 B13R1.883 CC(C)(C)Sc1ccc(cc1O)Cl 62a_100000211941_100000050036 [0,2,0,0,0,0|2,0,0]=4 3695 B13R1.883 CC(C)(C)Sc1ccc(cc1O)F 62a_100000211941_100000690578 [0,2,0,0,0,0|2,0,0]=4 3696 B13R1.883 CC(C)(C)Sc1ccc(cc1O)F 62a_100000690578_100000211941 [0,2,0,0,0,0|2,0,0]=4 3697 B13R1.883 CC(C)(C)Sc1ccc(cc1O)O 62a_100000211941_100009813921 [0,2,0,0,0,0|2,0,0]=4 3698 B13R1.883 Cc1cc(ccc1NC(C)(C)C)Br 34a_100000211769_100000210625 [0,2,0,0,0,0|2,0,0]=4 3699 B13R1.883 Cc1cc(ccc1NC(C)(C)C)Cl 34a_100000210418_100000210625 [0,2,0,0,0,0|2,0,0]=4 3700 B13R1.883 Cc1cc(ccc1NC(C)(C)C)F 34a_100000211637_100000210625 [0,2,0,0,0,0|2,0,0]=4 3701 B13R1.883 Cc1cc(ccc1NC(C)(C)C)I 34a_100000184554_100000210625 [0,2,0,0,0,0|2,0,0]=4 3702 B13R1.883 Cc1cc(ccc1NC(C)(C)C)O 34a_100000756630_100000210625 [0,2,0,0,0,0|2,0,0]=4 3703 B13R1.883 Cc1cc(ccc1OC(C)(C)C)Br 34a_100000186361_100000210625 [0,2,0,0,0,0|2,0,0]=4 3704 B13R1.883 Cc1cc(ccc1OC(C)(C)C)Cl 34a_100000211091_100000210625 [0,2,0,0,0,0|2,0,0]=4 3705 B13R1.883 Cc1cc(ccc1OC(C)(C)C)F 34a_100000764316_100000210625 [0,2,0,0,0,0|2,0,0]=4 3706 B13R1.883 Cc1cc(ccc1OC(C)(C)C)I 34a_100011218673_100000210625 [0,2,0,0,0,0|2,0,0]=4 3707 B13R1.883 Cc1cc(ccc1OC(C)(C)C)N 34a_100011218179_100000210625 [0,2,0,0,0,0|2,0,0]=4 3708 B13R1.883 Cc1cc(ccc1SC(C)(C)C)Br 62a_100000211941_100000701812 [0,2,0,0,0,0|2,0,0]=4 3709 B13R1.883 Cc1cc(ccc1SC(C)(C)C)Br 62a_100000701812_100000211941 [0,2,0,0,0,0|2,0,0]=4 3710 B13R1.883 Cc1cc(ccc1SC(C)(C)C)Cl 62a_100000211941_100011219607 [0,2,0,0,0,0|2,0,0]=4 3711 B13R1.883 Cc1cc(ccc1SC(C)(C)C)Cl 62a_100011219607_100000211941 [0,2,0,0,0,0|2,0,0]=4 3712 B13R1.883 Cc1cc(ccc1SC(C)(C)C)F 62a_100000211941_100011205405 [0,2,0,0,0,0|2,0,0]=4 3713 B13R1.883 Cc1cc(ccc1SC(C)(C)C)F 62a_100011205405_100000211941 [0,2,0,0,0,0|2,0,0]=4 3714 B13R1.883 Cc1cc(ccc1SC(C)(C)C)N 62a_100000210723_100000211941 [0,2,0,0,0,0|2,0,0]=4 3715 B13R1.883 Cc1cc(ccc1SC(C)(C)C)N 62a_100000211941_100000210723 [0,2,0,0,0,0|2,0,0]=4 3716 B13R1.883 Cc1cc(ccc1SC(C)(C)C)O 62a_100000211941_100000690111 [0,2,0,0,0,0|2,0,0]=4 3717 B13R1.883 Cc1ccc(c(c1)Br)NC(C)(C)C 34a_100000210942_100000210625 [0,2,0,0,0,0|2,0,0]=4 3718 B13R1.883 Cc1ccc(c(c1)Br)OC(C)(C)C 34a_100000210800_100000210625 [0,2,0,0,0,0|2,0,0]=4 3719 B13R1.883 Cc1ccc(c(c1)Br)SC(C)(C)C 62a_100000211941_100009813563 [0,2,0,0,0,0|2,0,0]=4 3720 B13R1.883 Cc1ccc(c(c1)Br)SC(C)(C)C 62a_100009813563_100000211941 [0,2,0,0,0,0|2,0,0]=4 3721 B13R1.883 Cc1ccc(c(c1)C)NC(C)(C)C 34a_100000736561_100000210625 [0,2,0,0,0,0|2,0,0]=4 3722 B13R1.883 Cc1ccc(c(c1)C)OC(C)(C)C 34a_100000211776_100000210625 [0,2,0,0,0,0|2,0,0]=4 3723 B13R1.883 Cc1ccc(c(c1)C)SC(C)(C)C 62a_100000211941_100011217332 [0,2,0,0,0,0|2,0,0]=4 3724 B13R1.883 Cc1ccc(c(c1)C)SC(C)(C)C 62a_100011217332_100000211941 [0,2,0,0,0,0|2,0,0]=4 3725 B13R1.883 Cc1ccc(c(c1)Cl)NC(C)(C)C 34a_100000210522_100000210625 [0,2,0,0,0,0|2,0,0]=4 3726 B13R1.883 Cc1ccc(c(c1)Cl)OC(C)(C)C 34a_100000749699_100000210625 [0,2,0,0,0,0|2,0,0]=4 3727 B13R1.883 Cc1ccc(c(c1)Cl)SC(C)(C)C 62a_100000211941_100011263221 [0,2,0,0,0,0|2,0,0]=4 3728 B13R1.883 Cc1ccc(c(c1)Cl)SC(C)(C)C 62a_100011263221_100000211941 [0,2,0,0,0,0|2,0,0]=4 3729 B13R1.883 Cc1ccc(c(c1)F)NC(C)(C)C 34a_100000211023_100000210625 [0,2,0,0,0,0|2,0,0]=4 3730 B13R1.883 Cc1ccc(c(c1)F)OC(C)(C)C 34a_100011216688_100000210625 [0,2,0,0,0,0|2,0,0]=4 3731 B13R1.883 Cc1ccc(c(c1)F)SC(C)(C)C 62a_100000211941_100011216119 [0,2,0,0,0,0|2,0,0]=4 3732 B13R1.883 Cc1ccc(c(c1)F)SC(C)(C)C 62a_100011216119_100000211941 [0,2,0,0,0,0|2,0,0]=4 3733 B13R1.883 Cc1ccc(c(c1)I)NC(C)(C)C 34a_100011356834_100000210625 [0,2,0,0,0,0|2,0,0]=4 3734 B13R1.883 Cc1ccc(c(c1)I)OC(C)(C)C 34a_100000765521_100000210625 [0,2,0,0,0,0|2,0,0]=4 3735 B13R1.883 Cc1ccc(c(c1)N)OC(C)(C)C 34a_100011215204_100000210625 [0,2,0,0,0,0|2,0,0]=4 3736 B13R1.883 Cc1ccc(c(c1)N)SC(C)(C)C 62a_100000211941_100011216686 [0,2,0,0,0,0|2,0,0]=4 3737 B13R1.883 Cc1ccc(c(c1)N)SC(C)(C)C 62a_100011216686_100000211941 [0,2,0,0,0,0|2,0,0]=4 3738 B13R1.883 Cc1ccc(c(c1)O)NC(C)(C)C 34a_100000211527_100000210625 [0,2,0,0,0,0|2,0,0]=4 3739 B13R1.883 Cc1ccc(c(c1)O)SC(C)(C)C 62a_100000211941_100012002257 [0,2,0,0,0,0|2,0,0]=4 3740 B13R1.883 Cc1ccc(c(c1)O)SC(C)(C)C 62a_100012002257_100000211941 [0,2,0,0,0,0|2,0,0]=4 3741 B13R1.80 C#Cc1cccc(c1)NC(C)(C)C 34a_100000735509_100000210625 [0,2,0,0,0,0|2,0,0]=4 3742 B13R1.80 C#Cc1cccc(c1)OC(C)(C)C 34a_100011216014_100000210625 [0,2,0,0,0,0|2,0,0]=4 3743 B13R1.80 C=Cc1cccc(c1)NC(C)(C)C 34a_100011827668_100000210625 [0,2,0,0,0,0|2,0,0]=4 3744 B13R1.80 C=Cc1cccc(c1)OC(C)(C)C 271570a_100011290941_100010078498 [0,2,0,0,0,0|2,0,0]=4 3745 B13R1.80 C=Cc1cccc(c1)OC(C)(C)C 34a_100011309434_100000210625 [0,2,0,0,0,0|2,0,0]=4 3746 B13R1.80 C=Cc1cccc(c1)SC(C)(C)C 62a_100000211941_100011215241 [0,2,0,0,0,0|2,0,0]=4 3747 B13R1.80 C=Cc1cccc(c1)SC(C)(C)C 62a_100011215241_100000211941 [0,2,0,0,0,0|2,0,0]=4 3748 B13R1.80 C=Cc1cccc(n1)CC(C)(C)O 271570a_100011290941_100010253926 [0,2,0,0,0,0|1,0,0]=3 3749 B13R1.80 CC(C)(C)Nc1cccc(c1)C#N 34a_100000210922_100000210625 [0,2,0,0,0,0|2,0,0]=4 3750 B13R1.80 CC(C)(C)Nc1cccc(c1)CF 34a_100000126320_100000210625 [0,2,0,0,0,0|2,0,0]=4 3751 B13R1.80 CC(C)(C)Nc1cccc(c1)CO 34a_100000211919_100000210625 [0,2,0,0,0,0|2,0,0]=4 3752 B13R1.80 CC(C)(C)Oc1cccc(c1)C#N 34a_100000184713_100000210625 [0,2,0,0,0,0|2,0,0]=4 3753 B13R1.80 CC(C)(C)Oc1cccc(c1)CBr 34a_100011660834_100000210625 [0,2,0,0,0,0|2,0,0]=4 3754 B13R1.80 CC(C)(C)Oc1cccc(c1)CCl 34a_100000084143_100000210625 [0,2,0,0,0,0|2,0,0]=4 3755 B13R1.80 CC(C)(C)Oc1cccc(c1)CN 34a_100000743036_100000210625 [0,2,0,0,0,0|2,0,0]=4 3756 B13R1.80 CC(C)(C)Oc1cccc(c1)CO 34a_100011214949_100000210625 [0,2,0,0,0,0|2,0,0]=4 3757 B13R1.80 CC(C)(C)Oc1cccc(c1)S[13CH3] 62a_100010078498_200025704644 [0,2,0,0,0,0|2,0,0]=4 3758 B13R1.80 CC(C)(C)Oc1cccc(c1)S[13CH3] 62a_200025704644_100010078498 [0,2,0,0,0,0|2,0,0]=4 3759 B13R1.80 CC(C)(C)Sc1cccc(c1)C#N 62a_100000211941_100000189340 [0,2,0,0,0,0|2,0,0]=4 3760 B13R1.80 CC(C)(C)Sc1cccc(c1)C=O 62a_100000014684_100000211941 [0,2,0,0,0,0|2,0,0]=4 3761 B13R1.80 CC(C)(C)Sc1cccc(c1)C=O 62a_100000211941_100000014684 [0,2,0,0,0,0|2,0,0]=4 3762 B13R1.80 CC(C)(C)Sc1cccc(c1)CF 62a_100000211941_100010878472 [0,2,0,0,0,0|2,0,0]=4 3763 B13R1.80 CC(C)(C)Sc1cccc(c1)CF 62a_100010878472_100000211941 [0,2,0,0,0,0|2,0,0]=4 3764 B13R1.80 CC(C)(C)Sc1cccc(c1)CN 62a_100000106179_100000211941 [0,2,0,0,0,0|2,0,0]=4 3765 B13R1.80 CC(C)(C)Sc1cccc(c1)CN 62a_100000211941_100000106179 [0,2,0,0,0,0|2,0,0]=4 3766 B13R1.80 CC(C)(C)Sc1cccc(c1)CO 62a_100000211941_100000687537 [0,2,0,0,0,0|2,0,0]=4 3767 B13R1.80 CC(C)(C)Sc1cccc(c1)CO 62a_100000687537_100000211941 [0,2,0,0,0,0|2,0,0]=4 3768 B13R1.80 CC(C)(C)Sc1cccc(c1)NN 62a_100000211941_100000217339 [0,2,0,0,0,0|2,0,0]=4 3769 B13R1.80 CC(C)(C)Sc1cccc(c1)NN 62a_100000217339_100000211941 [0,2,0,0,0,0|2,0,0]=4 3770 B13R1.80 CC(C)(O)Cc1cccc(n1)S[13CH3] 62a_100010253926_200025704644 [0,2,0,0,0,0|1,0,0]=3 3771 B13R1.80 CC(C)(O)Cc1cccc(n1)S[13CH3] 62a_200025704644_100010253926 [0,2,0,0,0,0|1,0,0]=3 3772 B13R1.80 CCc1cccc(c1)NC(C)(C)C 34a_100000211250_100000210625 [0,2,0,0,0,0|2,0,0]=4 3773 B13R1.80 CCc1cccc(c1)OC(C)(C)C 34a_100000211550_100000210625 [0,2,0,0,0,0|2,0,0]=4 3774 B13R1.80 CCc1cccc(c1)SC(C)(C)C 62a_100000211941_100011263222 [0,2,0,0,0,0|2,0,0]=4 3775 B13R1.80 CCc1cccc(c1)SC(C)(C)C 62a_100011263222_100000211941 [0,2,0,0,0,0|2,0,0]=4 3776 B13R1.80 CNc1cccc(c1)OC(C)(C)C 34a_100000756613_100000210625 [0,2,0,0,0,0|2,0,0]=4 3777 B13R1.80 CNc1cccc(c1)SC(C)(C)C 62a_100000211941_100000219648 [0,2,0,0,0,0|2,0,0]=4 3778 B13R1.80 CNc1cccc(c1)SC(C)(C)C 62a_100000219648_100000211941 [0,2,0,0,0,0|2,0,0]=4 3779 B13R1.80 COc1cccc(c1)NC(C)(C)C 34a_100000210024_100000210625 [0,2,0,0,0,0|2,0,0]=4 3780 B13R1.80 COc1cccc(c1)OC(C)(C)C 34a_100000211255_100000210625 [0,2,0,0,0,0|2,0,0]=4 3781 B13R1.80 COc1cccc(c1)SC(C)(C)C 62a_100000211941_100000170001 [0,2,0,0,0,0|2,0,0]=4 3782 B13R1.80 CSc1cccc(c1)NC(C)(C)C 34a_100000210049_100000210625 [0,2,0,0,0,0|2,0,0]=4 3783 B13R1.80 CSc1cccc(c1)OC(C)(C)C 34a_100011265683_100000210625 [0,2,0,0,0,0|2,0,0]=4 3784 B13R1.80 CSc1cccc(c1)OC(C)(C)C 62a_100010078498_200000210301 [0,2,0,0,0,0|2,0,0]=4 3785 B13R1.80 CSc1cccc(c1)OC(C)(C)C 62a_200000210301_100010078498 [0,2,0,0,0,0|2,0,0]=4 3786 B13R1.80 CSc1cccc(c1)SC(C)(C)C 62a_100000211941_100011215954 [0,2,0,0,0,0|2,0,0]=4 3787 B13R1.80 CSc1cccc(c1)SC(C)(C)C 62a_100011215954_100000211941 [0,2,0,0,0,0|2,0,0]=4 3788 B13R1.80 CSc1cccc(n1)CC(C)(C)O 62a_100010253926_200000210301 [0,2,0,0,0,0|1,0,0]=3 3789 B13R1.80 CSc1cccc(n1)CC(C)(C)O 62a_200000210301_100010253926 [0,2,0,0,0,0|1,0,0]=3 3790 B13R1.151 CC(C)(C)Nc1cccc(c1Br)Cl 34a_100000687072_100000210625 [0,2,0,0,0,0|2,0,0]=4 3791 B13R1.151 CC(C)(C)Nc1cccc(c1Br)F 34a_100011934729_100000210625 [0,2,0,0,0,0|2,0,0]=4 3792 B13R1.151 CC(C)(C)Nc1cccc(c1Br)O 34a_100012183704_100000210625 [0,2,0,0,0,0|2,0,0]=4 3793 B13R1.151 CC(C)(C)Nc1cccc(c1Cl)Br 34a_100000687075_100000210625 [0,2,0,0,0,0|2,0,0]=4 3794 B13R1.151 CC(C)(C)Nc1cccc(c1Cl)Cl 34a_100000185733_100000210625 [0,2,0,0,0,0|2,0,0]=4 3795 B13R1.151 CC(C)(C)Nc1cccc(c1Cl)F 34a_100000692321_100000210625 [0,2,0,0,0,0|2,0,0]=4 3796 B13R1.151 CC(C)(C)Nc1cccc(c1Cl)O 34a_100012002038_100000210625 [0,2,0,0,0,0|2,0,0]=4 3797 B13R1.151 CC(C)(C)Nc1cccc(c1F)Br 34a_100011935091_100000210625 [0,2,0,0,0,0|2,0,0]=4 3798 B13R1.151 CC(C)(C)Nc1cccc(c1F)Cl 34a_100000199060_100000210625 [0,2,0,0,0,0|2,0,0]=4 3799 B13R1.151 CC(C)(C)Nc1cccc(c1F)F 34a_100000743855_100000210625 [0,2,0,0,0,0|2,0,0]=4 3800 B13R1.151 CC(C)(C)Nc1cccc(c1I)Br 34a_100020590159_100000210625 [0,2,0,0,0,0|2,0,0]=4 3801 B13R1.151 CC(C)(C)Nc1cccc(c1I)Cl 34a_100000049713_100000210625 [0,2,0,0,0,0|2,0,0]=4 3802 B13R1.151 CC(C)(C)Nc1cccc(c1I)F 34a_100000690935_100000210625 [0,2,0,0,0,0|2,0,0]=4 3803 B13R1.151 CC(C)(C)Nc1cccc(c1O)Br 34a_100011934915_100000210625 [0,2,0,0,0,0|2,0,0]=4 3804 B13R1.151 CC(C)(C)Nc1cccc(c1O)Cl 34a_100000754742_100000210625 [0,2,0,0,0,0|2,0,0]=4 3805 B13R1.151 CC(C)(C)Nc1cccc(c1O)F 34a_100011934987_100000210625 [0,2,0,0,0,0|2,0,0]=4 3806 B13R1.151 CC(C)(C)Oc1cccc(c1Br)Br 34a_100010187966_100000210625 [0,2,0,0,0,0|2,0,0]=4 3807 B13R1.151 CC(C)(C)Oc1cccc(c1Br)Cl 34a_100012348804_100000210625 [0,2,0,0,0,0|2,0,0]=4 3808 B13R1.151 CC(C)(C)Oc1cccc(c1Br)F 34a_100009820682_100000210625 [0,2,0,0,0,0|2,0,0]=4 3809 B13R1.151 CC(C)(C)Oc1cccc(c1Br)I 34a_100010187914_100000210625 [0,2,0,0,0,0|2,0,0]=4 3810 B13R1.151 CC(C)(C)Oc1cccc(c1Br)N 34a_100012183704_100000210625 [0,2,0,0,0,0|2,0,0]=4 3811 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)Br 34a_100010187913_100000210625 [0,2,0,0,0,0|2,0,0]=4 3812 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)Cl 34a_100000211076_100000210625 [0,2,0,0,0,0|2,0,0]=4 3813 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)F 34a_100000087408_100000210625 [0,2,0,0,0,0|2,0,0]=4 3814 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)I 34a_100000049636_100000210625 [0,2,0,0,0,0|2,0,0]=4 3815 B13R1.151 CC(C)(C)Oc1cccc(c1Cl)N 34a_100012002038_100000210625 [0,2,0,0,0,0|2,0,0]=4 3816 B13R1.151 CC(C)(C)Oc1cccc(c1F)Br 34a_100009817021_100000210625 [0,2,0,0,0,0|2,0,0]=4 3817 B13R1.151 CC(C)(C)Oc1cccc(c1F)Cl 34a_100000687438_100000210625 [0,2,0,0,0,0|2,0,0]=4 3818 B13R1.151 CC(C)(C)Oc1cccc(c1F)F 34a_100000751161_100000210625 [0,2,0,0,0,0|2,0,0]=4 3819 B13R1.151 CC(C)(C)Oc1cccc(c1I)Br 34a_100010187912_100000210625 [0,2,0,0,0,0|2,0,0]=4 3820 B13R1.151 CC(C)(C)Oc1cccc(c1I)Cl 34a_100000050174_100000210625 [0,2,0,0,0,0|2,0,0]=4 3821 B13R1.151 CC(C)(C)Oc1cccc(c1I)F 34a_100000690913_100000210625 [0,2,0,0,0,0|2,0,0]=4 3822 B13R1.151 CC(C)(C)Oc1cccc(c1N)Br 34a_100011934926_100000210625 [0,2,0,0,0,0|2,0,0]=4 3823 B13R1.151 CC(C)(C)Oc1cccc(c1N)Cl 34a_100012022510_100000210625 [0,2,0,0,0,0|2,0,0]=4 3824 B13R1.151 CC(C)(C)Oc1cccc(c1N)F 34a_100020591140_100000210625 [0,2,0,0,0,0|2,0,0]=4 3825 B13R1.151 CC(C)(C)Oc1cccc(c1N)I 34a_200000049512_100000210625 [0,2,0,0,0,0|2,0,0]=4 3826 B13R1.151 CC(C)(C)Oc1cccc(c1N)N 34a_100000033209_100000210625 [0,2,0,0,0,0|2,0,0]=4 3827 B13R1.151 CC(C)(C)Sc1cccc(c1Br)Br 62a_100000211941_100010175083 [0,2,0,0,0,0|2,0,0]=4 3828 B13R1.151 CC(C)(C)Sc1cccc(c1Br)Br 62a_100010175083_100000211941 [0,2,0,0,0,0|2,0,0]=4 3829 B13R1.151 CC(C)(C)Sc1cccc(c1Br)Cl 62a_100000211941_100014021842 [0,2,0,0,0,0|2,0,0]=4 3830 B13R1.151 CC(C)(C)Sc1cccc(c1Br)Cl 62a_100014021842_100000211941 [0,2,0,0,0,0|2,0,0]=4 3831 B13R1.151 CC(C)(C)Sc1cccc(c1Br)F 62a_100000211941_100010202630 [0,2,0,0,0,0|2,0,0]=4 3832 B13R1.151 CC(C)(C)Sc1cccc(c1Br)F 62a_100010202630_100000211941 [0,2,0,0,0,0|2,0,0]=4 3833 B13R1.151 CC(C)(C)Sc1cccc(c1Br)O 62a_100000211941_100010187914 [0,2,0,0,0,0|2,0,0]=4 3834 B13R1.151 CC(C)(C)Sc1cccc(c1Br)O 62a_100010187914_100000211941 [0,2,0,0,0,0|2,0,0]=4 3835 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)Br 62a_100000211941_100010142854 [0,2,0,0,0,0|2,0,0]=4 3836 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)Br 62a_100010142854_100000211941 [0,2,0,0,0,0|2,0,0]=4 3837 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)Cl 62a_100000211941_100011215384 [0,2,0,0,0,0|2,0,0]=4 3838 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)Cl 62a_100011215384_100000211941 [0,2,0,0,0,0|2,0,0]=4 3839 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)F 62a_100000211941_200010234923 [0,2,0,0,0,0|2,0,0]=4 3840 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)F 62a_200010234923_100000211941 [0,2,0,0,0,0|2,0,0]=4 3841 B13R1.151 CC(C)(C)Sc1cccc(c1Cl)O 62a_100000211941_100000049636 [0,2,0,0,0,0|2,0,0]=4 3842 B13R1.151 CC(C)(C)Sc1cccc(c1F)Br 62a_100000211941_100000702267 [0,2,0,0,0,0|2,0,0]=4 3843 B13R1.151 CC(C)(C)Sc1cccc(c1F)Br 62a_100000702267_100000211941 [0,2,0,0,0,0|2,0,0]=4 3844 B13R1.151 CC(C)(C)Sc1cccc(c1F)Cl 62a_100000211941_100011217346 [0,2,0,0,0,0|2,0,0]=4 3845 B13R1.151 CC(C)(C)Sc1cccc(c1F)Cl 62a_100011217346_100000211941 [0,2,0,0,0,0|2,0,0]=4 3846 B13R1.151 CC(C)(C)Sc1cccc(c1F)F 62a_100000211941_100000694657 [0,2,0,0,0,0|2,0,0]=4 3847 B13R1.151 CC(C)(C)Sc1cccc(c1F)F 62a_100000694657_100000211941 [0,2,0,0,0,0|2,0,0]=4 3848 B13R1.151 CC(C)(C)Sc1cccc(c1F)N 62a_100000211941_100011935091 [0,2,0,0,0,0|2,0,0]=4 3849 B13R1.151 CC(C)(C)Sc1cccc(c1F)N 62a_100011935091_100000211941 [0,2,0,0,0,0|2,0,0]=4 3850 B13R1.151 CC(C)(C)Sc1cccc(c1F)O 62a_100000211941_100009817021 [0,2,0,0,0,0|2,0,0]=4 3851 B13R1.151 CC(C)(C)Sc1cccc(c1F)O 62a_100009817021_100000211941 [0,2,0,0,0,0|2,0,0]=4 3852 