0 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.20 CC(=O)C(C)c1ccc(cc1)Br 1458a_100000070787_100000755118 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000070787_100011261388 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_200000210301 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000070787_100000684792 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_200000210301 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100000070787_100000743420 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_200000210301 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.20 CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200000210301 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [0,0,0,0,0,0|2,0,1]=3 11 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [0,0,0,0,0,0|2,0,1]=3 12 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,0,0,0,0,0|1,0,1]=2 13 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [0,0,0,0,0,0|2,0,1]=3 17 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100011216001_200025704644 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)F 1458a_100011435297_200025704644 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.20 CC(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000210206 [0,0,0,0,0,0|2,0,2]=4 22 B12R1.20 CC(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210206 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.20 CC(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000210206 [0,0,0,0,0,0|2,0,2]=4 24 B12R1.20 CC(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000210206 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000210206 [0,0,0,0,0,0|1,0,2]=3 26 B12R1.20 CC(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100011220430 [0,0,0,0,0,0|1,0,2]=3 27 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219623_100000210206 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 2230a_100000219625_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219623_100000210206 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 269982a_100000219625_200000210301 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219623_100000210206 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 34a_100000219625_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.20 CC(C)N(C)c1ccc(cc1)Br 7a_100000219625_200000210301 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100000749197_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 2230a_100020629279_100000210206 [0,0,0,0,0,0|4,0,0]=4 36 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100000749197_200000210301 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 269982a_100020629279_100000210206 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100000749197_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 34a_100020629279_100000210206 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.20 CC(C)N(C)c1ccc(cc1)Cl 7a_100000749197_200000210301 [0,0,0,0,0,0|4,0,0]=4 41 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219829_100000210206 [0,0,0,0,0,0|4,0,0]=4 42 B12R1.20 CC(C)N(C)c1ccc(cc1)F 2230a_100000219830_200000210301 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219829_100000210206 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.20 CC(C)N(C)c1ccc(cc1)F 269982a_100000219830_200000210301 [0,0,0,0,0,0|4,0,0]=4 45 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219829_100000210206 [0,0,0,0,0,0|4,0,0]=4 46 B12R1.20 CC(C)N(C)c1ccc(cc1)F 34a_100000219830_200000210301 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.20 CC(C)N(C)c1ccc(cc1)F 7a_100000219830_200000210301 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.20 CC(C)N(C)c1ccc(cc1)I 2230a_100000743151_100000210206 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.20 CC(C)N(C)c1ccc(cc1)I 269982a_100000743151_100000210206 [0,0,0,0,0,0|4,0,0]=4 50 B12R1.20 CC(C)N(C)c1ccc(cc1)I 34a_100000743151_100000210206 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.20 CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000210206 [0,0,0,0,0,0|3,0,0]=3 52 B12R1.20 CC(C)N(C)c1ccc(cc1)O 34a_100000182112_100000210206 [0,0,0,0,0,0|3,0,0]=3 53 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 2230a_100000219625_200025704644 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 269982a_100000219625_200025704644 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 34a_100000219625_200025704644 [0,0,0,0,0,0|4,0,0]=4 56 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Br 7a_100000219625_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 2230a_100000749197_200025704644 [0,0,0,0,0,0|4,0,0]=4 58 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 269982a_100000749197_200025704644 [0,0,0,0,0,0|4,0,0]=4 59 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 34a_100000749197_200025704644 [0,0,0,0,0,0|4,0,0]=4 60 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)Cl 7a_100000749197_200025704644 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 2230a_100000219830_200025704644 [0,0,0,0,0,0|4,0,0]=4 62 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 269982a_100000219830_200025704644 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 34a_100000219830_200025704644 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.20 CC(C)N([13CH3])c1ccc(cc1)F 7a_100000219830_200025704644 [0,0,0,0,0,0|4,0,0]=4 65 B12R1.20 CC(C)S(=O)c1ccc(cc1)O 271570a_203496583355_100010749287 [0,0,0,0,0,0|2,0,1]=3 66 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [0,0,0,0,0,0|2,0,0]=2 67 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100000231103_200000210301 [0,0,0,0,0,0|4,0,0]=4 68 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 2230a_100102631434_100000755118 [0,0,0,0,0,0|4,0,0]=4 69 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100000231103_200000210301 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.20 CC(c1ccc(cc1)Br)N(C)C 269982a_100102631434_100000755118 [0,0,0,0,0,0|4,0,0]=4 71 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 2230a_100000231103_200025704644 [0,0,0,0,0,0|4,0,0]=4 72 B12R1.20 CC(c1ccc(cc1)Br)N(C)[13CH3] 269982a_100000231103_200025704644 [0,0,0,0,0,0|4,0,0]=4 73 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100000231102_200000210301 [0,0,0,0,0,0|4,0,0]=4 74 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 2230a_100102631434_100000684792 [0,0,0,0,0,0|4,0,0]=4 75 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100000231102_200000210301 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.20 CC(c1ccc(cc1)Cl)N(C)C 269982a_100102631434_100000684792 [0,0,0,0,0,0|4,0,0]=4 77 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 2230a_100000231102_200025704644 [0,0,0,0,0,0|4,0,0]=4 78 B12R1.20 CC(c1ccc(cc1)Cl)N(C)[13CH3] 269982a_100000231102_200025704644 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100000222788_200000210301 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.20 CC(c1ccc(cc1)F)N(C)C 2230a_100102631434_100000743420 [0,0,0,0,0,0|4,0,0]=4 81 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100000222788_200000210301 [0,0,0,0,0,0|4,0,0]=4 82 B12R1.20 CC(c1ccc(cc1)F)N(C)C 269982a_100102631434_100000743420 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.20 CC(c1ccc(cc1)F)N(C)C 34a_100000222788_200000210301 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 2230a_100000222788_200025704644 [0,0,0,0,0,0|4,0,0]=4 85 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 269982a_100000222788_200025704644 [0,0,0,0,0,0|4,0,0]=4 86 B12R1.20 CC(c1ccc(cc1)F)N(C)[13CH3] 34a_100000222788_200025704644 [0,0,0,0,0,0|4,0,0]=4 87 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 240690a_100102631434_100000212099 [0,0,0,0,0,0|2,0,2]=4 88 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000159574 [0,0,0,0,0,0|2,0,2]=4 89 B12R1.20 CN(C)C(=O)c1ccc(cc1)O 527a_100102631434_100000212099 [0,0,0,0,0,0|2,0,2]=4 90 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,0,0,0,0,0|2,0,2]=4 91 B12R1.20 Cc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000751627_200025704644 [0,0,0,0,0,0|3,0,1]=4 92 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [0,0,0,0,0,0|4,0,0]=4 94 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000219977_100000210206 [0,0,0,0,0,0|4,0,0]=4 95 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000748792_200000210301 [0,0,0,0,0,0|4,0,0]=4 96 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000219977_100000210206 [0,0,0,0,0,0|4,0,0]=4 97 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000748792_200000210301 [0,0,0,0,0,0|4,0,0]=4 98 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000219977_100000210206 [0,0,0,0,0,0|4,0,0]=4 99 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000748792_200000210301 [0,0,0,0,0,0|4,0,0]=4 100 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 7a_100000748792_200000210301 [0,0,0,0,0,0|4,0,0]=4 101 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 2230a_100000748792_200025704644 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 269982a_100000748792_200025704644 [0,0,0,0,0,0|4,0,0]=4 103 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 34a_100000748792_200025704644 [0,0,0,0,0,0|4,0,0]=4 104 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 7a_100000748792_200025704644 [0,0,0,0,0,0|4,0,0]=4 105 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [0,0,0,0,0,0|2,0,1]=3 106 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,0,0,0,0,0|1,0,3]=4 107 B12R1.20 [13CH3]C(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200025704644 [0,0,0,0,0,0|3,0,1]=4 108 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [0,0,0,0,0,0|2,0,1]=3 109 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [0,0,0,0,0,0|2,0,1]=3 110 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,0,0,0,0,0|1,0,1]=2 111 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [0,0,0,0,0,0|2,0,1]=3 112 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,0,0,0,0,0|1,0,2]=4 113 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [1,0,0,0,0,0|2,0,1]=4 114 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [1,0,0,0,0,0|2,0,1]=4 115 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [1,0,0,0,0,0|2,0,1]=4 116 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [1,0,0,0,0,0|2,0,1]=4 117 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [1,0,0,0,0,0|2,0,1]=4 118 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [1,0,0,0,0,0|2,0,1]=4 119 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [1,0,0,0,0,0|2,0,1]=4 120 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [1,0,0,0,0,0|2,0,1]=4 121 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [1,0,0,0,0,0|2,0,1]=4 122 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [1,0,0,0,0,0|2,0,1]=4 123 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,0,0,0,0,0|1,0,1]=3 124 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,0,0,0,0,0|1,0,1]=3 125 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [1,0,0,0,0,0|2,0,1]=4 126 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [1,0,0,0,0,0|2,0,1]=4 127 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [1,0,0,0,0,0|2,0,1]=4 128 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [1,0,0,0,0,0|2,0,1]=4 129 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [1,0,0,0,0,0|2,0,1]=4 130 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [1,0,0,0,0,0|1,0,0]=2 131 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [1,0,0,0,0,0|3,0,0]=4 132 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [1,0,0,0,0,0|3,0,0]=4 133 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [1,0,0,0,0,0|3,0,0]=4 134 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [1,0,0,0,0,0|3,0,0]=4 136 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [1,0,0,0,0,0|3,0,0]=4 137 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [1,0,0,0,0,0|2,0,0]=3 138 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [1,0,0,0,0,0|2,0,0]=3 139 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [1,0,0,0,0,0|3,0,0]=4 140 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [1,0,0,0,0,0|3,0,0]=4 141 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [1,0,0,0,0,0|3,0,0]=4 142 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [1,0,0,0,0,0|3,0,0]=4 143 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [1,0,0,0,0,0|3,0,0]=4 144 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [1,0,0,0,0,0|3,0,0]=4 145 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [1,0,0,0,0,0|3,0,0]=4 146 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [1,0,0,0,0,0|3,0,0]=4 147 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,0,0,0,0,0|2,0,0]=3 148 B11R1.20 CC(C)Oc1ccc(cn1)O 271570a_203496583355_100000688564 [1,0,0,0,0,0|3,0,0]=4 149 B11R1.20 CC(C)Oc1ccc(nc1)O 271570a_203496583355_100012354243 [1,0,0,0,0,0|3,0,0]=4 150 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [1,0,0,0,0,0|3,0,0]=4 151 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [1,0,0,0,0,0|3,0,0]=4 152 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [1,0,0,0,0,0|3,0,0]=4 153 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [1,0,0,0,0,0|3,0,0]=4 154 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [1,0,0,0,0,0|3,0,0]=4 155 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [1,0,0,0,0,0|3,0,0]=4 156 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [1,0,0,0,0,0|3,0,0]=4 157 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [1,0,0,0,0,0|3,0,0]=4 158 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [1,0,0,0,0,0|2,0,0]=3 159 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [1,0,0,0,0,0|2,0,0]=3 160 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000210206_100000744096 [1,0,0,0,0,0|3,0,0]=4 161 B11R1.20 CC(C)Sc1ccc(cn1)O 62a_100000685995_100000210206 [1,0,0,0,0,0|3,0,0]=4 162 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [1,0,0,0,0,0|3,0,0]=4 164 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [1,0,0,0,0,0|3,0,0]=4 165 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [1,0,0,0,0,0|3,0,0]=4 166 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [1,0,0,0,0,0|3,0,0]=4 167 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 168 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [1,0,0,0,0,0|3,0,0]=4 169 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 170 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [1,0,0,0,0,0|3,0,0]=4 171 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [1,0,0,0,0,0|3,0,0]=4 172 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 173 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 174 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [1,0,0,0,0,0|3,0,0]=4 175 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 176 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [1,0,0,0,0,0|3,0,0]=4 177 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [1,0,0,0,0,0|3,0,0]=4 178 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [1,0,0,0,0,0|3,0,0]=4 180 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [1,0,0,0,0,0|3,0,0]=4 181 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,0,0,0,0,0|2,0,0]=3 182 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,0,0,0,0,0|2,0,0]=3 183 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,0,0,0,0,0|2,0,0]=3 184 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [1,0,0,0,0,0|3,0,0]=4 185 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [1,0,0,0,0,0|3,0,0]=4 186 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [1,0,0,0,0,0|3,0,0]=4 187 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 188 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 189 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 190 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 191 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 192 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 193 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,0,0,0,0,0|2,0,0]=3 194 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,0,0,0,0,0|2,0,0]=3 195 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [1,0,0,0,0,0|2,0,1]=4 196 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [1,0,0,0,0,0|3,0,0]=4 198 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [1,0,0,0,0,0|3,0,0]=4 199 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [1,0,0,0,0,0|3,0,0]=4 200 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [1,0,0,0,0,0|3,0,0]=4 201 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [1,0,0,0,0,0|3,0,0]=4 203 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [1,0,0,0,0,0|3,0,0]=4 204 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [1,0,0,0,0,0|3,0,0]=4 205 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [1,0,0,0,0,0|3,0,0]=4 206 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [1,0,0,0,0,0|3,0,0]=4 207 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [1,0,0,0,0,0|3,0,0]=4 208 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [1,0,0,0,0,0|1,0,1]=3 211 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [1,0,0,0,0,0|2,0,1]=4 212 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [1,0,0,0,0,0|2,0,1]=4 213 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.20 Oc1ccc(cc1)OC(F)F 271570a_203496583355_100000179047 [1,0,0,0,0,0|3,0,0]=4 215 B11R1.20 Oc1ccc(cc1)SC(F)F 271570a_203496583355_100000178776 [1,0,0,0,0,0|3,0,0]=4 216 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [1,0,0,0,0,0|2,0,1]=4 217 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [1,0,0,0,0,0|2,0,1]=4 