0 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000140223 [0,0,0,0,0,0|1,0,1]=2 1 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_200009884166_200000210301 [0,0,0,0,0,0|1,0,1]=2 2 B12R1.4 C#Cc1ccc(cc1)CC(=O)[13CH3] 1458a_200009884166_200025704644 [0,0,0,0,0,0|1,0,1]=2 3 B12R1.4 C#Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000140223 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.4 C#Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000140223 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.4 C#Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361452 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 11a_100011215031_100015343762 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 1626a_100011215031_100015343762 [0,0,0,0,0,0|2,0,1]=3 8 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 22a_100011215031_100000070787 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 527a_100011215031_100103153847 [0,0,0,0,0,0|2,0,1]=3 10 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000034074 [0,0,0,0,0,0|1,0,1]=2 11 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 271570a_100011290941_100000691760 [0,0,0,0,0,0|1,0,1]=2 12 B12R1.4 C=Cc1ccc(cc1)CC(=O)N 271570a_100011290941_100000162331 [0,0,0,0,0,0|2,0,1]=3 13 B12R1.4 C=Cc1ccc(cc1)CC(C)C 271570a_100011290941_100011221366 [0,0,0,0,0,0|2,0,2]=4 14 B12R1.4 C=Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000034074 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.4 C=Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000034074 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.4 C=Cc1ccc(cc1)CN(C)C 270004a_100102631434_100011361436 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.4 C=Cc1ccc(cc1)CN(C)C 271570a_100011290941_100000174694 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 11a_100011218248_100015343762 [0,0,0,0,0,0|2,0,1]=3 19 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 1626a_100011218248_100015343762 [0,0,0,0,0,0|2,0,1]=3 20 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 22a_100011218248_100000070787 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 271570a_100011290941_100000155215 [0,0,0,0,0,0|2,0,1]=3 22 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 527a_100011218248_100103153847 [0,0,0,0,0,0|2,0,1]=3 23 B12R1.4 C=Cc1ccc(cc1)NC(=O)N 271570a_100011290941_100000198584 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.4 C=Cc1ccc(cc1)OC(=O)C 271570a_100011290941_100000002173 [0,0,0,0,0,0|2,0,1]=3 25 B12R1.4 C=Cc1ccc(cc1)OC(=S)C 271570a_100011290941_200009816735 [0,0,0,0,0,0|2,1,1]=4 26 B12R1.4 C=Cc1ccc(cc1)SC(=O)C 271570a_100011290941_200009995050 [0,0,0,0,0,0|2,0,1]=3 27 B12R1.4 C=Cc1ccc(cn1)CC(=O)N 271570a_100011290941_200000071513 [0,0,0,0,0,0|3,0,1]=4 28 B12R1.4 C=Cc1ccc(cn1)NC(=O)C 271570a_100011290941_100011934715 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.4 C=Cc1ccc(nc1)CC(=O)N 271570a_100011290941_200010888337 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.4 C=Cc1ccc(nc1)NC(=O)C 271570a_100011290941_100000193312 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.4 CC(=Cc1ccc(cc1)C#N)C 271570a_100102525489_100000179745 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.4 CC(=Cc1ccc(cc1)C=O)C 271570a_100102525489_100000186029 [0,0,0,0,0,0|3,0,1]=4 33 B12R1.4 CC(=Cc1ccc(cc1)CF)C 271570a_100102525489_100010268989 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.4 CC(=Cc1ccc(cc1)CN)C 271570a_100102525489_100016989417 [0,0,0,0,0,0|3,0,1]=4 35 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.4 CC(=Cc1ccc(cc1)NN)C 271570a_100102525489_100016988836 [0,0,0,0,0,0|3,0,1]=4 37 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000070787_100000184898 [0,0,0,0,0,0|2,0,0]=2 38 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200000210301 [0,0,0,0,0,0|2,0,0]=2 39 B12R1.4 CC(=O)Cc1ccc(cc1)C=O 1458a_100000070787_100000075337 [0,0,0,0,0,0|2,0,0]=2 40 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [0,0,0,0,0,0|2,0,0]=2 41 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [0,0,0,0,0,0|2,0,0]=2 42 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,0,0,0,0,0|0,0,0]=0 43 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,0,0,0,0,0|0,0,0]=0 44 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000691760_200025704644 [0,0,0,0,0,0|0,1,0]=1 45 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000691760 [0,0,0,0,0,0|0,1,0]=1 46 B12R1.4 CC(=O)Cc1ccc(cn1)C#N 1458a_100000070787_100000693164 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.4 CC(=O)Cc1ccc(nc1)C#N 1458a_100000070787_100009816919 [0,0,0,0,0,0|3,0,0]=3 48 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100015343762 [0,0,0,0,0,0|3,0,0]=3 49 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100015343762 [0,0,0,0,0,0|3,0,0]=3 50 B12R1.4 CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000070787 [0,0,0,0,0,0|3,0,0]=3 51 B12R1.4 CC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000184111_200025704644 [0,0,0,0,0,0|2,0,0]=2 52 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,0,0,0,0,0|1,0,0]=1 53 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,0,0,0,0,0|1,0,0]=1 54 B12R1.4 CC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000155215 [0,0,0,0,0,0|1,1,0]=2 55 B12R1.4 CC(=O)Nc1ccc(cn1)O[13CH3] 34a_200000094647_200025704644 [0,0,0,0,0,0|2,0,0]=2 56 B12R1.4 CC(=O)Nc1ccc(cn1)O[13CH3] 7a_200000094647_200025704644 [0,0,0,0,0,0|2,0,0]=2 57 B12R1.4 CC(=O)Nc1ccc(cn1)S[13CH3] 62a_200025704644_100000193312 [0,0,0,0,0,0|2,1,0]=3 58 B12R1.4 CC(=O)Nc1ccc(nc1)S[13CH3] 62a_200025704644_100011934715 [0,0,0,0,0,0|2,1,0]=3 59 B12R1.4 CC(=O)Nc1ccc(nn1)S[13CH3] 62a_200025704644_100011804224 [0,0,0,0,0,0|3,1,0]=4 60 B12R1.4 CC(=O)Nc1cnc(nc1)S[13CH3] 62a_200025704644_200010565192 [0,0,0,0,0,0|3,1,0]=4 61 B12R1.4 CC(=O)Nc1ncc(cn1)S[13CH3] 62a_100010141023_200025704644 [0,0,0,0,0,0|3,1,0]=4 62 B12R1.4 CC(=O)Nc1ncc(cn1)S[13CH3] 62a_200025704644_100010141023 [0,0,0,0,0,0|3,1,0]=4 63 B12R1.4 CC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000002173 [0,0,0,0,0,0|1,1,0]=2 64 B12R1.4 CC(=O)Sc1ccc(cc1)S[13CH3] 62a_200009995050_200025704644 [0,0,0,0,0,0|1,1,0]=2 65 B12R1.4 CC(=S)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009816735 [0,0,0,0,0,0|1,2,0]=3 66 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [0,0,0,0,0,0|2,0,1]=3 67 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [0,0,0,0,0,0|2,0,1]=3 68 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [0,0,0,0,0,0|1,1,1]=3 69 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [0,0,0,0,0,0|1,1,1]=3 70 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_100000219625_200025704644 [0,0,0,0,0,0|2,1,1]=4 71 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000219625 [0,0,0,0,0,0|2,1,1]=4 72 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 2230a_100011194259_200025704644 [0,0,0,0,0,0|3,0,1]=4 73 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 34a_100011194259_200025704644 [0,0,0,0,0,0|3,0,1]=4 74 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [0,0,0,0,0,0|2,0,1]=3 75 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [0,0,0,0,0,0|2,0,1]=3 76 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_100000169947_200025704644 [0,0,0,0,0,0|2,1,1]=4 77 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000169947 [0,0,0,0,0,0|2,1,1]=4 78 B12R1.4 CC(C)Oc1ccc(cn1)O[13CH3] 34a_100009858630_200025704644 [0,0,0,0,0,0|3,0,1]=4 79 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_100009811894_200025704644 [0,0,0,0,0,0|2,1,1]=4 80 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_200025704644_100009811894 [0,0,0,0,0,0|2,1,1]=4 81 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,0,0,0,0,0|1,0,1]=2 82 B12R1.4 CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011215824 [0,0,0,0,0,0|2,0,1]=3 83 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_100000070787_100000747183 [0,0,0,0,0,0|1,0,0]=1 84 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_200000759805_200000210301 [0,0,0,0,0,0|1,0,0]=1 85 B12R1.4 CCc1ccc(cc1)CC(=O)[13CH3] 1458a_200000759805_200025704644 [0,0,0,0,0,0|1,0,0]=1 86 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100000683253_200000210301 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100102631434_100000747183 [0,0,0,0,0,0|3,0,0]=3 88 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100000683253_200000210301 [0,0,0,0,0,0|3,0,0]=3 89 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100102631434_100000747183 [0,0,0,0,0,0|3,0,0]=3 90 B12R1.4 CCc1ccc(cc1)CN(C)C 270004a_100102631434_100000211036 [0,0,0,0,0,0|3,0,0]=3 91 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 2230a_100000683253_200025704644 [0,0,0,0,0,0|3,0,0]=3 92 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 269982a_100000683253_200025704644 [0,0,0,0,0,0|3,0,0]=3 93 B12R1.4 CCc1ccc(cc1)NC(=O)C 11a_100000211069_100015343762 [0,0,0,0,0,0|2,0,0]=2 94 B12R1.4 CCc1ccc(cc1)NC(=O)C 1626a_100000211069_100015343762 [0,0,0,0,0,0|2,0,0]=2 95 B12R1.4 CCc1ccc(cc1)NC(=O)C 22a_100000211069_100000070787 [0,0,0,0,0,0|2,0,0]=2 96 B12R1.4 CCc1ccc(cc1)NC(=O)C 527a_100000211069_100103153847 [0,0,0,0,0,0|2,0,0]=2 97 B12R1.4 CCc1ccc(cc1)NC(C)C 2230a_100000211069_100000210206 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.4 CCc1ccc(cc1)NC(C)C 34a_100000211069_100000210206 [0,0,0,0,0,0|3,0,1]=4 99 B12R1.4 CCc1ccc(cc1)OC(C)C 34a_100000211359_100000210206 [0,0,0,0,0,0|3,0,1]=4 100 B12R1.4 CCc1ccc(cc1)OC(C)C 7a_100000211359_100000210206 [0,0,0,0,0,0|3,0,1]=4 101 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100000210206_100011215824 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100011215824_100000210206 [0,0,0,0,0,0|3,0,1]=4 103 B12R1.4 CCc1ccc(cn1)C=C(C)C 271570a_100102525489_100009820025 [0,0,0,0,0,0|3,0,1]=4 104 B12R1.4 CCc1ccc(nc1)C=C(C)C 271570a_100102525489_100009843584 [0,0,0,0,0,0|3,0,1]=4 105 B12R1.4 CCc1ccc(nc1)CN(C)C 270004a_100102631434_100000069529 [0,0,0,0,0,0|4,0,0]=4 106 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100000217971_200000210301 [0,0,0,0,0,0|4,0,0]=4 107 B12R1.4 CN(C)Cc1ccc(cc1)C#N 2230a_100102631434_100000184898 [0,0,0,0,0,0|4,0,0]=4 108 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100000217971_200000210301 [0,0,0,0,0,0|4,0,0]=4 109 B12R1.4 CN(C)Cc1ccc(cc1)C#N 269982a_100102631434_100000184898 [0,0,0,0,0,0|4,0,0]=4 110 B12R1.4 CN(C)Cc1ccc(cc1)C#N 270004a_100102631434_100000211122 [0,0,0,0,0,0|4,0,0]=4 111 B12R1.4 CN(C)Cc1ccc(cc1)C#N 34a_100000217971_200000210301 [0,0,0,0,0,0|4,0,0]=4 112 B12R1.4 CN(C)Cc1ccc(cc1)C=O 2230a_100102631434_100009816848 [0,0,0,0,0,0|4,0,0]=4 113 B12R1.4 CN(C)Cc1ccc(cc1)C=O 269982a_100102631434_100009816848 [0,0,0,0,0,0|4,0,0]=4 114 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [0,0,0,0,0,0|4,0,0]=4 115 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [0,0,0,0,0,0|4,0,0]=4 116 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [0,0,0,0,0,0|4,0,0]=4 117 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_100000174694_200025704644 [0,0,0,0,0,0|2,1,0]=3 118 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000174694 [0,0,0,0,0,0|2,1,0]=3 119 B12R1.4 CN(C)Cc1ccc(nc1)S[13CH3] 62a_106446545466_200025704644 [0,0,0,0,0,0|3,1,0]=4 120 B12R1.4 CN(C)Cc1ccc(nc1)S[13CH3] 62a_200025704644_106446545466 [0,0,0,0,0,0|3,1,0]=4 121 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 2230a_100000217971_200025704644 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 269982a_100000217971_200025704644 [0,0,0,0,0,0|4,0,0]=4 123 B12R1.4 CN([13CH3])Cc1ccc(cc1)C#N 34a_100000217971_200025704644 [0,0,0,0,0,0|4,0,0]=4 124 B12R1.4 CNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219623 [0,0,0,0,0,0|2,0,1]=3 125 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [0,0,0,0,0,0|2,0,0]=2 126 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [0,0,0,0,0,0|2,0,0]=2 127 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [0,0,0,0,0,0|2,0,1]=3 128 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [0,0,0,0,0,0|2,0,1]=3 129 B12R1.4 CNc1ccc(cc1)NC(=O)C 34a_100000184111_200000210301 [0,0,0,0,0,0|2,0,0]=2 130 B12R1.4 CNc1ccc(cc1)OC(C)C 2230a_100011194259_200000210301 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100000182112_100000210206 [0,0,0,0,0,0|3,0,1]=4 132 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100011194259_200000210301 [0,0,0,0,0,0|3,0,1]=4 133 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000210206_100000743151 [0,0,0,0,0,0|3,0,1]=4 134 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000743151_100000210206 [0,0,0,0,0,0|3,0,1]=4 135 B12R1.4 CNc1ccc(cn1)C=C(C)C 271570a_100102525489_100000741341 [0,0,0,0,0,0|3,0,1]=4 136 B12R1.4 CNc1ccc(nc1)C=C(C)C 271570a_100102525489_100000764248 [0,0,0,0,0,0|3,0,1]=4 137 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,0,0,0,0,0|1,0,1]=2 138 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,0,0,0,0,0|0,0,0]=0 139 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,0,0,0,0,0|0,0,0]=0 140 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,0,0,0,0,0|0,0,0]=0 141 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [0,0,0,0,0,0|1,0,0]=1 142 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,0,0,0,0,0|0,0,0]=0 143 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,0,0,0,0,0|1,0,1]=2 144 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [0,0,0,0,0,0|2,0,0]=2 145 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [0,0,0,0,0,0|2,0,0]=2 146 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [0,0,0,0,0,0|2,0,0]=2 147 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [0,0,0,0,0,0|2,0,0]=2 148 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [0,0,0,0,0,0|2,0,0]=2 149 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [0,0,0,0,0,0|2,0,0]=2 150 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [0,0,0,0,0,0|2,0,0]=2 151 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,0,0,0,0,0|1,0,0]=1 152 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,0,0,0,0,0|1,0,0]=1 153 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,0,0,0,0,0|1,0,0]=1 154 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,0,0,0,0,0|1,0,0]=1 155 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,0,0,0,0,0|1,0,0]=1 156 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,0,0,0,0,0|1,0,0]=1 157 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [0,0,0,0,0,0|2,0,1]=3 158 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [0,0,0,0,0,0|2,0,1]=3 159 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [0,0,0,0,0,0|2,0,1]=3 160 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [0,0,0,0,0,0|2,0,1]=3 161 B12R1.4 COc1ccc(cc1)OC(F)F 34a_100011217645_200000210301 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.4 COc1ccc(cc1)OC(F)F 7a_100011217645_200000210301 [0,0,0,0,0,0|3,0,1]=4 163 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [0,0,0,0,0,0|2,0,1]=3 164 B12R1.4 COc1ccc(cn1)C=C(C)C 271570a_100102525489_100000047065 [0,0,0,0,0,0|2,0,1]=3 165 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100000070787_100020631284 [0,0,0,0,0,0|1,0,0]=1 166 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100012001117_200000210301 [0,0,0,0,0,0|1,0,0]=1 167 B12R1.4 COc1ccc(cn1)CC(=O)[13CH3] 1458a_100012001117_200025704644 [0,0,0,0,0,0|1,0,0]=1 168 B12R1.4 COc1ccc(cn1)CN(C)C 2230a_100102631434_100020631284 [0,0,0,0,0,0|3,0,0]=3 169 B12R1.4 COc1ccc(cn1)CN(C)C 269982a_100102631434_100020631284 [0,0,0,0,0,0|3,0,0]=3 170 B12R1.4 COc1ccc(cn1)CN(C)C 270004a_100102631434_100000761633 [0,0,0,0,0,0|3,0,0]=3 171 B12R1.4 COc1ccc(cn1)OC(C)C 34a_100011934560_100000210206 [0,0,0,0,0,0|3,0,1]=4 172 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000047065_100000210206 [0,0,0,0,0,0|3,0,1]=4 173 B12R1.4 COc1ccc(cn1)SC(C)C 62a_100000210206_100000047065 [0,0,0,0,0,0|3,0,1]=4 174 B12R1.4 COc1ccc(nc1)C=C(C)C 271570a_100102525489_100000755202 [0,0,0,0,0,0|2,0,1]=3 175 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000070787_200000757186 [0,0,0,0,0,0|1,0,0]=1 176 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000722272_200000210301 [0,0,0,0,0,0|1,0,0]=1 177 B12R1.4 COc1ccc(nc1)CC(=O)[13CH3] 1458a_100000722272_200025704644 [0,0,0,0,0,0|1,0,0]=1 178 B12R1.4 COc1ccc(nc1)CN(C)C 2230a_100102631434_200000757186 [0,0,0,0,0,0|3,0,0]=3 179 B12R1.4 COc1ccc(nc1)CN(C)C 269982a_100102631434_200000757186 [0,0,0,0,0,0|3,0,0]=3 180 B12R1.4 COc1ccc(nc1)CN(C)C 270004a_100102631434_100000701244 [0,0,0,0,0,0|3,0,0]=3 181 B12R1.4 COc1ccc(nc1)NC(=O)C 34a_200000094647_200000210301 [0,0,0,0,0,0|2,0,0]=2 182 B12R1.4 COc1ccc(nc1)NC(=O)C 7a_200000094647_200000210301 [0,0,0,0,0,0|2,0,0]=2 183 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100009858630_200000210301 [0,0,0,0,0,0|3,0,1]=4 184 B12R1.4 COc1ccc(nc1)OC(C)C 34a_100012002028_100000210206 [0,0,0,0,0,0|3,0,1]=4 185 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000210206_100000744180 [0,0,0,0,0,0|3,0,1]=4 186 B12R1.4 COc1ccc(nc1)SC(C)C 62a_100000755202_100000210206 [0,0,0,0,0,0|3,0,1]=4 187 B12R1.4 COc1ccc(nn1)C=C(C)C 271570a_100102525489_100009819040 [0,0,0,0,0,0|3,0,1]=4 188 B12R1.4 COc1cnc(cn1)C=C(C)C 271570a_100102525489_100011998698 [0,0,0,0,0,0|3,0,1]=4 189 B12R1.4 COc1cnc(cn1)CN(C)C 270004a_100102631434_100000099869 [0,0,0,0,0,0|4,0,0]=4 190 B12R1.4 COc1cnc(nc1)C=C(C)C 271570a_100102525489_100000069167 [0,0,0,0,0,0|3,0,1]=4 191 B12R1.4 COc1ncc(cn1)C=C(C)C 271570a_100102525489_100000686852 [0,0,0,0,0,0|3,0,1]=4 192 B12R1.4 COc1ncc(cn1)CN(C)C 270004a_100102631434_100011202752 [0,0,0,0,0,0|4,0,0]=4 193 B12R1.4 CSc1ccc(cc1)C=C(Br)Br 62a_200000210301_200013992848 [0,0,0,0,0,0|2,1,1]=4 194 B12R1.4 CSc1ccc(cc1)C=C(Br)Br 62a_200013992848_200000210301 [0,0,0,0,0,0|2,1,1]=4 195 B12R1.4 CSc1ccc(cc1)C=C(C)C 271570a_100102525489_100011263217 [0,0,0,0,0,0|1,1,1]=3 196 B12R1.4 CSc1ccc(cc1)C=C(F)F 62a_200000210301_200009816947 [0,0,0,0,0,0|2,1,1]=4 197 B12R1.4 CSc1ccc(cc1)C=C(F)F 62a_200009816947_200000210301 [0,0,0,0,0,0|2,1,1]=4 198 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000070787_100000181263 [0,0,0,0,0,0|0,1,0]=1 199 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000756958_200000210301 [0,0,0,0,0,0|0,1,0]=1 200 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_100000691760_200000210301 [0,0,0,0,0,0|0,1,0]=1 201 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_200000210301_100000691760 [0,0,0,0,0,0|0,1,0]=1 202 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [0,0,0,0,0,0|1,1,0]=2 203 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [0,0,0,0,0,0|1,1,0]=2 204 B12R1.4 CSc1ccc(cc1)CC(=O)[13CH3] 1458a_100000756958_200025704644 [0,0,0,0,0,0|0,1,0]=1 205 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [0,0,0,0,0,0|1,1,1]=3 206 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [0,0,0,0,0,0|1,1,1]=3 207 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_100102631434_100000181263 [0,0,0,0,0,0|2,1,0]=3 208 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_102495365258_200000210301 [0,0,0,0,0,0|2,1,0]=3 209 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_100102631434_100011934452 [0,0,0,0,0,0|2,1,0]=3 210 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_102495365258_200000210301 [0,0,0,0,0,0|2,1,0]=3 211 B12R1.4 CSc1ccc(cc1)CN(C)C 270004a_100102631434_100000211154 [0,0,0,0,0,0|2,1,0]=3 212 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_100000174694_200000210301 [0,0,0,0,0,0|2,1,0]=3 213 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_200000210301_100000174694 [0,0,0,0,0,0|2,1,0]=3 214 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 2230a_102495365258_200025704644 [0,0,0,0,0,0|2,1,0]=3 215 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 269982a_102495365258_200025704644 [0,0,0,0,0,0|2,1,0]=3 216 B12R1.4 CSc1ccc(cc1)NC(=O)C 11a_100000212337_100015343762 [0,0,0,0,0,0|1,1,0]=2 217 B12R1.4 CSc1ccc(cc1)NC(=O)C 22a_100000212337_100000070787 [0,0,0,0,0,0|1,1,0]=2 218 B12R1.4 CSc1ccc(cc1)NC(=O)C 527a_100000212337_100103153847 [0,0,0,0,0,0|1,1,0]=2 219 B12R1.4 CSc1ccc(cc1)NC(=O)C 62a_200000210301_100000155215 [0,0,0,0,0,0|1,1,0]=2 220 B12R1.4 CSc1ccc(cc1)NC(=O)N 62a_200000210301_100000198584 [0,0,0,0,0,0|2,1,0]=3 221 B12R1.4 CSc1ccc(cc1)NC(C)C 34a_100000212337_100000210206 [0,0,0,0,0,0|2,1,1]=4 222 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_100000219625_200000210301 [0,0,0,0,0,0|2,1,1]=4 223 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_200000210301_100000219625 [0,0,0,0,0,0|2,1,1]=4 224 B12R1.4 CSc1ccc(cc1)OC(=O)C 62a_200000210301_100000002173 [0,0,0,0,0,0|1,1,0]=2 225 B12R1.4 CSc1ccc(cc1)OC(=S)C 62a_200000210301_200009816735 [0,0,0,0,0,0|1,2,0]=3 226 B12R1.4 CSc1ccc(cc1)OC(C)C 34a_100000211864_100000210206 [0,0,0,0,0,0|2,1,1]=4 227 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_100000169947_200000210301 [0,0,0,0,0,0|2,1,1]=4 228 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_200000210301_100000169947 [0,0,0,0,0,0|2,1,1]=4 229 B12R1.4 CSc1ccc(cc1)SC(=O)C 62a_200009995050_200000210301 [0,0,0,0,0,0|1,1,0]=2 230 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100000210206_100011263217 [0,0,0,0,0,0|2,1,1]=4 231 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100009811894_200000210301 [0,0,0,0,0,0|2,1,1]=4 232 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100011263217_100000210206 [0,0,0,0,0,0|2,1,1]=4 233 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_200000210301_100009811894 [0,0,0,0,0,0|2,1,1]=4 234 B12R1.4 CSc1ccc(cn1)C=C(C)C 271570a_100102525489_100011408404 [0,0,0,0,0,0|2,1,1]=4 235 B12R1.4 CSc1ccc(cn1)CC(=O)N 62a_200000071513_200000210301 [0,0,0,0,0,0|2,1,0]=3 236 B12R1.4 CSc1ccc(cn1)CC(=O)N 62a_200000210301_200000071513 [0,0,0,0,0,0|2,1,0]=3 237 B12R1.4 CSc1ccc(cn1)CN(C)C 62a_106446545466_200000210301 [0,0,0,0,0,0|3,1,0]=4 238 B12R1.4 CSc1ccc(cn1)CN(C)C 62a_200000210301_106446545466 [0,0,0,0,0,0|3,1,0]=4 239 B12R1.4 CSc1ccc(cn1)NC(=O)C 62a_200000210301_100011934715 [0,0,0,0,0,0|2,1,0]=3 240 B12R1.4 CSc1ccc(nc1)C=C(C)C 271570a_100102525489_100009820866 [0,0,0,0,0,0|2,1,1]=4 241 B12R1.4 CSc1ccc(nc1)CC(=O)N 62a_200000210301_200010888337 [0,0,0,0,0,0|2,1,0]=3 242 B12R1.4 CSc1ccc(nc1)CC(=O)N 62a_200010888337_200000210301 [0,0,0,0,0,0|2,1,0]=3 243 B12R1.4 CSc1ccc(nc1)NC(=O)C 62a_200000210301_100000193312 [0,0,0,0,0,0|2,1,0]=3 244 B12R1.4 CSc1ccc(nn1)CC(=O)N 62a_100015841783_200000210301 [0,0,0,0,0,0|3,1,0]=4 245 B12R1.4 CSc1ccc(nn1)CC(=O)N 62a_200000210301_100015841783 [0,0,0,0,0,0|3,1,0]=4 246 B12R1.4 CSc1ccc(nn1)NC(=O)C 62a_200000210301_100011804224 [0,0,0,0,0,0|3,1,0]=4 247 B12R1.4 CSc1cnc(nc1)NC(=O)C 62a_100010141023_200000210301 [0,0,0,0,0,0|3,1,0]=4 248 B12R1.4 CSc1cnc(nc1)NC(=O)C 62a_200000210301_100010141023 [0,0,0,0,0,0|3,1,0]=4 249 B12R1.4 CSc1ncc(cn1)NC(=O)C 62a_200000210301_200010565192 [0,0,0,0,0,0|3,1,0]=4 250 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200025704644 [0,0,0,0,0,0|2,0,0]=2 251 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [0,0,0,0,0,0|2,0,0]=2 252 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [0,0,0,0,0,0|2,0,0]=2 253 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [0,0,0,0,0,0|2,0,0]=2 254 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [0,0,0,0,0,0|1,0,0]=1 255 B12R1.4 [13CH3]Oc1ccc(cc1)OC(F)F 34a_100011217645_200025704644 [0,0,0,0,0,0|3,0,1]=4 256 B12R1.4 [13CH3]Oc1ccc(cc1)OC(F)F 7a_100011217645_200025704644 [0,0,0,0,0,0|3,0,1]=4 257 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(Br)Br 62a_200013992848_200025704644 [0,0,0,0,0,0|2,1,1]=4 258 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(Br)Br 62a_200025704644_200013992848 [0,0,0,0,0,0|2,1,1]=4 259 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(F)F 62a_200009816947_200025704644 [0,0,0,0,0,0|2,1,1]=4 260 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(F)F 62a_200025704644_200009816947 [0,0,0,0,0,0|2,1,1]=4 261 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [0,0,0,0,0,0|1,1,0]=2 262 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [0,0,0,0,0,0|1,1,0]=2 263 B12R1.4 [13CH3]Sc1ccc(cc1)NC(=O)N 62a_200025704644_100000198584 [0,0,0,0,0,0|2,1,0]=3 264 B12R1.4 [13CH3]Sc1ccc(cn1)CC(=O)N 62a_200000071513_200025704644 [0,0,0,0,0,0|2,1,0]=3 265 B12R1.4 [13CH3]Sc1ccc(cn1)CC(=O)N 62a_200025704644_200000071513 [0,0,0,0,0,0|2,1,0]=3 266 B12R1.4 [13CH3]Sc1ccc(nc1)CC(=O)N 62a_200010888337_200025704644 [0,0,0,0,0,0|2,1,0]=3 267 B12R1.4 [13CH3]Sc1ccc(nc1)CC(=O)N 62a_200025704644_200010888337 [0,0,0,0,0,0|2,1,0]=3 268 B12R1.4 [13CH3]Sc1ccc(nn1)CC(=O)N 62a_100015841783_200025704644 [0,0,0,0,0,0|3,1,0]=4 269 B12R1.4 [13CH3]Sc1ccc(nn1)CC(=O)N 62a_200025704644_100015841783 [0,0,0,0,0,0|3,1,0]=4 270 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [1,0,0,0,0,0|2,0,1]=4 271 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [1,0,0,0,0,0|1,0,1]=3 272 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [1,0,0,0,0,0|2,0,1]=4 273 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [1,0,0,0,0,0|2,0,1]=4 274 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [1,0,0,0,0,0|2,0,1]=4 275 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,0,0,0,0,0|1,0,1]=3 276 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [1,0,0,0,0,0|2,0,1]=4 278 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [1,0,0,0,0,0|2,0,1]=4 279 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [1,0,0,0,0,0|1,0,0]=2 280 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [1,0,0,0,0,0|1,0,0]=2 281 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [1,0,0,0,0,0|0,0,0]=1 282 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [1,0,0,0,0,0|0,0,0]=1 283 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [1,0,0,0,0,0|1,0,0]=2 284 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [1,0,0,0,0,0|1,0,0]=2 285 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [1,0,0,0,0,0|1,0,0]=2 286 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [1,0,0,0,0,0|1,0,0]=2 287 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [1,0,0,0,0,0|1,0,0]=2 288 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [1,0,0,0,0,0|1,0,0]=2 289 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,0,0,0,0,0|0,0,0]=1 290 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,0,0,0,0,0|0,0,0]=1 291 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100000070787_100000702658 [1,0,0,0,0,0|2,0,0]=3 292 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000210301 [1,0,0,0,0,0|2,0,0]=3 293 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [1,0,0,0,0,0|1,0,0]=2 294 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [1,0,0,0,0,0|1,0,0]=2 295 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000070787_100012066911 [1,0,0,0,0,0|2,0,0]=3 296 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000210301 [1,0,0,0,0,0|2,0,0]=3 297 B11R1.20 CC(=O)Cc1ccc(cn1)F 1458a_100000070787_100000703193 [1,0,0,0,0,0|2,0,0]=3 298 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100000070787_100009831999 [1,0,0,0,0,0|2,0,0]=3 299 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000210301 [1,0,0,0,0,0|2,0,0]=3 300 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000070787_100016987292 [1,0,0,0,0,0|1,0,0]=2 301 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000740413_200000210301 [1,0,0,0,0,0|1,0,0]=2 302 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000210301 [1,0,0,0,0,0|2,0,0]=3 303 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000070787_100000735431 [1,0,0,0,0,0|2,0,0]=3 304 B11R1.20 CC(=O)Cc1ccc(nc1)F 1458a_100000070787_100009820150 [1,0,0,0,0,0|2,0,0]=3 305 B11R1.20 CC(=O)Cc1ccc(nn1)Cl 1458a_100000070787_100016992710 [1,0,0,0,0,0|3,0,0]=4 306 B11R1.20 CC(=O)Cc1cnc(cn1)C 1458a_100000070787_100000752025 [1,0,0,0,0,0|2,0,0]=3 307 B11R1.20 CC(=O)Cc1ncc(cn1)Br 1458a_100000070787_100010064664 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.20 CC(=O)Cc1ncc(cn1)C 1458a_100000070787_100000685645 [1,0,0,0,0,0|2,0,0]=3 309 B11R1.20 CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000210301 [1,0,0,0,0,0|1,0,1]=3 310 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [1,0,0,0,0,0|2,0,0]=3 311 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [1,0,0,0,0,0|2,0,0]=3 312 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [1,0,0,0,0,0|2,0,0]=3 313 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [1,0,0,0,0,0|2,0,0]=3 314 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [1,0,0,0,0,0|1,0,0]=2 315 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [1,0,0,0,0,0|1,0,0]=2 316 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [1,0,0,0,0,0|1,0,0]=2 317 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [1,0,0,0,0,0|1,0,0]=2 318 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [1,0,0,0,0,0|2,0,0]=3 319 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [1,0,0,0,0,0|2,0,0]=3 320 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [1,0,0,0,0,0|2,0,0]=3 321 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [1,0,0,0,0,0|2,0,0]=3 322 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [1,0,0,0,0,0|2,0,0]=3 323 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [1,0,0,0,0,0|2,0,0]=3 324 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [1,0,0,0,0,0|2,0,0]=3 325 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [1,0,0,0,0,0|2,0,0]=3 326 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [1,0,0,0,0,0|2,0,0]=3 327 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [1,0,0,0,0,0|2,0,0]=3 328 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [1,0,0,0,0,0|2,0,0]=3 329 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [1,0,0,0,0,0|2,0,0]=3 330 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [1,0,0,0,0,0|1,0,0]=2 331 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [1,0,0,0,0,0|1,0,0]=2 332 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [1,0,0,0,0,0|2,0,0]=3 333 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [1,0,0,0,0,0|2,0,0]=3 334 B11R1.20 CC(=O)Nc1ccc(nn1)O 271570a_203496583355_100011804224 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.20 CC(=O)Nc1ncc(cn1)O 271570a_203496583355_100010141023 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [1,0,0,0,0,0|1,0,0]=2 337 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [1,0,0,0,0,0|1,0,0]=2 338 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [1,0,0,0,0,0|1,1,0]=3 339 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [1,0,0,0,0,0|1,0,1]=3 340 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,0,0,0,0,0|2,0,1]=4 343 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [1,0,0,0,0,0|2,0,1]=4 344 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [1,0,0,0,0,0|2,0,1]=4 345 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [1,0,0,0,0,0|3,0,0]=4 346 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [1,0,0,0,0,0|3,0,0]=4 348 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [1,0,0,0,0,0|3,0,0]=4 349 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [1,0,0,0,0,0|3,0,0]=4 350 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 351 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [1,0,0,0,0,0|3,0,0]=4 352 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 353 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [1,0,0,0,0,0|3,0,0]=4 354 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [1,0,0,0,0,0|3,0,0]=4 355 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [1,0,0,0,0,0|3,0,0]=4 356 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 357 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [1,0,0,0,0,0|3,0,0]=4 361 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [1,0,0,0,0,0|3,0,0]=4 362 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [1,0,0,0,0,0|3,0,0]=4 364 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [1,0,0,0,0,0|2,0,0]=3 365 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [1,0,0,0,0,0|2,0,0]=3 366 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [1,0,0,0,0,0|2,0,0]=3 367 B11R1.20 CN(C)Cc1ccc(nc1)O 271570a_203496583355_106446545466 [1,0,0,0,0,0|3,0,0]=4 368 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [1,0,0,0,0,0|3,0,0]=4 369 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [1,0,0,0,0,0|3,0,0]=4 370 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 371 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 372 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [1,0,0,0,0,0|3,0,0]=4 373 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 374 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 375 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [1,0,0,0,0,0|3,0,0]=4 376 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [1,0,0,0,0,0|2,0,0]=3 377 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [1,0,0,0,0,0|2,0,0]=3 378 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [1,0,0,0,0,0|0,0,0]=1 379 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [1,0,0,0,0,0|2,0,0]=3 380 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [1,0,0,0,0,0|2,0,0]=3 381 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [1,0,0,0,0,0|2,0,0]=3 382 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [1,0,0,0,0,0|2,0,0]=3 383 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [1,0,0,0,0,0|2,0,0]=3 384 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [1,0,0,0,0,0|2,0,0]=3 385 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [1,0,0,0,0,0|2,0,0]=3 386 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [1,0,0,0,0,0|2,0,0]=3 387 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [1,0,0,0,0,0|2,0,0]=3 388 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.20 Cc1ccc(cn1)CC(=O)[13CH3] 1458a_100000740413_200025704644 [1,0,0,0,0,0|1,0,0]=2 394 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_100102631434_100016987292 [1,0,0,0,0,0|3,0,0]=4 395 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_106623407658_200000210301 [1,0,0,0,0,0|3,0,0]=4 396 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_100102631434_100016987292 [1,0,0,0,0,0|3,0,0]=4 397 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_106623407658_200000210301 [1,0,0,0,0,0|3,0,0]=4 398 B11R1.20 Cc1ccc(cn1)CN(C)C 270004a_100102631434_100000743784 [1,0,0,0,0,0|3,0,0]=4 399 B11R1.20 Cc1ccc(cn1)CN(C)C 34a_106623407658_200000210301 [1,0,0,0,0,0|3,0,0]=4 400 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 2230a_106623407658_200025704644 [1,0,0,0,0,0|3,0,0]=4 401 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 269982a_106623407658_200025704644 [1,0,0,0,0,0|3,0,0]=4 402 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 34a_106623407658_200025704644 [1,0,0,0,0,0|3,0,0]=4 403 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [1,0,0,0,0,0|1,0,0]=2 404 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_100102631434_100000691093 [1,0,0,0,0,0|3,0,0]=4 405 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_200000717808_200000210301 [1,0,0,0,0,0|3,0,0]=4 406 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_100102631434_100000691093 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_200000717808_200000210301 [1,0,0,0,0,0|3,0,0]=4 408 B11R1.20 Cc1ccc(nc1)CN(C)C 270004a_100102631434_100000050478 [1,0,0,0,0,0|3,0,0]=4 409 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 2230a_200000717808_200025704644 [1,0,0,0,0,0|3,0,0]=4 410 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 269982a_200000717808_200025704644 [1,0,0,0,0,0|3,0,0]=4 411 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [1,0,0,0,0,0|1,0,0]=2 412 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [1,0,0,0,0,0|2,0,0]=3 413 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [1,0,0,0,0,0|2,0,0]=3 414 B11R1.20 NC(=O)Cc1ccc(nn1)O 271570a_203496583355_100015841783 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [1,0,0,0,0,0|2,0,0]=3 416 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [1,0,0,0,0,0|2,0,1]=4 417 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [1,0,0,0,0,0|2,0,1]=4 418 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [1,0,0,0,0,0|1,0,0]=2 419 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [1,0,0,0,0,0|1,0,0]=2 420 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [1,0,0,0,0,0|1,0,0]=2 421 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [1,0,0,0,0,0|1,0,0]=2 422 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,0,0,0,0,0|0,0,0]=1 423 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200025704644 [1,0,0,0,0,0|2,0,0]=3 424 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200025704644 [1,0,0,0,0,0|2,0,0]=3 425 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200025704644 [1,0,0,0,0,0|2,0,0]=3 426 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200025704644 [1,0,0,0,0,0|2,0,0]=3 427 B11R1.20 [13CH3]C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200025704644 [1,0,0,0,0,0|1,0,1]=3 428 B11R1.83 C#Cc1ccc(cc1)CNC 207a_100102657272_100011361452 [1,0,0,0,0,0|2,0,1]=4 429 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_100015199678_200000210301 [1,0,0,0,0,0|2,0,1]=4 430 B11R1.83 C#Cc1ccc(cc1)CNC 2230a_106832991635_100000140223 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.83 C#Cc1ccc(cc1)CNC 270004a_106832991635_100011361452 [1,0,0,0,0,0|2,0,1]=4 432 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100015199678_200000210301 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.83 C#Cc1ccc(cc1)CNC 34a_100102657272_100000140223 [1,0,0,0,0,0|2,0,1]=4 434 B11R1.83 C#Cc1ccc(cc1)CNC 7a_106832991635_100000140223 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 