B13R1.151 CC(C)(C)Sc1cccc(c1N)Br 62a_100000211941_100010146558 [0,2,0,0,0,0|2,0,0]=4 3853 B13R1.151 CC(C)(C)Sc1cccc(c1N)Br 62a_100010146558_100000211941 [0,2,0,0,0,0|2,0,0]=4 3854 B13R1.151 CC(C)(C)Sc1cccc(c1N)Cl 62a_100000211941_100010190421 [0,2,0,0,0,0|2,0,0]=4 3855 B13R1.151 CC(C)(C)Sc1cccc(c1N)Cl 62a_100010190421_100000211941 [0,2,0,0,0,0|2,0,0]=4 3856 B13R1.151 CC(C)(C)Sc1cccc(c1N)F 62a_100000042321_100000211941 [0,2,0,0,0,0|2,0,0]=4 3857 B13R1.151 CC(C)(C)Sc1cccc(c1N)F 62a_100000211941_100000042321 [0,2,0,0,0,0|2,0,0]=4 3858 B13R1.151 CC(C)(C)Sc1cccc(c1N)N 62a_100015191791_100000211941 [0,2,0,0,0,0|2,0,0]=4 3859 B13R1.151 CC(C)(C)Sc1cccc(c1N)O 62a_100000211941_100011934926 [0,2,0,0,0,0|2,0,0]=4 3860 B13R1.151 CC(C)(C)Sc1cccc(c1O)Br 62a_100000211941_100010084509 [0,2,0,0,0,0|2,0,0]=4 3861 B13R1.151 CC(C)(C)Sc1cccc(c1O)Br 62a_100010084509_100000211941 [0,2,0,0,0,0|2,0,0]=4 3862 B13R1.151 CC(C)(C)Sc1cccc(c1O)Cl 62a_100000211941_100010202889 [0,2,0,0,0,0|2,0,0]=4 3863 B13R1.151 CC(C)(C)Sc1cccc(c1O)Cl 62a_100010202889_100000211941 [0,2,0,0,0,0|2,0,0]=4 3864 B13R1.151 CC(C)(C)Sc1cccc(c1O)F 62a_100000211941_100009813666 [0,2,0,0,0,0|2,0,0]=4 3865 B13R1.151 CC(C)(C)Sc1cccc(c1O)F 62a_100009813666_100000211941 [0,2,0,0,0,0|2,0,0]=4 3866 B13R1.151 CC(C)(C)Sc1cccc(c1O)N 62a_100000211941_100010084371 [0,2,0,0,0,0|2,0,0]=4 3867 B13R1.151 CC(C)(C)Sc1cccc(c1O)N 62a_100011934915_100000211941 [0,2,0,0,0,0|2,0,0]=4 3868 B13R1.151 CC(C)(C)Sc1cccc(c1O)O 62a_100000211941_100009815950 [0,2,0,0,0,0|2,0,0]=4 3869 B13R1.151 Cc1c(cccc1NC(C)(C)C)Br 34a_100000750434_100000210625 [0,2,0,0,0,0|2,0,0]=4 3870 B13R1.151 Cc1c(cccc1NC(C)(C)C)Cl 34a_100000210441_100000210625 [0,2,0,0,0,0|2,0,0]=4 3871 B13R1.151 Cc1c(cccc1NC(C)(C)C)F 34a_100000745574_100000210625 [0,2,0,0,0,0|2,0,0]=4 3872 B13R1.151 Cc1c(cccc1NC(C)(C)C)I 34a_100000761887_100000210625 [0,2,0,0,0,0|2,0,0]=4 3873 B13R1.151 Cc1c(cccc1NC(C)(C)C)O 34a_100011216573_100000210625 [0,2,0,0,0,0|2,0,0]=4 3874 B13R1.151 Cc1c(cccc1OC(C)(C)C)Br 34a_100012002258_100000210625 [0,2,0,0,0,0|2,0,0]=4 3875 B13R1.151 Cc1c(cccc1OC(C)(C)C)Cl 34a_100011265684_100000210625 [0,2,0,0,0,0|2,0,0]=4 3876 B13R1.151 Cc1c(cccc1OC(C)(C)C)F 34a_100011217231_100000210625 [0,2,0,0,0,0|2,0,0]=4 3877 B13R1.151 Cc1c(cccc1OC(C)(C)C)N 34a_100011216573_100000210625 [0,2,0,0,0,0|2,0,0]=4 3878 B13R1.151 Cc1c(cccc1SC(C)(C)C)Br 62a_100000211941_100012353703 [0,2,0,0,0,0|2,0,0]=4 3879 B13R1.151 Cc1c(cccc1SC(C)(C)C)Br 62a_100012353703_100000211941 [0,2,0,0,0,0|2,0,0]=4 3880 B13R1.151 Cc1c(cccc1SC(C)(C)C)Cl 62a_100000211941_100000726075 [0,2,0,0,0,0|2,0,0]=4 3881 B13R1.151 Cc1c(cccc1SC(C)(C)C)Cl 62a_100000726075_100000211941 [0,2,0,0,0,0|2,0,0]=4 3882 B13R1.151 Cc1c(cccc1SC(C)(C)C)F 62a_100000211941_100011216893 [0,2,0,0,0,0|2,0,0]=4 3883 B13R1.151 Cc1c(cccc1SC(C)(C)C)F 62a_100011216893_100000211941 [0,2,0,0,0,0|2,0,0]=4 3884 B13R1.151 Cc1c(cccc1SC(C)(C)C)N 62a_100000211941_100000761887 [0,2,0,0,0,0|2,0,0]=4 3885 B13R1.151 Cc1c(cccc1SC(C)(C)C)N 62a_100000761887_100000211941 [0,2,0,0,0,0|2,0,0]=4 3886 B13R1.151 Cc1c(cccc1SC(C)(C)C)O 62a_100000211941_100012002258 [0,2,0,0,0,0|2,0,0]=4 3887 B13R1.151 Cc1c(cccc1SC(C)(C)C)O 62a_100012002258_100000211941 [0,2,0,0,0,0|2,0,0]=4 3888 B13R1.151 Cc1cccc(c1Br)NC(C)(C)C 34a_100000684715_100000210625 [0,2,0,0,0,0|2,0,0]=4 3889 B13R1.151 Cc1cccc(c1Br)OC(C)(C)C 34a_100000686692_100000210625 [0,2,0,0,0,0|2,0,0]=4 3890 B13R1.151 Cc1cccc(c1Br)SC(C)(C)C 62a_100000211941_100012362457 [0,2,0,0,0,0|2,0,0]=4 3891 B13R1.151 Cc1cccc(c1Br)SC(C)(C)C 62a_100012362457_100000211941 [0,2,0,0,0,0|2,0,0]=4 3892 B13R1.151 Cc1cccc(c1C)NC(C)(C)C 34a_100000210026_100000210625 [0,2,0,0,0,0|2,0,0]=4 3893 B13R1.151 Cc1cccc(c1C)OC(C)(C)C 34a_100000185855_100000210625 [0,2,0,0,0,0|2,0,0]=4 3894 B13R1.151 Cc1cccc(c1C)SC(C)(C)C 62a_100000211941_100011214922 [0,2,0,0,0,0|2,0,0]=4 3895 B13R1.151 Cc1cccc(c1C)SC(C)(C)C 62a_100011214922_100000211941 [0,2,0,0,0,0|2,0,0]=4 3896 B13R1.151 Cc1cccc(c1Cl)NC(C)(C)C 34a_100000765562_100000210625 [0,2,0,0,0,0|2,0,0]=4 3897 B13R1.151 Cc1cccc(c1Cl)OC(C)(C)C 34a_100000695629_100000210625 [0,2,0,0,0,0|2,0,0]=4 3898 B13R1.151 Cc1cccc(c1Cl)SC(C)(C)C 62a_100000211941_200012352035 [0,2,0,0,0,0|2,0,0]=4 3899 B13R1.151 Cc1cccc(c1Cl)SC(C)(C)C 62a_200012352035_100000211941 [0,2,0,0,0,0|2,0,0]=4 3900 B13R1.151 Cc1cccc(c1F)NC(C)(C)C 34a_100000697159_100000210625 [0,2,0,0,0,0|2,0,0]=4 3901 B13R1.151 Cc1cccc(c1F)OC(C)(C)C 34a_100000751311_100000210625 [0,2,0,0,0,0|2,0,0]=4 3902 B13R1.151 Cc1cccc(c1F)SC(C)(C)C 62a_100000211941_100000717567 [0,2,0,0,0,0|2,0,0]=4 3903 B13R1.151 Cc1cccc(c1F)SC(C)(C)C 62a_100000717567_100000211941 [0,2,0,0,0,0|2,0,0]=4 3904 B13R1.151 Cc1cccc(c1I)NC(C)(C)C 34a_100000761888_100000210625 [0,2,0,0,0,0|2,0,0]=4 3905 B13R1.151 Cc1cccc(c1I)OC(C)(C)C 34a_100010083724_100000210625 [0,2,0,0,0,0|2,0,0]=4 3906 B13R1.151 Cc1cccc(c1N)OC(C)(C)C 34a_100000743429_100000210625 [0,2,0,0,0,0|2,0,0]=4 3907 B13R1.151 Cc1cccc(c1N)SC(C)(C)C 62a_100000211941_100011834072 [0,2,0,0,0,0|2,0,0]=4 3908 B13R1.151 Cc1cccc(c1N)SC(C)(C)C 62a_100011834072_100000211941 [0,2,0,0,0,0|2,0,0]=4 3909 B13R1.151 Cc1cccc(c1O)NC(C)(C)C 34a_100000756359_100000210625 [0,2,0,0,0,0|2,0,0]=4 3910 B13R1.151 Cc1cccc(c1O)SC(C)(C)C 62a_100000211941_100009817157 [0,2,0,0,0,0|2,0,0]=4 3911 B13R1.151 Cc1cccc(c1O)SC(C)(C)C 62a_100009817157_100000211941 [0,2,0,0,0,0|2,0,0]=4 3912 B13R1.250 C#CC(C)(C)Nc1cccc(c1)Br 34a_100000210019_100000038118 [0,2,0,0,0,0|2,0,0]=4 3913 B13R1.250 C#CC(C)(C)Nc1cccc(c1)C 34a_100000188690_100000038118 [0,2,0,0,0,0|2,0,0]=4 3914 B13R1.250 C#CC(C)(C)Nc1cccc(c1)Cl 34a_100000185859_100000038118 [0,2,0,0,0,0|2,0,0]=4 3915 B13R1.250 C#CC(C)(C)Nc1cccc(c1)F 34a_100000210047_100000038118 [0,2,0,0,0,0|2,0,0]=4 3916 B13R1.250 C#CC(C)(C)Nc1cccc(c1)I 34a_100000211102_100000038118 [0,2,0,0,0,0|2,0,0]=4 3917 B13R1.250 C#CC(C)(C)Nc1cccc(c1)O 34a_100000210217_100000038118 [0,2,0,0,0,0|2,0,0]=4 3918 B13R1.250 C#CC(C)(C)Oc1cccc(c1)Br 34a_100000210342_100000038118 [0,2,0,0,0,0|2,0,0]=4 3919 B13R1.250 C#CC(C)(C)Oc1cccc(c1)C 34a_100000210337_100000038118 [0,2,0,0,0,0|2,0,0]=4 3920 B13R1.250 C#CC(C)(C)Oc1cccc(c1)Cl 34a_100000210295_100000038118 [0,2,0,0,0,0|2,0,0]=4 3921 B13R1.250 C#CC(C)(C)Oc1cccc(c1)F 34a_100000210426_100000038118 [0,2,0,0,0,0|2,0,0]=4 3922 B13R1.250 C#CC(C)(C)Oc1cccc(c1)I 34a_100000211634_100000038118 [0,2,0,0,0,0|2,0,0]=4 3923 B13R1.250 C#CC(C)(C)Oc1cccc(c1)N 34a_100000210217_100000038118 [0,2,0,0,0,0|2,0,0]=4 3924 B13R1.250 C#CC(C)(C)Sc1cccc(c1)Br 62a_100000038118_100000691529 [0,2,0,0,0,0|2,0,0]=4 3925 B13R1.250 C#CC(C)(C)Sc1cccc(c1)Br 62a_100000691529_100000038118 [0,2,0,0,0,0|2,0,0]=4 3926 B13R1.250 C#CC(C)(C)Sc1cccc(c1)C 62a_100000038118_100011215228 [0,2,0,0,0,0|2,0,0]=4 3927 B13R1.250 C#CC(C)(C)Sc1cccc(c1)C 62a_100011215228_100000038118 [0,2,0,0,0,0|2,0,0]=4 3928 B13R1.250 C#CC(C)(C)Sc1cccc(c1)Cl 62a_100000038118_100000699651 [0,2,0,0,0,0|2,0,0]=4 3929 B13R1.250 C#CC(C)(C)Sc1cccc(c1)Cl 62a_100000699651_100000038118 [0,2,0,0,0,0|2,0,0]=4 3930 B13R1.250 C#CC(C)(C)Sc1cccc(c1)F 62a_100000038118_100000685547 [0,2,0,0,0,0|2,0,0]=4 3931 B13R1.250 C#CC(C)(C)Sc1cccc(c1)F 62a_100000685547_100000038118 [0,2,0,0,0,0|2,0,0]=4 3932 B13R1.250 C#CC(C)(C)Sc1cccc(c1)N 62a_100000038118_100000210019 [0,2,0,0,0,0|2,0,0]=4 3933 B13R1.250 C#CC(C)(C)Sc1cccc(c1)N 62a_100000210019_100000038118 [0,2,0,0,0,0|2,0,0]=4 3934 B13R1.250 C#CC(C)(C)Sc1cccc(c1)O 62a_100000038118_100000211634 [0,2,0,0,0,0|2,0,0]=4 3935 B13R1.250 C#CC(C)(C)Sc1cccc(c1)[S] 62a_100000038118_114929384022 [0,2,0,0,0,0|2,0,0]=4 3936 B13R1.250 C#CC(C)(C)Sc1cccc(c1)[S] 62a_114929384022_100000038118 [0,2,0,0,0,0|2,0,0]=4 3937 B13R1.250 CC(C)(C#N)Nc1cccc(c1)Br 34a_100000210019_100011162410 [0,2,0,0,0,0|2,0,0]=4 3938 B13R1.250 CC(C)(C#N)Nc1cccc(c1)Cl 34a_100000185859_100011162410 [0,2,0,0,0,0|2,0,0]=4 3939 B13R1.250 CC(C)(C#N)Nc1cccc(c1)F 34a_100000210047_100011162410 [0,2,0,0,0,0|2,0,0]=4 3940 B13R1.250 CC(C)(C#N)Nc1cccc(c1)I 34a_100000211102_100011162410 [0,2,0,0,0,0|2,0,0]=4 3941 B13R1.250 CC(C)(C#N)Nc1cccc(c1)O 34a_100000210217_100011162410 [0,2,0,0,0,0|2,0,0]=4 3942 B13R1.250 CC(C)(C#N)Oc1cccc(c1)Br 34a_100000210342_100011162410 [0,2,0,0,0,0|2,0,0]=4 3943 B13R1.250 CC(C)(C#N)Oc1cccc(c1)Br 7a_100000210342_100011162410 [0,2,0,0,0,0|2,0,0]=4 3944 B13R1.250 CC(C)(C#N)Oc1cccc(c1)Cl 34a_100000210295_100011162410 [0,2,0,0,0,0|2,0,0]=4 3945 B13R1.250 CC(C)(C#N)Oc1cccc(c1)Cl 7a_100000210295_100011162410 [0,2,0,0,0,0|2,0,0]=4 3946 B13R1.250 CC(C)(C#N)Oc1cccc(c1)F 34a_100000210426_100011162410 [0,2,0,0,0,0|2,0,0]=4 3947 B13R1.250 CC(C)(C#N)Oc1cccc(c1)F 7a_100000210426_100011162410 [0,2,0,0,0,0|2,0,0]=4 3948 B13R1.250 CC(C)(C#N)Oc1cccc(c1)I 34a_100000211634_100011162410 [0,2,0,0,0,0|2,0,0]=4 3949 B13R1.250 CC(C)(C#N)Oc1cccc(c1)I 7a_100000211634_100011162410 [0,2,0,0,0,0|2,0,0]=4 3950 B13R1.250 CC(C)(C#N)Oc1cccc(c1)N 34a_100000210217_100011162410 [0,2,0,0,0,0|2,0,0]=4 3951 B13R1.250 CC(C)(C#N)Sc1cccc(c1)Br 62a_100000691529_100011162410 [0,2,0,0,0,0|2,0,0]=4 3952 B13R1.250 CC(C)(C#N)Sc1cccc(c1)Br 62a_100011162410_100000691529 [0,2,0,0,0,0|2,0,0]=4 3953 B13R1.250 CC(C)(C#N)Sc1cccc(c1)Cl 62a_100000699651_100011162410 [0,2,0,0,0,0|2,0,0]=4 3954 B13R1.250 CC(C)(C#N)Sc1cccc(c1)Cl 62a_100011162410_100000699651 [0,2,0,0,0,0|2,0,0]=4 3955 B13R1.250 CC(C)(C#N)Sc1cccc(c1)F 62a_100000685547_100011162410 [0,2,0,0,0,0|2,0,0]=4 3956 B13R1.250 CC(C)(C#N)Sc1cccc(c1)F 62a_100011162410_100000685547 [0,2,0,0,0,0|2,0,0]=4 3957 B13R1.250 CC(C)(C#N)Sc1cccc(c1)N 62a_100000210019_100011162410 [0,2,0,0,0,0|2,0,0]=4 3958 B13R1.250 CC(C)(C#N)Sc1cccc(c1)N 62a_100011162410_100000210019 [0,2,0,0,0,0|2,0,0]=4 3959 B13R1.250 CC(C)(C#N)Sc1cccc(c1)O 62a_100011162410_100000211634 [0,2,0,0,0,0|2,0,0]=4 3960 B13R1.250 CC(C)(C#N)Sc1cccc(c1)[S] 62a_100011162410_114929384022 [0,2,0,0,0,0|2,0,0]=4 3961 B13R1.250 CC(C)(C#N)Sc1cccc(c1)[S] 62a_114929384022_100011162410 [0,2,0,0,0,0|2,0,0]=4 3962 B13R1.250 CC(C)(CO)Nc1cc(ccn1)F 27a_100000210608_100000764206 [0,2,0,0,0,0|2,0,0]=4 3963 B13R1.250 CC(C)(CO)Nc1cc[nH]c(=O)c1 27a_100000210608_100000061649 [0,2,0,0,0,0|2,0,0]=4 3964 B13R1.250 CC(C)(CO)Nc1cccc(n1)F 27a_100000210608_100009815982 [0,2,0,0,0,0|2,0,0]=4 3965 B13R1.250 CC(C)(CO)Nc1ccnc(c1)F 27a_100000210608_100009816116 [0,2,0,0,0,0|2,0,0]=4 3966 B13R1.250 CC(C)(Cc1cccc(n1)Br)O[13CH3] 7a_100010253926_200025704644 [0,2,0,0,0,0|1,0,0]=3 3967 B13R1.250 CCC(C)(C)Oc1cccc(c1)Br 7a_100000210342_100000210677 [0,2,0,0,0,0|2,0,0]=4 3968 B13R1.250 CCC(C)(C)Oc1cccc(c1)C 7a_100000210337_100000210677 [0,2,0,0,0,0|2,0,0]=4 3969 B13R1.250 CCC(C)(C)Oc1cccc(c1)Cl 7a_100000210295_100000210677 [0,2,0,0,0,0|2,0,0]=4 3970 B13R1.250 CCC(C)(C)Oc1cccc(c1)F 7a_100000210426_100000210677 [0,2,0,0,0,0|2,0,0]=4 3971 B13R1.250 CCC(C)(C)Oc1cccc(c1)I 7a_100000211634_100000210677 [0,2,0,0,0,0|2,0,0]=4 3972 B13R1.250 CCC(C)(C)Sc1cccc(c1)Br 62a_100000032637_100000691529 [0,2,0,0,0,0|2,0,0]=4 3973 B13R1.250 CCC(C)(C)Sc1cccc(c1)Br 62a_100000691529_100000032637 [0,2,0,0,0,0|2,0,0]=4 3974 B13R1.250 CCC(C)(C)Sc1cccc(c1)C 62a_100000032637_100011215228 [0,2,0,0,0,0|2,0,0]=4 3975 B13R1.250 CCC(C)(C)Sc1cccc(c1)C 62a_100011215228_100000032637 [0,2,0,0,0,0|2,0,0]=4 3976 B13R1.250 CCC(C)(C)Sc1cccc(c1)Cl 62a_100000032637_100000699651 [0,2,0,0,0,0|2,0,0]=4 3977 B13R1.250 CCC(C)(C)Sc1cccc(c1)Cl 62a_100000699651_100000032637 [0,2,0,0,0,0|2,0,0]=4 3978 B13R1.250 CCC(C)(C)Sc1cccc(c1)F 62a_100000032637_100000685547 [0,2,0,0,0,0|2,0,0]=4 3979 B13R1.250 CCC(C)(C)Sc1cccc(c1)F 62a_100000685547_100000032637 [0,2,0,0,0,0|2,0,0]=4 3980 B13R1.250 CCC(C)(C)Sc1cccc(c1)N 62a_100000032637_100000210019 [0,2,0,0,0,0|2,0,0]=4 3981 B13R1.250 CCC(C)(C)Sc1cccc(c1)N 62a_100000210019_100000032637 [0,2,0,0,0,0|2,0,0]=4 3982 B13R1.250 CCC(C)(C)Sc1cccc(c1)O 62a_100000032637_100000211634 [0,2,0,0,0,0|2,0,0]=4 3983 B13R1.250 CCC(C)(C)Sc1cccc(c1)[S] 62a_100000032637_114929384022 [0,2,0,0,0,0|2,0,0]=4 3984 B13R1.250 CCC(C)(C)Sc1cccc(c1)[S] 62a_114929384022_100000032637 [0,2,0,0,0,0|2,0,0]=4 3985 B13R1.250 COC(C)(C)Cc1cccc(n1)Br 7a_100010253926_200000210301 [0,2,0,0,0,0|1,0,0]=3 3986 B13R1.250 Cc1cc(ccn1)NC(C)(C)CO 27a_100000210608_100000758586 [0,2,0,0,0,0|2,0,0]=4 3987 B13R1.250 Cc1cccc(c1)NC(C)(C)C#N 34a_100000188690_100011162410 [0,2,0,0,0,0|2,0,0]=4 3988 B13R1.250 Cc1cccc(c1)OC(C)(C)C#N 34a_100000210337_100011162410 [0,2,0,0,0,0|2,0,0]=4 3989 B13R1.250 Cc1cccc(c1)OC(C)(C)C#N 7a_100000210337_100011162410 [0,2,0,0,0,0|2,0,0]=4 3990 B13R1.250 Cc1cccc(c1)SC(C)(C)C#N 62a_100011162410_100011215228 [0,2,0,0,0,0|2,0,0]=4 3991 B13R1.250 Cc1cccc(c1)SC(C)(C)C#N 62a_100011215228_100011162410 [0,2,0,0,0,0|2,0,0]=4 3992 B13R1.894 CC(C)(C)Nc1cc(ccc1Br)Br 34a_100000737762_100000210625 [0,2,0,0,0,0|2,0,0]=4 3993 B13R1.894 CC(C)(C)Nc1cc(ccc1Br)Cl 34a_100000687073_100000210625 [0,2,0,0,0,0|2,0,0]=4 3994 B13R1.894 CC(C)(C)Nc1cc(ccc1Br)F 34a_100000687223_100000210625 [0,2,0,0,0,0|2,0,0]=4 3995 B13R1.894 CC(C)(C)Nc1cc(ccc1Br)O 34a_100011999798_100000210625 [0,2,0,0,0,0|2,0,0]=4 3996 B13R1.894 CC(C)(C)Nc1cc(ccc1Cl)Br 34a_100000750497_100000210625 [0,2,0,0,0,0|2,0,0]=4 3997 B13R1.894 CC(C)(C)Nc1cc(ccc1Cl)Cl 34a_100000184485_100000210625 [0,2,0,0,0,0|2,0,0]=4 3998 B13R1.894 CC(C)(C)Nc1cc(ccc1Cl)F 34a_100000751338_100000210625 [0,2,0,0,0,0|2,0,0]=4 3999 B13R1.894 CC(C)(C)Nc1cc(ccc1Cl)I 34a_200000761891_100000210625 [0,2,0,0,0,0|2,0,0]=4 4000 B13R1.894 CC(C)(C)Nc1cc(ccc1Cl)O 34a_100011934297_100000210625 [0,2,0,0,0,0|2,0,0]=4 4001 B13R1.894 CC(C)(C)Nc1cc(ccc1F)Br 34a_100000740924_100000210625 [0,2,0,0,0,0|2,0,0]=4 4002 B13R1.894 CC(C)(C)Nc1cc(ccc1F)Cl 34a_100000212115_100000210625 [0,2,0,0,0,0|2,0,0]=4 4003 B13R1.894 CC(C)(C)Nc1cc(ccc1F)F 34a_100000210742_100000210625 [0,2,0,0,0,0|2,0,0]=4 4004 B13R1.894 CC(C)(C)Nc1cc(ccc1F)I 34a_100011464823_100000210625 [0,2,0,0,0,0|2,0,0]=4 4005 B13R1.894 CC(C)(C)Nc1cc(ccc1F)O 34a_100012017239_100000210625 [0,2,0,0,0,0|2,0,0]=4 4006 B13R1.894 CC(C)(C)Nc1cc(ccc1I)Br 34a_100000743836_100000210625 [0,2,0,0,0,0|2,0,0]=4 4007 B13R1.894 CC(C)(C)Nc1cc(ccc1I)Cl 34a_100000761886_100000210625 [0,2,0,0,0,0|2,0,0]=4 4008 B13R1.894 CC(C)(C)Nc1cc(ccc1I)F 34a_100011218093_100000210625 [0,2,0,0,0,0|2,0,0]=4 4009 B13R1.894 CC(C)(C)Nc1cc(ccc1O)Br 34a_100000752626_100000210625 [0,2,0,0,0,0|2,0,0]=4 4010 B13R1.894 CC(C)(C)Nc1cc(ccc1O)Cl 34a_100000210500_100000210625 [0,2,0,0,0,0|2,0,0]=4 4011 B13R1.894 CC(C)(C)Nc1cc(ccc1O)F 34a_100000759472_100000210625 [0,2,0,0,0,0|2,0,0]=4 4012 B13R1.894 CC(C)(C)Oc1cc(ccc1Br)Br 34a_100011220040_100000210625 [0,2,0,0,0,0|2,0,0]=4 4013 B13R1.894 CC(C)(C)Oc1cc(ccc1Br)Cl 34a_100012339455_100000210625 [0,2,0,0,0,0|2,0,0]=4 4014 B13R1.894 CC(C)(C)Oc1cc(ccc1Br)F 34a_100000690578_100000210625 [0,2,0,0,0,0|2,0,0]=4 4015 B13R1.894 CC(C)(C)Oc1cc(ccc1Br)I 34a_100012356990_100000210625 [0,2,0,0,0,0|2,0,0]=4 4016 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)Br 34a_100000738945_100000210625 [0,2,0,0,0,0|2,0,0]=4 4017 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)Cl 34a_100000211422_100000210625 [0,2,0,0,0,0|2,0,0]=4 4018 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)F 34a_100000692107_100000210625 [0,2,0,0,0,0|2,0,0]=4 4019 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)I 34a_100011356854_100000210625 [0,2,0,0,0,0|2,0,0]=4 4020 B13R1.894 CC(C)(C)Oc1cc(ccc1Cl)N 34a_100011934209_100000210625 [0,2,0,0,0,0|2,0,0]=4 4021 B13R1.894 CC(C)(C)Oc1cc(ccc1F)Br 34a_100000686035_100000210625 [0,2,0,0,0,0|2,0,0]=4 4022 B13R1.894 CC(C)(C)Oc1cc(ccc1F)Cl 34a_100000757397_100000210625 [0,2,0,0,0,0|2,0,0]=4 4023 B13R1.894 CC(C)(C)Oc1cc(ccc1F)F 34a_100000752141_100000210625 [0,2,0,0,0,0|2,0,0]=4 4024 B13R1.894 CC(C)(C)Oc1cc(ccc1F)I 34a_100009958187_100000210625 [0,2,0,0,0,0|2,0,0]=4 4025 B13R1.894 CC(C)(C)Oc1cc(ccc1F)N 34a_100012017398_100000210625 [0,2,0,0,0,0|2,0,0]=4 4026 B13R1.894 CC(C)(C)Oc1cc(ccc1I)Br 34a_100012344904_100000210625 [0,2,0,0,0,0|2,0,0]=4 4027 B13R1.894 CC(C)(C)Oc1cc(ccc1I)Cl 34a_100000050036_100000210625 [0,2,0,0,0,0|2,0,0]=4 4028 B13R1.894 CC(C)(C)Oc1cc(ccc1I)F 34a_100010084537_100000210625 [0,2,0,0,0,0|2,0,0]=4 4029 B13R1.894 CC(C)(C)Oc1cc(ccc1N)Br 34a_100000739049_100000210625 [0,2,0,0,0,0|2,0,0]=4 4030 B13R1.894 CC(C)(C)Oc1cc(ccc1N)Cl 34a_100000185728_100000210625 [0,2,0,0,0,0|2,0,0]=4 4031 B13R1.894 CC(C)(C)Oc1cc(ccc1N)F 34a_100000753323_100000210625 [0,2,0,0,0,0|2,0,0]=4 4032 B13R1.894 CC(C)(C)Oc1cc(ccc1N)I 34a_100000057187_100000210625 [0,2,0,0,0,0|2,0,0]=4 4033 B13R1.894 CC(C)(C)Oc1cc(ccc1N)N 34a_100025717382_100000210625 [0,2,0,0,0,0|2,0,0]=4 4034 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)Br 62a_100000211941_100011483371 [0,2,0,0,0,0|2,0,0]=4 4035 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)Br 62a_100011483371_100000211941 [0,2,0,0,0,0|2,0,0]=4 4036 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)Cl 62a_100000211941_100012339723 [0,2,0,0,0,0|2,0,0]=4 4037 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)Cl 62a_100012339723_100000211941 [0,2,0,0,0,0|2,0,0]=4 4038 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)F 62a_100000211941_100011217576 [0,2,0,0,0,0|2,0,0]=4 4039 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)F 62a_100011217576_100000211941 [0,2,0,0,0,0|2,0,0]=4 4040 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)N 62a_100000211941_100000750459 [0,2,0,0,0,0|2,0,0]=4 4041 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)N 62a_100000750459_100000211941 [0,2,0,0,0,0|2,0,0]=4 4042 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)O 62a_100000211941_100012339312 [0,2,0,0,0,0|2,0,0]=4 4043 B13R1.894 CC(C)(C)Sc1cc(ccc1Br)O 62a_100012339312_100000211941 [0,2,0,0,0,0|2,0,0]=4 4044 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)Br 62a_100000211941_100011772130 [0,2,0,0,0,0|2,0,0]=4 4045 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)Br 62a_100011772130_100000211941 [0,2,0,0,0,0|2,0,0]=4 4046 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)Cl 62a_100000211941_100000707729 [0,2,0,0,0,0|2,0,0]=4 4047 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)Cl 62a_100000707729_100000211941 [0,2,0,0,0,0|2,0,0]=4 4048 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)F 62a_100000211941_100011217299 [0,2,0,0,0,0|2,0,0]=4 4049 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)F 62a_100011217299_100000211941 [0,2,0,0,0,0|2,0,0]=4 4050 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)N 62a_100000211941_100012360549 [0,2,0,0,0,0|2,0,0]=4 4051 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)N 62a_100012360549_100000211941 [0,2,0,0,0,0|2,0,0]=4 4052 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)O 62a_100000049588_100000211941 [0,2,0,0,0,0|2,0,0]=4 4053 B13R1.894 CC(C)(C)Sc1cc(ccc1Cl)O 62a_100000211941_100000049588 [0,2,0,0,0,0|2,0,0]=4 4054 B13R1.894 CC(C)(C)Sc1cc(ccc1F)Br 62a_100000211941_100011217312 [0,2,0,0,0,0|2,0,0]=4 4055 B13R1.894 CC(C)(C)Sc1cc(ccc1F)Br 62a_100011217312_100000211941 [0,2,0,0,0,0|2,0,0]=4 4056 B13R1.894 CC(C)(C)Sc1cc(ccc1F)Cl 62a_100000211941_100011218116 [0,2,0,0,0,0|2,0,0]=4 4057 B13R1.894 CC(C)(C)Sc1cc(ccc1F)Cl 62a_100011218116_100000211941 [0,2,0,0,0,0|2,0,0]=4 4058 B13R1.894 CC(C)(C)Sc1cc(ccc1F)F 62a_100000211941_100011219198 [0,2,0,0,0,0|2,0,0]=4 4059 B13R1.894 CC(C)(C)Sc1cc(ccc1F)F 62a_100011219198_100000211941 [0,2,0,0,0,0|2,0,0]=4 4060 B13R1.894 CC(C)(C)Sc1cc(ccc1F)N 62a_100000211941_100000760356 [0,2,0,0,0,0|2,0,0]=4 4061 B13R1.894 CC(C)(C)Sc1cc(ccc1F)N 62a_100000760356_100000211941 [0,2,0,0,0,0|2,0,0]=4 4062 B13R1.894 CC(C)(C)Sc1cc(ccc1F)O 62a_100000211941_100000693481 [0,2,0,0,0,0|2,0,0]=4 4063 B13R1.894 CC(C)(C)Sc1cc(ccc1F)O 62a_100000693481_100000211941 [0,2,0,0,0,0|2,0,0]=4 4064 B13R1.894 CC(C)(C)Sc1cc(ccc1N)Br 62a_100000187925_100000211941 [0,2,0,0,0,0|2,0,0]=4 4065 B13R1.894 CC(C)(C)Sc1cc(ccc1N)Br 62a_100000211941_100000187925 [0,2,0,0,0,0|2,0,0]=4 4066 B13R1.894 CC(C)(C)Sc1cc(ccc1N)Cl 62a_100000211941_100000761889 [0,2,0,0,0,0|2,0,0]=4 4067 B13R1.894 CC(C)(C)Sc1cc(ccc1N)Cl 62a_100000761889_100000211941 [0,2,0,0,0,0|2,0,0]=4 4068 B13R1.894 CC(C)(C)Sc1cc(ccc1N)F 62a_100000211941_100000760547 [0,2,0,0,0,0|2,0,0]=4 4069 B13R1.894 CC(C)(C)Sc1cc(ccc1N)F 62a_100000760547_100000211941 [0,2,0,0,0,0|2,0,0]=4 4070 B13R1.894 CC(C)(C)Sc1cc(ccc1N)N 62a_100000211941_100011534242 [0,2,0,0,0,0|2,0,0]=4 4071 B13R1.894 CC(C)(C)Sc1cc(ccc1N)N 62a_100011534242_100000211941 [0,2,0,0,0,0|2,0,0]=4 4072 B13R1.894 CC(C)(C)Sc1cc(ccc1N)O 62a_100000211941_100012001276 [0,2,0,0,0,0|2,0,0]=4 4073 B13R1.894 CC(C)(C)Sc1cc(ccc1N)O 62a_100012001276_100000211941 [0,2,0,0,0,0|2,0,0]=4 4074 B13R1.894 CC(C)(C)Sc1cc(ccc1O)Br 62a_100000211941_100012355227 [0,2,0,0,0,0|2,0,0]=4 4075 B13R1.894 CC(C)(C)Sc1cc(ccc1O)Br 62a_100012355227_100000211941 [0,2,0,0,0,0|2,0,0]=4 4076 B13R1.894 CC(C)(C)Sc1cc(ccc1O)Cl 62a_100000211941_100011356953 [0,2,0,0,0,0|2,0,0]=4 4077 B13R1.894 CC(C)(C)Sc1cc(ccc1O)Cl 62a_100011356953_100000211941 [0,2,0,0,0,0|2,0,0]=4 4078 B13R1.894 CC(C)(C)Sc1cc(ccc1O)F 62a_100000211941_100000211999 [0,2,0,0,0,0|2,0,0]=4 4079 B13R1.894 CC(C)(C)Sc1cc(ccc1O)F 62a_100000211999_100000211941 [0,2,0,0,0,0|2,0,0]=4 4080 B13R1.894 CC(C)(C)Sc1cc(ccc1O)N 62a_100000211941_100011534360 [0,2,0,0,0,0|2,0,0]=4 4081 B13R1.894 CC(C)(C)Sc1cc(ccc1O)N 62a_100011534360_100000211941 [0,2,0,0,0,0|2,0,0]=4 4082 B13R1.894 CC(C)(C)Sc1cc(ccc1O)O 62a_100000211941_100009813629 [0,2,0,0,0,0|2,0,0]=4 4083 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)Br 34a_100000745044_100000210625 [0,2,0,0,0,0|2,0,0]=4 4084 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)C 34a_100000185781_100000210625 [0,2,0,0,0,0|2,0,0]=4 4085 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)Cl 34a_100011215360_100000210625 [0,2,0,0,0,0|2,0,0]=4 4086 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)F 34a_100000211285_100000210625 [0,2,0,0,0,0|2,0,0]=4 4087 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)I 34a_100011216686_100000210625 [0,2,0,0,0,0|2,0,0]=4 4088 B13R1.894 Cc1ccc(c(c1)NC(C)(C)C)O 34a_100011215204_100000210625 [0,2,0,0,0,0|2,0,0]=4 4089 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)Br 34a_100012002257_100000210625 [0,2,0,0,0,0|2,0,0]=4 4090 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)C 34a_100000210931_100000210625 [0,2,0,0,0,0|2,0,0]=4 4091 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)Cl 34a_100000211493_100000210625 [0,2,0,0,0,0|2,0,0]=4 4092 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)F 34a_100000759540_100000210625 [0,2,0,0,0,0|2,0,0]=4 4093 B13R1.894 Cc1ccc(c(c1)OC(C)(C)C)N 34a_100000211527_100000210625 [0,2,0,0,0,0|2,0,0]=4 4094 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)Br 62a_100000211941_100012353751 [0,2,0,0,0,0|2,0,0]=4 4095 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)Br 62a_100012353751_100000211941 [0,2,0,0,0,0|2,0,0]=4 4096 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)C 62a_100000210833_100000211941 [0,2,0,0,0,0|2,0,0]=4 4097 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)C 62a_100000211941_100000210833 [0,2,0,0,0,0|2,0,0]=4 4098 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)Cl 62a_100000211941_100012356289 [0,2,0,0,0,0|2,0,0]=4 4099 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)Cl 62a_100012356289_100000211941 [0,2,0,0,0,0|2,0,0]=4 4100 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)F 62a_100000211941_100000736223 [0,2,0,0,0,0|2,0,0]=4 4101 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)F 62a_100000736223_100000211941 [0,2,0,0,0,0|2,0,0]=4 4102 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)N 62a_100000211941_100011356834 [0,2,0,0,0,0|2,0,0]=4 4103 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)N 62a_100011356834_100000211941 [0,2,0,0,0,0|2,0,0]=4 4104 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)O 62a_100000211941_100000765521 [0,2,0,0,0,0|2,0,0]=4 4105 B13R1.894 Cc1ccc(c(c1)SC(C)(C)C)O 62a_100000765521_100000211941 [0,2,0,0,0,0|2,0,0]=4 4106 B13R1.894 Cc1ccc(cc1NC(C)(C)C)Br 34a_100000741167_100000210625 [0,2,0,0,0,0|2,0,0]=4 4107 B13R1.894 Cc1ccc(cc1NC(C)(C)C)Cl 34a_100000211374_100000210625 [0,2,0,0,0,0|2,0,0]=4 4108 B13R1.894 Cc1ccc(cc1NC(C)(C)C)F 34a_100000211107_100000210625 [0,2,0,0,0,0|2,0,0]=4 4109 B13R1.894 Cc1ccc(cc1NC(C)(C)C)O 34a_100011216113_100000210625 [0,2,0,0,0,0|2,0,0]=4 4110 B13R1.894 Cc1ccc(cc1OC(C)(C)C)Br 34a_100000685420_100000210625 [0,2,0,0,0,0|2,0,0]=4 4111 B13R1.894 Cc1ccc(cc1OC(C)(C)C)Cl 34a_100000756515_100000210625 [0,2,0,0,0,0|2,0,0]=4 4112 B13R1.894 Cc1ccc(cc1OC(C)(C)C)F 34a_100000690566_100000210625 [0,2,0,0,0,0|2,0,0]=4 4113 B13R1.894 Cc1ccc(cc1OC(C)(C)C)N 34a_100000759471_100000210625 [0,2,0,0,0,0|2,0,0]=4 4114 B13R1.894 Cc1ccc(cc1SC(C)(C)C)Br 62a_100000211941_100011344865 [0,2,0,0,0,0|2,0,0]=4 4115 B13R1.894 Cc1ccc(cc1SC(C)(C)C)Br 62a_100011344865_100000211941 [0,2,0,0,0,0|2,0,0]=4 4116 B13R1.894 Cc1ccc(cc1SC(C)(C)C)Cl 62a_100000211941_100011263213 [0,2,0,0,0,0|2,0,0]=4 4117 B13R1.894 Cc1ccc(cc1SC(C)(C)C)Cl 62a_100011263213_100000211941 [0,2,0,0,0,0|2,0,0]=4 4118 B13R1.894 Cc1ccc(cc1SC(C)(C)C)F 62a_100000211941_100011218078 [0,2,0,0,0,0|2,0,0]=4 4119 B13R1.894 Cc1ccc(cc1SC(C)(C)C)F 62a_100011218078_100000211941 [0,2,0,0,0,0|2,0,0]=4 4120 B13R1.894 Cc1ccc(cc1SC(C)(C)C)N 62a_100000211941_100000736455 [0,2,0,0,0,0|2,0,0]=4 4121 B13R1.894 Cc1ccc(cc1SC(C)(C)C)N 62a_100000736455_100000211941 [0,2,0,0,0,0|2,0,0]=4 4122 B13R1.894 Cc1ccc(cc1SC(C)(C)C)O 62a_100000211941_100011380479 [0,2,0,0,0,0|2,0,0]=4 4123 B13R1.894 Cc1ccc(cc1SC(C)(C)C)O 62a_100011380479_100000211941 [0,2,0,0,0,0|2,0,0]=4 4124 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Br)Br 34a_100012047176_100000210625 [0,2,0,0,0,0|2,0,0]=4 4125 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Br)Cl 34a_100011934539_100000210625 [0,2,0,0,0,0|2,0,0]=4 4126 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Br)F 34a_100000705686_100000210625 [0,2,0,0,0,0|2,0,0]=4 4127 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Cl)Cl 34a_100000210456_100000210625 [0,2,0,0,0,0|2,0,0]=4 4128 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Cl)F 34a_100000686136_100000210625 [0,2,0,0,0,0|2,0,0]=4 4129 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)Cl)O 34a_100000123917_100000210625 [0,2,0,0,0,0|2,0,0]=4 4130 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)F)F 34a_100000233717_100000210625 [0,2,0,0,0,0|2,0,0]=4 4131 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)I)F 34a_100011356972_100000210625 [0,2,0,0,0,0|2,0,0]=4 4132 B13R1.3421 CC(C)(C)Nc1cc(cc(c1)O)O 34a_100000043371_100000210625 [0,2,0,0,0,0|2,0,0]=4 4133 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Br)Br 34a_100010167048_100000210625 [0,2,0,0,0,0|2,0,0]=4 4134 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Br)Cl 34a_100010185897_100000210625 [0,2,0,0,0,0|2,0,0]=4 4135 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Br)F 34a_100000688818_100000210625 [0,2,0,0,0,0|2,0,0]=4 4136 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Cl)Cl 34a_100000181315_100000210625 [0,2,0,0,0,0|2,0,0]=4 4137 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Cl)F 34a_100011219751_100000210625 [0,2,0,0,0,0|2,0,0]=4 4138 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)Cl)N 34a_100000123917_100000210625 [0,2,0,0,0,0|2,0,0]=4 4139 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)F)F 34a_100000747503_100000210625 [0,2,0,0,0,0|2,0,0]=4 4140 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)I)Br 34a_100010068917_100000210625 [0,2,0,0,0,0|2,0,0]=4 4141 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)I)Cl 34a_100010068924_100000210625 [0,2,0,0,0,0|2,0,0]=4 4142 B13R1.3421 CC(C)(C)Oc1cc(cc(c1)I)F 34a_100000717995_100000210625 [0,2,0,0,0,0|2,0,0]=4 4143 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)Br 62a_100000211941_100009814770 [0,2,0,0,0,0|2,0,0]=4 4144 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)Br 62a_100009814770_100000211941 [0,2,0,0,0,0|2,0,0]=4 4145 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)Cl 62a_100000211941_100009814755 [0,2,0,0,0,0|2,0,0]=4 4146 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)Cl 62a_100009814755_100000211941 [0,2,0,0,0,0|2,0,0]=4 4147 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)F 62a_100000211941_100009814764 [0,2,0,0,0,0|2,0,0]=4 4148 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)F 62a_100009814764_100000211941 [0,2,0,0,0,0|2,0,0]=4 4149 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)N 62a_100000211941_100009814763 [0,2,0,0,0,0|2,0,0]=4 4150 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)N 62a_100009814763_100000211941 [0,2,0,0,0,0|2,0,0]=4 4151 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)O 62a_100000211941_100010068917 [0,2,0,0,0,0|2,0,0]=4 4152 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Br)O 62a_100010068917_100000211941 [0,2,0,0,0,0|2,0,0]=4 4153 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)Cl 62a_100000211941_100000747138 [0,2,0,0,0,0|2,0,0]=4 4154 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)Cl 