218 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [1,0,0,0,0,0|2,0,1]=4 219 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [1,0,0,0,0,0|2,0,1]=4 220 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,0,0,0,0,0|1,0,1]=3 221 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [1,0,0,0,0,0|1,0,2]=4 222 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [1,0,0,0,0,0|3,0,0]=4 223 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [1,0,0,0,0,0|3,0,0]=4 224 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [1,0,0,0,0,0|3,0,0]=4 225 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [1,0,0,0,0,0|3,0,0]=4 226 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [1,0,0,0,0,0|3,0,0]=4 227 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [1,0,0,0,0,0|3,0,0]=4 228 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [1,0,0,0,0,0|3,0,0]=4 229 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [1,0,0,0,0,0|3,0,0]=4 230 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [1,0,0,0,0,0|3,0,0]=4 231 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [1,0,0,0,0,0|3,0,0]=4 232 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [1,0,0,0,0,0|3,0,0]=4 233 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [1,0,0,0,0,0|1,0,2]=4 234 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [1,0,0,0,0,0|1,0,2]=4 235 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [1,0,0,0,0,0|1,0,2]=4 236 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [1,0,0,0,0,0|1,0,2]=4 237 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [1,0,0,0,0,0|1,0,2]=4 238 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [1,0,0,0,0,0|0,0,2]=3 239 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [1,0,0,0,0,0|0,0,2]=3 240 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [1,0,0,0,0,0|1,0,2]=4 241 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [1,0,0,0,0,0|1,0,0]=2 242 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [1,0,0,0,0,0|0,0,0]=1 243 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [1,0,0,0,0,0|3,0,0]=4 244 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [1,0,0,0,0,0|3,0,0]=4 245 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [1,0,0,0,0,0|3,0,0]=4 246 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [1,0,0,0,0,0|3,0,0]=4 247 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [1,0,0,0,0,0|3,0,0]=4 248 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [1,0,0,0,0,0|3,0,0]=4 249 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [1,0,0,0,0,0|3,0,0]=4 250 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [1,0,0,0,0,0|3,0,0]=4 251 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [1,0,0,0,0,0|3,0,0]=4 252 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [1,0,0,0,0,0|3,0,0]=4 253 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [1,0,0,0,0,0|3,0,0]=4 254 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [1,0,0,0,0,0|3,0,0]=4 255 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [1,0,0,0,0,0|3,0,0]=4 256 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [1,0,0,0,0,0|3,0,0]=4 257 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [1,0,0,0,0,0|3,0,0]=4 258 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [1,0,0,0,0,0|3,0,0]=4 259 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [1,0,0,0,0,0|3,0,0]=4 261 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [1,0,0,0,0,0|3,0,0]=4 262 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [1,0,0,0,0,0|3,0,0]=4 263 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [1,0,0,0,0,0|3,0,0]=4 264 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [1,0,0,0,0,0|3,0,0]=4 265 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [1,0,0,0,0,0|3,0,0]=4 266 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [1,0,0,0,0,0|3,0,0]=4 267 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [1,0,0,0,0,0|3,0,0]=4 268 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [1,0,0,0,0,0|3,0,0]=4 269 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [1,0,0,0,0,0|3,0,0]=4 270 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [1,0,0,0,0,0|2,0,0]=3 271 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [1,0,0,0,0,0|2,0,0]=3 272 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [1,0,0,0,0,0|2,0,0]=3 273 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [1,0,0,0,0,0|2,0,0]=3 274 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [1,0,0,0,0,0|2,0,0]=3 275 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [1,0,0,0,0,0|3,0,0]=4 276 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [1,0,0,0,0,0|3,0,0]=4 277 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [1,0,0,0,0,0|3,0,0]=4 280 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [1,0,0,0,0,0|3,0,0]=4 281 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [1,0,0,0,0,0|3,0,0]=4 282 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [1,0,0,0,0,0|3,0,0]=4 285 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [1,0,0,0,0,0|2,0,0]=3 288 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [1,0,0,0,0,0|2,0,0]=3 290 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [1,0,0,0,0,0|1,0,0]=2 291 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [1,0,0,0,0,0|3,0,0]=4 292 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [1,0,0,0,0,0|3,0,0]=4 293 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [1,0,0,0,0,0|1,0,2]=4 294 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [1,0,0,0,0,0|1,0,2]=4 295 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [1,0,0,0,0,0|1,0,2]=4 296 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [1,0,0,0,0,0|3,0,0]=4 297 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [1,0,0,0,0,0|3,0,0]=4 298 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [1,0,0,0,0,0|3,0,0]=4 300 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [1,0,0,0,0,0|3,0,0]=4 301 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [1,0,0,0,0,0|3,0,0]=4 302 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [1,0,0,0,0,0|3,0,0]=4 306 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [1,0,0,0,0,0|3,0,0]=4 307 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [1,0,0,0,0,0|3,0,0]=4 310 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [1,0,0,0,0,0|3,0,0]=4 311 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [1,0,0,0,0,0|2,0,0]=3 312 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [1,0,0,0,0,0|3,0,0]=4 313 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [1,0,0,0,0,0|3,0,0]=4 314 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [1,0,0,0,0,0|3,0,0]=4 315 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [1,0,0,0,0,0|2,0,0]=3 316 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [1,0,0,0,0,0|3,0,0]=4 318 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [1,0,0,0,0,0|3,0,0]=4 319 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [1,0,0,0,0,0|3,0,0]=4 320 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [1,0,0,0,0,0|3,0,0]=4 321 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [1,0,0,0,0,0|1,0,2]=4 322 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [1,0,0,0,0,0|3,0,0]=4 324 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [1,0,0,0,0,0|3,0,0]=4 325 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [1,0,0,0,0,0|3,0,0]=4 326 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [1,0,0,0,0,0|3,0,0]=4 327 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [1,0,0,0,0,0|3,0,0]=4 328 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [1,0,0,0,0,0|3,0,0]=4 329 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [1,0,0,0,0,0|3,0,0]=4 330 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [1,0,0,0,0,0|2,0,0]=3 331 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [1,0,0,0,0,0|3,0,0]=4 334 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [1,0,0,0,0,0|3,0,0]=4 337 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [1,0,0,0,0,0|3,0,0]=4 338 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [1,0,0,0,0,0|3,0,0]=4 340 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [1,0,0,0,0,0|3,0,0]=4 341 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [1,0,0,0,0,0|3,0,0]=4 342 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [1,0,0,0,0,0|3,0,0]=4 343 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [1,0,0,0,0,0|3,0,0]=4 346 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [1,0,0,0,0,0|3,0,0]=4 348 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [1,0,0,0,0,0|3,0,0]=4 349 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [1,0,0,0,0,0|2,0,0]=3 350 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [1,0,0,0,0,0|3,0,0]=4 351 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [1,0,0,0,0,0|3,0,0]=4 352 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [1,0,0,0,0,0|3,0,0]=4 353 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [1,0,0,0,0,0|3,0,0]=4 354 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [1,0,0,0,0,0|3,0,0]=4 355 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [1,0,0,0,0,0|3,0,0]=4 356 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [1,0,0,0,0,0|3,0,0]=4 357 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.22 N#CC(N)c1ccc(cc1)O 271570a_203496583355_106722365845 [1,0,0,0,0,0|1,0,2]=4 359 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [1,0,0,0,0,0|2,0,0]=3 360 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [1,0,0,0,0,0|0,0,2]=3 361 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [1,0,0,0,0,0|0,0,0]=1 362 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [1,0,0,0,0,0|1,0,2]=4 363 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [1,0,0,0,0,0|1,0,2]=4 364 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [1,0,0,0,0,0|1,0,2]=4 365 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [1,0,0,0,0,0|1,0,0]=2 366 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [1,0,0,0,0,0|3,0,0]=4 367 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [1,0,0,0,0,0|3,0,0]=4 368 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [1,0,0,0,0,0|3,0,0]=4 369 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [1,0,0,0,0,0|3,0,0]=4 370 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,0,0,0,0,0|1,0,1]=3 374 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [1,0,0,0,0,0|1,0,2]=4 375 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 376 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 377 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 378 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 381 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 384 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 385 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [1,0,0,0,0,0|3,0,0]=4 386 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [1,0,0,0,0,0|3,0,0]=4 387 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [1,0,0,0,0,0|3,0,0]=4 388 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [1,0,0,0,0,0|3,0,0]=4 389 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [1,0,0,0,0,0|3,0,0]=4 390 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [1,0,0,0,0,0|3,0,0]=4 391 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,0,0,0,0,0|1,0,1]=3 395 B13R1.21 C#CC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_200000035995 [0,1,0,0,0,0|1,0,2]=4 396 B13R1.21 C#CC(C)N(C)c1ccc(cc1)O 34a_100000182112_200000035995 [0,1,0,0,0,0|3,0,0]=4 397 B13R1.21 C=CC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100011215867 [0,1,0,0,0,0|3,0,0]=4 398 B13R1.21 CC(C#N)C(=O)c1ccc(cc1)O 1458a_100000212099_100000703298 [0,1,0,0,0,0|0,0,3]=4 399 B13R1.21 CC(C#N)N(C)c1ccc(cc1)O 269982a_100000182112_100000703298 [0,1,0,0,0,0|2,0,1]=4 400 B13R1.21 CC(C(=O)CF)c1ccc(cc1)O 1458a_100000031422_100015361967 [0,1,0,0,0,0|2,0,1]=4 401 B13R1.21 CC(CO)N(C)c1ccc(cc1)O 34a_100000182112_100012180447 [0,1,0,0,0,0|3,0,0]=4 402 B13R1.21 CC(S[13CH3])C(=O)c1ccc(cc1)O 62a_200010205864_200025704644 [0,1,0,0,0,0|1,0,2]=4 403 B13R1.21 CC(S[13CH3])C(=O)c1ccc(cc1)O 62a_200025704644_200010205864 [0,1,0,0,0,0|1,0,2]=4 404 B13R1.21 CCC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210202 [0,1,0,0,0,0|2,0,1]=4 405 B13R1.21 CCC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210202 [0,1,0,0,0,0|2,0,1]=4 406 B13R1.21 CCC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210202 [0,1,0,0,0,0|2,0,1]=4 407 B13R1.21 CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210202 [0,1,0,0,0,0|1,0,1]=3 408 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_100000210202 [0,1,0,0,0,0|2,0,1]=4 409 B13R1.21 CCC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210202 [0,1,0,0,0,0|2,0,1]=4 410 B13R1.21 CCC(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000758301 [0,1,0,0,0,0|1,0,2]=4 411 B13R1.21 CCC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100000758301 [0,1,0,0,0,0|3,0,0]=4 412 B13R1.21 CCC(C)N(C)c1ccc(cc1)O 34a_100000182112_100011215416 [0,1,0,0,0,0|3,0,0]=4 413 B13R1.21 CNC(=O)C(C)c1ccc(cc1)O 240690a_100102657272_100000031422 [0,1,0,0,0,0|2,0,1]=4 414 B13R1.21 CNC(=O)C(O)c1ccc(cc1)Br 240690a_100102657272_100000756554 [0,1,0,0,0,0|2,0,1]=4 415 B13R1.21 CNC(=O)C(O)c1ccc(cc1)F 240690a_100102657272_100000209909 [0,1,0,0,0,0|2,0,1]=4 416 B13R1.21 CNC(=O)C(O)c1ccc(cc1)O 240690a_100102657272_100011215213 [0,1,0,0,0,0|1,0,1]=3 417 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)C 240690a_100102657272_100009815954 [0,1,0,0,0,0|2,0,1]=4 418 B13R1.21 CNC(=O)[C@H](O)c1ccc(cc1)Cl 240690a_100102657272_100009817493 [0,1,0,0,0,0|2,0,1]=4 419 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Br 2230a_106832991635_100000184162 [0,1,0,0,0,0|1,0,2]=4 420 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Br 34a_100102657272_100000184162 [0,1,0,0,0,0|1,0,2]=4 421 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Br 7a_106832991635_100000184162 [0,1,0,0,0,0|1,0,2]=4 422 B13R1.21 CNC(C)C(=O)c1ccc(cc1)C 2230a_106832991635_100000726416 [0,1,0,0,0,0|1,0,2]=4 423 B13R1.21 CNC(C)C(=O)c1ccc(cc1)C 34a_100102657272_100000726416 [0,1,0,0,0,0|1,0,2]=4 424 B13R1.21 CNC(C)C(=O)c1ccc(cc1)C 7a_106832991635_100000183984 [0,1,0,0,0,0|1,0,2]=4 425 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Cl 2230a_106832991635_100000183210 [0,1,0,0,0,0|1,0,2]=4 426 B13R1.21 CNC(C)C(=O)c1ccc(cc1)Cl 7a_106832991635_100000183210 [0,1,0,0,0,0|1,0,2]=4 427 B13R1.21 CNC(C)C(=O)c1ccc(cc1)F 2230a_106832991635_100000229918 [0,1,0,0,0,0|1,0,2]=4 428 B13R1.21 CNC(C)C(=O)c1ccc(cc1)F 34a_100102657272_100000229918 [0,1,0,0,0,0|1,0,2]=4 429 B13R1.21 CNC(C)C(=O)c1ccc(cc1)F 7a_106832991635_100000229918 [0,1,0,0,0,0|1,0,2]=4 430 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 2230a_106832991635_200010205864 [0,1,0,0,0,0|0,0,2]=3 431 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 34a_100102657272_200010205864 [0,1,0,0,0,0|0,0,2]=3 432 B13R1.21 CNC(C)C(=O)c1ccc(cc1)O 7a_106832991635_200010205864 [0,1,0,0,0,0|0,0,2]=3 433 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_200000210301 [0,1,0,0,0,0|1,0,0]=2 434 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_200000210301 [0,1,0,0,0,0|1,0,0]=2 435 B13R1.21 COC(=O)C(N)c1ccc(cc1)O 271570a_203496583355_100000747369 [0,1,0,0,0,0|2,0,1]=4 436 B13R1.21 COC(C)C(=O)c1ccc(cc1)O 34a_100138415774_200010205864 [0,1,0,0,0,0|1,0,2]=4 437 B13R1.21 COC(C)N(C)c1ccc(cc1)O 269982a_100000182112_100009879195 [0,1,0,0,0,0|3,0,0]=4 438 B13R1.21 CSC(C)C(=O)c1ccc(cc1)O 62a_200000210301_200010205864 [0,1,0,0,0,0|1,0,2]=4 439 B13R1.21 CSC(C)C(=O)c1ccc(cc1)O 62a_200010205864_200000210301 [0,1,0,0,0,0|1,0,2]=4 440 B13R1.21 C[C@@H](N[13CH3])[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_200025704644 [0,1,0,0,0,0|1,0,0]=2 441 B13R1.21 C[C@@H](N[13CH3])[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_200025704644 [0,1,0,0,0,0|1,0,0]=2 442 B13R1.21 C[C@H](CO)N(C)c1ccc(cc1)O 269982a_100000182112_100016084084 [0,1,0,0,0,0|3,0,0]=4 443 B13R1.21 Cc1ccc(cc1)[C@@H](O)C(=O)CF 1458a_100009815954_100015361967 [0,1,0,0,0,0|2,0,1]=4 444 B13R1.21 O=C(CF)C(O)c1ccc(cc1)Br 1458a_100000756554_100015361967 [0,1,0,0,0,0|2,0,1]=4 445 B13R1.21 O=C(CF)C(O)c1ccc(cc1)F 1458a_100000209909_100015361967 [0,1,0,0,0,0|2,0,1]=4 446 B13R1.21 O=C(CF)C(O)c1ccc(cc1)O 1458a_100011215213_100015361967 [0,1,0,0,0,0|1,0,1]=3 447 B13R1.21 O=C(CF)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100015361967 [0,1,0,0,0,0|2,0,1]=4 448 B13R1.36 C=Cc1ccc(cc1)[C@@H](N)C(C)C 271570a_100011290941_100102422763 [0,1,0,0,0,0|3,0,0]=4 449 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 34a_200010205864_200025704644 [0,1,0,0,0,0|1,0,2]=4 450 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 7a_200010205864_200025704644 [0,1,0,0,0,0|1,0,2]=4 451 B13R1.36 CC(C)C(=O)c1ccc(cc1)CO 1458a_100000183892_100000210206 [0,1,0,0,0,0|1,0,2]=4 452 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100011995950_200025704644 [0,1,0,0,0,0|1,0,2]=4 453 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100011995950_200025704644 [0,1,0,0,0,0|1,0,2]=4 454 B13R1.36 CC(C)[C@H](N)c1ccc(cc1)S[13CH3] 62a_100102422763_200025704644 [0,1,0,0,0,0|2,1,0]=4 455 B13R1.36 CC(C)[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100102422763 [0,1,0,0,0,0|2,1,0]=4 456 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_200000210301 [0,1,0,0,0,0|1,0,2]=4 457 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_200000210301 [0,1,0,0,0,0|1,0,2]=4 458 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 1458a_100000184203_100000210206 [0,1,0,0,0,0|1,0,2]=4 459 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 34a_100011995950_200000210301 [0,1,0,0,0,0|1,0,2]=4 460 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 7a_100011995950_200000210301 [0,1,0,0,0,0|1,0,2]=4 461 B13R1.36 COc1ccc(cc1)C(C)C(=O)C 1458a_100000753396_200000210301 [0,1,0,0,0,0|2,0,1]=4 462 B13R1.36 COc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000753396_200025704644 [0,1,0,0,0,0|2,0,1]=4 463 B13R1.36 COc1ccc(cc1)C(C)N(C)C 2230a_100000736477_200000210301 [0,1,0,0,0,0|3,0,0]=4 464 B13R1.36 COc1ccc(cc1)C(C)N(C)C 269982a_100000736477_200000210301 [0,1,0,0,0,0|3,0,0]=4 465 B13R1.36 COc1ccc(cc1)C(C)N(C)[13CH3] 2230a_100000736477_200025704644 [0,1,0,0,0,0|3,0,0]=4 466 B13R1.36 COc1ccc(cc1)C(C)N(C)[13CH3] 269982a_100000736477_200025704644 [0,1,0,0,0,0|3,0,0]=4 467 B13R1.36 COc1ccc(cc1)C(O)C(=O)C 1458a_100011218652_200000210301 [0,1,0,0,0,0|1,0,1]=3 468 B13R1.36 COc1ccc(cc1)C(O)C(=O)[13CH3] 1458a_100011218652_200025704644 [0,1,0,0,0,0|1,0,1]=3 469 B13R1.36 COc1ccc(cc1)N(C)C(C)C 2230a_100000220023_100000210206 [0,1,0,0,0,0|3,0,0]=4 470 B13R1.36 COc1ccc(cc1)N(C)C(C)C 2230a_100000220024_200000210301 [0,1,0,0,0,0|3,0,0]=4 471 B13R1.36 COc1ccc(cc1)N(C)C(C)C 269982a_100000220023_100000210206 [0,1,0,0,0,0|3,0,0]=4 472 B13R1.36 COc1ccc(cc1)N(C)C(C)C 269982a_100000220024_200000210301 [0,1,0,0,0,0|3,0,0]=4 473 B13R1.36 COc1ccc(cc1)N(C)C(C)C 34a_100000220023_100000210206 [0,1,0,0,0,0|3,0,0]=4 474 B13R1.36 COc1ccc(cc1)N(C)C(C)C 34a_100000220024_200000210301 [0,1,0,0,0,0|3,0,0]=4 475 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 2230a_100000220024_200025704644 [0,1,0,0,0,0|3,0,0]=4 476 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 269982a_100000220024_200025704644 [0,1,0,0,0,0|3,0,0]=4 477 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 34a_100000220024_200025704644 [0,1,0,0,0,0|3,0,0]=4 478 B13R1.36 CSc1ccc(cc1)[C@@H](N)C(C)C 62a_100102422763_200000210301 [0,1,0,0,0,0|2,1,0]=4 479 B13R1.36 CSc1ccc(cc1)[C@@H](N)C(C)C 62a_200000210301_100102422763 [0,1,0,0,0,0|2,1,0]=4 480 B13R1.163 CC(=O)C(O)c1ccc(cc1F)Br 1458a_100011356516_200000210301 [0,1,0,0,0,0|2,0,1]=4 481 B13R1.163 CC(=O)C(O)c1ccc(cc1F)F 1458a_100011216397_200000210301 [0,1,0,0,0,0|2,0,1]=4 482 B13R1.163 CC(C)C(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210206 [0,1,0,0,0,0|1,0,2]=4 483 B13R1.163 CC(C)C(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210206 [0,1,0,0,0,0|1,0,2]=4 484 B13R1.163 CC(C)C(=O)c1ccc(cc1F)O 1458a_100000689029_100000210206 [0,1,0,0,0,0|1,0,2]=4 485 B13R1.163 CC(C)C(=O)c1ccc(cc1O)O 1458a_100000212172_100000210206 [0,1,0,0,0,0|1,0,2]=4 486 B13R1.163 Cc1cc(ccc1C(=O)C(C)C)O 1458a_100000692822_100000210206 [0,1,0,0,0,0|1,0,2]=4 487 B13R1.163 Cc1cc(ccc1N(C)C(C)C)O 269982a_100161107805_100000210206 [0,1,0,0,0,0|3,0,0]=4 488 B13R1.163 Cc1cc(ccc1N(C)C(C)C)O 34a_100161107805_100000210206 [0,1,0,0,0,0|3,0,0]=4 489 B13R1.163 [13CH3]C(=O)C(O)c1ccc(cc1F)Br 1458a_100011356516_200025704644 [0,1,0,0,0,0|2,0,1]=4 490 B13R1.163 [13CH3]C(=O)C(O)c1ccc(cc1F)F 1458a_100011216397_200025704644 [0,1,0,0,0,0|2,0,1]=4 491 B13R1.510 CC(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200000210301 [0,1,0,0,0,0|2,0,1]=4 492 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,1,0,0,0,0|1,0,1]=3 493 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210206 [0,1,0,0,0,0|1,0,2]=4 494 B13R1.510 CC(C)C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210206 [0,1,0,0,0,0|1,0,2]=4 495 B13R1.510 CC(C)C(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210206 [0,1,0,0,0,0|1,0,2]=4 496 B13R1.510 CC(C)C(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210206 [0,1,0,0,0,0|1,0,2]=4 497 B13R1.510 CC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210206 [0,1,0,0,0,0|1,0,2]=4 498 B13R1.510 Cc1cc(ccc1O)C(=O)C(C)C 1458a_100000685612_100000210206 [0,1,0,0,0,0|1,0,2]=4 499 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200025704644 [0,1,0,0,0,0|2,0,1]=4 500 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,1,0,0,0,0|1,0,1]=3 501 B13R1.522 CC(=O)C(C)(C)c1ccc(cc1)O 1458a_100000721645_200000210301 [0,1,0,0,0,0|2,0,1]=4 502 B13R1.522 CC(=O)C(C)(O)c1ccc(cc1)C 1458a_100011434902_200000210301 [0,1,0,0,0,0|2,0,1]=4 503 B13R1.522 CC(=O)C(C)(O)c1ccc(cc1)Cl 1458a_100000695402_200000210301 [0,1,0,0,0,0|2,0,1]=4 504 B13R1.522 CC(C)(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000721645_200025704644 [0,1,0,0,0,0|2,0,1]=4 505 B13R1.522 CC(C)S(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765145 [0,1,0,0,0,0|2,0,1]=4 506 B13R1.522 CC(O)(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100000695402_200025704644 [0,1,0,0,0,0|2,0,1]=4 507 B13R1.522 Cc1ccc(cc1)C(C)(O)C(=O)[13CH3] 1458a_100011434902_200025704644 [0,1,0,0,0,0|2,0,1]=4 508 B13R1.525 CC(C)(C)C(=O)c1ccc(cc1)O 271570a_203496583355_100000701730 [0,1,0,0,0,0|1,0,2]=4 509 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 269982a_100000182112_100000210625 [0,1,0,0,0,0|3,0,0]=4 510 B13R1.525 CN(c1ccc(cc1)O)C(C)(C)C 34a_100000182112_100000210625 [0,1,0,0,0,0|3,0,0]=4 511 B13R1.525 N[C@@H](c1ccc(cc1)O)C(F)(F)F 271570a_203496583355_100016988356 [0,1,0,0,0,0|3,0,0]=4 512 B13R1.525 Oc1ccc(cc1)[C@H](O)C(F)(F)F 271570a_203496583355_100010192173 [0,1,0,0,0,0|2,0,0]=3 513 B13R1.706 CC(C)C(C#N)c1ccc(cc1)O 271570a_203496583355_100000698803 [0,1,0,0,0,0|2,0,0]=3 514 B13R1.706 CC(C)C(N[13CH3])c1ccc(cc1)Cl 2230a_100015204473_200025704644 [0,1,0,0,0,0|3,0,0]=4 515 B13R1.706 CC(C)C(N[13CH3])c1ccc(cc1)Cl 34a_100015204473_200025704644 [0,1,0,0,0,0|3,0,0]=4 516 B13R1.706 CC(C)[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100102422763_200025704644 [0,1,0,0,0,0|3,0,0]=4 517 B13R1.706 CC(C)[C@H](N[13CH3])c1ccc(cc1)Br 34a_100102422763_200025704644 [0,1,0,0,0,0|3,0,0]=4 518 B13R1.706 CCN(c1ccc(cc1)O)C(C)C 2230a_100011337800_100000210206 [0,1,0,0,0,0|3,0,0]=4 519 B13R1.706 CCN(c1ccc(cc1)O)C(C)C 269982a_100011337800_100000210206 [0,1,0,0,0,0|3,0,0]=4 520 B13R1.706 CCN(c1ccc(cc1)O)C(C)C 34a_100011337800_100000210206 [0,1,0,0,0,0|3,0,0]=4 521 B13R1.706 CNC(c1ccc(cc1)Br)C(C)C 269862a_106832991636_100011220430 [0,1,0,0,0,0|3,0,0]=4 522 B13R1.706 CNC(c1ccc(cc1)Cl)C(C)C 2230a_100015204473_200000210301 [0,1,0,0,0,0|3,0,0]=4 523 B13R1.706 CNC(c1ccc(cc1)Cl)C(C)C 269862a_106832991636_100000742363 [0,1,0,0,0,0|3,0,0]=4 524 B13R1.706 CNC(c1ccc(cc1)Cl)C(C)C 34a_100015204473_200000210301 [0,1,0,0,0,0|3,0,0]=4 525 B13R1.706 CNC(c1ccc(cc1)F)C(C)C 269862a_106832991636_100011218555 [0,1,0,0,0,0|3,0,0]=4 526 B13R1.706 CN[C@H](c1ccc(cc1)Br)C(C)C 2230a_100102422763_200000210301 [0,1,0,0,0,0|3,0,0]=4 527 B13R1.706 CN[C@H](c1ccc(cc1)Br)C(C)C 34a_100102422763_200000210301 [0,1,0,0,0,0|3,0,0]=4 528 B13R1.706 CN[C@H](c1ccc(cc1)C)C(C)C 2230a_100020633675_200000210301 [0,1,0,0,0,0|3,0,0]=4 529 B13R1.706 CN[C@H](c1ccc(cc1)C)C(C)C 34a_100020633675_200000210301 [0,1,0,0,0,0|3,0,0]=4 530 B13R1.706 COC(C(=O)C)c1ccc(cc1)Cl 1458a_100012350483_200000210301 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.706 COC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100012350483_200025704644 [0,1,0,0,0,0|2,0,1]=4 532 B13R1.706 CO[C@@H](c1ccc(cc1)Cl)[C@@H](C)N 34a_200009830414_200000210301 [0,1,0,0,0,0|1,0,0]=2 533 B13R1.706 C[C@@H](N)[C@@H](O[13CH3])c1ccc(cc1)Cl 34a_200009830414_200025704644 [0,1,0,0,0,0|1,0,0]=2 534 B13R1.706 Cc1ccc(cc1)[C@@H](N[13CH3])C(C)C 2230a_100020633675_200025704644 [0,1,0,0,0,0|3,0,0]=4 535 B13R1.706 Cc1ccc(cc1)[C@@H](N[13CH3])C(C)C 34a_100020633675_200025704644 [0,1,0,0,0,0|3,0,0]=4 536 B13R2.520 C=C(c1ccc(cc1)O)C2CC2 271570a_100010895485_100000185759 [0,0,0,1,0,0|2,0,1]=4 537 B13R2.520 CN(c1ccc(cc1)O)C2CC2 269982a_100000182112_100000211595 [0,0,0,1,0,0|3,0,0]=4 538 B13R2.520 CN(c1ccc(cc1)O)C2CC2 34a_100000182112_100000211595 [0,0,0,1,0,0|3,0,0]=4 539 B13R2.520 NC(c1ccc(nc1)O)C2CC2 271570a_203496583355_100000114804 [0,0,0,1,0,0|3,0,0]=4 540 B13R2.520 O=C(c1ccc(cc1)O)C2CC2 271570a_203496583355_100000764646 [0,0,0,1,0,0|1,0,2]=4 541 B13R2.520 O=S(c1ccc(cc1)O)C2CC2 271570a_203496583355_103551703186 [0,0,0,1,0,0|2,0,1]=4 542 B13R2.520 Oc1ccc(cc1)C(O)C2CC2 271570a_203496583355_100000756592 [0,0,0,1,0,0|1,0,0]=2 543 B13R2.2988 Oc1ccc(cc1)C2CC2(F)F 271570a_203496583355_100010729999 [0,0,0,1,0,0|3,0,0]=4 544 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,0,0,1,0,0|2,0,1]=4 545 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,0,0,1,0,0|1,0,2]=4 546 B13R1.132 CC(=O)CC(O)c1ccc(cc1)Cl 1458a_100000070787_200011996143 [0,0,0,0,0,1|2,0,1]=4 547 B13R1.132 CC(=O)C[C@H](O)c1ccc(cc1)F 1458a_100000070787_100000720402 [0,0,0,0,0,1|2,0,1]=4 548 B13R1.132 CC(=O)NC(C)c1ccc(cc1)O 271570a_203496583355_100000153805 [0,0,0,0,0,1|2,0,1]=4 549 B13R1.132 CC(=O)N[C@@H](C)c1ccc(cc1)O 240690a_100161106496_100015343762 [0,0,0,0,0,1|2,0,1]=4 550 B13R1.132 CC(C)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000210624 [0,0,0,0,0,1|1,0,2]=4 551 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 269982a_100000182112_100000210624 [0,0,0,0,0,1|3,0,0]=4 552 B13R1.132 CC(C)CN(C)c1ccc(cc1)O 34a_100000182112_100000210624 [0,0,0,0,0,1|3,0,0]=4 553 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Br 271570a_100015190218_100000752885 [0,0,0,0,0,1|3,0,0]=4 554 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)Cl 271570a_100015190218_100000755918 [0,0,0,0,0,1|3,0,0]=4 555 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)F 271570a_100015190218_100000211213 [0,0,0,0,0,1|3,0,0]=4 556 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)N 271570a_100015190218_100000185761 [0,0,0,0,0,1|3,0,0]=4 557 B13R1.132 CC(C)C[C@H](N)c1ccc(cc1)O 271570a_100015190218_100000185759 [0,0,0,0,0,1|2,0,0]=3 558 B13R1.132 CC(C)C[C@H](N)c1ccc(cn1)O 271570a_100015190218_100000685995 [0,0,0,0,0,1|3,0,0]=4 559 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 240690a_100138425928_100000212099 [0,0,0,0,0,1|1,0,2]=4 560 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 271570a_203496583355_200000152628 [0,0,0,0,0,1|1,0,2]=4 561 B13R1.132 CC(C)NC(=O)c1ccc(cc1)O 527a_100138425928_100000212099 [0,0,0,0,0,1|1,0,2]=4 562 B13R1.132 CC(C)NC(C)c1ccc(cc1)Br 2230a_100138425928_100000755118 [0,0,0,0,0,1|3,0,0]=4 563 B13R1.132 CC(C)NC(C)c1ccc(cc1)Br 34a_100138425928_100000755118 [0,0,0,0,0,1|3,0,0]=4 564 B13R1.132 CC(C)NC(C)c1ccc(cc1)Cl 2230a_100138425928_100000684792 [0,0,0,0,0,1|3,0,0]=4 565 B13R1.132 CC(C)NC(C)c1ccc(cc1)F 2230a_100138425928_100000743420 [0,0,0,0,0,1|3,0,0]=4 566 B13R1.132 CC(C)NC(C)c1ccc(cc1)F 34a_100138425928_100000743420 [0,0,0,0,0,1|3,0,0]=4 567 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210206 [0,0,0,0,0,1|3,0,0]=4 568 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210206 [0,0,0,0,0,1|3,0,0]=4 569 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210206 [0,0,0,0,0,1|3,0,0]=4 570 B13R1.132 CC(C)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210206 [0,0,0,0,0,1|2,0,0]=3 571 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210206 [0,0,0,0,0,1|3,0,0]=4 572 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210206 [0,0,0,0,0,1|3,0,0]=4 573 B13R1.132 CC(C)N[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210206 [0,0,0,0,0,1|3,0,0]=4 574 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000212225_100000755118 [0,0,0,0,0,1|3,0,0]=4 575 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 34a_100000745893_100000210206 [0,0,0,0,0,1|3,0,0]=4 576 B13R1.132 CC(C)OC(C)c1ccc(cc1)Br 7a_100000745893_100000210206 [0,0,0,0,0,1|3,0,0]=4 577 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000181323_100000210206 [0,0,0,0,0,1|3,0,0]=4 578 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 34a_100000212225_100000743420 [0,0,0,0,0,1|3,0,0]=4 579 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 7a_100000181323_100000210206 [0,0,0,0,0,1|3,0,0]=4 580 B13R1.132 CC(C)OC(C)c1ccc(cc1)N 34a_100011216399_100000210206 [0,0,0,0,0,1|3,0,0]=4 581 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210206 [0,0,0,0,0,1|3,0,0]=4 582 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210206 [0,0,0,0,0,1|3,0,0]=4 583 B13R1.132 CC(C)SC(C)c1ccc(cc1)Br 62a_100000210206_100000755118 [0,0,0,0,0,1|3,0,0]=4 584 B13R1.132 CC(C)SC(C)c1ccc(cc1)Br 62a_100000755118_100000210206 [0,0,0,0,0,1|3,0,0]=4 585 B13R1.132 CC(C)SC(C)c1ccc(cc1)Cl 62a_100000210206_100000684792 [0,0,0,0,0,1|3,0,0]=4 586 B13R1.132 CC(C)SC(C)c1ccc(cc1)Cl 62a_100000684792_100000210206 [0,0,0,0,0,1|3,0,0]=4 587 B13R1.132 CC(C)SC(C)c1ccc(cc1)F 62a_100000210206_100000743420 [0,0,0,0,0,1|3,0,0]=4 588 B13R1.132 CC(C)SC(C)c1ccc(cc1)F 62a_100000743420_100000210206 [0,0,0,0,0,1|3,0,0]=4 589 B13R1.132 CC(O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100011218427 [0,0,0,0,0,1|1,0,2]=4 590 B13R1.132 CC(O)CN(C)c1ccc(cc1)O 269982a_100000182112_100011218427 [0,0,0,0,0,1|3,0,0]=4 591 B13R1.132 CC(O)CN(C)c1ccc(cc1)O 34a_100000182112_100011218427 [0,0,0,0,0,1|3,0,0]=4 592 B13R1.132 CN(C)CC(O)c1ccc(cc1)Cl 2230a_100102631434_200011996143 [0,0,0,0,0,1|3,0,0]=4 593 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 2230a_100016988945_200000210301 [0,0,0,0,0,1|2,0,0]=3 594 B13R1.132 CN(C)CC(O)c1ccc(cc1)O 269982a_100016988945_200000210301 [0,0,0,0,0,1|2,0,0]=3 595 B13R1.132 CN(C)C[C@H](O)c1ccc(cc1)F 2230a_100102631434_100000720402 [0,0,0,0,0,1|3,0,0]=4 596 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 2230a_100016988945_200025704644 [0,0,0,0,0,1|2,0,0]=3 597 B13R1.132 CN([13CH3])CC(O)c1ccc(cc1)O 269982a_100016988945_200025704644 [0,0,0,0,0,1|2,0,0]=3 598 B13R1.132 C[C@@H](O)CN(C)c1ccc(cc1)O 269982a_100000182112_100009817552 [0,0,0,0,0,1|3,0,0]=4 599 B13R1.132 C[C@@H](O)CN(C)c1ccc(cc1)O 34a_100000182112_100009817552 [0,0,0,0,0,1|3,0,0]=4 600 B13R1.132 Cc1ccc(cc1)C(C)NC(C)C 2230a_100138425928_100011261388 [0,0,0,0,0,1|3,0,0]=4 601 B13R1.132 Cc1ccc(cc1)C(C)NC(C)C 34a_100138425928_100011261388 [0,0,0,0,0,1|3,0,0]=4 602 B13R1.132 Cc1ccc(cc1)C(C)OC(C)C 34a_100000212225_100011261388 [0,0,0,0,0,1|3,0,0]=4 603 B13R1.132 Cc1ccc(cc1)C(C)SC(C)C 62a_100000210206_100011261388 [0,0,0,0,0,1|3,0,0]=4 604 B13R1.132 Cc1ccc(cc1)C(C)SC(C)C 62a_100011261388_100000210206 [0,0,0,0,0,1|3,0,0]=4 605 B13R1.132 Cc1ccc(cc1)[C@@H](C)NC(C)C 2230a_100016988085_100000210206 [0,0,0,0,0,1|3,0,0]=4 606 B13R1.132 Cc1ccc(cc1)[C@@H](C)NC(C)C 34a_100016988085_100000210206 [0,0,0,0,0,1|3,0,0]=4 607 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 34a_100000690690_100000210206 [0,0,0,0,0,1|3,0,0]=4 608 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 7a_100000690690_100000210206 [0,0,0,0,0,1|3,0,0]=4 609 B13R1.132 Cc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000186775 [0,0,0,0,0,1|3,0,0]=4 610 B13R1.132 [2H]C(OC(C)C)c1ccc(cc1)F 34a_217856618577_100000210206 [0,0,0,0,0,1|3,0,0]=4 611 B13R1.132 [2H]C(OC(C)C)c1ccc(cc1)F 7a_217856618577_100000210206 [0,0,0,0,0,1|3,0,0]=4 612 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)O 62a_100009814033_100000185759 [0,0,0,0,0,1|2,0,1]=4 613 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200000210301 [0,0,0,0,0,1|2,0,1]=4 614 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200000210301 [0,0,0,0,0,1|2,0,1]=4 615 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [0,0,0,0,0,1|1,0,1]=3 616 B13R1.133 CC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_200000210301 [0,0,0,0,0,1|2,0,1]=4 617 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200000210301 [0,0,0,0,0,1|2,0,1]=4 618 B13R1.133 CC(C)C(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210206 [0,0,0,0,0,1|1,0,2]=4 619 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000210198 [0,0,0,0,0,1|1,0,2]=4 620 B13R1.133 CC(C)C(=O)Nc1ccc(cc1)O 271570a_203496583355_200000153573 [0,0,0,0,0,1|1,0,2]=4 621 B13R1.133 CC(C)N(C)Cc1ccc(cc1)O 2230a_100000207500_100000210206 [0,0,0,0,0,1|3,0,0]=4 622 B13R1.133 CC(C)N(C)Cc1ccc(cc1)O 269982a_100000207500_100000210206 [0,0,0,0,0,1|3,0,0]=4 623 B13R1.133 CC(Cc1ccc(cc1)O)N(C)C 270004a_100102631434_100011218180 [0,0,0,0,0,1|3,0,0]=4 624 B13R1.133 CC(F)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000062450 [0,0,0,0,0,1|1,0,2]=4 625 B13R1.133 CC(Nc1ccc(cc1)O)C(=O)N 34a_100000185829_100000702099 [0,0,0,0,0,1|2,0,1]=4 626 B13R1.133 CC(Oc1ccc(cc1)O)C(=O)N 271570a_203496583355_100000150412 [0,0,0,0,0,1|2,0,1]=4 627 B13R1.133 CC(Sc1ccc(cc1)O)C(=O)N 62a_100000702099_100000185759 [0,0,0,0,0,1|2,0,1]=4 628 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000717761 [0,0,0,0,0,1|1,0,2]=4 629 B13R1.133 C[C@@H](Oc1ccc(cc1)O)C(=O)[13CH3] 1458a_100000005562_200025704644 [0,0,0,0,0,1|2,0,1]=4 630 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)O 22a_100000185829_217856618621 [0,0,0,0,0,1|1,0,2]=4 631 B13R1.133 NC(=O)C(F)Nc1ccc(cc1)O 34a_100000185829_100009813875 [0,0,0,0,0,1|2,0,1]=4 632 B13R1.133 NC(=O)C(F)Sc1ccc(cc1)O 62a_100009813875_100000185759 [0,0,0,0,0,1|2,0,1]=4 633 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200025704644 [0,0,0,0,0,1|2,0,1]=4 634 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200025704644 [0,0,0,0,0,1|2,0,1]=4 635 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [0,0,0,0,0,1|1,0,1]=3 636 B13R1.133 [13CH3]C(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200025704644 [0,0,0,0,0,1|2,0,1]=4 637 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [2,0,0,0,0,0|0,0,2]=4 638 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [2,0,0,0,0,0|0,0,2]=4 639 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [2,0,0,0,0,0|0,0,0]=2 640 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [2,0,0,0,0,0|2,0,0]=4 