2230a_100015199678_200025704644 [1,0,0,0,0,0|2,0,1]=4 436 B11R1.83 C#Cc1ccc(cc1)CN[13CH3] 34a_100015199678_200025704644 [1,0,0,0,0,0|2,0,1]=4 437 B11R1.83 C#Cc1ccc(cc1)COC 34a_100000054647_200000210301 [1,0,0,0,0,0|2,0,1]=4 438 B11R1.83 C#Cc1ccc(cc1)COC 34a_100138415774_100000140223 [1,0,0,0,0,0|2,0,1]=4 439 B11R1.83 C#Cc1ccc(cc1)COC 7a_100000054647_200000210301 [1,0,0,0,0,0|2,0,1]=4 440 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 34a_100000054647_200025704644 [1,0,0,0,0,0|2,0,1]=4 441 B11R1.83 C#Cc1ccc(cc1)CO[13CH3] 7a_100000054647_200025704644 [1,0,0,0,0,0|2,0,1]=4 442 B11R1.83 C#Cc1ccc(cc1)CSC 62a_200000210301_100000140223 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.83 C#Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000140223 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_100016259036_200000210301 [1,0,0,0,0,0|0,1,1]=3 445 B11R1.83 C/C=C/c1ccc(cc1)SC 62a_200000210301_100016259036 [1,0,0,0,0,0|0,1,1]=3 446 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_100016259036_200025704644 [1,0,0,0,0,0|0,1,1]=3 447 B11R1.83 C/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100016259036 [1,0,0,0,0,0|0,1,1]=3 448 B11R1.83 C=C=Cc1ccc(cc1)OC 271570a_100015277604_100000171711 [1,0,0,0,0,0|0,0,3]=4 449 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [1,0,0,0,0,0|0,0,1]=2 450 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [1,0,0,0,0,0|0,0,1]=2 451 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [1,0,0,0,0,0|0,0,1]=2 452 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [1,0,0,0,0,0|0,0,1]=2 453 B11R1.83 C=COc1ccc(cc1)SC 62a_100000704263_200000210301 [1,0,0,0,0,0|1,1,1]=4 454 B11R1.83 C=COc1ccc(cc1)SC 62a_200000210301_100000704263 [1,0,0,0,0,0|1,1,1]=4 455 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_100000704263_200025704644 [1,0,0,0,0,0|1,1,1]=4 456 B11R1.83 C=COc1ccc(cc1)S[13CH3] 62a_200025704644_100000704263 [1,0,0,0,0,0|1,1,1]=4 457 B11R1.83 C=Cc1ccc(cc1)/C=C/C 271570a_100011290941_100016259036 [1,0,0,0,0,0|1,0,2]=4 458 B11R1.83 C=Cc1ccc(cc1)CC=O 271570a_100011290941_100011361690 [1,0,0,0,0,0|1,0,1]=3 459 B11R1.83 C=Cc1ccc(cc1)CCC 271570a_100011290941_100000750032 [1,0,0,0,0,0|1,0,2]=4 460 B11R1.83 C=Cc1ccc(cc1)CNC 2230a_106832991635_100000034074 [1,0,0,0,0,0|2,0,1]=4 461 B11R1.83 C=Cc1ccc(cc1)CNC 26a_100102657272_100000189437 [1,0,0,0,0,0|2,0,1]=4 462 B11R1.83 C=Cc1ccc(cc1)CNC 270004a_106832991635_100011361436 [1,0,0,0,0,0|2,0,1]=4 463 B11R1.83 C=Cc1ccc(cc1)CNC 271570a_100011290941_100000180866 [1,0,0,0,0,0|2,0,1]=4 464 B11R1.83 C=Cc1ccc(cc1)CNC 34a_100102657272_100000034074 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.83 C=Cc1ccc(cc1)CNC 34a_200011934891_200000210301 [1,0,0,0,0,0|2,0,1]=4 466 B11R1.83 C=Cc1ccc(cc1)CNC 7a_106832991635_100000034074 [1,0,0,0,0,0|2,0,1]=4 467 B11R1.83 C=Cc1ccc(cc1)CN[13CH3] 34a_200011934891_200025704644 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.83 C=Cc1ccc(cc1)COC 271570a_100011290941_100011493685 [1,0,0,0,0,0|2,0,1]=4 469 B11R1.83 C=Cc1ccc(cc1)COC 34a_100000073583_200000210301 [1,0,0,0,0,0|2,0,1]=4 470 B11R1.83 C=Cc1ccc(cc1)COC 34a_100138415774_100000034074 [1,0,0,0,0,0|2,0,1]=4 471 B11R1.83 C=Cc1ccc(cc1)COC 7a_100000073583_200000210301 [1,0,0,0,0,0|2,0,1]=4 472 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 34a_100000073583_200025704644 [1,0,0,0,0,0|2,0,1]=4 473 B11R1.83 C=Cc1ccc(cc1)CO[13CH3] 7a_100000073583_200025704644 [1,0,0,0,0,0|2,0,1]=4 474 B11R1.83 C=Cc1ccc(cc1)CSC 62a_100000034074_200000210301 [1,0,0,0,0,0|2,0,1]=4 475 B11R1.83 C=Cc1ccc(cc1)CSC 62a_200000210301_100000034074 [1,0,0,0,0,0|2,0,1]=4 476 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_100000034074_200025704644 [1,0,0,0,0,0|2,0,1]=4 477 B11R1.83 C=Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000034074 [1,0,0,0,0,0|2,0,1]=4 478 B11R1.83 CC=Cc1ccc(cc1)C#N 271570a_100016259895_100000179745 [1,0,0,0,0,0|2,0,1]=4 479 B11R1.83 CC=Cc1ccc(cc1)C=O 271570a_100016259895_100000186029 [1,0,0,0,0,0|2,0,1]=4 480 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [1,0,0,0,0,0|1,0,1]=3 481 B11R1.83 CC=Cc1ccc(cc1)CF 271570a_100016259895_100010268989 [1,0,0,0,0,0|2,0,1]=4 482 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [1,0,0,0,0,0|2,0,1]=4 483 B11R1.83 CC=Cc1ccc(cc1)CO 271570a_100016259895_100000690907 [1,0,0,0,0,0|2,0,1]=4 484 B11R1.83 CC=Cc1ccc(cc1)NC 271570a_100016259895_100000219623 [1,0,0,0,0,0|1,0,1]=3 485 B11R1.83 CC=Cc1ccc(cc1)NN 271570a_100016259895_100016988836 [1,0,0,0,0,0|2,0,1]=4 486 B11R1.83 CC=Cc1ccc(cc1)OC 271570a_100016259895_100000171711 [1,0,0,0,0,0|0,0,1]=2 487 B11R1.83 CC=Cc1ccc(cc1)SC 271570a_100016259895_100011263217 [1,0,0,0,0,0|0,1,1]=3 488 B11R1.83 CC=Cc1ccc(cn1)CC 271570a_100016259895_100009843584 [1,0,0,0,0,0|2,0,1]=4 489 B11R1.83 CC=Cc1ccc(cn1)NC 271570a_100016259895_100000764248 [1,0,0,0,0,0|2,0,1]=4 490 B11R1.83 CC=Cc1ccc(cn1)OC 271570a_100016259895_100000755202 [1,0,0,0,0,0|1,0,1]=3 491 B11R1.83 CC=Cc1ccc(cn1)SC 271570a_100016259895_100009820866 [1,0,0,0,0,0|1,1,1]=4 492 B11R1.83 CC=Cc1ccc(nc1)CC 271570a_100016259895_100009820025 [1,0,0,0,0,0|2,0,1]=4 493 B11R1.83 CC=Cc1ccc(nc1)NC 271570a_100016259895_100000741341 [1,0,0,0,0,0|2,0,1]=4 494 B11R1.83 CC=Cc1ccc(nc1)OC 271570a_100016259895_100000047065 [1,0,0,0,0,0|1,0,1]=3 495 B11R1.83 CC=Cc1ccc(nc1)SC 271570a_100016259895_100011408404 [1,0,0,0,0,0|1,1,1]=4 496 B11R1.83 CC=Cc1ccc(nn1)OC 271570a_100016259895_100009819040 [1,0,0,0,0,0|2,0,1]=4 497 B11R1.83 CC=Cc1cnc(cn1)OC 271570a_100016259895_100011998698 [1,0,0,0,0,0|2,0,1]=4 498 B11R1.83 CC=Cc1cnc(nc1)OC 271570a_100016259895_100000686852 [1,0,0,0,0,0|2,0,1]=4 499 B11R1.83 CC=Cc1ncc(cn1)OC 271570a_100016259895_100000069167 [1,0,0,0,0,0|2,0,1]=4 500 B11R1.83 CCCc1ccc(cc1)NC 2230a_100000211780_200000210301 [1,0,0,0,0,0|1,0,1]=3 501 B11R1.83 CCCc1ccc(cc1)NC 34a_100000211780_200000210301 [1,0,0,0,0,0|1,0,1]=3 502 B11R1.83 CCCc1ccc(cc1)N[13CH3] 2230a_100000211780_200025704644 [1,0,0,0,0,0|1,0,1]=3 503 B11R1.83 CCCc1ccc(cc1)N[13CH3] 34a_100000211780_200025704644 [1,0,0,0,0,0|1,0,1]=3 504 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [1,0,0,0,0,0|0,0,1]=2 505 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [1,0,0,0,0,0|0,0,1]=2 506 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [1,0,0,0,0,0|0,0,1]=2 507 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [1,0,0,0,0,0|0,0,1]=2 508 B11R1.83 CCCc1ccc(cc1)SC 62a_100000750032_200000210301 [1,0,0,0,0,0|0,1,1]=3 509 B11R1.83 CCCc1ccc(cc1)SC 62a_200000210301_100000750032 [1,0,0,0,0,0|0,1,1]=3 510 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_100000750032_200025704644 [1,0,0,0,0,0|0,1,1]=3 511 B11R1.83 CCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000750032 [1,0,0,0,0,0|0,1,1]=3 512 B11R1.83 CCNc1ccc(cc1)CC 2230a_100000211069_100000210202 [1,0,0,0,0,0|2,0,1]=4 513 B11R1.83 CCNc1ccc(cc1)CC 34a_100000211069_100000210202 [1,0,0,0,0,0|2,0,1]=4 514 B11R1.83 CCNc1ccc(cc1)OC 34a_100000184247_100000210202 [1,0,0,0,0,0|1,0,1]=3 515 B11R1.83 CCNc1ccc(cc1)OC 34a_100011337800_200000210301 [1,0,0,0,0,0|1,0,1]=3 516 B11R1.83 CCNc1ccc(cc1)OC 7a_100011337800_200000210301 [1,0,0,0,0,0|1,0,1]=3 517 B11R1.83 CCNc1ccc(cc1)O[13CH3] 34a_100011337800_200025704644 [1,0,0,0,0,0|1,0,1]=3 518 B11R1.83 CCNc1ccc(cc1)O[13CH3] 7a_100011337800_200025704644 [1,0,0,0,0,0|1,0,1]=3 519 B11R1.83 CCNc1ccc(cc1)SC 34a_100000212337_100000210202 [1,0,0,0,0,0|1,1,1]=4 520 B11R1.83 CCNc1ccc(cc1)SC 62a_200000210301_100000219632 [1,0,0,0,0,0|1,1,1]=4 521 B11R1.83 CCNc1ccc(cc1)S[13CH3] 62a_200025704644_100000219632 [1,0,0,0,0,0|1,1,1]=4 522 B11R1.83 CCOc1ccc(cc1)CC 34a_100000211359_100000210202 [1,0,0,0,0,0|2,0,1]=4 523 B11R1.83 CCOc1ccc(cc1)CC 7a_100000211359_100000210202 [1,0,0,0,0,0|2,0,1]=4 524 B11R1.83 CCOc1ccc(cc1)NC 2230a_100000739623_200000210301 [1,0,0,0,0,0|2,0,1]=4 525 B11R1.83 CCOc1ccc(cc1)NC 34a_100000182112_100000210202 [1,0,0,0,0,0|2,0,1]=4 526 B11R1.83 CCOc1ccc(cc1)NC 34a_100000739623_200000210301 [1,0,0,0,0,0|2,0,1]=4 527 B11R1.83 CCOc1ccc(cc1)N[13CH3] 2230a_100000739623_200025704644 [1,0,0,0,0,0|2,0,1]=4 528 B11R1.83 CCOc1ccc(cc1)N[13CH3] 34a_100000739623_200025704644 [1,0,0,0,0,0|2,0,1]=4 529 B11R1.83 CCOc1ccc(cc1)OC 34a_100000185467_200000210301 [1,0,0,0,0,0|1,0,1]=3 530 B11R1.83 CCOc1ccc(cc1)OC 34a_100000210503_100000210202 [1,0,0,0,0,0|1,0,1]=3 531 B11R1.83 CCOc1ccc(cc1)O[13CH3] 34a_100000185467_200025704644 [1,0,0,0,0,0|1,0,1]=3 532 B11R1.83 CCOc1ccc(cc1)SC 34a_100000211864_100000210202 [1,0,0,0,0,0|1,1,1]=4 533 B11R1.83 CCOc1ccc(cc1)SC 62a_200000210301_100000171712 [1,0,0,0,0,0|1,1,1]=4 534 B11R1.83 CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000171712 [1,0,0,0,0,0|1,1,1]=4 535 B11R1.83 CCOc1ccc(cn1)OC 34a_100012002028_100000210202 [1,0,0,0,0,0|2,0,1]=4 536 B11R1.83 CCOc1ccc(nc1)OC 34a_100011934560_100000210202 [1,0,0,0,0,0|2,0,1]=4 537 B11R1.83 CCSc1ccc(cc1)CC 62a_100000210202_100011215824 [1,0,0,0,0,0|2,0,1]=4 538 B11R1.83 CCSc1ccc(cc1)CC 62a_100011215824_100000210202 [1,0,0,0,0,0|2,0,1]=4 539 B11R1.83 CCSc1ccc(cc1)NC 34a_100015187087_200000210301 [1,0,0,0,0,0|2,0,1]=4 540 B11R1.83 CCSc1ccc(cc1)NC 62a_100000210202_100000743151 [1,0,0,0,0,0|2,0,1]=4 541 B11R1.83 CCSc1ccc(cc1)NC 62a_100000743151_100000210202 [1,0,0,0,0,0|2,0,1]=4 542 B11R1.83 CCSc1ccc(cc1)N[13CH3] 34a_100015187087_200025704644 [1,0,0,0,0,0|2,0,1]=4 543 B11R1.83 CCSc1ccc(cc1)OC 62a_100000210202_100000171711 [1,0,0,0,0,0|1,0,1]=3 544 B11R1.83 CCSc1ccc(cc1)SC 62a_100000210202_100011263217 [1,0,0,0,0,0|1,1,1]=4 545 B11R1.83 CCSc1ccc(cc1)SC 62a_100011263217_100000210202 [1,0,0,0,0,0|1,1,1]=4 546 B11R1.83 CCSc1ccc(cc1)SC 62a_200000210301_200009811893 [1,0,0,0,0,0|1,1,1]=4 547 B11R1.83 CCSc1ccc(cc1)SC 62a_200009811893_200000210301 [1,0,0,0,0,0|1,1,1]=4 548 B11R1.83 CCSc1ccc(cc1)S[13CH3] 62a_200009811893_200025704644 [1,0,0,0,0,0|1,1,1]=4 549 B11R1.83 CCSc1ccc(cc1)S[13CH3] 62a_200025704644_200009811893 [1,0,0,0,0,0|1,1,1]=4 550 B11R1.83 CCSc1ccc(cn1)OC 62a_100000210202_100000744180 [1,0,0,0,0,0|2,0,1]=4 551 B11R1.83 CCSc1ccc(cn1)OC 62a_100000755202_100000210202 [1,0,0,0,0,0|2,0,1]=4 552 B11R1.83 CCSc1ccc(nc1)OC 62a_100000047065_100000210202 [1,0,0,0,0,0|2,0,1]=4 553 B11R1.83 CCSc1ccc(nc1)OC 62a_100000210202_100000047065 [1,0,0,0,0,0|2,0,1]=4 554 B11R1.83 CCc1ccc(cc1)CNC 207a_100102657272_100000211036 [1,0,0,0,0,0|2,0,0]=3 555 B11R1.83 CCc1ccc(cc1)CNC 2230a_100000721222_200000210301 [1,0,0,0,0,0|2,0,0]=3 556 B11R1.83 CCc1ccc(cc1)CNC 2230a_106832991635_100000747183 [1,0,0,0,0,0|2,0,0]=3 557 B11R1.83 CCc1ccc(cc1)CNC 26a_100102657272_100000211359 [1,0,0,0,0,0|2,0,0]=3 558 B11R1.83 CCc1ccc(cc1)CNC 270004a_106832991635_100000211036 [1,0,0,0,0,0|2,0,0]=3 559 B11R1.83 CCc1ccc(cc1)CNC 34a_100000721222_200000210301 [1,0,0,0,0,0|2,0,0]=3 560 B11R1.83 CCc1ccc(cc1)CNC 34a_100102657272_100000747183 [1,0,0,0,0,0|2,0,0]=3 561 B11R1.83 CCc1ccc(cc1)CNC 7a_106832991635_100000747183 [1,0,0,0,0,0|2,0,0]=3 562 B11R1.83 CCc1ccc(cc1)CN[13CH3] 2230a_100000721222_200025704644 [1,0,0,0,0,0|2,0,0]=3 563 B11R1.83 CCc1ccc(cc1)CN[13CH3] 34a_100000721222_200025704644 [1,0,0,0,0,0|2,0,0]=3 564 B11R1.83 CCc1ccc(cc1)COC 34a_100000702245_200000210301 [1,0,0,0,0,0|2,0,0]=3 565 B11R1.83 CCc1ccc(cc1)COC 34a_100138415774_100000747183 [1,0,0,0,0,0|2,0,0]=3 566 B11R1.83 CCc1ccc(cc1)COC 7a_100000702245_200000210301 [1,0,0,0,0,0|2,0,0]=3 567 B11R1.83 CCc1ccc(cc1)CO[13CH3] 34a_100000702245_200025704644 [1,0,0,0,0,0|2,0,0]=3 568 B11R1.83 CCc1ccc(cc1)CO[13CH3] 7a_100000702245_200025704644 [1,0,0,0,0,0|2,0,0]=3 569 B11R1.83 CCc1ccc(cc1)CSC 62a_100000757233_200000210301 [1,0,0,0,0,0|2,0,0]=3 570 B11R1.83 CCc1ccc(cc1)CSC 62a_200000210301_100000747183 [1,0,0,0,0,0|2,0,0]=3 571 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_100000757233_200025704644 [1,0,0,0,0,0|2,0,0]=3 572 B11R1.83 CCc1ccc(cc1)CS[13CH3] 62a_200025704644_100000747183 [1,0,0,0,0,0|2,0,0]=3 573 B11R1.83 CCc1ccc(nc1)CNC 207a_100102657272_100000069529 [1,0,0,0,0,0|3,0,0]=4 574 B11R1.83 CCc1ccc(nc1)CNC 2230a_100000069493_200000210301 [1,0,0,0,0,0|3,0,0]=4 575 B11R1.83 CCc1ccc(nc1)CNC 270004a_106832991635_100000069529 [1,0,0,0,0,0|3,0,0]=4 576 B11R1.83 CCc1ccc(nc1)CNC 34a_100000069493_200000210301 [1,0,0,0,0,0|3,0,0]=4 577 B11R1.83 CCc1ccc(nc1)CN[13CH3] 2230a_100000069493_200025704644 [1,0,0,0,0,0|3,0,0]=4 578 B11R1.83 CCc1ccc(nc1)CN[13CH3] 34a_100000069493_200025704644 [1,0,0,0,0,0|3,0,0]=4 579 B11R1.83 CCc1ccc(nc1)COC 34a_100000068455_200000210301 [1,0,0,0,0,0|3,0,0]=4 580 B11R1.83 CCc1ccc(nc1)CO[13CH3] 34a_100000068455_200025704644 [1,0,0,0,0,0|3,0,0]=4 581 B11R1.83 CNCc1ccc(cc1)C#N 207a_100102657272_100000211122 [1,0,0,0,0,0|3,0,0]=4 582 B11R1.83 CNCc1ccc(cc1)C#N 2230a_106832991635_100000184898 [1,0,0,0,0,0|3,0,0]=4 583 B11R1.83 CNCc1ccc(cc1)C#N 26a_100102657272_100000210344 [1,0,0,0,0,0|3,0,0]=4 584 B11R1.83 CNCc1ccc(cc1)C#N 270004a_106832991635_100000211122 [1,0,0,0,0,0|3,0,0]=4 585 B11R1.83 CNCc1ccc(cc1)C#N 34a_100015207190_200000210301 [1,0,0,0,0,0|3,0,0]=4 586 B11R1.83 CNCc1ccc(cc1)C#N 34a_100102657272_100000184898 [1,0,0,0,0,0|3,0,0]=4 587 B11R1.83 CNCc1ccc(cc1)C#N 7a_106832991635_100000184898 [1,0,0,0,0,0|3,0,0]=4 588 B11R1.83 CNCc1ccc(cc1)C=O 2230a_106832991635_100009816848 [1,0,0,0,0,0|3,0,0]=4 589 B11R1.83 CNCc1ccc(cc1)C=O 34a_100102657272_100009816848 [1,0,0,0,0,0|3,0,0]=4 590 B11R1.83 CNCc1ccc(cc1)C=O 7a_106832991635_100009816848 [1,0,0,0,0,0|3,0,0]=4 591 B11R1.83 CNCc1ccc(cc1)CO 207a_100102657272_100009832023 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.83 CNCc1ccc(cc1)CO 2230a_100015189231_200000210301 [1,0,0,0,0,0|3,0,0]=4 593 B11R1.83 CNCc1ccc(cc1)CO 2230a_106832991635_100000067286 [1,0,0,0,0,0|3,0,0]=4 594 B11R1.83 CNCc1ccc(cc1)CO 26a_100102657272_100000211755 [1,0,0,0,0,0|3,0,0]=4 595 B11R1.83 CNCc1ccc(cc1)CO 270004a_106832991635_100009832023 [1,0,0,0,0,0|3,0,0]=4 596 B11R1.83 CNCc1ccc(cc1)CO 34a_100015189231_200000210301 [1,0,0,0,0,0|3,0,0]=4 597 B11R1.83 CNCc1ccc(cc1)CO 34a_100102657272_100000067286 [1,0,0,0,0,0|3,0,0]=4 598 B11R1.83 CNCc1ccc(cc1)CO 7a_106832991635_100000067286 [1,0,0,0,0,0|3,0,0]=4 599 B11R1.83 CNCc1ccc(cc1)OC 207a_100102657272_100000169835 [1,0,0,0,0,0|1,0,0]=2 600 B11R1.83 CNCc1ccc(cc1)OC 2230a_106832991635_100000742318 [1,0,0,0,0,0|1,0,0]=2 601 B11R1.83 CNCc1ccc(cc1)OC 26a_100102657272_100000210503 [1,0,0,0,0,0|1,0,0]=2 602 B11R1.83 CNCc1ccc(cc1)OC 270004a_106832991635_100000169835 [1,0,0,0,0,0|1,0,0]=2 603 B11R1.83 CNCc1ccc(cc1)OC 34a_100000185587_200000210301 [1,0,0,0,0,0|1,0,0]=2 604 B11R1.83 CNCc1ccc(cc1)OC 34a_100000207500_200000210301 [1,0,0,0,0,0|1,0,0]=2 605 B11R1.83 CNCc1ccc(cc1)OC 34a_100102657272_100000742318 [1,0,0,0,0,0|1,0,0]=2 606 B11R1.83 CNCc1ccc(cc1)OC 7a_106832991635_100000742318 [1,0,0,0,0,0|1,0,0]=2 607 B11R1.83 CNCc1ccc(cc1)O[13CH3] 34a_100000207500_200025704644 [1,0,0,0,0,0|1,0,0]=2 608 B11R1.83 CNCc1ccc(cc1)SC 207a_100102657272_100000211154 [1,0,0,0,0,0|1,1,0]=3 609 B11R1.83 CNCc1ccc(cc1)SC 2230a_100000174980_200000210301 [1,0,0,0,0,0|1,1,0]=3 610 B11R1.83 CNCc1ccc(cc1)SC 2230a_106832991635_100000181263 [1,0,0,0,0,0|1,1,0]=3 611 B11R1.83 CNCc1ccc(cc1)SC 26a_100102657272_100000211864 [1,0,0,0,0,0|1,1,0]=3 612 B11R1.83 CNCc1ccc(cc1)SC 270004a_106832991635_100000211154 [1,0,0,0,0,0|1,1,0]=3 613 B11R1.83 CNCc1ccc(cc1)SC 34a_100000174980_200000210301 [1,0,0,0,0,0|1,1,0]=3 614 B11R1.83 CNCc1ccc(cc1)SC 34a_100102657272_100000181263 [1,0,0,0,0,0|1,1,0]=3 615 B11R1.83 CNCc1ccc(cc1)SC 62a_100000180866_200000210301 [1,0,0,0,0,0|1,1,0]=3 616 B11R1.83 CNCc1ccc(cc1)SC 62a_200000210301_100000180866 [1,0,0,0,0,0|1,1,0]=3 617 B11R1.83 CNCc1ccc(cc1)SC 7a_106832991635_100000181263 [1,0,0,0,0,0|1,1,0]=3 618 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_100000180866_200025704644 [1,0,0,0,0,0|1,1,0]=3 619 B11R1.83 CNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000180866 [1,0,0,0,0,0|1,1,0]=3 620 B11R1.83 CNCc1ccc(cn1)OC 207a_100102657272_100000701244 [1,0,0,0,0,0|2,0,0]=3 621 B11R1.83 CNCc1ccc(cn1)OC 2230a_106832991635_200000757186 [1,0,0,0,0,0|2,0,0]=3 622 B11R1.83 CNCc1ccc(cn1)OC 270004a_106832991635_100000701244 [1,0,0,0,0,0|2,0,0]=3 623 B11R1.83 CNCc1ccc(cn1)OC 34a_100000703904_200000210301 [1,0,0,0,0,0|2,0,0]=3 624 B11R1.83 CNCc1ccc(cn1)OC 34a_100102657272_200000757186 [1,0,0,0,0,0|2,0,0]=3 625 B11R1.83 CNCc1ccc(cn1)OC 7a_106832991635_200000757186 [1,0,0,0,0,0|2,0,0]=3 626 B11R1.83 CNCc1ccc(nc1)OC 207a_100102657272_100000761633 [1,0,0,0,0,0|2,0,0]=3 627 B11R1.83 CNCc1ccc(nc1)OC 2230a_100000241975_200000210301 [1,0,0,0,0,0|2,0,0]=3 628 B11R1.83 CNCc1ccc(nc1)OC 2230a_106832991635_100020631284 [1,0,0,0,0,0|2,0,0]=3 629 B11R1.83 CNCc1ccc(nc1)OC 270004a_106832991635_100000761633 [1,0,0,0,0,0|2,0,0]=3 630 B11R1.83 CNCc1ccc(nc1)OC 34a_100102657272_100020631284 [1,0,0,0,0,0|2,0,0]=3 631 B11R1.83 CNCc1ccc(nc1)OC 7a_106832991635_100020631284 [1,0,0,0,0,0|2,0,0]=3 632 B11R1.83 CNCc1ccc(nc1)SC 62a_100000026953_200000210301 [1,0,0,0,0,0|2,1,0]=4 633 B11R1.83 CNCc1ccc(nc1)SC 62a_200000210301_100000026953 [1,0,0,0,0,0|2,1,0]=4 634 B11R1.83 CNCc1ccc(nc1)S[13CH3] 62a_100000026953_200025704644 [1,0,0,0,0,0|2,1,0]=4 635 B11R1.83 CNCc1ccc(nc1)S[13CH3] 62a_200025704644_100000026953 [1,0,0,0,0,0|2,1,0]=4 636 B11R1.83 CNCc1cnc(cn1)OC 207a_100102657272_100000099869 [1,0,0,0,0,0|3,0,0]=4 637 B11R1.83 CNCc1cnc(cn1)OC 270004a_106832991635_100000099869 [1,0,0,0,0,0|3,0,0]=4 638 B11R1.83 CNCc1cnc(nc1)OC 270004a_106832991635_100011202752 [1,0,0,0,0,0|3,0,0]=4 639 B11R1.83 CNc1ccc(cc1)CC#N 34a_100000198999_200000210301 [1,0,0,0,0,0|2,0,1]=4 640 B11R1.83 CNc1ccc(cc1)CCO 2230a_100011204434_200000210301 [1,0,0,0,0,0|1,0,2]=4 641 B11R1.83 CNc1ccc(cc1)CCO 34a_100011204434_200000210301 [1,0,0,0,0,0|1,0,2]=4 642 B11R1.83 CNc1ccc(cc1)COC 34a_100000694113_200000210301 [1,0,0,0,0,0|2,0,0]=3 643 B11R1.83 CNc1ccc(cc1)CSC 2230a_106726388226_200000210301 [1,0,0,0,0,0|2,0,0]=3 644 B11R1.83 CNc1ccc(cc1)CSC 34a_106726388226_200000210301 [1,0,0,0,0,0|2,0,0]=3 645 B11R1.83 CNc1ccc(cc1)CSC 7a_106726388226_200000210301 [1,0,0,0,0,0|2,0,0]=3 646 B11R1.83 COCc1ccc(cc1)C#N 34a_100000238739_200000210301 [1,0,0,0,0,0|3,0,0]=4 647 B11R1.83 COCc1ccc(cc1)C#N 34a_100138415774_100000184898 [1,0,0,0,0,0|3,0,0]=4 648 B11R1.83 COCc1ccc(cc1)C#N 7a_100000238739_200000210301 [1,0,0,0,0,0|3,0,0]=4 649 B11R1.83 COCc1ccc(cc1)C=O 34a_100138415774_100009816848 [1,0,0,0,0,0|3,0,0]=4 650 B11R1.83 COCc1ccc(cc1)CBr 34a_100012353999_200000210301 [1,0,0,0,0,0|3,0,0]=4 651 B11R1.83 COCc1ccc(cc1)CBr 7a_100012353999_200000210301 [1,0,0,0,0,0|3,0,0]=4 652 B11R1.83 COCc1ccc(cc1)CCl 34a_100000067286_200000210301 [1,0,0,0,0,0|3,0,0]=4 653 B11R1.83 COCc1ccc(cc1)CCl 7a_100000067286_200000210301 [1,0,0,0,0,0|3,0,0]=4 654 B11R1.83 COCc1ccc(cc1)CN 34a_100015189231_200000210301 [1,0,0,0,0,0|3,0,0]=4 655 B11R1.83 COCc1ccc(cc1)CO 34a_100138415774_100000067286 [1,0,0,0,0,0|3,0,0]=4 656 B11R1.83 COCc1ccc(cc1)N[13CH3] 34a_100000694113_200025704644 [1,0,0,0,0,0|2,0,0]=3 657 B11R1.83 COCc1ccc(cc1)OC 34a_100000173359_200000210301 [1,0,0,0,0,0|1,0,0]=2 658 B11R1.83 COCc1ccc(cc1)OC 34a_100138415774_100000742318 [1,0,0,0,0,0|1,0,0]=2 659 B11R1.83 COCc1ccc(cc1)OC 34a_200011995677_200000210301 [1,0,0,0,0,0|1,0,0]=2 660 B11R1.83 COCc1ccc(cc1)OC 7a_200011995677_200000210301 [1,0,0,0,0,0|1,0,0]=2 661 B11R1.83 COCc1ccc(cc1)O[13CH3] 34a_200011995677_200025704644 [1,0,0,0,0,0|1,0,0]=2 662 B11R1.83 COCc1ccc(cc1)O[13CH3] 7a_200011995677_200025704644 [1,0,0,0,0,0|1,0,0]=2 663 B11R1.83 COCc1ccc(cc1)SC 34a_100011215404_200000210301 [1,0,0,0,0,0|1,1,0]=3 664 B11R1.83 COCc1ccc(cc1)SC 34a_100138415774_100000181263 [1,0,0,0,0,0|1,1,0]=3 665 B11R1.83 COCc1ccc(cc1)SC 62a_100011493685_200000210301 [1,0,0,0,0,0|1,1,0]=3 666 B11R1.83 COCc1ccc(cc1)SC 62a_200000210301_100011493685 [1,0,0,0,0,0|1,1,0]=3 667 B11R1.83 COCc1ccc(cc1)SC 7a_100011215404_200000210301 [1,0,0,0,0,0|1,1,0]=3 668 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_100011493685_200025704644 [1,0,0,0,0,0|1,1,0]=3 669 B11R1.83 COCc1ccc(cc1)S[13CH3] 62a_200025704644_100011493685 [1,0,0,0,0,0|1,1,0]=3 670 B11R1.83 COCc1ccc(cn1)OC 34a_100011998694_200000210301 [1,0,0,0,0,0|2,0,0]=3 671 B11R1.83 COCc1ccc(cn1)OC 34a_100138415774_200000757186 [1,0,0,0,0,0|2,0,0]=3 672 B11R1.83 COCc1ccc(nc1)OC 34a_100000763316_200000210301 [1,0,0,0,0,0|2,0,0]=3 673 B11R1.83 COCc1ccc(nc1)OC 34a_100138415774_100020631284 [1,0,0,0,0,0|2,0,0]=3 674 B11R1.83 COc1ccc(cc1)CC#N 34a_100000198970_200000210301 [1,0,0,0,0,0|1,0,1]=3 675 B11R1.83 COc1ccc(cc1)CC#N 7a_100000198970_200000210301 [1,0,0,0,0,0|1,0,1]=3 676 B11R1.83 COc1ccc(cc1)CCBr 34a_100009816426_200000210301 [1,0,0,0,0,0|1,0,1]=3 677 B11R1.83 COc1ccc(cc1)CCBr 7a_100009816426_200000210301 [1,0,0,0,0,0|1,0,1]=3 678 B11R1.83 COc1ccc(cc1)CCN 34a_100000743037_200000210301 [1,0,0,0,0,0|1,0,1]=3 679 B11R1.83 COc1ccc(cc1)CCO 34a_100011215338_200000210301 [1,0,0,0,0,0|0,0,2]=3 680 B11R1.83 COc1ccc(cc1)CCO 7a_100011215338_200000210301 [1,0,0,0,0,0|0,0,2]=3 681 B11R1.83 COc1ccc(cc1)CN[13CH3] 34a_100000185587_200025704644 [1,0,0,0,0,0|1,0,0]=2 682 B11R1.83 COc1ccc(cc1)CO[13CH3] 34a_100000173359_200025704644 [1,0,0,0,0,0|1,0,0]=2 683 B11R1.83 COc1ccc(cc1)CSC 62a_200000210301_100000742318 [1,0,0,0,0,0|1,0,0]=2 684 B11R1.83 COc1ccc(cc1)CS[13CH3] 62a_200025704644_100000742318 [1,0,0,0,0,0|1,0,0]=2 685 B11R1.83 COc1ccc(cc1)NCF 34a_100000184247_100015361967 [1,0,0,0,0,0|2,0,1]=4 686 B11R1.83 COc1ccc(cc1)OCF 34a_100000210503_100015361967 [1,0,0,0,0,0|2,0,1]=4 687 B11R1.83 COc1ccc(cc1)SCF 62a_100015361967_100000171711 [1,0,0,0,0,0|2,0,1]=4 688 B11R1.83 COc1ccc(cn1)CN[13CH3] 2230a_100000241975_200025704644 [1,0,0,0,0,0|2,0,0]=3 689 B11R1.83 COc1ccc(cn1)CO[13CH3] 34a_100000763316_200025704644 [1,0,0,0,0,0|2,0,0]=3 690 B11R1.83 COc1ccc(cn1)CSC 62a_100020631284_200000210301 [1,0,0,0,0,0|2,0,0]=3 691 B11R1.83 COc1ccc(cn1)CSC 62a_200000210301_100020631284 [1,0,0,0,0,0|2,0,0]=3 692 B11R1.83 COc1ccc(cn1)CS[13CH3] 62a_100020631284_200025704644 [1,0,0,0,0,0|2,0,0]=3 693 B11R1.83 COc1ccc(cn1)CS[13CH3] 62a_200025704644_100020631284 [1,0,0,0,0,0|2,0,0]=3 694 B11R1.83 COc1ccc(nc1)CN[13CH3] 34a_100000703904_200025704644 [1,0,0,0,0,0|2,0,0]=3 695 B11R1.83 COc1ccc(nc1)CO[13CH3] 34a_100011998694_200025704644 [1,0,0,0,0,0|2,0,0]=3 696 B11R1.83 COc1ccc(nc1)CSC 62a_200000210301_200000757186 [1,0,0,0,0,0|2,0,0]=3 697 B11R1.83 COc1ccc(nc1)CSC 62a_200000757186_200000210301 [1,0,0,0,0,0|2,0,0]=3 698 B11R1.83 COc1ccc(nc1)CS[13CH3] 62a_200000757186_200025704644 [1,0,0,0,0,0|2,0,0]=3 699 B11R1.83 COc1ccc(nc1)CS[13CH3] 62a_200025704644_200000757186 [1,0,0,0,0,0|2,0,0]=3 700 B11R1.83 CSCc1ccc(cc1)C#N 62a_200000210301_100000184898 [1,0,0,0,0,0|3,0,0]=4 701 B11R1.83 CSCc1ccc(cc1)C=O 62a_100009816848_200000210301 [1,0,0,0,0,0|3,0,0]=4 702 B11R1.83 CSCc1ccc(cc1)C=O 62a_200000210301_100009816848 [1,0,0,0,0,0|3,0,0]=4 703 B11R1.83 CSCc1ccc(cc1)CO 62a_100000067286_200000210301 [1,0,0,0,0,0|3,0,0]=4 704 B11R1.83 CSCc1ccc(cc1)CO 62a_200000210301_100000067286 [1,0,0,0,0,0|3,0,0]=4 705 B11R1.83 CSCc1ccc(cc1)N[13CH3] 2230a_106726388226_200025704644 [1,0,0,0,0,0|2,0,0]=3 706 B11R1.83 CSCc1ccc(cc1)N[13CH3] 34a_106726388226_200025704644 [1,0,0,0,0,0|2,0,0]=3 707 B11R1.83 CSCc1ccc(cc1)N[13CH3] 7a_106726388226_200025704644 [1,0,0,0,0,0|2,0,0]=3 708 B11R1.83 CSCc1ccc(cc1)SC 62a_100000181263_200000210301 [1,0,0,0,0,0|1,1,0]=3 709 B11R1.83 CSCc1ccc(cc1)SC 62a_200000210301_100000181263 [1,0,0,0,0,0|1,1,0]=3 710 B11R1.83 CSCc1ccc(nc1)SC 62a_100000753673_200000210301 [1,0,0,0,0,0|2,1,0]=4 711 B11R1.83 CSCc1ccc(nc1)SC 62a_200000210301_100000753673 [1,0,0,0,0,0|2,1,0]=4 712 B11R1.83 CSCc1ccc(nc1)S[13CH3] 62a_100000753673_200025704644 [1,0,0,0,0,0|2,1,0]=4 713 B11R1.83 CSCc1ccc(nc1)S[13CH3] 62a_200025704644_100000753673 [1,0,0,0,0,0|2,1,0]=4 714 B11R1.83 CSc1ccc(cc1)/C=C/Br 62a_200000210301_200016255901 [1,0,0,0,0,0|1,1,1]=4 715 B11R1.83 CSc1ccc(cc1)/C=C/Br 62a_200016255901_200000210301 [1,0,0,0,0,0|1,1,1]=4 716 B11R1.83 CSc1ccc(cc1)CC#N 62a_100011217881_200000210301 [1,0,0,0,0,0|1,1,1]=4 717 B11R1.83 CSc1ccc(cc1)CC#N 62a_200000210301_100011217881 [1,0,0,0,0,0|1,1,1]=4 718 B11R1.83 CSc1ccc(cc1)CC=O 62a_100011361690_200000210301 [1,0,0,0,0,0|0,1,0]=2 719 B11R1.83 CSc1ccc(cc1)CC=O 62a_200000210301_100011361690 [1,0,0,0,0,0|0,1,0]=2 720 B11R1.83 CSc1ccc(cc1)CCN 62a_100000755846_200000210301 [1,0,0,0,0,0|1,1,1]=4 721 B11R1.83 CSc1ccc(cc1)CCN 62a_200000210301_100000755846 [1,0,0,0,0,0|1,1,1]=4 722 B11R1.83 CSc1ccc(cc1)CCO 62a_100000766406_200000210301 [1,0,0,0,0,0|0,1,2]=4 723 B11R1.83 CSc1ccc(cc1)CCO 62a_200000210301_100000766406 [1,0,0,0,0,0|0,1,2]=4 724 B11R1.83 CSc1ccc(cc1)CNN 62a_100016993955_200000210301 [1,0,0,0,0,0|2,1,0]=4 725 B11R1.83 CSc1ccc(cc1)CNN 62a_200000210301_100016993955 [1,0,0,0,0,0|2,1,0]=4 726 B11R1.83 CSc1ccc(cc1)CN[13CH3] 2230a_100000174980_200025704644 [1,0,0,0,0,0|1,1,0]=3 727 B11R1.83 CSc1ccc(cc1)CN[13CH3] 34a_100000174980_200025704644 [1,0,0,0,0,0|1,1,0]=3 728 B11R1.83 CSc1ccc(cc1)CO[13CH3] 34a_100011215404_200025704644 [1,0,0,0,0,0|1,1,0]=3 729 B11R1.83 CSc1ccc(cc1)CO[13CH3] 7a_100011215404_200025704644 [1,0,0,0,0,0|1,1,0]=3 730 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_100000181263_200025704644 [1,0,0,0,0,0|1,1,0]=3 731 B11R1.83 CSc1ccc(cc1)CS[13CH3] 62a_200025704644_100000181263 [1,0,0,0,0,0|1,1,0]=3 732 B11R1.83 [13CH3]NCc1ccc(cc1)C#N 34a_100015207190_200025704644 [1,0,0,0,0,0|3,0,0]=4 733 B11R1.83 [13CH3]NCc1ccc(cc1)CO 2230a_100015189231_200025704644 [1,0,0,0,0,0|3,0,0]=4 734 B11R1.83 [13CH3]NCc1ccc(cc1)CO 34a_100015189231_200025704644 [1,0,0,0,0,0|3,0,0]=4 735 B11R1.83 [13CH3]Nc1ccc(cc1)CC#N 34a_100000198999_200025704644 [1,0,0,0,0,0|2,0,1]=4 736 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 2230a_100011204434_200025704644 [1,0,0,0,0,0|1,0,2]=4 737 B11R1.83 [13CH3]Nc1ccc(cc1)CCO 34a_100011204434_200025704644 [1,0,0,0,0,0|1,0,2]=4 738 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 34a_100000238739_200025704644 [1,0,0,0,0,0|3,0,0]=4 739 B11R1.83 [13CH3]OCc1ccc(cc1)C#N 7a_100000238739_200025704644 [1,0,0,0,0,0|3,0,0]=4 740 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 34a_100012353999_200025704644 [1,0,0,0,0,0|3,0,0]=4 741 B11R1.83 [13CH3]OCc1ccc(cc1)CBr 7a_100012353999_200025704644 [1,0,0,0,0,0|3,0,0]=4 742 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 34a_100000067286_200025704644 [1,0,0,0,0,0|3,0,0]=4 743 B11R1.83 [13CH3]OCc1ccc(cc1)CCl 7a_100000067286_200025704644 [1,0,0,0,0,0|3,0,0]=4 744 B11R1.83 [13CH3]OCc1ccc(cc1)CN 34a_100015189231_200025704644 [1,0,0,0,0,0|3,0,0]=4 745 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 34a_100000198970_200025704644 [1,0,0,0,0,0|1,0,1]=3 746 B11R1.83 [13CH3]Oc1ccc(cc1)CC#N 7a_100000198970_200025704644 [1,0,0,0,0,0|1,0,1]=3 747 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 34a_100009816426_200025704644 [1,0,0,0,0,0|1,0,1]=3 748 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 7a_100009816426_200025704644 [1,0,0,0,0,0|1,0,1]=3 749 B11R1.83 [13CH3]Oc1ccc(cc1)CCN 34a_100000743037_200025704644 [1,0,0,0,0,0|1,0,1]=3 750 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 34a_100011215338_200025704644 [1,0,0,0,0,0|0,0,2]=3 751 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 7a_100011215338_200025704644 [1,0,0,0,0,0|0,0,2]=3 752 B11R1.83 [13CH3]SCc1ccc(cc1)C#N 62a_200025704644_100000184898 [1,0,0,0,0,0|3,0,0]=4 753 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_100009816848_200025704644 [1,0,0,0,0,0|3,0,0]=4 754 B11R1.83 [13CH3]SCc1ccc(cc1)C=O 62a_200025704644_100009816848 [1,0,0,0,0,0|3,0,0]=4 755 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_100000067286_200025704644 [1,0,0,0,0,0|3,0,0]=4 756 B11R1.83 [13CH3]SCc1ccc(cc1)CO 62a_200025704644_100000067286 [1,0,0,0,0,0|3,0,0]=4 757 B11R1.83 [13CH3]Sc1ccc(cc1)/C=C/Br 62a_200016255901_200025704644 [1,0,0,0,0,0|1,1,1]=4 758 B11R1.83 [13CH3]Sc1ccc(cc1)/C=C/Br 62a_200025704644_200016255901 [1,0,0,0,0,0|1,1,1]=4 759 B11R1.83 [13CH3]Sc1ccc(cc1)CC#N 62a_100011217881_200025704644 [1,0,0,0,0,0|1,1,1]=4 760 B11R1.83 [13CH3]Sc1ccc(cc1)CC#N 62a_200025704644_100011217881 [1,0,0,0,0,0|1,1,1]=4 761 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_100011361690_200025704644 [1,0,0,0,0,0|0,1,0]=2 762 B11R1.83 [13CH3]Sc1ccc(cc1)CC=O 62a_200025704644_100011361690 [1,0,0,0,0,0|0,1,0]=2 763 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_100000755846_200025704644 [1,0,0,0,0,0|1,1,1]=4 764 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_200025704644_100000755846 [1,0,0,0,0,0|1,1,1]=4 765 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_100000766406_200025704644 [1,0,0,0,0,0|0,1,2]=4 766 B11R1.83 [13CH3]Sc1ccc(cc1)CCO 62a_200025704644_100000766406 [1,0,0,0,0,0|0,1,2]=4 767 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_100016993955_200025704644 [1,0,0,0,0,0|2,1,0]=4 768 B11R1.83 [13CH3]Sc1ccc(cc1)CNN 62a_200025704644_100016993955 [1,0,0,0,0,0|2,1,0]=4 769 B13R1.4 C=Cc1ccc(cc1)CS(=O)(=O)C 271570a_100011290941_100009814647 [0,1,0,0,0,0|2,0,1]=4 770 B13R1.4 CC(C)(C)Oc1ccc(cc1)O[13CH3] 34a_100000061920_200025704644 [0,1,0,0,0,0|2,0,1]=4 771 B13R1.4 CC(C)(C)Oc1ccc(cc1)O[13CH3] 7a_100000061920_200025704644 [0,1,0,0,0,0|2,0,1]=4 772 B13R1.4 CC(F)(F)Cc1ccc(cc1)S[13CH3] 62a_100010238340_200025704644 [0,1,0,0,0,0|1,1,1]=4 773 B13R1.4 CC(F)(F)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100010238340 [0,1,0,0,0,0|1,1,1]=4 774 B13R1.4 CCc1ccc(cc1)NS(=O)(=O)C 40a_100000211069_100000738038 [0,1,0,0,0,0|3,0,0]=4 775 B13R1.4 CNc1ccc(cc1)CS(=O)(=O)C 2230a_100000747337_200000210301 [0,1,0,0,0,0|2,0,0]=3 776 B13R1.4 CNc1ccc(cc1)CS(=O)(=O)C 34a_100000747337_200000210301 [0,1,0,0,0,0|2,0,0]=3 777 B13R1.4 CNc1ccc(cc1)CS(=O)(=O)N 2230a_100000735681_200000210301 [0,1,0,0,0,0|3,0,0]=4 778 B13R1.4 CNc1ccc(cc1)CS(=O)(=O)N 34a_100000735681_200000210301 [0,1,0,0,0,0|3,0,0]=4 779 B13R1.4 CNc1ccc(cc1)NS(=O)(=O)C 34a_100011191326_200000210301 [0,1,0,0,0,0|3,0,0]=4 780 B13R1.4 COc1ccc(cc1)NC(C)(C)C 34a_100000184247_100000210625 [0,1,0,0,0,0|2,0,1]=4 781 B13R1.4 COc1ccc(cc1)NS(=O)(=O)C 34a_100000165719_200000210301 [0,1,0,0,0,0|2,0,0]=3 782 B13R1.4 COc1ccc(cc1)NS(=O)(=O)C 40a_100000184247_100000738038 [0,1,0,0,0,0|2,0,0]=3 783 B13R1.4 COc1ccc(cc1)OC(C)(C)C 34a_100000061920_200000210301 [0,1,0,0,0,0|2,0,1]=4 784 B13R1.4 COc1ccc(cc1)OC(C)(C)C 34a_100000210503_100000210625 [0,1,0,0,0,0|2,0,1]=4 785 B13R1.4 COc1ccc(cc1)OC(C)(C)C 7a_100000061920_200000210301 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.4 COc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000171711 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.4 CS(=O)(=O)Cc1ccc(cc1)N[13CH3] 2230a_100000747337_200025704644 [0,1,0,0,0,0|2,0,0]=3 788 B13R1.4 CS(=O)(=O)Cc1ccc(cc1)N[13CH3] 34a_100000747337_200025704644 [0,1,0,0,0,0|2,0,0]=3 789 B13R1.4 CS(=O)(=O)Cc1ccc(cc1)S[13CH3] 62a_100009814647_200025704644 [0,1,0,0,0,0|1,1,0]=3 790 B13R1.4 CS(=O)(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100009814647 [0,1,0,0,0,0|1,1,0]=3 791 B13R1.4 CS(=O)(=O)Cc1ccc(nc1)S[13CH3] 62a_200000061366_200025704644 [0,1,0,0,0,0|2,1,0]=4 792 B13R1.4 CS(=O)(=O)Cc1ccc(nc1)S[13CH3] 62a_200025704644_200000061366 [0,1,0,0,0,0|2,1,0]=4 793 B13R1.4 CS(=O)(=O)Nc1ccc(cc1)N[13CH3] 34a_100011191326_200025704644 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.4 CS(=O)(=O)Nc1ccc(cc1)O[13CH3] 34a_100000165719_200025704644 [0,1,0,0,0,0|2,0,0]=3 795 B13R1.4 CS(=O)(=O)Nc1ccc(cc1)S[13CH3] 62a_200000165602_200025704644 [0,1,0,0,0,0|2,1,0]=4 796 B13R1.4 CS(=O)(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_200000165602 [0,1,0,0,0,0|2,1,0]=4 797 B13R1.4 CSc1ccc(cc1)CC(C)(F)F 62a_100010238340_200000210301 [0,1,0,0,0,0|1,1,1]=4 798 B13R1.4 CSc1ccc(cc1)CC(C)(F)F 62a_200000210301_100010238340 [0,1,0,0,0,0|1,1,1]=4 799 B13R1.4 CSc1ccc(cc1)CS(=O)(=O)C 62a_100009814647_200000210301 [0,1,0,0,0,0|1,1,0]=3 800 B13R1.4 CSc1ccc(cc1)CS(=O)(=O)C 62a_200000210301_100009814647 [0,1,0,0,0,0|1,1,0]=3 801 B13R1.4 CSc1ccc(cc1)CS(=O)(=O)N 62a_100000764258_200000210301 [0,1,0,0,0,0|2,1,0]=4 802 B13R1.4 CSc1ccc(cc1)C[Si](C)(C)C 62a_100009813299_200000210301 [0,1,0,0,0,0|1,2,0]=4 803 B13R1.4 CSc1ccc(cc1)C[Si](C)(C)C 62a_200000210301_100009813299 [0,1,0,0,0,0|1,2,0]=4 804 B13R1.4 CSc1ccc(cc1)NS(=O)(=O)C 40a_100000212337_100000738038 [0,1,0,0,0,0|2,1,0]=4 805 B13R1.4 CSc1ccc(cc1)NS(=O)(=O)C 62a_200000165602_200000210301 [0,1,0,0,0,0|2,1,0]=4 806 B13R1.4 CSc1ccc(cc1)NS(=O)(=O)C 62a_200000210301_200000165602 [0,1,0,0,0,0|2,1,0]=4 807 B13R1.4 CSc1ccc(cn1)CS(=O)(=O)C 62a_200000061366_200000210301 [0,1,0,0,0,0|2,1,0]=4 808 B13R1.4 CSc1ccc(cn1)CS(=O)(=O)C 62a_200000210301_200000061366 [0,1,0,0,0,0|2,1,0]=4 809 B13R1.4 C[Si](C)(C)Cc1ccc(cc1)S[13CH3] 62a_100009813299_200025704644 [0,1,0,0,0,0|1,2,0]=4 810 B13R1.4 C[Si](C)(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100009813299 [0,1,0,0,0,0|1,2,0]=4 811 B13R1.4 [13CH3]Nc1ccc(cc1)CS(=O)(=O)N 2230a_100000735681_200025704644 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.4 [13CH3]Nc1ccc(cc1)CS(=O)(=O)N 34a_100000735681_200025704644 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.4 [13CH3]Sc1ccc(cc1)CS(=O)(=O)N 62a_100000764258_200025704644 [0,1,0,0,0,0|2,1,0]=4 814 B13R1.5 C#CC(=O)Cc1ccc(cc1)C#C 1458a_100000211873_100000140223 [0,1,0,0,0,0|1,0,2]=4 815 B13R1.5 C#CC(=O)Cc1ccc(cc1)C#N 1458a_100000211873_100000184898 [0,1,0,0,0,0|2,0,1]=4 816 B13R1.5 C#CC(=O)Cc1ccc(cc1)C=C 1458a_100000211873_100000034074 [0,1,0,0,0,0|1,0,2]=4 817 B13R1.5 C#CC(=O)Cc1ccc(cc1)C=O 1458a_100000211873_100000075337 [0,1,0,0,0,0|2,0,1]=4 818 B13R1.5 C#CC(=O)Cc1ccc(cc1)CC 1458a_100000211873_100000747183 [0,1,0,0,0,0|1,0,1]=3 819 B13R1.5 C#CC(=O)Cc1ccc(cc1)CO 1458a_100000211873_100000067286 [0,1,0,0,0,0|2,0,1]=4 820 B13R1.5 C#CC(=O)Cc1ccc(cc1)SC 1458a_100000211873_100000181263 [0,1,0,0,0,0|0,1,1]=3 821 B13R1.5 C#CC(=O)Cc1ccc(cn1)OC 1458a_100000211873_200000757186 [0,1,0,0,0,0|1,0,1]=3 822 B13R1.5 C#CC(=O)Cc1ccc(nc1)OC 1458a_100000211873_100020631284 [0,1,0,0,0,0|1,0,1]=3 823 B13R1.5 C#CC(C)Nc1ccc(cc1)OC 34a_100000184247_200000035995 [0,1,0,0,0,0|2,0,1]=4 824 B13R1.5 C#CC(C)Oc1ccc(cc1)OC 34a_100000210503_200000035995 [0,1,0,0,0,0|2,0,1]=4 825 B13R1.5 C#CC(C)Sc1ccc(cc1)OC 62a_200000035995_100000171711 [0,1,0,0,0,0|2,0,1]=4 826 B13R1.5 C#Cc1ccc(cc1)CC(=O)C=C 1458a_100000185746_100000140223 [0,1,0,0,0,0|1,0,2]=4 827 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000140223 [0,1,0,0,0,0|1,0,1]=3 828 B13R1.5 C#Cc1ccc(cc1)CC(=O)CC 1458a_200009884166_100000210202 [0,1,0,0,0,0|1,0,1]=3 829 B13R1.5 C#Cc1ccc(cc1)CC(=O)CF 1458a_200009884166_100015361967 [0,1,0,0,0,0|1,0,1]=3 830 B13R1.5 C#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000140223 [0,1,0,0,0,0|1,0,1]=3 831 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 11a_106832991635_200009884166 [0,1,0,0,0,0|1,0,1]=3 832 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 1626a_100102657272_200009884166 [0,1,0,0,0,0|1,0,1]=3 833 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 240690a_100102657272_200009884166 [0,1,0,0,0,0|1,0,1]=3 834 B13R1.5 C#Cc1ccc(cc1)CC(=O)NC 527a_100102657272_200009884166 [0,1,0,0,0,0|1,0,1]=3 835 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 11a_100011215031_100000210414 [0,1,0,0,0,0|2,0,1]=4 836 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 1626a_100011215031_100000210414 [0,1,0,0,0,0|2,0,1]=4 837 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 22a_100011215031_100000210414 [0,1,0,0,0,0|2,0,1]=4 838 B13R1.5 C#Cc1ccc(cc1)NC(=O)CC 527a_100011215031_100000210414 [0,1,0,0,0,0|2,0,1]=4 839 B13R1.5 C#Cc1ccc(cc1)NC(=O)CO 22a_100011215031_100000210174 [0,1,0,0,0,0|2,0,1]=4 840 B13R1.5 C#Cc1ccc(cc1)NC(=O)CO 527a_100011215031_100000210174 [0,1,0,0,0,0|2,0,1]=4 841 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 2430a_100011215031_100102657272 [0,1,0,0,0,0|2,0,1]=4 842 B13R1.5 C#Cc1ccc(cc1)NC(=O)NC 512a_100011215031_100102657272 [0,1,0,0,0,0|2,0,1]=4 843 B13R1.5 C=CC(=O)Cc1ccc(cc1)C#N 1458a_100000185746_100000184898 [0,1,0,0,0,0|2,0,1]=4 844 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=C 1458a_100000185746_100000034074 [0,1,0,0,0,0|1,0,2]=4 845 B13R1.5 C=CC(=O)Cc1ccc(cc1)C=O 1458a_100000185746_100000075337 [0,1,0,0,0,0|2,0,1]=4 846 B13R1.5 C=CC(=O)Cc1ccc(cc1)CC 1458a_100000185746_100000747183 [0,1,0,0,0,0|1,0,1]=3 847 B13R1.5 C=CC(=O)Cc1ccc(cc1)CO 1458a_100000185746_100000067286 [0,1,0,0,0,0|2,0,1]=4 848 B13R1.5 C=CC(=O)Cc1ccc(cc1)SC 1458a_100000185746_100000181263 [0,1,0,0,0,0|0,1,1]=3 849 B13R1.5 C=CC(=O)Cc1ccc(cn1)OC 1458a_100000185746_200000757186 [0,1,0,0,0,0|1,0,1]=3 850 B13R1.5 C=CC(=O)Cc1ccc(nc1)OC 1458a_100000185746_100020631284 [0,1,0,0,0,0|1,0,1]=3 851 B13R1.5 C=CC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000185746 [0,1,0,0,0,0|2,0,1]=4 852 B13R1.5 C=CC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000185746 [0,1,0,0,0,0|2,0,1]=4 853 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000185746 [0,1,0,0,0,0|1,0,1]=3 854 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000185746 [0,1,0,0,0,0|1,0,1]=3 855 B13R1.5 C=CC(=O)Nc1ccc(cc1)OC 34a_100011235904_200000210301 [0,1,0,0,0,0|1,0,1]=3 856 B13R1.5 C=CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235904_200025704644 [0,1,0,0,0,0|1,0,1]=3 857 B13R1.5 C=CC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000185746 [0,1,0,0,0,0|1,1,1]=4 858 B13R1.5 C=CC(C)Sc1ccc(cc1)OC 62a_100011215867_100000171711 [0,1,0,0,0,0|2,0,1]=4 859 B13R1.5 C=Cc1ccc(cc1)CC(=O)CC 1458a_100000210414_100000034074 [0,1,0,0,0,0|1,0,1]=3 860 B13R1.5 C=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000034074 [0,1,0,0,0,0|1,0,1]=3 861 B13R1.5 C=Cc1ccc(cc1)CC(=O)NC 