62a_100000747138_100000211941 [0,2,0,0,0,0|2,0,0]=4 4155 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)F 62a_100000211941_100013859453 [0,2,0,0,0,0|2,0,0]=4 4156 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)F 62a_100013859453_100000211941 [0,2,0,0,0,0|2,0,0]=4 4157 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)N 62a_100000211941_100010147676 [0,2,0,0,0,0|2,0,0]=4 4158 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)N 62a_100010147676_100000211941 [0,2,0,0,0,0|2,0,0]=4 4159 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)O 62a_100000211941_100010068924 [0,2,0,0,0,0|2,0,0]=4 4160 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)Cl)O 62a_100010068924_100000211941 [0,2,0,0,0,0|2,0,0]=4 4161 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)F 62a_100000211941_100000233788 [0,2,0,0,0,0|2,0,0]=4 4162 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)F 62a_100000233788_100000211941 [0,2,0,0,0,0|2,0,0]=4 4163 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)N 62a_100000211941_100011356972 [0,2,0,0,0,0|2,0,0]=4 4164 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)N 62a_100011356972_100000211941 [0,2,0,0,0,0|2,0,0]=4 4165 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)O 62a_100000211941_100000688818 [0,2,0,0,0,0|2,0,0]=4 4166 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)F)O 62a_100000688818_100000211941 [0,2,0,0,0,0|2,0,0]=4 4167 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)N)N 62a_100000211941_100011999608 [0,2,0,0,0,0|2,0,0]=4 4168 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)N)N 62a_100011999608_100000211941 [0,2,0,0,0,0|2,0,0]=4 4169 B13R1.3421 CC(C)(C)Sc1cc(cc(c1)O)O 62a_100000211941_100009868816 [0,2,0,0,0,0|2,0,0]=4 4170 B13R1.3421 Cc1cc(cc(c1)NC(C)(C)C)Br 34a_100000695972_100000210625 [0,2,0,0,0,0|2,0,0]=4 4171 B13R1.3421 Cc1cc(cc(c1)NC(C)(C)C)C 34a_100000210930_100000210625 [0,2,0,0,0,0|2,0,0]=4 4172 B13R1.3421 Cc1cc(cc(c1)NC(C)(C)C)Cl 34a_100012022512_100000210625 [0,2,0,0,0,0|2,0,0]=4 4173 B13R1.3421 Cc1cc(cc(c1)NC(C)(C)C)F 34a_100000742734_100000210625 [0,2,0,0,0,0|2,0,0]=4 4174 B13R1.3421 Cc1cc(cc(c1)NC(C)(C)C)O 34a_100011995906_100000210625 [0,2,0,0,0,0|2,0,0]=4 4175 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)Br 34a_100011999630_100000210625 [0,2,0,0,0,0|2,0,0]=4 4176 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)C 34a_100000210933_100000210625 [0,2,0,0,0,0|2,0,0]=4 4177 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)Cl 34a_100000087485_100000210625 [0,2,0,0,0,0|2,0,0]=4 4178 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)F 34a_100011830401_100000210625 [0,2,0,0,0,0|2,0,0]=4 4179 B13R1.3421 Cc1cc(cc(c1)OC(C)(C)C)N 34a_100011995906_100000210625 [0,2,0,0,0,0|2,0,0]=4 4180 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)C 62a_100000211941_100011215608 [0,2,0,0,0,0|2,0,0]=4 4181 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)C 62a_100011215608_100000211941 [0,2,0,0,0,0|2,0,0]=4 4182 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)Cl 62a_100000211941_100010172791 [0,2,0,0,0,0|2,0,0]=4 4183 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)Cl 62a_100010172791_100000211941 [0,2,0,0,0,0|2,0,0]=4 4184 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)F 62a_100000211941_100011356977 [0,2,0,0,0,0|2,0,0]=4 4185 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)F 62a_100011356977_100000211941 [0,2,0,0,0,0|2,0,0]=4 4186 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)N 62a_100000211941_100000695972 [0,2,0,0,0,0|2,0,0]=4 4187 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)N 62a_100000695972_100000211941 [0,2,0,0,0,0|2,0,0]=4 4188 B13R1.3421 Cc1cc(cc(c1)SC(C)(C)C)O 62a_100000211941_100011999630 [0,2,0,0,0,0|2,0,0]=4 4189 B13R1.3492 CC(C)(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011667116 [0,2,0,0,0,0|1,0,1]=4 4190 B13R1.3492 CN(c1cccc(c1)Br)C(C)(C)C 269982a_100000219648_100000210625 [0,2,0,0,0,0|2,0,0]=4 4191 B13R1.3492 CN(c1cccc(c1)Br)C(C)(C)C 34a_100000219648_100000210625 [0,2,0,0,0,0|2,0,0]=4 4192 B13R1.3492 CN(c1cccc(c1)Cl)C(C)(C)C 269982a_100000220044_100000210625 [0,2,0,0,0,0|2,0,0]=4 4193 B13R1.3492 CN(c1cccc(c1)Cl)C(C)(C)C 34a_100000220044_100000210625 [0,2,0,0,0,0|2,0,0]=4 4194 B13R1.3492 CN(c1cccc(c1)F)C(C)(C)C 269982a_100020633736_100000210625 [0,2,0,0,0,0|2,0,0]=4 4195 B13R1.3492 CN(c1cccc(c1)F)C(C)(C)C 34a_100020633736_100000210625 [0,2,0,0,0,0|2,0,0]=4 4196 B13R1.3492 CN(c1cccc(c1)I)C(C)(C)C 269982a_100000221217_100000210625 [0,2,0,0,0,0|2,0,0]=4 4197 B13R1.3492 CN(c1cccc(c1)I)C(C)(C)C 34a_100000221217_100000210625 [0,2,0,0,0,0|2,0,0]=4 4198 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 269982a_100000756613_100000210625 [0,2,0,0,0,0|2,0,0]=4 4199 B13R1.3492 CN(c1cccc(c1)O)C(C)(C)C 34a_100000756613_100000210625 [0,2,0,0,0,0|2,0,0]=4 4200 B13R1.3492 Cc1cccc(c1)N(C)C(C)(C)C 269982a_100000219674_100000210625 [0,2,0,0,0,0|2,0,0]=4 4201 B13R1.3492 Cc1cccc(c1)N(C)C(C)(C)C 34a_100000219674_100000210625 [0,2,0,0,0,0|2,0,0]=4 4202 B13R1.275 C#CC(C)(C)Nc1ccccc1Br 34a_100000210017_100000038118 [0,2,0,0,0,0|2,0,0]=4 4203 B13R1.275 C#CC(C)(C)Nc1ccccc1C 34a_100015192222_100000038118 [0,2,0,0,0,0|2,0,0]=4 4204 B13R1.275 C#CC(C)(C)Nc1ccccc1Cl 34a_100000185783_100000038118 [0,2,0,0,0,0|2,0,0]=4 4205 B13R1.275 C#CC(C)(C)Nc1ccccc1F 34a_100000210422_100000038118 [0,2,0,0,0,0|2,0,0]=4 4206 B13R1.275 C#CC(C)(C)Nc1ccccc1I 34a_100000210053_100000038118 [0,2,0,0,0,0|2,0,0]=4 4207 B13R1.275 C#CC(C)(C)Nc1ccccc1O 34a_100000185747_100000038118 [0,2,0,0,0,0|2,0,0]=4 4208 B13R1.275 C#CC(C)(C)Oc1ccccc1Br 34a_100000181306_100000038118 [0,2,0,0,0,0|2,0,0]=4 4209 B13R1.275 C#CC(C)(C)Oc1ccccc1C 34a_100000210338_100000038118 [0,2,0,0,0,0|2,0,0]=4 4210 B13R1.275 C#CC(C)(C)Oc1ccccc1Cl 34a_100000210172_100000038118 [0,2,0,0,0,0|2,0,0]=4 4211 B13R1.275 C#CC(C)(C)Oc1ccccc1F 34a_100000210171_100000038118 [0,2,0,0,0,0|2,0,0]=4 4212 B13R1.275 C#CC(C)(C)Oc1ccccc1I 34a_100000739446_100000038118 [0,2,0,0,0,0|2,0,0]=4 4213 B13R1.275 C#CC(C)(C)Oc1ccccc1N 34a_100000185747_100000038118 [0,2,0,0,0,0|2,0,0]=4 4214 B13R1.275 C#CC(C)(C)Sc1ccccc1Br 62a_100000038118_100000695589 [0,2,0,0,0,0|2,0,0]=4 4215 B13R1.275 C#CC(C)(C)Sc1ccccc1Br 62a_100000695589_100000038118 [0,2,0,0,0,0|2,0,0]=4 4216 B13R1.275 C#CC(C)(C)Sc1ccccc1C 62a_100000038118_100000210755 [0,2,0,0,0,0|2,0,0]=4 4217 B13R1.275 C#CC(C)(C)Sc1ccccc1C 62a_100000210755_100000038118 [0,2,0,0,0,0|2,0,0]=4 4218 B13R1.275 C#CC(C)(C)Sc1ccccc1Cl 62a_100000038118_100000764095 [0,2,0,0,0,0|2,0,0]=4 4219 B13R1.275 C#CC(C)(C)Sc1ccccc1Cl 62a_100000764095_100000038118 [0,2,0,0,0,0|2,0,0]=4 4220 B13R1.275 C#CC(C)(C)Sc1ccccc1F 62a_100000038118_100011215700 [0,2,0,0,0,0|2,0,0]=4 4221 B13R1.275 C#CC(C)(C)Sc1ccccc1F 62a_100011215700_100000038118 [0,2,0,0,0,0|2,0,0]=4 4222 B13R1.275 C#CC(C)(C)Sc1ccccc1N 62a_100000038118_100000210017 [0,2,0,0,0,0|2,0,0]=4 4223 B13R1.275 C#CC(C)(C)Sc1ccccc1N 62a_100000210017_100000038118 [0,2,0,0,0,0|2,0,0]=4 4224 B13R1.275 C#CC(C)(C)Sc1ccccc1O 62a_100000038118_100000739446 [0,2,0,0,0,0|2,0,0]=4 4225 B13R1.275 C#CC(C)(C)Sc1ccccc1O 62a_100000739446_100000038118 [0,2,0,0,0,0|2,0,0]=4 4226 B13R1.275 CC(C)(C#N)Nc1ccccc1Br 34a_100000210017_100011162410 [0,2,0,0,0,0|2,0,0]=4 4227 B13R1.275 CC(C)(C#N)Nc1ccccc1Cl 34a_100000185783_100011162410 [0,2,0,0,0,0|2,0,0]=4 4228 B13R1.275 CC(C)(C#N)Nc1ccccc1F 34a_100000210422_100011162410 [0,2,0,0,0,0|2,0,0]=4 4229 B13R1.275 CC(C)(C#N)Nc1ccccc1I 34a_100000210053_100011162410 [0,2,0,0,0,0|2,0,0]=4 4230 B13R1.275 CC(C)(C#N)Nc1ccccc1O 34a_100000185747_100011162410 [0,2,0,0,0,0|2,0,0]=4 4231 B13R1.275 CC(C)(C#N)Oc1ccccc1Br 34a_100000181306_100011162410 [0,2,0,0,0,0|2,0,0]=4 4232 B13R1.275 CC(C)(C#N)Oc1ccccc1Br 7a_100000181306_100011162410 [0,2,0,0,0,0|2,0,0]=4 4233 B13R1.275 CC(C)(C#N)Oc1ccccc1Cl 34a_100000210172_100011162410 [0,2,0,0,0,0|2,0,0]=4 4234 B13R1.275 CC(C)(C#N)Oc1ccccc1Cl 7a_100000210172_100011162410 [0,2,0,0,0,0|2,0,0]=4 4235 B13R1.275 CC(C)(C#N)Oc1ccccc1F 34a_100000210171_100011162410 [0,2,0,0,0,0|2,0,0]=4 4236 B13R1.275 CC(C)(C#N)Oc1ccccc1F 7a_100000210171_100011162410 [0,2,0,0,0,0|2,0,0]=4 4237 B13R1.275 CC(C)(C#N)Oc1ccccc1I 34a_100000739446_100011162410 [0,2,0,0,0,0|2,0,0]=4 4238 B13R1.275 CC(C)(C#N)Oc1ccccc1I 7a_100000739446_100011162410 [0,2,0,0,0,0|2,0,0]=4 4239 B13R1.275 CC(C)(C#N)Oc1ccccc1N 34a_100000185747_100011162410 [0,2,0,0,0,0|2,0,0]=4 4240 B13R1.275 CC(C)(C#N)Oc1ccccc1N 7a_100000185747_100011162410 [0,2,0,0,0,0|2,0,0]=4 4241 B13R1.275 CC(C)(C#N)Sc1ccccc1Br 62a_100000695589_100011162410 [0,2,0,0,0,0|2,0,0]=4 4242 B13R1.275 CC(C)(C#N)Sc1ccccc1Br 62a_100011162410_100000695589 [0,2,0,0,0,0|2,0,0]=4 4243 B13R1.275 CC(C)(C#N)Sc1ccccc1Cl 62a_100000764095_100011162410 [0,2,0,0,0,0|2,0,0]=4 4244 B13R1.275 CC(C)(C#N)Sc1ccccc1Cl 62a_100011162410_100000764095 [0,2,0,0,0,0|2,0,0]=4 4245 B13R1.275 CC(C)(C#N)Sc1ccccc1F 62a_100011162410_100011215700 [0,2,0,0,0,0|2,0,0]=4 4246 B13R1.275 CC(C)(C#N)Sc1ccccc1F 62a_100011215700_100011162410 [0,2,0,0,0,0|2,0,0]=4 4247 B13R1.275 CC(C)(C#N)Sc1ccccc1N 62a_100000210017_100011162410 [0,2,0,0,0,0|2,0,0]=4 4248 B13R1.275 CC(C)(C#N)Sc1ccccc1N 62a_100011162410_100000210017 [0,2,0,0,0,0|2,0,0]=4 4249 B13R1.275 CC(C)(C#N)Sc1ccccc1O 62a_100000739446_100011162410 [0,2,0,0,0,0|2,0,0]=4 4250 B13R1.275 CC(C)(C#N)Sc1ccccc1O 62a_100011162410_100000739446 [0,2,0,0,0,0|2,0,0]=4 4251 B13R1.275 CC(C)(CO)Nc1ccncc1Br 27a_100000210608_100000726257 [0,2,0,0,0,0|2,0,0]=4 4252 B13R1.275 CC(C)(CO)Nc1ccncc1F 27a_100000210608_100000035921 [0,2,0,0,0,0|2,0,0]=4 4253 B13R1.275 CC(C)(CO)Nc1ncccc1Br 27a_100000210608_100000696092 [0,2,0,0,0,0|2,0,0]=4 4254 B13R1.275 CC(C)(Cc1ccccc1Br)N[13CH3] 2230a_100161000475_200025704644 [0,2,0,0,0,0|1,0,0]=3 4255 B13R1.275 CC(C)(Cc1ccccc1Cl)O[13CH3] 7a_100000751322_200025704644 [0,2,0,0,0,0|0,0,0]=2 4256 B13R1.275 CC(C)(Cc1ccccc1F)O[13CH3] 34a_100011350413_200025704644 [0,2,0,0,0,0|0,0,0]=2 4257 B13R1.275 CC(C)(Cc1ccccc1F)O[13CH3] 7a_100011350413_200025704644 [0,2,0,0,0,0|0,0,0]=2 4258 B13R1.275 CCC(C)(C)Oc1ccccc1Br 7a_100000181306_100000210677 [0,2,0,0,0,0|2,0,0]=4 4259 B13R1.275 CCC(C)(C)Oc1ccccc1C 7a_100000210338_100000210677 [0,2,0,0,0,0|2,0,0]=4 4260 B13R1.275 CCC(C)(C)Oc1ccccc1Cl 7a_100000210172_100000210677 [0,2,0,0,0,0|2,0,0]=4 4261 B13R1.275 CCC(C)(C)Oc1ccccc1F 7a_100000210171_100000210677 [0,2,0,0,0,0|2,0,0]=4 4262 B13R1.275 CCC(C)(C)Oc1ccccc1I 7a_100000739446_100000210677 [0,2,0,0,0,0|2,0,0]=4 4263 B13R1.275 CCC(C)(C)Oc1ccccc1N 7a_100000185747_100000210677 [0,2,0,0,0,0|2,0,0]=4 4264 B13R1.275 CCC(C)(C)Sc1ccccc1Br 62a_100000032637_100000695589 [0,2,0,0,0,0|2,0,0]=4 4265 B13R1.275 CCC(C)(C)Sc1ccccc1Br 62a_100000695589_100000032637 [0,2,0,0,0,0|2,0,0]=4 4266 B13R1.275 CCC(C)(C)Sc1ccccc1C 62a_100000032637_100000210755 [0,2,0,0,0,0|2,0,0]=4 4267 B13R1.275 CCC(C)(C)Sc1ccccc1C 62a_100000210755_100000032637 [0,2,0,0,0,0|2,0,0]=4 4268 B13R1.275 CCC(C)(C)Sc1ccccc1Cl 62a_100000032637_100000764095 [0,2,0,0,0,0|2,0,0]=4 4269 B13R1.275 CCC(C)(C)Sc1ccccc1Cl 62a_100000764095_100000032637 [0,2,0,0,0,0|2,0,0]=4 4270 B13R1.275 CCC(C)(C)Sc1ccccc1F 62a_100000032637_100011215700 [0,2,0,0,0,0|2,0,0]=4 4271 B13R1.275 CCC(C)(C)Sc1ccccc1F 62a_100011215700_100000032637 [0,2,0,0,0,0|2,0,0]=4 4272 B13R1.275 CCC(C)(C)Sc1ccccc1N 62a_100000032637_100000210017 [0,2,0,0,0,0|2,0,0]=4 4273 B13R1.275 CCC(C)(C)Sc1ccccc1N 62a_100000210017_100000032637 [0,2,0,0,0,0|2,0,0]=4 4274 B13R1.275 CCC(C)(C)Sc1ccccc1O 62a_100000032637_100000739446 [0,2,0,0,0,0|2,0,0]=4 4275 B13R1.275 CCC(C)(C)Sc1ccccc1O 62a_100000739446_100000032637 [0,2,0,0,0,0|2,0,0]=4 4276 B13R1.275 CNC(C)(C)Cc1ccccc1Br 2230a_100161000475_200000210301 [0,2,0,0,0,0|1,0,0]=3 4277 B13R1.275 COC(C)(C)Cc1ccccc1Cl 7a_100000751322_200000210301 [0,2,0,0,0,0|0,0,0]=2 4278 B13R1.275 COC(C)(C)Cc1ccccc1F 34a_100011350413_200000210301 [0,2,0,0,0,0|0,0,0]=2 4279 B13R1.275 COC(C)(C)Cc1ccccc1F 7a_100011350413_200000210301 [0,2,0,0,0,0|0,0,0]=2 4280 B13R1.275 Cc1ccccc1NC(C)(C)C#N 34a_100015192222_100011162410 [0,2,0,0,0,0|2,0,0]=4 4281 B13R1.275 Cc1ccccc1OC(C)(C)C#N 34a_100000210338_100011162410 [0,2,0,0,0,0|2,0,0]=4 4282 B13R1.275 Cc1ccccc1OC(C)(C)C#N 7a_100000210338_100011162410 [0,2,0,0,0,0|2,0,0]=4 4283 B13R1.275 Cc1ccccc1SC(C)(C)C#N 62a_100000210755_100011162410 [0,2,0,0,0,0|2,0,0]=4 4284 B13R1.275 Cc1ccccc1SC(C)(C)C#N 62a_100011162410_100000210755 [0,2,0,0,0,0|2,0,0]=4 4285 B13R1.275 Cc1cnccc1NC(C)(C)CO 27a_100000210608_100000765111 [0,2,0,0,0,0|2,0,0]=4 4286 B13R1.276 CN(c1ccccc1Br)C(C)(C)C 269982a_100020606079_100000210625 [0,2,0,0,0,0|2,0,0]=4 4287 B13R1.276 CN(c1ccccc1Br)C(C)(C)C 34a_100020606079_100000210625 [0,2,0,0,0,0|2,0,0]=4 4288 B13R1.276 CN(c1ccccc1Cl)C(C)(C)C 269982a_100000219374_100000210625 [0,2,0,0,0,0|2,0,0]=4 4289 B13R1.276 CN(c1ccccc1Cl)C(C)(C)C 34a_100000219374_100000210625 [0,2,0,0,0,0|2,0,0]=4 4290 B13R1.276 CN(c1ccccc1F)C(C)(C)C 269982a_100000220357_100000210625 [0,2,0,0,0,0|2,0,0]=4 4291 B13R1.276 CN(c1ccccc1F)C(C)(C)C 34a_100000220357_100000210625 [0,2,0,0,0,0|2,0,0]=4 4292 B13R1.276 CN(c1ccccc1O)C(C)(C)C 269982a_100000033821_100000210625 [0,2,0,0,0,0|2,0,0]=4 4293 B13R1.276 Cc1ccccc1N(C)C(C)(C)C 269982a_100000219699_100000210625 [0,2,0,0,0,0|2,0,0]=4 4294 B13R1.276 Cc1ccccc1N(C)C(C)(C)C 34a_100000219699_100000210625 [0,2,0,0,0,0|2,0,0]=4 4295 B13R1.622 C#Cc1ccccc1NC(C)(C)C 34a_100011470550_100000210625 [0,2,0,0,0,0|2,0,0]=4 4296 B13R1.622 C#Cc1ccccc1OC(C)(C)C 34a_200011470546_100000210625 [0,2,0,0,0,0|2,0,0]=4 4297 B13R1.622 C=Cc1ccccc1CC(C)(C)N 271570a_100011290941_100161000475 [0,2,0,0,0,0|1,0,0]=3 4298 B13R1.622 C=Cc1ccccc1NC(C)(C)C 34a_100012022501_100000210625 [0,2,0,0,0,0|2,0,0]=4 4299 B13R1.622 C=Cc1ccccc1OC(C)(C)C 271570a_100011290941_100010078496 [0,2,0,0,0,0|2,0,0]=4 4300 B13R1.622 C=Cc1ccccc1SC(C)(C)C 62a_100000211941_100011218376 [0,2,0,0,0,0|2,0,0]=4 4301 B13R1.622 C=Cc1ccccc1SC(C)(C)C 62a_100011218376_100000211941 [0,2,0,0,0,0|2,0,0]=4 4302 B13R1.622 CC(C)(C)Nc1ccccc1C#N 34a_100000211148_100000210625 [0,2,0,0,0,0|2,0,0]=4 4303 B13R1.622 CC(C)(C)Nc1ccccc1CO 34a_100000212039_100000210625 [0,2,0,0,0,0|2,0,0]=4 4304 B13R1.622 CC(C)(C)Oc1ccccc1C#N 34a_100000211048_100000210625 [0,2,0,0,0,0|2,0,0]=4 4305 B13R1.622 CC(C)(C)Oc1ccccc1CN 34a_100000185550_100000210625 [0,2,0,0,0,0|2,0,0]=4 4306 B13R1.622 CC(C)(C)Oc1ccccc1CO 34a_100011216872_100000210625 [0,2,0,0,0,0|2,0,0]=4 4307 B13R1.622 CC(C)(C)Oc1ccccc1S[13CH3] 62a_100010078496_200025704644 [0,2,0,0,0,0|2,0,0]=4 4308 B13R1.622 