641 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 642 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 643 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [2,0,0,0,0,0|2,0,0]=4 644 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 645 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 646 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [2,0,0,0,0,0|2,0,0]=4 647 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 648 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [2,0,0,0,0,0|1,0,0]=3 649 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [2,0,0,0,0,0|1,0,0]=3 650 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [2,0,0,0,0,0|2,0,0]=4 651 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 652 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 653 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 654 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 655 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 656 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 657 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [2,0,0,0,0,0|2,0,0]=4 658 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 659 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 660 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [2,0,0,0,0,0|2,0,0]=4 661 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [2,0,0,0,0,0|1,0,0]=3 662 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [2,0,0,0,0,0|2,0,0]=4 663 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [2,0,0,0,0,0|2,0,0]=4 664 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [2,0,0,0,0,0|2,0,0]=4 665 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [2,0,0,0,0,0|2,0,0]=4 666 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [2,0,0,0,0,0|2,0,0]=4 667 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [2,0,0,0,0,0|2,0,0]=4 668 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [2,0,0,0,0,0|2,0,0]=4 669 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [2,0,0,0,0,0|2,0,0]=4 670 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [2,0,0,0,0,0|2,0,0]=4 671 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [2,0,0,0,0,0|2,0,0]=4 672 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 673 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [2,0,0,0,0,0|2,0,0]=4 674 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [2,0,0,0,0,0|1,0,0]=3 675 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [2,0,0,0,0,0|1,0,0]=3 676 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [2,0,0,0,0,0|2,0,0]=4 677 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [2,0,0,0,0,0|2,0,0]=4 678 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [2,0,0,0,0,0|2,0,0]=4 679 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [2,0,0,0,0,0|2,0,0]=4 680 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 681 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 682 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [2,0,0,0,0,0|2,0,0]=4 683 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [2,0,0,0,0,0|2,0,0]=4 684 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 685 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [2,0,0,0,0,0|2,0,0]=4 686 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 687 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [2,0,0,0,0,0|2,0,0]=4 688 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [2,0,0,0,0,0|2,0,0]=4 689 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [2,0,0,0,0,0|2,0,0]=4 690 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [2,0,0,0,0,0|2,0,0]=4 691 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [2,0,0,0,0,0|2,0,0]=4 692 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [2,0,0,0,0,0|2,0,0]=4 693 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [2,0,0,0,0,0|2,0,0]=4 694 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [2,0,0,0,0,0|2,0,0]=4 695 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [2,0,0,0,0,0|2,0,0]=4 696 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 697 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [2,0,0,0,0,0|2,0,0]=4 698 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [2,0,0,0,0,0|2,0,0]=4 699 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 700 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [2,0,0,0,0,0|2,0,0]=4 701 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [2,0,0,0,0,0|2,0,0]=4 702 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [2,0,0,0,0,0|2,0,0]=4 703 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 704 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 705 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [2,0,0,0,0,0|2,0,0]=4 706 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 707 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [2,0,0,0,0,0|2,0,0]=4 708 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 709 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [2,0,0,0,0,0|2,0,0]=4 710 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 711 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 712 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 713 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [2,0,0,0,0,0|2,0,0]=4 714 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 715 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [2,0,0,0,0,0|1,0,0]=3 716 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [2,0,0,0,0,0|1,0,0]=3 717 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [2,0,0,0,0,0|2,0,0]=4 718 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [2,0,0,0,0,0|2,0,0]=4 719 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [2,0,0,0,0,0|2,0,0]=4 720 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [2,0,0,0,0,0|2,0,0]=4 721 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [2,0,0,0,0,0|2,0,0]=4 722 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 723 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [2,0,0,0,0,0|2,0,0]=4 724 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 725 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 726 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [2,0,0,0,0,0|2,0,0]=4 727 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 728 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 729 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [2,0,0,0,0,0|2,0,0]=4 730 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 731 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 732 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [2,0,0,0,0,0|2,0,0]=4 733 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 734 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [2,0,0,0,0,0|2,0,0]=4 735 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [2,0,0,0,0,0|1,0,0]=3 736 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [2,0,0,0,0,0|2,0,0]=4 737 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [2,0,0,0,0,0|2,0,0]=4 738 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [2,0,0,0,0,0|2,0,0]=4 739 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [2,0,0,0,0,0|2,0,0]=4 740 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [2,0,0,0,0,0|2,0,0]=4 741 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [2,0,0,0,0,0|2,0,0]=4 742 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [2,0,0,0,0,0|2,0,0]=4 743 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [2,0,0,0,0,0|2,0,0]=4 744 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [2,0,0,0,0,0|2,0,0]=4 745 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [2,0,0,0,0,0|2,0,0]=4 746 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [2,0,0,0,0,0|2,0,0]=4 747 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [2,0,0,0,0,0|2,0,0]=4 748 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [2,0,0,0,0,0|2,0,0]=4 749 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 750 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 751 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [2,0,0,0,0,0|2,0,0]=4 752 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [2,0,0,0,0,0|2,0,0]=4 753 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [2,0,0,0,0,0|0,0,2]=4 754 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [2,0,0,0,0,0|0,0,0]=2 755 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [2,0,0,0,0,0|1,0,0]=3 756 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [2,0,0,0,0,0|2,0,0]=4 757 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [2,0,0,0,0,0|1,0,1]=4 758 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [2,0,0,0,0,0|1,0,0]=3 759 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [2,0,0,0,0,0|2,0,0]=4 760 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [2,0,0,0,0,0|2,0,0]=4 761 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [2,0,0,0,0,0|2,0,0]=4 762 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [2,0,0,0,0,0|2,0,0]=4 763 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 764 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 765 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 766 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 767 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 768 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 769 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 770 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 771 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [2,0,0,0,0,0|1,0,0]=3 772 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [2,0,0,0,0,0|2,0,0]=4 773 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [2,0,0,0,0,0|2,0,0]=4 774 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 775 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 776 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 777 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 778 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 779 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 780 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [2,0,0,0,0,0|2,0,0]=4 781 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [2,0,0,0,0,0|2,0,0]=4 782 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [2,0,0,0,0,0|2,0,0]=4 783 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [2,0,0,0,0,0|2,0,0]=4 784 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [2,0,0,0,0,0|2,0,0]=4 785 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [2,0,0,0,0,0|2,0,0]=4 786 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [2,0,0,0,0,0|2,0,0]=4 787 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [2,0,0,0,0,0|2,0,0]=4 788 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [2,0,0,0,0,0|2,0,0]=4 789 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [2,0,0,0,0,0|1,0,1]=4 790 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [2,0,0,0,0,0|2,0,0]=4 791 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [2,0,0,0,0,0|2,0,0]=4 792 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [2,0,0,0,0,0|2,0,0]=4 793 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [2,0,0,0,0,0|2,0,0]=4 794 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [2,0,0,0,0,0|2,0,0]=4 795 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 796 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [2,0,0,0,0,0|2,0,0]=4 797 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 798 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [2,0,0,0,0,0|2,0,0]=4 799 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [2,0,0,0,0,0|2,0,0]=4 800 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 801 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 802 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [2,0,0,0,0,0|1,0,1]=4 803 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [2,0,0,0,0,0|1,0,1]=4 804 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [2,0,0,0,0,0|0,0,2]=4 805 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [2,0,0,0,0,0|0,0,2]=4 806 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [2,0,0,0,0,0|1,0,0]=3 807 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [2,0,0,0,0,0|2,0,0]=4 808 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [2,0,0,0,0,0|2,0,0]=4 809 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [2,0,0,0,0,0|2,0,0]=4 810 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [2,0,0,0,0,0|0,0,0]=2 811 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [2,0,0,0,0,0|1,0,0]=3 812 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [2,0,0,0,0,0|1,0,0]=3 813 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [2,0,0,0,0,0|2,0,0]=4 814 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [2,0,0,0,0,0|2,0,0]=4 815 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [2,0,0,0,0,0|2,0,0]=4 816 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [2,0,0,0,0,0|2,0,0]=4 817 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [2,0,0,0,0,0|2,0,0]=4 818 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [2,0,0,0,0,0|1,0,1]=4 819 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [2,0,0,0,0,0|1,0,0]=3 820 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [2,0,0,0,0,0|1,0,0]=3 821 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [2,0,0,0,0,0|2,0,0]=4 822 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [2,0,0,0,0,0|0,0,2]=4 823 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [2,0,0,0,0,0|2,0,0]=4 824 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [2,0,0,0,0,0|2,0,0]=4 825 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [2,0,0,0,0,0|0,0,2]=4 826 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [2,0,0,0,0,0|2,0,0]=4 827 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [2,0,0,0,0,0|2,0,0]=4 828 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [2,0,0,0,0,0|0,0,2]=4 829 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 830 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 831 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [2,0,0,0,0,0|2,0,0]=4 832 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 833 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [2,0,0,0,0,0|2,0,0]=4 834 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [2,0,0,0,0,0|2,0,0]=4 835 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 836 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 837 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [2,0,0,0,0,0|2,0,0]=4 838 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [2,0,0,0,0,0|2,0,0]=4 839 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [2,0,0,0,0,0|2,0,0]=4 840 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [2,0,0,0,0,0|2,0,0]=4 841 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [2,0,0,0,0,0|2,0,0]=4 842 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [2,0,0,0,0,0|2,0,0]=4 843 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [2,0,0,0,0,0|2,0,0]=4 844 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [2,0,0,0,0,0|2,0,0]=4 845 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [2,0,0,0,0,0|2,0,0]=4 846 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [2,0,0,0,0,0|2,0,0]=4 847 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [2,0,0,0,0,0|2,0,0]=4 848 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [2,0,0,0,0,0|2,0,0]=4 849 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [2,0,0,0,0,0|2,0,0]=4 850 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [2,0,0,0,0,0|2,0,0]=4 851 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [1,1,0,0,0,0|2,0,0]=4 852 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [1,1,0,0,0,0|1,0,1]=4 853 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [1,1,0,0,0,0|1,0,1]=4 854 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [1,1,0,0,0,0|1,0,1]=4 855 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [1,1,0,0,0,0|1,0,1]=4 856 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [1,1,0,0,0,0|2,0,0]=4 857 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [1,1,0,0,0,0|2,0,0]=4 858 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [1,1,0,0,0,0|1,1,0]=4 859 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [1,1,0,0,0,0|1,1,0]=4 860 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [1,1,0,0,0,0|2,0,0]=4 861 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [1,1,0,0,0,0|2,0,0]=4 862 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [1,1,0,0,0,0|2,0,0]=4 863 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [1,1,0,0,0,0|2,0,0]=4 864 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [1,1,0,0,0,0|2,0,0]=4 865 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [1,1,0,0,0,0|2,0,0]=4 866 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [1,1,0,0,0,0|2,0,0]=4 867 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [1,1,0,0,0,0|0,0,0]=2 868 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [1,1,0,0,0,0|2,0,0]=4 869 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [1,1,0,0,0,0|2,0,0]=4 870 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [1,1,0,0,0,0|2,0,0]=4 871 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [1,1,0,0,0,0|2,0,0]=4 873 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [1,1,0,0,0,0|1,0,1]=4 874 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [1,1,0,0,0,0|1,0,1]=4 875 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [1,1,0,0,0,0|1,0,1]=4 876 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [1,1,0,0,0,0|1,0,1]=4 877 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [1,1,0,0,0,0|1,0,1]=4 878 