271570a_100011290941_100000155101 [0,1,0,0,0,0|1,0,1]=3 862 B13R1.5 C=Cc1ccc(cc1)CC(=O)OC 271570a_100011290941_100000149743 [0,1,0,0,0,0|1,0,1]=3 863 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 11a_100011218248_100000210414 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 1626a_100011218248_100000210414 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 22a_100011218248_100000210414 [0,1,0,0,0,0|2,0,1]=4 866 B13R1.5 C=Cc1ccc(cc1)NC(=O)CC 527a_100011218248_100000210414 [0,1,0,0,0,0|2,0,1]=4 867 B13R1.5 C=Cc1ccc(cc1)NC(=O)CO 22a_100011218248_100000210174 [0,1,0,0,0,0|2,0,1]=4 868 B13R1.5 C=Cc1ccc(cc1)NC(=O)CO 527a_100011218248_100000210174 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.5 C=Cc1ccc(cc1)NC(=O)NC 2430a_100011218248_100102657272 [0,1,0,0,0,0|2,0,1]=4 870 B13R1.5 C=Cc1ccc(cc1)NC(=O)OC 271570a_100011290941_100000181880 [0,1,0,0,0,0|2,0,1]=4 871 B13R1.5 C=Cc1ccc(cc1)OC(=O)CC 271570a_100011290941_200009811598 [0,1,0,0,0,0|2,0,1]=4 872 B13R1.5 C=Cc1ccc(cn1)CC(=O)OC 271570a_100011290941_100000071674 [0,1,0,0,0,0|2,0,1]=4 873 B13R1.5 C=Cc1ccc(nc1)CC(=O)OC 271570a_100011290941_100012362609 [0,1,0,0,0,0|2,0,1]=4 874 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000210414_100000184898 [0,1,0,0,0,0|2,0,0]=3 875 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210202 [0,1,0,0,0,0|2,0,0]=3 876 B13R1.5 CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210414_100000075337 [0,1,0,0,0,0|2,0,0]=3 877 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_100000210414_100000747183 [0,1,0,0,0,0|1,0,0]=2 878 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210202 [0,1,0,0,0,0|1,0,0]=2 879 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100000210414_100000067286 [0,1,0,0,0,0|2,0,0]=3 880 B13R1.5 CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210202 [0,1,0,0,0,0|2,0,0]=3 881 B13R1.5 CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210202 [0,1,0,0,0,0|0,0,0]=1 882 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000210414_100000181263 [0,1,0,0,0,0|0,1,0]=2 883 B13R1.5 CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210202 [0,1,0,0,0,0|0,1,0]=2 884 B13R1.5 CCC(=O)Cc1ccc(cn1)C#N 1458a_100000210414_100000693164 [0,1,0,0,0,0|3,0,0]=4 885 B13R1.5 CCC(=O)Cc1ccc(cn1)OC 1458a_100000210414_200000757186 [0,1,0,0,0,0|1,0,0]=2 886 B13R1.5 CCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000210202 [0,1,0,0,0,0|1,0,0]=2 887 B13R1.5 CCC(=O)Cc1ccc(nc1)C#N 1458a_100000210414_100009816919 [0,1,0,0,0,0|3,0,0]=4 888 B13R1.5 CCC(=O)Cc1ccc(nc1)OC 1458a_100000210414_100020631284 [0,1,0,0,0,0|1,0,0]=2 889 B13R1.5 CCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000210202 [0,1,0,0,0,0|1,0,0]=2 890 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100000210414 [0,1,0,0,0,0|3,0,0]=4 891 B13R1.5 CCC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100000210414 [0,1,0,0,0,0|3,0,0]=4 892 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210414 [0,1,0,0,0,0|2,0,0]=3 893 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210414 [0,1,0,0,0,0|2,0,0]=3 894 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210414 [0,1,0,0,0,0|2,0,0]=3 895 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000210414 [0,1,0,0,0,0|2,0,0]=3 896 B13R1.5 CCC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000210414 [0,1,0,0,0,0|3,0,0]=4 897 B13R1.5 CCC(=O)Nc1ccc(cc1)NC 34a_100000186511_200000210301 [0,1,0,0,0,0|2,0,0]=3 898 B13R1.5 CCC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000186511_200025704644 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210414 [0,1,0,0,0,0|1,0,0]=2 900 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210414 [0,1,0,0,0,0|1,0,0]=2 901 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210414 [0,1,0,0,0,0|1,0,0]=2 902 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 34a_200000243810_200000210301 [0,1,0,0,0,0|1,0,0]=2 903 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000210414 [0,1,0,0,0,0|1,0,0]=2 904 B13R1.5 CCC(=O)Nc1ccc(cc1)OC 7a_200000243810_200000210301 [0,1,0,0,0,0|1,0,0]=2 905 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 34a_200000243810_200025704644 [0,1,0,0,0,0|1,0,0]=2 906 B13R1.5 CCC(=O)Nc1ccc(cc1)O[13CH3] 7a_200000243810_200025704644 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210414 [0,1,0,0,0,0|1,1,0]=3 908 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210414 [0,1,0,0,0,0|1,1,0]=3 909 B13R1.5 CCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000210414 [0,1,0,0,0,0|1,1,0]=3 910 B13R1.5 CCC(=O)Oc1ccc(cc1)SC 62a_200000210301_200009811598 [0,1,0,0,0,0|1,1,0]=3 911 B13R1.5 CCC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009811598 [0,1,0,0,0,0|1,1,0]=3 912 B13R1.5 CCC(C)Nc1ccc(cc1)OC 34a_100000184247_100011215416 [0,1,0,0,0,0|2,0,1]=4 913 B13R1.5 CCC(C)Oc1ccc(cc1)OC 34a_100000210503_100011215416 [0,1,0,0,0,0|2,0,1]=4 914 B13R1.5 CCC(C)Sc1ccc(cc1)OC 62a_100000758301_100000171711 [0,1,0,0,0,0|2,0,1]=4 915 B13R1.5 CCN(C)Cc1ccc(cc1)OC 2230a_100000184145_100000210202 [0,1,0,0,0,0|2,0,0]=3 916 B13R1.5 CCN(C)Cc1ccc(cc1)OC 2230a_100000225621_100000742318 [0,1,0,0,0,0|2,0,0]=3 917 B13R1.5 CCN(C)Cc1ccc(cc1)OC 2230a_100000741509_200000210301 [0,1,0,0,0,0|2,0,0]=3 918 B13R1.5 CCN(C)Cc1ccc(cc1)OC 269982a_100000184145_100000204670 [0,1,0,0,0,0|2,0,0]=3 919 B13R1.5 CCN(C)Cc1ccc(cc1)OC 269982a_100000225621_100000742318 [0,1,0,0,0,0|2,0,0]=3 920 B13R1.5 CCN(C)Cc1ccc(cc1)OC 269982a_100000741509_200000210301 [0,1,0,0,0,0|2,0,0]=3 921 B13R1.5 CCN(C)Cc1ccc(cc1)OC 26a_100000225621_100000210503 [0,1,0,0,0,0|2,0,0]=3 922 B13R1.5 CCN(C)Cc1ccc(cc1)SC 2230a_100000225621_100000181263 [0,1,0,0,0,0|2,1,0]=4 923 B13R1.5 CCN(C)Cc1ccc(cc1)SC 2230a_100015183344_200000210301 [0,1,0,0,0,0|2,1,0]=4 924 B13R1.5 CCN(C)Cc1ccc(cc1)SC 2230a_102495365258_100000210202 [0,1,0,0,0,0|2,1,0]=4 925 B13R1.5 CCN(C)Cc1ccc(cc1)SC 269982a_100000225621_100011934452 [0,1,0,0,0,0|2,1,0]=4 926 B13R1.5 CCN(C)Cc1ccc(cc1)SC 269982a_100015183344_200000210301 [0,1,0,0,0,0|2,1,0]=4 927 B13R1.5 CCN(C)Cc1ccc(cc1)SC 269982a_102495365258_100000204670 [0,1,0,0,0,0|2,1,0]=4 928 B13R1.5 CCN(C)Cc1ccc(cc1)SC 26a_100000225621_100000211864 [0,1,0,0,0,0|2,1,0]=4 929 B13R1.5 CCN(C)Cc1ccc(cn1)OC 2230a_100000225621_200000757186 [0,1,0,0,0,0|3,0,0]=4 930 B13R1.5 CCN(C)Cc1ccc(cn1)OC 269982a_100000225621_200000757186 [0,1,0,0,0,0|3,0,0]=4 931 B13R1.5 CCN(C)Cc1ccc(nc1)OC 2230a_100000225621_100020631284 [0,1,0,0,0,0|3,0,0]=4 932 B13R1.5 CCN(C)Cc1ccc(nc1)OC 269982a_100000225621_100020631284 [0,1,0,0,0,0|3,0,0]=4 933 B13R1.5 CCN([13CH3])Cc1ccc(cc1)OC 2230a_100000741509_200025704644 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.5 CCN([13CH3])Cc1ccc(cc1)OC 269982a_100000741509_200025704644 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.5 CCN([13CH3])Cc1ccc(cc1)SC 2230a_100015183344_200025704644 [0,1,0,0,0,0|2,1,0]=4 936 B13R1.5 CCN([13CH3])Cc1ccc(cc1)SC 269982a_100015183344_200025704644 [0,1,0,0,0,0|2,1,0]=4 937 B13R1.5 CCc1ccc(cc1)CC(=O)CF 1458a_200000759805_100015361967 [0,1,0,0,0,0|1,0,0]=2 938 B13R1.5 CCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000747183 [0,1,0,0,0,0|1,0,0]=2 939 B13R1.5 CCc1ccc(cc1)CC(=O)NC 11a_106832991635_200000759805 [0,1,0,0,0,0|1,0,0]=2 940 B13R1.5 CCc1ccc(cc1)CC(=O)NC 1626a_100102657272_200000759805 [0,1,0,0,0,0|1,0,0]=2 941 B13R1.5 CCc1ccc(cc1)CC(=O)NC 240690a_100102657272_200000759805 [0,1,0,0,0,0|1,0,0]=2 942 B13R1.5 CCc1ccc(cc1)CC(=O)NC 527a_100102657272_200000759805 [0,1,0,0,0,0|1,0,0]=2 943 B13R1.5 CCc1ccc(cc1)CN(C)CC 2230a_100000225621_100000747183 [0,1,0,0,0,0|3,0,0]=4 944 B13R1.5 CCc1ccc(cc1)CN(C)CC 2230a_100000683253_100000210202 [0,1,0,0,0,0|3,0,0]=4 945 B13R1.5 CCc1ccc(cc1)CN(C)CC 2230a_100015187470_200000210301 [0,1,0,0,0,0|3,0,0]=4 946 B13R1.5 CCc1ccc(cc1)CN(C)CC 269982a_100000225621_100000747183 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.5 CCc1ccc(cc1)CN(C)CC 269982a_100000683253_100000204670 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.5 CCc1ccc(cc1)CN(C)CC 269982a_100015187470_200000210301 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.5 CCc1ccc(cc1)CN(C)CC 26a_100000225621_100000211359 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.5 CCc1ccc(cc1)CN(C)CF 269982a_100000683253_100015361967 [0,1,0,0,0,0|3,0,0]=4 951 B13R1.5 CCc1ccc(cc1)CN([13CH3])CC 2230a_100015187470_200025704644 [0,1,0,0,0,0|3,0,0]=4 952 B13R1.5 CCc1ccc(cc1)CN([13CH3])CC 269982a_100015187470_200025704644 [0,1,0,0,0,0|3,0,0]=4 953 B13R1.5 CCc1ccc(cc1)NC(=O)CO 22a_100000211069_100000210174 [0,1,0,0,0,0|2,0,0]=3 954 B13R1.5 CCc1ccc(cc1)NC(=O)CO 527a_100000211069_100000210174 [0,1,0,0,0,0|2,0,0]=3 955 B13R1.5 CCc1ccc(cc1)NC(=O)NC 2430a_100000211069_100102657272 [0,1,0,0,0,0|2,0,0]=3 956 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 11a_106832991635_100000748677 [0,1,0,0,0,0|2,0,0]=3 957 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 1626a_100102657272_100000748677 [0,1,0,0,0,0|2,0,0]=3 958 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 240690a_100102657272_100000748677 [0,1,0,0,0,0|2,0,0]=3 959 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N 527a_100102657272_100000748677 [0,1,0,0,0,0|2,0,0]=3 960 B13R1.5 CNC(=O)Cc1ccc(cc1)CO 240690a_100102657272_100011356463 [0,1,0,0,0,0|2,0,0]=3 961 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 2230a_100000736799_200000210301 [0,1,0,0,0,0|1,0,0]=2 962 B13R1.5 CNC(=O)Cc1ccc(cc1)NC 34a_100000736799_200000210301 [0,1,0,0,0,0|1,0,0]=2 963 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 2230a_100000736799_200025704644 [0,1,0,0,0,0|1,0,0]=2 964 B13R1.5 CNC(=O)Cc1ccc(cc1)N[13CH3] 34a_100000736799_200025704644 [0,1,0,0,0,0|1,0,0]=2 965 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 11a_106832991635_100000210706 [0,1,0,0,0,0|0,0,0]=1 966 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 240690a_100102657272_100000210706 [0,1,0,0,0,0|0,0,0]=1 967 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 34a_200000020795_200000210301 [0,1,0,0,0,0|0,0,0]=1 968 B13R1.5 CNC(=O)Cc1ccc(cc1)OC 527a_100102657272_100000210706 [0,1,0,0,0,0|0,0,0]=1 969 B13R1.5 CNC(=O)Cc1ccc(cc1)O[13CH3] 34a_200000020795_200025704644 [0,1,0,0,0,0|0,0,0]=1 970 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 11a_106832991635_100000756958 [0,1,0,0,0,0|0,1,0]=2 971 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 1626a_100102657272_100000756958 [0,1,0,0,0,0|0,1,0]=2 972 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 240690a_100102657272_100000756958 [0,1,0,0,0,0|0,1,0]=2 973 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 527a_100102657272_100000756958 [0,1,0,0,0,0|0,1,0]=2 974 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_100000155101_200000210301 [0,1,0,0,0,0|0,1,0]=2 975 B13R1.5 CNC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000155101 [0,1,0,0,0,0|0,1,0]=2 976 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000155101_200025704644 [0,1,0,0,0,0|0,1,0]=2 977 B13R1.5 CNC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000155101 [0,1,0,0,0,0|0,1,0]=2 978 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 11a_106832991635_100000722272 [0,1,0,0,0,0|1,0,0]=2 979 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 240690a_100102657272_100000722272 [0,1,0,0,0,0|1,0,0]=2 980 B13R1.5 CNC(=O)Cc1ccc(cn1)OC 527a_100102657272_100000722272 [0,1,0,0,0,0|1,0,0]=2 981 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 11a_106832991635_100012001117 [0,1,0,0,0,0|1,0,0]=2 982 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 240690a_100102657272_100012001117 [0,1,0,0,0,0|1,0,0]=2 983 B13R1.5 CNC(=O)Cc1ccc(nc1)OC 527a_100102657272_100012001117 [0,1,0,0,0,0|1,0,0]=2 984 B13R1.5 CNC(=O)Nc1ccc(cc1)C#N 2430a_100000185469_100102657272 [0,1,0,0,0,0|3,0,0]=4 985 B13R1.5 CNC(=O)Nc1ccc(cc1)CO 2430a_100011215238_100102657272 [0,1,0,0,0,0|3,0,0]=4 986 B13R1.5 CNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100102657272 [0,1,0,0,0,0|1,0,0]=2 987 B13R1.5 CNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100102657272 [0,1,0,0,0,0|1,1,0]=3 988 B13R1.5 CNC(C)Cc1ccc(cc1)OC 270004a_106832991635_100000211147 [0,1,0,0,0,0|1,0,1]=3 989 B13R1.5 CNc1ccc(cc1)NC(=O)CO 34a_100011269904_200000210301 [0,1,0,0,0,0|2,0,0]=3 990 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [0,1,0,0,0,0|0,0,0]=1 991 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [0,1,0,0,0,0|0,0,0]=1 992 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [0,1,0,0,0,0|0,1,0]=2 993 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [0,1,0,0,0,0|0,1,0]=2 994 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [0,1,0,0,0,0|0,1,0]=2 995 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [0,1,0,0,0,0|0,1,0]=2 996 B13R1.5 COC(=O)Cc1ccc(cn1)SC 62a_100012362609_200000210301 [0,1,0,0,0,0|1,1,0]=3 997 B13R1.5 COC(=O)Cc1ccc(cn1)SC 62a_200000210301_100012362609 [0,1,0,0,0,0|1,1,0]=3 998 B13R1.5 COC(=O)Cc1ccc(cn1)S[13CH3] 62a_100012362609_200025704644 [0,1,0,0,0,0|1,1,0]=3 999 B13R1.5 COC(=O)Cc1ccc(cn1)S[13CH3] 62a_200025704644_100012362609 [0,1,0,0,0,0|1,1,0]=3 1000 B13R1.5 COC(=O)Cc1ccc(nc1)SC 62a_100000071674_200000210301 [0,1,0,0,0,0|1,1,0]=3 1001 B13R1.5 COC(=O)Cc1ccc(nc1)SC 62a_200000210301_100000071674 [0,1,0,0,0,0|1,1,0]=3 1002 B13R1.5 COC(=O)Cc1ccc(nc1)S[13CH3] 62a_100000071674_200025704644 [0,1,0,0,0,0|1,1,0]=3 1003 B13R1.5 COC(=O)Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000071674 [0,1,0,0,0,0|1,1,0]=3 1004 B13R1.5 COC(=O)Cc1ncc(cn1)SC 62a_100010080487_200000210301 [0,1,0,0,0,0|2,1,0]=4 1005 B13R1.5 COC(=O)Cc1ncc(cn1)SC 62a_200000210301_100010080487 [0,1,0,0,0,0|2,1,0]=4 1006 B13R1.5 COC(=O)Cc1ncc(cn1)S[13CH3] 62a_100010080487_200025704644 [0,1,0,0,0,0|2,1,0]=4 1007 B13R1.5 COC(=O)Cc1ncc(cn1)S[13CH3] 62a_200025704644_100010080487 [0,1,0,0,0,0|2,1,0]=4 1008 B13R1.5 COC(=O)Nc1ccc(cc1)OC 34a_100011235918_200000210301 [0,1,0,0,0,0|1,0,0]=2 1009 B13R1.5 COC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235918_200025704644 [0,1,0,0,0,0|1,0,0]=2 1010 B13R1.5 COC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000181880 [0,1,0,0,0,0|1,1,0]=3 1011 B13R1.5 COC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000181880 [0,1,0,0,0,0|1,1,0]=3 1012 B13R1.5 COC(=O)Nc1ccc(cn1)SC 62a_200000210301_100000188976 [0,1,0,0,0,0|2,1,0]=4 1013 B13R1.5 COC(=O)Nc1ccc(cn1)S[13CH3] 62a_200025704644_100000188976 [0,1,0,0,0,0|2,1,0]=4 1014 B13R1.5 COc1ccc(cc1)CC(=O)CF 1458a_100000210706_100015361967 [0,1,0,0,0,0|0,0,0]=1 1015 B13R1.5 COc1ccc(cc1)CC(=O)NN 34a_100000020777_200000210301 [0,1,0,0,0,0|1,0,0]=2 1016 B13R1.5 COc1ccc(cc1)CN(C)CF 269982a_100000184145_100015361967 [0,1,0,0,0,0|2,0,0]=3 1017 B13R1.5 COc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_200000210301 [0,1,0,0,0,0|1,0,1]=3 1018 B13R1.5 COc1ccc(cc1)NC(=O)CCl 34a_100000233757_200000210301 [0,1,0,0,0,0|1,0,0]=2 1019 B13R1.5 COc1ccc(cc1)NC(=O)CO 22a_100000184247_100000210174 [0,1,0,0,0,0|1,0,0]=2 1020 B13R1.5 COc1ccc(cc1)NC(=O)CO 527a_100000184247_100000210174 [0,1,0,0,0,0|1,0,0]=2 1021 B13R1.5 COc1ccc(cc1)NC(C)CO 34a_100000184247_100012180447 [0,1,0,0,0,0|1,0,2]=4 1022 B13R1.5 COc1ccc(cc1)OC(C)CO 34a_100000210503_100012180447 [0,1,0,0,0,0|1,0,2]=4 1023 B13R1.5 COc1ccc(cc1)SC(C)C#N 62a_100000703298_100000171711 [0,1,0,0,0,0|2,0,1]=4 1024 B13R1.5 COc1ccc(cc1)SC(C)CO 62a_100012180447_100000171711 [0,1,0,0,0,0|1,0,2]=4 1025 B13R1.5 COc1ccc(cc1)SC(C)OC 62a_100009879195_100000171711 [0,1,0,0,0,0|1,0,2]=4 1026 B13R1.5 COc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000171711 [0,1,0,0,0,0|1,0,2]=4 1027 B13R1.5 COc1ccc(cn1)CC(=O)CF 1458a_100012001117_100015361967 [0,1,0,0,0,0|1,0,0]=2 1028 B13R1.5 COc1ccc(cn1)CC(=O)CO 1458a_100000210174_100020631284 [0,1,0,0,0,0|1,0,0]=2 1029 B13R1.5 COc1ccc(nc1)CC(=O)CF 1458a_100000722272_100015361967 [0,1,0,0,0,0|1,0,0]=2 1030 B13R1.5 COc1ccc(nc1)CC(=O)CO 1458a_100000210174_200000757186 [0,1,0,0,0,0|1,0,0]=2 1031 B13R1.5 CSc1ccc(cc1)CC(=O)CF 1458a_100000756958_100015361967 [0,1,0,0,0,0|0,1,0]=2 1032 B13R1.5 CSc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181263 [0,1,0,0,0,0|0,1,0]=2 1033 B13R1.5 CSc1ccc(cc1)CN(C)CF 269982a_102495365258_100015361967 [0,1,0,0,0,0|2,1,0]=4 1034 B13R1.5 CSc1ccc(cc1)NC(=O)CN 62a_200000210301_100000741985 [0,1,0,0,0,0|1,1,0]=3 1035 B13R1.5 CSc1ccc(cc1)NC(=O)CO 22a_100000212337_100000210174 [0,1,0,0,0,0|1,1,0]=3 1036 B13R1.5 CSc1ccc(cc1)NC(=O)CO 527a_100000212337_100000210174 [0,1,0,0,0,0|1,1,0]=3 1037 B13R1.5 N#Cc1ccc(cc1)CC(=O)CF 1458a_100000748677_100015361967 [0,1,0,0,0,0|2,0,0]=3 1038 B13R1.5 N#Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000184898 [0,1,0,0,0,0|2,0,0]=3 1039 B13R1.5 N#Cc1ccc(cn1)CC(=O)CO 1458a_100000210174_100009816919 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.5 N#Cc1ccc(nc1)CC(=O)CO 1458a_100000210174_100000693164 [0,1,0,0,0,0|3,0,0]=4 1041 B13R1.5 O=C(CF)Cc1ccc(cc1)CO 1458a_100011356463_100015361967 [0,1,0,0,0,0|2,0,0]=3 1042 B13R1.5 O=C(CO)Cc1ccc(cc1)CO 1458a_100000210174_100000067286 [0,1,0,0,0,0|2,0,0]=3 1043 B13R1.5 O=C(CO)Nc1ccc(cc1)CO 22a_100011215238_100000210174 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.5 O=Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000075337 [0,1,0,0,0,0|2,0,0]=3 1045 B13R1.5 [13CH3]Nc1ccc(cc1)NC(=O)CO 34a_100011269904_200025704644 [0,1,0,0,0,0|2,0,0]=3 1046 B13R1.5 [13CH3]Oc1ccc(cc1)CC(=O)NN 34a_100000020777_200025704644 [0,1,0,0,0,0|1,0,0]=2 1047 B13R1.5 [13CH3]Oc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_200025704644 [0,1,0,0,0,0|1,0,1]=3 1048 B13R1.5 [13CH3]Oc1ccc(cc1)NC(=O)CCl 34a_100000233757_200025704644 [0,1,0,0,0,0|1,0,0]=2 1049 B13R1.5 [13CH3]Sc1ccc(cc1)NC(=O)CN 62a_200025704644_100000741985 [0,1,0,0,0,0|1,1,0]=3 1050 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 11a_100012001888_100015343762 [0,1,0,0,0,0|2,0,1]=4 1051 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 1626a_100012001888_100015343762 [0,1,0,0,0,0|2,0,1]=4 1052 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 22a_100012001888_100000070787 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 11a_100012001886_100015343762 [0,1,0,0,0,0|2,0,1]=4 1054 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 1626a_100012001886_100015343762 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 22a_100012001886_100000070787 [0,1,0,0,0,0|2,0,1]=4 1056 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 527a_100012001886_100103153847 [0,1,0,0,0,0|2,0,1]=4 1057 B13R1.35 C=Cc1ccc(cc1C)NC(=O)C 271570a_100011290941_100000155607 [0,1,0,0,0,0|2,0,1]=4 1058 B13R1.35 C=Cc1ccc(cc1F)NC(=O)C 271570a_100011290941_100011219590 [0,1,0,0,0,0|2,0,1]=4 1059 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)C#N 1458a_100000070787_100012355662 [0,1,0,0,0,0|2,0,0]=3 1060 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010141077_200025704644 [0,1,0,0,0,0|0,0,0]=1 1061 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010141077_200025704644 [0,1,0,0,0,0|0,0,0]=1 1062 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [0,1,0,0,0,0|0,0,0]=1 1063 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [0,1,0,0,0,0|0,0,0]=1 1064 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)C#N 1458a_100000070787_100010147163 [0,1,0,0,0,0|2,0,0]=3 1065 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_200000080078_200025704644 [0,1,0,0,0,0|0,0,0]=1 1066 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_200000080078_200025704644 [0,1,0,0,0,0|0,0,0]=1 1067 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100000070787_100011217145 [0,1,0,0,0,0|2,0,0]=3 1068 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200000210301 [0,1,0,0,0,0|2,0,0]=3 1069 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C=O 1458a_100000070787_100010142638 [0,1,0,0,0,0|2,0,0]=3 1070 B13R1.35 CC(=O)Nc1cc(c(cn1)S[13CH3])C 62a_200025704644_100011934553 [0,1,0,0,0,0|2,1,0]=4 1071 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C#N 11a_100000689153_100015343762 [0,1,0,0,0,0|3,0,0]=4 1072 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C#N 1626a_100000689153_100015343762 [0,1,0,0,0,0|3,0,0]=4 1073 B13R1.35 CC(=O)Nc1ccc(c(c1)C)C#N 11a_100011999795_100015343762 [0,1,0,0,0,0|3,0,0]=4 1074 B13R1.35 CC(=O)Nc1ccc(c(c1)C)C#N 1626a_100011999795_100015343762 [0,1,0,0,0,0|3,0,0]=4 1075 B13R1.35 CC(=O)Nc1ccc(c(c1)C)CO 22a_100000102464_100000070787 [0,1,0,0,0,0|3,0,0]=4 1076 B13R1.35 CC(=O)Nc1ccc(c(c1)C)O[13CH3] 34a_100012186693_200025704644 [0,1,0,0,0,0|1,0,0]=2 1077 B13R1.35 CC(=O)Nc1ccc(c(c1)C)O[13CH3] 7a_100012186693_200025704644 [0,1,0,0,0,0|1,0,0]=2 1078 B13R1.35 CC(=O)Nc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000155607 [0,1,0,0,0,0|1,1,0]=3 1079 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C#N 11a_100000211542_100015343762 [0,1,0,0,0,0|3,0,0]=4 1080 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C#N 1626a_100000211542_100015343762 [0,1,0,0,0,0|3,0,0]=4 1081 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)CO 22a_100000689119_100000070787 [0,1,0,0,0,0|3,0,0]=4 1082 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)O[13CH3] 34a_100011215158_200025704644 [0,1,0,0,0,0|1,0,0]=2 1083 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)O[13CH3] 7a_100011215158_200025704644 [0,1,0,0,0,0|1,0,0]=2 1084 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C#N 11a_100000765089_100015343762 [0,1,0,0,0,0|3,0,0]=4 1085 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C#N 1626a_100000765089_100015343762 [0,1,0,0,0,0|3,0,0]=4 1086 B13R1.35 CC(=O)Nc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011219590 [0,1,0,0,0,0|1,1,0]=3 1087 B13R1.35 CC(=O)Nc1ccc(c(n1)C)S[13CH3] 62a_100000187074_200025704644 [0,1,0,0,0,0|2,1,0]=4 1088 B13R1.35 CC(=O)Nc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100000187074 [0,1,0,0,0,0|2,1,0]=4 1089 B13R1.35 CC(=O)Nc1ccc(c(n1)F)S[13CH3] 62a_200025704644_100000050017 [0,1,0,0,0,0|2,1,0]=4 1090 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 11a_100000766362_100015343762 [0,1,0,0,0,0|2,0,0]=3 1091 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 1626a_100000766362_100015343762 [0,1,0,0,0,0|2,0,0]=3 1092 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 22a_100000766362_100000070787 [0,1,0,0,0,0|2,0,0]=3 1093 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 527a_100000766362_100103153847 [0,1,0,0,0,0|2,0,0]=3 1094 B13R1.35 CCc1ccc(cc1F)C=C(C)C 271570a_100102525489_200010071577 [0,1,0,0,0,0|2,0,1]=4 1095 B13R1.35 CCc1ccc(cc1N)C=C(C)C 271570a_100102525489_100012354963 [0,1,0,0,0,0|2,0,1]=4 1096 B13R1.35 CNc1ccc(cc1C)C=C(C)C 271570a_100102525489_100000221803 [0,1,0,0,0,0|2,0,1]=4 1097 B13R1.35 CNc1ccc(cc1F)C=C(C)C 271570a_100102525489_100000743884 [0,1,0,0,0,0|2,0,1]=4 1098 B13R1.35 CNc1ccc(cc1N)C=C(C)C 271570a_100102525489_100000741790 [0,1,0,0,0,0|2,0,1]=4 1099 B13R1.35 COc1ccc(cc1Br)C=C(C)C 271570a_100102525489_100011249507 [0,1,0,0,0,0|1,0,1]=3 1100 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100000070787_200011397701 [0,1,0,0,0,0|0,0,0]=1 1101 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100011202338_200000210301 [0,1,0,0,0,0|0,0,0]=1 1102 B13R1.35 COc1ccc(cc1Br)CC(=O)C 34a_100010141077_200000210301 [0,1,0,0,0,0|0,0,0]=1 1103 B13R1.35 COc1ccc(cc1Br)CC(=O)C 7a_100010141077_200000210301 [0,1,0,0,0,0|0,0,0]=1 1104 B13R1.35 COc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100011202338_200025704644 [0,1,0,0,0,0|0,0,0]=1 1105 B13R1.35 COc1ccc(cc1Br)CN(C)C 2230a_100102631434_200011397701 [0,1,0,0,0,0|2,0,0]=3 1106 B13R1.35 COc1ccc(cc1Br)CN(C)C 269982a_100102631434_200011397701 [0,1,0,0,0,0|2,0,0]=3 1107 B13R1.35 COc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000173361 [0,1,0,0,0,0|2,0,0]=3 1108 B13R1.35 COc1ccc(cc1Br)NC(=O)C 11a_100000187427_100015343762 [0,1,0,0,0,0|1,0,0]=2 1109 B13R1.35 COc1ccc(cc1Br)NC(=O)C 1626a_100000187427_100015343762 [0,1,0,0,0,0|1,0,0]=2 1110 B13R1.35 COc1ccc(cc1Br)NC(=O)C 22a_100000187427_100000070787 [0,1,0,0,0,0|1,0,0]=2 1111 B13R1.35 COc1ccc(cc1Br)NC(=O)C 527a_100000187427_100103153847 [0,1,0,0,0,0|1,0,0]=2 1112 B13R1.35 COc1ccc(cc1Br)NC(C)C 34a_100000187427_100000210206 [0,1,0,0,0,0|2,0,1]=4 1113 B13R1.35 COc1ccc(cc1Br)OC(C)C 34a_100010234764_100000210206 [0,1,0,0,0,0|2,0,1]=4 1114 B13R1.35 COc1ccc(cc1Br)OC(C)C 7a_100010234764_100000210206 [0,1,0,0,0,0|2,0,1]=4 1115 B13R1.35 COc1ccc(cc1Br)SC(C)C 62a_100000210206_100011249507 [0,1,0,0,0,0|2,0,1]=4 1116 B13R1.35 COc1ccc(cc1Br)SC(C)C 62a_100011249507_100000210206 [0,1,0,0,0,0|2,0,1]=4 1117 B13R1.35 COc1ccc(cc1C)C=C(C)C 271570a_100102525489_100011219705 [0,1,0,0,0,0|1,0,1]=3 1118 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [0,1,0,0,0,0|0,0,0]=1 1119 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [0,1,0,0,0,0|0,0,0]=1 1120 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [0,1,0,0,0,0|0,0,0]=1 1121 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [0,1,0,0,0,0|0,0,0]=1 1122 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [0,1,0,0,0,0|0,0,0]=1 1123 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100000241087_200000210301 [0,1,0,0,0,0|2,0,0]=3 1124 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100102631434_200011290836 [0,1,0,0,0,0|2,0,0]=3 1125 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100000241087_200000210301 [0,1,0,0,0,0|2,0,0]=3 1126 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100102631434_200011290836 [0,1,0,0,0,0|2,0,0]=3 1127 B13R1.35 COc1ccc(cc1C)CN(C)C 270004a_100102631434_100000239718 [0,1,0,0,0,0|2,0,0]=3 1128 B13R1.35 COc1ccc(cc1C)CN(C)C 34a_100000241087_200000210301 [0,1,0,0,0,0|2,0,0]=3 1129 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 2230a_100000241087_200025704644 [0,1,0,0,0,0|2,0,0]=3 1130 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 269982a_100000241087_200025704644 [0,1,0,0,0,0|2,0,0]=3 1131 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 34a_100000241087_200025704644 [0,1,0,0,0,0|2,0,0]=3 1132 B13R1.35 COc1ccc(cc1C)NC(=O)C 11a_100000743268_100015343762 [0,1,0,0,0,0|1,0,0]=2 1133 B13R1.35 COc1ccc(cc1C)NC(=O)C 1626a_100000743268_100015343762 [0,1,0,0,0,0|1,0,0]=2 1134 B13R1.35 COc1ccc(cc1C)NC(=O)C 22a_100000743268_100000070787 [0,1,0,0,0,0|1,0,0]=2 1135 B13R1.35 COc1ccc(cc1C)NC(=O)C 34a_100012186693_200000210301 [0,1,0,0,0,0|1,0,0]=2 1136 B13R1.35 COc1ccc(cc1C)NC(=O)C 527a_100000743268_100103153847 [0,1,0,0,0,0|1,0,0]=2 1137 B13R1.35 COc1ccc(cc1C)NC(=O)C 7a_100012186693_200000210301 [0,1,0,0,0,0|1,0,0]=2 1138 B13R1.35 COc1ccc(cc1C)NC(C)C 2230a_100000743268_100000210206 [0,1,0,0,0,0|2,0,1]=4 1139 B13R1.35 COc1ccc(cc1C)NC(C)C 34a_100000743268_100000210206 [0,1,0,0,0,0|2,0,1]=4 1140 B13R1.35 COc1ccc(cc1C)NC(C)C 7a_100000743268_100000210206 [0,1,0,0,0,0|2,0,1]=4 1141 B13R1.35 COc1ccc(cc1C)OC(C)C 34a_100000759738_100000210206 [0,1,0,0,0,0|2,0,1]=4 1142 B13R1.35 COc1ccc(cc1C)OC(C)C 7a_100000759738_100000210206 [0,1,0,0,0,0|2,0,1]=4 1143 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100000210206_100011219705 [0,1,0,0,0,0|2,0,1]=4 1144 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100011219705_100000210206 [0,1,0,0,0,0|2,0,1]=4 1145 B13R1.35 COc1ccc(cc1Cl)C=C(C)C 271570a_100102525489_100012355395 [0,1,0,0,0,0|1,0,1]=3 1146 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100000070787_100000693707 [0,1,0,0,0,0|0,0,0]=1 1147 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100012026953_200000210301 [0,1,0,0,0,0|0,0,0]=1 1148 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_200000210301 [0,1,0,0,0,0|0,0,0]=1 1149 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_200000210301 [0,1,0,0,0,0|0,0,0]=1 1150 B13R1.35 COc1ccc(cc1Cl)CC(=O)[13CH3] 1458a_100012026953_200025704644 [0,1,0,0,0,0|0,0,0]=1 1151 B13R1.35 COc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100000693707 [0,1,0,0,0,0|2,0,0]=3 1152 B13R1.35 COc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100000693707 [0,1,0,0,0,0|2,0,0]=3 1153 B13R1.35 COc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000186747 [0,1,0,0,0,0|2,0,0]=3 1154 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 11a_100000211044_100015343762 [0,1,0,0,0,0|1,0,0]=2 1155 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 1626a_100000211044_100015343762 [0,1,0,0,0,0|1,0,0]=2 1156 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 22a_100000211044_100000070787 [0,1,0,0,0,0|1,0,0]=2 1157 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 34a_100011215158_200000210301 [0,1,0,0,0,0|1,0,0]=2 1158 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 527a_100000211044_100103153847 [0,1,0,0,0,0|1,0,0]=2 1159 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_200000210301 [0,1,0,0,0,0|1,0,0]=2 1160 B13R1.35 COc1ccc(cc1Cl)NC(C)C 2230a_100000211044_100000210206 [0,1,0,0,0,0|2,0,1]=4 1161 B13R1.35 COc1ccc(cc1Cl)NC(C)C 34a_100000211044_100000210206 [0,1,0,0,0,0|2,0,1]=4 1162 B13R1.35 COc1ccc(cc1Cl)OC(C)C 34a_200009861682_100000210206 [0,1,0,0,0,0|2,0,1]=4 1163 B13R1.35 COc1ccc(cc1Cl)OC(C)C 7a_200009861682_100000210206 [0,1,0,0,0,0|2,0,1]=4 1164 B13R1.35 COc1ccc(cc1Cl)SC(C)C 62a_100000210206_100012355395 [0,1,0,0,0,0|2,0,1]=4 1165 B13R1.35 COc1ccc(cc1Cl)SC(C)C 62a_100012355395_100000210206 [0,1,0,0,0,0|2,0,1]=4 1166 B13R1.35 COc1ccc(cc1F)C=C(C)C 271570a_100102525489_100000185480 [0,1,0,0,0,0|1,0,1]=3 1167 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000070787_100000189595 [0,1,0,0,0,0|0,0,0]=1 1168 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000204603_200000210301 [0,1,0,0,0,0|0,0,0]=1 1169 B13R1.35 COc1ccc(cc1F)CC(=O)[13CH3] 1458a_100000204603_200025704644 [0,1,0,0,0,0|0,0,0]=1 1170 B13R1.35 COc1ccc(cc1F)CN(C)C 2230a_100102631434_100000189595 [0,1,0,0,0,0|2,0,0]=3 1171 B13R1.35 COc1ccc(cc1F)CN(C)C 269982a_100102631434_100000189595 [0,1,0,0,0,0|2,0,0]=3 1172 B13R1.35 COc1ccc(cc1F)CN(C)C 270004a_100102631434_100000204617 [0,1,0,0,0,0|2,0,0]=3 1173 B13R1.35 COc1ccc(cc1F)NC(=O)C 11a_100000740183_100015343762 [0,1,0,0,0,0|1,0,0]=2 1174 B13R1.35 COc1ccc(cc1F)NC(=O)C 1626a_100000740183_100015343762 [0,1,0,0,0,0|1,0,0]=2 1175 B13R1.35 COc1ccc(cc1F)NC(=O)C 22a_100000740183_100000070787 [0,1,0,0,0,0|1,0,0]=2 1176 B13R1.35 COc1ccc(cc1F)NC(=O)C 527a_100000740183_100103153847 [0,1,0,0,0,0|1,0,0]=2 1177 B13R1.35 COc1ccc(cc1F)NC(C)C 2230a_100000740183_100000210206 [0,1,0,0,0,0|2,0,1]=4 1178 B13R1.35 COc1ccc(cc1F)NC(C)C 34a_100000740183_100000210206 [0,1,0,0,0,0|2,0,1]=4 1179 B13R1.35 COc1ccc(cc1F)OC(C)C 34a_100000746305_100000210206 [0,1,0,0,0,0|2,0,1]=4 1180 B13R1.35 COc1ccc(cc1F)OC(C)C 7a_100000746305_100000210206 [0,1,0,0,0,0|2,0,1]=4 1181 B13R1.35 COc1ccc(cc1F)SC(C)C 62a_100000171752_100000210206 [0,1,0,0,0,0|2,0,1]=4 1182 B13R1.35 COc1ccc(cc1F)SC(C)C 62a_100000210206_100000171752 [0,1,0,0,0,0|2,0,1]=4 1183 B13R1.35 COc1ccc(cc1I)CN(C)C 270004a_100102631434_100009827998 [0,1,0,0,0,0|2,0,0]=3 1184 B13R1.35 COc1ccc(cc1I)NC(=O)C 11a_100011356947_100015343762 [0,1,0,0,0,0|1,0,0]=2 1185 B13R1.35 COc1ccc(cc1I)NC(=O)C 1626a_100011356947_100015343762 [0,1,0,0,0,0|1,0,0]=2 1186 B13R1.35 COc1ccc(cc1I)NC(=O)C 22a_100011356947_100000070787 [0,1,0,0,0,0|1,0,0]=2 1187 B13R1.35 COc1ccc(cc1I)NC(=O)C 527a_100011356947_100103153847 [0,1,0,0,0,0|1,0,0]=2 1188 B13R1.35 COc1ccc(cc1I)NC(C)C 34a_100011356947_100000210206 [0,1,0,0,0,0|2,0,1]=4 1189 B13R1.35 COc1ccc(cc1I)OC(C)C 34a_100010084122_100000210206 [0,1,0,0,0,0|2,0,1]=4 1190 B13R1.35 COc1ccc(cc1I)OC(C)C 7a_100010084122_100000210206 [0,1,0,0,0,0|2,0,1]=4 1191 B13R1.35 COc1ccc(cc1N)C=C(C)C 271570a_100102525489_100000743470 [0,1,0,0,0,0|1,0,1]=3 1192 B13R1.35 COc1ccc(cc1N)SC(C)C 62a_100000210206_100011249504 [0,1,0,0,0,0|2,0,1]=4 1193 B13R1.35 COc1ccc(cc1N)SC(C)C 62a_100011249504_100000210206 [0,1,0,0,0,0|2,0,1]=4 1194 B13R1.35 COc1ccc(cc1O)C=C(C)C 271570a_100102525489_100009816560 [0,1,0,0,0,0|1,0,1]=3 1195 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [0,1,0,0,0,0|0,0,0]=1 1196 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [0,1,0,0,0,0|0,0,0]=1 1197 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [0,1,0,0,0,0|0,0,0]=1 1198 B13R1.35 COc1ccc(cc1O)CN(C)C 2230a_100000188468_200000210301 [0,1,0,0,0,0|2,0,0]=3 1199 B13R1.35 COc1ccc(cc1O)CN(C)C 269982a_100000188468_200000210301 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 2230a_100000188468_200025704644 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 269982a_100000188468_200025704644 [0,1,0,0,0,0|2,0,0]=3 1202 B13R1.35 COc1ccc(cc1O)NC(=O)C 22a_100000211920_100000070787 [0,1,0,0,0,0|1,0,0]=2 1203 B13R1.35 COc1ccc(cc1O)NC(=O)C 527a_100000211920_100103153847 [0,1,0,0,0,0|1,0,0]=2 1204 B13R1.35 COc1ccc(cc1O)NC(C)C 34a_100000211920_100000210206 [0,1,0,0,0,0|2,0,1]=4 1205 B13R1.35 COc1ccc(cc1O)SC(C)C 62a_100000210206_100009816560 [0,1,0,0,0,0|2,0,1]=4 1206 B13R1.35 COc1ccc(nc1Br)C=C(C)C 271570a_100102525489_100010214827 [0,1,0,0,0,0|2,0,1]=4 1207 B13R1.35 COc1ccc(nc1Br)CN(C)C 270004a_100102631434_100010174741 [0,1,0,0,0,0|3,0,0]=4 1208 B13R1.35 COc1ccc(nc1C)C=C(C)C 271570a_100102525489_100010244750 [0,1,0,0,0,0|2,0,1]=4 1209 B13R1.35 COc1ccc(nc1Cl)C=C(C)C 271570a_100102525489_100010233546 [0,1,0,0,0,0|2,0,1]=4 1210 B13R1.35 COc1ccc(nc1F)C=C(C)C 271570a_100102525489_100010138636 [0,1,0,0,0,0|2,0,1]=4 1211 B13R1.35 COc1ccc(nc1N)C=C(C)C 271570a_100102525489_100010192976 [0,1,0,0,0,0|2,0,1]=4 1212 B13R1.35 COc1cnc(cc1Br)CN(C)C 270004a_100102631434_100010893078 [0,1,0,0,0,0|3,0,0]=4 1213 B13R1.35 COc1cnc(cc1N)C=C(C)C 271570a_100102525489_100010896307 [0,1,0,0,0,0|2,0,1]=4 1214 B13R1.35 COc1cnc(cc1O)C=C(C)C 271570a_100102525489_100010264082 [0,1,0,0,0,0|2,0,1]=4 1215 B13R1.35 COc1coc(cc1=O)CC(=O)C 1458a_100000070787_100000081511 [0,1,0,0,0,0|1,0,0]=2 1216 B13R1.35 COc1coc(cc1=O)CN(C)C 2230a_100102631434_100000081511 [0,1,0,0,0,0|3,0,0]=4 1217 B13R1.35 COc1coc(cc1=O)CN(C)C 269982a_100102631434_100000081511 [0,1,0,0,0,0|3,0,0]=4 1218 B13R1.35 COc1ncc(cc1Br)C=C(C)C 271570a_100102525489_200010988584 [0,1,0,0,0,0|2,0,1]=4 1219 B13R1.35 COc1ncc(cc1Br)CN(C)C 270004a_100102631434_200010064893 [0,1,0,0,0,0|3,0,0]=4 1220 B13R1.35 COc1ncc(cc1C)C=C(C)C 271570a_100102525489_100011290809 [0,1,0,0,0,0|2,0,1]=4 1221 B13R1.35 COc1ncc(cc1C)CN(C)C 270004a_100102631434_100012183433 [0,1,0,0,0,0|3,0,0]=4 1222 B13R1.35 COc1ncc(cc1Cl)CN(C)C 270004a_100102631434_100000081810 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.35 COc1ncc(cc1F)C=C(C)C 271570a_100102525489_100011880707 [0,1,0,0,0,0|2,0,1]=4 1224 B13R1.35 COc1ncc(cc1F)CN(C)C 270004a_100102631434_100000081167 [0,1,0,0,0,0|3,0,0]=4 1225 B13R1.35 COc1ncc(cc1N)C=C(C)C 271570a_100102525489_100000748608 [0,1,0,0,0,0|2,0,1]=4 1226 B13R1.35 COc1ncc(cc1O)C=C(C)C 271570a_100102525489_100010135713 [0,1,0,0,0,0|2,0,1]=4 1227 B13R1.35 CSc1ccc(cc1C)NC(=O)C 62a_200000210301_100000155607 [0,1,0,0,0,0|1,1,0]=3 1228 B13R1.35 CSc1ccc(cc1C)NC(=O)N 62a_200000210301_100000238934 [0,1,0,0,0,0|2,1,0]=4 1229 B13R1.35 CSc1ccc(cc1Cl)C=C(C)C 271570a_100102525489_206447510565 [0,1,0,0,0,0|1,1,1]=4 1230 B13R1.35 CSc1ccc(cc1F)C=C(C)C 271570a_100102525489_100010161220 [0,1,0,0,0,0|1,1,1]=4 1231 B13R1.35 CSc1ccc(cc1F)NC(=O)C 11a_100000762756_100015343762 [0,1,0,0,0,0|1,1,0]=3 1232 B13R1.35 CSc1ccc(cc1F)NC(=O)C 1626a_100000762756_100015343762 [0,1,0,0,0,0|1,1,0]=3 1233 B13R1.35 CSc1ccc(cc1F)NC(=O)C 22a_100000762756_100000070787 [0,1,0,0,0,0|1,1,0]=3 1234 B13R1.35 CSc1ccc(cc1F)NC(=O)C 527a_100000762756_100103153847 [0,1,0,0,0,0|1,1,0]=3 1235 B13R1.35 CSc1ccc(cc1F)NC(=O)C 62a_200000210301_100011219590 [0,1,0,0,0,0|1,1,0]=3 1236 B13R1.35 CSc1ccc(nc1C)NC(=O)C 62a_100000187074_200000210301 [0,1,0,0,0,0|2,1,0]=4 1237 B13R1.35 CSc1ccc(nc1C)NC(=O)C 62a_200000210301_100000187074 [0,1,0,0,0,0|2,1,0]=4 1238 B13R1.35 CSc1ccc(nc1F)NC(=O)C 62a_200000210301_100000050017 [0,1,0,0,0,0|2,1,0]=4 1239 B13R1.35 CSc1cnc(cc1C)NC(=O)C 62a_200000210301_100011934553 [0,1,0,0,0,0|2,1,0]=4 1240 B13R1.35 Cc1cc(ccc1S[13CH3])NC(=O)N 62a_200025704644_100000238934 [0,1,0,0,0,0|2,1,0]=4 1241 B13R1.35 [13CH3]C(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200025704644 [0,1,0,0,0,0|2,0,0]=3 1242 B13R1.36 C=Cc1ccc(cc1)N(C)C(=O)C 271570a_100011290941_200009816415 [0,1,0,0,0,0|2,0,1]=4 1243 B13R1.36 CC(=O)N(C)c1ccc(cc1)C#N 11a_100000739737_100015343762 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.36 CC(=O)N(C)c1ccc(cc1)C#N 1626a_100000739737_100015343762 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.36 CC(=O)N(C)c1ccc(cc1)N[13CH3] 34a_100000229935_200025704644 [0,1,0,0,0,0|2,0,0]=3 1246 B13R1.36 CC(=O)N(C)c1ccc(cc1)O[13CH3] 34a_100000743460_200025704644 [0,1,0,0,0,0|1,0,0]=2 1247 B13R1.36 CC(=O)N(C)c1ccc(cc1)S[13CH3] 62a_200009816415_200025704644 [0,1,0,0,0,0|1,1,0]=3 1248 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 34a_200010205864_200025704644 [0,1,0,0,0,0|1,0,2]=4 1249 B13R1.36 CC(Br)C(=O)c1ccc(cc1)O[13CH3] 7a_200010205864_200025704644 [0,1,0,0,0,0|1,0,2]=4 1250 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100011995950_200025704644 [0,1,0,0,0,0|1,0,2]=4 1251 B13R1.36 CC(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100011995950_200025704644 [0,1,0,0,0,0|1,0,2]=4 1252 B13R1.36 CC(C)[C@H](N)c1ccc(cc1)S[13CH3] 62a_100102422763_200025704644 [0,1,0,0,0,0|1,1,1]=4 1253 B13R1.36 CC(C)[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100102422763 [0,1,0,0,0,0|1,1,1]=4 1254 B13R1.36 CCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100011215824 [0,1,0,0,0,0|2,0,1]=4 1255 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 34a_100000192105_200025704644 [0,1,0,0,0,0|2,0,1]=4 1256 B13R1.36 CN(C)C(=O)c1ccc(cc1)O[13CH3] 7a_100000192105_200025704644 [0,1,0,0,0,0|2,0,1]=4 1257 B13R1.36 