CC(C)(C)Oc1ccccc1S[13CH3] 62a_200025704644_100010078496 [0,2,0,0,0,0|2,0,0]=4 4309 B13R1.622 CC(C)(C)Sc1ccccc1C#N 62a_100000211941_100000188569 [0,2,0,0,0,0|2,0,0]=4 4310 B13R1.622 CC(C)(C)Sc1ccccc1C=O 62a_100000210073_100000211941 [0,2,0,0,0,0|2,0,0]=4 4311 B13R1.622 CC(C)(C)Sc1ccccc1C=O 62a_100000211941_100000210073 [0,2,0,0,0,0|2,0,0]=4 4312 B13R1.622 CC(C)(C)Sc1ccccc1CN 62a_100000211941_100000689332 [0,2,0,0,0,0|2,0,0]=4 4313 B13R1.622 CC(C)(C)Sc1ccccc1CN 62a_100000689332_100000211941 [0,2,0,0,0,0|2,0,0]=4 4314 B13R1.622 CC(C)(C)Sc1ccccc1CO 62a_100000187465_100000211941 [0,2,0,0,0,0|2,0,0]=4 4315 B13R1.622 CC(C)(C)Sc1ccccc1CO 62a_100000211941_100000187465 [0,2,0,0,0,0|2,0,0]=4 4316 B13R1.622 CC(C)(C)Sc1ccccc1NN 62a_100000211941_100000241748 [0,2,0,0,0,0|2,0,0]=4 4317 B13R1.622 CC(C)(C)Sc1ccccc1NN 62a_100000241748_100000211941 [0,2,0,0,0,0|2,0,0]=4 4318 B13R1.622 CC(C)(C)Sc1ccccc1N[13CH3] 34a_100011229668_200025704644 [0,2,0,0,0,0|2,0,0]=4 4319 B13R1.622 CC(C)(C)Sc1ccccc1N[13CH3] 7a_100011229668_200025704644 [0,2,0,0,0,0|2,0,0]=4 4320 B13R1.622 CC(C)(N)Cc1ccccc1S[13CH3] 62a_100161000475_200025704644 [0,2,0,0,0,0|1,0,0]=3 4321 B13R1.622 CC(C)(N)Cc1ccccc1S[13CH3] 62a_200025704644_100161000475 [0,2,0,0,0,0|1,0,0]=3 4322 B13R1.622 CCc1ccccc1NC(C)(C)C 34a_100000212081_100000210625 [0,2,0,0,0,0|2,0,0]=4 4323 B13R1.622 CCc1ccccc1OC(C)(C)C 34a_100000210936_100000210625 [0,2,0,0,0,0|2,0,0]=4 4324 B13R1.622 CCc1ccccc1SC(C)(C)C 62a_100000211941_100011215823 [0,2,0,0,0,0|2,0,0]=4 4325 B13R1.622 CCc1ccccc1SC(C)(C)C 62a_100011215823_100000211941 [0,2,0,0,0,0|2,0,0]=4 4326 B13R1.622 CNc1ccccc1OC(C)(C)C 34a_100000033821_100000210625 [0,2,0,0,0,0|2,0,0]=4 4327 B13R1.622 CNc1ccccc1SC(C)(C)C 34a_100011229668_200000210301 [0,2,0,0,0,0|2,0,0]=4 4328 B13R1.622 CNc1ccccc1SC(C)(C)C 62a_100000211941_100020606079 [0,2,0,0,0,0|2,0,0]=4 4329 B13R1.622 CNc1ccccc1SC(C)(C)C 62a_100020606079_100000211941 [0,2,0,0,0,0|2,0,0]=4 4330 B13R1.622 CNc1ccccc1SC(C)(C)C 7a_100011229668_200000210301 [0,2,0,0,0,0|2,0,0]=4 4331 B13R1.622 COc1ccccc1NC(C)(C)C 34a_100000210025_100000210625 [0,2,0,0,0,0|2,0,0]=4 4332 B13R1.622 COc1ccccc1OC(C)(C)C 34a_100000210385_100000210625 [0,2,0,0,0,0|2,0,0]=4 4333 B13R1.622 COc1ccccc1SC(C)(C)C 62a_100000210334_100000211941 [0,2,0,0,0,0|2,0,0]=4 4334 B13R1.622 COc1ccccc1SC(C)(C)C 62a_100000211941_100000210334 [0,2,0,0,0,0|2,0,0]=4 4335 B13R1.622 CSc1ccccc1CC(C)(C)N 62a_100161000475_200000210301 [0,2,0,0,0,0|1,0,0]=3 4336 B13R1.622 CSc1ccccc1CC(C)(C)N 62a_200000210301_100161000475 [0,2,0,0,0,0|1,0,0]=3 4337 B13R1.622 CSc1ccccc1NC(C)(C)C 34a_100000211160_100000210625 [0,2,0,0,0,0|2,0,0]=4 4338 B13R1.622 CSc1ccccc1OC(C)(C)C 34a_100011216402_100000210625 [0,2,0,0,0,0|2,0,0]=4 4339 B13R1.622 CSc1ccccc1OC(C)(C)C 62a_100010078496_200000210301 [0,2,0,0,0,0|2,0,0]=4 4340 B13R1.622 CSc1ccccc1OC(C)(C)C 62a_200000210301_100010078496 [0,2,0,0,0,0|2,0,0]=4 4341 B13R1.622 CSc1ccccc1SC(C)(C)C 62a_100000211941_100011217816 [0,2,0,0,0,0|2,0,0]=4 4342 B13R1.622 CSc1ccccc1SC(C)(C)C 62a_100011217816_100000211941 [0,2,0,0,0,0|2,0,0]=4 4343 B13R1.3788 CC(C)(C)Nc1c(cccc1Br)Br 34a_100000690995_100000210625 [0,2,0,0,0,0|2,0,0]=4 4344 B13R1.3788 CC(C)(C)Nc1c(cccc1Br)Cl 34a_100102946385_100000210625 [0,2,0,0,0,0|2,0,0]=4 4345 B13R1.3788 CC(C)(C)Nc1c(cccc1Br)F 34a_100000684712_100000210625 [0,2,0,0,0,0|2,0,0]=4 4346 B13R1.3788 CC(C)(C)Nc1c(cccc1Br)O 34a_100011934926_100000210625 [0,2,0,0,0,0|2,0,0]=4 4347 B13R1.3788 CC(C)(C)Nc1c(cccc1Cl)Cl 34a_100000210028_100000210625 [0,2,0,0,0,0|2,0,0]=4 4348 B13R1.3788 CC(C)(C)Nc1c(cccc1Cl)F 34a_100000760031_100000210625 [0,2,0,0,0,0|2,0,0]=4 4349 B13R1.3788 CC(C)(C)Nc1c(cccc1Cl)O 34a_100012022510_100000210625 [0,2,0,0,0,0|2,0,0]=4 4350 B13R1.3788 CC(C)(C)Nc1c(cccc1F)F 34a_100000210704_100000210625 [0,2,0,0,0,0|2,0,0]=4 4351 B13R1.3788 CC(C)(C)Nc1c(cccc1F)O 34a_100020591140_100000210625 [0,2,0,0,0,0|2,0,0]=4 4352 B13R1.3788 CC(C)(C)Nc1c(cccc1I)F 34a_100000042321_100000210625 [0,2,0,0,0,0|2,0,0]=4 4353 B13R1.3788 CC(C)(C)Oc1c(cccc1Br)Br 34a_100000736428_100000210625 [0,2,0,0,0,0|2,0,0]=4 4354 B13R1.3788 CC(C)(C)Oc1c(cccc1Br)Cl 34a_100010214474_100000210625 [0,2,0,0,0,0|2,0,0]=4 4355 B13R1.3788 CC(C)(C)Oc1c(cccc1Br)F 34a_100009813666_100000210625 [0,2,0,0,0,0|2,0,0]=4 4356 B13R1.3788 CC(C)(C)Oc1c(cccc1Br)N 34a_100011934915_100000210625 [0,2,0,0,0,0|2,0,0]=4 4357 B13R1.3788 CC(C)(C)Oc1c(cccc1Cl)Cl 34a_100000211709_100000210625 [0,2,0,0,0,0|2,0,0]=4 4358 B13R1.3788 CC(C)(C)Oc1c(cccc1Cl)F 34a_100000694953_100000210625 [0,2,0,0,0,0|2,0,0]=4 4359 B13R1.3788 CC(C)(C)Oc1c(cccc1Cl)N 34a_100000754742_100000210625 [0,2,0,0,0,0|2,0,0]=4 4360 B13R1.3788 CC(C)(C)Oc1c(cccc1F)F 34a_100000230165_100000210625 [0,2,0,0,0,0|2,0,0]=4 4361 B13R1.3788 CC(C)(C)Oc1c(cccc1F)N 34a_100011934987_100000210625 [0,2,0,0,0,0|2,0,0]=4 4362 B13R1.3788 CC(C)(C)Oc1c(cccc1I)Br 34a_100010084509_100000210625 [0,2,0,0,0,0|2,0,0]=4 4363 B13R1.3788 CC(C)(C)Oc1c(cccc1I)Cl 34a_100010202889_100000210625 [0,2,0,0,0,0|2,0,0]=4 4364 B13R1.3788 CC(C)(C)Oc1c(cccc1I)F 34a_100010186298_100000210625 [0,2,0,0,0,0|2,0,0]=4 4365 B13R1.3788 CC(C)(C)Oc1c(cccc1I)N 34a_100010084371_100000210625 [0,2,0,0,0,0|2,0,0]=4 4366 B13R1.3788 CC(C)(C)Oc1c(cccc1N)N 34a_200016994477_100000210625 [0,2,0,0,0,0|2,0,0]=4 4367 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)Br 62a_100000211941_100009994525 [0,2,0,0,0,0|2,0,0]=4 4368 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)Br 62a_100009994525_100000211941 [0,2,0,0,0,0|2,0,0]=4 4369 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)Cl 62a_100000211941_100010214488 [0,2,0,0,0,0|2,0,0]=4 4370 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)Cl 62a_100010214488_100000211941 [0,2,0,0,0,0|2,0,0]=4 4371 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)F 62a_100000211941_100011219512 [0,2,0,0,0,0|2,0,0]=4 4372 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)F 62a_100011219512_100000211941 [0,2,0,0,0,0|2,0,0]=4 4373 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)N 62a_100000211941_100020590159 [0,2,0,0,0,0|2,0,0]=4 4374 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)N 62a_100020590159_100000211941 [0,2,0,0,0,0|2,0,0]=4 4375 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)O 62a_100000211941_100010187912 [0,2,0,0,0,0|2,0,0]=4 4376 B13R1.3788 CC(C)(C)Sc1c(cccc1Br)O 62a_100010187912_100000211941 [0,2,0,0,0,0|2,0,0]=4 4377 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)Cl 62a_100000034237_100000211941 [0,2,0,0,0,0|2,0,0]=4 4378 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)Cl 62a_100000211941_100000034237 [0,2,0,0,0,0|2,0,0]=4 4379 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)F 62a_100000050007_100000211941 [0,2,0,0,0,0|2,0,0]=4 4380 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)F 62a_100000211941_100000050007 [0,2,0,0,0,0|2,0,0]=4 4381 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)N 62a_100000049713_100000211941 [0,2,0,0,0,0|2,0,0]=4 4382 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)N 62a_100000211941_100000049713 [0,2,0,0,0,0|2,0,0]=4 4383 B13R1.3788 CC(C)(C)Sc1c(cccc1Cl)O 62a_100000211941_100000050174 [0,2,0,0,0,0|2,0,0]=4 4384 B13R1.3788 CC(C)(C)Sc1c(cccc1F)F 62a_100000211941_100000693133 [0,2,0,0,0,0|2,0,0]=4 4385 B13R1.3788 CC(C)(C)Sc1c(cccc1F)F 62a_100000693133_100000211941 [0,2,0,0,0,0|2,0,0]=4 4386 B13R1.3788 CC(C)(C)Sc1c(cccc1F)N 62a_100000211941_100000690935 [0,2,0,0,0,0|2,0,0]=4 4387 B13R1.3788 CC(C)(C)Sc1c(cccc1F)N 62a_100000690935_100000211941 [0,2,0,0,0,0|2,0,0]=4 4388 B13R1.3788 CC(C)(C)Sc1c(cccc1F)O 62a_100000211941_100009820682 [0,2,0,0,0,0|2,0,0]=4 4389 B13R1.3788 CC(C)(C)Sc1c(cccc1F)O 62a_100009820682_100000211941 [0,2,0,0,0,0|2,0,0]=4 4390 B13R1.3788 CC(C)(C)Sc1c(cccc1O)N 62a_100000211941_100012183704 [0,2,0,0,0,0|2,0,0]=4 4391 B13R1.3788 CC(C)(C)Sc1c(cccc1O)N 62a_100012183704_100000211941 [0,2,0,0,0,0|2,0,0]=4 4392 B13R1.3788 CC(C)(C)Sc1c(cccc1O)O 62a_100000211941_100010205330 [0,2,0,0,0,0|2,0,0]=4 4393 B13R1.3788 Cc1cccc(c1NC(C)(C)C)Br 34a_100011834072_100000210625 [0,2,0,0,0,0|2,0,0]=4 4394 B13R1.3788 Cc1cccc(c1NC(C)(C)C)C 34a_100000185769_100000210625 [0,2,0,0,0,0|2,0,0]=4 4395 B13R1.3788 Cc1cccc(c1NC(C)(C)C)Cl 34a_100000756524_100000210625 [0,2,0,0,0,0|2,0,0]=4 4396 B13R1.3788 Cc1cccc(c1NC(C)(C)C)F 34a_100000766463_100000210625 [0,2,0,0,0,0|2,0,0]=4 4397 B13R1.3788 Cc1cccc(c1NC(C)(C)C)O 34a_100000743429_100000210625 [0,2,0,0,0,0|2,0,0]=4 4398 B13R1.3788 Cc1cccc(c1OC(C)(C)C)Br 34a_100009817157_100000210625 [0,2,0,0,0,0|2,0,0]=4 4399 B13R1.3788 Cc1cccc(c1OC(C)(C)C)C 34a_100000210341_100000210625 [0,2,0,0,0,0|2,0,0]=4 4400 B13R1.3788 Cc1cccc(c1OC(C)(C)C)Cl 34a_100000033731_100000210625 [0,2,0,0,0,0|2,0,0]=4 4401 B13R1.3788 Cc1cccc(c1OC(C)(C)C)F 34a_100011659162_100000210625 [0,2,0,0,0,0|2,0,0]=4 4402 B13R1.3788 Cc1cccc(c1OC(C)(C)C)N 34a_100000756359_100000210625 [0,2,0,0,0,0|2,0,0]=4 4403 B13R1.3788 Cc1cccc(c1SC(C)(C)C)Br 62a_100000211941_100010141302 [0,2,0,0,0,0|2,0,0]=4 4404 B13R1.3788 Cc1cccc(c1SC(C)(C)C)Br 62a_100010141302_100000211941 [0,2,0,0,0,0|2,0,0]=4 4405 B13R1.3788 Cc1cccc(c1SC(C)(C)C)C 62a_100000033847_100000211941 [0,2,0,0,0,0|2,0,0]=4 4406 B13R1.3788 Cc1cccc(c1SC(C)(C)C)C 62a_100000211941_100000033847 [0,2,0,0,0,0|2,0,0]=4 4407 B13R1.3788 Cc1cccc(c1SC(C)(C)C)Cl 62a_100000043165_100000211941 [0,2,0,0,0,0|2,0,0]=4 4408 B13R1.3788 Cc1cccc(c1SC(C)(C)C)Cl 62a_100000211941_100000043165 [0,2,0,0,0,0|2,0,0]=4 4409 B13R1.3788 Cc1cccc(c1SC(C)(C)C)F 62a_100000211941_100011218421 [0,2,0,0,0,0|2,0,0]=4 4410 B13R1.3788 Cc1cccc(c1SC(C)(C)C)F 62a_100011218421_100000211941 [0,2,0,0,0,0|2,0,0]=4 4411 B13R1.3788 Cc1cccc(c1SC(C)(C)C)N 62a_100000211941_100000684715 [0,2,0,0,0,0|2,0,0]=4 4412 B13R1.3788 Cc1cccc(c1SC(C)(C)C)N 62a_100000684715_100000211941 [0,2,0,0,0,0|2,0,0]=4 4413 B13R1.3788 Cc1cccc(c1SC(C)(C)C)O 62a_100000211941_100000686692 [0,2,0,0,0,0|2,0,0]=4 4414 B13R1.3788 Cc1cccc(c1SC(C)(C)C)O 62a_100000686692_100000211941 [0,2,0,0,0,0|2,0,0]=4 4415 B13R1.263 C#CC(C)(C)C(=O)c1ccccc1 1458a_100000185807_100000038118 [0,2,0,0,0,0|1,0,1]=4 4416 B13R1.263 C#CC(C)(C)N(C)c1ccccc1 34a_100000210012_100000038118 [0,2,0,0,0,0|2,0,0]=4 4417 B13R1.263 CC(C)(C#N)N([13CH3])c1ccccc1 34a_100000186197_200025704644 [0,2,0,0,0,0|2,0,0]=4 4418 B13R1.263 CC(C)(C#N)N([13CH3])c1ccccc1 7a_100000186197_200025704644 [0,2,0,0,0,0|2,0,0]=4 4419 B13R1.263 CC(C)(O[13CH3])C(=O)c1ccccc1 34a_100011217161_200025704644 [0,2,0,0,0,0|0,0,1]=3 4420 B13R1.263 CC(C)(O[13CH3])C(=O)c1ccccc1 7a_100011217161_200025704644 [0,2,0,0,0,0|0,0,1]=3 4421 B13R1.263 CC(C)(S[13CH3])C(=O)c1ccccc1 62a_200009813919_200025704644 [0,2,0,0,0,0|0,1,1]=4 4422 B13R1.263 CC(C)(S[13CH3])C(=O)c1ccccc1 62a_200025704644_200009813919 [0,2,0,0,0,0|0,1,1]=4 4423 B13R1.263 CCC(C)(C)N(C)c1ccccc1 269982a_100000210012_100000032637 [0,2,0,0,0,0|2,0,0]=4 4424 B13R1.263 CN(c1ccccc1)C(C)(C)C#N 269982a_100000210012_100011162410 [0,2,0,0,0,0|2,0,0]=4 4425 B13R1.263 CN(c1ccccc1)C(C)(C)C#N 34a_100000186197_200000210301 [0,2,0,0,0,0|2,0,0]=4 4426 B13R1.263 CN(c1ccccc1)C(C)(C)C#N 34a_100000210012_100011162410 [0,2,0,0,0,0|2,0,0]=4 4427 B13R1.263 CN(c1ccccc1)C(C)(C)C#N 7a_100000186197_200000210301 [0,2,0,0,0,0|2,0,0]=4 4428 B13R1.263 CNC(C)(C)C(=O)c1ccccc1 2230a_106832991635_200009813919 [0,2,0,0,0,0|1,0,1]=4 4429 B13R1.263 CNC(C)(C)C(=O)c1ccccc1 7a_106832991635_200009813919 [0,2,0,0,0,0|1,0,1]=4 4430 B13R1.263 COC(C)(C)C(=O)c1ccccc1 34a_100011217161_200000210301 [0,2,0,0,0,0|0,0,1]=3 4431 B13R1.263 COC(C)(C)C(=O)c1ccccc1 7a_100011217161_200000210301 [0,2,0,0,0,0|0,0,1]=3 4432 B13R1.263 CSC(C)(C)C(=O)c1ccccc1 62a_200000210301_200009813919 [0,2,0,0,0,0|0,1,1]=4 4433 B13R1.263 CSC(C)(C)C(=O)c1ccccc1 62a_200009813919_200000210301 [0,2,0,0,0,0|0,1,1]=4 4434 B13R1.1073 CC(=O)C(C)(C)Cc1ccccc1 1458a_100000757416_200000210301 [0,2,0,0,0,0|0,0,1]=3 4435 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 1458a_100000743201_200000210301 [0,2,0,0,0,0|1,0,1]=4 4436 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 7a_100000210340_100000075568 [0,2,0,0,0,0|1,0,1]=4 4437 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000075568_100000041952 [0,2,0,0,0,0|1,0,1]=4 4438 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000719477_100000075568 [0,2,0,0,0,0|1,0,1]=4 4439 B13R1.1073 CC(C)(Cc1ccccc1)C(=O)[13CH3] 1458a_100000757416_200025704644 [0,2,0,0,0,0|0,0,1]=3 4440 B13R1.1073 CC(C)(Nc1ccccc1)C(=O)N 34a_100000106764_100000702505 [0,2,0,0,0,0|1,0,1]=4 4441 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)N 34a_100000210340_100000702505 [0,2,0,0,0,0|1,0,1]=4 4442 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)N 7a_100000210340_100000702505 [0,2,0,0,0,0|1,0,1]=4 4443 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)[13CH3] 1458a_100000743201_200025704644 [0,2,0,0,0,0|1,0,1]=4 4444 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)N 62a_100000702505_100000041952 [0,2,0,0,0,0|1,0,1]=4 4445 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)N 62a_100000719477_100000702505 [0,2,0,0,0,0|1,0,1]=4 4446 B13R1.1073 CC(C)(Sc1ccccc1)[N+](=O)[O-] 62a_100000719477_200009813997 [0,2,0,0,0,0|1,0,1]=4 4447 B13R1.1073 CC(C)(Sc1ccccc1)[N+](=O)[O-] 62a_200009813997_100000041952 [0,2,0,0,0,0|1,0,1]=4 4448 B13R1.1073 CN(C)C(C)(C)Sc1ccccc1 62a_100000719477_217856628674 [0,2,0,0,0,0|2,0,0]=4 4449 B13R1.1073 CN(C)C(C)(C)Sc1ccccc1 62a_217856628674_100000041952 [0,2,0,0,0,0|2,0,0]=4 4450 B13R1.1327 CC(C)(Cc1ccccc1)OCF 7a_100011215222_100015361967 [0,2,0,0,0,0|0,0,0]=2 4451 B13R1.1327 CCOC(C)(C)Cc1ccccc1 7a_100011215222_100000210202 [0,2,0,0,0,0|0,0,0]=2 4452 B13R1.3080 CCC(C)(CC)Oc1ccccc1 7a_100000210340_100009817345 [0,2,0,0,0,0|2,0,0]=4 4453 B13R1.3080 CCC(C)(CC)Sc1ccccc1 62a_100000719477_100009817345 [0,2,0,0,0,0|2,0,0]=4 4454 B13R1.3080 CCC(C)(CC)Sc1ccccc1 62a_100009817345_100000041952 [0,2,0,0,0,0|2,0,0]=4 4455 B13R1.3080 CCC(C)(Cc1ccccc1)OC 7a_100011346069_200000210301 [0,2,0,0,0,0|0,0,0]=2 4456 B13R1.3080 CCC(C)(Cc1ccccc1)O[13CH3] 7a_100011346069_200025704644 [0,2,0,0,0,0|0,0,0]=2 4457 B13R1.719 CC(C)(C)C(N[13CH3])c1ccccc1 2230a_100000738585_200025704644 [0,2,0,0,0,0|1,0,0]=3 4458 B13R1.719 CCN(c1ccccc1)C(C)(C)C 269982a_100000210013_100000210625 [0,2,0,0,0,0|2,0,0]=4 4459 B13R1.719 CCN(c1ccccc1)C(C)(C)C 34a_100000210013_100000210625 [0,2,0,0,0,0|2,0,0]=4 4460 B13R1.719 CNC(c1ccccc1)C(C)(C)C 2230a_100000738585_200000210301 [0,2,0,0,0,0|1,0,0]=3 4461 B13R1.719 CNC(c1ccccc1)C(C)(C)O 269862a_106832991636_100011217161 [0,2,0,0,0,0|0,0,0]=2 4462 B11R1.510 