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [1,1,0,0,0,0|0,0,0]=2 879 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [1,1,0,0,0,0|2,0,0]=4 880 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [1,1,0,0,0,0|2,0,0]=4 881 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [1,1,0,0,0,0|2,0,0]=4 882 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [1,1,0,0,0,0|2,0,0]=4 883 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [1,1,0,0,0,0|2,0,0]=4 884 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [1,1,0,0,0,0|2,0,0]=4 885 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [1,1,0,0,0,0|2,0,0]=4 886 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [1,1,0,0,0,0|2,0,0]=4 887 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [1,1,0,0,0,0|2,0,0]=4 888 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [1,1,0,0,0,0|2,0,0]=4 889 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [1,1,0,0,0,0|2,0,0]=4 890 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [1,1,0,0,0,0|2,0,0]=4 891 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [1,1,0,0,0,0|1,1,0]=4 892 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [1,1,0,0,0,0|1,1,0]=4 893 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [1,1,0,0,0,0|1,0,1]=4 894 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [1,1,0,0,0,0|1,0,1]=4 895 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,1,0,0,0,0|1,0,1]=4 896 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,1,0,0,0,0|1,0,1]=4 897 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,1,0,0,0,0|1,0,1]=4 898 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,1,0,0,0,0|1,0,1]=4 899 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,1,0,0,0,0|1,0,1]=4 900 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,1,0,0,0,0|1,0,1]=4 901 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [1,1,0,0,0,0|2,0,0]=4 902 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [1,1,0,0,0,0|2,0,0]=4 903 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 904 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 905 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,1,0,0,0,0|2,0,0]=4 906 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [1,1,0,0,0,0|2,0,0]=4 907 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [1,1,0,0,0,0|2,0,0]=4 908 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [1,1,0,0,0,0|2,0,0]=4 909 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [1,1,0,0,0,0|2,0,0]=4 910 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [1,1,0,0,0,0|2,0,0]=4 911 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [1,1,0,0,0,0|2,0,0]=4 912 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [1,1,0,0,0,0|2,0,0]=4 913 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [1,1,0,0,0,0|2,0,0]=4 914 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [1,1,0,0,0,0|2,0,0]=4 915 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,1,0,0,0,0|2,0,0]=4 916 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,1,0,0,0,0|1,0,1]=4 917 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,1,0,0,0,0|2,0,0]=4 918 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,1,0,0,0,0|2,0,0]=4 919 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,1,0,0,0,0|2,0,0]=4 920 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,1,0,0,0,0|1,0,1]=4 921 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,1,0,0,0,0|1,0,1]=4 922 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,1,0,0,0,0|1,0,1]=4 923 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,1,0,0,0,0|1,0,1]=4 924 B12R1.49 C#CC(C)Nc1ccc(cc1)O 34a_100000185829_200000035995 [1,1,0,0,0,0|2,0,0]=4 925 B12R1.49 C#CC(C)Sc1ccc(cc1)O 62a_200000035995_100000185759 [1,1,0,0,0,0|2,0,0]=4 926 B12R1.49 C=CC(C)Sc1ccc(cc1)O 62a_100011215867_100000185759 [1,1,0,0,0,0|2,0,0]=4 927 B12R1.49 CC(C#N)Sc1ccc(cc1)O 62a_100000703298_100000185759 [1,1,0,0,0,0|1,0,1]=4 928 B12R1.49 CC(CO)Nc1ccc(cc1)O 34a_100000185829_100012180447 [1,1,0,0,0,0|2,0,0]=4 929 B12R1.49 CC(CO)Sc1ccc(cc1)O 62a_100012180447_100000185759 [1,1,0,0,0,0|2,0,0]=4 930 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [1,1,0,0,0,0|2,0,0]=4 931 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [1,1,0,0,0,0|2,0,0]=4 932 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [1,1,0,0,0,0|0,0,0]=2 933 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [1,1,0,0,0,0|0,0,0]=2 934 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [1,1,0,0,0,0|1,0,1]=4 935 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [1,1,0,0,0,0|2,0,0]=4 936 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [1,1,0,0,0,0|2,0,0]=4 937 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [1,1,0,0,0,0|2,0,0]=4 938 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [1,1,0,0,0,0|2,0,0]=4 939 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [1,1,0,0,0,0|2,0,0]=4 940 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [1,1,0,0,0,0|2,0,0]=4 941 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [1,1,0,0,0,0|2,0,0]=4 942 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [1,1,0,0,0,0|1,0,1]=4 943 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [1,1,0,0,0,0|1,0,1]=4 944 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [1,1,0,0,0,0|1,0,1]=4 945 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [1,1,0,0,0,0|1,0,1]=4 946 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [1,1,0,0,0,0|1,0,0]=3 947 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [1,1,0,0,0,0|1,0,0]=3 948 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [1,1,0,0,0,0|1,0,0]=3 949 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [1,1,0,0,0,0|1,0,0]=3 950 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [1,1,0,0,0,0|0,0,0]=2 951 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [1,1,0,0,0,0|0,0,0]=2 952 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [1,1,0,0,0,0|0,0,0]=2 953 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [1,1,0,0,0,0|1,0,1]=4 954 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [1,1,0,0,0,0|2,0,0]=4 955 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [1,1,0,0,0,0|2,0,0]=4 956 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [1,1,0,0,0,0|2,0,0]=4 957 B12R1.49 C[C@H](CO)Sc1ccc(cc1)O 62a_100016084084_100000185759 [1,1,0,0,0,0|2,0,0]=4 958 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [1,1,0,0,0,0|1,0,1]=4 959 B12R1.106 CC(C)(C)Nc1ccc(cc1)O 34a_100000185829_100000210625 [1,1,0,0,0,0|2,0,0]=4 960 B12R1.106 CC(C)(C)Oc1ccc(cc1)O 271570a_203496583355_100000701926 [1,1,0,0,0,0|2,0,0]=4 961 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 271570a_203496583355_200009816747 [1,1,0,0,0,0|2,0,0]=4 962 B12R1.106 CC(C)(C)Sc1ccc(cc1)O 62a_100000211941_100000185759 [1,1,0,0,0,0|2,0,0]=4 963 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [1,1,0,0,0,0|1,0,0]=3 964 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [1,1,0,0,0,0|2,0,0]=4 965 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [1,1,0,0,0,0|1,1,0]=4 966 B12R1.106 NS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100000764258 [1,1,0,0,0,0|2,0,0]=4 967 B12R1.106 Oc1ccc(cc1)CC(F)(F)F 271570a_203496583355_100000723781 [1,1,0,0,0,0|2,0,0]=4 968 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [1,1,0,0,0,0|1,0,1]=4 969 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [1,1,0,0,0,0|1,0,1]=4 970 B12R1.233 CC(C)Nc1ccc(cc1Br)O 34a_100012001276_100000210206 [1,1,0,0,0,0|2,0,0]=4 971 B12R1.233 CC(C)Nc1ccc(cc1Cl)O 34a_100011215599_100000210206 [1,1,0,0,0,0|2,0,0]=4 972 B12R1.233 CC(C)Nc1ccc(cc1F)O 34a_100000759473_100000210206 [1,1,0,0,0,0|2,0,0]=4 973 B12R1.233 CC(C)Nc1ccc(cc1I)O 34a_100010084370_100000210206 [1,1,0,0,0,0|2,0,0]=4 974 B12R1.233 CC(C)Nc1ccc(cc1O)O 34a_100000106777_100000210206 [1,1,0,0,0,0|2,0,0]=4 975 B12R1.233 CC(C)Oc1ccc(cc1F)O 271570a_203496583355_100009811877 [1,1,0,0,0,0|2,0,0]=4 976 B12R1.233 CC(C)Oc1ccc(cc1N)O 271570a_203496583355_100000690130 [1,1,0,0,0,0|2,0,0]=4 977 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000210206_100000701344 [1,1,0,0,0,0|2,0,0]=4 978 B12R1.233 CC(C)Sc1ccc(cc1Br)O 62a_100000701344_100000210206 [1,1,0,0,0,0|2,0,0]=4 979 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000047559_100000210206 [1,1,0,0,0,0|2,0,0]=4 980 B12R1.233 CC(C)Sc1ccc(cc1Cl)O 62a_100000210206_100000047559 [1,1,0,0,0,0|2,0,0]=4 981 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000210206_100000755031 [1,1,0,0,0,0|2,0,0]=4 982 B12R1.233 CC(C)Sc1ccc(cc1F)O 62a_100000755031_100000210206 [1,1,0,0,0,0|2,0,0]=4 983 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100000210206_100011999798 [1,1,0,0,0,0|2,0,0]=4 984 B12R1.233 CC(C)Sc1ccc(cc1N)O 62a_100011999798_100000210206 [1,1,0,0,0,0|2,0,0]=4 985 B12R1.233 CC(C)Sc1ccc(cc1O)O 62a_100000210206_100009813921 [1,1,0,0,0,0|2,0,0]=4 986 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [1,1,0,0,0,0|2,0,0]=4 987 B12R1.233 Cc1cc(ccc1NC(C)C)O 34a_100000756630_100000210206 [1,1,0,0,0,0|2,0,0]=4 988 B12R1.233 Cc1cc(ccc1OC(C)C)O 271570a_203496583355_200011825982 [1,1,0,0,0,0|2,0,0]=4 989 B12R1.233 Cc1cc(ccc1SC(C)C)O 62a_100000210206_100000690111 [1,1,0,0,0,0|2,0,0]=4 990 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [1,1,0,0,0,0|1,0,1]=4 991 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [1,1,0,0,0,0|1,0,1]=4 992 B12R1.5 C=Cc1ccc(cc1)C(C)CC 271570a_100011290941_100011221364 [1,1,0,0,0,0|2,0,0]=4 993 B12R1.5 C=Cc1ccc(cc1)C(O)CC 271570a_100011290941_100000246506 [1,1,0,0,0,0|1,0,0]=3 994 B12R1.5 C=Cc1ccc(cc1)C(O)CN 271570a_100011290941_100020626992 [1,1,0,0,0,0|1,0,0]=3 995 B12R1.5 C=Cc1ccc(cc1)C(O)CO 271570a_100011290941_200012355997 [1,1,0,0,0,0|2,0,0]=4 996 B12R1.5 C=Cc1ccc(cc1)[C@@H](N)CC 271570a_100011290941_100025736560 [1,1,0,0,0,0|2,0,0]=4 997 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [1,1,0,0,0,0|1,0,0]=3 998 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [1,1,0,0,0,0|0,0,2]=4 999 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [1,1,0,0,0,0|0,0,2]=4 1000 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [1,1,0,0,0,0|0,0,2]=4 1001 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [1,1,0,0,0,0|0,0,2]=4 1002 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [1,1,0,0,0,0|0,0,2]=4 1003 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [1,1,0,0,0,0|0,0,2]=4 1004 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [1,1,0,0,0,0|2,0,0]=4 1005 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [1,1,0,0,0,0|2,0,0]=4 1006 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [1,1,0,0,0,0|2,0,0]=4 1007 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [1,1,0,0,0,0|2,0,0]=4 1008 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [1,1,0,0,0,0|2,0,0]=4 1009 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [1,1,0,0,0,0|2,0,0]=4 1010 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [1,1,0,0,0,0|1,0,0]=3 1011 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [1,1,0,0,0,0|1,0,0]=3 1012 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [1,1,0,0,0,0|1,0,0]=3 1013 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [1,1,0,0,0,0|1,0,0]=3 1014 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [1,1,0,0,0,0|1,1,0]=4 1015 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [1,1,0,0,0,0|1,1,0]=4 1016 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [1,1,0,0,0,0|1,1,0]=4 1017 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [1,1,0,0,0,0|1,1,0]=4 1018 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [1,1,0,0,0,0|1,0,0]=3 1019 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [1,1,0,0,0,0|1,0,0]=3 1020 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_100000246506_200000210301 [1,1,0,0,0,0|0,1,0]=3 1021 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_200000210301_100000246506 [1,1,0,0,0,0|0,1,0]=3 1022 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_100000246506_200025704644 [1,1,0,0,0,0|0,1,0]=3 1023 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000246506 [1,1,0,0,0,0|0,1,0]=3 1024 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [1,1,0,0,0,0|2,0,0]=4 1025 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [1,1,0,0,0,0|2,0,0]=4 1026 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [1,1,0,0,0,0|2,0,0]=4 1027 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_100025736560_200000210301 [1,1,0,0,0,0|1,1,0]=4 1028 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_200000210301_100025736560 [1,1,0,0,0,0|1,1,0]=4 1029 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_100025736560_200025704644 [1,1,0,0,0,0|1,1,0]=4 1030 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100025736560 [1,1,0,0,0,0|1,1,0]=4 1031 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [1,1,0,0,0,0|2,0,0]=4 1032 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [1,1,0,0,0,0|2,0,0]=4 1033 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [1,1,0,0,0,0|2,0,0]=4 1034 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [1,1,0,0,0,0|2,0,0]=4 1035 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [1,1,0,0,0,0|2,0,0]=4 1036 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [1,1,0,0,0,0|1,0,0]=3 1037 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [1,1,0,0,0,0|2,0,0]=4 1038 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [1,1,0,0,0,0|2,0,0]=4 1039 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [1,1,0,0,0,0|2,0,0]=4 1040 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [1,1,0,0,0,0|2,0,0]=4 1041 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [1,1,0,0,0,0|2,0,0]=4 1042 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [1,1,0,0,0,0|2,0,0]=4 1043 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [1,1,0,0,0,0|0,0,0]=2 1044 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [1,1,0,0,0,0|2,0,0]=4 1045 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_100020626992_200000210301 [1,1,0,0,0,0|0,1,0]=3 1046 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_200000210301_100020626992 [1,1,0,0,0,0|0,1,0]=3 1047 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200000210301_200012355997 [1,1,0,0,0,0|1,1,0]=4 1048 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200012355997_200000210301 [1,1,0,0,0,0|1,1,0]=4 1049 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [1,1,0,0,0,0|0,0,0]=2 1050 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_100020626992_200025704644 [1,1,0,0,0,0|0,1,0]=3 1051 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_200025704644_100020626992 [1,1,0,0,0,0|0,1,0]=3 1052 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200012355997_200025704644 [1,1,0,0,0,0|1,1,0]=4 1053 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200025704644_200012355997 [1,1,0,0,0,0|1,1,0]=4 1054 B12R1.9 CCC(F)(F)c1ccc(cc1)O 271570a_203496583355_100010208532 [1,1,0,0,0,0|1,0,0]=3 1055 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [1,1,0,0,0,0|1,0,1]=4 1056 B12R1.12 CCC(NC)c1ccc(cc1)Br 269862a_106832991636_100000211647 [1,1,0,0,0,0|2,0,0]=4 1057 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [1,1,0,0,0,0|2,0,0]=4 1058 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [1,1,0,0,0,0|2,0,0]=4 1059 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [1,1,0,0,0,0|2,0,0]=4 1060 B12R1.12 CCC(NC)c1ccc(cc1)Cl 269862a_106832991636_100000210983 [1,1,0,0,0,0|2,0,0]=4 1061 B12R1.12 CCC(NC)c1ccc(cc1)F 2230a_100011191751_200000210301 [1,1,0,0,0,0|2,0,0]=4 1062 B12R1.12 CCC(NC)c1ccc(cc1)F 269862a_106832991636_100000211089 [1,1,0,0,0,0|2,0,0]=4 1063 B12R1.12 CCC(NC)c1ccc(cc1)F 34a_100011191751_200000210301 [1,1,0,0,0,0|2,0,0]=4 1064 B12R1.12 CCC(NC)c1ccc(cc1)I 269862a_106832991636_100000763097 [1,1,0,0,0,0|2,0,0]=4 1065 B12R1.12 CCC(NC)c1ccc(cc1)O 271570a_203496583355_100000231127 [1,1,0,0,0,0|1,0,0]=3 1066 B12R1.12 CCC(NC)c1ccc(cc1)O 34a_100015187210_200000210301 [1,1,0,0,0,0|1,0,0]=3 1067 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [1,1,0,0,0,0|2,0,0]=4 1068 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [1,1,0,0,0,0|2,0,0]=4 1069 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 2230a_100011191751_200025704644 [1,1,0,0,0,0|2,0,0]=4 1070 B12R1.12 CCC(N[13CH3])c1ccc(cc1)F 34a_100011191751_200025704644 [1,1,0,0,0,0|2,0,0]=4 1071 B12R1.12 CCC(N[13CH3])c1ccc(cc1)O 34a_100015187210_200025704644 [1,1,0,0,0,0|1,0,0]=3 1072 B12R1.12 CCC(OC)c1ccc(cc1)Br 34a_100000246506_200000210301 [1,1,0,0,0,0|1,0,0]=3 1073 B12R1.12 CCC(OC)c1ccc(cc1)Br 7a_100000246506_200000210301 [1,1,0,0,0,0|1,0,0]=3 1074 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [1,1,0,0,0,0|1,0,0]=3 1075 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [1,1,0,0,0,0|1,0,0]=3 1076 B12R1.12 CCC(OC)c1ccc(cc1)Cl 34a_100000246471_200000210301 [1,1,0,0,0,0|1,0,0]=3 1077 B12R1.12 CCC(OC)c1ccc(cc1)Cl 7a_100000246471_200000210301 [1,1,0,0,0,0|1,0,0]=3 1078 B12R1.12 CCC(OC)c1ccc(cc1)F 34a_100000246474_200000210301 [1,1,0,0,0,0|1,0,0]=3 1079 B12R1.12 CCC(OC)c1ccc(cc1)F 7a_100000246474_200000210301 [1,1,0,0,0,0|1,0,0]=3 1080 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 34a_100000246506_200025704644 [1,1,0,0,0,0|1,0,0]=3 1081 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Br 7a_100000246506_200025704644 [1,1,0,0,0,0|1,0,0]=3 1082 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [1,1,0,0,0,0|1,0,0]=3 1083 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [1,1,0,0,0,0|1,0,0]=3 1084 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 34a_100000246471_200025704644 [1,1,0,0,0,0|1,0,0]=3 1085 B12R1.12 