CNc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000219623 [0,1,0,0,0,0|2,0,1]=4 1258 B13R1.36 CNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_200000210301 [0,1,0,0,0,0|2,0,0]=3 1259 B13R1.36 COc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000171711 [0,1,0,0,0,0|1,0,1]=3 1260 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 34a_200010205864_200000210301 [0,1,0,0,0,0|1,0,2]=4 1261 B13R1.36 COc1ccc(cc1)C(=O)C(C)Br 7a_200010205864_200000210301 [0,1,0,0,0,0|1,0,2]=4 1262 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 1458a_100000184203_100000210206 [0,1,0,0,0,0|1,0,2]=4 1263 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 34a_100011995950_200000210301 [0,1,0,0,0,0|1,0,2]=4 1264 B13R1.36 COc1ccc(cc1)C(=O)C(C)C 7a_100011995950_200000210301 [0,1,0,0,0,0|1,0,2]=4 1265 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000184203 [0,1,0,0,0,0|2,0,1]=4 1266 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000184203 [0,1,0,0,0,0|2,0,1]=4 1267 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000184203 [0,1,0,0,0,0|2,0,1]=4 1268 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 34a_100000192105_200000210301 [0,1,0,0,0,0|2,0,1]=4 1269 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000184203 [0,1,0,0,0,0|2,0,1]=4 1270 B13R1.36 COc1ccc(cc1)C(=O)N(C)C 7a_100000192105_200000210301 [0,1,0,0,0,0|2,0,1]=4 1271 B13R1.36 COc1ccc(cc1)C(C)C(=O)C 1458a_100000753396_200000210301 [0,1,0,0,0,0|0,0,0]=1 1272 B13R1.36 COc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000753396_200025704644 [0,1,0,0,0,0|0,0,0]=1 1273 B13R1.36 COc1ccc(cc1)C(C)N(C)C 2230a_100000736477_200000210301 [0,1,0,0,0,0|2,0,0]=3 1274 B13R1.36 COc1ccc(cc1)C(C)N(C)C 269982a_100000736477_200000210301 [0,1,0,0,0,0|2,0,0]=3 1275 B13R1.36 COc1ccc(cc1)C(C)N(C)[13CH3] 2230a_100000736477_200025704644 [0,1,0,0,0,0|2,0,0]=3 1276 B13R1.36 COc1ccc(cc1)C(C)N(C)[13CH3] 269982a_100000736477_200025704644 [0,1,0,0,0,0|2,0,0]=3 1277 B13R1.36 COc1ccc(cc1)C(O)C(=O)C 1458a_100011218652_200000210301 [0,1,0,0,0,0|0,0,0]=1 1278 B13R1.36 COc1ccc(cc1)C(O)C(=O)[13CH3] 1458a_100011218652_200025704644 [0,1,0,0,0,0|0,0,0]=1 1279 B13R1.36 COc1ccc(cc1)N(C)C(=O)C 11a_100000220023_100015343762 [0,1,0,0,0,0|1,0,0]=2 1280 B13R1.36 COc1ccc(cc1)N(C)C(=O)C 1626a_100000220023_100015343762 [0,1,0,0,0,0|1,0,0]=2 1281 B13R1.36 COc1ccc(cc1)N(C)C(=O)C 22a_100000220023_100000070787 [0,1,0,0,0,0|1,0,0]=2 1282 B13R1.36 COc1ccc(cc1)N(C)C(=O)C 34a_100000743460_200000210301 [0,1,0,0,0,0|1,0,0]=2 1283 B13R1.36 COc1ccc(cc1)N(C)C(=O)C 527a_100000220023_100103153847 [0,1,0,0,0,0|1,0,0]=2 1284 B13R1.36 COc1ccc(cc1)N(C)C(C)C 2230a_100000220023_100000210206 [0,1,0,0,0,0|2,0,1]=4 1285 B13R1.36 COc1ccc(cc1)N(C)C(C)C 2230a_100000220024_200000210301 [0,1,0,0,0,0|2,0,1]=4 1286 B13R1.36 COc1ccc(cc1)N(C)C(C)C 269982a_100000220023_100000210206 [0,1,0,0,0,0|2,0,1]=4 1287 B13R1.36 COc1ccc(cc1)N(C)C(C)C 269982a_100000220024_200000210301 [0,1,0,0,0,0|2,0,1]=4 1288 B13R1.36 COc1ccc(cc1)N(C)C(C)C 34a_100000220023_100000210206 [0,1,0,0,0,0|2,0,1]=4 1289 B13R1.36 COc1ccc(cc1)N(C)C(C)C 34a_100000220024_200000210301 [0,1,0,0,0,0|2,0,1]=4 1290 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 2230a_100000220024_200025704644 [0,1,0,0,0,0|2,0,1]=4 1291 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 269982a_100000220024_200025704644 [0,1,0,0,0,0|2,0,1]=4 1292 B13R1.36 COc1ccc(cc1)N([13CH3])C(C)C 34a_100000220024_200025704644 [0,1,0,0,0,0|2,0,1]=4 1293 B13R1.36 COc1ccc(cn1)C(=C(C)C)C 271570a_200000049429_100000047065 [0,1,0,0,0,0|2,0,1]=4 1294 B13R1.36 COc1ccc(nc1)C(=C(C)C)C 271570a_200000049429_100000755202 [0,1,0,0,0,0|2,0,1]=4 1295 B13R1.36 CSc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100011263217 [0,1,0,0,0,0|1,1,1]=4 1296 B13R1.36 CSc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200000210301 [0,1,0,0,0,0|1,1,1]=4 1297 B13R1.36 CSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_200000210301 [0,1,0,0,0,0|1,1,0]=3 1298 B13R1.36 CSc1ccc(cc1)[C@@H](N)C(C)C 62a_100102422763_200000210301 [0,1,0,0,0,0|1,1,1]=4 1299 B13R1.36 CSc1ccc(cc1)[C@@H](N)C(C)C 62a_200000210301_100102422763 [0,1,0,0,0,0|1,1,1]=4 1300 B13R1.36 [13CH3]Sc1ccc(cc1)C(=O)C(=O)N 62a_200009822167_200025704644 [0,1,0,0,0,0|1,1,1]=4 1301 B13R1.142 C/C=C/c1ccc(cc1)C=C(C)C 271570a_100102525489_100016259036 [0,1,0,0,0,0|2,0,1]=4 1302 B13R1.142 C=C=Cc1ccc(cc1)CC(=O)C 271570a_100015277604_100000691760 [0,1,0,0,0,0|1,0,1]=3 1303 B13R1.142 C=C=Cc1ccc(cc1)CC(=O)N 271570a_100015277604_100000162331 [0,1,0,0,0,0|2,0,1]=4 1304 B13R1.142 C=C=Cc1ccc(cc1)NC(=O)C 271570a_100015277604_100000155215 [0,1,0,0,0,0|2,0,1]=4 1305 B13R1.142 C=C=Cc1ccc(cc1)OC(=O)C 271570a_100015277604_100000002173 [0,1,0,0,0,0|2,0,1]=4 1306 B13R1.142 C=C=Cc1ccc(cc1)SC(=O)C 271570a_100015277604_200009995050 [0,1,0,0,0,0|2,0,1]=4 1307 B13R1.142 CC(=Cc1ccc(cc1)CCN)C 271570a_100102525489_100000755846 [0,1,0,0,0,0|2,0,1]=4 1308 B13R1.142 CC(=Cc1ccc(cc1)CCO)C 271570a_100102525489_100000766406 [0,1,0,0,0,0|2,0,1]=4 1309 B13R1.142 CC(=O)Cc1ccc(cc1)N=[N+]=[N-] 1458a_100010395652_200000210301 [0,1,0,0,0,0|2,0,0]=3 1310 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 34a_100011218180_100015361967 [0,1,0,0,0,0|0,0,0]=1 1311 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 7a_100011218180_100015361967 [0,1,0,0,0,0|0,0,0]=1 1312 B13R1.142 CC(=O)Cc1ccc(cc1)SCF 62a_100000691760_100015361967 [0,1,0,0,0,0|0,1,0]=2 1313 B13R1.142 CC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000691760 [0,1,0,0,0,0|0,1,0]=2 1314 B13R1.142 CC(=O)Nc1ccc(cc1)CC#N 11a_100000198999_100015343762 [0,1,0,0,0,0|2,0,1]=4 1315 B13R1.142 CC(=O)Nc1ccc(cc1)CC#N 1626a_100000198999_100015343762 [0,1,0,0,0,0|2,0,1]=4 1316 B13R1.142 CC(=O)Nc1ccc(cc1)CC#N 22a_100000198999_100000070787 [0,1,0,0,0,0|2,0,1]=4 1317 B13R1.142 CC(=O)Nc1ccc(cc1)CC#N 527a_100000198999_100103153847 [0,1,0,0,0,0|2,0,1]=4 1318 B13R1.142 CC(=O)Nc1ccc(cc1)CCO 22a_100011204434_100000070787 [0,1,0,0,0,0|2,0,0]=3 1319 B13R1.142 CC(=O)Nc1ccc(cc1)CCO 527a_100011204434_100103153847 [0,1,0,0,0,0|2,0,0]=3 1320 B13R1.142 CC(=O)Nc1ccc(cc1)CN[13CH3] 34a_100000735448_200025704644 [0,1,0,0,0,0|2,0,0]=3 1321 B13R1.142 CC(=O)Nc1ccc(cc1)CO[13CH3] 34a_100000246270_200025704644 [0,1,0,0,0,0|1,0,0]=2 1322 B13R1.142 CC(=O)Nc1ccc(cc1)CO[13CH3] 7a_100000246270_200025704644 [0,1,0,0,0,0|1,0,0]=2 1323 B13R1.142 CC(=O)Nc1ccc(cc1)CS[13CH3] 62a_200025704644_100000731167 [0,1,0,0,0,0|1,1,0]=3 1324 B13R1.142 CC(=O)Nc1ccc(cc1)N=[N+]=[N-] 22a_100000032754_100000070787 [0,1,0,0,0,0|3,0,0]=4 1325 B13R1.142 CC(=O)Nc1ccc(cc1)NCF 34a_100000184111_100015361967 [0,1,0,0,0,0|2,0,0]=3 1326 B13R1.142 CC(=O)Nc1ccc(cc1)OCF 34a_100000184395_100015361967 [0,1,0,0,0,0|1,0,0]=2 1327 B13R1.142 CC(=O)Nc1ccc(cc1)OCF 7a_100000184395_100015361967 [0,1,0,0,0,0|1,0,0]=2 1328 B13R1.142 CC(=O)Nc1ccc(cc1)SCF 62a_100015361967_100000155215 [0,1,0,0,0,0|1,1,0]=3 1329 B13R1.142 CC(=O)Nc1ccc(cn1)OCF 34a_200000094647_100015361967 [0,1,0,0,0,0|2,0,0]=3 1330 B13R1.142 CC(=O)Nc1ccc(cn1)OCF 7a_200000094647_100015361967 [0,1,0,0,0,0|2,0,0]=3 1331 B13R1.142 CC(=O)Nc1ccc(cn1)SCF 62a_100015361967_100000193312 [0,1,0,0,0,0|2,1,0]=4 1332 B13R1.142 CC(=O)Nc1ccc(nc1)SCF 62a_100015361967_100011934715 [0,1,0,0,0,0|2,1,0]=4 1333 B13R1.142 CC(=O)Oc1ccc(cc1)CS[13CH3] 62a_200025704644_100000033664 [0,1,0,0,0,0|1,1,0]=3 1334 B13R1.142 CC(=O)Oc1ccc(cc1)SCF 62a_100015361967_100000002173 [0,1,0,0,0,0|1,1,0]=3 1335 B13R1.142 CC(=O)Sc1ccc(cc1)SCF 62a_200009995050_100015361967 [0,1,0,0,0,0|1,1,0]=3 1336 B13R1.142 CC(=S)Oc1ccc(cc1)SCF 62a_100015361967_200009816735 [0,1,0,0,0,0|1,2,0]=4 1337 B13R1.142 CC(C)Cc1ccc(cc1)CO[13CH3] 34a_200011266444_200025704644 [0,1,0,0,0,0|1,0,1]=3 1338 B13R1.142 CC(C)Cc1ccc(cc1)CO[13CH3] 7a_200011266444_200025704644 [0,1,0,0,0,0|1,0,1]=3 1339 B13R1.142 CC(C)Cc1ccc(cc1)CS[13CH3] 62a_100011982790_200025704644 [0,1,0,0,0,0|1,1,1]=4 1340 B13R1.142 CC(C)Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100011982790 [0,1,0,0,0,0|1,1,1]=4 1341 B13R1.142 CC(C)Cc1ccc(cc1)NCF 34a_100000687309_100015361967 [0,1,0,0,0,0|2,0,1]=4 1342 B13R1.142 CC(C)Cc1ccc(cc1)SCF 62a_100011221366_100015361967 [0,1,0,0,0,0|1,1,1]=4 1343 B13R1.142 CC(C)Cc1ccc(cc1)SCF 62a_100015361967_100011221366 [0,1,0,0,0,0|1,1,1]=4 1344 B13R1.142 CC(C)Oc1ccc(cc1)CO[13CH3] 34a_100000173089_200025704644 [0,1,0,0,0,0|2,0,1]=4 1345 B13R1.142 CC(C)Oc1ccc(cc1)CO[13CH3] 7a_100000173089_200025704644 [0,1,0,0,0,0|2,0,1]=4 1346 B13R1.142 CC(C)Oc1ccc(cc1)OCF 34a_100000757185_100015361967 [0,1,0,0,0,0|2,0,1]=4 1347 B13R1.142 CC(C)Oc1ccc(cc1)OCF 7a_100000757185_100015361967 [0,1,0,0,0,0|2,0,1]=4 1348 B13R1.142 CC(N)Cc1ccc(cc1)OCF 34a_100102634573_100015361967 [0,1,0,0,0,0|1,0,1]=3 1349 B13R1.142 CC=Cc1ccc(cc1)CC(=O)C 271570a_100016259895_100000691760 [0,1,0,0,0,0|1,0,0]=2 1350 B13R1.142 CC=Cc1ccc(cc1)CC(=O)N 271570a_100016259895_100000162331 [0,1,0,0,0,0|2,0,0]=3 1351 B13R1.142 CC=Cc1ccc(cc1)CC(C)C 271570a_100016259895_100011221366 [0,1,0,0,0,0|2,0,1]=4 1352 B13R1.142 CC=Cc1ccc(cc1)CN(C)C 271570a_100016259895_100000174694 [0,1,0,0,0,0|3,0,0]=4 1353 B13R1.142 CC=Cc1ccc(cc1)NC(=O)C 271570a_100016259895_100000155215 [0,1,0,0,0,0|2,0,0]=3 1354 B13R1.142 CC=Cc1ccc(cc1)NC(=O)N 271570a_100016259895_100000198584 [0,1,0,0,0,0|3,0,0]=4 1355 B13R1.142 CC=Cc1ccc(cc1)OC(=O)C 271570a_100016259895_100000002173 [0,1,0,0,0,0|2,0,0]=3 1356 B13R1.142 CC=Cc1ccc(cc1)OC(=S)C 271570a_100016259895_200009816735 [0,1,0,0,0,0|2,1,0]=4 1357 B13R1.142 CC=Cc1ccc(cc1)SC(=O)C 271570a_100016259895_200009995050 [0,1,0,0,0,0|2,0,0]=3 1358 B13R1.142 CC=Cc1ccc(cn1)CC(=O)N 271570a_100016259895_200000071513 [0,1,0,0,0,0|3,0,0]=4 1359 B13R1.142 CC=Cc1ccc(cn1)NC(=O)C 271570a_100016259895_100011934715 [0,1,0,0,0,0|3,0,0]=4 1360 B13R1.142 CC=Cc1ccc(nc1)CC(=O)N 271570a_100016259895_200010888337 [0,1,0,0,0,0|3,0,0]=4 1361 B13R1.142 CC=Cc1ccc(nc1)NC(=O)C 271570a_100016259895_100000193312 [0,1,0,0,0,0|3,0,0]=4 1362 B13R1.142 CCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000750032 [0,1,0,0,0,0|2,0,1]=4 1363 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000070787_100011982809 [0,1,0,0,0,0|1,0,0]=2 1364 B13R1.142 CCCc1ccc(cc1)CC(=O)C 1458a_100000186164_200000210301 [0,1,0,0,0,0|1,0,0]=2 1365 B13R1.142 CCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000186164_200025704644 [0,1,0,0,0,0|1,0,0]=2 1366 B13R1.142 CCCc1ccc(cc1)CN(C)C 2230a_100102631434_100011982809 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.142 CCCc1ccc(cc1)CN(C)C 269982a_100102631434_100011982809 [0,1,0,0,0,0|3,0,0]=4 1368 B13R1.142 CCCc1ccc(cc1)CN(C)C 270004a_100102631434_100000229940 [0,1,0,0,0,0|3,0,0]=4 1369 B13R1.142 CCCc1ccc(cc1)NC(=O)C 11a_100000211780_100015343762 [0,1,0,0,0,0|2,0,0]=3 1370 B13R1.142 CCCc1ccc(cc1)NC(=O)C 1626a_100000211780_100015343762 [0,1,0,0,0,0|2,0,0]=3 1371 B13R1.142 CCCc1ccc(cc1)NC(=O)C 22a_100000211780_100000070787 [0,1,0,0,0,0|2,0,0]=3 1372 B13R1.142 CCCc1ccc(cc1)NC(=O)C 527a_100000211780_100103153847 [0,1,0,0,0,0|2,0,0]=3 1373 B13R1.142 CCNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219632 [0,1,0,0,0,0|2,0,1]=4 1374 B13R1.142 CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000210202 [0,1,0,0,0,0|2,0,0]=3 1375 B13R1.142 CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000210202 [0,1,0,0,0,0|2,0,0]=3 1376 B13R1.142 CCNc1ccc(cc1)CC(C)C 2230a_100000687309_100000210202 [0,1,0,0,0,0|2,0,1]=4 1377 B13R1.142 CCNc1ccc(cc1)CC(C)C 34a_100000687309_100000210202 [0,1,0,0,0,0|2,0,1]=4 1378 B13R1.142 CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000210202 [0,1,0,0,0,0|2,0,0]=3 1379 B13R1.142 CCOc1ccc(cc1)C=C(C)C 271570a_100102525489_100000169946 [0,1,0,0,0,0|1,0,1]=3 1380 B13R1.142 CCOc1ccc(cc1)CC(=O)C 1458a_100000183096_200000210301 [0,1,0,0,0,0|0,0,0]=1 1381 B13R1.142 CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210202 [0,1,0,0,0,0|0,0,0]=1 1382 B13R1.142 CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210202 [0,1,0,0,0,0|0,0,0]=1 1383 B13R1.142 CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000210202 [0,1,0,0,0,0|1,0,0]=2 1384 B13R1.142 CCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000183096_200025704644 [0,1,0,0,0,0|0,0,0]=1 1385 B13R1.142 CCOc1ccc(cc1)CC(C)N 34a_100102634573_100000210202 [0,1,0,0,0,0|1,0,1]=3 1386 B13R1.142 CCOc1ccc(cc1)CN(C)C 2230a_100000180828_200000210301 [0,1,0,0,0,0|2,0,0]=3 1387 B13R1.142 CCOc1ccc(cc1)CN(C)C 269982a_100000180828_200000210301 [0,1,0,0,0,0|2,0,0]=3 1388 B13R1.142 CCOc1ccc(cc1)CN(C)C 270004a_100102631434_100000169836 [0,1,0,0,0,0|2,0,0]=3 1389 B13R1.142 CCOc1ccc(cc1)CN(C)[13CH3] 2230a_100000180828_200025704644 [0,1,0,0,0,0|2,0,0]=3 1390 B13R1.142 CCOc1ccc(cc1)CN(C)[13CH3] 269982a_100000180828_200025704644 [0,1,0,0,0,0|2,0,0]=3 1391 B13R1.142 CCOc1ccc(cc1)NC(=O)C 11a_100000739623_100015343762 [0,1,0,0,0,0|1,0,0]=2 1392 B13R1.142 CCOc1ccc(cc1)NC(=O)C 1626a_100000739623_100015343762 [0,1,0,0,0,0|1,0,0]=2 1393 B13R1.142 CCOc1ccc(cc1)NC(=O)C 22a_100000739623_100000070787 [0,1,0,0,0,0|1,0,0]=2 1394 B13R1.142 CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000210202 [0,1,0,0,0,0|1,0,0]=2 1395 B13R1.142 CCOc1ccc(cc1)NC(=O)C 527a_100000739623_100103153847 [0,1,0,0,0,0|1,0,0]=2 1396 B13R1.142 CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000210202 [0,1,0,0,0,0|1,0,0]=2 1397 B13R1.142 CCOc1ccc(cc1)NC(C)C 2230a_100000739623_100000210206 [0,1,0,0,0,0|2,0,1]=4 1398 B13R1.142 CCOc1ccc(cc1)NC(C)C 34a_100000739623_100000210206 [0,1,0,0,0,0|2,0,1]=4 1399 B13R1.142 CCOc1ccc(cc1)OC(C)C 34a_100000185467_100000210206 [0,1,0,0,0,0|2,0,1]=4 1400 B13R1.142 CCOc1ccc(cc1)OC(C)C 34a_100000757185_100000210202 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.142 CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000210202 [0,1,0,0,0,0|2,0,1]=4 1402 B13R1.142 CCOc1ccc(cc1)SC(C)C 62a_100000210206_100000171712 [0,1,0,0,0,0|2,0,1]=4 1403 B13R1.142 CCOc1ccc(cn1)C=C(C)C 271570a_100102525489_100011219444 [0,1,0,0,0,0|2,0,1]=4 1404 B13R1.142 CCOc1ccc(cn1)CN(C)C 270004a_100102631434_100012002837 [0,1,0,0,0,0|3,0,0]=4 1405 B13R1.142 CCOc1ccc(nc1)C=C(C)C 271570a_100102525489_100000753957 [0,1,0,0,0,0|2,0,1]=4 1406 B13R1.142 CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000210202 [0,1,0,0,0,0|2,0,0]=3 1407 B13R1.142 CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000210202 [0,1,0,0,0,0|2,0,0]=3 1408 B13R1.142 CCSc1ccc(cc1)C=C(C)C 271570a_100102525489_200009811893 [0,1,0,0,0,0|1,1,1]=4 1409 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000210202_100000691760 [0,1,0,0,0,0|0,1,0]=2 1410 B13R1.142 CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210202 [0,1,0,0,0,0|0,1,0]=2 1411 B13R1.142 CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000210202 [0,1,0,0,0,0|1,1,0]=3 1412 B13R1.142 CCSc1ccc(cc1)CC(=O)N 62a_100000210202_100000162331 [0,1,0,0,0,0|1,1,0]=3 1413 B13R1.142 CCSc1ccc(cc1)CC(C)C 62a_100000210202_100011221366 [0,1,0,0,0,0|1,1,1]=4 1414 B13R1.142 CCSc1ccc(cc1)CC(C)C 62a_100011221366_100000210202 [0,1,0,0,0,0|1,1,1]=4 1415 B13R1.142 CCSc1ccc(cc1)CN(C)C 62a_100000174694_100000210202 [0,1,0,0,0,0|2,1,0]=4 1416 B13R1.142 CCSc1ccc(cc1)CN(C)C 62a_100000210202_100000174694 [0,1,0,0,0,0|2,1,0]=4 1417 B13R1.142 CCSc1ccc(cc1)NC(=O)C 11a_100015187087_100015343762 [0,1,0,0,0,0|1,1,0]=3 1418 B13R1.142 CCSc1ccc(cc1)NC(=O)C 1626a_100015187087_100015343762 [0,1,0,0,0,0|1,1,0]=3 1419 B13R1.142 CCSc1ccc(cc1)NC(=O)C 22a_100015187087_100000070787 [0,1,0,0,0,0|1,1,0]=3 1420 B13R1.142 CCSc1ccc(cc1)NC(=O)C 527a_100015187087_100103153847 [0,1,0,0,0,0|1,1,0]=3 1421 B13R1.142 CCSc1ccc(cc1)NC(=O)C 62a_100000210202_100000155215 [0,1,0,0,0,0|1,1,0]=3 1422 B13R1.142 CCSc1ccc(cc1)NC(=O)N 62a_100000210202_100000198584 [0,1,0,0,0,0|2,1,0]=4 1423 B13R1.142 CCSc1ccc(cc1)OC(=O)C 62a_100000210202_100000002173 [0,1,0,0,0,0|1,1,0]=3 1424 B13R1.142 CCSc1ccc(cc1)OC(=S)C 62a_100000210202_200009816735 [0,1,0,0,0,0|1,2,0]=4 1425 B13R1.142 CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210202 [0,1,0,0,0,0|1,1,0]=3 1426 B13R1.142 CCSc1ccc(cn1)CC(=O)N 62a_100000210202_200000071513 [0,1,0,0,0,0|2,1,0]=4 1427 B13R1.142 CCSc1ccc(cn1)CC(=O)N 62a_200000071513_100000210202 [0,1,0,0,0,0|2,1,0]=4 1428 B13R1.142 CCSc1ccc(cn1)NC(=O)C 62a_100000210202_100011934715 [0,1,0,0,0,0|2,1,0]=4 1429 B13R1.142 CCSc1ccc(nc1)CC(=O)N 62a_100000210202_200010888337 [0,1,0,0,0,0|2,1,0]=4 1430 B13R1.142 CCSc1ccc(nc1)CC(=O)N 62a_200010888337_100000210202 [0,1,0,0,0,0|2,1,0]=4 1431 B13R1.142 CCSc1ccc(nc1)NC(=O)C 62a_100000210202_100000193312 [0,1,0,0,0,0|2,1,0]=4 1432 B13R1.142 CN(C)Cc1ccc(cc1)CN[13CH3] 2230a_100000203713_200025704644 [0,1,0,0,0,0|3,0,0]=4 1433 B13R1.142 CN(C)Cc1ccc(cc1)SCF 62a_100000174694_100015361967 [0,1,0,0,0,0|2,1,0]=4 1434 B13R1.142 CN(C)Cc1ccc(cc1)SCF 62a_100015361967_100000174694 [0,1,0,0,0,0|2,1,0]=4 1435 B13R1.142 CNCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000180866 [0,1,0,0,0,0|2,0,1]=4 1436 B13R1.142 CNCc1ccc(cc1)CC(=O)O 269956a_100016989728_200000210301 [0,1,0,0,0,0|2,0,0]=3 1437 B13R1.142 CNCc1ccc(cc1)CC(C)C 207a_100102657272_100000749234 [0,1,0,0,0,0|2,0,1]=4 1438 B13R1.142 CNCc1ccc(cc1)CC(C)C 2230a_106832991635_100011982790 [0,1,0,0,0,0|2,0,1]=4 1439 B13R1.142 CNCc1ccc(cc1)CC(C)C 269862a_106832991636_100000749234 [0,1,0,0,0,0|2,0,1]=4 1440 B13R1.142 CNCc1ccc(cc1)CC(C)C 270004a_106832991635_100000749234 [0,1,0,0,0,0|2,0,1]=4 1441 B13R1.142 CNCc1ccc(cc1)CC(C)C 34a_100102657272_100011982790 [0,1,0,0,0,0|2,0,1]=4 1442 B13R1.142 CNCc1ccc(cc1)CC(C)C 7a_106832991635_100011982790 [0,1,0,0,0,0|2,0,1]=4 1443 B13R1.142 CNCc1ccc(cc1)CC(C)N 26a_100102657272_100102634573 [0,1,0,0,0,0|2,0,1]=4 1444 B13R1.142 CNCc1ccc(cc1)CN(C)C 207a_100102657272_100000059705 [0,1,0,0,0,0|3,0,0]=4 1445 B13R1.142 CNCc1ccc(cc1)CN(C)C 2230a_100000203713_200000210301 [0,1,0,0,0,0|3,0,0]=4 1446 B13R1.142 CNCc1ccc(cc1)CN(C)C 270004a_106832991635_100000059705 [0,1,0,0,0,0|3,0,0]=4 1447 B13R1.142 CNCc1ccc(cc1)NC(=O)C 207a_100102657272_100000210072 [0,1,0,0,0,0|2,0,0]=3 1448 B13R1.142 CNCc1ccc(cc1)NC(=O)C 2230a_106832991635_100000731167 [0,1,0,0,0,0|2,0,0]=3 1449 B13R1.142 CNCc1ccc(cc1)NC(=O)C 34a_100000735448_200000210301 [0,1,0,0,0,0|2,0,0]=3 1450 B13R1.142 CNCc1ccc(cc1)NC(=O)C 34a_100102657272_100000731167 [0,1,0,0,0,0|2,0,0]=3 1451 B13R1.142 CNCc1ccc(cc1)NC(=O)C 7a_106832991635_100000731167 [0,1,0,0,0,0|2,0,0]=3 1452 B13R1.142 CNCc1ccc(cc1)OC(=O)C 207a_100102657272_100000014718 [0,1,0,0,0,0|2,0,0]=3 1453 B13R1.142 CNCc1ccc(cc1)OC(=O)C 2230a_106832991635_100000033664 [0,1,0,0,0,0|2,0,0]=3 1454 B13R1.142 CNCc1ccc(cc1)OC(=O)C 270004a_106832991635_100000014718 [0,1,0,0,0,0|2,0,0]=3 1455 B13R1.142 CNCc1ccc(cc1)OC(=O)C 7a_106832991635_100000033664 [0,1,0,0,0,0|2,0,0]=3 1456 B13R1.142 COCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011493685 [0,1,0,0,0,0|1,0,1]=3 1457 B13R1.142 COCc1ccc(cc1)CC(=O)C 1458a_100011290826_200000210301 [0,1,0,0,0,0|0,0,0]=1 1458 B13R1.142 COCc1ccc(cc1)CC(=O)[13CH3] 1458a_100011290826_200025704644 [0,1,0,0,0,0|0,0,0]=1 1459 B13R1.142 COCc1ccc(cc1)CC(C)C 34a_100138415774_100011982790 [0,1,0,0,0,0|1,0,1]=3 1460 B13R1.142 COCc1ccc(cc1)CC(C)C 34a_200011266444_200000210301 [0,1,0,0,0,0|1,0,1]=3 1461 B13R1.142 COCc1ccc(cc1)CC(C)C 7a_200011266444_200000210301 [0,1,0,0,0,0|1,0,1]=3 1462 B13R1.142 COCc1ccc(cc1)NC(=O)C 11a_100000694113_100015343762 [0,1,0,0,0,0|1,0,0]=2 1463 B13R1.142 COCc1ccc(cc1)NC(=O)C 1626a_100000694113_100015343762 [0,1,0,0,0,0|1,0,0]=2 1464 B13R1.142 COCc1ccc(cc1)NC(=O)C 22a_100000694113_100000070787 [0,1,0,0,0,0|1,0,0]=2 1465 B13R1.142 COCc1ccc(cc1)NC(=O)C 34a_100000246270_200000210301 [0,1,0,0,0,0|1,0,0]=2 1466 B13R1.142 COCc1ccc(cc1)NC(=O)C 34a_100138415774_100000731167 [0,1,0,0,0,0|1,0,0]=2 1467 B13R1.142 COCc1ccc(cc1)NC(=O)C 527a_100000694113_100103153847 [0,1,0,0,0,0|1,0,0]=2 1468 B13R1.142 COCc1ccc(cc1)NC(=O)C 7a_100000246270_200000210301 [0,1,0,0,0,0|1,0,0]=2 1469 B13R1.142 COCc1ccc(cc1)NC(C)C 34a_100000694113_100000210206 [0,1,0,0,0,0|2,0,1]=4 1470 B13R1.142 COCc1ccc(cc1)OC(C)C 34a_100000173089_200000210301 [0,1,0,0,0,0|2,0,1]=4 1471 B13R1.142 COCc1ccc(cc1)OC(C)C 34a_200011995677_100000210206 [0,1,0,0,0,0|2,0,1]=4 1472 B13R1.142 COCc1ccc(cc1)OC(C)C 7a_100000173089_200000210301 [0,1,0,0,0,0|2,0,1]=4 1473 B13R1.142 COCc1ccc(cc1)OC(C)C 7a_200011995677_100000210206 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.142 COCc1ccc(cc1)SC(C)C 62a_100000210206_100011493685 [0,1,0,0,0,0|2,0,1]=4 1475 B13R1.142 COCc1ccc(cc1)SC(C)C 62a_100011493685_100000210206 [0,1,0,0,0,0|2,0,1]=4 1476 B13R1.142 CSCc1ccc(cc1)CC(C)C 62a_100011982790_200000210301 [0,1,0,0,0,0|1,1,1]=4 1477 B13R1.142 CSCc1ccc(cc1)CC(C)C 62a_200000210301_100011982790 [0,1,0,0,0,0|1,1,1]=4 1478 B13R1.142 CSCc1ccc(cc1)NC(=O)C 11a_106726388226_100015343762 [0,1,0,0,0,0|1,1,0]=3 1479 B13R1.142 CSCc1ccc(cc1)NC(=O)C 1626a_106726388226_100015343762 [0,1,0,0,0,0|1,1,0]=3 1480 B13R1.142 CSCc1ccc(cc1)NC(=O)C 22a_106726388226_100000070787 [0,1,0,0,0,0|1,1,0]=3 1481 B13R1.142 CSCc1ccc(cc1)NC(=O)C 527a_106726388226_100103153847 [0,1,0,0,0,0|1,1,0]=3 1482 B13R1.142 CSCc1ccc(cc1)NC(=O)C 62a_200000210301_100000731167 [0,1,0,0,0,0|1,1,0]=3 1483 B13R1.142 CSCc1ccc(cc1)OC(=O)C 62a_200000210301_100000033664 [0,1,0,0,0,0|1,1,0]=3 1484 B13R1.142 NC(=O)Cc1ccc(cc1)NCF 34a_100000738315_100015361967 [0,1,0,0,0,0|2,0,0]=3 1485 B13R1.142 NC(=O)Cc1ccc(cc1)OCF 34a_100000020825_100015361967 [0,1,0,0,0,0|1,0,0]=2 1486 B13R1.142 NC(=O)Cc1ccc(cc1)SCF 62a_100000162331_100015361967 [0,1,0,0,0,0|1,1,0]=3 1487 B13R1.142 NC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000162331 [0,1,0,0,0,0|1,1,0]=3 1488 B13R1.142 NC(=O)Cc1ccc(cn1)SCF 62a_100015361967_200010888337 [0,1,0,0,0,0|2,1,0]=4 1489 B13R1.142 NC(=O)Cc1ccc(cn1)SCF 62a_200010888337_100015361967 [0,1,0,0,0,0|2,1,0]=4 1490 B13R1.142 NC(=O)Cc1ccc(nc1)SCF 62a_100015361967_200000071513 [0,1,0,0,0,0|2,1,0]=4 1491 B13R1.142 NC(=O)Cc1ccc(nc1)SCF 62a_200000071513_100015361967 [0,1,0,0,0,0|2,1,0]=4 1492 B13R1.142 NC(=O)Nc1ccc(cc1)SCF 62a_100015361967_100000198584 [0,1,0,0,0,0|2,1,0]=4 1493 B13R1.142 [13CH3]C(=O)Cc1ccc(cc1)N=[N+]=[N-] 1458a_100010395652_200025704644 [0,1,0,0,0,0|2,0,0]=3 1494 B13R1.142 [13CH3]NCc1ccc(cc1)CC(=O)O 269956a_100016989728_200025704644 [0,1,0,0,0,0|2,0,0]=3 1495 B13R1.585 C=C(C)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000185454 [0,1,0,0,0,0|2,0,1]=4 1496 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)C 271570a_100000694244_100000691760 [0,1,0,0,0,0|1,0,0]=2 1497 B13R1.585 C=C(C)c1ccc(cc1)CC(=O)N 271570a_100000694244_100000162331 [0,1,0,0,0,0|2,0,0]=3 1498 B13R1.585 C=C(C)c1ccc(cc1)CC(C)C 271570a_100000694244_100011221366 [0,1,0,0,0,0|2,0,1]=4 1499 B13R1.585 C=C(C)c1ccc(cc1)CN(C)C 271570a_100000694244_100000174694 [0,1,0,0,0,0|3,0,0]=4 1500 B13R1.585 C=C(C)c1ccc(cc1)NC(=O)C 271570a_100000694244_100000155215 [0,1,0,0,0,0|2,0,0]=3 1501 B13R1.585 C=C(C)c1ccc(cc1)NC(=O)N 271570a_100000694244_100000198584 [0,1,0,0,0,0|3,0,0]=4 1502 B13R1.585 C=C(C)c1ccc(cc1)OC(=O)C 271570a_100000694244_100000002173 [0,1,0,0,0,0|2,0,0]=3 1503 B13R1.585 C=C(C)c1ccc(cc1)OC(=S)C 271570a_100000694244_200009816735 [0,1,0,0,0,0|2,1,0]=4 1504 B13R1.585 C=C(C)c1ccc(cc1)SC(=O)C 271570a_100000694244_200009995050 [0,1,0,0,0,0|2,0,0]=3 1505 B13R1.585 C=C(C)c1ccc(cn1)CC(=O)N 271570a_100000694244_200000071513 [0,1,0,0,0,0|3,0,0]=4 1506 B13R1.585 C=C(C)c1ccc(cn1)NC(=O)C 271570a_100000694244_100011934715 [0,1,0,0,0,0|3,0,0]=4 1507 B13R1.585 C=C(C)c1ccc(nc1)CC(=O)N 271570a_100000694244_200010888337 [0,1,0,0,0,0|3,0,0]=4 1508 B13R1.585 C=C(C)c1ccc(nc1)NC(=O)C 271570a_100000694244_100000193312 [0,1,0,0,0,0|3,0,0]=4 1509 B13R1.585 CC(=Cc1ccc(cc1)C(C)C)C 271570a_100102525489_100000750031 [0,1,0,0,0,0|2,0,1]=4 1510 B13R1.585 CC(=Cc1ccc(cc1)C(C)O)C 271570a_100102525489_100000745893 [0,1,0,0,0,0|2,0,1]=4 1511 B13R1.585 CC(=Cc1ccc(cc1)N(C)C)C 271570a_100102525489_100000210421 [0,1,0,0,0,0|2,0,1]=4 1512 B13R1.585 CC(=Cc1ccc(cc1)S(=O)C)C 271570a_100102525489_100009816266 [0,1,0,0,0,0|1,1,1]=4 1513 B13R1.585 CC(=Cc1ccc(cc1)[C@@H](C)N)C 271570a_100102525489_100000720352 [0,1,0,0,0,0|2,0,1]=4 1514 B13R1.585 CC(=Cc1ccc(cc1)[C@H](C)N)C 271570a_100102525489_100000753911 [0,1,0,0,0,0|2,0,1]=4 1515 B13R1.585 CC(=O)Cc1ccc(cc1)B(O)O 1458a_100000070787_100009813762 [0,1,0,0,0,0|2,0,0]=3 1516 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000070787_100000756337 [0,1,0,0,0,0|1,0,0]=2 1517 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000070787_100000231043 [0,1,0,0,0,0|2,0,0]=3 1518 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000070787_100000181262 [0,1,0,0,0,0|1,0,0]=2 1519 B13R1.585 CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_200000210301 [0,1,0,0,0,0|1,0,0]=2 1520 B13R1.585 CC(=O)Cc1ccc(cc1)C(F)F 1458a_100000070787_200012343607 [0,1,0,0,0,0|2,0,0]=3 1521 B13R1.585 CC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_200000210301 [0,1,0,0,0,0|1,0,0]=2 1522 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000181861 [0,1,0,0,0,0|2,0,0]=3 1523 B13R1.585 CC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200000210301 [0,1,0,0,0,0|2,0,0]=3 1524 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)C 1458a_100000185149_200000210301 [0,1,0,0,0,0|2,0,0]=3 1525 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 11a_100000210537_100015343762 [0,1,0,0,0,0|3,0,0]=4 1526 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 1626a_100000210537_100015343762 [0,1,0,0,0,0|3,0,0]=4 1527 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 22a_100000210537_100000070787 [0,1,0,0,0,0|3,0,0]=4 1528 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)N 527a_100000210537_100103153847 [0,1,0,0,0,0|3,0,0]=4 1529 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)[13CH3] 1458a_100000185149_200025704644 [0,1,0,0,0,0|2,0,0]=3 1530 B13R1.585 CC(=O)Nc1ccc(cc1)C(=S)N 1626a_100000739662_100015343762 [0,1,0,0,0,0|3,0,0]=4 1531 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 11a_100000210773_100015343762 [0,1,0,0,0,0|2,0,0]=3 1532 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 1626a_100000210773_100015343762 [0,1,0,0,0,0|2,0,0]=3 1533 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 22a_100000210773_100000070787 [0,1,0,0,0,0|2,0,0]=3 1534 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)C 527a_100000210773_100103153847 [0,1,0,0,0,0|2,0,0]=3 1535 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)O 22a_100011216399_100000070787 [0,1,0,0,0,0|2,0,0]=3 1536 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)O 527a_100011216399_100103153847 [0,1,0,0,0,0|2,0,0]=3 1537 B13R1.585 CC(=O)Nc1ccc(cc1)C(F)F 11a_100020620101_100015343762 [0,1,0,0,0,0|3,0,0]=4 1538 B13R1.585 CC(=O)Nc1ccc(cc1)C(F)F 1626a_100020620101_100015343762 [0,1,0,0,0,0|3,0,0]=4 1539 B13R1.585 CC(=O)Nc1ccc(cc1)C(F)F 22a_100020620101_100000070787 [0,1,0,0,0,0|3,0,0]=4 1540 B13R1.585 CC(=O)Nc1ccc(cc1)C(F)F 527a_100020620101_100103153847 [0,1,0,0,0,0|3,0,0]=4 1541 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 11a_100016997997_100015343762 [0,1,0,0,0,0|2,0,0]=3 1542 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 1626a_100016997997_100015343762 [0,1,0,0,0,0|2,0,0]=3 1543 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 2230a_100000219403_200000210301 [0,1,0,0,0,0|2,0,0]=3 1544 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 22a_100016997997_100000070787 [0,1,0,0,0,0|2,0,0]=3 1545 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 269982a_100000219403_200000210301 [0,1,0,0,0,0|2,0,0]=3 1546 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 34a_100000219403_200000210301 [0,1,0,0,0,0|2,0,0]=3 1547 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 38a_100000219403_200000210301 [0,1,0,0,0,0|2,0,0]=3 1548 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)C 527a_100016997997_100103153847 [0,1,0,0,0,0|2,0,0]=3 1549 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 2230a_100000219403_200025704644 [0,1,0,0,0,0|2,0,0]=3 1550 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 269982a_100000219403_200025704644 [0,1,0,0,0,0|2,0,0]=3 1551 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 34a_100000219403_200025704644 [0,1,0,0,0,0|2,0,0]=3 1552 B13R1.585 CC(=O)Nc1ccc(cc1)N(C)[13CH3] 38a_100000219403_200025704644 [0,1,0,0,0,0|2,0,0]=3 1553 B13R1.585 CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 11a_100015195142_100015343762 [0,1,0,0,0,0|3,0,0]=4 1554 B13R1.585 CC(=O)Nc1ccc(cc1)[N+](=O)[O-] 1626a_100015195142_100015343762 [0,1,0,0,0,0|3,0,0]=4 1555 B13R1.585 CC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000185465 [0,1,0,0,0,0|2,0,1]=4 1556 B13R1.585 CC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_200000210301 [0,1,0,0,0,0|2,0,1]=4 1557 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 1458a_100000749272_200000210301 [0,1,0,0,0,0|3,0,0]=4 1558 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000756337 [0,1,0,0,0,0|3,0,0]=4 1559 B13R1.585 CC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000756337 [0,1,0,0,0,0|3,0,0]=4 1560 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000185289_200025704644 [0,1,0,0,0,0|2,0,1]=4 1561 B13R1.585 CC(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000689720_200025704644 [0,1,0,0,0,0|1,0,0]=2 1562 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 2230a_100102631434_100000181262 [0,1,0,0,0,0|3,0,0]=4 1563 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 269982a_100102631434_100000181262 [0,1,0,0,0,0|3,0,0]=4 1564 B13R1.585 CC(C)c1ccc(cc1)CN(C)C 270004a_100102631434_100000210693 [0,1,0,0,0,0|3,0,0]=4 1565 B13R1.585 CN(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000749272_200025704644 [0,1,0,0,0,0|3,0,0]=4 1566 B13R1.585 CN(C)Cc1ccc(cc1)N(C)C 269982a_100000186899_200000210301 [0,1,0,0,0,0|3,0,0]=4 1567 B13R1.585 CN(C)Cc1ccc(cc1)N(C)C 270004a_100102631434_100000185837 [0,1,0,0,0,0|3,0,0]=4 1568 B13R1.585 CN(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011218386_200025704644 [0,1,0,0,0,0|1,0,0]=2 1569 B13R1.585 CN([13CH3])Cc1ccc(cc1)N(C)C 269982a_100000186899_200025704644 [0,1,0,0,0,0|3,0,0]=4 1570 B13R1.585 [13CH3]C(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_200025704644 [0,1,0,0,0,0|2,0,0]=3 1571 B13R1.653 C=Cc1ccc(c(c1)C)NC(=O)C 271570a_100011290941_100000152120 [0,1,0,0,0,0|2,0,1]=4 1572 B13R1.653 C=Cc1ccc(c(c1)Cl)NC(=O)C 271570a_100011290941_100011273303 [0,1,0,0,0,0|2,0,1]=4 1573 B13R1.653 C=Cc1ccc(c(c1)F)NC(=O)C 271570a_100011290941_100000155584 [0,1,0,0,0,0|2,0,1]=4 1574 B13R1.653 C=Cc1ccc(c(c1)F)OC(=O)C 271570a_100011290941_100009811628 [0,1,0,0,0,0|2,0,1]=4 1575 B13R1.653 C=Cc1ccc(c(c1)N)NC(=O)C 271570a_100011290941_100000749274 [0,1,0,0,0,0|2,0,1]=4 1576 B13R1.653 CC(=O)Cc1ccc(cc1Br)C#N 1458a_100000070787_100000694769 [0,1,0,0,0,0|2,0,0]=3 1577 B13R1.653 CC(=O)Cc1ccc(cc1Cl)C#N 1458a_100000070787_100000709902 [0,1,0,0,0,0|2,0,0]=3 1578 B13R1.653 CC(=O)Cc1ccc(cc1Cl)O[13CH3] 34a_200000084595_200025704644 [0,1,0,0,0,0|0,0,0]=1 1579 B13R1.653 CC(=O)Cc1ccc(cc1Cl)O[13CH3] 7a_200000084595_200025704644 [0,1,0,0,0,0|0,0,0]=1 1580 B13R1.653 CC(=O)Cc1ccc(cc1F)C#N 1458a_100000070787_100000239720 [0,1,0,0,0,0|2,0,0]=3 1581 B13R1.653 CC(=O)Cc1ccc(cc1I)C#N 1458a_100000070787_100010079267 [0,1,0,0,0,0|2,0,0]=3 1582 B13R1.653 CC(=O)Nc1ccc(cc1Br)C#N 1626a_100000736769_100015343762 [0,1,0,0,0,0|3,0,0]=4 1583 B13R1.653 CC(=O)Nc1ccc(cc1C)C#N 11a_100011216260_100015343762 [0,1,0,0,0,0|3,0,0]=4 1584 B13R1.653 CC(=O)Nc1ccc(cc1C)C#N 1626a_100011216260_100015343762 [0,1,0,0,0,0|3,0,0]=4 1585 B13R1.653 CC(=O)Nc1ccc(cc1C)C#N 527a_100011216260_100103153847 [0,1,0,0,0,0|3,0,0]=4 1586 B13R1.653 CC(=O)Nc1ccc(cc1C)CO 22a_200011997030_100000070787 [0,1,0,0,0,0|3,0,0]=4 1587 B13R1.653 CC(=O)Nc1ccc(cc1C)N[13CH3] 34a_100000736504_200025704644 [0,1,0,0,0,0|2,0,0]=3 1588 B13R1.653 CC(=O)Nc1ccc(cc1C)N[13CH3] 7a_100000736504_200025704644 [0,1,0,0,0,0|2,0,0]=3 1589 B13R1.653 CC(=O)Nc1ccc(cc1C)S[13CH3] 62a_200025704644_100000152120 [0,1,0,0,0,0|1,1,0]=3 1590 B13R1.653 CC(=O)Nc1ccc(cc1Cl)C#N 1626a_100000690208_100015343762 [0,1,0,0,0,0|3,0,0]=4 1591 B13R1.653 CC(=O)Nc1ccc(cc1Cl)N[13CH3] 34a_100000244014_200025704644 [0,1,0,0,0,0|2,0,0]=3 1592 B13R1.653 CC(=O)Nc1ccc(cc1Cl)N[13CH3] 7a_100000244014_200025704644 [0,1,0,0,0,0|2,0,0]=3 1593 B13R1.653 CC(=O)Nc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011273303 [0,1,0,0,0,0|1,1,0]=3 1594 B13R1.653 CC(=O)Nc1ccc(cc1F)C#N 11a_100000760432_100015343762 [0,1,0,0,0,0|3,0,0]=4 1595 B13R1.653 CC(=O)Nc1ccc(cc1F)C#N 1626a_100000760432_100015343762 [0,1,0,0,0,0|3,0,0]=4 1596 B13R1.653 CC(=O)Nc1ccc(cc1F)S[13CH3] 62a_200025704644_100000155584 [0,1,0,0,0,0|1,1,0]=3 1597 B13R1.653 CC(=O)Nc1ccc(cc1I)C#N 1626a_100000067503_100015343762 [0,1,0,0,0,0|3,0,0]=4 1598 B13R1.653 CC(=O)Nc1ccc(cc1O)C#N 22a_100011997735_100000070787 [0,1,0,0,0,0|3,0,0]=4 1599 B13R1.653 CC(=O)Nc1ccc(cc1O)C#N 271570a_203496583355_200011214909 [0,1,0,0,0,0|3,0,0]=4 1600 B13R1.653 CC(=O)Nc1ccc(cc1O)C#N 527a_100011997735_100103153847 [0,1,0,0,0,0|3,0,0]=4 1601 B13R1.653 CC(=O)Nc1ncc(cc1C)S[13CH3] 62a_200025704644_200011934169 [0,1,0,0,0,0|2,1,0]=4 1602 B13R1.653 CC(=O)Oc1ccc(cc1F)S[13CH3] 62a_100009811628_200025704644 [0,1,0,0,0,0|1,1,0]=3 1603 B13R1.653 CC(=O)Oc1ccc(cc1F)S[13CH3] 62a_200025704644_100009811628 [0,1,0,0,0,0|1,1,0]=3 1604 B13R1.653 CCc1ccc(c(c1)Br)C=C(C)C 271570a_100102525489_200009997437 [0,1,0,0,0,0|2,0,1]=4 1605 B13R1.653 CCc1ccc(c(c1)Br)NC(=O)C 11a_100012339725_100015343762 [0,1,0,0,0,0|2,0,0]=3 1606 B13R1.653 CCc1ccc(c(c1)Br)NC(=O)C 1626a_100012339725_100015343762 [0,1,0,0,0,0|2,0,0]=3 1607 B13R1.653 CCc1ccc(c(c1)Br)NC(=O)C 527a_100012339725_100103153847 [0,1,0,0,0,0|2,0,0]=3 1608 B13R1.653 CCc1ccc(c(c1)C)NC(=O)C 11a_100011226020_100015343762 [0,1,0,0,0,0|2,0,0]=3 1609 B13R1.653 CCc1ccc(c(c1)C)NC(=O)C 1626a_100011226020_100015343762 [0,1,0,0,0,0|2,0,0]=3 1610 B13R1.653 CCc1ccc(c(c1)C)NC(=O)C 22a_100011226020_100000070787 [0,1,0,0,0,0|2,0,0]=3 1611 B13R1.653 CCc1ccc(c(c1)C)NC(=O)C 527a_100011226020_100103153847 [0,1,0,0,0,0|2,0,0]=3 1612 B13R1.653 CCc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_200010339503 [0,1,0,0,0,0|2,0,1]=4 1613 B13R1.653 CCc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011156597 [0,1,0,0,0,0|3,0,0]=4 1614 B13R1.653 CCc1ccc(c(c1)F)NC(=O)C 11a_100016177294_100015343762 [0,1,0,0,0,0|2,0,0]=3 1615 B13R1.653 CCc1ccc(c(c1)F)NC(=O)C 1626a_100016177294_100015343762 [0,1,0,0,0,0|2,0,0]=3 1616 B13R1.653 CCc1ccc(c(c1)F)NC(=O)C 22a_100016177294_100000070787 [0,1,0,0,0,0|2,0,0]=3 1617 B13R1.653 CCc1ccc(c(c1)F)NC(=O)C 527a_100016177294_100103153847 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.653 CCc1ccc(c(c1)O)NC(=O)C 22a_100000124328_100000070787 [0,1,0,0,0,0|2,0,0]=3 1619 B13R1.653 CCc1ccc(c(c1)O)NC(=O)C 527a_100000124328_100103153847 [0,1,0,0,0,0|2,0,0]=3 1620 B13R1.653 CN(C)Cc1ccc(cc1F)S[13CH3] 62a_100000174744_200025704644 [0,1,0,0,0,0|2,1,0]=4 1621 B13R1.653 CN(C)Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000174744 [0,1,0,0,0,0|2,1,0]=4 1622 B13R1.653 CNc1ccc(c(c1)C)C=C(C)C 271570a_100102525489_100102888905 [0,1,0,0,0,0|2,0,1]=4 1623 B13R1.653 CNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_200000210301 [0,1,0,0,0,0|2,0,0]=3 1624 B13R1.653 CNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_200000210301 [0,1,0,0,0,0|2,0,0]=3 1625 B13R1.653 CNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_200000210301 [0,1,0,0,0,0|2,0,0]=3 1626 B13R1.653 CNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_200000210301 [0,1,0,0,0,0|2,0,0]=3 1627 B13R1.653 CNc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100012285320 [0,1,0,0,0,0|2,0,1]=4 1628 B13R1.653 COc1cc(c(cn1)C=C(C)C)C 271570a_100102525489_100011934368 [0,1,0,0,0,0|2,0,1]=4 1629 B13R1.653 COc1cc(c(cn1)C=C(C)C)F 271570a_100102525489_100010136277 [0,1,0,0,0,0|2,0,1]=4 1630 B13R1.653 COc1cc(c(cn1)C=C(C)C)N 271570a_100102525489_100010254562 [0,1,0,0,0,0|2,0,1]=4 1631 B13R1.653 COc1cc(c(cn1)C=C(C)C)O 271570a_100102525489_100010738159 [0,1,0,0,0,0|2,0,1]=4 1632 B13R1.653 COc1cc(c(cn1)CN(C)C)C 270004a_100102631434_100000085380 [0,1,0,0,0,0|3,0,0]=4 1633 B13R1.653 COc1ccc(c(c1)Br)C=C(C)C 271570a_100102525489_100012349170 [0,1,0,0,0,0|1,0,1]=3 1634 B13R1.653 COc1ccc(c(c1)Br)CC(=O)C 1458a_100000070787_100011982828 [0,1,0,0,0,0|0,0,0]=1 1635 B13R1.653 COc1ccc(c(c1)Br)CC(=O)C 1458a_100000238646_200000210301 [0,1,0,0,0,0|0,0,0]=1 1636 B13R1.653 COc1ccc(c(c1)Br)CC(=O)[13CH3] 1458a_100000238646_200025704644 [0,1,0,0,0,0|0,0,0]=1 1637 B13R1.653 COc1ccc(c(c1)Br)CN(C)C 2230a_100102631434_100011982828 [0,1,0,0,0,0|2,0,0]=3 1638 B13R1.653 COc1ccc(c(c1)Br)CN(C)C 269982a_100102631434_100011982828 [0,1,0,0,0,0|2,0,0]=3 1639 B13R1.653 COc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000723261 [0,1,0,0,0,0|2,0,0]=3 1640 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C 11a_100015195136_100015343762 [0,1,0,0,0,0|1,0,0]=2 1641 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C 1626a_100015195136_100015343762 [0,1,0,0,0,0|1,0,0]=2 1642 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C 22a_100015195136_100000070787 [0,1,0,0,0,0|1,0,0]=2 1643 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C 527a_100015195136_100103153847 [0,1,0,0,0,0|1,0,0]=2 1644 B13R1.653 COc1ccc(c(c1)Br)NC(C)C 34a_100015195136_100000210206 [0,1,0,0,0,0|2,0,1]=4 1645 B13R1.653 COc1ccc(c(c1)Br)OC(C)C 34a_100000685887_100000210206 [0,1,0,0,0,0|2,0,1]=4 1646 B13R1.653 COc1ccc(c(c1)Br)OC(C)C 7a_100000685887_100000210206 [0,1,0,0,0,0|2,0,1]=4 1647 B13R1.653 COc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100012349170 [0,1,0,0,0,0|2,0,1]=4 1648 B13R1.653 