CC(C)(O)C=Cc1ccco1 271570a_200016258132_100009814098 [0,0,1,1,0,0|1,0,1]=4 4463 B11R1.510 CC(C)(O)C=Cc1cccs1 271570a_200016258132_100011215356 [0,0,1,1,0,0|1,0,1]=4 4464 B11R1.510 CC(C)(O)C=Cc1ccoc1 271570a_200016258132_100011215275 [0,0,1,1,0,0|1,0,1]=4 4465 B11R1.510 CC(C)(O)C=Cc1ccsc1 271570a_200016258132_100000738268 [0,0,1,1,0,0|1,0,1]=4 4466 B11R1.510 CC(C)(O)COc1ccsc1 34a_100000106738_100000764493 [0,0,1,1,0,0|2,0,0]=4 4467 B11R1.510 CC(C)(O)COc1ccsc1 7a_100000106738_100000764493 [0,0,1,1,0,0|2,0,0]=4 4468 B11R1.510 CC(C)(O)CSc1ccco1 62a_100000764493_100009814098 [0,0,1,1,0,0|2,0,0]=4 4469 B11R1.510 CC(C)(O)CSc1ccco1 62a_100009814098_100000764493 [0,0,1,1,0,0|2,0,0]=4 4470 B11R1.510 CC(C)(O)CSc1cccs1 62a_100000764493_100011215356 [0,0,1,1,0,0|2,0,0]=4 4471 B11R1.510 CC(C)(O)CSc1cccs1 62a_100011215356_100000764493 [0,0,1,1,0,0|2,0,0]=4 4472 B11R1.510 CC(C)(O)CSc1ccoc1 62a_100000764493_100011215275 [0,0,1,1,0,0|2,0,0]=4 4473 B11R1.510 CC(C)(O)CSc1ccoc1 62a_100011215275_100000764493 [0,0,1,1,0,0|2,0,0]=4 4474 B11R1.510 CC(C)(O)CSc1ccsc1 62a_100000738268_100000764493 [0,0,1,1,0,0|2,0,0]=4 4475 B11R1.510 CC(C)(O)CSc1ccsc1 62a_100000764493_100000738268 [0,0,1,1,0,0|2,0,0]=4 4476 B11R1.345 C=CC=CC(=O)CC1(CO1)C 1458a_100016291481_100000760498 [0,0,1,1,0,0|1,0,0]=3 4477 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [1,0,0,1,0,0|1,0,0]=3 4478 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [1,0,0,1,0,0|1,0,0]=3 4479 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [1,0,0,1,0,0|1,0,0]=3 4480 B11R2.10 CN1Cc2cccnc2C1 269982a_100000726175_200000210301 [1,0,0,1,0,0|2,0,0]=4 4481 B11R2.10 CN1Cc2ccncc2C1 2230a_100000730608_200000210301 [1,0,0,1,0,0|2,0,0]=4 4482 B11R2.10 CN1Cc2ccncc2C1 269982a_100000730608_200000210301 [1,0,0,1,0,0|2,0,0]=4 4483 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [1,0,0,1,0,0|1,0,0]=3 4484 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [1,0,0,1,0,0|1,0,0]=3 4485 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [1,0,0,1,0,0|1,0,0]=3 4486 B11R2.10 [13CH3]N1Cc2cccnc2C1 269982a_100000726175_200025704644 [1,0,0,1,0,0|2,0,0]=4 4487 B11R2.10 [13CH3]N1Cc2ccncc2C1 2230a_100000730608_200025704644 [1,0,0,1,0,0|2,0,0]=4 4488 B11R2.10 [13CH3]N1Cc2ccncc2C1 269982a_100000730608_200025704644 [1,0,0,1,0,0|2,0,0]=4 4489 B11R2.238 c1cc(ccn1)OC2CC2 34a_100000212176_100000211595 [1,0,0,1,0,0|2,0,0]=4 4490 B11R2.238 c1cc(ccn1)SC2CC2 62a_100000728582_100000211595 [1,0,0,1,0,0|2,0,0]=4 4491 B11R2.238 c1ccc(cc1)NC2CC2 34a_100000106764_100000211595 [1,0,0,1,0,0|1,0,0]=3 4492 B11R2.238 c1ccc(cc1)OC2CC2 34a_100000210340_100000211595 [1,0,0,1,0,0|1,0,0]=3 4493 B11R2.238 c1ccc(cc1)SC2CC2 62a_100000719477_100000211595 [1,0,0,1,0,0|1,0,0]=3 4494 B11R2.238 c1ccc(nc1)SC2CC2 62a_100011216584_100000211595 [1,0,0,1,0,0|2,0,0]=4 4495 B11R2.238 c1cncc(c1)OC2CC2 34a_100000210849_100000211595 [1,0,0,1,0,0|2,0,0]=4 4496 B11R2.238 c1cncc(c1)SC2CC2 62a_100000210063_100000211595 [1,0,0,1,0,0|2,0,0]=4 4497 B13R2.173 CC1(CN(C1)c2cccnn2)O 27a_100000718560_100016991348 [0,0,0,1,0,1|2,0,0]=4 4498 B13R2.173 CC1(CN(C1)c2ccncn2)O 27a_100000718560_100000703185 [0,0,0,1,0,1|2,0,0]=4 4499 B13R2.173 CC1(CN(C1)c2cnccn2)O 27a_100000718560_100000211759 [0,0,0,1,0,1|2,0,0]=4 4500 B13R2.173 CC1(CN(C1)c2ncccn2)O 27a_100000718560_100000211032 [0,0,0,1,0,1|2,0,0]=4 4501 B13R2.3203 CC1(CC1)NCc2ccccc2 207a_100000757604_100015611070 [0,0,0,1,0,1|1,0,0]=3 4502 B13R2.3203 CC1(CC1)NCc2ccccc2 2230a_100000757604_100015291786 [0,0,0,1,0,1|1,0,0]=3 4503 B13R2.3203 CC1(CC1)NCc2ccccn2 207a_100000757604_100000209966 [0,0,0,1,0,1|2,0,0]=4 4504 B13R2.3203 CC1(CC1)NCc2ccccn2 2230a_100000757604_100000721315 [0,0,0,1,0,1|2,0,0]=4 4505 B13R2.3203 CC1(CC1)NCc2cccnc2 207a_100000757604_100000209961 [0,0,0,1,0,1|2,0,0]=4 4506 B13R2.3203 CC1(CC1)NCc2cccnc2 2230a_100000757604_100000741622 [0,0,0,1,0,1|2,0,0]=4 4507 B13R2.3203 CC1(CC1)NCc2ccncc2 207a_100000757604_100000186114 [0,0,0,1,0,1|2,0,0]=4 4508 B13R2.3203 CC1(CC1)NCc2ccncc2 2230a_100000757604_100015193705 [0,0,0,1,0,1|2,0,0]=4 4509 B13R2.3203 CC1(CC1)OCc2ccccc2 7a_100011725673_100000211182 [0,0,0,1,0,1|1,0,0]=3 4510 B13R2.3203 CC1(CC1)OCc2ccccn2 7a_100011725673_100000721315 [0,0,0,1,0,1|2,0,0]=4 4511 B13R2.3203 CC1(CC1)OCc2cccnc2 7a_100011725673_100000741622 [0,0,0,1,0,1|2,0,0]=4 4512 B13R2.3203 CC1(CC1)OCc2ccncc2 7a_100011725673_100015193705 [0,0,0,1,0,1|2,0,0]=4 4513 B13R2.3203 CC1(CO1)CNc2ccccc2 34a_100000106764_100000760498 [0,0,0,1,0,1|0,0,0]=2 4514 B13R2.3203 CC1(CO1)COc2ccccc2 34a_100000210340_100000760498 [0,0,0,1,0,1|0,0,0]=2 4515 B13R2.3203 CC1(CO1)COc2cccnc2 34a_100000210849_100000760498 [0,0,0,1,0,1|1,0,0]=3 4516 B13R2.3203 CC1(CO1)COc2ccncc2 34a_100000212176_100000760498 [0,0,0,1,0,1|1,0,0]=3 4517 B13R2.3203 CC1(CO1)COc2ccnnc2 34a_100015204005_100000760498 [0,0,0,1,0,1|2,0,0]=4 4518 B13R2.3203 CC1(CO1)CSc2ccccc2 62a_100000719477_100000760498 [0,0,0,1,0,1|0,0,0]=2 4519 B13R2.3203 CC1(CO1)CSc2ccccc2 62a_100000760498_100000041952 [0,0,0,1,0,1|0,0,0]=2 4520 B13R2.3203 CC1(CO1)CSc2ccccn2 62a_100000760498_100011216584 [0,0,0,1,0,1|1,0,0]=3 4521 B13R2.3203 CC1(CO1)CSc2ccccn2 62a_100011216584_100000760498 [0,0,0,1,0,1|1,0,0]=3 4522 B13R2.3203 CC1(CO1)CSc2cccnc2 62a_100000210063_100000760498 [0,0,0,1,0,1|1,0,0]=3 4523 B13R2.3203 CC1(CO1)CSc2cccnc2 62a_100000760498_100000210063 [0,0,0,1,0,1|1,0,0]=3 4524 B13R2.3203 CC1(CO1)CSc2cccnn2 62a_100000760498_100016991348 [0,0,0,1,0,1|2,0,0]=4 4525 B13R2.3203 CC1(CO1)CSc2cccnn2 62a_100016991348_100000760498 [0,0,0,1,0,1|2,0,0]=4 4526 B13R2.3203 CC1(CO1)CSc2ccncc2 62a_100000728582_100000760498 [0,0,0,1,0,1|1,0,0]=3 4527 B13R2.3203 CC1(CO1)CSc2ccncc2 62a_100000760498_100000728582 [0,0,0,1,0,1|1,0,0]=3 4528 B13R2.3203 CC1(CO1)CSc2ccncn2 62a_100000703185_100000760498 [0,0,0,1,0,1|2,0,0]=4 4529 B13R2.3203 CC1(CO1)CSc2ccncn2 62a_100000760498_100000703185 [0,0,0,1,0,1|2,0,0]=4 4530 B13R2.3203 CC1(CO1)CSc2ccnnc2 62a_100000732662_100000760498 [0,0,0,1,0,1|2,0,0]=4 4531 B13R2.3203 CC1(CO1)CSc2ccnnc2 62a_100000760498_100000732662 [0,0,0,1,0,1|2,0,0]=4 4532 B13R2.3203 CC1(CO1)CSc2cnccn2 62a_100000211759_100000760498 [0,0,0,1,0,1|2,0,0]=4 4533 B13R2.3203 CC1(CO1)CSc2cnccn2 62a_100000760498_100000211759 [0,0,0,1,0,1|2,0,0]=4 4534 B13R2.3203 CC1(CO1)CSc2cncnc2 62a_100000760498_100011206942 [0,0,0,1,0,1|2,0,0]=4 4535 B13R2.3203 CC1(CO1)CSc2cncnc2 62a_100011206942_100000760498 [0,0,0,1,0,1|2,0,0]=4 4536 B13R2.3203 CC1(CO1)CSc2ncccn2 62a_100000211032_100000760498 [0,0,0,1,0,1|2,0,0]=4 4537 B13R2.3203 CC1(CO1)CSc2ncccn2 62a_100000760498_100000211032 [0,0,0,1,0,1|2,0,0]=4 4538 B13R2.3203 OC1(CC1)CNc2cccnn2 27a_100011936951_100016991348 [0,0,0,1,0,1|2,0,0]=4 4539 B13R2.3203 OC1(CC1)CNc2ccncn2 27a_100011936951_100000703185 [0,0,0,1,0,1|2,0,0]=4 4540 B13R2.3203 OC1(CC1)CNc2cnccn2 27a_100011936951_100000211759 [0,0,0,1,0,1|2,0,0]=4 4541 B13R2.3203 OC1(CC1)CNc2ncccn2 27a_100011936951_100000211032 [0,0,0,1,0,1|2,0,0]=4 4542 B13R2.2988 Oc1ccc(cc1)C2CC2(F)F 271570a_203496583355_100010729999 [0,1,0,1,0,0|2,0,0]=4 4543 B13R2.3051 CC1(Oc2ccc(cc2O1)O)C 271570a_203496583355_100010187540 [0,1,0,1,0,0|1,0,0]=3 4544 B13R2.4826 CC1(Cc2cccc(c2O1)O)C 271570a_203496583355_100000741280 [0,1,0,1,0,0|0,0,0]=2 4545 B13R2.101 N#CC1(CC1)Nc2ccccc2 34a_100000106764_100009889376 [0,1,0,1,0,0|2,0,0]=4 4546 B13R2.101 N#CC1(CC1)Oc2ccccc2 34a_100000210340_100009889376 [0,1,0,1,0,0|2,0,0]=4 4547 B13R2.101 N#CC1(CC1)Sc2ccccc2 62a_100000719477_100009889376 [0,1,0,1,0,0|2,0,0]=4 4548 B13R2.101 N#CC1(CC1)Sc2ccccc2 62a_100009889376_100000041952 [0,1,0,1,0,0|2,0,0]=4 4549 B13R2.103 CC1(Cc2ccccc2C1)N[13CH3] 2230a_100000706725_200025704644 [0,1,0,1,0,0|1,0,0]=3 4550 B13R2.103 CC1(Cc2ccccc2C1)N[13CH3] 34a_100000706725_200025704644 [0,1,0,1,0,0|1,0,0]=3 4551 B13R2.103 CNC1(Cc2ccccc2C1)C 2230a_100000706725_200000210301 [0,1,0,1,0,0|1,0,0]=3 4552 B13R2.103 CNC1(Cc2ccccc2C1)C 34a_100000706725_200000210301 [0,1,0,1,0,0|1,0,0]=3 4553 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,1,0|0,0,2]=4 4554 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,1,0|0,0,2]=4 4555 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,1,0|1,0,0]=3 4556 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,1,0|1,0,0]=3 4557 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,1,0|1,0,0]=3 4558 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,1,0|1,0,0]=3 4559 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,1,0|1,0,0]=3 4560 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,1,0|1,0,0]=3 4561 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,1,0|0,0,2]=4 4562 B9R1.13 CC(C)Oc1ccsc1 34a_100000106738_100000210206 [1,0,0,0,1,0|2,0,0]=4 4563 B9R1.13 CC(C)Oc1ccsc1 7a_100000106738_100000210206 [1,0,0,0,1,0|2,0,0]=4 4564 B9R1.13 CC(C)Sc1ccco1 62a_100000210206_100009814098 [1,0,0,0,1,0|2,0,0]=4 4565 B9R1.13 CC(C)Sc1ccco1 62a_100009814098_100000210206 [1,0,0,0,1,0|2,0,0]=4 4566 B9R1.13 CC(C)Sc1cccs1 62a_100000210206_100011215356 [1,0,0,0,1,0|2,0,0]=4 4567 B9R1.13 CC(C)Sc1cccs1 62a_100011215356_100000210206 [1,0,0,0,1,0|2,0,0]=4 4568 B9R1.13 CC(C)Sc1ccoc1 62a_100000210206_100011215275 [1,0,0,0,1,0|2,0,0]=4 4569 B9R1.13 CC(C)Sc1ccoc1 62a_100011215275_100000210206 [1,0,0,0,1,0|2,0,0]=4 4570 B9R1.13 CC(C)Sc1ccsc1 62a_100000210206_100000738268 [1,0,0,0,1,0|2,0,0]=4 4571 B9R1.13 CC(C)Sc1ccsc1 62a_100000738268_100000210206 [1,0,0,0,1,0|2,0,0]=4 4572 B9R1.13 CN(C)Cc1ccco1 2230a_100000185268_200000210301 [1,0,0,0,1,0|2,0,0]=4 4573 B9R1.13 CN(C)Cc1ccco1 269982a_100000185268_200000210301 [1,0,0,0,1,0|2,0,0]=4 4574 B9R1.13 CN(C)Cc1ccco1 270004a_100102631434_100000186105 [1,0,0,0,1,0|2,0,0]=4 4575 B9R1.13 CN(C)Cc1cccs1 2230a_100000184426_200000210301 [1,0,0,0,1,0|2,0,0]=4 4576 B9R1.13 CN(C)Cc1cccs1 269982a_100000184426_200000210301 [1,0,0,0,1,0|2,0,0]=4 4577 B9R1.13 CN(C)Cc1cccs1 270004a_100102631434_100000209959 [1,0,0,0,1,0|2,0,0]=4 4578 B9R1.13 CN(C)Cc1ccoc1 270004a_100102631434_100011215517 [1,0,0,0,1,0|2,0,0]=4 4579 B9R1.13 CN(C)Cc1ccsc1 2230a_100020654213_200000210301 [1,0,0,0,1,0|2,0,0]=4 4580 B9R1.13 CN(C)Cc1ccsc1 2230a_100102631434_100011261437 [1,0,0,0,1,0|2,0,0]=4 4581 B9R1.13 CN(C)Cc1ccsc1 269982a_100020654213_200000210301 [1,0,0,0,1,0|2,0,0]=4 4582 B9R1.13 CN(C)Cc1ccsc1 269982a_100102631434_100011233845 [1,0,0,0,1,0|2,0,0]=4 4583 B9R1.13 CN(C)Cc1ccsc1 270004a_100102631434_100000188534 [1,0,0,0,1,0|2,0,0]=4 4584 B9R1.13 CN([13CH3])Cc1ccco1 2230a_100000185268_200025704644 [1,0,0,0,1,0|2,0,0]=4 4585 B9R1.13 CN([13CH3])Cc1ccco1 269982a_100000185268_200025704644 [1,0,0,0,1,0|2,0,0]=4 4586 B9R1.13 CN([13CH3])Cc1cccs1 2230a_100000184426_200025704644 [1,0,0,0,1,0|2,0,0]=4 4587 B9R1.13 CN([13CH3])Cc1cccs1 269982a_100000184426_200025704644 [1,0,0,0,1,0|2,0,0]=4 4588 B9R1.13 CN([13CH3])Cc1ccsc1 2230a_100020654213_200025704644 [1,0,0,0,1,0|2,0,0]=4 4589 B9R1.13 CN([13CH3])Cc1ccsc1 269982a_100020654213_200025704644 [1,0,0,0,1,0|2,0,0]=4 4590 B11R0.196 C=CCC(C=C)OCC(C)(C)O 34a_100000038011_100000764493 [0,0,1,0,0,1|0,0,2]=4 4591 B11R0.196 C=CCC(C=C)OCC(C)(C)O 7a_100000038011_100000764493 [0,0,1,0,0,1|0,0,2]=4 4592 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [1,0,0,0,0,1|0,0,2]=4 4593 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [1,0,0,0,0,1|0,0,2]=4 4594 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [1,0,0,0,0,1|0,0,2]=4 4595 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [1,0,0,0,0,1|0,0,2]=4 4596 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [1,0,0,0,0,1|0,0,2]=4 4597 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [1,0,0,0,0,1|0,0,2]=4 4598 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [1,0,0,0,0,1|0,0,2]=4 4599 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [1,0,0,0,0,1|0,0,2]=4 4600 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [1,0,0,0,0,1|0,0,2]=4 4601 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [1,0,0,0,0,1|0,0,2]=4 4602 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [1,0,0,0,0,1|0,0,2]=4 4603 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [1,0,0,0,0,1|0,0,2]=4 4604 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [1,0,0,0,0,1|0,0,2]=4 4605 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [1,0,0,0,0,1|0,0,1]=3 4606 B11R1.91 CC(C)C=Cc1ccccn1 271570a_100016257149_100011216584 [1,0,0,0,0,1|1,0,1]=4 4607 B11R1.91 CC(C)C=Cc1cccnc1 271570a_100016257149_100000752921 [1,0,0,0,0,1|1,0,1]=4 4608 B11R1.91 CC(C)C=Cc1ccncc1 271570a_100016257149_100000035832 [1,0,0,0,0,1|1,0,1]=4 4609 B11R1.91 CC(C)CNc1ccccc1 34a_100000106764_100000210624 [1,0,0,0,0,1|0,0,0]=2 4610 B11R1.91 CC(C)CNc1cccnn1 27a_100000210953_100016991348 [1,0,0,0,0,1|2,0,0]=4 4611 B11R1.91 CC(C)CNc1ccncn1 27a_100000210953_100000703185 [1,0,0,0,0,1|2,0,0]=4 4612 B11R1.91 CC(C)CNc1cnccn1 27a_100000210953_100000211759 [1,0,0,0,0,1|2,0,0]=4 4613 B11R1.91 CC(C)CNc1ncccn1 27a_100000210953_100000211032 [1,0,0,0,0,1|2,0,0]=4 4614 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [1,0,0,0,0,1|0,0,0]=2 4615 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [1,0,0,0,0,1|0,0,0]=2 4616 B11R1.91 CC(C)COc1cccnc1 34a_100000210849_100000210624 [1,0,0,0,0,1|1,0,0]=3 4617 B11R1.91 CC(C)COc1cccnc1 7a_100000210849_100000210760 [1,0,0,0,0,1|1,0,0]=3 4618 B11R1.91 CC(C)COc1ccncc1 34a_100000212176_100000210624 [1,0,0,0,0,1|1,0,0]=3 4619 B11R1.91 CC(C)COc1ccnnc1 34a_100015204005_100000210624 [1,0,0,0,0,1|2,0,0]=4 4620 B11R1.91 CC(C)COc1cncnc1 7a_100000754086_100000210760 [1,0,0,0,0,1|2,0,0]=4 4621 B11R1.91 CC(C)CSc1ccccc1 62a_100000210624_100000041952 [1,0,0,0,0,1|0,0,0]=2 4622 B11R1.91 CC(C)CSc1ccccc1 62a_100000719477_100000210760 [1,0,0,0,0,1|0,0,0]=2 4623 B11R1.91 CC(C)CSc1ccccn1 62a_100000210624_100011216584 [1,0,0,0,0,1|1,0,0]=3 4624 B11R1.91 CC(C)CSc1ccccn1 62a_100011216584_100000210760 [1,0,0,0,0,1|1,0,0]=3 4625 B11R1.91 CC(C)CSc1cccnc1 62a_100000210063_100000210760 [1,0,0,0,0,1|1,0,0]=3 4626 B11R1.91 CC(C)CSc1cccnc1 62a_100000210624_100000210063 [1,0,0,0,0,1|1,0,0]=3 4627 B11R1.91 CC(C)CSc1cccnn1 62a_100000210624_100016991348 [1,0,0,0,0,1|2,0,0]=4 4628 B11R1.91 CC(C)CSc1cccnn1 62a_100016991348_100000210760 [1,0,0,0,0,1|2,0,0]=4 4629 B11R1.91 CC(C)CSc1ccncc1 62a_100000210624_100000728582 [1,0,0,0,0,1|1,0,0]=3 4630 B11R1.91 CC(C)CSc1ccncc1 62a_100000728582_100000210760 [1,0,0,0,0,1|1,0,0]=3 4631 B11R1.91 CC(C)CSc1ccncn1 62a_100000210624_100000703185 [1,0,0,0,0,1|2,0,0]=4 4632 B11R1.91 CC(C)CSc1ccncn1 62a_100000703185_100000210760 [1,0,0,0,0,1|2,0,0]=4 4633 B11R1.91 CC(C)CSc1ccnnc1 62a_100000210624_100000732662 [1,0,0,0,0,1|2,0,0]=4 