CCC(O[13CH3])c1ccc(cc1)Cl 7a_100000246471_200025704644 [1,1,0,0,0,0|1,0,0]=3 1086 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 34a_100000246474_200025704644 [1,1,0,0,0,0|1,0,0]=3 1087 B12R1.12 CCC(O[13CH3])c1ccc(cc1)F 7a_100000246474_200025704644 [1,1,0,0,0,0|1,0,0]=3 1088 B12R1.12 CCN(CC)c1ccc(cc1)O 2230a_100011337800_100000210202 [1,1,0,0,0,0|2,0,0]=4 1089 B12R1.12 CCN(CC)c1ccc(cc1)O 269982a_100011337800_100000204670 [1,1,0,0,0,0|2,0,0]=4 1090 B12R1.12 CCN(CC)c1ccc(cc1)O 271570a_203496583355_100011216415 [1,1,0,0,0,0|2,0,0]=4 1091 B12R1.12 CCN(CC)c1ccc(cc1)O 34a_100011337800_100000210202 [1,1,0,0,0,0|2,0,0]=4 1092 B12R1.12 CCN(CF)c1ccc(cc1)O 269982a_100011337800_100015361967 [1,1,0,0,0,0|2,0,0]=4 1093 B12R1.12 CCN(CF)c1ccc(cc1)O 34a_100011337800_100015361967 [1,1,0,0,0,0|2,0,0]=4 1094 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 2230a_100025736560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1095 B12R1.12 CC[C@H](NC)c1ccc(cc1)Br 34a_100025736560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1096 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 2230a_100015186824_200000210301 [1,1,0,0,0,0|2,0,0]=4 1097 B12R1.12 CC[C@H](NC)c1ccc(cc1)Cl 34a_100015186824_200000210301 [1,1,0,0,0,0|2,0,0]=4 1098 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 2230a_100025736560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1099 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Br 34a_100025736560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1100 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015186824_200025704644 [1,1,0,0,0,0|2,0,0]=4 1101 B12R1.12 CC[C@H](N[13CH3])c1ccc(cc1)Cl 34a_100015186824_200025704644 [1,1,0,0,0,0|2,0,0]=4 1102 B12R1.12 CNC(CO)c1ccc(cc1)Br 2230a_100000734186_200000210301 [1,1,0,0,0,0|2,0,0]=4 1103 B12R1.12 CNC(CO)c1ccc(cc1)Br 34a_100000734186_200000210301 [1,1,0,0,0,0|2,0,0]=4 1104 B12R1.12 CNC(CO)c1ccc(cc1)F 2230a_100000705410_200000210301 [1,1,0,0,0,0|2,0,0]=4 1105 B12R1.12 CNC(CO)c1ccc(cc1)F 34a_100000705410_200000210301 [1,1,0,0,0,0|2,0,0]=4 1106 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_200000210301 [1,1,0,0,0,0|2,0,0]=4 1107 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_200000210301 [1,1,0,0,0,0|2,0,0]=4 1108 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200000210301 [1,1,0,0,0,0|2,0,0]=4 1109 B12R1.12 CN[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200000210301 [1,1,0,0,0,0|2,0,0]=4 1110 B12R1.12 COC(CCl)c1ccc(cc1)Cl 34a_200011996143_200000210301 [1,1,0,0,0,0|2,0,0]=4 1111 B12R1.12 COC(CCl)c1ccc(cc1)Cl 7a_200011996143_200000210301 [1,1,0,0,0,0|2,0,0]=4 1112 B12R1.12 COC(CN)c1ccc(cc1)Br 34a_100020626992_200000210301 [1,1,0,0,0,0|1,0,0]=3 1113 B12R1.12 COC(CN)c1ccc(cc1)Cl 34a_100000736658_200000210301 [1,1,0,0,0,0|1,0,0]=3 1114 B12R1.12 COC(OC)c1ccc(cc1)O 271570a_203496583355_100009813454 [1,1,0,0,0,0|1,0,0]=3 1115 B12R1.12 COC(OC)c1ccc(cn1)O 271570a_203496583355_100010270258 [1,1,0,0,0,0|2,0,0]=4 1116 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200000210301 [1,1,0,0,0,0|2,0,0]=4 1117 B12R1.12 CO[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200000210301 [1,1,0,0,0,0|2,0,0]=4 1118 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 2230a_100009818840_200025704644 [1,1,0,0,0,0|2,0,0]=4 1119 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 34a_100009818840_200025704644 [1,1,0,0,0,0|2,0,0]=4 1120 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 2230a_100000734186_200025704644 [1,1,0,0,0,0|2,0,0]=4 1121 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)Br 34a_100000734186_200025704644 [1,1,0,0,0,0|2,0,0]=4 1122 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 2230a_100000705410_200025704644 [1,1,0,0,0,0|2,0,0]=4 1123 B12R1.12 [13CH3]NC(CO)c1ccc(cc1)F 34a_100000705410_200025704644 [1,1,0,0,0,0|2,0,0]=4 1124 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_200025704644 [1,1,0,0,0,0|2,0,0]=4 1125 B12R1.12 [13CH3]N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_200025704644 [1,1,0,0,0,0|2,0,0]=4 1126 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 34a_200011996143_200025704644 [1,1,0,0,0,0|2,0,0]=4 1127 B12R1.12 [13CH3]OC(CCl)c1ccc(cc1)Cl 7a_200011996143_200025704644 [1,1,0,0,0,0|2,0,0]=4 1128 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Br 34a_100020626992_200025704644 [1,1,0,0,0,0|1,0,0]=3 1129 B12R1.12 [13CH3]OC(CN)c1ccc(cc1)Cl 34a_100000736658_200025704644 [1,1,0,0,0,0|1,0,0]=3 1130 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 34a_100000720402_200025704644 [1,1,0,0,0,0|2,0,0]=4 1131 B12R1.12 [13CH3]O[C@@H](CCl)c1ccc(cc1)F 7a_100000720402_200025704644 [1,1,0,0,0,0|2,0,0]=4 1132 B12R1.16 C=CCC(O)c1ccc(cc1)O 271570a_203496583355_100011466436 [1,1,0,0,0,0|0,0,1]=3 1133 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [1,1,0,0,0,0|1,0,0]=3 1134 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [1,1,0,0,0,0|0,0,2]=4 1135 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [1,1,0,0,0,0|0,0,2]=4 1136 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [1,1,0,0,0,0|0,0,0]=2 1137 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [1,1,0,0,0,0|2,0,0]=4 1138 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [1,1,0,0,0,0|2,0,0]=4 1139 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [1,1,0,0,0,0|0,0,2]=4 1140 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [1,1,0,0,0,0|0,0,2]=4 1141 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [1,1,0,0,0,0|0,0,2]=4 1142 B12R1.16 CCNC(C)c1ccc(cc1)Br 2230a_100015525214_100000755118 [1,1,0,0,0,0|2,0,0]=4 1143 B12R1.16 CCNC(C)c1ccc(cc1)Br 269862a_100015525214_100000185794 [1,1,0,0,0,0|2,0,0]=4 1144 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [1,1,0,0,0,0|2,0,0]=4 1145 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [1,1,0,0,0,0|2,0,0]=4 1146 B12R1.16 CCNC(C)c1ccc(cc1)Cl 2230a_100015525214_100000684792 [1,1,0,0,0,0|2,0,0]=4 1147 B12R1.16 CCNC(C)c1ccc(cc1)Cl 269862a_100015525214_100000185797 [1,1,0,0,0,0|2,0,0]=4 1148 B12R1.16 CCNC(C)c1ccc(cc1)F 2230a_100015525214_100000743420 [1,1,0,0,0,0|2,0,0]=4 1149 B12R1.16 CCNC(C)c1ccc(cc1)F 269862a_100015525214_100000185800 [1,1,0,0,0,0|2,0,0]=4 1150 B12R1.16 CCNC(C)c1ccc(cc1)I 269862a_100015525214_100000185465 [1,1,0,0,0,0|2,0,0]=4 1151 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_100000210202 [1,1,0,0,0,0|2,0,0]=4 1152 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 34a_100025705893_100000210202 [1,1,0,0,0,0|2,0,0]=4 1153 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_100000210202 [1,1,0,0,0,0|2,0,0]=4 1154 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [1,1,0,0,0,0|1,0,0]=3 1155 B12R1.16 CCN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_100000210202 [1,1,0,0,0,0|2,0,0]=4 1156 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [1,1,0,0,0,0|2,0,0]=4 1157 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [1,1,0,0,0,0|2,0,0]=4 1158 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_100000210202 [1,1,0,0,0,0|2,0,0]=4 1159 B12R1.16 CCN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_100000210202 [1,1,0,0,0,0|2,0,0]=4 1160 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [1,1,0,0,0,0|0,0,2]=4 1161 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100000745893_100000210202 [1,1,0,0,0,0|2,0,0]=4 1162 B12R1.16 CCOC(C)c1ccc(cc1)Br 34a_100121572206_100000755118 [1,1,0,0,0,0|2,0,0]=4 1163 B12R1.16 CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000210202 [1,1,0,0,0,0|2,0,0]=4 1164 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [1,1,0,0,0,0|2,0,0]=4 1165 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100000181323_100000210202 [1,1,0,0,0,0|2,0,0]=4 1166 B12R1.16 CCOC(C)c1ccc(cc1)F 34a_100121572206_100000743420 [1,1,0,0,0,0|2,0,0]=4 1167 B12R1.16 CCOC(C)c1ccc(cc1)F 7a_100000181323_100000210202 [1,1,0,0,0,0|2,0,0]=4 1168 B12R1.16 CCOC(C)c1ccc(cc1)N 34a_100011216399_100000210202 [1,1,0,0,0,0|2,0,0]=4 1169 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_100000210202 [1,1,0,0,0,0|2,0,0]=4 1170 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000210202 [1,1,0,0,0,0|2,0,0]=4 1171 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [1,1,0,0,0,0|2,0,0]=4 1172 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [1,1,0,0,0,0|2,0,0]=4 1173 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000210202_100000755118 [1,1,0,0,0,0|2,0,0]=4 1174 B12R1.16 CCSC(C)c1ccc(cc1)Br 62a_100000755118_100000210202 [1,1,0,0,0,0|2,0,0]=4 1175 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [1,1,0,0,0,0|2,0,0]=4 1176 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [1,1,0,0,0,0|2,0,0]=4 1177 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000210202_100000684792 [1,1,0,0,0,0|2,0,0]=4 1178 B12R1.16 CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000210202 [1,1,0,0,0,0|2,0,0]=4 1179 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000210202_100000743420 [1,1,0,0,0,0|2,0,0]=4 1180 B12R1.16 CCSC(C)c1ccc(cc1)F 62a_100000743420_100000210202 [1,1,0,0,0,0|2,0,0]=4 1181 B12R1.16 CN(CCF)c1ccc(cc1)O 269982a_100000182112_100011217306 [1,1,0,0,0,0|2,0,0]=4 1182 B12R1.16 CN(CCF)c1ccc(cc1)O 34a_100000182112_100011217306 [1,1,0,0,0,0|2,0,0]=4 1183 B12R1.16 CN(CCO)c1ccc(cc1)O 269982a_100000182112_100000211926 [1,1,0,0,0,0|2,0,0]=4 1184 B12R1.16 CN(CCO)c1ccc(cc1)O 34a_100000182112_100000211926 [1,1,0,0,0,0|2,0,0]=4 1185 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [1,1,0,0,0,0|0,0,2]=4 1186 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [1,1,0,0,0,0|0,0,2]=4 1187 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [1,1,0,0,0,0|1,0,0]=3 1188 B12R1.16 CNCC(O)c1ccc(cc1)Br 2230a_100020626992_200000210301 [1,1,0,0,0,0|1,0,0]=3 1189 B12R1.16 CNCC(O)c1ccc(cc1)Br 34a_100020626992_200000210301 [1,1,0,0,0,0|1,0,0]=3 1190 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [1,1,0,0,0,0|1,0,0]=3 1191 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [1,1,0,0,0,0|1,0,0]=3 1192 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_200000210301 [1,1,0,0,0,0|1,0,0]=3 1193 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_106832991635_200011996143 [1,1,0,0,0,0|1,0,0]=3 1194 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100000736658_200000210301 [1,1,0,0,0,0|1,0,0]=3 1195 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100102657272_200011996143 [1,1,0,0,0,0|1,0,0]=3 1196 B12R1.16 CNCC(O)c1ccc(cc1)Cl 7a_106832991635_200011996143 [1,1,0,0,0,0|1,0,0]=3 1197 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [1,1,0,0,0,0|0,0,0]=2 1198 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 2230a_106832991635_100000720402 [1,1,0,0,0,0|1,0,0]=3 1199 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 34a_100102657272_100000720402 [1,1,0,0,0,0|1,0,0]=3 1200 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 7a_106832991635_100000720402 [1,1,0,0,0,0|1,0,0]=3 1201 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [1,1,0,0,0,0|0,0,2]=4 1202 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [1,1,0,0,0,0|0,0,2]=4 1203 B12R1.16 COCC(N)c1ccc(cc1)Br 34a_100000734186_200000210301 [1,1,0,0,0,0|2,0,0]=4 1204 B12R1.16 COCC(N)c1ccc(cc1)F 34a_100000705410_200000210301 [1,1,0,0,0,0|2,0,0]=4 1205 B12R1.16 COCC(O)c1ccc(cc1)Cl 34a_100138415774_200011996143 [1,1,0,0,0,0|1,0,0]=3 1206 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [1,1,0,0,0,0|2,0,0]=4 1207 B12R1.16 COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200000210301 [1,1,0,0,0,0|2,0,0]=4 1208 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [1,1,0,0,0,0|2,0,0]=4 1209 B12R1.16 COC[C@H](O)c1ccc(cc1)F 34a_100138415774_100000720402 [1,1,0,0,0,0|1,0,0]=3 1210 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [1,1,0,0,0,0|0,0,2]=4 1211 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [1,1,0,0,0,0|0,0,2]=4 1212 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200000210301_200011996143 [1,1,0,0,0,0|1,0,0]=3 1213 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200011996143_200000210301 [1,1,0,0,0,0|1,0,0]=3 1214 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [1,1,0,0,0,0|2,0,0]=4 1215 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [1,1,0,0,0,0|2,0,0]=4 1216 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_200000210301 [1,1,0,0,0,0|1,0,0]=3 1217 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_200000210301_100000720402 [1,1,0,0,0,0|1,0,0]=3 1218 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [1,1,0,0,0,0|1,0,0]=3 1219 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [1,1,0,0,0,0|1,0,0]=3 1220 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [1,1,0,0,0,0|2,0,0]=4 1221 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [1,1,0,0,0,0|1,0,0]=3 1222 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [1,1,0,0,0,0|0,0,2]=4 1223 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [1,1,0,0,0,0|0,0,2]=4 1224 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 2230a_100020626992_200025704644 [1,1,0,0,0,0|1,0,0]=3 1225 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 34a_100020626992_200025704644 [1,1,0,0,0,0|1,0,0]=3 1226 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 2230a_100000736658_200025704644 [1,1,0,0,0,0|1,0,0]=3 1227 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 34a_100000736658_200025704644 [1,1,0,0,0,0|1,0,0]=3 1228 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [1,1,0,0,0,0|0,0,0]=2 1229 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)Br 34a_100000734186_200025704644 [1,1,0,0,0,0|2,0,0]=4 1230 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)F 34a_100000705410_200025704644 [1,1,0,0,0,0|2,0,0]=4 1231 B12R1.16 [13CH3]OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200025704644 [1,1,0,0,0,0|2,0,0]=4 1232 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [1,1,0,0,0,0|0,0,2]=4 1233 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [1,1,0,0,0,0|0,0,2]=4 1234 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200011996143_200025704644 [1,1,0,0,0,0|1,0,0]=3 1235 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200025704644_200011996143 [1,1,0,0,0,0|1,0,0]=3 1236 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_100000720402_200025704644 [1,1,0,0,0,0|1,0,0]=3 1237 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_200025704644_100000720402 [1,1,0,0,0,0|1,0,0]=3 1238 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 34a_217856618577_100000210202 [1,1,0,0,0,0|2,0,0]=4 1239 B12R1.16 [2H]C(OCC)c1ccc(cc1)F 7a_217856618577_100000210202 [1,1,0,0,0,0|2,0,0]=4 1240 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [1,1,0,0,0,0|0,0,2]=4 1241 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [1,1,0,0,0,0|0,0,2]=4 1242 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [1,1,0,0,0,0|0,0,2]=4 1243 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [1,1,0,0,0,0|0,0,2]=4 1244 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [1,1,0,0,0,0|0,0,2]=4 1245 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [1,1,0,0,0,0|0,0,2]=4 1246 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,1,0,0,0,0|0,0,2]=4 1247 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [1,1,0,0,0,0|2,0,0]=4 1248 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [1,1,0,0,0,0|2,0,0]=4 1249 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [1,1,0,0,0,0|2,0,0]=4 1250 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [1,1,0,0,0,0|2,0,0]=4 1251 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [1,1,0,0,0,0|0,0,2]=4 1252 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [1,1,0,0,0,0|0,0,2]=4 1253 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [1,1,0,0,0,0|0,0,2]=4 1254 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [1,1,0,0,0,0|0,0,2]=4 1255 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [1,1,0,0,0,0|0,0,2]=4 1256 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [1,1,0,0,0,0|0,0,2]=4 1257 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [1,1,0,0,0,0|0,0,2]=4 1258 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [1,1,0,0,0,0|0,0,2]=4 1259 B12R1.1703 CCN(C)c1ccc(cc1C)O 269982a_100161107805_100000204670 [1,1,0,0,0,0|2,0,0]=4 1260 B12R1.1703 CCN(C)c1ccc(cc1C)O 34a_100161107805_100000210202 [1,1,0,0,0,0|2,0,0]=4 1261 B12R1.1703 Cc1cc(ccc1[C@H](N)CO)O 271570a_203496583355_100138412551 [1,1,0,0,0,0|2,0,0]=4 1262 B12R1.34 CCC(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000210202 [1,1,0,0,0,0|1,0,1]=4 1263 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 240690a_100102657272_100000684486 [1,1,0,0,0,0|1,0,1]=4 1264 B12R1.34 CNC(C)C(=O)c1ccccc1 2230a_106832991635_100000239700 [1,1,0,0,0,0|0,0,2]=4 1265 B12R1.34 CNC(C)C(=O)c1ccccc1 7a_106832991635_100000239700 [1,1,0,0,0,0|0,0,2]=4 1266 B12R1.34 CO[C@@H](C)[C@@H](N)c1ccccc1 34a_100134616770_200000210301 [1,1,0,0,0,0|2,0,0]=4 1267 B12R1.34 C[C@H](O[13CH3])[C@@H](N)c1ccccc1 34a_100134616770_200025704644 [1,1,0,0,0,0|2,0,0]=4 1268 B12R1.34 O=C(CF)[C@H](O)c1ccccc1 1458a_100000684486_100015361967 [1,1,0,0,0,0|1,0,1]=4 1269 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [1,1,0,0,0,0|1,0,1]=4 1270 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [1,1,0,0,0,0|1,0,1]=4 1271 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [1,1,0,0,0,0|1,0,1]=4 1272 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [1,1,0,0,0,0|1,0,1]=4 1273 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [1,1,0,0,0,0|1,0,1]=4 1274 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [1,1,0,0,0,0|1,0,1]=4 1275 