COc1ccc(c(c1)Br)SC(C)C 62a_100012349170_100000210206 [0,1,0,0,0,0|2,0,1]=4 1649 B13R1.653 COc1ccc(c(c1)C)C=C(C)C 271570a_100102525489_100000759875 [0,1,0,0,0,0|1,0,1]=3 1650 B13R1.653 COc1ccc(c(c1)C)CC(=O)C 1458a_100011996676_200000210301 [0,1,0,0,0,0|0,0,0]=1 1651 B13R1.653 COc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011996676_200025704644 [0,1,0,0,0,0|0,0,0]=1 1652 B13R1.653 COc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100011214997 [0,1,0,0,0,0|2,0,0]=3 1653 B13R1.653 COc1ccc(c(c1)C)NC(=O)C 11a_100000750285_100015343762 [0,1,0,0,0,0|1,0,0]=2 1654 B13R1.653 COc1ccc(c(c1)C)NC(=O)C 1626a_100000750285_100015343762 [0,1,0,0,0,0|1,0,0]=2 1655 B13R1.653 COc1ccc(c(c1)C)NC(=O)C 22a_100000750285_100000070787 [0,1,0,0,0,0|1,0,0]=2 1656 B13R1.653 COc1ccc(c(c1)C)NC(=O)C 527a_100000750285_100103153847 [0,1,0,0,0,0|1,0,0]=2 1657 B13R1.653 COc1ccc(c(c1)C)NC(C)C 34a_100000750285_100000210206 [0,1,0,0,0,0|2,0,1]=4 1658 B13R1.653 COc1ccc(c(c1)C)OC(C)C 34a_100012002223_100000210206 [0,1,0,0,0,0|2,0,1]=4 1659 B13R1.653 COc1ccc(c(c1)C)OC(C)C 7a_100012002223_100000210206 [0,1,0,0,0,0|2,0,1]=4 1660 B13R1.653 COc1ccc(c(c1)C)SC(C)C 62a_100000210206_100000759875 [0,1,0,0,0,0|2,0,1]=4 1661 B13R1.653 COc1ccc(c(c1)C)SC(C)C 62a_100000759875_100000210206 [0,1,0,0,0,0|2,0,1]=4 1662 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 1458a_100000070787_200011830453 [0,1,0,0,0,0|0,0,0]=1 1663 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 1458a_100000688043_200000210301 [0,1,0,0,0,0|0,0,0]=1 1664 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_200000210301 [0,1,0,0,0,0|0,0,0]=1 1665 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_200000210301 [0,1,0,0,0,0|0,0,0]=1 1666 B13R1.653 COc1ccc(c(c1)Cl)CC(=O)[13CH3] 1458a_100000688043_200025704644 [0,1,0,0,0,0|0,0,0]=1 1667 B13R1.653 COc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_200011830453 [0,1,0,0,0,0|2,0,0]=3 1668 B13R1.653 COc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_200011830453 [0,1,0,0,0,0|2,0,0]=3 1669 B13R1.653 COc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100000235372 [0,1,0,0,0,0|2,0,0]=3 1670 B13R1.653 COc1ccc(c(c1)Cl)NC(=O)C 11a_100000747055_100015343762 [0,1,0,0,0,0|1,0,0]=2 1671 B13R1.653 COc1ccc(c(c1)Cl)NC(=O)C 1626a_100000747055_100015343762 [0,1,0,0,0,0|1,0,0]=2 1672 B13R1.653 COc1ccc(c(c1)Cl)NC(=O)C 22a_100000747055_100000070787 [0,1,0,0,0,0|1,0,0]=2 1673 B13R1.653 COc1ccc(c(c1)Cl)NC(=O)C 527a_100000747055_100103153847 [0,1,0,0,0,0|1,0,0]=2 1674 B13R1.653 COc1ccc(c(c1)Cl)NC(C)C 34a_100000747055_100000210206 [0,1,0,0,0,0|2,0,1]=4 1675 B13R1.653 COc1ccc(c(c1)Cl)OC(C)C 34a_100000038596_100000210206 [0,1,0,0,0,0|2,0,1]=4 1676 B13R1.653 COc1ccc(c(c1)Cl)OC(C)C 7a_100000038596_100000210206 [0,1,0,0,0,0|2,0,1]=4 1677 B13R1.653 COc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100000753793 [0,1,0,0,0,0|1,0,1]=3 1678 B13R1.653 COc1ccc(c(c1)F)CC(=O)C 1458a_100000070787_100011260761 [0,1,0,0,0,0|0,0,0]=1 1679 B13R1.653 COc1ccc(c(c1)F)CC(=O)C 1458a_100000709196_200000210301 [0,1,0,0,0,0|0,0,0]=1 1680 B13R1.653 COc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000709196_200025704644 [0,1,0,0,0,0|0,0,0]=1 1681 B13R1.653 COc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011260761 [0,1,0,0,0,0|2,0,0]=3 1682 B13R1.653 COc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011260761 [0,1,0,0,0,0|2,0,0]=3 1683 B13R1.653 COc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011216087 [0,1,0,0,0,0|2,0,0]=3 1684 B13R1.653 COc1ccc(c(c1)F)NC(=O)C 11a_100011299463_100015343762 [0,1,0,0,0,0|1,0,0]=2 1685 B13R1.653 COc1ccc(c(c1)F)NC(=O)C 1626a_100011299463_100015343762 [0,1,0,0,0,0|1,0,0]=2 1686 B13R1.653 COc1ccc(c(c1)F)NC(=O)C 22a_100011299463_100000070787 [0,1,0,0,0,0|1,0,0]=2 1687 B13R1.653 COc1ccc(c(c1)F)NC(=O)C 527a_100011299463_100103153847 [0,1,0,0,0,0|1,0,0]=2 1688 B13R1.653 COc1ccc(c(c1)F)NC(C)C 34a_100011299463_100000210206 [0,1,0,0,0,0|2,0,1]=4 1689 B13R1.653 COc1ccc(c(c1)F)OC(C)C 34a_100000036999_100000210206 [0,1,0,0,0,0|2,0,1]=4 1690 B13R1.653 COc1ccc(c(c1)F)OC(C)C 7a_100000036999_100000210206 [0,1,0,0,0,0|2,0,1]=4 1691 B13R1.653 COc1ccc(c(c1)F)SC(C)C 62a_100000210206_100000753793 [0,1,0,0,0,0|2,0,1]=4 1692 B13R1.653 COc1ccc(c(c1)F)SC(C)C 62a_100000753793_100000210206 [0,1,0,0,0,0|2,0,1]=4 1693 B13R1.653 COc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010159643 [0,1,0,0,0,0|2,0,0]=3 1694 B13R1.653 COc1ccc(c(c1)I)NC(=O)C 11a_100000049804_100015343762 [0,1,0,0,0,0|1,0,0]=2 1695 B13R1.653 COc1ccc(c(c1)I)NC(=O)C 1626a_100000049804_100015343762 [0,1,0,0,0,0|1,0,0]=2 1696 B13R1.653 COc1ccc(c(c1)I)NC(=O)C 22a_100000049804_100000070787 [0,1,0,0,0,0|1,0,0]=2 1697 B13R1.653 COc1ccc(c(c1)I)NC(=O)C 527a_100000049804_100103153847 [0,1,0,0,0,0|1,0,0]=2 1698 B13R1.653 COc1ccc(c(c1)I)NC(C)C 34a_100000049804_100000210206 [0,1,0,0,0,0|2,0,1]=4 1699 B13R1.653 COc1ccc(c(c1)N)C=C(C)C 271570a_100102525489_100000748021 [0,1,0,0,0,0|1,0,1]=3 1700 B13R1.653 COc1ccc(c(c1)N)OC(C)C 34a_100000188146_100000210206 [0,1,0,0,0,0|2,0,1]=4 1701 B13R1.653 COc1ccc(c(c1)N)SC(C)C 62a_100000210206_100000748021 [0,1,0,0,0,0|2,0,1]=4 1702 B13R1.653 COc1ccc(c(c1)N)SC(C)C 62a_100000748021_100000210206 [0,1,0,0,0,0|2,0,1]=4 1703 B13R1.653 COc1ccc(c(c1)O)C=C(C)C 271570a_100102525489_100000719091 [0,1,0,0,0,0|1,0,1]=3 1704 B13R1.653 COc1ccc(c(c1)O)NC(=O)C 22a_100016989039_100000070787 [0,1,0,0,0,0|1,0,0]=2 1705 B13R1.653 COc1ccc(c(c1)O)NC(=O)C 527a_100016989039_100103153847 [0,1,0,0,0,0|1,0,0]=2 1706 B13R1.653 COc1ccc(c(c1)O)NC(C)C 34a_100016989039_100000210206 [0,1,0,0,0,0|2,0,1]=4 1707 B13R1.653 COc1ccc(c(c1)O)SC(C)C 62a_100000210206_100000719091 [0,1,0,0,0,0|2,0,1]=4 1708 B13R1.653 COc1ccc(c(n1)C)C=C(C)C 271570a_100102525489_100000766551 [0,1,0,0,0,0|2,0,1]=4 1709 B13R1.653 COc1ccc(c(n1)C)CN(C)C 270004a_100102631434_100000101190 [0,1,0,0,0,0|3,0,0]=4 1710 B13R1.653 COc1ccc(c(n1)F)C=C(C)C 271570a_100102525489_100010067559 [0,1,0,0,0,0|2,0,1]=4 1711 B13R1.653 COc1ccc(c(n1)N)C=C(C)C 271570a_100102525489_100010187629 [0,1,0,0,0,0|2,0,1]=4 1712 B13R1.653 COc1cnc(c(c1)Br)CN(C)C 270004a_100102631434_200010135874 [0,1,0,0,0,0|3,0,0]=4 1713 B13R1.653 COc1cnc(c(c1)C)C=C(C)C 271570a_100102525489_200009851512 [0,1,0,0,0,0|2,0,1]=4 1714 B13R1.653 COc1cnc(c(c1)N)C=C(C)C 271570a_100102525489_100010074831 [0,1,0,0,0,0|2,0,1]=4 1715 B13R1.653 CSc1ccc(c(c1)C)NC(=O)C 62a_200000210301_100000152120 [0,1,0,0,0,0|1,1,0]=3 1716 B13R1.653 CSc1ccc(c(c1)Cl)NC(=O)C 62a_200000210301_100011273303 [0,1,0,0,0,0|1,1,0]=3 1717 B13R1.653 CSc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100009816902 [0,1,0,0,0,0|1,1,1]=4 1718 B13R1.653 CSc1ccc(c(c1)F)CN(C)C 62a_100000174744_200000210301 [0,1,0,0,0,0|2,1,0]=4 1719 B13R1.653 CSc1ccc(c(c1)F)CN(C)C 62a_200000210301_100000174744 [0,1,0,0,0,0|2,1,0]=4 1720 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 11a_100012056844_100015343762 [0,1,0,0,0,0|1,1,0]=3 1721 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 1626a_100012056844_100015343762 [0,1,0,0,0,0|1,1,0]=3 1722 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 22a_100012056844_100000070787 [0,1,0,0,0,0|1,1,0]=3 1723 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 527a_100012056844_100103153847 [0,1,0,0,0,0|1,1,0]=3 1724 B13R1.653 CSc1ccc(c(c1)F)NC(=O)C 62a_200000210301_100000155584 [0,1,0,0,0,0|1,1,0]=3 1725 B13R1.653 CSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_200000210301 [0,1,0,0,0,0|1,1,0]=3 1726 B13R1.653 CSc1ccc(c(c1)F)OC(=O)C 62a_200000210301_100009811628 [0,1,0,0,0,0|1,1,0]=3 1727 B13R1.653 CSc1cnc(c(c1)C)NC(=O)C 62a_200000210301_200011934169 [0,1,0,0,0,0|2,1,0]=4 1728 B13R2.16 CSc1ccc(cc1)C2CC2N 62a_100000755575_200000210301 [0,0,0,1,0,0|1,1,1]=4 1729 B13R2.16 CSc1ccc(cc1)C2CC2N 62a_200000210301_100000755575 [0,0,0,1,0,0|1,1,1]=4 1730 B13R2.16 [13CH3]Sc1ccc(cc1)C2CC2N 62a_100000755575_200025704644 [0,0,0,1,0,0|1,1,1]=4 1731 B13R2.16 [13CH3]Sc1ccc(cc1)C2CC2N 62a_200025704644_100000755575 [0,0,0,1,0,0|1,1,1]=4 1732 B13R2.184 COc1ccc(cc1)NC2CC2 34a_100000184247_100000211595 [0,0,0,1,0,0|2,0,1]=4 1733 B13R2.184 COc1ccc(cc1)OC2CC2 34a_100000210503_100000211595 [0,0,0,1,0,0|2,0,1]=4 1734 B13R2.1279 CC(=Cc1ccc2c(c1)CC2)C 271570a_100102525489_100009818592 [0,0,0,1,0,0|2,0,1]=4 1735 B13R2.1279 CN(C)Cc1ccc2c(c1)CC2 270004a_100102631434_100010273998 [0,0,0,1,0,0|3,0,0]=4 1736 B13R2.2121 C=Cc1ccc2c(c1)CC(=O)C2 271570a_100011290941_100010185598 [0,0,0,1,0,0|1,0,1]=3 1737 B13R2.2121 C=Cc1ccc2c(c1)CC(=O)N2 271570a_100011290941_100000754858 [0,0,0,1,0,0|2,0,1]=4 1738 B13R2.2121 C=Cc1ccc2c(c1)NC(=O)C2 271570a_100011290941_100000760487 [0,0,0,1,0,0|2,0,1]=4 1739 B13R2.2121 CNc1ccc2nc(oc2c1)C 34a_100000736495_200000210301 [0,0,0,1,0,0|2,0,1]=4 1740 B13R2.2121 CNc1ccc2oc(nc2c1)C 34a_100000195416_200000210301 [0,0,0,1,0,0|3,0,0]=4 1741 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [0,0,0,1,0,0|2,0,0]=3 1742 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,0,0,1,0,0|2,0,0]=3 1743 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,0,0,1,0,0|2,0,0]=3 1744 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 34a_100000035078_200000210301 [0,0,0,1,0,0|1,0,0]=2 1745 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 7a_100000035078_200000210301 [0,0,0,1,0,0|1,0,0]=2 1746 B13R2.2121 COc1ccc2c(c1)CN(C2)C 269982a_100000051402_200000210301 [0,0,0,1,0,0|2,0,0]=3 1747 B13R2.2121 COc1ccc2c(c1)CN(C2)C 34a_100000051402_200000210301 [0,0,0,1,0,0|2,0,0]=3 1748 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 269982a_100000051402_200025704644 [0,0,0,1,0,0|2,0,0]=3 1749 B13R2.2121 COc1ccc2c(c1)CN(C2)[13CH3] 34a_100000051402_200025704644 [0,0,0,1,0,0|2,0,0]=3 1750 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,0,0,1,0,0|1,0,1]=3 1751 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [0,0,0,1,0,0|0,0,2]=3 1752 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [0,0,0,1,0,0|0,0,2]=3 1753 B13R2.2121 COc1ccc2nc(oc2c1)C 34a_100000116946_200000210301 [0,0,0,1,0,0|1,0,1]=3 1754 B13R2.2121 COc1ccc2nc(oc2c1)C 7a_100000116946_200000210301 [0,0,0,1,0,0|1,0,1]=3 1755 B13R2.2121 COc1ccc2nc(sc2c1)Br 7a_100010063415_200000210301 [0,0,0,1,0,0|2,1,0]=4 1756 B13R2.2121 COc1ccc2nc(sc2c1)C 34a_100000008955_200000210301 [0,0,0,1,0,0|1,1,0]=3 1757 B13R2.2121 COc1ccc2nc(sc2c1)C 7a_100000008955_200000210301 [0,0,0,1,0,0|1,1,0]=3 1758 B13R2.2121 COc1ccc2nc(sc2c1)N 7a_100000012012_200000210301 [0,0,0,1,0,0|2,1,0]=4 1759 B13R2.2121 COc1ccc2nc(sc2c1)O 271570a_203496583355_100010195960 [0,0,0,1,0,0|2,0,1]=4 1760 B13R2.2121 COc1ccc2nn(cc2c1)C 34a_100000106843_200000210301 [0,0,0,1,0,0|3,0,0]=4 1761 B13R2.2121 COc1ccc2oc(nc2c1)C 34a_100000102623_200000210301 [0,0,0,1,0,0|2,0,0]=3 1762 B13R2.2121 COc1ccc2oc(nc2c1)C 7a_100000102623_200000210301 [0,0,0,1,0,0|2,0,0]=3 1763 B13R2.2121 COc1ccc2oc(nc2c1)Cl 34a_100010673232_200000210301 [0,0,0,1,0,0|3,0,0]=4 1764 B13R2.2121 COc1ccc2oc(nc2c1)Cl 7a_100010673232_200000210301 [0,0,0,1,0,0|3,0,0]=4 1765 B13R2.2121 COc1ccc2sc(nc2c1)C 34a_100000031546_200000210301 [0,0,0,1,0,0|2,0,0]=3 1766 B13R2.2121 COc1ccc2sc(nc2c1)C 7a_100000031546_200000210301 [0,0,0,1,0,0|2,0,0]=3 1767 B13R2.2121 COc1ccc2sc(nc2c1)N 7a_100000066538_200000210301 [0,0,0,1,0,0|3,0,0]=4 1768 B13R2.2121 COc1ccn2cc(nc2c1)C 34a_106256048495_200000210301 [0,0,0,1,0,0|2,0,1]=4 1769 B13R2.2121 CSc1cc2c(cn1)CC(=O)N2 62a_200000210301_100000089690 [0,0,0,1,0,0|2,1,0]=4 1770 B13R2.2121 CSc1cc2c(cn1)NC(=O)C2 62a_200000210301_100000104063 [0,0,0,1,0,0|2,1,0]=4 1771 B13R2.2121 CSc1ccc2[nH]c(=O)[nH]c2c1 62a_200000210301_200011356815 [0,0,0,1,0,0|2,1,0]=4 1772 B13R2.2121 CSc1ccc2[nH]c(=O)oc2c1 62a_200000210301_100000697996 [0,0,0,1,0,0|2,1,0]=4 1773 B13R2.2121 CSc1ccc2[nH]c(cc2c1)C 62a_200000210301_100011214893 [0,0,0,1,0,0|2,1,0]=4 1774 B13R2.2121 CSc1ccc2[nH]c(nc2c1)C 62a_200000210301_100011264012 [0,0,0,1,0,0|2,1,0]=4 1775 B13R2.2121 CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_200000210301 [0,0,0,1,0,0|0,1,0]=2 1776 B13R2.2121 CSc1ccc2c(c1)CC(=O)N2 62a_200000210301_100000754858 [0,0,0,1,0,0|1,1,0]=3 1777 B13R2.2121 CSc1ccc2c(c1)CC(C2)N 62a_100015193702_200000210301 [0,0,0,1,0,0|1,1,1]=4 1778 B13R2.2121 CSc1ccc2c(c1)CC(C2)N 62a_200000210301_100015193702 [0,0,0,1,0,0|1,1,1]=4 1779 B13R2.2121 CSc1ccc2c(c1)CC(C2)O 62a_100010161096_200000210301 [0,0,0,1,0,0|0,1,2]=4 1780 B13R2.2121 CSc1ccc2c(c1)CC(C2)O 62a_200000210301_100010161096 [0,0,0,1,0,0|0,1,2]=4 1781 B13R2.2121 CSc1ccc2c(c1)NC(=O)C2 62a_200000210301_100000760487 [0,0,0,1,0,0|1,1,0]=3 1782 B13R2.2121 CSc1ccc2c(n1)CC(=O)N2 62a_200000210301_100000087150 [0,0,0,1,0,0|2,1,0]=4 1783 B13R2.2121 CSc1ccc2c(n1)NC(=O)C2 62a_200000210301_100000104062 [0,0,0,1,0,0|2,1,0]=4 1784 B13R2.2121 CSc1ccc2cc([nH]c2c1)C 62a_200000210301_100010196937 [0,0,0,1,0,0|1,1,1]=4 1785 B13R2.2121 CSc1ccc2nc(oc2c1)C 62a_200000210301_100010171164 [0,0,0,1,0,0|1,1,1]=4 1786 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_100009813144_200000210301 [0,0,0,1,0,0|1,2,0]=4 1787 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_200000210301_100009813144 [0,0,0,1,0,0|1,2,0]=4 1788 B13R2.2121 CSc1ccc2oc(nc2c1)C 62a_200000210301_100009816932 [0,0,0,1,0,0|2,1,0]=4 1789 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_100000695401_200000210301 [0,0,0,1,0,0|2,1,0]=4 1790 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_200000210301_100000695401 [0,0,0,1,0,0|2,1,0]=4 1791 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_100009813953_200000210301 [0,0,0,1,0,0|2,1,0]=4 1792 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_200000210301_100009813953 [0,0,0,1,0,0|2,1,0]=4 1793 B13R2.2121 CSc1cnc2c(c1)CC(=O)N2 62a_200000210301_100010177629 [0,0,0,1,0,0|2,1,0]=4 1794 B13R2.2121 CSc1cnc2c(c1)NC(=O)C2 62a_200000210301_100010168558 [0,0,0,1,0,0|2,1,0]=4 1795 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,0,0,1,0,0|2,0,0]=3 1796 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,0,0,1,0,0|2,0,0]=3 1797 B13R2.2121 Cc1cc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011214893 [0,0,0,1,0,0|2,1,0]=4 1798 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_100000695401_200025704644 [0,0,0,1,0,0|2,1,0]=4 1799 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_200025704644_100000695401 [0,0,0,1,0,0|2,1,0]=4 1800 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,0,0,1,0,0|1,0,1]=3 1801 B13R2.2121 Cc1cc2ccc(cc2[nH]1)S[13CH3] 62a_200025704644_100010196937 [0,0,0,1,0,0|1,1,1]=4 1802 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [0,0,0,1,0,0|0,0,2]=3 1803 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [0,0,0,1,0,0|0,0,2]=3 1804 B13R2.2121 Cc1cn2ccc(cc2n1)O[13CH3] 34a_106256048495_200025704644 [0,0,0,1,0,0|2,0,1]=4 1805 B13R2.2121 Cc1nc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011264012 [0,0,0,1,0,0|2,1,0]=4 1806 B13R2.2121 Cc1nc2cc(ccc2o1)N[13CH3] 34a_100000195416_200025704644 [0,0,0,1,0,0|3,0,0]=4 1807 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 34a_100000102623_200025704644 [0,0,0,1,0,0|2,0,0]=3 1808 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 7a_100000102623_200025704644 [0,0,0,1,0,0|2,0,0]=3 1809 B13R2.2121 Cc1nc2cc(ccc2o1)S[13CH3] 62a_200025704644_100009816932 [0,0,0,1,0,0|2,1,0]=4 1810 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 34a_100000031546_200025704644 [0,0,0,1,0,0|2,0,0]=3 1811 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 7a_100000031546_200025704644 [0,0,0,1,0,0|2,0,0]=3 1812 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_100009813953_200025704644 [0,0,0,1,0,0|2,1,0]=4 1813 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_200025704644_100009813953 [0,0,0,1,0,0|2,1,0]=4 1814 B13R2.2121 Cc1nc2ccc(cc2o1)N[13CH3] 34a_100000736495_200025704644 [0,0,0,1,0,0|2,0,1]=4 1815 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 34a_100000116946_200025704644 [0,0,0,1,0,0|1,0,1]=3 1816 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 7a_100000116946_200025704644 [0,0,0,1,0,0|1,0,1]=3 1817 B13R2.2121 Cc1nc2ccc(cc2o1)S[13CH3] 62a_200025704644_100010171164 [0,0,0,1,0,0|1,1,1]=4 1818 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 34a_100000008955_200025704644 [0,0,0,1,0,0|1,1,0]=3 1819 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 7a_100000008955_200025704644 [0,0,0,1,0,0|1,1,0]=3 1820 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_100009813144_200025704644 [0,0,0,1,0,0|1,2,0]=4 1821 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_200025704644_100009813144 [0,0,0,1,0,0|1,2,0]=4 1822 B13R2.2121 Cn1cc2cc(ccc2n1)O[13CH3] 34a_100000106843_200025704644 [0,0,0,1,0,0|3,0,0]=4 1823 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [0,0,0,1,0,0|2,0,0]=3 1824 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 34a_100000035078_200025704644 [0,0,0,1,0,0|1,0,0]=2 1825 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_200025704644 [0,0,0,1,0,0|1,0,0]=2 1826 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)Br 7a_100010063415_200025704644 [0,0,0,1,0,0|2,1,0]=4 1827 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)N 7a_100000012012_200025704644 [0,0,0,1,0,0|2,1,0]=4 1828 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 34a_100010673232_200025704644 [0,0,0,1,0,0|3,0,0]=4 1829 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 7a_100010673232_200025704644 [0,0,0,1,0,0|3,0,0]=4 1830 B13R2.2121 [13CH3]Oc1ccc2sc(nc2c1)N 7a_100000066538_200025704644 [0,0,0,1,0,0|3,0,0]=4 1831 B13R2.2121 [13CH3]Sc1cc2c(cn1)CC(=O)N2 62a_200025704644_100000089690 [0,0,0,1,0,0|2,1,0]=4 1832 B13R2.2121 [13CH3]Sc1cc2c(cn1)NC(=O)C2 62a_200025704644_100000104063 [0,0,0,1,0,0|2,1,0]=4 1833 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)[nH]c2c1 62a_200025704644_200011356815 [0,0,0,1,0,0|2,1,0]=4 1834 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)oc2c1 62a_200025704644_100000697996 [0,0,0,1,0,0|2,1,0]=4 1835 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)C2 62a_100010185598_200025704644 [0,0,0,1,0,0|0,1,0]=2 1836 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)N2 62a_200025704644_100000754858 [0,0,0,1,0,0|1,1,0]=3 1837 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)N 62a_100015193702_200025704644 [0,0,0,1,0,0|1,1,1]=4 1838 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)N 62a_200025704644_100015193702 [0,0,0,1,0,0|1,1,1]=4 1839 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)O 62a_100010161096_200025704644 [0,0,0,1,0,0|0,1,2]=4 1840 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(C2)O 62a_200025704644_100010161096 [0,0,0,1,0,0|0,1,2]=4 1841 B13R2.2121 [13CH3]Sc1ccc2c(c1)NC(=O)C2 62a_200025704644_100000760487 [0,0,0,1,0,0|1,1,0]=3 1842 B13R2.2121 [13CH3]Sc1ccc2c(n1)CC(=O)N2 62a_200025704644_100000087150 [0,0,0,1,0,0|2,1,0]=4 1843 B13R2.2121 [13CH3]Sc1ccc2c(n1)NC(=O)C2 62a_200025704644_100000104062 [0,0,0,1,0,0|2,1,0]=4 1844 B13R2.2121 [13CH3]Sc1cnc2c(c1)CC(=O)N2 62a_200025704644_100010177629 [0,0,0,1,0,0|2,1,0]=4 1845 B13R2.2121 [13CH3]Sc1cnc2c(c1)NC(=O)C2 62a_200025704644_100010168558 [0,0,0,1,0,0|2,1,0]=4 1846 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [0,0,0,0,1,0|1,0,1]=3 1847 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [0,0,0,0,1,0|1,0,1]=3 1848 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [0,0,0,0,1,0|3,0,0]=4 1849 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [0,0,0,0,1,0|3,0,0]=4 1850 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,0,0,0,1,0|2,0,0]=3 1851 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [0,0,0,0,1,0|3,0,0]=4 1852 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [0,0,0,0,1,0|3,0,0]=4 1853 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,0,0,0,1,0|3,0,0]=4 1854 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [0,0,0,0,1,0|2,0,0]=3 1855 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [0,0,0,0,1,0|3,0,0]=4 1856 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [0,0,0,0,1,0|1,0,0]=2 1857 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [0,0,0,0,1,0|1,0,0]=2 1858 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [0,0,0,0,1,0|1,0,0]=2 1859 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [0,0,0,0,1,0|1,0,0]=2 1860 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [0,0,0,0,1,0|1,0,0]=2 1861 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [0,0,0,0,1,0|1,1,0]=3 1862 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [0,0,0,0,1,0|1,1,0]=3 1863 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [0,0,0,0,1,0|1,1,0]=3 1864 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [0,0,0,0,1,0|1,1,0]=3 1865 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [0,0,0,0,1,0|1,1,0]=3 1866 B11R1.3 C=C(C)c1ccc(cn1)CC 271570a_100000694244_100009843584 [0,0,0,0,1,0|3,0,0]=4 1867 B11R1.3 C=C(C)c1ccc(cn1)NC 271570a_100000694244_100000764248 [0,0,0,0,1,0|3,0,0]=4 1868 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [0,0,0,0,1,0|2,0,0]=3 1869 B11R1.3 C=C(C)c1ccc(cn1)SC 271570a_100000694244_100009820866 [0,0,0,0,1,0|2,1,0]=4 1870 B11R1.3 C=C(C)c1ccc(nc1)CC 271570a_100000694244_100009820025 [0,0,0,0,1,0|3,0,0]=4 1871 B11R1.3 C=C(C)c1ccc(nc1)NC 271570a_100000694244_100000741341 [0,0,0,0,1,0|3,0,0]=4 1872 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [0,0,0,0,1,0|2,0,0]=3 1873 B11R1.3 C=C(C)c1ccc(nc1)SC 271570a_100000694244_100011408404 [0,0,0,0,1,0|2,1,0]=4 1874 B11R1.3 C=C(C)c1ccc(nn1)OC 271570a_100000694244_100009819040 [0,0,0,0,1,0|3,0,0]=4 1875 B11R1.3 C=C(C)c1cnc(cn1)OC 271570a_100000694244_100011998698 [0,0,0,0,1,0|3,0,0]=4 1876 B11R1.3 C=C(C)c1cnc(nc1)OC 271570a_100000694244_100000686852 [0,0,0,0,1,0|3,0,0]=4 1877 B11R1.3 C=C(C)c1ncc(cn1)OC 271570a_100000694244_100000069167 [0,0,0,0,1,0|3,0,0]=4 1878 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [0,0,0,0,1,0|2,0,1]=4 1879 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [0,0,0,0,1,0|1,0,1]=3 1880 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [0,0,0,0,1,0|1,0,1]=3 1881 B11R1.3 C=Cc1ccc(cc1)C(=O)N 271570a_100011290941_100000162191 [0,0,0,0,1,0|2,0,1]=4 1882 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [0,0,0,0,1,0|1,0,1]=3 1883 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [0,0,0,0,1,0|2,0,1]=4 1884 B11R1.3 C=Cc1ccc(cn1)C(=O)C 271570a_100011290941_100000684857 [0,0,0,0,1,0|2,0,1]=4 1885 B11R1.3 C=Cc1ccc(nc1)C(=O)C 271570a_100011290941_100000686046 [0,0,0,0,1,0|2,0,1]=4 1886 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [0,0,0,0,1,0|2,0,0]=3 1887 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [0,0,0,0,1,0|2,0,0]=3 1888 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [0,0,0,0,1,0|0,0,0]=1 1889 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [0,0,0,0,1,0|0,0,0]=1 1890 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [0,0,0,0,1,0|0,1,0]=2 1891 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [0,0,0,0,1,0|0,1,0]=2 1892 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [0,0,0,0,1,0|1,0,0]=2 1893 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [0,0,0,0,1,0|1,0,0]=2 1894 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [0,0,0,0,1,0|1,1,0]=3 1895 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [0,0,0,0,1,0|1,1,0]=3 1896 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [0,0,0,0,1,0|1,1,0]=3 1897 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [0,0,0,0,1,0|1,1,0]=3 1898 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_100009883172_200025704644 [0,0,0,0,1,0|2,1,0]=4 1899 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_200025704644_100009883172 [0,0,0,0,1,0|2,1,0]=4 1900 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_100000099681_200025704644 [0,0,0,0,1,0|2,1,0]=4 1901 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_200025704644_100000099681 [0,0,0,0,1,0|2,1,0]=4 1902 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_100010077182_200025704644 [0,0,0,0,1,0|2,1,0]=4 1903 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100010077182 [0,0,0,0,1,0|2,1,0]=4 1904 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 2230a_100000210773_200025704644 [0,0,0,0,1,0|2,0,1]=4 1905 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 34a_100000210773_200025704644 [0,0,0,0,1,0|2,0,1]=4 1906 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 7a_100000210773_200025704644 [0,0,0,0,1,0|2,0,1]=4 1907 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [0,0,0,0,1,0|1,0,1]=3 1908 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [0,0,0,0,1,0|1,0,1]=3 1909 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_100000750031_200025704644 [0,0,0,0,1,0|1,1,1]=4 1910 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000750031 [0,0,0,0,1,0|1,1,1]=4 1911 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 2230a_100011216399_200025704644 [0,0,0,0,1,0|1,0,2]=4 1912 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 34a_100011216399_200025704644 [0,0,0,0,1,0|1,0,2]=4 1913 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [0,0,0,0,1,0|0,0,2]=3 1914 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [0,0,0,0,1,0|0,0,2]=3 1915 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_100000745893_200025704644 [0,0,0,0,1,0|0,1,2]=4 1916 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000745893 [0,0,0,0,1,0|0,1,2]=4 1917 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,0,0,0,1,0|1,0,0]=2 1918 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,0,0,0,1,0|1,0,0]=2 1919 B11R1.3 CN(C)c1ccc(cc1)N[13CH3] 34a_100016997997_200025704644 [0,0,0,0,1,0|3,0,0]=4 1920 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [0,0,0,0,1,0|2,0,0]=3 1921 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_100000210421_200025704644 [0,0,0,0,1,0|2,1,0]=4 1922 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000210421 [0,0,0,0,1,0|2,1,0]=4 1923 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [0,0,0,0,1,0|2,0,0]=3 1924 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [0,0,0,0,1,0|2,0,0]=3 1925 B11R1.3 CNc1ccc(cc1)C(C)C 2230a_100000210773_200000210301 [0,0,0,0,1,0|2,0,1]=4 1926 B11R1.3 CNc1ccc(cc1)C(C)C 34a_100000210773_200000210301 [0,0,0,0,1,0|2,0,1]=4 1927 B11R1.3 CNc1ccc(cc1)C(C)C 7a_100000210773_200000210301 [0,0,0,0,1,0|2,0,1]=4 1928 B11R1.3 CNc1ccc(cc1)C(C)O 2230a_100011216399_200000210301 [0,0,0,0,1,0|1,0,2]=4 1929 B11R1.3 CNc1ccc(cc1)C(C)O 34a_100011216399_200000210301 [0,0,0,0,1,0|1,0,2]=4 1930 B11R1.3 CNc1ccc(cc1)N(C)C 34a_100016997997_200000210301 [0,0,0,0,1,0|3,0,0]=4 1931 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200000210301 [0,0,0,0,1,0|3,0,0]=4 1932 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200000210301 [0,0,0,0,1,0|3,0,0]=4 1933 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [0,0,0,0,1,0|2,0,0]=3 1934 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [0,0,0,0,1,0|3,0,0]=4 1935 B11R1.3 CNc1cnc(cn1)C(=O)C 27a_100102657272_100009883172 [0,0,0,0,1,0|3,0,0]=4 1936 B11R1.3 CNc1ncc(cn1)C(=O)C 27a_100102657272_100000099681 [0,0,0,0,1,0|3,0,0]=4 1937 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [0,0,0,0,1,0|0,0,0]=1 1938 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [0,0,0,0,1,0|0,0,0]=1 1939 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [0,0,0,0,1,0|0,0,0]=1 1940 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [0,0,0,0,1,0|1,0,0]=2 1941 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [0,0,0,0,1,0|1,0,0]=2 1942 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [0,0,0,0,1,0|0,0,0]=1 1943 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [0,0,0,0,1,0|1,0,1]=3 1944 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [0,0,0,0,1,0|1,0,1]=3 1945 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [0,0,0,0,1,0|0,0,2]=3 1946 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [0,0,0,0,1,0|0,0,2]=3 1947 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [0,0,0,0,1,0|2,0,0]=3 1948 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [0,0,0,0,1,0|2,0,0]=3 1949 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [0,0,0,0,1,0|2,0,0]=3 1950 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [0,0,0,0,1,0|2,0,0]=3 1951 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [0,0,0,0,1,0|2,0,0]=3 1952 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [0,0,0,0,1,0|2,0,0]=3 1953 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [0,0,0,0,1,0|2,0,0]=3 1954 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [0,0,0,0,1,0|1,0,0]=2 1955 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [0,0,0,0,1,0|1,0,0]=2 1956 B11R1.3 COc1ccc(cc1)[C@H](C)N 34a_100161106496_200000210301 [0,0,0,0,1,0|1,0,1]=3 1957 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [0,0,0,0,1,0|2,0,0]=3 1958 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [0,0,0,0,1,0|2,0,0]=3 1959 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [0,0,0,0,1,0|2,0,0]=3 1960 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [0,0,0,0,1,0|2,0,0]=3 1961 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [0,0,0,0,1,0|1,0,0]=2 1962 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [0,0,0,0,1,0|1,0,0]=2 1963 B11R1.3 COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_200000210301 [0,0,0,0,1,0|3,0,0]=4 1964 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [0,0,0,0,1,0|1,0,0]=2 1965 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [0,0,0,0,1,0|1,0,0]=2 1966 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [0,0,0,0,1,0|1,1,0]=3 1967 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [0,0,0,0,1,0|0,1,0]=2 1968 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [0,0,0,0,1,0|0,1,0]=2 1969 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [0,0,0,0,1,0|0,1,0]=2 1970 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [0,0,0,0,1,0|1,1,0]=3 1971 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [0,0,0,0,1,0|1,1,0]=3 1972 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [0,0,0,0,1,0|0,1,0]=2 1973 B11R1.3 CSc1ccc(cc1)C(C)C 62a_100000750031_200000210301 [0,0,0,0,1,0|1,1,1]=4 1974 B11R1.3 CSc1ccc(cc1)C(C)C 62a_200000210301_100000750031 [0,0,0,0,1,0|1,1,1]=4 1975 B11R1.3 CSc1ccc(cc1)C(C)O 62a_100000745893_200000210301 [0,0,0,0,1,0|0,1,2]=4 1976 B11R1.3 CSc1ccc(cc1)C(C)O 62a_200000210301_100000745893 [0,0,0,0,1,0|0,1,2]=4 1977 B11R1.3 CSc1ccc(cc1)N(C)C 62a_100000210421_200000210301 [0,0,0,0,1,0|2,1,0]=4 1978 B11R1.3 CSc1ccc(cc1)N(C)C 62a_200000210301_100000210421 [0,0,0,0,1,0|2,1,0]=4 1979 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [0,0,0,0,1,0|1,1,0]=3 1980 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_100000720352_200000210301 [0,0,0,0,1,0|1,1,1]=4 1981 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_200000210301_100000720352 [0,0,0,0,1,0|1,1,1]=4 1982 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_100000753911_200000210301 [0,0,0,0,1,0|1,1,1]=4 1983 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_200000210301_100000753911 [0,0,0,0,1,0|1,1,1]=4 1984 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [0,0,0,0,1,0|1,1,0]=3 1985 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [0,0,0,0,1,0|1,1,0]=3 1986 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [0,0,0,0,1,0|2,1,0]=4 1987 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [0,0,0,0,1,0|2,1,0]=4 1988 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [0,0,0,0,1,0|1,1,0]=3 1989 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [0,0,0,0,1,0|1,1,0]=3 1990 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [0,0,0,0,1,0|2,1,0]=4 1991 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [0,0,0,0,1,0|2,1,0]=4 1992 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_100009883172_200000210301 [0,0,0,0,1,0|2,1,0]=4 1993 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_200000210301_100009883172 [0,0,0,0,1,0|2,1,0]=4 1994 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_100010077182_200000210301 [0,0,0,0,1,0|2,1,0]=4 1995 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_200000210301_100010077182 [0,0,0,0,1,0|2,1,0]=4 1996 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_100000099681_200000210301 [0,0,0,0,1,0|2,1,0]=4 1997 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_200000210301_100000099681 [0,0,0,0,1,0|2,1,0]=4 1998 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_100000720352_200025704644 [0,0,0,0,1,0|1,1,1]=4 1999 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000720352 [0,0,0,0,1,0|1,1,1]=4 2000 B11R1.3 C[C@H](N)c1ccc(cc1)O[13CH3] 34a_100161106496_200025704644 [0,0,0,0,1,0|1,0,1]=3 2001 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_100000753911_200025704644 [0,0,0,0,1,0|1,1,1]=4 2002 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753911 [0,0,0,0,1,0|1,1,1]=4 2003 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [0,0,0,0,1,0|2,0,0]=3 2004 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [0,0,0,0,1,0|2,0,0]=3 2005 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [0,0,0,0,1,0|2,0,0]=3 2006 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [0,0,0,0,1,0|2,0,0]=3 2007 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [0,0,0,0,1,0|2,0,0]=3 2008 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200025704644 [0,0,0,0,1,0|3,0,0]=4 2009 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200025704644 [0,0,0,0,1,0|3,0,0]=4 2010 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [0,0,0,0,1,0|1,0,0]=2 2011 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [0,0,0,0,1,0|1,0,0]=2 2012 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [0,0,0,0,1,0|2,0,0]=3 2013 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [0,0,0,0,1,0|2,0,0]=3 2014 B11R1.3 [13CH3]Oc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_200025704644 [0,0,0,0,1,0|3,0,0]=4 2015 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [0,0,0,0,1,0|1,1,0]=3 2016 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [0,0,0,0,1,0|1,1,0]=3 2017 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [0,0,0,0,1,0|2,1,0]=4 2018 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [0,0,0,0,1,0|2,1,0]=4 2019 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [0,0,0,0,1,0|2,1,0]=4 2020 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [0,0,0,0,1,0|2,1,0]=4 2021 B11R1.43 CC(=O)Cc1ccc(o1)C#N 1458a_100000070787_100009822536 [0,0,0,0,1,0|3,0,0]=4 2022 B11R1.43 CC(=O)Cc1ccc(o1)C=O 1458a_100000070787_200000079136 [0,0,0,0,1,0|3,0,0]=4 2023 B11R1.43 CC(=O)Cc1ccc(s1)C#N 1458a_100000070787_100010188212 [0,0,0,0,1,0|3,0,0]=4 2024 B11R1.43 CC(=O)Cc1csc(c1)C=O 1458a_100000070787_100000070824 [0,0,0,0,1,0|3,0,0]=4 2025 B11R1.43 CC(=O)Cn1cc(cn1)S[13CH3] 62a_100000763327_200025704644 [0,0,0,0,1,0|2,1,0]=4 2026 B11R1.43 CC(=O)Cn1cc(cn1)S[13CH3] 62a_200025704644_100000763327 [0,0,0,0,1,0|2,1,0]=4 2027 B11R1.43 CC(=O)Nc1ccc(s1)S[13CH3] 62a_200025704644_100010002808 [0,0,0,0,1,0|2,1,0]=4 2028 B11R1.43 CCc1cc(on1)CC(=O)C 1458a_100000070787_100012000519 [0,0,0,0,1,0|3,0,0]=4 2029 B11R1.43 CCc1nc(cs1)CC(=O)C 1458a_100000070787_100020603300 [0,0,0,0,1,0|3,0,0]=4 2030 B11R1.43 CCn1ccc(n1)CC(=O)C 1458a_100000070787_100000094151 [0,0,0,0,1,0|3,0,0]=4 2031 B11R1.43 COc1nnc(s1)CC(=O)C 1458a_100000070787_100000744270 [0,0,0,0,1,0|3,0,0]=4 2032 B11R1.43 CSc1ccc(s1)NC(=O)C 62a_200000210301_100010002808 [0,0,0,0,1,0|2,1,0]=4 2033 B11R1.43 CSc1cnn(c1)CC(=O)C 62a_100000763327_200000210301 [0,0,0,0,1,0|2,1,0]=4 2034 B11R1.43 CSc1cnn(c1)CC(=O)C 62a_200000210301_100000763327 [0,0,0,0,1,0|2,1,0]=4 2035 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 11a_100015199678_100015343762 [0,0,0,0,0,1|1,0,1]=3 2036 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 1626a_100015199678_100015343762 [0,0,0,0,0,1|1,0,1]=3 2037 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 240690a_100015199678_100015343762 [0,0,0,0,0,1|1,0,1]=3 2038 B13R1.3 C#Cc1ccc(cc1)CNC(=O)C 527a_100015199678_100103153847 [0,0,0,0,0,1|1,0,1]=3 2039 B13R1.3 C#Cc1ccc(cc1)NCC(=C)C 34a_100011215031_100000748629 [0,0,0,0,0,1|2,0,1]=4 2040 B13R1.3 C#Cc1ccc(cc1)NCC(=O)N 34a_100011215031_100000187820 [0,0,0,0,0,1|2,0,1]=4 2041 B13R1.3 C#Cc1ccc(cc1)NCC(=O)[O-] 34a_100011215031_100020667443 [0,0,0,0,0,1|2,0,1]=4 2042 B13R1.3 C=C(C)CNc1ccc(cc1)C#N 34a_100000185469_100000748629 [0,0,0,0,0,1|3,0,0]=4 2043 B13R1.3 C=C(C)CNc1ccc(cc1)CC 2230a_100000211069_100000748629 [0,0,0,0,0,1|2,0,0]=3 2044 B13R1.3 C=C(C)CNc1ccc(cc1)CC 34a_100000211069_100000748629 [0,0,0,0,0,1|2,0,0]=3 2045 B13R1.3 C=C(C)CNc1ccc(cc1)CO 2230a_100011215238_100000748629 [0,0,0,0,0,1|3,0,0]=4 2046 B13R1.3 C=C(C)CNc1ccc(cc1)CO 34a_100011215238_100000748629 [0,0,0,0,0,1|3,0,0]=4 2047 B13R1.3 C=C(C)CNc1ccc(cc1)OC 34a_100000184247_100000748629 [0,0,0,0,0,1|1,0,0]=2 2048 B13R1.3 C=C(C)CNc1ccc(cc1)SC 34a_100000212337_100000748629 [0,0,0,0,0,1|1,1,0]=3 2049 B13R1.3 C=C(C)CNc1ccc(cn1)SC 27a_100000765925_100009820866 [0,0,0,0,0,1|2,1,0]=4 2050 B13R1.3 C=C(C)CNc1ccc(nn1)OC 27a_100000765925_100010231723 [0,0,0,0,0,1|3,0,0]=4 2051 B13R1.3 C=C(C)CNc1ncc(cn1)OC 27a_100000765925_100000069167 [0,0,0,0,0,1|3,0,0]=4 2052 B13R1.3 C=C(C)COc1ccc(cc1)C#N 34a_100000210344_100000748629 [0,0,0,0,0,1|3,0,0]=4 2053 B13R1.3 C=C(C)COc1ccc(cc1)C#N 7a_100000210344_100000748629 [0,0,0,0,0,1|3,0,0]=4 2054 B13R1.3 C=C(C)COc1ccc(cc1)CC 34a_100000211359_100000748629 [0,0,0,0,0,1|2,0,0]=3 2055 B13R1.3 C=C(C)COc1ccc(cc1)CC 7a_100000211359_100000748629 [0,0,0,0,0,1|2,0,0]=3 2056 B13R1.3 C=C(C)COc1ccc(cc1)CN 34a_100000185549_100000748629 [0,0,0,0,0,1|3,0,0]=4 2057 B13R1.3 C=C(C)COc1ccc(cc1)CO 34a_100000211755_100000748629 [0,0,0,0,0,1|3,0,0]=4 2058 B13R1.3 C=C(C)COc1ccc(cc1)NC 2230a_200015186533_200000210301 [0,0,0,0,0,1|2,0,0]=3 2059 B13R1.3 C=C(C)COc1ccc(cc1)NC 34a_100000182112_100000748629 [0,0,0,0,0,1|2,0,0]=3 2060 B13R1.3 C=C(C)COc1ccc(cc1)NC 34a_200015186533_200000210301 [0,0,0,0,0,1|2,0,0]=3 2061 B13R1.3 C=C(C)COc1ccc(cc1)N[13CH3] 2230a_200015186533_200025704644 [0,0,0,0,0,1|2,0,0]=3 2062 B13R1.3 C=C(C)COc1ccc(cc1)N[13CH3] 34a_200015186533_200025704644 [0,0,0,0,0,1|2,0,0]=3 2063 B13R1.3 C=C(C)COc1ccc(cc1)OC 34a_100000210503_100000748629 [0,0,0,0,0,1|1,0,0]=2 2064 B13R1.3 C=C(C)COc1ccc(cc1)SC 34a_100000211864_100000748629 [0,0,0,0,0,1|1,1,0]=3 2065 B13R1.3 C=C(C)COc1ccc(cn1)OC 34a_100012002028_100000748629 [0,0,0,0,0,1|2,0,0]=3 2066 B13R1.3 C=C(C)COc1ccc(nc1)OC 34a_100011934560_100000748629 [0,0,0,0,0,1|2,0,0]=3 2067 B13R1.3 C=C(C)COc1cnc(nc1)OC 34a_100000099601_100000748629 [0,0,0,0,0,1|3,0,0]=4 2068 B13R1.3 C=C(C)COc1cnc(nc1)OC 7a_100000099601_100000748629 [0,0,0,0,0,1|3,0,0]=4 2069 B13R1.3 C=C(C)CSc1ccc(cc1)C#N 62a_100000748629_100000184291 [0,0,0,0,0,1|3,0,0]=4 2070 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000188517_100000211660 [0,0,0,0,0,1|3,0,0]=4 2071 B13R1.3 C=C(C)CSc1ccc(cc1)C=O 62a_100000748629_100000188517 [0,0,0,0,0,1|3,0,0]=4 2072 B13R1.3 C=C(C)CSc1ccc(cc1)CC 62a_100000748629_100011215824 [0,0,0,0,0,1|2,0,0]=3 2073 B13R1.3 C=C(C)CSc1ccc(cc1)CC 62a_100011215824_100000211660 [0,0,0,0,0,1|2,0,0]=3 2074 B13R1.3 C=C(C)CSc1ccc(cc1)CF 62a_100000748629_100010268989 [0,0,0,0,0,1|3,0,0]=4 2075 B13R1.3 C=C(C)CSc1ccc(cc1)CF 62a_100010268989_100000211660 [0,0,0,0,0,1|3,0,0]=4 2076 B13R1.3 C=C(C)CSc1ccc(cc1)CN 62a_100000748629_100016989417 [0,0,0,0,0,1|3,0,0]=4 2077 B13R1.3 C=C(C)CSc1ccc(cc1)CN 62a_100016989417_100000211660 [0,0,0,0,0,1|3,0,0]=4 2078 B13R1.3 C=C(C)CSc1ccc(cc1)CO 62a_100000690907_100000211660 [0,0,0,0,0,1|3,0,0]=4 2079 B13R1.3 C=C(C)CSc1ccc(cc1)CO 62a_100000748629_100000690907 [0,0,0,0,0,1|3,0,0]=4 2080 B13R1.3 C=C(C)CSc1ccc(cc1)NC 62a_100000743151_100000211660 [0,0,0,0,0,1|2,0,0]=3 2081 B13R1.3 C=C(C)CSc1ccc(cc1)NC 62a_100000748629_100000743151 [0,0,0,0,0,1|2,0,0]=3 2082 B13R1.3 C=C(C)CSc1ccc(cc1)NN 62a_100000748629_100016988836 [0,0,0,0,0,1|3,0,0]=4 2083 B13R1.3 C=C(C)CSc1ccc(cc1)NN 62a_100016988836_100000211660 [0,0,0,0,0,1|3,0,0]=4 2084 B13R1.3 C=C(C)CSc1ccc(cc1)OC 62a_100000748629_100000171711 [0,0,0,0,0,1|1,0,0]=2 2085 B13R1.3 C=C(C)CSc1ccc(cc1)SC 62a_100000748629_100011263217 [0,0,0,0,0,1|1,1,0]=3 2086 B13R1.3 C=C(C)CSc1ccc(cc1)SC 62a_100011263217_100000211660 [0,0,0,0,0,1|1,1,0]=3 2087 B13R1.3 C=C(C)CSc1ccc(cn1)CC 62a_100000748629_100009843584 [0,0,0,0,0,1|3,0,0]=4 2088 B13R1.3 C=C(C)CSc1ccc(cn1)CC 62a_100009843584_100000211660 [0,0,0,0,0,1|3,0,0]=4 2089 B13R1.3 C=C(C)CSc1ccc(cn1)NC 62a_100000748629_100000764248 [0,0,0,0,0,1|3,0,0]=4 2090 B13R1.3 C=C(C)CSc1ccc(cn1)NC 62a_100000764248_100000211660 [0,0,0,0,0,1|3,0,0]=4 2091 B13R1.3 C=C(C)CSc1ccc(cn1)OC 62a_100000748629_100000744180 [0,0,0,0,0,1|2,0,0]=3 2092 B13R1.3 C=C(C)CSc1ccc(cn1)OC 62a_100000755202_100000211660 [0,0,0,0,0,1|2,0,0]=3 2093 B13R1.3 C=C(C)CSc1ccc(cn1)SC 62a_100000748629_100009820866 [0,0,0,0,0,1|2,1,0]=4 2094 B13R1.3 C=C(C)CSc1ccc(cn1)SC 62a_100009820866_100000211660 [0,0,0,0,0,1|2,1,0]=4 2095 B13R1.3 C=C(C)CSc1ccc(nc1)CC 62a_100000748629_100009820025 [0,0,0,0,0,1|3,0,0]=4 2096 B13R1.3 C=C(C)CSc1ccc(nc1)CC 62a_100009820025_100000211660 [0,0,0,0,0,1|3,0,0]=4 2097 B13R1.3 C=C(C)CSc1ccc(nc1)NC 62a_100000741341_100000211660 [0,0,0,0,0,1|3,0,0]=4 2098 B13R1.3 C=C(C)CSc1ccc(nc1)NC 62a_100000748629_100000741341 [0,0,0,0,0,1|3,0,0]=4 2099 B13R1.3 C=C(C)CSc1ccc(nc1)OC 62a_100000047065_100000211660 [0,0,0,0,0,1|2,0,0]=3 2100 B13R1.3 C=C(C)CSc1ccc(nc1)OC 62a_100000748629_100000047065 [0,0,0,0,0,1|2,0,0]=3 2101 B13R1.3 C=C(C)CSc1ccc(nc1)SC 62a_100000748629_100011408404 [0,0,0,0,0,1|2,1,0]=4 2102 B13R1.3 C=C(C)CSc1ccc(nc1)SC 62a_100011408404_100000211660 [0,0,0,0,0,1|2,1,0]=4 2103 B13R1.3 C=C(C)CSc1ccc(nn1)OC 62a_100000748629_100009819040 [0,0,0,0,0,1|3,0,0]=4 2104 B13R1.3 C=C(C)CSc1ccc(nn1)OC 62a_100009819040_100000211660 [0,0,0,0,0,1|3,0,0]=4 2105 B13R1.3 C=C(C)CSc1cnc(cn1)OC 62a_100000748629_100011998698 [0,0,0,0,0,1|3,0,0]=4 2106 B13R1.3 C=C(C)CSc1cnc(cn1)OC 62a_100011998698_100000211660 [0,0,0,0,0,1|3,0,0]=4 2107 B13R1.3 C=C(C)CSc1cnc(nc1)OC 62a_100000686852_100000211660 [0,0,0,0,0,1|3,0,0]=4 2108 B13R1.3 C=C(C)CSc1cnc(nc1)OC 62a_100000748629_100000686852 [0,0,0,0,0,1|3,0,0]=4 2109 B13R1.3 C=C(C)CSc1ncc(cn1)OC 62a_100000069167_100000211660 [0,0,0,0,0,1|3,0,0]=4 2110 B13R1.3 C=C(C)CSc1ncc(cn1)OC 62a_100000748629_100000069167 [0,0,0,0,0,1|3,0,0]=4 2111 B13R1.3 C=C(F)CNc1ccc(cc1)CC 2230a_100000211069_100009893438 [0,0,0,0,0,1|2,0,1]=4 2112 B13R1.3 C=C(F)CNc1ccc(cc1)CC 34a_100000211069_100009893438 [0,0,0,0,0,1|2,0,1]=4 2113 B13R1.3 C=C(F)CNc1ccc(cc1)OC 34a_100000184247_100009893438 [0,0,0,0,0,1|1,0,1]=3 2114 B13R1.3 C=C(F)CNc1ccc(cc1)SC 34a_100000212337_100009893438 [0,0,0,0,0,1|1,1,1]=4 2115 B13R1.3 C=C(F)COc1ccc(cc1)CC 34a_100000211359_100009893438 [0,0,0,0,0,1|2,0,1]=4 2116 B13R1.3 C=C(F)COc1ccc(cc1)CC 7a_100000211359_100000042424 [0,0,0,0,0,1|2,0,1]=4 2117 B13R1.3 C=C(F)COc1ccc(cc1)NC 34a_100000182112_100009893438 [0,0,0,0,0,1|2,0,1]=4 2118 B13R1.3 C=C(F)COc1ccc(cc1)OC 34a_100000210503_100009893438 [0,0,0,0,0,1|1,0,1]=3 2119 B13R1.3 C=C(F)COc1ccc(cc1)SC 34a_100000211864_100009893438 [0,0,0,0,0,1|1,1,1]=4 2120 B13R1.3 C=C(F)COc1ccc(cn1)OC 34a_100012002028_100009893438 [0,0,0,0,0,1|2,0,1]=4 2121 B13R1.3 C=C(F)COc1ccc(nc1)OC 34a_100011934560_100009893438 [0,0,0,0,0,1|2,0,1]=4 2122 B13R1.3 C=C(F)CSc1ccc(cc1)CC 62a_100000042424_100011215824 [0,0,0,0,0,1|2,0,1]=4 2123 B13R1.3 C=C(F)CSc1ccc(cc1)CC 62a_100011215824_100000042424 [0,0,0,0,0,1|2,0,1]=4 2124 B13R1.3 C=C(F)CSc1ccc(cc1)NC 62a_100000042424_100000743151 [0,0,0,0,0,1|2,0,1]=4 2125 B13R1.3 C=C(F)CSc1ccc(cc1)NC 62a_100000743151_100000042424 [0,0,0,0,0,1|2,0,1]=4 2126 B13R1.3 C=C(F)CSc1ccc(cc1)OC 62a_100000042424_100000171711 [0,0,0,0,0,1|1,0,1]=3 2127 B13R1.3 C=C(F)CSc1ccc(cc1)SC 62a_100000042424_100011263217 [0,0,0,0,0,1|1,1,1]=4 2128 B13R1.3 C=C(F)CSc1ccc(cc1)SC 62a_100011263217_100000042424 [0,0,0,0,0,1|1,1,1]=4 2129 B13R1.3 C=C(F)CSc1ccc(cn1)OC 62a_100000042424_100000744180 [0,0,0,0,0,1|2,0,1]=4 2130 B13R1.3 C=C(F)CSc1ccc(cn1)OC 62a_100000755202_100000042424 [0,0,0,0,0,1|2,0,1]=4 2131 B13R1.3 C=C(F)CSc1ccc(nc1)OC 62a_100000042424_100000047065 [0,0,0,0,0,1|2,0,1]=4 2132 B13R1.3 C=C(F)CSc1ccc(nc1)OC 62a_100000047065_100000042424 [0,0,0,0,0,1|2,0,1]=4 2133 B13R1.3 C=Cc1ccc(cc1)/C=C/C(=O)C 271570a_100011290941_200016259395 [0,0,0,0,0,1|1,0,2]=4 2134 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000142037 [0,0,0,0,0,1|1,0,1]=3 2135 B13R1.3 C=Cc1ccc(cc1)CCC(=O)C 271570a_100011290941_100000723691 [0,0,0,0,0,1|1,0,1]=3 2136 B13R1.3 C=Cc1ccc(cc1)CCC(=O)N 271570a_100011290941_200010110666 [0,0,0,0,0,1|2,0,1]=4 2137 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 11a_200011934891_100015343762 [0,0,0,0,0,1|1,0,1]=3 2138 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 1626a_200011934891_100015343762 [0,0,0,0,0,1|1,0,1]=3 2139 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 240690a_200011934891_100015343762 [0,0,0,0,0,1|1,0,1]=3 2140 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 271570a_100011290941_200000685173 [0,0,0,0,0,1|1,0,1]=3 2141 B13R1.3 C=Cc1ccc(cc1)CNC(=O)C 527a_200011934891_100103153847 [0,0,0,0,0,1|1,0,1]=3 2142 B13R1.3 C=Cc1ccc(cc1)NCC(=C)C 34a_100011218248_100000748629 [0,0,0,0,0,1|2,0,1]=4 2143 B13R1.3 C=Cc1ccc(cc1)NCC(=O)N 34a_100011218248_100000187820 [0,0,0,0,0,1|2,0,1]=4 2144 B13R1.3 C=Cc1ccc(cc1)NCC(=O)[O-] 34a_100011218248_100020667443 [0,0,0,0,0,1|2,0,1]=4 2145 B13R1.3 C=Cc1ccc(cc1)NNC(=O)C 271570a_100011290941_200009815283 [0,0,0,0,0,1|2,0,1]=4 2146 B13R1.3 C=Cc1ccc(cc1)OCC(=C)C 34a_100000189437_100000748629 [0,0,0,0,0,1|2,0,1]=4 2147 B13R1.3 C=Cc1ccc(cc1)OCC(=C)C 7a_100000189437_100000748629 [0,0,0,0,0,1|2,0,1]=4 2148 B13R1.3 C=Cc1ccc(cc1)OCC(=O)N 34a_100000189437_100000187820 [0,0,0,0,0,1|2,0,1]=4 2149 B13R1.3 C=Cc1ccc(cc1)OCC(=O)N 7a_100000189437_100000187820 [0,0,0,0,0,1|2,0,1]=4 2150 B13R1.3 C=Cc1ccc(cc1)OCC(=O)[O-] 34a_100000189437_100020667443 [0,0,0,0,0,1|2,0,1]=4 2151 B13R1.3 C=Cc1ccc(cc1)SCC(=C)C 62a_100000748128_100000211660 [0,0,0,0,0,1|2,0,1]=4 2152 B13R1.3 C=Cc1ccc(cc1)SCC(=C)C 62a_100000748629_100000748128 [0,0,0,0,0,1|2,0,1]=4 2153 B13R1.3 C=Cc1ccc(cc1)SCC(=O)N 271570a_100011290941_100000149456 [0,0,0,0,0,1|2,0,1]=4 2154 B13R1.3 C=Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000748128 [0,0,0,0,0,1|2,0,1]=4 2155 B13R1.3 C=Cc1ccc(cc1)SCC(=O)N 62a_100000748128_100000747473 [0,0,0,0,0,1|2,0,1]=4 2156 B13R1.3 C=Cc1ccc(cc1)SCC(=O)[O-] 62a_100000748128_100020667443 [0,0,0,0,0,1|2,0,1]=4 2157 B13R1.3 C=Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000748128 [0,0,0,0,0,1|2,0,1]=4 2158 B13R1.3 CC(=O)/C=C/c1ccc(cc1)O[13CH3] 34a_100000189429_200025704644 [0,0,0,0,0,1|0,0,1]=2 2159 B13R1.3 CC(=O)/C=C/c1ccc(cc1)S[13CH3] 62a_200016259395_200025704644 [0,0,0,0,0,1|0,1,1]=3 2160 B13R1.3 CC(=O)/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_200016259395 [0,0,0,0,0,1|0,1,1]=3 2161 B13R1.3 CC(=O)C=Cc1ccc(cc1)C#N 1458a_100000185084_200000210301 [0,0,0,0,0,1|2,0,1]=4 2162 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200000210301 [0,0,0,0,0,1|2,0,0]=3 2163 B13R1.3 CC(=O)CCc1ccc(cc1)C#N 1458a_100000070787_100012161189 [0,0,0,0,0,1|2,0,0]=3 2164 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 34a_100000198047_200025704644 [0,0,0,0,0,1|0,0,0]=1 2165 B13R1.3 CC(=O)CCc1ccc(cc1)O[13CH3] 7a_100000198047_200025704644 [0,0,0,0,0,1|0,0,0]=1 2166 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_100000723691_200025704644 [0,0,0,0,0,1|0,1,0]=2 2167 B13R1.3 CC(=O)CCc1ccc(cc1)S[13CH3] 62a_200025704644_100000723691 [0,0,0,0,0,1|0,1,0]=2 2168 B13R1.3 CC(=O)COc1ccc(cc1)C#N 1458a_100000182482_200000210301 [0,0,0,0,0,1|2,0,0]=3 2169 B13R1.3 CC(=O)COc1ccc(cc1)CO 1458a_100000730898_200000210301 [0,0,0,0,0,1|2,0,0]=3 2170 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 11a_100015207190_100015343762 [0,0,0,0,0,1|2,0,0]=3 2171 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 1626a_100015207190_100015343762 [0,0,0,0,0,1|2,0,0]=3 2172 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 240690a_100015207190_100015343762 [0,0,0,0,0,1|2,0,0]=3 2173 B13R1.3 CC(=O)NCc1ccc(cc1)C#N 527a_100015207190_100103153847 [0,0,0,0,0,1|2,0,0]=3 2174 B13R1.3 CC(=O)NCc1ccc(cc1)CO 240690a_100015189231_100015343762 [0,0,0,0,0,1|2,0,0]=3 2175 B13R1.3 CC(=O)NCc1ccc(cc1)CO 527a_100015189231_100103153847 [0,0,0,0,0,1|2,0,0]=3 2176 B13R1.3 CC(=O)NCc1ccc(cc1)N[13CH3] 34a_100000755463_200025704644 [0,0,0,0,0,1|1,0,0]=2 2177 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200000685173_200025704644 [0,0,0,0,0,1|0,1,0]=2 2178 B13R1.3 CC(=O)NCc1ccc(cc1)S[13CH3] 62a_200025704644_200000685173 [0,0,0,0,0,1|0,1,0]=2 2179 B13R1.3 CC(=O)NN=C1C=CC(=NCl)C=C1 4a_100000189765_100000088476 [0,0,0,0,0,1|3,0,0]=4 2180 B13R1.3 CC(=O)NN=C1C=CC(=NO)C=C1 4a_100000189765_200000095120 [0,0,0,0,0,1|3,0,0]=4 2181 B13R1.3 CC(=O)NNc1ccc(cc1)C#N 22a_100000739705_100000070787 [0,0,0,0,0,1|3,0,0]=4 2182 B13R1.3 CC(=O)NNc1ccc(cc1)S[13CH3] 62a_200009815283_200025704644 [0,0,0,0,0,1|1,1,0]=3 2183 B13R1.3 CC(=O)NNc1ccc(cc1)S[13CH3] 62a_200025704644_200009815283 [0,0,0,0,0,1|1,1,0]=3 2184 B13R1.3 CC(=O)NNc1ccc(cn1)S[13CH3] 62a_200010175596_200025704644 [0,0,0,0,0,1|2,1,0]=4 2185 B13R1.3 CC(=O)NNc1ccc(cn1)S[13CH3] 62a_200025704644_200010175596 [0,0,0,0,0,1|2,1,0]=4 2186 B13R1.3 CC(C)CNc1ccc(cc1)S[13CH3] 62a_200011231703_200025704644 [0,0,0,0,0,1|1,1,1]=4 2187 B13R1.3 CC(C)CNc1ccc(cc1)S[13CH3] 62a_200025704644_200011231703 [0,0,0,0,0,1|1,1,1]=4 2188 B13R1.3 CC(C)COc1ccc(cc1)N[13CH3] 34a_200000243789_200025704644 [0,0,0,0,0,1|2,0,1]=4 2189 B13R1.3 CC(C)COc1ccc(cc1)S[13CH3] 62a_200000169949_200025704644 [0,0,0,0,0,1|1,1,1]=4 2190 B13R1.3 CC(C)COc1ccc(cc1)S[13CH3] 62a_200025704644_200000169949 [0,0,0,0,0,1|1,1,1]=4 2191 B13R1.3 CC(C)NCc1ccc(cc1)S[13CH3] 62a_100000195760_200025704644 [0,0,0,0,0,1|1,1,1]=4 2192 B13R1.3 CC(C)NCc1ccc(cc1)S[13CH3] 62a_200025704644_100000195760 [0,0,0,0,0,1|1,1,1]=4 2193 B13R1.3 CC(C)OCc1ccc(cc1)S[13CH3] 62a_100000758563_200025704644 [0,0,0,0,0,1|1,1,1]=4 2194 B13R1.3 CC(C)OCc1ccc(cc1)S[13CH3] 62a_200025704644_100000758563 [0,0,0,0,0,1|1,1,1]=4 2195 B13R1.3 CC(C)SCc1ccc(cc1)S[13CH3] 62a_100000173087_200025704644 [0,0,0,0,0,1|1,1,1]=4 2196 B13R1.3 CC(C)SCc1ccc(cc1)S[13CH3] 62a_200025704644_100000173087 [0,0,0,0,0,1|1,1,1]=4 2197 B13R1.3 CC(O)CCc1ccc(cc1)O[13CH3] 34a_100000189425_200025704644 [0,0,0,0,0,1|0,0,2]=3 2198 B13R1.3 CC(O)CCc1ccc(cc1)O[13CH3] 7a_100000189425_200025704644 [0,0,0,0,0,1|0,0,2]=3 2199 B13R1.3 CCc1ccc(cc1)C=CC(=O)C 1458a_100000187855_200000210301 [0,0,0,0,0,1|1,0,1]=3 2200 B13R1.3 CCc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000187855_200025704644 [0,0,0,0,0,1|1,0,1]=3 2201 B13R1.3 CCc1ccc(cc1)CCC(=O)C 1458a_100000195522_200000210301 [0,0,0,0,0,1|1,0,0]=2 2202 B13R1.3 CCc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000195522_200025704644 [0,0,0,0,0,1|1,0,0]=2 2203 B13R1.3 CCc1ccc(cc1)CNC(=O)C 11a_100000721222_100015343762 [0,0,0,0,0,1|1,0,0]=2 2204 B13R1.3 CCc1ccc(cc1)CNC(=O)C 1626a_100000721222_100015343762 [0,0,0,0,0,1|1,0,0]=2 2205 B13R1.3 CCc1ccc(cc1)CNC(=O)C 240690a_100000721222_100015343762 [0,0,0,0,0,1|1,0,0]=2 2206 B13R1.3 CCc1ccc(cc1)CNC(=O)C 527a_100000721222_100103153847 [0,0,0,0,0,1|1,0,0]=2 2207 B13R1.3 CCc1ccc(cc1)CNC(C)C 207a_100138425928_100000211036 [0,0,0,0,0,1|2,0,1]=4 2208 B13R1.3 CCc1ccc(cc1)CNC(C)C 2230a_100000721222_100000210206 [0,0,0,0,0,1|2,0,1]=4 2209 B13R1.3 CCc1ccc(cc1)CNC(C)C 2230a_100138425928_100000747183 [0,0,0,0,0,1|2,0,1]=4 2210 B13R1.3 CCc1ccc(cc1)CNC(C)C 34a_100000721222_100000210206 [0,0,0,0,0,1|2,0,1]=4 2211 B13R1.3 CCc1ccc(cc1)CNC(C)C 34a_100138425928_100000747183 [0,0,0,0,0,1|2,0,1]=4 2212 B13R1.3 CCc1ccc(cc1)COC(C)C 34a_100000212225_100000747183 [0,0,0,0,0,1|2,0,1]=4 2213 B13R1.3 CCc1ccc(cc1)COC(C)C 34a_100000702245_100000210206 [0,0,0,0,0,1|2,0,1]=4 2214 B13R1.3 CCc1ccc(cc1)COC(C)C 7a_100000702245_100000210206 [0,0,0,0,0,1|2,0,1]=4 2215 B13R1.3 CCc1ccc(cc1)CSC(C)C 62a_100000210206_100000747183 [0,0,0,0,0,1|2,0,1]=4 2216 B13R1.3 CCc1ccc(cc1)CSC(C)C 62a_100000757233_100000210206 [0,0,0,0,0,1|2,0,1]=4 2217 B13R1.3 CCc1ccc(cc1)NCC(=O)N 2230a_100000211069_100000747473 [0,0,0,0,0,1|2,0,0]=3 2218 B13R1.3 CCc1ccc(cc1)NCC(=O)N 34a_100000211069_100000187820 [0,0,0,0,0,1|2,0,0]=3 2219 B13R1.3 CCc1ccc(cc1)NCC(=O)[O-] 34a_100000211069_100020667443 [0,0,0,0,0,1|2,0,0]=3 2220 B13R1.3 CCc1ccc(cc1)NCC(C)C 2230a_100000211069_100000210760 [0,0,0,0,0,1|2,0,1]=4 2221 B13R1.3 CCc1ccc(cc1)NCC(C)C 34a_100000211069_100000210624 [0,0,0,0,0,1|2,0,1]=4 2222 B13R1.3 CCc1ccc(cc1)NCC(C)O 2230a_100000211069_100011218427 [0,0,0,0,0,1|1,0,2]=4 2223 B13R1.3 CCc1ccc(cc1)NCC(C)O 34a_100000211069_100011218427 [0,0,0,0,0,1|1,0,2]=4 2224 B13R1.3 CCc1ccc(cc1)NC[C@@H](C)O 2230a_100000211069_100009817552 [0,0,0,0,0,1|1,0,2]=4 2225 B13R1.3 CCc1ccc(cc1)NC[C@@H](C)O 34a_100000211069_100009817552 [0,0,0,0,0,1|1,0,2]=4 2226 B13R1.3 CCc1ccc(cc1)NC[N+](=O)[O-] 34a_100000211069_100000761209 [0,0,0,0,0,1|3,0,0]=4 2227 B13R1.3 CCc1ccc(cc1)NNC(=O)C 22a_100015204395_100000070787 [0,0,0,0,0,1|2,0,0]=3 2228 B13R1.3 CCc1ccc(cc1)OCC(=O)C 1458a_100000182499_200000210301 [0,0,0,0,0,1|1,0,0]=2 2229 B13R1.3 CCc1ccc(cc1)OCC(=O)N 34a_100000211359_100000187820 [0,0,0,0,0,1|2,0,0]=3 2230 B13R1.3 CCc1ccc(cc1)OCC(=O)N 7a_100000211359_100000187820 [0,0,0,0,0,1|2,0,0]=3 2231 B13R1.3 CCc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182499_200025704644 [0,0,0,0,0,1|1,0,0]=2 2232 B13R1.3 CCc1ccc(cc1)OCC(=O)[O-] 34a_100000211359_100020667443 [0,0,0,0,0,1|2,0,0]=3 2233 B13R1.3 CCc1ccc(cc1)OCC(C)C 34a_100000211359_100000210624 [0,0,0,0,0,1|2,0,1]=4 2234 B13R1.3 CCc1ccc(cc1)OCC(C)C 7a_100000211359_100000210760 [0,0,0,0,0,1|2,0,1]=4 2235 B13R1.3 CCc1ccc(cc1)OCC(C)O 34a_100000211359_100011218427 [0,0,0,0,0,1|1,0,2]=4 2236 B13R1.3 CCc1ccc(cc1)OCC(C)O 7a_100000211359_100011218427 [0,0,0,0,0,1|1,0,2]=4 2237 B13R1.3 CCc1ccc(cc1)OC[C@@H](C)O 34a_100000211359_100009817552 [0,0,0,0,0,1|1,0,2]=4 2238 B13R1.3 CCc1ccc(cc1)OC[C@@H](C)O 7a_100000211359_100009817552 [0,0,0,0,0,1|1,0,2]=4 2239 B13R1.3 CCc1ccc(cc1)OC[N+](=O)[O-] 34a_100000211359_100000761209 [0,0,0,0,0,1|3,0,0]=4 2240 B13R1.3 CCc1ccc(cc1)SCC(=O)N 62a_100000747473_100011215824 [0,0,0,0,0,1|2,0,0]=3 2241 B13R1.3 CCc1ccc(cc1)SCC(=O)N 62a_100011215824_100000747473 [0,0,0,0,0,1|2,0,0]=3 2242 B13R1.3 CCc1ccc(cc1)SCC(=O)[O-] 62a_100011215824_100020667443 [0,0,0,0,0,1|2,0,0]=3 2243 B13R1.3 CCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100011215824 [0,0,0,0,0,1|2,0,0]=3 2244 B13R1.3 CCc1ccc(cc1)SCC(C)C 62a_100000210624_100011215824 [0,0,0,0,0,1|2,0,1]=4 2245 B13R1.3 CCc1ccc(cc1)SCC(C)C 62a_100011215824_100000210760 [0,0,0,0,0,1|2,0,1]=4 2246 B13R1.3 CCc1ccc(cc1)SCC(C)O 62a_100011215824_100011218427 [0,0,0,0,0,1|1,0,2]=4 2247 B13R1.3 CCc1ccc(cc1)SCC(C)O 62a_100011218427_100011215824 [0,0,0,0,0,1|1,0,2]=4 2248 B13R1.3 CCc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100011215824 [0,0,0,0,0,1|1,0,2]=4 2249 B13R1.3 CCc1ccc(cc1)SC[C@@H](C)O 62a_100011215824_100009817552 [0,0,0,0,0,1|1,0,2]=4 2250 B13R1.3 CCc1ccc(cc1)SC[N+](=O)[O-] 62a_100011215824_100000761209 [0,0,0,0,0,1|3,0,0]=4 2251 B13R1.3 CCc1ccc(cn1)SCC(=O)N 62a_100000747473_100009820025 [0,0,0,0,0,1|3,0,0]=4 2252 B13R1.3 CCc1ccc(cn1)SCC(=O)N 62a_100009820025_100000747473 [0,0,0,0,0,1|3,0,0]=4 2253 B13R1.3 CCc1ccc(cn1)SCC(=O)[O-] 62a_100009820025_100020667443 [0,0,0,0,0,1|3,0,0]=4 2254 B13R1.3 CCc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100009820025 [0,0,0,0,0,1|3,0,0]=4 2255 B13R1.3 CCc1ccc(nc1)CNC(=O)C 11a_100000069493_100015343762 [0,0,0,0,0,1|2,0,0]=3 2256 B13R1.3 CCc1ccc(nc1)CNC(=O)C 1626a_100000069493_100015343762 [0,0,0,0,0,1|2,0,0]=3 2257 B13R1.3 CCc1ccc(nc1)CNC(=O)C 240690a_100000069493_100015343762 [0,0,0,0,0,1|2,0,0]=3 2258 B13R1.3 CCc1ccc(nc1)CNC(=O)C 527a_100000069493_100103153847 [0,0,0,0,0,1|2,0,0]=3 2259 B13R1.3 CCc1ccc(nc1)SCC(=O)N 62a_100000747473_100009843584 [0,0,0,0,0,1|3,0,0]=4 2260 B13R1.3 CCc1ccc(nc1)SCC(=O)N 62a_100009843584_100000747473 [0,0,0,0,0,1|3,0,0]=4 2261 B13R1.3 CCc1ccc(nc1)SCC(=O)[O-] 62a_100009843584_100020667443 [0,0,0,0,0,1|3,0,0]=4 2262 B13R1.3 CCc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100009843584 [0,0,0,0,0,1|3,0,0]=4 2263 B13R1.3 CNc1ccc(cc1)CNC(=O)C 34a_100000755463_200000210301 [0,0,0,0,0,1|1,0,0]=2 2264 B13R1.3 CNc1ccc(cc1)CNC(=O)N 34a_100000747042_200000210301 [0,0,0,0,0,1|2,0,0]=3 2265 B13R1.3 CNc1ccc(cc1)OCC(=O)N 2230a_100000238760_200000210301 [0,0,0,0,0,1|2,0,0]=3 2266 B13R1.3 CNc1ccc(cc1)OCC(=O)N 34a_100000182112_100000187820 [0,0,0,0,0,1|2,0,0]=3 2267 B13R1.3 CNc1ccc(cc1)OCC(=O)N 34a_100000238760_200000210301 [0,0,0,0,0,1|2,0,0]=3 2268 B13R1.3 CNc1ccc(cc1)OCC(=O)[O-] 34a_100000182112_100020667443 [0,0,0,0,0,1|2,0,0]=3 2269 B13R1.3 CNc1ccc(cc1)OCC(C)C 27a_100102657272_200000169949 [0,0,0,0,0,1|2,0,1]=4 2270 B13R1.3 CNc1ccc(cc1)OCC(C)C 34a_100000182112_100000210624 [0,0,0,0,0,1|2,0,1]=4 2271 B13R1.3 CNc1ccc(cc1)OCC(C)C 34a_200000243789_200000210301 [0,0,0,0,0,1|2,0,1]=4 2272 B13R1.3 CNc1ccc(cc1)OCC(C)O 34a_100000182112_100011218427 [0,0,0,0,0,1|1,0,2]=4 2273 B13R1.3 CNc1ccc(cc1)OC[C@@H](C)O 34a_100000182112_100009817552 [0,0,0,0,0,1|1,0,2]=4 2274 B13R1.3 CNc1ccc(cc1)OC[N+](=O)[O-] 34a_100000182112_100000761209 [0,0,0,0,0,1|3,0,0]=4 2275 B13R1.3 CNc1ccc(cc1)SCC(=O)N 62a_100000743151_100000747473 [0,0,0,0,0,1|2,0,0]=3 2276 B13R1.3 CNc1ccc(cc1)SCC(=O)N 62a_100000747473_100000743151 [0,0,0,0,0,1|2,0,0]=3 2277 B13R1.3 CNc1ccc(cc1)SCC(=O)[O-] 62a_100000743151_100020667443 [0,0,0,0,0,1|2,0,0]=3 2278 B13R1.3 CNc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000743151 [0,0,0,0,0,1|2,0,0]=3 2279 B13R1.3 CNc1ccc(cc1)SCC(C)C 62a_100000210624_100000743151 [0,0,0,0,0,1|2,0,1]=4 2280 B13R1.3 CNc1ccc(cc1)SCC(C)C 62a_100000743151_100000210760 [0,0,0,0,0,1|2,0,1]=4 2281 B13R1.3 CNc1ccc(cc1)SCC(C)O 62a_100000743151_100011218427 [0,0,0,0,0,1|1,0,2]=4 2282 B13R1.3 CNc1ccc(cc1)SCC(C)O 62a_100011218427_100000743151 [0,0,0,0,0,1|1,0,2]=4 2283 B13R1.3 CNc1ccc(cc1)SC[C@@H](C)O 62a_100000743151_100009817552 [0,0,0,0,0,1|1,0,2]=4 2284 B13R1.3 CNc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000743151 [0,0,0,0,0,1|1,0,2]=4 2285 B13R1.3 CNc1ccc(cc1)SC[N+](=O)[O-] 62a_100000743151_100000761209 [0,0,0,0,0,1|3,0,0]=4 2286 B13R1.3 CNc1ccc(cn1)SCC(=O)N 62a_100000741341_100000747473 [0,0,0,0,0,1|3,0,0]=4 2287 B13R1.3 CNc1ccc(cn1)SCC(=O)N 62a_100000747473_100000741341 [0,0,0,0,0,1|3,0,0]=4 2288 B13R1.3 CNc1ccc(cn1)SCC(=O)[O-] 62a_100000741341_100020667443 [0,0,0,0,0,1|3,0,0]=4 2289 B13R1.3 CNc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000741341 [0,0,0,0,0,1|3,0,0]=4 2290 B13R1.3 CNc1ccc(nc1)SCC(=O)N 62a_100000747473_100000764248 [0,0,0,0,0,1|3,0,0]=4 2291 B13R1.3 CNc1ccc(nc1)SCC(=O)N 62a_100000764248_100000747473 [0,0,0,0,0,1|3,0,0]=4 2292 B13R1.3 CNc1ccc(nc1)SCC(=O)[O-] 62a_100000764248_100020667443 [0,0,0,0,0,1|3,0,0]=4 2293 B13R1.3 CNc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000764248 [0,0,0,0,0,1|3,0,0]=4 2294 B13R1.3 COc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_200000210301 [0,0,0,0,0,1|0,0,1]=2 2295 B13R1.3 COc1ccc(cc1)/C=C/[N+](=O)[O-] 34a_100102610870_200000210301 [0,0,0,0,0,1|2,0,1]=4 2296 B13R1.3 COc1ccc(cc1)C#CC(=O)C 1458a_100000185621_200000210301 [0,0,0,0,0,1|0,0,1]=2 2297 B13R1.3 COc1ccc(cc1)C#CC(=O)[13CH3] 1458a_100000185621_200025704644 [0,0,0,0,0,1|0,0,1]=2 2298 B13R1.3 COc1ccc(cc1)C=CC(=O)C 1458a_100000184205_200000210301 [0,0,0,0,0,1|0,0,1]=2 2299 B13R1.3 COc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000184205_200025704644 [0,0,0,0,0,1|0,0,1]=2 2300 B13R1.3 COc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000171711 [0,0,0,0,0,1|1,0,2]=4 2301 B13R1.3 COc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000171711 [0,0,0,0,0,1|0,0,3]=4 2302 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000070787_100000184700 [0,0,0,0,0,1|0,0,0]=1 2303 B13R1.3 COc1ccc(cc1)CCC(=O)C 1458a_100000211712_200000210301 [0,0,0,0,0,1|0,0,0]=1 2304 B13R1.3 COc1ccc(cc1)CCC(=O)C 34a_100000198047_200000210301 [0,0,0,0,0,1|0,0,0]=1 2305 B13R1.3 COc1ccc(cc1)CCC(=O)C 7a_100000198047_200000210301 [0,0,0,0,0,1|0,0,0]=1 2306 B13R1.3 COc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000211712_200025704644 [0,0,0,0,0,1|0,0,0]=1 2307 B13R1.3 COc1ccc(cc1)CCC(C)O 34a_100000189425_200000210301 [0,0,0,0,0,1|0,0,2]=3 2308 B13R1.3 COc1ccc(cc1)CCC(C)O 7a_100000189425_200000210301 [0,0,0,0,0,1|0,0,2]=3 2309 B13R1.3 COc1ccc(cc1)CCN(C)C 2230a_100000225672_200000210301 [0,0,0,0,0,1|2,0,0]=3 2310 B13R1.3 COc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713689 [0,0,0,0,0,1|2,0,0]=3 2311 B13R1.3 COc1ccc(cc1)CCN(C)C 269982a_100000225672_200000210301 [0,0,0,0,0,1|2,0,0]=3 2312 B13R1.3 COc1ccc(cc1)CCN(C)C 269982a_100102631434_100000184700 [0,0,0,0,0,1|2,0,0]=3 2313 B13R1.3 COc1ccc(cc1)CCN(C)C 270004a_100102631434_100011242372 [0,0,0,0,0,1|2,0,0]=3 2314 B13R1.3 COc1ccc(cc1)CCN(C)C 34a_100000225672_200000210301 [0,0,0,0,0,1|2,0,0]=3 2315 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 2230a_100000225672_200025704644 [0,0,0,0,0,1|2,0,0]=3 2316 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 269982a_100000225672_200025704644 [0,0,0,0,0,1|2,0,0]=3 2317 B13R1.3 COc1ccc(cc1)CCN(C)[13CH3] 34a_100000225672_200025704644 [0,0,0,0,0,1|2,0,0]=3 2318 B13R1.3 COc1ccc(cc1)CNC(=O)C 11a_100000185587_100015343762 [0,0,0,0,0,1|0,0,0]=1 2319 B13R1.3 COc1ccc(cc1)CNC(=O)C 1626a_100000185587_100015343762 [0,0,0,0,0,1|0,0,0]=1 2320 B13R1.3 COc1ccc(cc1)CNC(=O)C 240690a_100000185587_100015343762 [0,0,0,0,0,1|0,0,0]=1 2321 B13R1.3 COc1ccc(cc1)CNC(=O)C 527a_100000185587_100103153847 [0,0,0,0,0,1|0,0,0]=1 2322 B13R1.3 COc1ccc(cc1)CNC(C)C 207a_100138425928_100000169835 [0,0,0,0,0,1|1,0,1]=3 2323 B13R1.3 COc1ccc(cc1)CNC(C)C 2230a_100138425928_100000742318 [0,0,0,0,0,1|1,0,1]=3 2324 B13R1.3 COc1ccc(cc1)CNC(C)C 34a_100000185587_100000210206 [0,0,0,0,0,1|1,0,1]=3 2325 B13R1.3 COc1ccc(cc1)CNC(C)C 34a_100138425928_100000742318 [0,0,0,0,0,1|1,0,1]=3 2326 B13R1.3 COc1ccc(cc1)COC(C)C 34a_100000173359_100000210206 [0,0,0,0,0,1|1,0,1]=3 2327 B13R1.3 COc1ccc(cc1)COC(C)C 34a_100000212225_100000742318 [0,0,0,0,0,1|1,0,1]=3 2328 B13R1.3 COc1ccc(cc1)CSC(C)C 62a_100000210206_100000742318 [0,0,0,0,0,1|1,0,1]=3 2329 B13R1.3 COc1ccc(cc1)NCC(=O)N 34a_100000184247_100000187820 [0,0,0,0,0,1|1,0,0]=2 2330 B13R1.3 COc1ccc(cc1)NCC(=O)[O-] 34a_100000184247_100020667443 [0,0,0,0,0,1|1,0,0]=2 2331 B13R1.3 COc1ccc(cc1)NCC(C)C 34a_100000184247_100000210624 [0,0,0,0,0,1|1,0,1]=3 2332 B13R1.3 COc1ccc(cc1)NCC(C)O 34a_100000184247_100011218427 [0,0,0,0,0,1|0,0,2]=3 2333 B13R1.3 COc1ccc(cc1)NCC(F)F 34a_100000184247_100011934356 [0,0,0,0,0,1|2,0,1]=4 2334 B13R1.3 COc1ccc(cc1)NC[C@@H](C)O 34a_100000184247_100009817552 [0,0,0,0,0,1|0,0,2]=3 2335 B13R1.3 COc1ccc(cc1)NC[N+](=O)[O-] 34a_100000184247_100000761209 [0,0,0,0,0,1|2,0,0]=3 2336 B13R1.3 COc1ccc(cc1)NNC(=O)C 22a_100000005221_100000070787 [0,0,0,0,0,1|1,0,0]=2 2337 B13R1.3 COc1ccc(cc1)OCC(=O)C 1458a_100000186439_200000210301 [0,0,0,0,0,1|0,0,0]=1 2338 B13R1.3 COc1ccc(cc1)OCC(=O)N 34a_100000210503_100000187820 [0,0,0,0,0,1|1,0,0]=2 2339 B13R1.3 COc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000186439_200025704644 [0,0,0,0,0,1|0,0,0]=1 2340 B13R1.3 COc1ccc(cc1)OCC(=O)[O-] 34a_100000210503_100020667443 [0,0,0,0,0,1|1,0,0]=2 2341 B13R1.3 COc1ccc(cc1)OCC(C)C 34a_100000210503_100000210624 [0,0,0,0,0,1|1,0,1]=3 2342 B13R1.3 COc1ccc(cc1)OCC(C)O 34a_100000210503_100011218427 [0,0,0,0,0,1|0,0,2]=3 2343 B13R1.3 COc1ccc(cc1)OCC(F)F 34a_100000210503_100011934356 [0,0,0,0,0,1|2,0,1]=4 2344 B13R1.3 COc1ccc(cc1)OC[C@@H](C)O 34a_100000210503_100009817552 [0,0,0,0,0,1|0,0,2]=3 2345 B13R1.3 COc1ccc(cc1)OC[N+](=O)[O-] 34a_100000210503_100000761209 [0,0,0,0,0,1|2,0,0]=3 2346 B13R1.3 COc1ccc(cc1)SCC(=O)C 1458a_100000182033_200000210301 [0,0,0,0,0,1|0,0,0]=1 2347 B13R1.3 COc1ccc(cc1)SCC(=O)N 62a_100000747473_100000171711 [0,0,0,0,0,1|1,0,0]=2 2348 B13R1.3 COc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000182033_200025704644 [0,0,0,0,0,1|0,0,0]=1 2349 B13R1.3 COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000171711 [0,0,0,0,0,1|1,0,0]=2 2350 B13R1.3 COc1ccc(cc1)SCC(C)C 62a_100000210624_100000171711 [0,0,0,0,0,1|1,0,1]=3 2351 B13R1.3 COc1ccc(cc1)SCC(C)O 62a_100011218427_100000171711 [0,0,0,0,0,1|0,0,2]=3 2352 B13R1.3 COc1ccc(cc1)SCC(F)F 62a_100011934356_100000171711 [0,0,0,0,0,1|2,0,1]=4 2353 B13R1.3 COc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000171711 [0,0,0,0,0,1|0,0,2]=3 2354 B13R1.3 COc1ccc(cn1)CNC(=O)C 11a_100000241975_100015343762 [0,0,0,0,0,1|1,0,0]=2 2355 B13R1.3 COc1ccc(cn1)CNC(=O)C 1626a_100000241975_100015343762 [0,0,0,0,0,1|1,0,0]=2 2356 B13R1.3 COc1ccc(cn1)CNC(=O)C 240690a_100000241975_100015343762 [0,0,0,0,0,1|1,0,0]=2 2357 B13R1.3 COc1ccc(cn1)CNC(=O)C 527a_100000241975_100103153847 [0,0,0,0,0,1|1,0,0]=2 2358 B13R1.3 COc1ccc(cn1)CNC(C)C 207a_100138425928_100000761633 [0,0,0,0,0,1|2,0,1]=4 2359 B13R1.3 COc1ccc(cn1)CNC(C)C 2230a_100000241975_100000210206 [0,0,0,0,0,1|2,0,1]=4 2360 B13R1.3 COc1ccc(cn1)CNC(C)C 2230a_100138425928_100020631284 [0,0,0,0,0,1|2,0,1]=4 2361 B13R1.3 COc1ccc(cn1)CNC(C)C 34a_100138425928_100020631284 [0,0,0,0,0,1|2,0,1]=4 2362 B13R1.3 COc1ccc(cn1)COC(C)C 34a_100000212225_100020631284 [0,0,0,0,0,1|2,0,1]=4 2363 B13R1.3 COc1ccc(cn1)COC(C)C 34a_100000763316_100000210206 [0,0,0,0,0,1|2,0,1]=4 2364 B13R1.3 COc1ccc(cn1)CSC(C)C 62a_100000210206_100020631284 [0,0,0,0,0,1|2,0,1]=4 2365 B13R1.3 COc1ccc(cn1)CSC(C)C 62a_100020631284_100000210206 [0,0,0,0,0,1|2,0,1]=4 2366 B13R1.3 COc1ccc(cn1)NNC(=O)C 22a_100102564821_100000070787 [0,0,0,0,0,1|2,0,0]=3 2367 B13R1.3 COc1ccc(cn1)OCC(=O)N 34a_100011934560_100000187820 [0,0,0,0,0,1|2,0,0]=3 2368 B13R1.3 COc1ccc(cn1)OCC(=O)[O-] 34a_100011934560_100020667443 [0,0,0,0,0,1|2,0,0]=3 2369 B13R1.3 COc1ccc(cn1)OCC(C)C 34a_100011934560_100000210624 [0,0,0,0,0,1|2,0,1]=4 2370 B13R1.3 COc1ccc(cn1)OCC(C)O 34a_100011934560_100011218427 [0,0,0,0,0,1|1,0,2]=4 2371 B13R1.3 COc1ccc(cn1)OC[C@@H](C)O 34a_100011934560_100009817552 [0,0,0,0,0,1|1,0,2]=4 2372 B13R1.3 COc1ccc(cn1)OC[N+](=O)[O-] 34a_100011934560_100000761209 [0,0,0,0,0,1|3,0,0]=4 2373 B13R1.3 COc1ccc(cn1)SCC(=O)N 62a_100000047065_100000747473 [0,0,0,0,0,1|2,0,0]=3 2374 B13R1.3 COc1ccc(cn1)SCC(=O)N 62a_100000747473_100000047065 [0,0,0,0,0,1|2,0,0]=3 2375 B13R1.3 COc1ccc(cn1)SCC(=O)[O-] 62a_100000047065_100020667443 [0,0,0,0,0,1|2,0,0]=3 2376 B13R1.3 COc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000047065 [0,0,0,0,0,1|2,0,0]=3 2377 B13R1.3 COc1ccc(cn1)SCC(C)C 62a_100000047065_100000210760 [0,0,0,0,0,1|2,0,1]=4 2378 B13R1.3 COc1ccc(cn1)SCC(C)C 62a_100000210624_100000047065 [0,0,0,0,0,1|2,0,1]=4 2379 B13R1.3 COc1ccc(cn1)SCC(C)O 62a_100000047065_100011218427 [0,0,0,0,0,1|1,0,2]=4 2380 B13R1.3 COc1ccc(cn1)SCC(C)O 62a_100011218427_100000047065 [0,0,0,0,0,1|1,0,2]=4 2381 B13R1.3 COc1ccc(cn1)SC[C@@H](C)O 62a_100000047065_100009817552 [0,0,0,0,0,1|1,0,2]=4 2382 B13R1.3 COc1ccc(cn1)SC[C@@H](C)O 62a_100009817552_100000047065 [0,0,0,0,0,1|1,0,2]=4 2383 B13R1.3 COc1ccc(cn1)SC[N+](=O)[O-] 62a_100000047065_100000761209 [0,0,0,0,0,1|3,0,0]=4 2384 B13R1.3 COc1ccc(nc1)CNC(=O)C 11a_100000703904_100015343762 [0,0,0,0,0,1|1,0,0]=2 2385 B13R1.3 COc1ccc(nc1)CNC(=O)C 1626a_100000703904_100015343762 [0,0,0,0,0,1|1,0,0]=2 2386 B13R1.3 COc1ccc(nc1)CNC(=O)C 240690a_100000703904_100015343762 [0,0,0,0,0,1|1,0,0]=2 2387 B13R1.3 COc1ccc(nc1)CNC(=O)C 527a_100000703904_100103153847 [0,0,0,0,0,1|1,0,0]=2 2388 B13R1.3 COc1ccc(nc1)CNC(C)C 207a_100138425928_100000701244 [0,0,0,0,0,1|2,0,1]=4 2389 B13R1.3 COc1ccc(nc1)CNC(C)C 2230a_100138425928_200000757186 [0,0,0,0,0,1|2,0,1]=4 2390 B13R1.3 COc1ccc(nc1)CNC(C)C 34a_100000703904_100000210206 [0,0,0,0,0,1|2,0,1]=4 2391 B13R1.3 COc1ccc(nc1)CNC(C)C 34a_100138425928_200000757186 [0,0,0,0,0,1|2,0,1]=4 2392 B13R1.3 COc1ccc(nc1)COC(C)C 34a_100000212225_200000757186 [0,0,0,0,0,1|2,0,1]=4 2393 B13R1.3 COc1ccc(nc1)COC(C)C 34a_100011998694_100000210206 [0,0,0,0,0,1|2,0,1]=4 2394 B13R1.3 COc1ccc(nc1)CSC(C)C 62a_100000210206_200000757186 [0,0,0,0,0,1|2,0,1]=4 2395 B13R1.3 COc1ccc(nc1)CSC(C)C 62a_200000757186_100000210206 [0,0,0,0,0,1|2,0,1]=4 2396 B13R1.3 COc1ccc(nc1)OCC(=O)N 34a_100012002028_100000187820 [0,0,0,0,0,1|2,0,0]=3 2397 B13R1.3 COc1ccc(nc1)OCC(=O)[O-] 34a_100012002028_100020667443 [0,0,0,0,0,1|2,0,0]=3 2398 B13R1.3 COc1ccc(nc1)OCC(C)C 34a_100012002028_100000210624 [0,0,0,0,0,1|2,0,1]=4 2399 B13R1.3 COc1ccc(nc1)OCC(C)O 34a_100012002028_100011218427 [0,0,0,0,0,1|1,0,2]=4 2400 B13R1.3 COc1ccc(nc1)OC[C@@H](C)O 34a_100012002028_100009817552 [0,0,0,0,0,1|1,0,2]=4 2401 B13R1.3 COc1ccc(nc1)OC[N+](=O)[O-] 34a_100012002028_100000761209 [0,0,0,0,0,1|3,0,0]=4 2402 B13R1.3 COc1ccc(nc1)SCC(=O)N 62a_100000747473_100000744180 [0,0,0,0,0,1|2,0,0]=3 2403 B13R1.3 COc1ccc(nc1)SCC(=O)N 62a_100000755202_100000747473 [0,0,0,0,0,1|2,0,0]=3 2404 B13R1.3 COc1ccc(nc1)SCC(=O)[O-] 62a_100000755202_100020667443 [0,0,0,0,0,1|2,0,0]=3 2405 B13R1.3 COc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000744180 [0,0,0,0,0,1|2,0,0]=3 2406 B13R1.3 COc1ccc(nc1)SCC(C)C 62a_100000210624_100000744180 [0,0,0,0,0,1|2,0,1]=4 2407 B13R1.3 COc1ccc(nc1)SCC(C)C 62a_100000755202_100000210760 [0,0,0,0,0,1|2,0,1]=4 2408 B13R1.3 COc1ccc(nc1)SCC(C)O 62a_100000755202_100011218427 [0,0,0,0,0,1|1,0,2]=4 2409 B13R1.3 COc1ccc(nc1)SCC(C)O 62a_100011218427_100000744180 [0,0,0,0,0,1|1,0,2]=4 2410 B13R1.3 COc1ccc(nc1)SC[C@@H](C)O 62a_100000755202_100009817552 [0,0,0,0,0,1|1,0,2]=4 2411 B13R1.3 COc1ccc(nc1)SC[C@@H](C)O 62a_100009817552_100000744180 [0,0,0,0,0,1|1,0,2]=4 2412 B13R1.3 COc1ccc(nc1)SC[N+](=O)[O-] 62a_100000755202_100000761209 [0,0,0,0,0,1|3,0,0]=4 2413 B13R1.3 COc1ccc(nn1)SCC(=O)N 62a_100000747473_100009819040 [0,0,0,0,0,1|3,0,0]=4 2414 B13R1.3 COc1ccc(nn1)SCC(=O)N 62a_100009819040_100000747473 [0,0,0,0,0,1|3,0,0]=4 2415 B13R1.3 COc1ccc(nn1)SCC(=O)[O-] 62a_100009819040_100020667443 [0,0,0,0,0,1|3,0,0]=4 2416 B13R1.3 COc1ccc(nn1)SCC(=O)[O-] 62a_100020667443_100009819040 [0,0,0,0,0,1|3,0,0]=4 2417 B13R1.3 COc1cnc(cn1)SCC(=O)N 62a_100000747473_100011998698 [0,0,0,0,0,1|3,0,0]=4 2418 B13R1.3 COc1cnc(cn1)SCC(=O)N 62a_100011998698_100000747473 [0,0,0,0,0,1|3,0,0]=4 2419 B13R1.3 COc1cnc(cn1)SCC(=O)[O-] 62a_100011998698_100020667443 [0,0,0,0,0,1|3,0,0]=4 2420 B13R1.3 COc1cnc(cn1)SCC(=O)[O-] 62a_100020667443_100011998698 [0,0,0,0,0,1|3,0,0]=4 2421 B13R1.3 COc1cnc(nc1)SCC(=O)N 62a_100000069167_100000747473 [0,0,0,0,0,1|3,0,0]=4 2422 B13R1.3 COc1cnc(nc1)SCC(=O)N 62a_100000747473_100000069167 [0,0,0,0,0,1|3,0,0]=4 2423 B13R1.3 COc1cnc(nc1)SCC(=O)[O-] 62a_100000069167_100020667443 [0,0,0,0,0,1|3,0,0]=4 2424 B13R1.3 COc1cnc(nc1)SCC(=O)[O-] 62a_100020667443_100000069167 [0,0,0,0,0,1|3,0,0]=4 2425 B13R1.3 COc1ncc(cn1)OCC(=O)N 34a_100000099601_100000187820 [0,0,0,0,0,1|3,0,0]=4 2426 B13R1.3 COc1ncc(cn1)OCC(=O)N 7a_100000099601_100000187820 [0,0,0,0,0,1|3,0,0]=4 2427 B13R1.3 COc1ncc(cn1)OCC(=O)[O-] 34a_100000099601_100020667443 [0,0,0,0,0,1|3,0,0]=4 2428 B13R1.3 COc1ncc(cn1)SCC(=O)N 62a_100000686852_100000747473 [0,0,0,0,0,1|3,0,0]=4 2429 B13R1.3 COc1ncc(cn1)SCC(=O)N 62a_100000747473_100000686852 [0,0,0,0,0,1|3,0,0]=4 2430 B13R1.3 COc1ncc(cn1)SCC(=O)[O-] 62a_100000686852_100020667443 [0,0,0,0,0,1|3,0,0]=4 2431 B13R1.3 COc1ncc(cn1)SCC(=O)[O-] 62a_100020667443_100000686852 [0,0,0,0,0,1|3,0,0]=4 2432 B13R1.3 CSc1ccc(cc1)/C=C/C(=O)C 62a_200000210301_200016259395 [0,0,0,0,0,1|0,1,1]=3 2433 B13R1.3 CSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_200000210301 [0,0,0,0,0,1|0,1,1]=3 2434 B13R1.3 CSc1ccc(cc1)C=CC(=O)C 1458a_100102526083_200000210301 [0,0,0,0,0,1|0,1,1]=3 2435 B13R1.3 CSc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100102526083_200025704644 [0,0,0,0,0,1|0,1,1]=3 2436 B13R1.3 CSc1ccc(cc1)CCC(=O)C 1458a_100011252364_200000210301 [0,0,0,0,0,1|0,1,0]=2 2437 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_100000723691_200000210301 [0,0,0,0,0,1|0,1,0]=2 2438 B13R1.3 CSc1ccc(cc1)CCC(=O)C 62a_200000210301_100000723691 [0,0,0,0,0,1|0,1,0]=2 2439 B13R1.3 CSc1ccc(cc1)CCC(=O)N 62a_200000210301_200010110666 [0,0,0,0,0,1|1,1,0]=3 2440 B13R1.3 CSc1ccc(cc1)CCC(=O)N 62a_200010110666_200000210301 [0,0,0,0,0,1|1,1,0]=3 2441 B13R1.3 CSc1ccc(cc1)CCC(=O)[13CH3] 1458a_100011252364_200025704644 [0,0,0,0,0,1|0,1,0]=2 2442 B13R1.3 CSc1ccc(cc1)CNC(=O)C 11a_100000174980_100015343762 [0,0,0,0,0,1|0,1,0]=2 2443 B13R1.3 CSc1ccc(cc1)CNC(=O)C 240690a_100000174980_100015343762 [0,0,0,0,0,1|0,1,0]=2 2444 B13R1.3 CSc1ccc(cc1)CNC(=O)C 527a_100000174980_100103153847 [0,0,0,0,0,1|0,1,0]=2 2445 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000210301_200000685173 [0,0,0,0,0,1|0,1,0]=2 2446 B13R1.3 CSc1ccc(cc1)CNC(=O)C 62a_200000685173_200000210301 [0,0,0,0,0,1|0,1,0]=2 2447 B13R1.3 CSc1ccc(cc1)CNC(C)C 207a_100138425928_100000211154 [0,0,0,0,0,1|1,1,1]=4 2448 B13R1.3 CSc1ccc(cc1)CNC(C)C 2230a_100000174980_100000210206 [0,0,0,0,0,1|1,1,1]=4 2449 B13R1.3 CSc1ccc(cc1)CNC(C)C 2230a_100138425928_100000181263 [0,0,0,0,0,1|1,1,1]=4 2450 B13R1.3 CSc1ccc(cc1)CNC(C)C 34a_100000174980_100000210206 [0,0,0,0,0,1|1,1,1]=4 2451 B13R1.3 CSc1ccc(cc1)CNC(C)C 34a_100138425928_100000181263 [0,0,0,0,0,1|1,1,1]=4 2452 B13R1.3 CSc1ccc(cc1)CNC(C)C 62a_100000195760_200000210301 [0,0,0,0,0,1|1,1,1]=4 2453 B13R1.3 CSc1ccc(cc1)CNC(C)C 62a_200000210301_100000195760 [0,0,0,0,0,1|1,1,1]=4 2454 B13R1.3 CSc1ccc(cc1)COC(C)C 34a_100000212225_100000181263 [0,0,0,0,0,1|1,1,1]=4 2455 B13R1.3 CSc1ccc(cc1)COC(C)C 34a_100011215404_100000210206 [0,0,0,0,0,1|1,1,1]=4 2456 B13R1.3 CSc1ccc(cc1)COC(C)C 62a_100000758563_200000210301 [0,0,0,0,0,1|1,1,1]=4 2457 B13R1.3 CSc1ccc(cc1)COC(C)C 62a_200000210301_100000758563 [0,0,0,0,0,1|1,1,1]=4 2458 B13R1.3 CSc1ccc(cc1)COC(C)C 7a_100011215404_100000210206 [0,0,0,0,0,1|1,1,1]=4 2459 B13R1.3 CSc1ccc(cc1)CSC(C)C 62a_100000173087_200000210301 [0,0,0,0,0,1|1,1,1]=4 2460 B13R1.3 CSc1ccc(cc1)CSC(C)C 62a_100000181263_100000210206 [0,0,0,0,0,1|1,1,1]=4 2461 B13R1.3 CSc1ccc(cc1)CSC(C)C 62a_100000210206_100000181263 [0,0,0,0,0,1|1,1,1]=4 2462 B13R1.3 CSc1ccc(cc1)CSC(C)C 62a_200000210301_100000173087 [0,0,0,0,0,1|1,1,1]=4 2463 B13R1.3 CSc1ccc(cc1)NCC(=O)N 34a_100000212337_100000187820 [0,0,0,0,0,1|1,1,0]=3 2464 B13R1.3 CSc1ccc(cc1)NCC(=O)[O-] 34a_100000212337_100020667443 [0,0,0,0,0,1|1,1,0]=3 2465 B13R1.3 CSc1ccc(cc1)NCC(C)C 34a_100000212337_100000210624 [0,0,0,0,0,1|1,1,1]=4 2466 B13R1.3 CSc1ccc(cc1)NCC(C)C 62a_200000210301_200011231703 [0,0,0,0,0,1|1,1,1]=4 2467 B13R1.3 CSc1ccc(cc1)NCC(C)C 62a_200011231703_200000210301 [0,0,0,0,0,1|1,1,1]=4 2468 B13R1.3 CSc1ccc(cc1)NCC(C)O 34a_100000212337_100011218427 [0,0,0,0,0,1|0,1,2]=4 2469 B13R1.3 CSc1ccc(cc1)NC[C@@H](C)O 34a_100000212337_100009817552 [0,0,0,0,0,1|0,1,2]=4 2470 B13R1.3 CSc1ccc(cc1)NC[N+](=O)[O-] 34a_100000212337_100000761209 [0,0,0,0,0,1|2,1,0]=4 2471 B13R1.3 CSc1ccc(cc1)NNC(=O)C 22a_100000006515_100000070787 [0,0,0,0,0,1|1,1,0]=3 2472 B13R1.3 CSc1ccc(cc1)NNC(=O)C 62a_200000210301_200009815283 [0,0,0,0,0,1|1,1,0]=3 2473 B13R1.3 CSc1ccc(cc1)NNC(=O)C 62a_200009815283_200000210301 [0,0,0,0,0,1|1,1,0]=3 2474 B13R1.3 CSc1ccc(cc1)OCC(=O)N 34a_100000211864_100000187820 [0,0,0,0,0,1|1,1,0]=3 2475 B13R1.3 CSc1ccc(cc1)OCC(=O)[O-] 34a_100000211864_100020667443 [0,0,0,0,0,1|1,1,0]=3 2476 B13R1.3 CSc1ccc(cc1)OCC(C)C 