4634 B11R1.91 CC(C)CSc1ccnnc1 62a_100000732662_100000210760 [1,0,0,0,0,1|2,0,0]=4 4635 B11R1.91 CC(C)CSc1cnccn1 62a_100000210624_100000211759 [1,0,0,0,0,1|2,0,0]=4 4636 B11R1.91 CC(C)CSc1cnccn1 62a_100000211759_100000210760 [1,0,0,0,0,1|2,0,0]=4 4637 B11R1.91 CC(C)CSc1cncnc1 62a_100000210624_100011206942 [1,0,0,0,0,1|2,0,0]=4 4638 B11R1.91 CC(C)CSc1cncnc1 62a_100011206942_100000210760 [1,0,0,0,0,1|2,0,0]=4 4639 B11R1.91 CC(C)CSc1ncccn1 62a_100000210624_100000211032 [1,0,0,0,0,1|2,0,0]=4 4640 B11R1.91 CC(C)CSc1ncccn1 62a_100000211032_100000210760 [1,0,0,0,0,1|2,0,0]=4 4641 B11R1.91 CC(C)NCc1ccccc1 207a_100138425928_100015611070 [1,0,0,0,0,1|0,0,0]=2 4642 B11R1.91 CC(C)NCc1ccccc1 2230a_100015324214_100000210206 [1,0,0,0,0,1|0,0,0]=2 4643 B11R1.91 CC(C)NCc1ccccc1 2230a_100138425928_100015291786 [1,0,0,0,0,1|0,0,0]=2 4644 B11R1.91 CC(C)NCc1ccccc1 34a_100015324214_100000210206 [1,0,0,0,0,1|0,0,0]=2 4645 B11R1.91 CC(C)NCc1ccccc1 34a_100138425928_100015291786 [1,0,0,0,0,1|0,0,0]=2 4646 B11R1.91 CC(C)NCc1ccccn1 207a_100138425928_100000209966 [1,0,0,0,0,1|1,0,0]=3 4647 B11R1.91 CC(C)NCc1ccccn1 2230a_100138425928_100000721315 [1,0,0,0,0,1|1,0,0]=3 4648 B11R1.91 CC(C)NCc1ccccn1 34a_100138425928_100000721315 [1,0,0,0,0,1|1,0,0]=3 4649 B11R1.91 CC(C)NCc1cccnc1 207a_100138425928_100000209961 [1,0,0,0,0,1|1,0,0]=3 4650 B11R1.91 CC(C)NCc1cccnc1 2230a_100138425928_100000741622 [1,0,0,0,0,1|1,0,0]=3 4651 B11R1.91 CC(C)NCc1cccnc1 34a_100138425928_100000733263 [1,0,0,0,0,1|1,0,0]=3 4652 B11R1.91 CC(C)NCc1cccnn1 2230a_100138425928_100016990269 [1,0,0,0,0,1|2,0,0]=4 4653 B11R1.91 CC(C)NCc1cccnn1 2230a_100159270163_100000210206 [1,0,0,0,0,1|2,0,0]=4 4654 B11R1.91 CC(C)NCc1cccnn1 34a_100138425928_100016990269 [1,0,0,0,0,1|2,0,0]=4 4655 B11R1.91 CC(C)NCc1ccncc1 207a_100138425928_100000186114 [1,0,0,0,0,1|1,0,0]=3 4656 B11R1.91 CC(C)NCc1ccncc1 2230a_100138425928_100015193705 [1,0,0,0,0,1|1,0,0]=3 4657 B11R1.91 CC(C)NCc1cnccn1 2230a_100138425928_100016995436 [1,0,0,0,0,1|2,0,0]=4 4658 B11R1.91 CC(C)NCc1cnccn1 34a_100138425928_100016995436 [1,0,0,0,0,1|2,0,0]=4 4659 B11R1.91 CC(C)NCc1cncnc1 2230a_100011243677_100000210206 [1,0,0,0,0,1|2,0,0]=4 4660 B11R1.91 CC(C)NCc1cncnc1 2230a_100138425928_100015196519 [1,0,0,0,0,1|2,0,0]=4 4661 B11R1.91 CC(C)NCc1cncnc1 34a_100138425928_100015196519 [1,0,0,0,0,1|2,0,0]=4 4662 B11R1.91 CC(C)NCc1ncccn1 2230a_100138425928_100000703007 [1,0,0,0,0,1|2,0,0]=4 4663 B11R1.91 CC(C)NCc1ncccn1 34a_100138425928_100000703007 [1,0,0,0,0,1|2,0,0]=4 4664 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [1,0,0,0,0,1|0,0,0]=2 4665 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [1,0,0,0,0,1|0,0,0]=2 4666 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [1,0,0,0,0,1|0,0,0]=2 4667 B11R1.91 CC(C)OCc1ccccn1 34a_100000212225_100000721315 [1,0,0,0,0,1|1,0,0]=3 4668 B11R1.91 CC(C)OCc1cccnc1 34a_100000212225_100000733263 [1,0,0,0,0,1|1,0,0]=3 4669 B11R1.91 CC(C)OCc1cccnn1 34a_100000212225_100016990269 [1,0,0,0,0,1|2,0,0]=4 4670 B11R1.91 CC(C)OCc1cnccn1 34a_100000212225_100016995436 [1,0,0,0,0,1|2,0,0]=4 4671 B11R1.91 CC(C)OCc1cncnc1 34a_100000212225_100015196519 [1,0,0,0,0,1|2,0,0]=4 4672 B11R1.91 CC(C)OCc1ncccn1 34a_100000212225_100000703007 [1,0,0,0,0,1|2,0,0]=4 4673 B11R1.91 CC(C)SCc1ccccc1 62a_100000210206_100015291786 [1,0,0,0,0,1|0,0,0]=2 4674 B11R1.91 CC(C)SCc1ccccc1 62a_100000211182_100000210206 [1,0,0,0,0,1|0,0,0]=2 4675 B11R1.91 CC(C)SCc1ccccn1 62a_100000210206_100000721315 [1,0,0,0,0,1|1,0,0]=3 4676 B11R1.91 CC(C)SCc1ccccn1 62a_100000721315_100000210206 [1,0,0,0,0,1|1,0,0]=3 4677 B11R1.91 CC(C)SCc1cccnc1 62a_100000210206_100000741622 [1,0,0,0,0,1|1,0,0]=3 4678 B11R1.91 CC(C)SCc1cccnc1 62a_100000741622_100000210206 [1,0,0,0,0,1|1,0,0]=3 4679 B11R1.91 CC(C)SCc1cccnn1 62a_100000210206_100016990269 [1,0,0,0,0,1|2,0,0]=4 4680 B11R1.91 CC(C)SCc1cccnn1 62a_100016990269_100000210206 [1,0,0,0,0,1|2,0,0]=4 4681 B11R1.91 CC(C)SCc1ccncc1 62a_100000210206_100015193705 [1,0,0,0,0,1|1,0,0]=3 4682 B11R1.91 CC(C)SCc1ccncc1 62a_100015193705_100000210206 [1,0,0,0,0,1|1,0,0]=3 4683 B11R1.91 CC(C)SCc1cnccn1 62a_100000210206_100016995436 [1,0,0,0,0,1|2,0,0]=4 4684 B11R1.91 CC(C)SCc1cnccn1 62a_100016995436_100000210206 [1,0,0,0,0,1|2,0,0]=4 4685 B11R1.91 CC(C)SCc1cncnc1 62a_100000210206_100015196519 [1,0,0,0,0,1|2,0,0]=4 4686 B11R1.91 CC(C)SCc1cncnc1 62a_100015196519_100000210206 [1,0,0,0,0,1|2,0,0]=4 4687 B11R1.91 CC(C)SCc1ncccn1 62a_100000210206_100000703007 [1,0,0,0,0,1|2,0,0]=4 4688 B11R1.91 CC(C)SCc1ncccn1 62a_100000703007_100000210206 [1,0,0,0,0,1|2,0,0]=4 4689 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [1,0,0,0,0,1|0,0,1]=3 4690 B11R1.91 CC(O)C=Cc1ccccn1 271570a_200011019289_100011216584 [1,0,0,0,0,1|1,0,1]=4 4691 B11R1.91 CC(O)C=Cc1cccnc1 271570a_200011019289_100000752921 [1,0,0,0,0,1|1,0,1]=4 4692 B11R1.91 CC(O)C=Cc1ccncc1 271570a_200011019289_100000035832 [1,0,0,0,0,1|1,0,1]=4 4693 B11R1.91 CC(O)CNc1ccccc1 34a_100000106764_100011218427 [1,0,0,0,0,1|0,0,0]=2 4694 B11R1.91 CC(O)CNc1cccnn1 27a_100000210904_100016991348 [1,0,0,0,0,1|2,0,0]=4 4695 B11R1.91 CC(O)CNc1ccncn1 27a_100000210904_100000703185 [1,0,0,0,0,1|2,0,0]=4 4696 B11R1.91 CC(O)CNc1cnccn1 27a_100000210904_100000211759 [1,0,0,0,0,1|2,0,0]=4 4697 B11R1.91 CC(O)CNc1ncccn1 27a_100000210904_100000211032 [1,0,0,0,0,1|2,0,0]=4 4698 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [1,0,0,0,0,1|0,0,0]=2 4699 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [1,0,0,0,0,1|0,0,0]=2 4700 B11R1.91 CC(O)COc1cccnc1 34a_100000210849_100011218427 [1,0,0,0,0,1|1,0,0]=3 4701 B11R1.91 CC(O)COc1cccnc1 7a_100000210849_100011218427 [1,0,0,0,0,1|1,0,0]=3 4702 B11R1.91 CC(O)COc1ccncc1 34a_100000212176_100011218427 [1,0,0,0,0,1|1,0,0]=3 4703 B11R1.91 CC(O)COc1ccnnc1 34a_100015204005_100011218427 [1,0,0,0,0,1|2,0,0]=4 4704 B11R1.91 CC(O)COc1cncnc1 7a_100000754086_100011218427 [1,0,0,0,0,1|2,0,0]=4 4705 B11R1.91 CC(O)CSc1ccccc1 62a_100000719477_100011218427 [1,0,0,0,0,1|0,0,0]=2 4706 B11R1.91 CC(O)CSc1ccccc1 62a_100011218427_100000041952 [1,0,0,0,0,1|0,0,0]=2 4707 B11R1.91 CC(O)CSc1ccccn1 62a_100011216584_100011218427 [1,0,0,0,0,1|1,0,0]=3 4708 B11R1.91 CC(O)CSc1ccccn1 62a_100011218427_100011216584 [1,0,0,0,0,1|1,0,0]=3 4709 B11R1.91 CC(O)CSc1cccnc1 62a_100000210063_100011218427 [1,0,0,0,0,1|1,0,0]=3 4710 B11R1.91 CC(O)CSc1cccnc1 62a_100011218427_100000210063 [1,0,0,0,0,1|1,0,0]=3 4711 B11R1.91 CC(O)CSc1cccnn1 62a_100011218427_100016991348 [1,0,0,0,0,1|2,0,0]=4 4712 B11R1.91 CC(O)CSc1cccnn1 62a_100016991348_100011218427 [1,0,0,0,0,1|2,0,0]=4 4713 B11R1.91 CC(O)CSc1ccncc1 62a_100000728582_100011218427 [1,0,0,0,0,1|1,0,0]=3 4714 B11R1.91 CC(O)CSc1ccncc1 62a_100011218427_100000728582 [1,0,0,0,0,1|1,0,0]=3 4715 B11R1.91 CC(O)CSc1ccncn1 62a_100000703185_100011218427 [1,0,0,0,0,1|2,0,0]=4 4716 B11R1.91 CC(O)CSc1ccncn1 62a_100011218427_100000703185 [1,0,0,0,0,1|2,0,0]=4 4717 B11R1.91 CC(O)CSc1ccnnc1 62a_100000732662_100011218427 [1,0,0,0,0,1|2,0,0]=4 4718 B11R1.91 CC(O)CSc1ccnnc1 62a_100011218427_100000732662 [1,0,0,0,0,1|2,0,0]=4 4719 B11R1.91 CC(O)CSc1cnccn1 62a_100000211759_100011218427 [1,0,0,0,0,1|2,0,0]=4 4720 B11R1.91 CC(O)CSc1cnccn1 62a_100011218427_100000211759 [1,0,0,0,0,1|2,0,0]=4 4721 B11R1.91 CC(O)CSc1cncnc1 62a_100011206942_100011218427 [1,0,0,0,0,1|2,0,0]=4 4722 B11R1.91 CC(O)CSc1cncnc1 62a_100011218427_100011206942 [1,0,0,0,0,1|2,0,0]=4 4723 B11R1.91 CC(O)CSc1ncccn1 62a_100000211032_100011218427 [1,0,0,0,0,1|2,0,0]=4 4724 B11R1.91 CC(O)CSc1ncccn1 62a_100011218427_100000211032 [1,0,0,0,0,1|2,0,0]=4 4725 B11R1.91 CN(C)CCc1ccccc1 2230a_100000207497_200000210301 [1,0,0,0,0,1|1,0,0]=3 4726 B11R1.91 CN(C)CCc1ccccc1 2230a_100102631434_100000765856 [1,0,0,0,0,1|1,0,0]=3 4727 B11R1.91 CN(C)CCc1ccccc1 269982a_100000207497_200000210301 [1,0,0,0,0,1|1,0,0]=3 4728 B11R1.91 CN(C)CCc1ccccc1 269982a_100102631434_100000765856 [1,0,0,0,0,1|1,0,0]=3 4729 B11R1.91 CN(C)CCc1ccccn1 2230a_100000737206_200000210301 [1,0,0,0,0,1|2,0,0]=4 4730 B11R1.91 CN(C)CCc1ccccn1 2230a_100102631434_100015183660 [1,0,0,0,0,1|2,0,0]=4 4731 B11R1.91 CN(C)CCc1ccccn1 269982a_100000737206_200000210301 [1,0,0,0,0,1|2,0,0]=4 4732 B11R1.91 CN(C)CCc1ccccn1 269982a_100102631434_100015183660 [1,0,0,0,0,1|2,0,0]=4 4733 B11R1.91 CN(C)CCc1cccnc1 2230a_100000763209_200000210301 [1,0,0,0,0,1|2,0,0]=4 4734 B11R1.91 CN(C)CCc1cccnc1 2230a_100102631434_200011713674 [1,0,0,0,0,1|2,0,0]=4 4735 B11R1.91 CN(C)CCc1cccnc1 269982a_100000763209_200000210301 [1,0,0,0,0,1|2,0,0]=4 4736 B11R1.91 CN(C)CCc1cccnc1 269982a_100102631434_200011713674 [1,0,0,0,0,1|2,0,0]=4 4737 B11R1.91 CN(C)CCc1ccncc1 2230a_100000742850_200000210301 [1,0,0,0,0,1|2,0,0]=4 4738 B11R1.91 CN(C)CCc1ccncc1 2230a_100102631434_100000723409 [1,0,0,0,0,1|2,0,0]=4 4739 B11R1.91 CN(C)CCc1ccncc1 269982a_100000742850_200000210301 [1,0,0,0,0,1|2,0,0]=4 4740 B11R1.91 CN(C)CCc1ccncc1 269982a_100102631434_100000723409 [1,0,0,0,0,1|2,0,0]=4 4741 B11R1.91 CN(C)CSc1ccccc1 2230a_100102631434_100011218342 [1,0,0,0,0,1|1,0,0]=3 4742 B11R1.91 CN(C)CSc1ccccc1 269982a_100102631434_100011218342 [1,0,0,0,0,1|1,0,0]=3 4743 B11R1.91 CN([13CH3])CCc1ccccc1 2230a_100000207497_200025704644 [1,0,0,0,0,1|1,0,0]=3 4744 B11R1.91 CN([13CH3])CCc1ccccc1 269982a_100000207497_200025704644 [1,0,0,0,0,1|1,0,0]=3 4745 B11R1.91 CN([13CH3])CCc1ccccn1 2230a_100000737206_200025704644 [1,0,0,0,0,1|2,0,0]=4 4746 B11R1.91 CN([13CH3])CCc1ccccn1 269982a_100000737206_200025704644 [1,0,0,0,0,1|2,0,0]=4 4747 B11R1.91 CN([13CH3])CCc1cccnc1 2230a_100000763209_200025704644 [1,0,0,0,0,1|2,0,0]=4 4748 B11R1.91 CN([13CH3])CCc1cccnc1 269982a_100000763209_200025704644 [1,0,0,0,0,1|2,0,0]=4 4749 B11R1.91 CN([13CH3])CCc1ccncc1 2230a_100000742850_200025704644 [1,0,0,0,0,1|2,0,0]=4 4750 B11R1.91 CN([13CH3])CCc1ccncc1 269982a_100000742850_200025704644 [1,0,0,0,0,1|2,0,0]=4 4751 B11R1.91 C[C@@H](O)CNc1ccccc1 34a_100000106764_100009817552 [1,0,0,0,0,1|0,0,0]=2 4752 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [1,0,0,0,0,1|0,0,0]=2 4753 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [1,0,0,0,0,1|0,0,0]=2 4754 B11R1.91 C[C@@H](O)COc1cccnc1 34a_100000210849_100009817552 [1,0,0,0,0,1|1,0,0]=3 4755 B11R1.91 C[C@@H](O)COc1cccnc1 7a_100000210849_100009817552 [1,0,0,0,0,1|1,0,0]=3 4756 B11R1.91 C[C@@H](O)COc1ccncc1 34a_100000212176_100009817552 [1,0,0,0,0,1|1,0,0]=3 4757 B11R1.91 C[C@@H](O)COc1ccnnc1 34a_100015204005_100009817552 [1,0,0,0,0,1|2,0,0]=4 4758 B11R1.91 C[C@@H](O)COc1cncnc1 7a_100000754086_100009817552 [1,0,0,0,0,1|2,0,0]=4 4759 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100000719477_100009817552 [1,0,0,0,0,1|0,0,0]=2 4760 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100009817552_100000041952 [1,0,0,0,0,1|0,0,0]=2 4761 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100009817552_100011216584 [1,0,0,0,0,1|1,0,0]=3 4762 B11R1.91 C[C@@H](O)CSc1ccccn1 62a_100011216584_100009817552 [1,0,0,0,0,1|1,0,0]=3 4763 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100000210063_100009817552 [1,0,0,0,0,1|1,0,0]=3 4764 B11R1.91 C[C@@H](O)CSc1cccnc1 62a_100009817552_100000210063 [1,0,0,0,0,1|1,0,0]=3 4765 B11R1.91 C[C@@H](O)CSc1cccnn1 62a_100009817552_100016991348 [1,0,0,0,0,1|2,0,0]=4 4766 B11R1.91 C[C@@H](O)CSc1cccnn1 62a_100016991348_100009817552 [1,0,0,0,0,1|2,0,0]=4 4767 B11R1.91 C[C@@H](O)CSc1ccncc1 62a_100000728582_100009817552 [1,0,0,0,0,1|1,0,0]=3 4768 B11R1.91 C[C@@H](O)CSc1ccncc1 62a_100009817552_100000728582 [1,0,0,0,0,1|1,0,0]=3 4769 B11R1.91 C[C@@H](O)CSc1ccncn1 62a_100000703185_100009817552 [1,0,0,0,0,1|2,0,0]=4 4770 B11R1.91 C[C@@H](O)CSc1ccncn1 62a_100009817552_100000703185 [1,0,0,0,0,1|2,0,0]=4 4771 B11R1.91 C[C@@H](O)CSc1ccnnc1 62a_100000732662_100009817552 [1,0,0,0,0,1|2,0,0]=4 4772 B11R1.91 C[C@@H](O)CSc1ccnnc1 62a_100009817552_100000732662 [1,0,0,0,0,1|2,0,0]=4 4773 B11R1.91 C[C@@H](O)CSc1cnccn1 62a_100000211759_100009817552 [1,0,0,0,0,1|2,0,0]=4 4774 B11R1.91 C[C@@H](O)CSc1cnccn1 62a_100009817552_100000211759 [1,0,0,0,0,1|2,0,0]=4 4775 B11R1.91 C[C@@H](O)CSc1cncnc1 62a_100009817552_100011206942 [1,0,0,0,0,1|2,0,0]=4 4776 B11R1.91 C[C@@H](O)CSc1cncnc1 62a_100011206942_100009817552 [1,0,0,0,0,1|2,0,0]=4 4777 B11R1.91 C[C@@H](O)CSc1ncccn1 62a_100000211032_100009817552 [1,0,0,0,0,1|2,0,0]=4 4778 B11R1.91 C[C@@H](O)CSc1ncccn1 62a_100009817552_100000211032 [1,0,0,0,0,1|2,0,0]=4 4779 B11R1.91 FC(F)CNc1ccccc1 34a_100000106764_100011934356 [1,0,0,0,0,1|2,0,0]=4 4780 B11R1.91 FC(F)COc1ccccc1 34a_100000210340_100011934356 [1,0,0,0,0,1|2,0,0]=4 4781 B11R1.91 FC(F)COc1ccccc1 7a_100000210340_100011934356 [1,0,0,0,0,1|2,0,0]=4 4782 B11R1.91 FC(F)CSc1ccccc1 62a_100000719477_100011934356 [1,0,0,0,0,1|2,0,0]=4 4783 B11R1.91 FC(F)CSc1ccccc1 62a_100011934356_100000041952 [1,0,0,0,0,1|2,0,0]=4 4784 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [1,0,0,0,0,1|0,0,2]=4 4785 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [1,0,0,0,0,1|0,0,2]=4 4786 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [1,0,0,0,0,1|0,0,2]=4 4787 B13R1.3523 CC(C)(C)CCNc1ccccc1 34a_100000106764_100000755188 [0,0,0,0,0,2|1,0,0]=3 4788 B13R1.3523 CC(C)(C)CCOc1ccccc1 34a_100000210340_100000755188 [0,0,0,0,0,2|1,0,0]=3 4789 B13R1.3523 CC(C)(C)CCOc1ccccc1 7a_100000210340_100000755188 [0,0,0,0,0,2|1,0,0]=3 4790 B13R1.3523 CC(C)(C)CCOc1cccnc1 34a_100000210849_100000755188 [0,0,0,0,0,2|2,0,0]=4 4791 B13R1.3523 CC(C)(C)CCOc1cccnc1 7a_100000210849_100000755188 [0,0,0,0,0,2|2,0,0]=4 4792 B13R1.3523 CC(C)(C)CCOc1ccncc1 34a_100000212176_100000755188 [0,0,0,0,0,2|2,0,0]=4 4793 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000719477_100000755188 [0,0,0,0,0,2|1,0,0]=3 4794 B13R1.3523 CC(C)(C)CCSc1ccccc1 62a_100000755188_100000041952 [0,0,0,0,0,2|1,0,0]=3 4795 B13R1.3523 CC(C)(C)CCSc1ccccn1 62a_100000755188_100011216584 [0,0,0,0,0,2|2,0,0]=4 4796 B13R1.3523 CC(C)(C)CCSc1ccccn1 62a_100011216584_100000755188 [0,0,0,0,0,2|2,0,0]=4 4797 B13R1.3523 CC(C)(C)CCSc1cccnc1 62a_100000210063_100000755188 [0,0,0,0,0,2|2,0,0]=4 4798 B13R1.3523 CC(C)(C)CCSc1cccnc1 62a_100000755188_100000210063 [0,0,0,0,0,2|2,0,0]=4 4799 B13R1.3523 CC(C)(C)CCSc1ccncc1 62a_100000728582_100000755188 [0,0,0,0,0,2|2,0,0]=4 4800 B13R1.3523 CC(C)(C)CCSc1ccncc1 62a_100000755188_100000728582 [0,0,0,0,0,2|2,0,0]=4 4801 B13R1.3523 CC(C)(C)CNCc1ccccc1 207a_100000743828_100015611070 [0,0,0,0,0,2|1,0,0]=3 4802 B13R1.3523 CC(C)(C)CNCc1ccccc1 2230a_100000743828_100015291786 [0,0,0,0,0,2|1,0,0]=3 4803 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100000743828_100015611070 [0,0,0,0,0,2|1,0,0]=3 