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [1,1,0,0,0,0|1,0,1]=4 1276 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [1,1,0,0,0,0|1,0,1]=4 1277 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [1,1,0,0,0,0|1,0,1]=4 1278 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [1,1,0,0,0,0|1,0,1]=4 1279 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [1,1,0,0,0,0|1,0,1]=4 1280 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [1,1,0,0,0,0|1,0,1]=4 1281 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_200000210301 [1,1,0,0,0,0|1,0,1]=4 1282 B12R1.253 C[C@](O)(C(=O)[13CH3])c1ccccc1 1458a_100000753667_200025704644 [1,1,0,0,0,0|1,0,1]=4 1283 B12R1.478 C=C(C)C(OC)c1ccccc1 34a_200011216824_200000210301 [1,1,0,0,0,0|1,0,1]=4 1284 B12R1.478 C=C(C)C(OC)c1ccccc1 7a_200011216824_200000210301 [1,1,0,0,0,0|1,0,1]=4 1285 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 34a_200011216824_200025704644 [1,1,0,0,0,0|1,0,1]=4 1286 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 7a_200011216824_200025704644 [1,1,0,0,0,0|1,0,1]=4 1287 B12R1.478 CC(=O)C(CO)c1ccccc1 1458a_100011218805_200000210301 [1,1,0,0,0,0|1,0,1]=4 1288 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 34a_200011217822_200025704644 [1,1,0,0,0,0|1,0,0]=3 1289 B12R1.478 CC(C)C(O[13CH3])c1ccccc1 7a_200011217822_200025704644 [1,1,0,0,0,0|1,0,0]=3 1290 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 2230a_100015186014_200025704644 [1,1,0,0,0,0|2,0,0]=4 1291 B12R1.478 CC(C)[C@H](N[13CH3])c1ccccc1 34a_100015186014_200025704644 [1,1,0,0,0,0|2,0,0]=4 1292 B12R1.478 CN[C@@H](c1ccccc1)[C@H](C)O 2230a_100134616770_200000210301 [1,1,0,0,0,0|2,0,0]=4 1293 B12R1.478 CN[C@H](c1ccccc1)C(C)C 2230a_100015186014_200000210301 [1,1,0,0,0,0|2,0,0]=4 1294 B12R1.478 CN[C@H](c1ccccc1)C(C)C 34a_100015186014_200000210301 [1,1,0,0,0,0|2,0,0]=4 1295 B12R1.478 COC(C(=O)N)c1ccccc1 34a_100011200849_200000210301 [1,1,0,0,0,0|1,0,1]=4 1296 B12R1.478 COC(C(=O)N)c1ccccc1 7a_100011200849_200000210301 [1,1,0,0,0,0|1,0,1]=4 1297 B12R1.478 COC(c1ccccc1)C(C)C 34a_200011217822_200000210301 [1,1,0,0,0,0|1,0,0]=3 1298 B12R1.478 COC(c1ccccc1)C(C)C 7a_200011217822_200000210301 [1,1,0,0,0,0|1,0,0]=3 1299 B12R1.478 CO[C@@H](C(=O)C)c1ccccc1 1458a_100000698336_200000210301 [1,1,0,0,0,0|1,0,1]=4 1300 B12R1.478 CO[C@@H](C(=O)[13CH3])c1ccccc1 1458a_100000698336_200025704644 [1,1,0,0,0,0|1,0,1]=4 1301 B12R1.478 C[C@H](O)[C@@H](N[13CH3])c1ccccc1 2230a_100134616770_200025704644 [1,1,0,0,0,0|2,0,0]=4 1302 B12R1.478 [13CH3]C(=O)C(CO)c1ccccc1 1458a_100011218805_200025704644 [1,1,0,0,0,0|1,0,1]=4 1303 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 34a_100011200849_200025704644 [1,1,0,0,0,0|1,0,1]=4 1304 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 7a_100011200849_200025704644 [1,1,0,0,0,0|1,0,1]=4 1305 B14R1.2 CC(C)C[C@H](N)c1ccc(cc1)CO 271570a_100015190218_100000690907 [0,1,0,0,0,1|2,0,0]=4 1306 B14R1.2 COc1ccc(cc1)C(C)OC(C)C 34a_100000742907_100000210206 [0,1,0,0,0,1|2,0,0]=4 1307 B14R1.2 COc1ccc(cc1)C(C)OC(C)C 7a_100000742907_100000210206 [0,1,0,0,0,1|2,0,0]=4 1308 B14R1.2 COc1ccc(cc1)C(O)CN(C)C 2230a_100011290904_200000210301 [0,1,0,0,0,1|2,0,0]=4 1309 B14R1.2 COc1ccc(cc1)C(O)CN(C)C 269982a_100011290904_200000210301 [0,1,0,0,0,1|2,0,0]=4 1310 B14R1.2 COc1ccc(cc1)C(O)CN(C)[13CH3] 2230a_100011290904_200025704644 [0,1,0,0,0,1|2,0,0]=4 1311 B14R1.2 COc1ccc(cc1)C(O)CN(C)[13CH3] 269982a_100011290904_200025704644 [0,1,0,0,0,1|2,0,0]=4 1312 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(C)C 2230a_100011830352_100000210206 [0,1,0,0,0,1|2,0,0]=4 1313 B14R1.2 COc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000171711 [0,1,0,0,0,1|2,0,0]=4 1314 B14R1.10 CC(C#N)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000184139 [0,1,0,0,0,1|1,0,1]=4 1315 B14R1.10 CC(CN)OC(C)c1ccc(cc1)Br 34a_100000210904_100000755118 [0,1,0,0,0,1|2,0,0]=4 1316 B14R1.10 CC(CN)OC(C)c1ccc(cc1)F 34a_100000210904_100000743420 [0,1,0,0,0,1|2,0,0]=4 1317 B14R1.10 CC(CO)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100012180447 [0,1,0,0,0,1|2,0,0]=4 1318 B14R1.10 CCC(C)N[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000758301 [0,1,0,0,0,1|2,0,0]=4 1319 B14R1.10 CCN(C)CC(O)c1ccc(cc1)O 2230a_100016988945_100000210202 [0,1,0,0,0,1|2,0,0]=4 1320 B14R1.10 CCN(C)CC(O)c1ccc(cc1)O 269982a_100016988945_100000204670 [0,1,0,0,0,1|2,0,0]=4 1321 B14R1.10 CN(CF)CC(O)c1ccc(cc1)O 269982a_100016988945_100015361967 [0,1,0,0,0,1|2,0,0]=4 1322 B14R1.10 Cc1ccc(cc1)C(C)OC(C)CN 34a_100000210904_100011261388 [0,1,0,0,0,1|2,0,0]=4 1323 B14R1.132 CC(C)C(=O)C(C)c1ccc(cc1)O 1458a_100000031422_100000210206 [0,1,0,0,0,1|2,0,0]=4 1324 B14R1.132 CC(C)C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_100000210206 [0,1,0,0,0,1|2,0,0]=4 1325 B14R1.132 CC(C)C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_100000210206 [0,1,0,0,0,1|2,0,0]=4 1326 B14R1.132 CC(C)C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210206 [0,1,0,0,0,1|1,0,0]=3 1327 B14R1.132 CC(C)C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_100000210206 [0,1,0,0,0,1|2,0,0]=4 1328 B14R1.132 CN(C)C(=O)C(O)c1ccc(cc1)O 240690a_100102631434_100011215213 [0,1,0,0,0,1|2,0,0]=4 1329 B14R1.132 Cc1ccc(cc1)[C@@H](O)C(=O)C(C)C 1458a_100009815954_100000210206 [0,1,0,0,0,1|2,0,0]=4 1330 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Br)O 271570a_100015190218_100012361655 [0,1,0,0,0,1|2,0,0]=4 1331 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Cl)O 271570a_100015190218_100012360047 [0,1,0,0,0,1|2,0,0]=4 1332 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)F)O 271570a_100015190218_100000185481 [0,1,0,0,0,1|2,0,0]=4 1333 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)N)O 271570a_100015190218_100000752626 [0,1,0,0,0,1|2,0,0]=4 1334 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)O 271570a_100015190218_100009813601 [0,1,0,0,0,1|2,0,0]=4 1335 B14R1.685 Cc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000186361 [0,1,0,0,0,1|2,0,0]=4 1336 B14R1.1019 CC(C)NC(CO)c1ccc(cc1)Br 2230a_100000734186_100000210206 [0,1,0,0,0,1|2,0,0]=4 1337 B14R1.1019 CC(C)NC(CO)c1ccc(cc1)Br 34a_100000734186_100000210206 [0,1,0,0,0,1|2,0,0]=4 1338 B14R1.1019 CC(C)NC(CO)c1ccc(cc1)F 2230a_100000705410_100000210206 [0,1,0,0,0,1|2,0,0]=4 1339 B14R1.1019 CC(C)NC(CO)c1ccc(cc1)F 34a_100000705410_100000210206 [0,1,0,0,0,1|2,0,0]=4 1340 B14R1.1019 CC(C)N[C@H](CO)c1ccc(cc1)Cl 2230a_100009818818_100000210206 [0,1,0,0,0,1|2,0,0]=4 1341 B14R1.1019 CC(C)N[C@H](CO)c1ccc(cc1)Cl 34a_100009818818_100000210206 [0,1,0,0,0,1|2,0,0]=4 1342 B14R1.1019 CCC(NC(C)C)c1ccc(cc1)O 34a_100015187210_100000210206 [0,1,0,0,0,1|2,0,0]=4 1343 B14R1.1019 Cc1ccc(cc1)[C@H](CO)NC(C)C 2230a_100009818840_100000210206 [0,1,0,0,0,1|2,0,0]=4 1344 B14R1.1019 Cc1ccc(cc1)[C@H](CO)NC(C)C 34a_100009818840_100000210206 [0,1,0,0,0,1|2,0,0]=4 1345 B14R1.6048 CC(C)C[C@H](N)c1ccc(cc1Br)O 271570a_100015190218_100000701344 [0,1,0,0,0,1|2,0,0]=4 1346 B14R1.6048 CC(C)C[C@H](N)c1ccc(cc1Cl)O 271570a_100015190218_100000047559 [0,1,0,0,0,1|2,0,0]=4 1347 B14R1.6048 CC(C)C[C@H](N)c1ccc(cc1F)O 271570a_100015190218_100000755031 [0,1,0,0,0,1|2,0,0]=4 1348 B14R1.6048 CC(C)C[C@H](N)c1ccc(cc1N)O 271570a_100015190218_100011999798 [0,1,0,0,0,1|2,0,0]=4 1349 B14R1.6048 CC(C)C[C@H](N)c1ccc(cc1O)O 271570a_100015190218_100009813921 [0,1,0,0,0,1|2,0,0]=4 1350 B14R1.6048 Cc1cc(ccc1[C@@H](N)CC(C)C)O 271570a_100015190218_100000729255 [0,1,0,0,0,1|2,0,0]=4 1351 B14R1.134 CCC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_100000210202 [0,1,0,0,0,1|1,0,1]=4 1352 B14R1.134 CNC(=O)C(O)Cc1ccc(cc1)O 240690a_100102657272_100015278814 [0,1,0,0,0,1|1,0,1]=4 1353 B14R1.134 O=C(CF)C(O)Cc1ccc(cc1)O 1458a_100015278814_100015361967 [0,1,0,0,0,1|1,0,1]=4 1354 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,1,0,0,0,1|1,0,1]=4 1355 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,1,0,0,0,1|1,0,1]=4 1356 B14R1.7 CCC(=O)C(O)c1ccc(cc1)OC 1458a_100011218652_100000210202 [0,2,0,0,0,0|1,0,1]=4 1357 B14R1.7 CNC(=O)C(O)c1ccc(cc1)OC 240690a_100102657272_100011218652 [0,2,0,0,0,0|1,0,1]=4 1358 B14R1.7 CNC(C)C(=O)c1ccc(cc1)OC 2230a_106832991635_100000742912 [0,2,0,0,0,0|0,0,2]=4 1359 B14R1.7 CNC(C)C(=O)c1ccc(cc1)OC 7a_106832991635_100000742912 [0,2,0,0,0,0|0,0,2]=4 1360 B14R1.7 COc1ccc(cc1)C(O)C(=O)CF 1458a_100011218652_100015361967 [0,2,0,0,0,0|1,0,1]=4 1361 B14R1.35 C#CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000184674 [0,2,0,0,0,0|1,0,1]=4 1362 B14R1.35 C=CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210623 [0,2,0,0,0,0|1,0,1]=4 1363 B14R1.35 CCCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100000210303 [0,2,0,0,0,0|1,0,1]=4 1364 B14R1.35 CCNC(=O)C(O)c1ccc(cc1)O 240690a_100015525214_100011215213 [0,2,0,0,0,0|1,0,1]=4 1365 B14R1.35 CCNC(C)C(=O)c1ccc(cc1)O 2230a_100015525214_200010205864 [0,2,0,0,0,0|0,0,2]=4 1366 B14R1.35 CCN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 2230a_200009830414_100000210202 [0,2,0,0,0,0|1,0,0]=3 1367 B14R1.35 CCN[C@H](C)[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_100000210202 [0,2,0,0,0,0|1,0,0]=3 1368 B14R1.35 CNNC(=O)C(O)c1ccc(cc1)O 22a_100016993582_100011215213 [0,2,0,0,0,0|1,0,1]=4 1369 B14R1.35 C[C@@H](NCF)[C@@H](O)c1ccc(cc1)Cl 34a_200009830414_100015361967 [0,2,0,0,0,0|1,0,0]=3 1370 B14R1.35 N#CCC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_100011214920 [0,2,0,0,0,0|1,0,1]=4 1371 B14R1.35 O=C(CCF)C(O)c1ccc(cc1)O 1458a_100011215213_100011217306 [0,2,0,0,0,0|1,0,1]=4 1372 B14R1.35 O=C(CCO)C(O)c1ccc(cc1)O 1458a_100011215213_100000211926 [0,2,0,0,0,0|1,0,1]=4 1373 B14R1.1003 CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210202 [0,2,0,0,0,0|1,0,1]=4 1374 B14R1.1003 CNC(=O)C(O)c1ccc(c(c1)O)O 240690a_100102657272_200000032065 [0,2,0,0,0,0|1,0,1]=4 1375 B14R1.1003 O=C(CF)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100015361967 [0,2,0,0,0,0|1,0,1]=4 1376 B14R1.8 CNC(c1ccc(cc1)OC)C(C)C 2230a_100000205938_200000210301 [0,2,0,0,0,0|2,0,0]=4 1377 B14R1.8 CNC(c1ccc(cc1)OC)C(C)C 34a_100000205938_200000210301 [0,2,0,0,0,0|2,0,0]=4 1378 B14R1.8 COc1ccc(cc1)C(N[13CH3])C(C)C 2230a_100000205938_200025704644 [0,2,0,0,0,0|2,0,0]=4 1379 B14R1.8 COc1ccc(cc1)C(N[13CH3])C(C)C 34a_100000205938_200025704644 [0,2,0,0,0,0|2,0,0]=4 1380 B14R1.8 COc1ccc(cc1)C(OC)C(C)C 34a_200011350851_200000210301 [0,2,0,0,0,0|1,0,0]=3 1381 B14R1.8 COc1ccc(cc1)C(OC)C(C)C 7a_200011350851_200000210301 [0,2,0,0,0,0|1,0,0]=3 1382 B14R1.8 COc1ccc(cc1)C(O[13CH3])C(C)C 34a_200011350851_200025704644 [0,2,0,0,0,0|1,0,0]=3 1383 B14R1.8 COc1ccc(cc1)C(O[13CH3])C(C)C 7a_200011350851_200025704644 [0,2,0,0,0,0|1,0,0]=3 1384 B14R1.213 COc1ccc(cc1)C(C)(O)C(=O)C 1458a_200011434898_200000210301 [0,2,0,0,0,0|1,0,1]=4 1385 B14R1.213 COc1ccc(cc1)C(C)(O)C(=O)[13CH3] 1458a_200011434898_200025704644 [0,2,0,0,0,0|1,0,1]=4 1386 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,2,0,0,0,0|1,0,1]=4 1387 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,2,0,0,0,0|1,0,1]=4 1388 B14R1.508 CCO[C@@H](c1ccc(cc1)Cl)[C@@H](C)N 34a_200009830414_100000210202 [0,2,0,0,0,0|1,0,0]=3 1389 B14R1.508 C[C@@H](N)[C@@H](OCF)c1ccc(cc1)Cl 34a_200009830414_100015361967 [0,2,0,0,0,0|1,0,0]=3 1390 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [1,0,0,1,0,0|0,0,0]=2 1391 B12R2.294 Oc1ccc(cc1)NC2CC2 34a_100000185829_100000211595 [1,0,0,1,0,0|2,0,0]=4 1392 B12R2.294 Oc1ccc(cc1)OC2CC2 271570a_203496583355_100000704264 [1,0,0,1,0,0|2,0,0]=4 1393 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1394 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1395 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 1396 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [1,0,0,1,0,0|0,0,2]=4 1397 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [1,0,0,1,0,0|0,0,0]=2 1398 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [1,0,0,1,0,0|1,0,1]=4 1399 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [1,0,0,1,0,0|1,0,1]=4 1400 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [1,0,0,1,0,0|1,0,0]=3 1401 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1402 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1403 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 1404 B12R2.290 NC1(CC1)c2ccc(cc2)O 271570a_203496583355_100000742681 [1,0,0,1,0,0|1,0,0]=3 1405 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [1,0,0,1,0,0|2,0,0]=4 1406 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [1,0,0,1,0,0|1,0,0]=3 1407 B12R2.612 NC1COc2c1ccc(c2)O 271570a_203496583355_100020628175 [1,0,0,1,0,0|2,0,0]=4 1408 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [1,0,0,1,0,0|0,0,2]=4 1409 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [1,0,0,1,0,0|0,0,0]=2 1410 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [1,0,0,1,0,0|1,0,0]=3 1411 B12R2.2302 Oc1ccc(cc1)C2COC2 271570a_203496583355_100010732642 [1,0,0,1,0,0|2,0,0]=4 1412 B14R2.20 CC1COC(O1)c2ccc(cc2)O 271570a_203496583355_200010007801 [0,0,0,1,0,1|1,0,0]=3 1413 B14R2.933 CC(NC1CC1)c2ccc(cc2)O 271570a_203496583355_100160470766 [0,0,0,1,0,1|2,0,0]=4 1414 B14R2.10606 NC(c1ccc(cc1)O)C2CCC2 271570a_203496583355_100000743061 [0,1,0,1,0,0|2,0,0]=4 1415 B14R2.10606 Oc1ccc(cc1)C(O)C2CCC2 271570a_203496583355_100000687797 [0,1,0,1,0,0|1,0,0]=3 1416 B14R2.329 C=Cc1ccc(cc1)C(O)C2CC2 271570a_100011290941_100000756592 [0,1,0,1,0,0|2,0,0]=4 1417 B14R2.329 CSc1ccc(cc1)C(O)C2CC2 62a_100000756592_200000210301 [0,1,0,1,0,0|1,1,0]=4 1418 B14R2.329 CSc1ccc(cc1)C(O)C2CC2 62a_200000210301_100000756592 [0,1,0,1,0,0|1,1,0]=4 1419 B14R2.329 [13CH3]Sc1ccc(cc1)C(O)C2CC2 62a_100000756592_200025704644 [0,1,0,1,0,0|1,1,0]=4 1420 B14R2.329 [13CH3]Sc1ccc(cc1)C(O)C2CC2 62a_200025704644_100000756592 [0,1,0,1,0,0|1,1,0]=4 1421 B14R2.2854 CNC(c1ccc(cc1)O)C2CC2 269862a_106832991636_100011997326 [0,1,0,1,0,0|2,0,0]=4 1422 B14R2.2854 COC(c1ccc(cc1)Br)C2CC2 34a_100000756592_200000210301 [0,1,0,1,0,0|2,0,0]=4 1423 B14R2.2854 COC(c1ccc(cc1)Br)C2CC2 7a_100000756592_200000210301 [0,1,0,1,0,0|2,0,0]=4 1424 B14R2.2854 [13CH3]OC(c1ccc(cc1)Br)C2CC2 34a_100000756592_200025704644 [0,1,0,1,0,0|2,0,0]=4 1425 B14R2.2854 [13CH3]OC(c1ccc(cc1)Br)C2CC2 7a_100000756592_200025704644 [0,1,0,1,0,0|2,0,0]=4 1426 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [1,0,0,0,0,1|1,0,1]=4 1427 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [1,0,0,0,0,1|1,0,1]=4 1428 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [1,0,0,0,0,1|1,0,1]=4 1429 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [1,0,0,0,0,1|1,0,1]=4 1430 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [1,0,0,0,0,1|1,0,1]=4 1431 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [1,0,0,0,0,1|1,0,1]=4 1432 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [1,0,0,0,0,1|1,0,1]=4 1433 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [1,0,0,0,0,1|1,0,1]=4 1434 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [1,0,0,0,0,1|1,0,1]=4 1435 B12R1.21 CC(C)C=Cc1ccc(cc1)O 271570a_100016257149_100000185759 [1,0,0,0,0,1|1,0,1]=4 1436 B12R1.21 CC(C)CNc1ccc(cc1)Br 2230a_100000210018_100000210760 [1,0,0,0,0,1|2,0,0]=4 1437 B12R1.21 CC(C)CNc1ccc(cc1)Br 34a_100000210018_100000210624 [1,0,0,0,0,1|2,0,0]=4 1438 B12R1.21 CC(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000210760 [1,0,0,0,0,1|2,0,0]=4 1439 B12R1.21 CC(C)CNc1ccc(cc1)Cl 34a_100000210052_100000210624 [1,0,0,0,0,1|2,0,0]=4 1440 B12R1.21 CC(C)CNc1ccc(cc1)F 34a_100000185862_100000210624 [1,0,0,0,0,1|2,0,0]=4 1441 B12R1.21 CC(C)CNc1ccc(cc1)I 34a_100000185761_100000210624 [1,0,0,0,0,1|2,0,0]=4 1442 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [1,0,0,0,0,1|1,0,0]=3 1443 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [1,0,0,0,0,1|1,0,0]=3 1444 B12R1.21 CC(C)COc1ccc(cc1)Br 34a_100000185759_100000210624 [1,0,0,0,0,1|2,0,0]=4 1445 B12R1.21 CC(C)COc1ccc(cc1)Br 7a_100000185759_100000210760 [1,0,0,0,0,1|2,0,0]=4 1446 B12R1.21 CC(C)COc1ccc(cc1)Cl 34a_100000210216_100000210624 [1,0,0,0,0,1|2,0,0]=4 1447 B12R1.21 CC(C)COc1ccc(cc1)Cl 7a_100000210216_100000210760 [1,0,0,0,0,1|2,0,0]=4 1448 B12R1.21 CC(C)COc1ccc(cc1)F 34a_100000210339_100000210624 [1,0,0,0,0,1|2,0,0]=4 1449 B12R1.21 CC(C)COc1ccc(cc1)I 34a_100000212066_100000210624 [1,0,0,0,0,1|2,0,0]=4 1450 B12R1.21 CC(C)COc1ccc(cc1)I 7a_100000212066_100000210760 [1,0,0,0,0,1|2,0,0]=4 1451 B12R1.21 CC(C)COc1ccc(cc1)N 34a_100000185829_100000210624 [1,0,0,0,0,1|2,0,0]=4 1452 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [1,0,0,0,0,1|1,0,0]=3 1453 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000210624_100000752885 [1,0,0,0,0,1|2,0,0]=4 1454 B12R1.21 CC(C)CSc1ccc(cc1)Br 62a_100000752885_100000210760 [1,0,0,0,0,1|2,0,0]=4 1455 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000210624_100000755918 [1,0,0,0,0,1|2,0,0]=4 1456 B12R1.21 CC(C)CSc1ccc(cc1)Cl 62a_100000755918_100000210760 [1,0,0,0,0,1|2,0,0]=4 1457 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000210624_100000211213 [1,0,0,0,0,1|2,0,0]=4 1458 B12R1.21 CC(C)CSc1ccc(cc1)F 62a_100000211213_100000210760 [1,0,0,0,0,1|2,0,0]=4 1459 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000185761_100000210760 [1,0,0,0,0,1|2,0,0]=4 1460 B12R1.21 CC(C)CSc1ccc(cc1)N 62a_100000210624_100000185761 [1,0,0,0,0,1|2,0,0]=4 1461 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [1,0,0,0,0,1|1,0,0]=3 1462 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000210624_100000744096 [1,0,0,0,0,1|2,0,0]=4 1463 B12R1.21 CC(C)CSc1ccc(cn1)O 62a_100000685995_100000210760 [1,0,0,0,0,1|2,0,0]=4 1464 B12R1.21 CC(C)NCc1ccc(cc1)Br 207a_100138425928_100000186029 [1,0,0,0,0,1|2,0,0]=4 1465 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100000174875_100000210206 [1,0,0,0,0,1|2,0,0]=4 1466 B12R1.21 CC(C)NCc1ccc(cc1)Br 2230a_100138425928_100011217064 [1,0,0,0,0,1|2,0,0]=4 1467 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100000174875_100000210206 [1,0,0,0,0,1|2,0,0]=4 1468 B12R1.21 CC(C)NCc1ccc(cc1)Br 34a_100138425928_100000189115 [1,0,0,0,0,1|2,0,0]=4 1469 B12R1.21 CC(C)NCc1ccc(cc1)Cl 207a_100138425928_100000189385 [1,0,0,0,0,1|2,0,0]=4 1470 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100000174871_100000210206 [1,0,0,0,0,1|2,0,0]=4 1471 B12R1.21 CC(C)NCc1ccc(cc1)Cl 2230a_100138425928_100000694040 [1,0,0,0,0,1|2,0,0]=4 1472 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100000174871_100000210206 [1,0,0,0,0,1|2,0,0]=4 1473 B12R1.21 CC(C)NCc1ccc(cc1)Cl 34a_100138425928_100000694040 [1,0,0,0,0,1|2,0,0]=4 1474 B12R1.21 CC(C)NCc1ccc(cc1)F 207a_100138425928_100000210084 [1,0,0,0,0,1|2,0,0]=4 1475 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100000174882_100000210206 [1,0,0,0,0,1|2,0,0]=4 1476 B12R1.21 CC(C)NCc1ccc(cc1)F 2230a_100138425928_100000198546 [1,0,0,0,0,1|2,0,0]=4 1477 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100000174882_100000210206 [1,0,0,0,0,1|2,0,0]=4 1478 B12R1.21 CC(C)NCc1ccc(cc1)F 34a_100138425928_100000198546 [1,0,0,0,0,1|2,0,0]=4 1479 B12R1.21 CC(C)NCc1ccc(cc1)I 207a_100138425928_100000188517 [1,0,0,0,0,1|2,0,0]=4 1480 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100016989417_100000210206 [1,0,0,0,0,1|2,0,0]=4 1481 B12R1.21 CC(C)NCc1ccc(cc1)I 2230a_100138425928_100000189116 [1,0,0,0,0,1|2,0,0]=4 1482 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100016989417_100000210206 [1,0,0,0,0,1|2,0,0]=4 1483 B12R1.21 CC(C)NCc1ccc(cc1)I 34a_100138425928_100000189116 [1,0,0,0,0,1|2,0,0]=4 1484 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [1,0,0,0,0,1|1,0,0]=3 1485 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [1,0,0,0,0,1|1,0,0]=3 1486 B12R1.21 CC(C)NCc1ccc(nc1)O 207a_100138425928_100011361521 [1,0,0,0,0,1|2,0,0]=4 1487 B12R1.21 CC(C)NCc1ccc(nc1)O 2230a_100000757128_100000210206 [1,0,0,0,0,1|2,0,0]=4 1488 B12R1.21 CC(C)NCc1ccc(nc1)O 271570a_203496583355_100016992178 [1,0,0,0,0,1|2,0,0]=4 1489 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000212225_100000189115 [1,0,0,0,0,1|2,0,0]=4 1490 B12R1.21 CC(C)OCc1ccc(cc1)Br 34a_100000695286_100000210206 [1,0,0,0,0,1|2,0,0]=4 1491 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000211118_100000210206 [1,0,0,0,0,1|2,0,0]=4 1492 B12R1.21 CC(C)OCc1ccc(cc1)Cl 34a_100000212225_100000694040 [1,0,0,0,0,1|2,0,0]=4 1493 B12R1.21 CC(C)OCc1ccc(cc1)Cl 7a_100000211118_100000210206 [1,0,0,0,0,1|2,0,0]=4 1494 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000210977_100000210206 [1,0,0,0,0,1|2,0,0]=4 1495 B12R1.21 CC(C)OCc1ccc(cc1)F 34a_100000212225_100000198546 [1,0,0,0,0,1|2,0,0]=4 1496 B12R1.21 CC(C)OCc1ccc(cc1)F 7a_100000210977_100000210206 [1,0,0,0,0,1|2,0,0]=4 1497 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000212225_100000189116 [1,0,0,0,0,1|2,0,0]=4 1498 B12R1.21 CC(C)OCc1ccc(cc1)I 34a_100000690907_100000210206 [1,0,0,0,0,1|2,0,0]=4 1499 B12R1.21 CC(C)OCc1ccc(cc1)I 7a_100000690907_100000210206 [1,0,0,0,0,1|2,0,0]=4 1500 B12R1.21 CC(C)OCc1ccc(cc1)N 34a_100011215238_100000210206 [1,0,0,0,0,1|2,0,0]=4 1501 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [1,0,0,0,0,1|1,0,0]=3 1502 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000189115_100000210206 [1,0,0,0,0,1|2,0,0]=4 1503 B12R1.21 CC(C)SCc1ccc(cc1)Br 62a_100000210206_100000189115 [1,0,0,0,0,1|2,0,0]=4 1504 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000187161_100000210206 [1,0,0,0,0,1|2,0,0]=4 1505 B12R1.21 CC(C)SCc1ccc(cc1)Cl 62a_100000210206_100000187161 [1,0,0,0,0,1|2,0,0]=4 1506 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000198546_100000210206 [1,0,0,0,0,1|2,0,0]=4 1507 B12R1.21 CC(C)SCc1ccc(cc1)F 62a_100000210206_100000187164 [1,0,0,0,0,1|2,0,0]=4 1508 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000189116_100000210206 [1,0,0,0,0,1|2,0,0]=4 1509 B12R1.21 CC(C)SCc1ccc(cc1)I 62a_100000210206_100000189116 [1,0,0,0,0,1|2,0,0]=4 1510 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [1,0,0,0,0,1|1,0,0]=3 1511 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [1,0,0,0,0,1|1,0,1]=4 1512 B12R1.21 CC(O)CNc1ccc(cc1)Br 2230a_100000210018_100011218427 [1,0,0,0,0,1|2,0,0]=4 1513 B12R1.21 CC(O)CNc1ccc(cc1)Br 34a_100000210018_100011218427 [1,0,0,0,0,1|2,0,0]=4 1514 B12R1.21 CC(O)CNc1ccc(cc1)Cl 2230a_100000210052_100011218427 [1,0,0,0,0,1|2,0,0]=4 1515 B12R1.21 CC(O)CNc1ccc(cc1)Cl 34a_100000210052_100011218427 [1,0,0,0,0,1|2,0,0]=4 1516 B12R1.21 CC(O)CNc1ccc(cc1)F 34a_100000185862_100011218427 [1,0,0,0,0,1|2,0,0]=4 1517 B12R1.21 CC(O)CNc1ccc(cc1)I 34a_100000185761_100011218427 [1,0,0,0,0,1|2,0,0]=4 1518 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [1,0,0,0,0,1|1,0,0]=3 1519 B12R1.21 CC(O)COc1ccc(cc1)Br 34a_100000185759_100011218427 [1,0,0,0,0,1|2,0,0]=4 1520 B12R1.21 CC(O)COc1ccc(cc1)Br 7a_100000185759_100011218427 [1,0,0,0,0,1|2,0,0]=4 1521 B12R1.21 CC(O)COc1ccc(cc1)Cl 34a_100000210216_100011218427 [1,0,0,0,0,1|2,0,0]=4 1522 B12R1.21 CC(O)COc1ccc(cc1)Cl 7a_100000210216_100011218427 [1,0,0,0,0,1|2,0,0]=4 1523 B12R1.21 CC(O)COc1ccc(cc1)F 34a_100000210339_100011218427 [1,0,0,0,0,1|2,0,0]=4 1524 B12R1.21 CC(O)COc1ccc(cc1)I 34a_100000212066_100011218427 [1,0,0,0,0,1|2,0,0]=4 1525 B12R1.21 CC(O)COc1ccc(cc1)I 7a_100000212066_100011218427 [1,0,0,0,0,1|2,0,0]=4 1526 B12R1.21 CC(O)COc1ccc(cc1)N 34a_100000185829_100011218427 [1,0,0,0,0,1|2,0,0]=4 1527 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100000752885_100011218427 [1,0,0,0,0,1|2,0,0]=4 1528 B12R1.21 CC(O)CSc1ccc(cc1)Br 62a_100011218427_100000752885 [1,0,0,0,0,1|2,0,0]=4 1529 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100000755918_100011218427 [1,0,0,0,0,1|2,0,0]=4 1530 B12R1.21 CC(O)CSc1ccc(cc1)Cl 62a_100011218427_100000755918 [1,0,0,0,0,1|2,0,0]=4 1531 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100000211213_100011218427 [1,0,0,0,0,1|2,0,0]=4 1532 B12R1.21 CC(O)CSc1ccc(cc1)F 62a_100011218427_100000211213 [1,0,0,0,0,1|2,0,0]=4 1533 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100000185761_100011218427 [1,0,0,0,0,1|2,0,0]=4 1534 B12R1.21 CC(O)CSc1ccc(cc1)N 62a_100011218427_100000185761 [1,0,0,0,0,1|2,0,0]=4 1535 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [1,0,0,0,0,1|1,0,0]=3 1536 B12R1.21 CC(O)CSc1ccc(cn1)O 62a_100000685995_100011218427 [1,0,0,0,0,1|2,0,0]=4 1537 B12R1.21 CC(O)CSc1ccc(cn1)O 62a_100011218427_100000744096 [1,0,0,0,0,1|2,0,0]=4 1538 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 1539 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [1,0,0,0,0,1|2,0,0]=4 1540 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 1541 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [1,0,0,0,0,1|2,0,0]=4 1542 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 1543 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 1544 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 1545 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 1546 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2230a_100000210018_100009817552 [1,0,0,0,0,1|2,0,0]=4 1547 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 34a_100000210018_100009817552 [1,0,0,0,0,1|2,0,0]=4 1548 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 2230a_100000210052_100009817552 [1,0,0,0,0,1|2,0,0]=4 1549 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Cl 34a_100000210052_100009817552 [1,0,0,0,0,1|2,0,0]=4 1550 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F 34a_100000185862_100009817552 [1,0,0,0,0,1|2,0,0]=4 1551 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I 34a_100000185761_100009817552 [1,0,0,0,0,1|2,0,0]=4 1552 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [1,0,0,0,0,1|1,0,0]=3 1553 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 34a_100000185759_100009817552 [1,0,0,0,0,1|2,0,0]=4 1554 B12R1.21 C[C@@H](O)COc1ccc(cc1)Br 7a_100000185759_100009817552 [1,0,0,0,0,1|2,0,0]=4 1555 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 34a_100000210216_100009817552 [1,0,0,0,0,1|2,0,0]=4 1556 B12R1.21 C[C@@H](O)COc1ccc(cc1)Cl 7a_100000210216_100009817552 [1,0,0,0,0,1|2,0,0]=4 1557 B12R1.21 C[C@@H](O)COc1ccc(cc1)F 34a_100000210339_100009817552 [1,0,0,0,0,1|2,0,0]=4 1558 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 34a_100000212066_100009817552 [1,0,0,0,0,1|2,0,0]=4 1559 B12R1.21 C[C@@H](O)COc1ccc(cc1)I 7a_100000212066_100009817552 [1,0,0,0,0,1|2,0,0]=4 1560 B12R1.21 C[C@@H](O)COc1ccc(cc1)N 34a_100000185829_100009817552 [1,0,0,0,0,1|2,0,0]=4 1561 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100000752885_100009817552 [1,0,0,0,0,1|2,0,0]=4 1562 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Br 62a_100009817552_100000752885 [1,0,0,0,0,1|2,0,0]=4 1563 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100000755918_100009817552 [1,0,0,0,0,1|2,0,0]=4 1564 B12R1.21 C[C@@H](O)CSc1ccc(cc1)Cl 62a_100009817552_100000755918 [1,0,0,0,0,1|2,0,0]=4 1565 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100000211213_100009817552 [1,0,0,0,0,1|2,0,0]=4 1566 B12R1.21 C[C@@H](O)CSc1ccc(cc1)F 62a_100009817552_100000211213 [1,0,0,0,0,1|2,0,0]=4 1567 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100000185761_100009817552 [1,0,0,0,0,1|2,0,0]=4 1568 B12R1.21 C[C@@H](O)CSc1ccc(cc1)N 62a_100009817552_100000185761 [1,0,0,0,0,1|2,0,0]=4 1569 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [1,0,0,0,0,1|1,0,0]=3 1570 B12R1.21 C[C@@H](O)CSc1ccc(cn1)O 62a_100000685995_100009817552 [1,0,0,0,0,1|2,0,0]=4 1571 B12R1.21 C[C@@H](O)CSc1ccc(cn1)O 62a_100009817552_100000744096 [1,0,0,0,0,1|2,0,0]=4 1572 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [1,0,0,0,0,1|2,0,0]=4 1573 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [1,0,0,0,0,1|2,0,0]=4 1574 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [1,0,0,0,0,1|2,0,0]=4 1575 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [1,0,0,0,0,1|2,0,0]=4 1576 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [1,0,0,0,0,1|2,0,0]=4 1577 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [1,0,0,0,0,1|2,0,0]=4 1578 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [1,0,0,0,0,1|2,0,0]=4 1579 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [1,0,0,0,0,1|2,0,0]=4 1580 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [1,0,0,0,0,1|2,0,0]=4 1581 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [1,0,0,0,0,1|2,0,0]=4 1582 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [1,0,0,0,0,1|2,0,0]=4 1583 B12R1.21 Cc1ccc(cc1)NCC(C)O 34a_100000124888_100011218427 [1,0,0,0,0,1|2,0,0]=4 1584 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O 34a_100000124888_100009817552 [1,0,0,0,0,1|2,0,0]=4 1585 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [1,0,0,0,0,1|2,0,0]=4 1586 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [1,0,0,0,0,1|2,0,0]=4 1587 B12R1.21 Cc1ccc(cc1)OCC(C)O 34a_100000210336_100011218427 [1,0,0,0,0,1|2,0,0]=4 1588 B12R1.21 Cc1ccc(cc1)OCC(C)O 7a_100000210336_100011218427 [1,0,0,0,0,1|2,0,0]=4 1589 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 34a_100000210336_100009817552 [1,0,0,0,0,1|2,0,0]=4 1590 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 7a_100000210336_100009817552 [1,0,0,0,0,1|2,0,0]=4 1591 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [1,0,0,0,0,1|2,0,0]=4 1592 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [1,0,0,0,0,1|2,0,0]=4 1593 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100000186775_100011218427 [1,0,0,0,0,1|2,0,0]=4 1594 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000186775 [1,0,0,0,0,1|2,0,0]=4 1595 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100000186775_100009817552 [1,0,0,0,0,1|2,0,0]=4 1596 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000186775 [1,0,0,0,0,1|2,0,0]=4 1597 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [1,0,0,0,0,1|1,0,1]=4 1598 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [1,0,0,0,0,1|1,0,1]=4 1599 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [1,0,0,0,0,1|1,0,1]=4 1600 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [1,0,0,0,0,1|1,0,1]=4 1601 B12R1.21 Oc1ccc(cc1)NCC(F)F 34a_100000185829_100011934356 [1,0,0,0,0,1|2,0,0]=4 1602 B12R1.21 Oc1ccc(cc1)SCC(F)F 62a_100011934356_100000185759 [1,0,0,0,0,1|2,0,0]=4 1603 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [1,0,0,0,0,1|1,0,1]=4 1604 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [1,0,0,0,0,1|1,0,1]=4 1605 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [1,0,0,0,0,1|1,0,1]=4 1606 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [1,0,0,0,0,1|1,0,1]=4 1607 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,0,0,0,0,1|1,0,1]=4 1608 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,0,0,0,0,1|1,0,1]=4 1609 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,0,0,0,0,1|1,0,1]=4 1610 B12R1.107 CC(C)C[C@H](N)c1ccccc1 271570a_100015190218_100000210277 [1,0,0,0,0,1|2,0,0]=4 1611 B12R1.107 CC(C)NC(C)c1ccccc1 2230a_100138425928_100000230085 [1,0,0,0,0,1|2,0,0]=4 1612 B12R1.107 CC(C)NC(C)c1ccccc1 34a_100138425928_100000211855 [1,0,0,0,0,1|2,0,0]=4 1613 B12R1.107 CC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000210206 [1,0,0,0,0,1|2,0,0]=4 1614 B12R1.107 CC(C)OC(C)c1ccccc1 34a_100000212225_100000211855 [1,0,0,0,0,1|2,0,0]=4 1615 B12R1.107 CC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000210206 [1,0,0,0,0,1|2,0,0]=4 1616 B12R1.107 CC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000210206 [1,0,0,0,0,1|2,0,0]=4 1617 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000210206_100000230085 [1,0,0,0,0,1|2,0,0]=4 1618 B12R1.107 CC(C)SC(C)c1ccccc1 62a_100000230085_100000210206 [1,0,0,0,0,1|2,0,0]=4 1619 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100000227976_200000210301 [1,0,0,0,0,1|2,0,0]=4 1620 B12R1.107 CN(C)CC(O)c1ccccc1 2230a_100102631434_100000185958 [1,0,0,0,0,1|2,0,0]=4 1621 B12R1.107 CN(C)CC(O)c1ccccc1 269982a_100000227976_200000210301 [1,0,0,0,0,1|2,0,0]=4 1622 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 2230a_100102631434_100011933945 [1,0,0,0,0,1|2,0,0]=4 1623 B12R1.107 CN([13CH3])CC(O)c1ccccc1 2230a_100000227976_200025704644 [1,0,0,0,0,1|2,0,0]=4 1624 B12R1.107 CN([13CH3])CC(O)c1ccccc1 269982a_100000227976_200025704644 [1,0,0,0,0,1|2,0,0]=4 1625 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,0,0,0,0,1|1,0,1]=4 1626 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)O 240690a_100000067596_100015343762 [0,0,0,0,0,2|1,0,1]=4 1627 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210760 [0,0,0,0,0,2|2,0,0]=4 1628 B14R1.678 CC(C)CN[C@@H](C)c1ccc(cc1)O 270004a_100161106496_100000210432 [0,0,0,0,0,2|2,0,0]=4 1629 B14R1.678 CC(C)NCC(C)c1ccc(cc1)O 34a_200015188644_100000210206 [0,0,0,0,0,2|2,0,0]=4 1630 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Br 2230a_100020626992_100000210206 [0,0,0,0,0,2|2,0,0]=4 1631 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Br 34a_100020626992_100000210206 [0,0,0,0,0,2|2,0,0]=4 1632 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000210206 [0,0,0,0,0,2|2,0,0]=4 1633 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Cl 2230a_100138425928_200011996143 [0,0,0,0,0,2|2,0,0]=4 1634 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Cl 34a_100000736658_100000210206 [0,0,0,0,0,2|2,0,0]=4 1635 B14R1.678 CC(C)NCC(O)c1ccc(cc1)Cl 34a_100138425928_200011996143 [0,0,0,0,0,2|2,0,0]=4 1636 B14R1.678 CC(C)NCC(O)c1ccc(cc1)O 34a_100000067596_100000210206 [0,0,0,0,0,2|1,0,0]=3 1637 B14R1.678 CC(C)NC[C@H](O)c1ccc(cc1)F 2230a_100138425928_100000720402 [0,0,0,0,0,2|2,0,0]=4 1638 B14R1.678 CC(C)NC[C@H](O)c1ccc(cc1)F 34a_100138425928_100000720402 [0,0,0,0,0,2|2,0,0]=4 1639 B14R1.678 CC(C)OCC(O)c1ccc(cc1)Cl 34a_100000212225_200011996143 [0,0,0,0,0,2|2,0,0]=4 1640 B14R1.678 CC(C)OC[C@H](O)c1ccc(cc1)F 34a_100000212225_100000720402 [0,0,0,0,0,2|2,0,0]=4 1641 B14R1.678 CC(C)SCC(O)c1ccc(cc1)Cl 62a_100000210206_200011996143 [0,0,0,0,0,2|2,0,0]=4 1642 B14R1.678 CC(C)SCC(O)c1ccc(cc1)Cl 62a_200011996143_100000210206 [0,0,0,0,0,2|2,0,0]=4 1643 B14R1.678 CC(C)SC[C@H](O)c1ccc(cc1)F 62a_100000210206_100000720402 [0,0,0,0,0,2|2,0,0]=4 1644 B14R1.678 CC(C)SC[C@H](O)c1ccc(cc1)F 62a_100000720402_100000210206 [0,0,0,0,0,2|2,0,0]=4 1645 B14R1.678 CC(O)CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100011218427 [0,0,0,0,0,2|2,0,0]=4 1646 B14R1.678 CC(OC[C@@H](C)N)c1ccc(cc1)Br 34a_100000737577_100000755118 [0,0,0,0,0,2|2,0,0]=4 1647 B14R1.678 CC(OC[C@@H](C)N)c1ccc(cc1)F 34a_100000737577_100000743420 [0,0,0,0,0,2|2,0,0]=4 1648 B14R1.678 C[C@H](NC[C@@H](C)O)c1ccc(cc1)O 2230a_100161106496_100009817552 [0,0,0,0,0,2|2,0,0]=4 1649 B14R1.678 Cc1ccc(cc1)C(C)OC[C@@H](C)N 34a_100000737577_100011261388 [0,0,0,0,0,2|2,0,0]=4 1650 B14R1.678 Cc1ccc(cc1)C(O)CNC(C)C 2230a_200020610344_100000210206 [0,0,0,0,0,2|2,0,0]=4 1651 B14R1.678 Cc1ccc(cc1)C(O)CNC(C)C 34a_200020610344_100000210206 [0,0,0,0,0,2|2,0,0]=4 1652 B14R1.698 CC(C)CC(C)Nc1ccc(cc1)O 34a_100000185829_100000731052 [0,0,0,0,0,2|2,0,0]=4 1653 B14R1.698 CC(C)CC(C)Sc1ccc(cc1)O 62a_100000731052_100000185759 [0,0,0,0,0,2|2,0,0]=4 1654 B14R1.698 CC(C)NC(C)Cc1ccc(cc1)O 2230a_100102634573_100000210206 [0,0,0,0,0,2|2,0,0]=4 1655 B14R1.698 CC(C)NC(C)Cc1ccc(cc1)O 34a_100102634573_100000210206 [0,0,0,0,0,2|2,0,0]=4