34a_100000211864_100000210624 [0,0,0,0,0,1|1,1,1]=4 2477 B13R1.3 CSc1ccc(cc1)OCC(C)C 62a_200000169949_200000210301 [0,0,0,0,0,1|1,1,1]=4 2478 B13R1.3 CSc1ccc(cc1)OCC(C)C 62a_200000210301_200000169949 [0,0,0,0,0,1|1,1,1]=4 2479 B13R1.3 CSc1ccc(cc1)OCC(C)O 34a_100000211864_100011218427 [0,0,0,0,0,1|0,1,2]=4 2480 B13R1.3 CSc1ccc(cc1)OC[C@@H](C)O 34a_100000211864_100009817552 [0,0,0,0,0,1|0,1,2]=4 2481 B13R1.3 CSc1ccc(cc1)OC[N+](=O)[O-] 34a_100000211864_100000761209 [0,0,0,0,0,1|2,1,0]=4 2482 B13R1.3 CSc1ccc(cc1)SCC(=O)N 62a_100000149456_200000210301 [0,0,0,0,0,1|1,1,0]=3 2483 B13R1.3 CSc1ccc(cc1)SCC(=O)N 62a_100000747473_100011263217 [0,0,0,0,0,1|1,1,0]=3 2484 B13R1.3 CSc1ccc(cc1)SCC(=O)N 62a_100011263217_100000747473 [0,0,0,0,0,1|1,1,0]=3 2485 B13R1.3 CSc1ccc(cc1)SCC(=O)N 62a_200000210301_100000149456 [0,0,0,0,0,1|1,1,0]=3 2486 B13R1.3 CSc1ccc(cc1)SCC(=O)[O-] 62a_100011263217_100020667443 [0,0,0,0,0,1|1,1,0]=3 2487 B13R1.3 CSc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100011263217 [0,0,0,0,0,1|1,1,0]=3 2488 B13R1.3 CSc1ccc(cc1)SCC(C)C 62a_100000210624_100011263217 [0,0,0,0,0,1|1,1,1]=4 2489 B13R1.3 CSc1ccc(cc1)SCC(C)C 62a_100011263217_100000210760 [0,0,0,0,0,1|1,1,1]=4 2490 B13R1.3 CSc1ccc(cc1)SCC(C)O 62a_100011218427_100011263217 [0,0,0,0,0,1|0,1,2]=4 2491 B13R1.3 CSc1ccc(cc1)SCC(C)O 62a_100011263217_100011218427 [0,0,0,0,0,1|0,1,2]=4 2492 B13R1.3 CSc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100011263217 [0,0,0,0,0,1|0,1,2]=4 2493 B13R1.3 CSc1ccc(cc1)SC[C@@H](C)O 62a_100011263217_100009817552 [0,0,0,0,0,1|0,1,2]=4 2494 B13R1.3 CSc1ccc(cc1)SC[N+](=O)[O-] 62a_100011263217_100000761209 [0,0,0,0,0,1|2,1,0]=4 2495 B13R1.3 CSc1ccc(cn1)SCC(=O)N 62a_100000747473_100011408404 [0,0,0,0,0,1|2,1,0]=4 2496 B13R1.3 CSc1ccc(cn1)SCC(=O)N 62a_100011408404_100000747473 [0,0,0,0,0,1|2,1,0]=4 2497 B13R1.3 CSc1ccc(cn1)SCC(=O)[O-] 62a_100011408404_100020667443 [0,0,0,0,0,1|2,1,0]=4 2498 B13R1.3 CSc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100011408404 [0,0,0,0,0,1|2,1,0]=4 2499 B13R1.3 CSc1ccc(nc1)NNC(=O)C 62a_200000210301_200010175596 [0,0,0,0,0,1|2,1,0]=4 2500 B13R1.3 CSc1ccc(nc1)NNC(=O)C 62a_200010175596_200000210301 [0,0,0,0,0,1|2,1,0]=4 2501 B13R1.3 CSc1ccc(nc1)SCC(=O)N 62a_100000747473_100009820866 [0,0,0,0,0,1|2,1,0]=4 2502 B13R1.3 CSc1ccc(nc1)SCC(=O)N 62a_100009820866_100000747473 [0,0,0,0,0,1|2,1,0]=4 2503 B13R1.3 CSc1ccc(nc1)SCC(=O)[O-] 62a_100009820866_100020667443 [0,0,0,0,0,1|2,1,0]=4 2504 B13R1.3 CSc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100009820866 [0,0,0,0,0,1|2,1,0]=4 2505 B13R1.3 N#Cc1ccc(cc1)NCC(=O)N 34a_100000185469_100000187820 [0,0,0,0,0,1|3,0,0]=4 2506 B13R1.3 N#Cc1ccc(cc1)NCC(=O)[O-] 34a_100000185469_100020667443 [0,0,0,0,0,1|3,0,0]=4 2507 B13R1.3 N#Cc1ccc(cc1)OCC(=O)N 34a_100000210344_100000187820 [0,0,0,0,0,1|3,0,0]=4 2508 B13R1.3 N#Cc1ccc(cc1)OCC(=O)N 7a_100000210344_100000187820 [0,0,0,0,0,1|3,0,0]=4 2509 B13R1.3 N#Cc1ccc(cc1)OCC(=O)[O-] 34a_100000210344_100020667443 [0,0,0,0,0,1|3,0,0]=4 2510 B13R1.3 N#Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000184291 [0,0,0,0,0,1|3,0,0]=4 2511 B13R1.3 N#Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000184291 [0,0,0,0,0,1|3,0,0]=4 2512 B13R1.3 NC(=O)CNc1ccc(cc1)CO 2230a_100011215238_100000747473 [0,0,0,0,0,1|3,0,0]=4 2513 B13R1.3 NC(=O)CNc1ccc(cc1)CO 34a_100011215238_100000187820 [0,0,0,0,0,1|3,0,0]=4 2514 B13R1.3 NC(=O)COc1ccc(cc1)CO 34a_100000211755_100000187820 [0,0,0,0,0,1|3,0,0]=4 2515 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000747473 [0,0,0,0,0,1|3,0,0]=4 2516 B13R1.3 NC(=O)CSc1ccc(cc1)C=O 62a_100000747473_100000188517 [0,0,0,0,0,1|3,0,0]=4 2517 B13R1.3 NC(=O)CSc1ccc(cc1)CF 62a_100000747473_100010268989 [0,0,0,0,0,1|3,0,0]=4 2518 B13R1.3 NC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000747473 [0,0,0,0,0,1|3,0,0]=4 2519 B13R1.3 NC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000747473 [0,0,0,0,0,1|3,0,0]=4 2520 B13R1.3 NC(=O)CSc1ccc(cc1)CO 62a_100000747473_100000690907 [0,0,0,0,0,1|3,0,0]=4 2521 B13R1.3 NCc1ccc(cc1)OCC(=O)N 34a_100000185549_100000187820 [0,0,0,0,0,1|3,0,0]=4 2522 B13R1.3 NCc1ccc(cc1)OCC(=O)[O-] 34a_100000185549_100020667443 [0,0,0,0,0,1|3,0,0]=4 2523 B13R1.3 NCc1ccc(cc1)SCC(=O)N 62a_100000747473_100016989417 [0,0,0,0,0,1|3,0,0]=4 2524 B13R1.3 NCc1ccc(cc1)SCC(=O)N 62a_100016989417_100000747473 [0,0,0,0,0,1|3,0,0]=4 2525 B13R1.3 NCc1ccc(cc1)SCC(=O)[O-] 62a_100016989417_100020667443 [0,0,0,0,0,1|3,0,0]=4 2526 B13R1.3 NCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100016989417 [0,0,0,0,0,1|3,0,0]=4 2527 B13R1.3 NNc1ccc(cc1)SCC(=O)N 62a_100000747473_100016988836 [0,0,0,0,0,1|3,0,0]=4 2528 B13R1.3 NNc1ccc(cc1)SCC(=O)N 62a_100016988836_100000747473 [0,0,0,0,0,1|3,0,0]=4 2529 B13R1.3 NNc1ccc(cc1)SCC(=O)[O-] 62a_100016988836_100020667443 [0,0,0,0,0,1|3,0,0]=4 2530 B13R1.3 NNc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100016988836 [0,0,0,0,0,1|3,0,0]=4 2531 B13R1.3 O=C([O-])CNc1ccc(cc1)CO 34a_100011215238_100020667443 [0,0,0,0,0,1|3,0,0]=4 2532 B13R1.3 O=C([O-])COc1ccc(cc1)CO 34a_100000211755_100020667443 [0,0,0,0,0,1|3,0,0]=4 2533 B13R1.3 O=C([O-])CSc1ccc(cc1)CF 62a_100010268989_100020667443 [0,0,0,0,0,1|3,0,0]=4 2534 B13R1.3 O=C([O-])CSc1ccc(cc1)CF 62a_100020667443_100010268989 [0,0,0,0,0,1|3,0,0]=4 2535 B13R1.3 O=C([O-])CSc1ccc(cc1)CO 62a_100000690907_100020667443 [0,0,0,0,0,1|3,0,0]=4 2536 B13R1.3 O=C([O-])CSc1ccc(cc1)CO 62a_100020667443_100000690907 [0,0,0,0,0,1|3,0,0]=4 2537 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100000188517_100020667443 [0,0,0,0,0,1|3,0,0]=4 2538 B13R1.3 O=Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000188517 [0,0,0,0,0,1|3,0,0]=4 2539 B13R1.3 [13CH3]C(=O)C=Cc1ccc(cc1)C#N 1458a_100000185084_200025704644 [0,0,0,0,0,1|2,0,1]=4 2540 B13R1.3 [13CH3]C(=O)CCc1ccc(cc1)C#N 1458a_100000021948_200025704644 [0,0,0,0,0,1|2,0,0]=3 2541 B13R1.3 [13CH3]C(=O)COc1ccc(cc1)C#N 1458a_100000182482_200025704644 [0,0,0,0,0,1|2,0,0]=3 2542 B13R1.3 [13CH3]C(=O)COc1ccc(cc1)CO 1458a_100000730898_200025704644 [0,0,0,0,0,1|2,0,0]=3 2543 B13R1.3 [13CH3]Nc1ccc(cc1)CNC(=O)N 34a_100000747042_200025704644 [0,0,0,0,0,1|2,0,0]=3 2544 B13R1.3 [13CH3]Nc1ccc(cc1)OCC(=O)N 2230a_100000238760_200025704644 [0,0,0,0,0,1|2,0,0]=3 2545 B13R1.3 [13CH3]Nc1ccc(cc1)OCC(=O)N 34a_100000238760_200025704644 [0,0,0,0,0,1|2,0,0]=3 2546 B13R1.3 [13CH3]Oc1ccc(cc1)/C=C/[N+](=O)[O-] 34a_100102610870_200025704644 [0,0,0,0,0,1|2,0,1]=4 2547 B13R1.3 [13CH3]Sc1ccc(cc1)CCC(=O)N 62a_200010110666_200025704644 [0,0,0,0,0,1|1,1,0]=3 2548 B13R1.3 [13CH3]Sc1ccc(cc1)CCC(=O)N 62a_200025704644_200010110666 [0,0,0,0,0,1|1,1,0]=3 2549 B13R1.3 [13CH3]Sc1ccc(cc1)SCC(=O)N 62a_100000149456_200025704644 [0,0,0,0,0,1|1,1,0]=3 2550 B13R1.3 [13CH3]Sc1ccc(cc1)SCC(=O)N 62a_200025704644_100000149456 [0,0,0,0,0,1|1,1,0]=3 2551 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [2,0,0,0,0,0|0,0,1]=3 2552 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [2,0,0,0,0,0|1,0,1]=4 2553 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [2,0,0,0,0,0|0,0,1]=3 2554 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [2,0,0,0,0,0|1,0,1]=4 2555 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [2,0,0,0,0,0|1,0,1]=4 2556 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [2,0,0,0,0,0|1,0,1]=4 2557 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [2,0,0,0,0,0|0,0,1]=3 2558 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [2,0,0,0,0,0|1,0,1]=4 2559 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [2,0,0,0,0,0|1,0,1]=4 2560 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [2,0,0,0,0,0|1,0,1]=4 2561 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [2,0,0,0,0,0|0,0,1]=3 2562 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [2,0,0,0,0,0|1,0,1]=4 2563 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [2,0,0,0,0,0|1,0,1]=4 2564 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [2,0,0,0,0,0|1,0,1]=4 2565 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [2,0,0,0,0,0|1,0,1]=4 2566 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [2,0,0,0,0,0|1,0,1]=4 2567 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [2,0,0,0,0,0|1,0,1]=4 2568 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [2,0,0,0,0,0|1,0,1]=4 2569 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [2,0,0,0,0,0|1,0,1]=4 2570 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [2,0,0,0,0,0|1,0,1]=4 2571 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [2,0,0,0,0,0|1,0,1]=4 2572 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [2,0,0,0,0,0|2,0,0]=4 2573 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 2574 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 2575 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [2,0,0,0,0,0|2,0,0]=4 2576 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [2,0,0,0,0,0|2,0,0]=4 2577 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 2578 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [2,0,0,0,0,0|2,0,0]=4 2579 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 2580 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [2,0,0,0,0,0|1,0,0]=3 2581 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [2,0,0,0,0,0|1,0,0]=3 2582 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [2,0,0,0,0,0|1,0,0]=3 2583 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [2,0,0,0,0,0|1,0,0]=3 2584 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [2,0,0,0,0,0|1,0,0]=3 2585 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [2,0,0,0,0,0|1,0,0]=3 2586 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [2,0,0,0,0,0|1,0,0]=3 2587 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [2,0,0,0,0,0|1,0,0]=3 2588 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [2,0,0,0,0,0|2,0,0]=4 2589 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 2590 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [2,0,0,0,0,0|2,0,0]=4 2591 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [2,0,0,0,0,0|2,0,0]=4 2592 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 2593 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [2,0,0,0,0,0|2,0,0]=4 2594 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [2,0,0,0,0,0|2,0,0]=4 2595 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [2,0,0,0,0,0|2,0,0]=4 2596 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 2597 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 2598 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [2,0,0,0,0,0|2,0,0]=4 2599 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 2600 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [2,0,0,0,0,0|2,0,0]=4 2601 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 2602 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [2,0,0,0,0,0|2,0,0]=4 2603 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 2604 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 2605 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 2606 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [2,0,0,0,0,0|2,0,0]=4 2607 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 2608 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [2,0,0,0,0,0|1,0,0]=3 2609 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [2,0,0,0,0,0|1,0,0]=3 2610 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [2,0,0,0,0,0|2,0,0]=4 2611 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [2,0,0,0,0,0|2,0,0]=4 2612 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [2,0,0,0,0,0|2,0,0]=4 2613 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [2,0,0,0,0,0|2,0,0]=4 2614 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [2,0,0,0,0,0|2,0,0]=4 2615 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [2,0,0,0,0,0|2,0,0]=4 2616 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [2,0,0,0,0,0|2,0,0]=4 2617 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [2,0,0,0,0,0|2,0,0]=4 2618 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [2,0,0,0,0,0|2,0,0]=4 2619 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [2,0,0,0,0,0|2,0,0]=4 2620 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [2,0,0,0,0,0|2,0,0]=4 2621 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [2,0,0,0,0,0|2,0,0]=4 2622 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [2,0,0,0,0,0|2,0,0]=4 2623 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [2,0,0,0,0,0|2,0,0]=4 2624 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [2,0,0,0,0,0|2,0,0]=4 2625 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [2,0,0,0,0,0|2,0,0]=4 2626 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [2,0,0,0,0,0|2,0,0]=4 2627 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [2,0,0,0,0,0|1,0,0]=3 2628 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [2,0,0,0,0,0|1,0,0]=3 2629 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [2,0,0,0,0,0|1,0,0]=3 2630 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 2631 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [2,0,0,0,0,0|2,0,0]=4 2632 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 2633 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 2634 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [2,0,0,0,0,0|2,0,0]=4 2635 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 2636 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 2637 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [2,0,0,0,0,0|2,0,0]=4 2638 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 2639 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [2,0,0,0,0,0|2,0,0]=4 2640 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [2,0,0,0,0,0|1,0,0]=3 2641 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [2,0,0,0,0,0|2,0,0]=4 2642 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [2,0,0,0,0,0|2,0,0]=4 2643 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [2,0,0,0,0,0|2,0,0]=4 2644 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [2,0,0,0,0,0|2,0,0]=4 2645 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [2,0,0,0,0,0|2,0,0]=4 2646 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [2,0,0,0,0,0|2,0,0]=4 2647 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [2,0,0,0,0,0|1,0,0]=3 2648 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [2,0,0,0,0,0|1,0,0]=3 2649 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [2,0,0,0,0,0|2,0,0]=4 2650 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [2,0,0,0,0,0|2,0,0]=4 2651 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [2,0,0,0,0,0|2,0,0]=4 2652 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [2,0,0,0,0,0|2,0,0]=4 2653 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [2,0,0,0,0,0|2,0,0]=4 2654 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [2,0,0,0,0,0|2,0,0]=4 2655 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [2,0,0,0,0,0|2,0,0]=4 2656 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [2,0,0,0,0,0|2,0,0]=4 2657 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [2,0,0,0,0,0|2,0,0]=4 2658 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [2,0,0,0,0,0|2,0,0]=4 2659 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [2,0,0,0,0,0|2,0,0]=4 2660 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [2,0,0,0,0,0|2,0,0]=4 2661 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [2,0,0,0,0,0|1,0,0]=3 2662 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [2,0,0,0,0,0|1,0,0]=3 2663 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [2,0,0,0,0,0|1,0,0]=3 2664 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [2,0,0,0,0,0|1,0,0]=3 2665 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [2,0,0,0,0,0|1,0,0]=3 2666 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [2,0,0,0,0,0|1,0,0]=3 2667 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [2,0,0,0,0,0|2,0,0]=4 2668 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [2,0,0,0,0,0|2,0,0]=4 2669 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [2,0,0,0,0,0|2,0,0]=4 2670 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [2,0,0,0,0,0|2,0,0]=4 2671 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [2,0,0,0,0,0|2,0,0]=4 2672 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [2,0,0,0,0,0|2,0,0]=4 2673 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [2,0,0,0,0,0|2,0,0]=4 2674 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [2,0,0,0,0,0|2,0,0]=4 2675 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [2,0,0,0,0,0|1,0,1]=4 2676 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [2,0,0,0,0,0|1,0,1]=4 2677 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [2,0,0,0,0,0|2,0,0]=4 2678 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [2,0,0,0,0,0|0,0,0]=2 2679 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [2,0,0,0,0,0|0,0,2]=4 2680 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [2,0,0,0,0,0|1,0,1]=4 2681 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 2682 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 2683 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 2684 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 2685 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 2686 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 2687 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 2688 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 2689 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [2,0,0,0,0,0|1,0,0]=3 2690 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [2,0,0,0,0,0|2,0,0]=4 2691 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [2,0,0,0,0,0|2,0,0]=4 2692 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 2693 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 2694 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 2695 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 2696 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 2697 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 2698 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [2,0,0,0,0,0|2,0,0]=4 2699 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [2,0,0,0,0,0|2,0,0]=4 2700 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [2,0,0,0,0,0|2,0,0]=4 2701 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [2,0,0,0,0,0|2,0,0]=4 2702 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [2,0,0,0,0,0|2,0,0]=4 2703 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [2,0,0,0,0,0|2,0,0]=4 2704 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [2,0,0,0,0,0|2,0,0]=4 2705 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [2,0,0,0,0,0|2,0,0]=4 2706 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [2,0,0,0,0,0|2,0,0]=4 2707 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [2,0,0,0,0,0|1,0,1]=4 2708 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [2,0,0,0,0,0|1,0,0]=3 2709 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [2,0,0,0,0,0|0,0,0]=2 2710 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [2,0,0,0,0,0|1,0,0]=3 2711 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [2,0,0,0,0,0|1,0,0]=3 2712 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [2,0,0,0,0,0|1,0,0]=3 2713 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [2,0,0,0,0,0|1,0,0]=3 2714 B10R1.18 CC(=O)Cc1cccnn1 1458a_100000070787_100016990269 [2,0,0,0,0,0|2,0,0]=4 2715 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [2,0,0,0,0,0|1,0,0]=3 2716 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [2,0,0,0,0,0|2,0,0]=4 2717 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000070787_100015196519 [2,0,0,0,0,0|2,0,0]=4 2718 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000721575_200000210301 [2,0,0,0,0,0|2,0,0]=4 2719 B10R1.18 CC(=O)Cc1ncccn1 1458a_100000070787_100000703007 [2,0,0,0,0,0|2,0,0]=4 2720 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [2,0,0,0,0,0|1,0,0]=3 2721 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [2,0,0,0,0,0|1,0,0]=3 2722 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [2,0,0,0,0,0|1,0,0]=3 2723 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [2,0,0,0,0,0|1,0,0]=3 2724 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 2725 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [2,0,0,0,0,0|2,0,0]=4 2726 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [2,0,0,0,0,0|2,0,0]=4 2727 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [2,0,0,0,0,0|2,0,0]=4 2728 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [2,0,0,0,0,0|2,0,0]=4 2729 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 2730 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [2,0,0,0,0,0|2,0,0]=4 2731 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [2,0,0,0,0,0|1,0,0]=3 2732 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [2,0,0,0,0,0|1,0,0]=3 2733 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [2,0,0,0,0,0|1,0,0]=3 2734 B10R1.18 [13CH3]C(=O)Cc1cncnc1 1458a_100000721575_200025704644 [2,0,0,0,0,0|2,0,0]=4 2735 B10R1.3 C=Cc1ccc(cc1)C=O 271570a_100011290941_100000186029 [2,0,0,0,0,0|1,0,1]=4 2736 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [2,0,0,0,0,0|1,0,1]=4 2737 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [2,0,0,0,0,0|1,0,1]=4 2738 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [2,0,0,0,0,0|1,0,1]=4 2739 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [2,0,0,0,0,0|1,0,1]=4 2740 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [2,0,0,0,0,0|0,0,1]=3 2741 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [2,0,0,0,0,0|0,0,1]=3 2742 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [2,0,0,0,0,0|0,0,1]=3 2743 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [2,0,0,0,0,0|0,0,1]=3 2744 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [2,0,0,0,0,0|0,0,1]=3 2745 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [2,0,0,0,0,0|0,1,1]=4 2746 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [2,0,0,0,0,0|0,1,1]=4 2747 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [2,0,0,0,0,0|0,1,1]=4 2748 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [2,0,0,0,0,0|0,1,1]=4 2749 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [2,0,0,0,0,0|0,1,1]=4 2750 B10R1.3 C=Cc1ccc(cn1)OC 271570a_100011290941_100000755202 [2,0,0,0,0,0|1,0,1]=4 2751 B10R1.3 C=Cc1ccc(nc1)OC 271570a_100011290941_100000047065 [2,0,0,0,0,0|1,0,1]=4 2752 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [2,0,0,0,0,0|1,0,0]=3 2753 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [2,0,0,0,0,0|1,0,0]=3 2754 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [2,0,0,0,0,0|1,0,0]=3 2755 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [2,0,0,0,0,0|1,0,0]=3 2756 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [2,0,0,0,0,0|0,0,0]=2 2757 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [2,0,0,0,0,0|0,0,0]=2 2758 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [2,0,0,0,0,0|0,0,0]=2 2759 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [2,0,0,0,0,0|0,0,0]=2 2760 B10R1.3 CCc1ccc(cc1)SC 62a_100011215824_200000210301 [2,0,0,0,0,0|0,1,0]=3 2761 B10R1.3 CCc1ccc(cc1)SC 62a_200000210301_100011215824 [2,0,0,0,0,0|0,1,0]=3 2762 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_100011215824_200025704644 [2,0,0,0,0,0|0,1,0]=3 2763 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_200025704644_100011215824 [2,0,0,0,0,0|0,1,0]=3 2764 B10R1.3 CCc1ccc(cn1)SC 62a_100009820025_200000210301 [2,0,0,0,0,0|1,1,0]=4 2765 B10R1.3 CCc1ccc(cn1)SC 62a_200000210301_100009820025 [2,0,0,0,0,0|1,1,0]=4 2766 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_100009820025_200025704644 [2,0,0,0,0,0|1,1,0]=4 2767 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_200025704644_100009820025 [2,0,0,0,0,0|1,1,0]=4 2768 B10R1.3 CCc1ccc(nc1)SC 62a_100009843584_200000210301 [2,0,0,0,0,0|1,1,0]=4 2769 B10R1.3 CCc1ccc(nc1)SC 62a_200000210301_100009843584 [2,0,0,0,0,0|1,1,0]=4 2770 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_100009843584_200025704644 [2,0,0,0,0,0|1,1,0]=4 2771 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_200025704644_100009843584 [2,0,0,0,0,0|1,1,0]=4 2772 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [2,0,0,0,0,0|1,0,1]=4 2773 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [2,0,0,0,0,0|1,0,1]=4 2774 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [2,0,0,0,0,0|1,0,0]=3 2775 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [2,0,0,0,0,0|1,0,0]=3 2776 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [2,0,0,0,0,0|1,0,0]=3 2777 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [2,0,0,0,0,0|1,1,0]=4 2778 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [2,0,0,0,0,0|1,1,0]=4 2779 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [2,0,0,0,0,0|1,1,0]=4 2780 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [2,0,0,0,0,0|1,1,0]=4 2781 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [2,0,0,0,0,0|1,1,0]=4 2782 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [2,0,0,0,0,0|1,0,1]=4 2783 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [2,0,0,0,0,0|1,0,1]=4 2784 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [2,0,0,0,0,0|1,0,0]=3 2785 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [2,0,0,0,0,0|0,0,1]=3 2786 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [2,0,0,0,0,0|1,0,0]=3 2787 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [2,0,0,0,0,0|1,0,0]=3 2788 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [2,0,0,0,0,0|1,0,0]=3 2789 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [2,0,0,0,0,0|1,0,0]=3 2790 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [2,0,0,0,0,0|1,0,0]=3 2791 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [2,0,0,0,0,0|1,0,0]=3 2792 B10R1.3 COc1ccc(cn1)CN 34a_100000757128_200000210301 [2,0,0,0,0,0|2,0,0]=4 2793 B10R1.3 COc1ccc(cn1)O[13CH3] 34a_100011934560_200025704644 [2,0,0,0,0,0|2,0,0]=4 2794 B10R1.3 COc1ccc(cn1)SC 62a_100000047065_200000210301 [2,0,0,0,0,0|2,0,0]=4 2795 B10R1.3 COc1ccc(cn1)SC 62a_200000210301_100000047065 [2,0,0,0,0,0|2,0,0]=4 2796 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_100000047065_200025704644 [2,0,0,0,0,0|2,0,0]=4 2797 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_200025704644_100000047065 [2,0,0,0,0,0|2,0,0]=4 2798 B10R1.3 COc1ccc(nc1)CN 34a_100020605196_200000210301 [2,0,0,0,0,0|2,0,0]=4 2799 B10R1.3 COc1ccc(nc1)CO 34a_103436540053_200000210301 [2,0,0,0,0,0|1,0,1]=4 2800 B10R1.3 COc1ccc(nc1)OC 34a_100011934560_200000210301 [2,0,0,0,0,0|2,0,0]=4 2801 B10R1.3 COc1ccc(nc1)OC 34a_100012002028_200000210301 [2,0,0,0,0,0|2,0,0]=4 2802 B10R1.3 COc1ccc(nc1)O[13CH3] 34a_100012002028_200025704644 [2,0,0,0,0,0|2,0,0]=4 2803 B10R1.3 COc1ccc(nc1)SC 62a_100000755202_200000210301 [2,0,0,0,0,0|2,0,0]=4 2804 B10R1.3 COc1ccc(nc1)SC 62a_200000210301_100000744180 [2,0,0,0,0,0|2,0,0]=4 2805 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_100000755202_200025704644 [2,0,0,0,0,0|2,0,0]=4 2806 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_200025704644_100000744180 [2,0,0,0,0,0|2,0,0]=4 2807 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [2,0,0,0,0,0|0,1,0]=3 2808 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [2,0,0,0,0,0|0,1,0]=3 2809 B10R1.3 CSc1ccc(cc1)CF 62a_100010268989_200000210301 [2,0,0,0,0,0|1,1,0]=4 2810 B10R1.3 CSc1ccc(cc1)CF 62a_200000210301_100010268989 [2,0,0,0,0,0|1,1,0]=4 2811 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [2,0,0,0,0,0|1,1,0]=4 2812 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [2,0,0,0,0,0|1,1,0]=4 2813 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [2,0,0,0,0,0|0,1,1]=4 2814 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [2,0,0,0,0,0|0,1,1]=4 2815 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [2,0,0,0,0,0|1,1,0]=4 2816 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [2,0,0,0,0,0|1,0,0]=3 2817 B10R1.3 CSc1ccc(cc1)SC 62a_100011263217_200000210301 [2,0,0,0,0,0|1,1,0]=4 2818 B10R1.3 CSc1ccc(cc1)SC 62a_200000210301_100011263217 [2,0,0,0,0,0|1,1,0]=4 2819 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_100011263217_200025704644 [2,0,0,0,0,0|1,1,0]=4 2820 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_200025704644_100011263217 [2,0,0,0,0,0|1,1,0]=4 2821 B10R1.3 CSc1ccc(cn1)C=O 62a_100000766901_200000210301 [2,0,0,0,0,0|1,1,0]=4 2822 B10R1.3 CSc1ccc(cn1)C=O 62a_200000210301_100000766901 [2,0,0,0,0,0|1,1,0]=4 2823 B10R1.3 CSc1ccc(nc1)C=O 62a_100000754260_200000210301 [2,0,0,0,0,0|1,1,0]=4 2824 B10R1.3 CSc1ccc(nc1)C=O 62a_200000210301_100000754260 [2,0,0,0,0,0|1,1,0]=4 2825 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [2,0,0,0,0,0|1,0,1]=4 2826 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [2,0,0,0,0,0|1,0,1]=4 2827 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [2,0,0,0,0,0|1,0,1]=4 2828 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [2,0,0,0,0,0|1,0,1]=4 2829 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [2,0,0,0,0,0|1,0,0]=3 2830 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [2,0,0,0,0,0|0,0,1]=3 2831 B10R1.3 [13CH3]Oc1ccc(cn1)CN 34a_100000757128_200025704644 [2,0,0,0,0,0|2,0,0]=4 2832 B10R1.3 [13CH3]Oc1ccc(nc1)CN 34a_100020605196_200025704644 [2,0,0,0,0,0|2,0,0]=4 2833 B10R1.3 [13CH3]Oc1ccc(nc1)CO 34a_103436540053_200025704644 [2,0,0,0,0,0|1,0,1]=4 2834 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [2,0,0,0,0,0|0,1,0]=3 2835 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [2,0,0,0,0,0|0,1,0]=3 2836 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_100010268989_200025704644 [2,0,0,0,0,0|1,1,0]=4 2837 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_200025704644_100010268989 [2,0,0,0,0,0|1,1,0]=4 2838 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [2,0,0,0,0,0|1,1,0]=4 2839 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [2,0,0,0,0,0|1,1,0]=4 2840 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [2,0,0,0,0,0|0,1,1]=4 2841 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [2,0,0,0,0,0|0,1,1]=4 2842 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_100000766901_200025704644 [2,0,0,0,0,0|1,1,0]=4 2843 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_200025704644_100000766901 [2,0,0,0,0,0|1,1,0]=4 2844 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_100000754260_200025704644 [2,0,0,0,0,0|1,1,0]=4 2845 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_200025704644_100000754260 [2,0,0,0,0,0|1,1,0]=4 2846 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [1,1,0,0,0,0|1,0,1]=4 2847 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [1,1,0,0,0,0|1,0,1]=4 2848 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [1,1,0,0,0,0|1,0,1]=4 2849 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [1,1,0,0,0,0|1,0,1]=4 2850 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [1,1,0,0,0,0|1,0,1]=4 2851 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [1,1,0,0,0,0|1,0,1]=4 2852 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [1,1,0,0,0,0|1,0,1]=4 2853 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [1,1,0,0,0,0|1,0,1]=4 2854 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [1,1,0,0,0,0|1,0,1]=4 2855 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [1,1,0,0,0,0|1,0,1]=4 2856 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [1,1,0,0,0,0|1,0,1]=4 2857 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,1,0,0,0,0|1,0,1]=4 2858 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [1,1,0,0,0,0|1,0,0]=3 2859 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [1,1,0,0,0,0|1,0,0]=3 2860 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [1,1,0,0,0,0|0,0,0]=2 2861 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [1,1,0,0,0,0|0,0,0]=2 2862 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [1,1,0,0,0,0|1,0,0]=3 2863 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [1,1,0,0,0,0|1,0,0]=3 2864 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [1,1,0,0,0,0|1,0,0]=3 2865 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [1,1,0,0,0,0|1,0,0]=3 2866 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,1,0,0,0,0|0,0,0]=2 2867 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [1,1,0,0,0,0|1,0,0]=3 2868 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [1,1,0,0,0,0|1,0,0]=3 2869 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [1,1,0,0,0,0|0,0,0]=2 2870 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [1,1,0,0,0,0|0,0,0]=2 2871 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [1,1,0,0,0,0|1,0,0]=3 2872 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [1,1,0,0,0,0|1,0,0]=3 2873 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [1,1,0,0,0,0|1,0,0]=3 2874 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,1,0,0,0,0|0,0,0]=2 2875 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [1,1,0,0,0,0|1,0,0]=3 2876 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [1,1,0,0,0,0|1,0,0]=3 2877 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [1,1,0,0,0,0|0,0,0]=2 2878 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [1,1,0,0,0,0|1,0,0]=3 2879 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [1,1,0,0,0,0|1,0,0]=3 2880 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [1,1,0,0,0,0|1,0,0]=3 2881 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [1,1,0,0,0,0|1,0,0]=3 2882 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [1,1,0,0,0,0|1,0,0]=3 2883 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,1,0,0,0,0|0,0,0]=2 2884 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [1,1,0,0,0,0|1,0,0]=3 2885 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [1,1,0,0,0,0|1,0,0]=3 2886 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [1,1,0,0,0,0|0,0,0]=2 2887 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [1,1,0,0,0,0|0,0,0]=2 2888 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [1,1,0,0,0,0|1,0,0]=3 2889 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [1,1,0,0,0,0|1,0,0]=3 2890 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [1,1,0,0,0,0|1,0,0]=3 2891 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [1,1,0,0,0,0|1,0,0]=3 2892 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [1,1,0,0,0,0|1,0,0]=3 2893 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [1,1,0,0,0,0|1,0,0]=3 2894 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,1,0,0,0,0|0,0,0]=2 2895 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [1,1,0,0,0,0|1,0,0]=3 2896 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [1,1,0,0,0,0|0,0,0]=2 2897 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [1,1,0,0,0,0|1,0,0]=3 2898 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,1,0,0,0,0|0,0,0]=2 2899 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,1,0,0,0,0|0,0,0]=2 2900 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,1,0,0,0,0|0,0,0]=2 2901 B12R1.19 CC(=O)Cc1cnc(c(c1)Br)F 1458a_100000070787_200010066439 [1,1,0,0,0,0|2,0,0]=4 2902 B12R1.19 CC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000070787_100009843750 [1,1,0,0,0,0|2,0,0]=4 2903 B12R1.19 CC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000070787_100011072623 [1,1,0,0,0,0|2,0,0]=4 2904 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [1,1,0,0,0,0|2,0,0]=4 2905 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100015343762 [1,1,0,0,0,0|2,0,0]=4 2906 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100015343762 [1,1,0,0,0,0|2,0,0]=4 2907 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000070787 [1,1,0,0,0,0|2,0,0]=4 2908 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100103153847 [1,1,0,0,0,0|2,0,0]=4 2909 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100015343762 [1,1,0,0,0,0|1,0,0]=3 2910 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100015343762 [1,1,0,0,0,0|1,0,0]=3 2911 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000070787 [1,1,0,0,0,0|1,0,0]=3 2912 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100103153847 [1,1,0,0,0,0|1,0,0]=3 2913 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100015343762 [1,1,0,0,0,0|2,0,0]=4 2914 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100015343762 [1,1,0,0,0,0|2,0,0]=4 2915 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000070787 [1,1,0,0,0,0|2,0,0]=4 2916 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100103153847 [1,1,0,0,0,0|2,0,0]=4 2917 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100015343762 [1,1,0,0,0,0|2,0,0]=4 2918 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100015343762 [1,1,0,0,0,0|2,0,0]=4 2919 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000070787 [1,1,0,0,0,0|2,0,0]=4 2920 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100103153847 [1,1,0,0,0,0|2,0,0]=4 2921 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100015343762 [1,1,0,0,0,0|2,0,0]=4 2922 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100015343762 [1,1,0,0,0,0|2,0,0]=4 2923 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000070787 [1,1,0,0,0,0|2,0,0]=4 2924 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100103153847 [1,1,0,0,0,0|2,0,0]=4 2925 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [1,1,0,0,0,0|1,0,0]=3 2926 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [1,1,0,0,0,0|1,0,0]=3 2927 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [1,1,0,0,0,0|2,0,0]=4 2928 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [1,1,0,0,0,0|2,0,0]=4 2929 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [1,1,0,0,0,0|2,0,0]=4 2930 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [1,1,0,0,0,0|2,0,0]=4 