4804 B13R1.3523 CC(C)(C)CNCc1ccccc1 270004a_100015324214_100011204126 [0,0,0,0,0,2|1,0,0]=3 4805 B13R1.3523 CC(C)(C)CNCc1ccccc1 34a_100015324214_100011219605 [0,0,0,0,0,2|1,0,0]=3 4806 B13R1.3523 CC(C)(C)CNCc1ccccn1 207a_100000743828_100000209966 [0,0,0,0,0,2|2,0,0]=4 4807 B13R1.3523 CC(C)(C)CNCc1ccccn1 2230a_100000743828_100000721315 [0,0,0,0,0,2|2,0,0]=4 4808 B13R1.3523 CC(C)(C)CNCc1ccccn1 270004a_100000210449_100011204126 [0,0,0,0,0,2|2,0,0]=4 4809 B13R1.3523 CC(C)(C)CNCc1ccccn1 270004a_100000743828_100000209966 [0,0,0,0,0,2|2,0,0]=4 4810 B13R1.3523 CC(C)(C)CNCc1cccnc1 207a_100000743828_100000209961 [0,0,0,0,0,2|2,0,0]=4 4811 B13R1.3523 CC(C)(C)CNCc1cccnc1 2230a_100000743828_100000741622 [0,0,0,0,0,2|2,0,0]=4 4812 B13R1.3523 CC(C)(C)CNCc1cccnc1 270004a_100000210453_100011204126 [0,0,0,0,0,2|2,0,0]=4 4813 B13R1.3523 CC(C)(C)CNCc1cccnc1 270004a_100000743828_100000209961 [0,0,0,0,0,2|2,0,0]=4 4814 B13R1.3523 CC(C)(C)CNCc1ccncc1 207a_100000743828_100000186114 [0,0,0,0,0,2|2,0,0]=4 4815 B13R1.3523 CC(C)(C)CNCc1ccncc1 2230a_100000743828_100015193705 [0,0,0,0,0,2|2,0,0]=4 4816 B13R1.3523 CC(C)(C)COCc1ccccc1 34a_100000210790_100011219605 [0,0,0,0,0,2|1,0,0]=3 4817 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100000211182_100011219605 [0,0,0,0,0,2|1,0,0]=3 4818 B13R1.3523 CC(C)(C)CSCc1ccccc1 62a_100011219605_100015291786 [0,0,0,0,0,2|1,0,0]=3 4819 B13R1.3523 CC(C)(C)CSCc1ccccn1 62a_100000721315_100011219605 [0,0,0,0,0,2|2,0,0]=4 4820 B13R1.3523 CC(C)(C)CSCc1ccccn1 62a_100011219605_100000721315 [0,0,0,0,0,2|2,0,0]=4 4821 B13R1.3523 CC(C)(C)CSCc1cccnc1 62a_100000741622_100011219605 [0,0,0,0,0,2|2,0,0]=4 4822 B13R1.3523 CC(C)(C)CSCc1cccnc1 62a_100011219605_100000741622 [0,0,0,0,0,2|2,0,0]=4 4823 B13R1.3523 CC(C)(C)CSCc1ccncc1 62a_100011219605_100015193705 [0,0,0,0,0,2|2,0,0]=4 4824 B13R1.3523 CC(C)(C)CSCc1ccncc1 62a_100015193705_100011219605 [0,0,0,0,0,2|2,0,0]=4 4825 B13R1.3523 CC(C)(C)NCCc1ccccc1 2230a_100000715429_100000765856 [0,0,0,0,0,2|1,0,0]=3 4826 B13R1.3523 CC(C)(C)NCCc1ccccc1 34a_100000106460_100000210625 [0,0,0,0,0,2|1,0,0]=3 4827 B13R1.3523 CC(C)(C)NCCc1ccccn1 2230a_100000715429_100015183660 [0,0,0,0,0,2|2,0,0]=4 4828 B13R1.3523 CC(C)(C)NCCc1cccnc1 2230a_100000715429_200011713674 [0,0,0,0,0,2|2,0,0]=4 4829 B13R1.3523 CC(C)(C)NCCc1ccncc1 2230a_100000715429_100000723409 [0,0,0,0,0,2|2,0,0]=4 4830 B13R1.3523 CC(C)(C)NCSc1ccccc1 2230a_100000715429_100011218342 [0,0,0,0,0,2|1,0,0]=3 4831 B13R1.3523 CC(C)(C)NN=Cc1ccccc1 4a_100000725372_100015611070 [0,0,0,0,0,2|1,0,1]=4 4832 B13R1.3523 CC(C)(C)OCCc1ccccc1 34a_100000210268_100000210625 [0,0,0,0,0,2|1,0,0]=3 4833 B13R1.3523 CC(C)(C)OCCc1ccccc1 34a_100015890283_100000765856 [0,0,0,0,0,2|1,0,0]=3 4834 B13R1.3523 CC(C)(C)OCCc1ccccc1 7a_100015890283_100000765856 [0,0,0,0,0,2|1,0,0]=3 4835 B13R1.3523 CC(C)(C)OCCc1ccccn1 34a_100000210271_100000210625 [0,0,0,0,0,2|2,0,0]=4 4836 B13R1.3523 CC(C)(C)OCCc1ccccn1 7a_100015890283_100015183660 [0,0,0,0,0,2|2,0,0]=4 4837 B13R1.3523 CC(C)(C)OCCc1cccnc1 34a_100011217484_100000210625 [0,0,0,0,0,2|2,0,0]=4 4838 B13R1.3523 CC(C)(C)OCCc1cccnc1 7a_100015890283_200011713674 [0,0,0,0,0,2|2,0,0]=4 4839 B13R1.3523 CC(C)(C)OCCc1ccncc1 34a_100011216225_100000210625 [0,0,0,0,0,2|2,0,0]=4 4840 B13R1.3523 CC(C)(C)OCCc1ccncc1 7a_100015890283_100000723409 [0,0,0,0,0,2|2,0,0]=4 4841 B13R1.3523 CC(C)(C)SCCc1ccccc1 62a_100000211941_100011218657 [0,0,0,0,0,2|1,0,0]=3 4842 B13R1.3523 CC(C)(C)SCCc1ccccc1 62a_100000765856_100000211941 [0,0,0,0,0,2|1,0,0]=3 4843 B13R1.3523 CC(C)(C)SCCc1ccccn1 62a_100000211941_100015183660 [0,0,0,0,0,2|2,0,0]=4 4844 B13R1.3523 CC(C)(C)SCCc1ccccn1 62a_100015183660_100000211941 [0,0,0,0,0,2|2,0,0]=4 4845 B13R1.3523 CC(C)(C)SCCc1cccnc1 62a_100000211941_200011713674 [0,0,0,0,0,2|2,0,0]=4 4846 B13R1.3523 CC(C)(C)SCCc1cccnc1 62a_200011713674_100000211941 [0,0,0,0,0,2|2,0,0]=4 4847 B13R1.3523 CC(C)(C)SCCc1ccncc1 62a_100000211941_100000723409 [0,0,0,0,0,2|2,0,0]=4 4848 B13R1.3523 CC(C)(C)SCCc1ccncc1 62a_100000723409_100000211941 [0,0,0,0,0,2|2,0,0]=4 4849 B13R1.3523 CC(C)(C)SCSc1ccccc1 62a_100000211941_100011218342 [0,0,0,0,0,2|1,0,0]=3 4850 B13R1.3523 CC(C)(C)SCSc1ccccc1 62a_100011218342_100000211941 [0,0,0,0,0,2|1,0,0]=3 4851 B13R1.3523 CC(C)(F)CNCc1ccccc1 207a_100020643315_100015611070 [0,0,0,0,0,2|1,0,0]=3 4852 B13R1.3523 CC(C)(F)CNCc1ccccc1 2230a_100020643315_100015291786 [0,0,0,0,0,2|1,0,0]=3 4853 B13R1.3523 CC(C)(F)CNCc1ccccc1 270004a_100020643315_100015611070 [0,0,0,0,0,2|1,0,0]=3 4854 B13R1.3523 CC(C)(F)CNCc1ccccc1 34a_100015324214_100011997219 [0,0,0,0,0,2|1,0,0]=3 4855 B13R1.3523 CC(C)(F)CNCc1ccccn1 207a_100020643315_100000209966 [0,0,0,0,0,2|2,0,0]=4 4856 B13R1.3523 CC(C)(F)CNCc1ccccn1 2230a_100020643315_100000721315 [0,0,0,0,0,2|2,0,0]=4 4857 B13R1.3523 CC(C)(F)CNCc1ccccn1 270004a_100020643315_100000209966 [0,0,0,0,0,2|2,0,0]=4 4858 B13R1.3523 CC(C)(F)CNCc1cccnc1 207a_100020643315_100000209961 [0,0,0,0,0,2|2,0,0]=4 4859 B13R1.3523 CC(C)(F)CNCc1cccnc1 2230a_100020643315_100000741622 [0,0,0,0,0,2|2,0,0]=4 4860 B13R1.3523 CC(C)(F)CNCc1cccnc1 270004a_100020643315_100000209961 [0,0,0,0,0,2|2,0,0]=4 4861 B13R1.3523 CC(C)(F)CNCc1ccncc1 207a_100020643315_100000186114 [0,0,0,0,0,2|2,0,0]=4 4862 B13R1.3523 CC(C)(F)CNCc1ccncc1 2230a_100020643315_100015193705 [0,0,0,0,0,2|2,0,0]=4 4863 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000210790_100011997219 [0,0,0,0,0,2|1,0,0]=3 4864 B13R1.3523 CC(C)(F)COCc1ccccc1 34a_100000716592_100015291786 [0,0,0,0,0,2|1,0,0]=3 4865 B13R1.3523 CC(C)(F)COCc1ccccn1 34a_100000716592_100000721315 [0,0,0,0,0,2|2,0,0]=4 4866 B13R1.3523 CC(C)(F)COCc1cccnc1 34a_100000716592_100000733263 [0,0,0,0,0,2|2,0,0]=4 4867 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100000211182_100011997219 [0,0,0,0,0,2|1,0,0]=3 4868 B13R1.3523 CC(C)(F)CSCc1ccccc1 62a_100011997219_100015291786 [0,0,0,0,0,2|1,0,0]=3 4869 B13R1.3523 CC(C)(F)CSCc1ccccn1 62a_100000721315_100011997219 [0,0,0,0,0,2|2,0,0]=4 4870 B13R1.3523 CC(C)(F)CSCc1ccccn1 62a_100011997219_100000721315 [0,0,0,0,0,2|2,0,0]=4 4871 B13R1.3523 CC(C)(F)CSCc1cccnc1 62a_100000741622_100011997219 [0,0,0,0,0,2|2,0,0]=4 4872 B13R1.3523 CC(C)(F)CSCc1cccnc1 62a_100011997219_100000741622 [0,0,0,0,0,2|2,0,0]=4 4873 B13R1.3523 CC(C)(F)CSCc1ccncc1 62a_100011997219_100015193705 [0,0,0,0,0,2|2,0,0]=4 4874 B13R1.3523 CC(C)(F)CSCc1ccncc1 62a_100015193705_100011997219 [0,0,0,0,0,2|2,0,0]=4 4875 B13R1.3523 CC(C)(O)CCNc1ccccc1 34a_100000106764_100000702414 [0,0,0,0,0,2|0,0,0]=2 4876 B13R1.3523 CC(C)(O)CCNc1cccnn1 27a_100000707701_100016991348 [0,0,0,0,0,2|2,0,0]=4 4877 B13R1.3523 CC(C)(O)CCNc1ccncn1 27a_100000707701_100000703185 [0,0,0,0,0,2|2,0,0]=4 4878 B13R1.3523 CC(C)(O)CCNc1cnccn1 27a_100000707701_100000211759 [0,0,0,0,0,2|2,0,0]=4 4879 B13R1.3523 CC(C)(O)CCNc1ncccn1 27a_100000707701_100000211032 [0,0,0,0,0,2|2,0,0]=4 4880 B13R1.3523 CC(C)(O)CCOc1ccccc1 34a_100000210340_100000702414 [0,0,0,0,0,2|0,0,0]=2 4881 B13R1.3523 CC(C)(O)CCOc1ccccc1 7a_100000210340_100000702414 [0,0,0,0,0,2|0,0,0]=2 4882 B13R1.3523 CC(C)(O)CCOc1cccnc1 34a_100000210849_100000702414 [0,0,0,0,0,2|1,0,0]=3 4883 B13R1.3523 CC(C)(O)CCOc1cccnc1 7a_100000210849_100000702414 [0,0,0,0,0,2|1,0,0]=3 4884 B13R1.3523 CC(C)(O)CCOc1ccncc1 34a_100000212176_100000702414 [0,0,0,0,0,2|1,0,0]=3 4885 B13R1.3523 CC(C)(O)CCOc1ccnnc1 34a_100015204005_100000702414 [0,0,0,0,0,2|2,0,0]=4 4886 B13R1.3523 CC(C)(O)CCOc1cncnc1 7a_100000754086_100000702414 [0,0,0,0,0,2|2,0,0]=4 4887 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000702414_100000041952 [0,0,0,0,0,2|0,0,0]=2 4888 B13R1.3523 CC(C)(O)CCSc1ccccc1 62a_100000719477_100000702414 [0,0,0,0,0,2|0,0,0]=2 4889 B13R1.3523 CC(C)(O)CCSc1ccccn1 62a_100000702414_100011216584 [0,0,0,0,0,2|1,0,0]=3 4890 B13R1.3523 CC(C)(O)CCSc1ccccn1 62a_100011216584_100000702414 [0,0,0,0,0,2|1,0,0]=3 4891 B13R1.3523 CC(C)(O)CCSc1cccnc1 62a_100000210063_100000702414 [0,0,0,0,0,2|1,0,0]=3 4892 B13R1.3523 CC(C)(O)CCSc1cccnc1 62a_100000702414_100000210063 [0,0,0,0,0,2|1,0,0]=3 4893 B13R1.3523 CC(C)(O)CCSc1cccnn1 62a_100000702414_100016991348 [0,0,0,0,0,2|2,0,0]=4 4894 B13R1.3523 CC(C)(O)CCSc1cccnn1 62a_100016991348_100000702414 [0,0,0,0,0,2|2,0,0]=4 4895 B13R1.3523 CC(C)(O)CCSc1ccncc1 62a_100000702414_100000728582 [0,0,0,0,0,2|1,0,0]=3 4896 B13R1.3523 CC(C)(O)CCSc1ccncc1 62a_100000728582_100000702414 [0,0,0,0,0,2|1,0,0]=3 4897 B13R1.3523 CC(C)(O)CCSc1ccncn1 62a_100000702414_100000703185 [0,0,0,0,0,2|2,0,0]=4 4898 B13R1.3523 CC(C)(O)CCSc1ccncn1 62a_100000703185_100000702414 [0,0,0,0,0,2|2,0,0]=4 4899 B13R1.3523 CC(C)(O)CCSc1ccnnc1 62a_100000702414_100000732662 [0,0,0,0,0,2|2,0,0]=4 4900 B13R1.3523 CC(C)(O)CCSc1ccnnc1 62a_100000732662_100000702414 [0,0,0,0,0,2|2,0,0]=4 4901 B13R1.3523 CC(C)(O)CCSc1cnccn1 62a_100000211759_100000702414 [0,0,0,0,0,2|2,0,0]=4 4902 B13R1.3523 CC(C)(O)CCSc1cnccn1 62a_100000702414_100000211759 [0,0,0,0,0,2|2,0,0]=4 4903 B13R1.3523 CC(C)(O)CCSc1cncnc1 62a_100000702414_100011206942 [0,0,0,0,0,2|2,0,0]=4 4904 B13R1.3523 CC(C)(O)CCSc1cncnc1 62a_100011206942_100000702414 [0,0,0,0,0,2|2,0,0]=4 4905 B13R1.3523 CC(C)(O)CCSc1ncccn1 62a_100000211032_100000702414 [0,0,0,0,0,2|2,0,0]=4 4906 B13R1.3523 CC(C)(O)CCSc1ncccn1 62a_100000702414_100000211032 [0,0,0,0,0,2|2,0,0]=4 4907 B13R1.3523 CC(C)(O)CNCc1ccccc1 207a_100000751335_100015611070 [0,0,0,0,0,2|0,0,0]=2 4908 B13R1.3523 CC(C)(O)CNCc1ccccc1 2230a_100000751335_100015291786 [0,0,0,0,0,2|0,0,0]=2 4909 B13R1.3523 CC(C)(O)CNCc1ccccc1 270004a_100000751335_100015611070 [0,0,0,0,0,2|0,0,0]=2 4910 B13R1.3523 CC(C)(O)CNCc1ccccc1 34a_100015324214_100000764493 [0,0,0,0,0,2|0,0,0]=2 4911 B13R1.3523 CC(C)(O)CNCc1ccccn1 207a_100000751335_100000209966 [0,0,0,0,0,2|1,0,0]=3 4912 B13R1.3523 CC(C)(O)CNCc1ccccn1 2230a_100000751335_100000721315 [0,0,0,0,0,2|1,0,0]=3 4913 B13R1.3523 CC(C)(O)CNCc1ccccn1 270004a_100000751335_100000209966 [0,0,0,0,0,2|1,0,0]=3 4914 B13R1.3523 CC(C)(O)CNCc1cccnc1 207a_100000751335_100000209961 [0,0,0,0,0,2|1,0,0]=3 4915 B13R1.3523 CC(C)(O)CNCc1cccnc1 2230a_100000751335_100000741622 [0,0,0,0,0,2|1,0,0]=3 4916 B13R1.3523 CC(C)(O)CNCc1cccnc1 270004a_100000751335_100000209961 [0,0,0,0,0,2|1,0,0]=3 4917 B13R1.3523 CC(C)(O)CNCc1cccnn1 2230a_100000751335_100016990269 [0,0,0,0,0,2|2,0,0]=4 4918 B13R1.3523 CC(C)(O)CNCc1ccncc1 207a_100000751335_100000186114 [0,0,0,0,0,2|1,0,0]=3 4919 B13R1.3523 CC(C)(O)CNCc1ccncc1 2230a_100000751335_100015193705 [0,0,0,0,0,2|1,0,0]=3 4920 B13R1.3523 CC(C)(O)CNCc1ccnnc1 270004a_100000751335_100011934578 [0,0,0,0,0,2|2,0,0]=4 4921 B13R1.3523 CC(C)(O)CNCc1cnccn1 2230a_100000751335_100016995436 [0,0,0,0,0,2|2,0,0]=4 4922 B13R1.3523 CC(C)(O)CNCc1cnccn1 270004a_100000751335_100000749867 [0,0,0,0,0,2|2,0,0]=4 4923 B13R1.3523 CC(C)(O)CNCc1cncnc1 2230a_100000751335_100015196519 [0,0,0,0,0,2|2,0,0]=4 4924 B13R1.3523 CC(C)(O)CNCc1cncnc1 270004a_100000751335_100000749868 [0,0,0,0,0,2|2,0,0]=4 4925 B13R1.3523 CC(C)(O)CNCc1ncccn1 2230a_100000751335_100000703007 [0,0,0,0,0,2|2,0,0]=4 4926 B13R1.3523 CC(C)(O)CNCc1ncccn1 270004a_100000751335_100011532527 [0,0,0,0,0,2|2,0,0]=4 4927 B13R1.3523 CC(C)(O)COCc1ccccc1 34a_100000210790_100000764493 [0,0,0,0,0,2|0,0,0]=2 4928 B13R1.3523 CC(C)(O)COCc1ccccc1 7a_100000210790_100000764493 [0,0,0,0,0,2|0,0,0]=2 4929 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000211182_100000764493 [0,0,0,0,0,2|0,0,0]=2 4930 B13R1.3523 CC(C)(O)CSCc1ccccc1 62a_100000764493_100015291786 [0,0,0,0,0,2|0,0,0]=2 4931 B13R1.3523 CC(C)(O)CSCc1ccccn1 62a_100000721315_100000764493 [0,0,0,0,0,2|1,0,0]=3 4932 B13R1.3523 CC(C)(O)CSCc1ccccn1 62a_100000764493_100000721315 [0,0,0,0,0,2|1,0,0]=3 4933 B13R1.3523 CC(C)(O)CSCc1cccnc1 62a_100000741622_100000764493 [0,0,0,0,0,2|1,0,0]=3 4934 B13R1.3523 CC(C)(O)CSCc1cccnc1 62a_100000764493_100000741622 [0,0,0,0,0,2|1,0,0]=3 4935 B13R1.3523 CC(C)(O)CSCc1cccnn1 62a_100000764493_100016990269 [0,0,0,0,0,2|2,0,0]=4 4936 B13R1.3523 CC(C)(O)CSCc1cccnn1 62a_100016990269_100000764493 [0,0,0,0,0,2|2,0,0]=4 4937 B13R1.3523 CC(C)(O)CSCc1ccncc1 62a_100000764493_100015193705 [0,0,0,0,0,2|1,0,0]=3 4938 B13R1.3523 CC(C)(O)CSCc1ccncc1 62a_100015193705_100000764493 [0,0,0,0,0,2|1,0,0]=3 4939 B13R1.3523 CC(C)(O)CSCc1cnccn1 62a_100000764493_100016995436 [0,0,0,0,0,2|2,0,0]=4 4940 B13R1.3523 CC(C)(O)CSCc1cnccn1 62a_100016995436_100000764493 [0,0,0,0,0,2|2,0,0]=4 4941 B13R1.3523 CC(C)(O)CSCc1cncnc1 62a_100000764493_100015196519 [0,0,0,0,0,2|2,0,0]=4 4942 B13R1.3523 CC(C)(O)CSCc1cncnc1 62a_100015196519_100000764493 [0,0,0,0,0,2|2,0,0]=4 4943 B13R1.3523 CC(C)(O)CSCc1ncccn1 62a_100000703007_100000764493 [0,0,0,0,0,2|2,0,0]=4 4944 B13R1.3523 CC(C)(O)CSCc1ncccn1 62a_100000764493_100000703007 [0,0,0,0,0,2|2,0,0]=4 4945 B13R1.3523 CC(F)(F)CNCc1ccccc1 207a_100000731000_100015611070 [0,0,0,0,0,2|2,0,0]=4 4946 B13R1.3523 CC(F)(F)CNCc1ccccc1 270004a_100000731000_100015611070 [0,0,0,0,0,2|2,0,0]=4 4947 B13R1.3523 CC(F)(F)COCc1ccccc1 34a_100000068830_100015291786 [0,0,0,0,0,2|2,0,0]=4 4948 B13R1.3523 C[N+](C)(C)CCNc1ccccc1 34a_100000106764_100000085578 [0,0,0,0,0,2|2,0,0]=4 4949 B13R1.3523 C[N+](C)(C)CCOc1ccccc1 34a_100000210340_100000085578 [0,0,0,0,0,2|2,0,0]=4 4950 B13R1.3523 C[N+](C)(C)CCOc1ccccc1 7a_100000210340_100000085578 [0,0,0,0,0,2|2,0,0]=4 4951 B13R1.3523 C[N+](C)(C)CCSc1ccccc1 62a_100000085578_100000041952 [0,0,0,0,0,2|2,0,0]=4 4952 B13R1.3523 C[N+](C)(C)CCSc1ccccc1 62a_100000719477_100000085578 [0,0,0,0,0,2|2,0,0]=4 4953 B13R1.3523 C[N+](C)(C)CSCc1ccccc1 62a_100000211182_200000036245 [0,0,0,0,0,2|2,0,0]=4 4954 B13R1.3523 C[N+](C)(C)CSCc1ccccc1 62a_200000036245_100015291786 [0,0,0,0,0,2|2,0,0]=4 4955 B13R1.3523 C[Si](C)(C)/C=C/Cc1ccccc1 271570a_100160482004_100000210277 [0,0,0,0,0,2|1,1,0]=4 4956 B13R1.3523 C[Si](C)(C)CCNc1ccccc1 34a_100000106764_200000733723 [0,0,0,0,0,2|1,1,0]=4 4957 B13R1.3523 C[Si](C)(C)CCOc1ccccc1 34a_100000210340_200000733723 [0,0,0,0,0,2|1,1,0]=4 4958 B13R1.3523 C[Si](C)(C)CCOc1ccccc1 7a_100000210340_200000733723 [0,0,0,0,0,2|1,1,0]=4 4959 B13R1.3523 C[Si](C)(C)CCSc1ccccc1 62a_100000719477_200000733723 [0,0,0,0,0,2|1,1,0]=4 4960 B13R1.3523 C[Si](C)(C)CCSc1ccccc1 62a_200000733723_100000041952 [0,0,0,0,0,2|1,1,0]=4 4961 B13R1.3523 C[Si](C)(C)CNCc1ccccc1 2230a_100015324214_100000037933 [0,0,0,0,0,2|1,1,0]=4 4962 B13R1.3523 C[Si](C)(C)COCc1ccccc1 7a_100000210790_100000233785 [0,0,0,0,0,2|1,1,0]=4 4963 B13R1.3523 C[Si](C)(C)CSCc1ccccc1 62a_100000037933_100015291786 [0,0,0,0,0,2|1,1,0]=4 4964 B13R1.3523 C[Si](C)(C)CSCc1ccccc1 62a_100000211182_100000037933 [0,0,0,0,0,2|1,1,0]=4