2931 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [1,1,0,0,0,0|1,0,0]=3 2932 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [1,1,0,0,0,0|1,0,0]=3 2933 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [1,1,0,0,0,0|1,0,0]=3 2934 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [1,1,0,0,0,0|1,0,0]=3 2935 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [1,1,0,0,0,0|2,0,0]=4 2936 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [1,1,0,0,0,0|2,0,0]=4 2937 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [1,1,0,0,0,0|2,0,0]=4 2938 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [1,1,0,0,0,0|2,0,0]=4 2939 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [1,1,0,0,0,0|2,0,0]=4 2940 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [1,1,0,0,0,0|2,0,0]=4 2941 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [1,1,0,0,0,0|2,0,0]=4 2942 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [1,1,0,0,0,0|2,0,0]=4 2943 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [1,1,0,0,0,0|2,0,0]=4 2944 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [1,1,0,0,0,0|2,0,0]=4 2945 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [1,1,0,0,0,0|2,0,0]=4 2946 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [1,1,0,0,0,0|2,0,0]=4 2947 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [1,1,0,0,0,0|1,0,0]=3 2948 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [1,1,0,0,0,0|1,0,0]=3 2949 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [1,1,0,0,0,0|1,0,0]=3 2950 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [1,1,0,0,0,0|1,0,0]=3 2951 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100015343762 [1,1,0,0,0,0|2,0,0]=4 2952 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100015343762 [1,1,0,0,0,0|2,0,0]=4 2953 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000070787 [1,1,0,0,0,0|2,0,0]=4 2954 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100103153847 [1,1,0,0,0,0|2,0,0]=4 2955 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100015343762 [1,1,0,0,0,0|1,0,0]=3 2956 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100015343762 [1,1,0,0,0,0|1,0,0]=3 2957 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000070787 [1,1,0,0,0,0|1,0,0]=3 2958 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100103153847 [1,1,0,0,0,0|1,0,0]=3 2959 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100015343762 [1,1,0,0,0,0|2,0,0]=4 2960 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100015343762 [1,1,0,0,0,0|2,0,0]=4 2961 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000070787 [1,1,0,0,0,0|2,0,0]=4 2962 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100103153847 [1,1,0,0,0,0|2,0,0]=4 2963 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100015343762 [1,1,0,0,0,0|2,0,0]=4 2964 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100015343762 [1,1,0,0,0,0|2,0,0]=4 2965 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000070787 [1,1,0,0,0,0|2,0,0]=4 2966 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100103153847 [1,1,0,0,0,0|2,0,0]=4 2967 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100015343762 [1,1,0,0,0,0|2,0,0]=4 2968 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100015343762 [1,1,0,0,0,0|2,0,0]=4 2969 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000070787 [1,1,0,0,0,0|2,0,0]=4 2970 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [1,1,0,0,0,0|1,0,0]=3 2971 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100015343762 [1,1,0,0,0,0|2,0,0]=4 2972 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100015343762 [1,1,0,0,0,0|2,0,0]=4 2973 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000070787 [1,1,0,0,0,0|2,0,0]=4 2974 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100103153847 [1,1,0,0,0,0|2,0,0]=4 2975 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100015343762 [1,1,0,0,0,0|1,0,0]=3 2976 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100015343762 [1,1,0,0,0,0|1,0,0]=3 2977 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000070787 [1,1,0,0,0,0|1,0,0]=3 2978 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100103153847 [1,1,0,0,0,0|1,0,0]=3 2979 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100015343762 [1,1,0,0,0,0|2,0,0]=4 2980 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100015343762 [1,1,0,0,0,0|2,0,0]=4 2981 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000070787 [1,1,0,0,0,0|2,0,0]=4 2982 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100015343762 [1,1,0,0,0,0|2,0,0]=4 2983 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100015343762 [1,1,0,0,0,0|2,0,0]=4 2984 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000070787 [1,1,0,0,0,0|2,0,0]=4 2985 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100015343762 [1,1,0,0,0,0|2,0,0]=4 2986 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100015343762 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000070787 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [1,1,0,0,0,0|1,0,0]=3 2989 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [1,1,0,0,0,0|1,0,0]=3 2990 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [1,1,0,0,0,0|1,0,0]=3 2991 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100015343762 [1,1,0,0,0,0|2,0,0]=4 2992 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100015343762 [1,1,0,0,0,0|2,0,0]=4 2993 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000070787 [1,1,0,0,0,0|2,0,0]=4 2994 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100103153847 [1,1,0,0,0,0|2,0,0]=4 2995 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100015343762 [1,1,0,0,0,0|1,0,0]=3 2996 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100015343762 [1,1,0,0,0,0|1,0,0]=3 2997 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000070787 [1,1,0,0,0,0|1,0,0]=3 2998 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100103153847 [1,1,0,0,0,0|1,0,0]=3 2999 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100015343762 [1,1,0,0,0,0|2,0,0]=4 3000 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100015343762 [1,1,0,0,0,0|2,0,0]=4 3001 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000070787 [1,1,0,0,0,0|2,0,0]=4 3002 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100103153847 [1,1,0,0,0,0|2,0,0]=4 3003 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100015343762 [1,1,0,0,0,0|2,0,0]=4 3004 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100015343762 [1,1,0,0,0,0|2,0,0]=4 3005 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000070787 [1,1,0,0,0,0|2,0,0]=4 3006 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100103153847 [1,1,0,0,0,0|2,0,0]=4 3007 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [1,1,0,0,0,0|1,0,0]=3 3008 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [1,1,0,0,0,0|1,0,0]=3 3009 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [1,1,0,0,0,0|1,0,0]=3 3010 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [1,1,0,0,0,0|1,0,0]=3 3011 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [1,1,0,0,0,0|2,0,0]=4 3012 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [1,1,0,0,0,0|2,0,0]=4 3013 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [1,1,0,0,0,0|2,0,0]=4 3014 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [1,1,0,0,0,0|2,0,0]=4 3015 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,1,0,0,0,0|1,0,0]=3 3016 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,1,0,0,0,0|1,0,0]=3 3017 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [1,1,0,0,0,0|2,0,0]=4 3018 B12R1.19 CC(=O)Nc1ccc(c(n1)F)O 271570a_203496583355_100000050017 [1,1,0,0,0,0|2,0,0]=4 3019 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [1,1,0,0,0,0|1,0,0]=3 3020 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [1,1,0,0,0,0|1,0,0]=3 3021 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [1,1,0,0,0,0|1,0,0]=3 3022 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,1,0,0,0,0|0,0,0]=2 3023 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [1,1,0,0,0,0|2,0,0]=4 3024 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [1,1,0,0,0,0|0,0,0]=2 3025 B12R1.19 Cc1ccc(cc1Br)CN(C)C 2230a_100102631434_100012232412 [1,1,0,0,0,0|2,0,0]=4 3026 B12R1.19 Cc1ccc(cc1Br)CN(C)C 269982a_100102631434_100012232412 [1,1,0,0,0,0|2,0,0]=4 3027 B12R1.19 Cc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000695567 [1,1,0,0,0,0|2,0,0]=4 3028 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [1,1,0,0,0,0|0,0,0]=2 3029 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 3030 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 3031 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 3032 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 3033 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [1,1,0,0,0,0|2,0,0]=4 3034 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 3035 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 3036 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 3037 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 3038 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100011823929 [1,1,0,0,0,0|2,0,0]=4 3039 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100011823929 [1,1,0,0,0,0|2,0,0]=4 3040 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000760539 [1,1,0,0,0,0|2,0,0]=4 3041 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [1,1,0,0,0,0|0,0,0]=2 3042 B12R1.19 Cc1ccc(cc1F)CN(C)C 2230a_100102631434_100011217369 [1,1,0,0,0,0|2,0,0]=4 3043 B12R1.19 Cc1ccc(cc1F)CN(C)C 269982a_100102631434_100011217369 [1,1,0,0,0,0|2,0,0]=4 3044 B12R1.19 Cc1ccc(cc1F)CN(C)C 270004a_100102631434_100000753222 [1,1,0,0,0,0|2,0,0]=4 3045 B12R1.19 Cc1ccc(cc1I)CN(C)C 2230a_100102631434_100010206137 [1,1,0,0,0,0|2,0,0]=4 3046 B12R1.19 Cc1ccc(cc1I)CN(C)C 269982a_100102631434_100010206137 [1,1,0,0,0,0|2,0,0]=4 3047 B12R1.19 Cc1ccc(cc1I)CN(C)C 270004a_100102631434_100010197721 [1,1,0,0,0,0|2,0,0]=4 3048 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,1,0,0,0,0|0,0,0]=2 3049 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [1,1,0,0,0,0|1,0,0]=3 3050 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [1,1,0,0,0,0|1,0,0]=3 3051 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,1,0,0,0,0|0,0,0]=2 3052 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [1,1,0,0,0,0|1,0,0]=3 3053 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [1,1,0,0,0,0|1,0,0]=3 3054 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [1,1,0,0,0,0|1,0,0]=3 3055 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,1,0,0,0,0|0,0,0]=2 3056 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [1,1,0,0,0,0|1,0,0]=3 3057 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [1,1,0,0,0,0|1,0,0]=3 3058 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [1,1,0,0,0,0|1,0,0]=3 3059 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [1,1,0,0,0,0|1,0,0]=3 3060 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,1,0,0,0,0|0,0,0]=2 3061 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,1,0,0,0,0|0,0,0]=2 3062 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [1,1,0,0,0,0|1,0,1]=4 3063 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [1,1,0,0,0,0|1,0,1]=4 3064 B12R1.20 CC(=O)C(C)c1ccc(cc1)Br 1458a_100000070787_100000755118 [1,1,0,0,0,0|1,0,0]=3 3065 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000070787_100011261388 [1,1,0,0,0,0|0,0,0]=2 3066 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_200000210301 [1,1,0,0,0,0|0,0,0]=2 3067 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000070787_100000684792 [1,1,0,0,0,0|1,0,0]=3 3068 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_200000210301 [1,1,0,0,0,0|1,0,0]=3 3069 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100000070787_100000743420 [1,1,0,0,0,0|1,0,0]=3 3070 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_200000210301 [1,1,0,0,0,0|1,0,0]=3 3071 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [1,1,0,0,0,0|0,0,0]=2 3072 B12R1.20 CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200000210301 [1,1,0,0,0,0|1,0,0]=3 3073 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [1,1,0,0,0,0|1,0,0]=3 3074 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [1,1,0,0,0,0|1,0,0]=3 3075 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [1,1,0,0,0,0|0,0,0]=2 3076 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100015343762 [1,1,0,0,0,0|2,0,0]=4 3077 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100015343762 [1,1,0,0,0,0|2,0,0]=4 3078 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000070787 [1,1,0,0,0,0|2,0,0]=4 3079 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100015343762 [1,1,0,0,0,0|1,0,0]=3 3080 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100015343762 [1,1,0,0,0,0|1,0,0]=3 3081 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000070787 [1,1,0,0,0,0|1,0,0]=3 3082 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100015343762 [1,1,0,0,0,0|2,0,0]=4 3083 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100015343762 [1,1,0,0,0,0|2,0,0]=4 3084 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000070787 [1,1,0,0,0,0|2,0,0]=4 3085 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100015343762 [1,1,0,0,0,0|2,0,0]=4 3086 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100015343762 [1,1,0,0,0,0|2,0,0]=4 3087 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000070787 [1,1,0,0,0,0|2,0,0]=4 3088 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100015343762 [1,1,0,0,0,0|2,0,0]=4 3089 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100015343762 [1,1,0,0,0,0|2,0,0]=4 3090 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000070787 [1,1,0,0,0,0|2,0,0]=4 3091 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [1,1,0,0,0,0|1,0,0]=3 3092 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [1,1,0,0,0,0|1,0,0]=3 3093 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [1,1,0,0,0,0|1,0,0]=3 3094 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [1,1,0,0,0,0|0,0,0]=2 3095 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [1,1,0,0,0,0|1,0,0]=3 3096 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100011216001_200025704644 [1,1,0,0,0,0|1,0,0]=3 3097 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)F 1458a_100011435297_200025704644 [1,1,0,0,0,0|1,0,0]=3 3098 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [1,1,0,0,0,0|0,0,0]=2 3099 B12R1.20 CC(C)[C@H](N)c1ccc(cc1)O 271570a_203496583355_100102422763 [1,1,0,0,0,0|1,0,1]=4 3100 B12R1.20 Cc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000751627_200025704644 [1,1,0,0,0,0|0,0,0]=2 3101 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [1,1,0,0,0,0|2,0,0]=4 3102 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [1,1,0,0,0,0|2,0,0]=4 3103 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [1,1,0,0,0,0|0,0,0]=2 3104 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [1,1,0,0,0,0|1,0,1]=4 3105 B12R1.20 [13CH3]C(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200025704644 [1,1,0,0,0,0|1,0,0]=3 3106 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [1,1,0,0,0,0|1,0,0]=3 3107 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [1,1,0,0,0,0|1,0,0]=3 3108 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [1,1,0,0,0,0|0,0,0]=2 3109 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [1,1,0,0,0,0|1,0,0]=3 3110 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [1,1,0,0,0,0|1,0,1]=4 3111 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [1,1,0,0,0,0|0,0,1]=3 3112 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [1,1,0,0,0,0|1,0,1]=4 3113 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [1,1,0,0,0,0|1,0,1]=4 3114 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [1,1,0,0,0,0|1,0,1]=4 3115 B12R1.49 C#CC(=O)Cc1ccc(cn1)C 1458a_100000211873_100000691093 [1,1,0,0,0,0|1,0,1]=4 3116 B12R1.49 C#CC(=O)Cc1ccc(nc1)C 1458a_100000211873_100016987292 [1,1,0,0,0,0|1,0,1]=4 3117 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [1,1,0,0,0,0|1,0,1]=4 3118 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [1,1,0,0,0,0|0,0,1]=3 3119 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [1,1,0,0,0,0|1,0,1]=4 3120 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [1,1,0,0,0,0|1,0,1]=4 3121 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [1,1,0,0,0,0|1,0,1]=4 3122 B12R1.49 C=CC(=O)Cc1ccc(cn1)C 1458a_100000185746_100000691093 [1,1,0,0,0,0|1,0,1]=4 3123 B12R1.49 C=CC(=O)Cc1ccc(nc1)C 1458a_100000185746_100016987292 [1,1,0,0,0,0|1,0,1]=4 3124 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [1,1,0,0,0,0|1,0,1]=4 3125 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [1,1,0,0,0,0|1,0,1]=4 3126 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [1,1,0,0,0,0|1,0,1]=4 3127 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [1,1,0,0,0,0|1,0,1]=4 3128 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [1,1,0,0,0,0|1,0,1]=4 3129 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [1,1,0,0,0,0|1,0,0]=3 3130 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [1,1,0,0,0,0|1,0,0]=3 3131 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [1,1,0,0,0,0|0,0,0]=2 3132 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [1,1,0,0,0,0|0,0,0]=2 3133 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [1,1,0,0,0,0|1,0,0]=3 3134 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [1,1,0,0,0,0|1,0,0]=3 3135 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [1,1,0,0,0,0|1,0,0]=3 3136 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [1,1,0,0,0,0|1,0,0]=3 3137 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [1,1,0,0,0,0|1,0,0]=3 3138 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [1,1,0,0,0,0|1,0,0]=3 3139 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [1,1,0,0,0,0|0,0,0]=2 3140 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100000210414_100000702658 [1,1,0,0,0,0|2,0,0]=4 3141 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210202 [1,1,0,0,0,0|2,0,0]=4 3142 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100000210414_100000691093 [1,1,0,0,0,0|1,0,0]=3 3143 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210202 [1,1,0,0,0,0|1,0,0]=3 3144 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000210414_100012066911 [1,1,0,0,0,0|2,0,0]=4 3145 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210202 [1,1,0,0,0,0|2,0,0]=4 3146 B12R1.49 CCC(=O)Cc1ccc(cn1)F 1458a_100000210414_100000703193 [1,1,0,0,0,0|2,0,0]=4 3147 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100000210414_100009831999 [1,1,0,0,0,0|2,0,0]=4 3148 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210202 [1,1,0,0,0,0|2,0,0]=4 3149 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000210414_100016987292 [1,1,0,0,0,0|1,0,0]=3 3150 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210202 [1,1,0,0,0,0|1,0,0]=3 3151 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210202 [1,1,0,0,0,0|2,0,0]=4 3152 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000210414_100000735431 [1,1,0,0,0,0|2,0,0]=4 3153 B12R1.49 CCC(=O)Cc1ccc(nc1)F 1458a_100000210414_100009820150 [1,1,0,0,0,0|2,0,0]=4 3154 B12R1.49 CCC(=O)Cc1cnc(cn1)C 1458a_100000210414_100000752025 [1,1,0,0,0,0|2,0,0]=4 3155 B12R1.49 CCC(=O)Cc1ncc(cn1)C 1458a_100000210414_100000685645 [1,1,0,0,0,0|2,0,0]=4 3156 B12R1.49 CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210202 [1,1,0,0,0,0|1,0,1]=4 3157 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [1,1,0,0,0,0|2,0,0]=4 3158 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [1,1,0,0,0,0|2,0,0]=4 3159 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [1,1,0,0,0,0|2,0,0]=4 3160 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [1,1,0,0,0,0|2,0,0]=4 3161 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [1,1,0,0,0,0|1,0,0]=3 3162 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [1,1,0,0,0,0|1,0,0]=3 3163 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [1,1,0,0,0,0|1,0,0]=3 3164 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [1,1,0,0,0,0|1,0,0]=3 3165 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [1,1,0,0,0,0|2,0,0]=4 3166 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [1,1,0,0,0,0|2,0,0]=4 3167 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [1,1,0,0,0,0|2,0,0]=4 3168 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [1,1,0,0,0,0|2,0,0]=4 3169 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [1,1,0,0,0,0|2,0,0]=4 3170 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [1,1,0,0,0,0|2,0,0]=4 3171 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [1,1,0,0,0,0|2,0,0]=4 3172 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [1,1,0,0,0,0|2,0,0]=4 3173 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [1,1,0,0,0,0|2,0,0]=4 3174 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [1,1,0,0,0,0|2,0,0]=4 3175 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [1,1,0,0,0,0|2,0,0]=4 3176 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [1,1,0,0,0,0|2,0,0]=4 3177 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [1,1,0,0,0,0|1,0,0]=3 3178 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [1,1,0,0,0,0|1,0,0]=3 3179 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [1,1,0,0,0,0|2,0,0]=4 3180 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [1,1,0,0,0,0|2,0,0]=4 3181 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [1,1,0,0,0,0|2,0,0]=4 3182 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [1,1,0,0,0,0|2,0,0]=4 3183 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [1,1,0,0,0,0|2,0,0]=4 3184 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [1,1,0,0,0,0|2,0,0]=4 3185 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [1,1,0,0,0,0|2,0,0]=4 3186 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [1,1,0,0,0,0|2,0,0]=4 3187 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [1,1,0,0,0,0|2,0,0]=4 3188 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [1,1,0,0,0,0|2,0,0]=4 3189 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [1,1,0,0,0,0|2,0,0]=4 3190 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [1,1,0,0,0,0|2,0,0]=4 3191 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [1,1,0,0,0,0|2,0,0]=4 3192 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [1,1,0,0,0,0|2,0,0]=4 3193 B12R1.49 CN(CF)Cc1ccc(cc1)O 269982a_100000207500_100015361967 [1,1,0,0,0,0|2,0,0]=4 3194 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [1,1,0,0,0,0|1,0,0]=3 3195 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [1,1,0,0,0,0|1,0,0]=3 3196 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [1,1,0,0,0,0|1,0,0]=3 3197 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [1,1,0,0,0,0|0,0,0]=2 3198 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [1,1,0,0,0,0|0,0,0]=2 3199 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [1,1,0,0,0,0|0,0,0]=2 3200 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [1,1,0,0,0,0|1,0,0]=3 3201 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [1,1,0,0,0,0|1,0,0]=3 3202 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [1,1,0,0,0,0|1,0,0]=3 3203 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [1,1,0,0,0,0|1,0,0]=3 3204 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [1,1,0,0,0,0|1,0,0]=3 3205 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [1,1,0,0,0,0|1,0,0]=3 3206 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [1,1,0,0,0,0|1,0,0]=3 3207 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [1,1,0,0,0,0|1,0,0]=3 3208 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [1,1,0,0,0,0|1,0,0]=3 3209 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [1,1,0,0,0,0|1,0,0]=3 3210 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [1,1,0,0,0,0|1,0,0]=3 3211 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [1,1,0,0,0,0|0,0,0]=2 3212 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [1,1,0,0,0,0|0,0,0]=2 3213 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [1,1,0,0,0,0|0,0,0]=2 3214 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [1,1,0,0,0,0|0,0,0]=2 3215 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 11a_106832991635_100020629044 [1,1,0,0,0,0|2,0,0]=4 3216 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 240690a_100102657272_100020629044 [1,1,0,0,0,0|2,0,0]=4 3217 B12R1.49 CNC(=O)Cc1ccc(cn1)C 11a_106832991635_100025705728 [1,1,0,0,0,0|1,0,0]=3 3218 B12R1.49 CNC(=O)Cc1ccc(cn1)C 1626a_100102657272_100025705728 [1,1,0,0,0,0|1,0,0]=3 3219 B12R1.49 CNC(=O)Cc1ccc(cn1)C 240690a_100102657272_100025705728 [1,1,0,0,0,0|1,0,0]=3 3220 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 11a_106832991635_100000728320 [1,1,0,0,0,0|2,0,0]=4 3221 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 1626a_100102657272_100000728320 [1,1,0,0,0,0|2,0,0]=4 3222 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 240690a_100102657272_100000728320 [1,1,0,0,0,0|2,0,0]=4 3223 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 527a_100102657272_100000728320 [1,1,0,0,0,0|2,0,0]=4 3224 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 11a_106832991635_100010067268 [1,1,0,0,0,0|2,0,0]=4 3225 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 240690a_100102657272_100010067268 [1,1,0,0,0,0|2,0,0]=4 3226 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 527a_100102657272_100010067268 [1,1,0,0,0,0|2,0,0]=4 3227 B12R1.49 CNC(=O)Cc1ccc(nc1)C 11a_106832991635_100000740413 [1,1,0,0,0,0|1,0,0]=3 3228 B12R1.49 CNC(=O)Cc1ccc(nc1)C 1626a_100102657272_100000740413 [1,1,0,0,0,0|1,0,0]=3 3229 B12R1.49 CNC(=O)Cc1ccc(nc1)C 240690a_100102657272_100000740413 [1,1,0,0,0,0|1,0,0]=3 3230 B12R1.49 CNC(=O)Cc1ccc(nc1)C 527a_100102657272_100000740413 [1,1,0,0,0,0|1,0,0]=3 3231 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 11a_106832991635_100000061944 [1,1,0,0,0,0|2,0,0]=4 3232 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 1626a_100102657272_100000061944 [1,1,0,0,0,0|2,0,0]=4 3233 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 240690a_100102657272_100000061944 [1,1,0,0,0,0|2,0,0]=4 3234 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 527a_100102657272_100000061944 [1,1,0,0,0,0|2,0,0]=4 3235 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 11a_106832991635_200000238563 [1,1,0,0,0,0|1,0,1]=4 3236 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 1626a_100102657272_200000238563 [1,1,0,0,0,0|1,0,1]=4 3237 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 240690a_100102657272_200000238563 [1,1,0,0,0,0|1,0,1]=4 3238 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 527a_100102657272_200000238563 [1,1,0,0,0,0|1,0,1]=4 3239 B12R1.49 CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102657272 [1,1,0,0,0,0|2,0,0]=4 3240 B12R1.49 CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100102657272 [1,1,0,0,0,0|1,0,0]=3 3241 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102657272 [1,1,0,0,0,0|2,0,0]=4 3242 B12R1.49 CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102657272 [1,1,0,0,0,0|2,0,0]=4 3243 B12R1.49 CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102657272 [1,1,0,0,0,0|2,0,0]=4 3244 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [1,1,0,0,0,0|1,0,0]=3 3245 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [1,1,0,0,0,0|1,0,1]=4 3246 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [1,1,0,0,0,0|1,0,1]=4 3247 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [1,1,0,0,0,0|1,0,1]=4 3248 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [1,1,0,0,0,0|1,0,1]=4 3249 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [1,1,0,0,0,0|0,0,0]=2 3250 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [1,1,0,0,0,0|1,0,0]=3 3251 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [1,1,0,0,0,0|1,0,0]=3 3252 B12R1.49 COC(=O)Cc1ncc(cn1)O 271570a_203496583355_100010080487 [1,1,0,0,0,0|2,0,0]=4 3253 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [1,1,0,0,0,0|1,0,0]=3 3254 B12R1.49 COC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000188976 [1,1,0,0,0,0|2,0,0]=4 3255 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [1,1,0,0,0,0|0,0,0]=2 3256 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [1,1,0,0,0,0|0,0,0]=2 3257 B12R1.49 Cc1ccc(cc1)CN(C)CF 269982a_100000744650_100015361967 [1,1,0,0,0,0|2,0,0]=4 3258 B12R1.49 Cc1ccc(cc1)CN(C)CF 34a_100000744650_100015361967 [1,1,0,0,0,0|2,0,0]=4 3259 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [1,1,0,0,0,0|1,0,0]=3 3260 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [1,1,0,0,0,0|1,0,0]=3 3261 B12R1.49 Cc1ccc(cn1)CC(=O)CF 1458a_100000740413_100015361967 [1,1,0,0,0,0|1,0,0]=3 3262 B12R1.49 Cc1ccc(cn1)CC(=O)CO 1458a_100000210174_100016987292 [1,1,0,0,0,0|1,0,0]=3 3263 B12R1.49 Cc1ccc(nc1)CC(=O)CF 1458a_100025705728_100015361967 [1,1,0,0,0,0|1,0,0]=3 3264 B12R1.49 Cc1ccc(nc1)CC(=O)CO 1458a_100000210174_100000691093 [1,1,0,0,0,0|1,0,0]=3 3265 B12R1.49 Cc1cnc(cn1)CC(=O)CO 1458a_100000210174_100000752025 [1,1,0,0,0,0|2,0,0]=4 3266 B12R1.49 Cc1cnc(nc1)CC(=O)CO 1458a_100000210174_100000685645 [1,1,0,0,0,0|2,0,0]=4 3267 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [1,1,0,0,0,0|1,0,0]=3 3268 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [1,1,0,0,0,0|1,0,0]=3 3269 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [1,1,0,0,0,0|1,0,0]=3 3270 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [1,1,0,0,0,0|1,0,0]=3 3271 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [1,1,0,0,0,0|0,0,0]=2 3272 B12R1.49 O=C(CF)Cc1ccc(cn1)Br 1458a_100020629044_100015361967 [1,1,0,0,0,0|2,0,0]=4 3273 B12R1.49 O=C(CF)Cc1ccc(cn1)Cl 1458a_100000728320_100015361967 [1,1,0,0,0,0|2,0,0]=4 3274 B12R1.49 O=C(CF)Cc1ccc(nc1)Br 1458a_100010067268_100015361967 [1,1,0,0,0,0|2,0,0]=4 3275 B12R1.49 O=C(CF)Cc1ccc(nc1)Cl 1458a_100000061944_100015361967 [1,1,0,0,0,0|2,0,0]=4 3276 B12R1.49 O=C(CF)Cn1ccc(=O)cc1 1458a_200000238563_100015361967 [1,1,0,0,0,0|1,0,1]=4 3277 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [1,1,0,0,0,0|1,0,0]=3 3278 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [1,1,0,0,0,0|1,0,0]=3 3279 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [1,1,0,0,0,0|1,0,0]=3 3280 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [1,1,0,0,0,0|1,0,0]=3 3281 B12R1.49 O=C(CO)Cc1ccc(cn1)Br 1458a_100000210174_100000702658 [1,1,0,0,0,0|2,0,0]=4 3282 B12R1.49 O=C(CO)Cc1ccc(cn1)Cl 1458a_100000210174_100012066911 [1,1,0,0,0,0|2,0,0]=4 3283 B12R1.49 O=C(CO)Cc1ccc(cn1)F 1458a_100000210174_100000703193 [1,1,0,0,0,0|2,0,0]=4 3284 B12R1.49 O=C(CO)Cc1ccc(nc1)Br 1458a_100000210174_100009831999 [1,1,0,0,0,0|2,0,0]=4 3285 B12R1.49 O=C(CO)Cc1ccc(nc1)Cl 1458a_100000210174_100000735431 [1,1,0,0,0,0|2,0,0]=4 3286 B12R1.49 O=C(CO)Cc1ccc(nc1)F 1458a_100000210174_100009820150 [1,1,0,0,0,0|2,0,0]=4 3287 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [1,1,0,0,0,0|2,0,0]=4 3288 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [1,1,0,0,0,0|2,0,0]=4 3289 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [1,1,0,0,0,0|2,0,0]=4 3290 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [1,1,0,0,0,0|2,0,0]=4 3291 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [1,1,0,0,0,0|2,0,0]=4 3292 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [1,1,0,0,0,0|2,0,0]=4 3293 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [1,1,0,0,0,0|2,0,0]=4 3294 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [1,1,0,0,0,0|2,0,0]=4 3295 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [1,1,0,0,0,0|1,0,0]=3 3296 B12R1.106 CC(F)(F)Cc1ccc(cc1)O 271570a_203496583355_100010238340 [1,1,0,0,0,0|1,0,1]=4 3297 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [1,1,0,0,0,0|1,0,0]=3 3298 B12R1.106 CS(=O)(=O)Cc1ccc(nc1)O 271570a_203496583355_200000061366 [1,1,0,0,0,0|2,0,0]=4 3299 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O 271570a_203496583355_200000165602 [1,1,0,0,0,0|2,0,0]=4 3300 B12R1.106 C[Si](C)(C)Cc1ccc(cc1)O 271570a_203496583355_100009813299 [1,1,0,0,0,0|1,1,0]=4 3301 B12R1.106 Cc1ccc(cc1)NS(=O)(=O)C 40a_100000124888_100000738038 [1,1,0,0,0,0|2,0,0]=4 3302 B12R1.106 NS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100000764258 [1,1,0,0,0,0|2,0,0]=4 3303 B12R1.233 CC(=Cc1ccc(cc1Br)C)C 271570a_100102525489_100009813563 [1,1,0,0,0,0|1,0,1]=4 3304 B12R1.233 CC(=Cc1ccc(cc1Br)O)C 271570a_100102525489_100000701344 [1,1,0,0,0,0|1,0,1]=4 3305 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [1,1,0,0,0,0|1,0,1]=4 3306 B12R1.233 CC(=Cc1ccc(cc1C)O)C 271570a_100102525489_100000729255 [1,1,0,0,0,0|1,0,1]=4 3307 B12R1.233 CC(=Cc1ccc(cc1Cl)C)C 271570a_100102525489_100011263221 [1,1,0,0,0,0|1,0,1]=4 3308 B12R1.233 CC(=Cc1ccc(cc1Cl)O)C 271570a_100102525489_100000047559 [1,1,0,0,0,0|1,0,1]=4 3309 B12R1.233 CC(=Cc1ccc(cc1F)C)C 271570a_100102525489_100011216119 [1,1,0,0,0,0|1,0,1]=4 3310 B12R1.233 CC(=Cc1ccc(cc1F)O)C 271570a_100102525489_100000755031 [1,1,0,0,0,0|1,0,1]=4 3311 B12R1.233 CC(=Cc1ccc(cc1N)C)C 271570a_100102525489_100011216686 [1,1,0,0,0,0|1,0,1]=4 3312 B12R1.233 CC(=Cc1ccc(cc1N)O)C 271570a_100102525489_100011999798 [1,1,0,0,0,0|1,0,1]=4 3313 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [1,1,0,0,0,0|1,0,1]=4 3314 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [1,1,0,0,0,0|1,0,1]=4 3315 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [1,1,0,0,0,0|1,0,0]=3 3316 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [1,1,0,0,0,0|1,0,0]=3 3317 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [1,1,0,0,0,0|1,0,0]=3 3318 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [1,1,0,0,0,0|1,0,0]=3 3319 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [1,1,0,0,0,0|1,0,0]=3 3320 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [1,1,0,0,0,0|1,0,0]=3 3321 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [1,1,0,0,0,0|1,0,0]=3 3322 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [1,1,0,0,0,0|0,0,0]=2 3323 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [1,1,0,0,0,0|1,0,0]=3 3324 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [1,1,0,0,0,0|1,0,0]=3 3325 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [1,1,0,0,0,0|0,0,0]=2 3326 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [1,1,0,0,0,0|0,0,0]=2 3327 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [1,1,0,0,0,0|1,0,0]=3 3328 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [1,1,0,0,0,0|1,0,0]=3 3329 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [1,1,0,0,0,0|1,0,0]=3 3330 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [1,1,0,0,0,0|1,0,0]=3 3331 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [1,1,0,0,0,0|1,0,0]=3 3332 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [1,1,0,0,0,0|0,0,0]=2 3333 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [1,1,0,0,0,0|1,0,0]=3 3334 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [1,1,0,0,0,0|1,0,0]=3 3335 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [1,1,0,0,0,0|1,0,0]=3 3336 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [1,1,0,0,0,0|1,0,0]=3 3337 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [1,1,0,0,0,0|1,0,0]=3 3338 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [1,1,0,0,0,0|1,0,0]=3 3339 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [1,1,0,0,0,0|0,0,0]=2 3340 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [1,1,0,0,0,0|0,0,0]=2 3341 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [1,1,0,0,0,0|1,0,0]=3 3342 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [1,1,0,0,0,0|1,0,0]=3 3343 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [1,1,0,0,0,0|1,0,0]=3 3344 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [1,1,0,0,0,0|1,0,0]=3 3345 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [1,1,0,0,0,0|1,0,0]=3 3346 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [1,1,0,0,0,0|1,0,0]=3 3347 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [1,1,0,0,0,0|0,0,0]=2 3348 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [1,1,0,0,0,0|1,0,0]=3 3349 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [1,1,0,0,0,0|1,0,0]=3 3350 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [1,1,0,0,0,0|1,0,0]=3 3351 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [1,1,0,0,0,0|1,0,0]=3 3352 B12R1.233 CC(=O)Cc1ccc(nc1Br)C 1458a_100000070787_200010064658 [1,1,0,0,0,0|1,0,0]=3 3353 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_100000070787_100000722033 [1,1,0,0,0,0|2,0,0]=4 3354 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200000210301 [1,1,0,0,0,0|2,0,0]=4 3355 B12R1.233 CC(=O)Cc1cnc(cc1C)F 1458a_100000070787_100010382440 [1,1,0,0,0,0|2,0,0]=4 3356 B12R1.233 CC(=O)Cc1cnc(cc1Cl)Cl 1458a_100000070787_100011997056 [1,1,0,0,0,0|2,0,0]=4 3357 B12R1.233 CC(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200000210301 [1,1,0,0,0,0|2,0,0]=4 3358 B12R1.233 CC(=O)Cc1ncc(cc1C)C 1458a_100000070787_100016990036 [1,1,0,0,0,0|1,0,0]=3 3359 B12R1.233 CC(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200000210301 [1,1,0,0,0,0|2,0,0]=4 3360 B12R1.233 CC(=O)Cc1ncc(cc1F)Cl 1458a_100000070787_200009879301 [1,1,0,0,0,0|2,0,0]=4 3361 B12R1.233 CC(=O)Cn1ccc(cc1=O)C 1458a_100000721392_200000210301 [1,1,0,0,0,0|1,0,0]=3 3362 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100015343762 [1,1,0,0,0,0|2,0,0]=4 3363 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100015343762 [1,1,0,0,0,0|2,0,0]=4 3364 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100015343762 [1,1,0,0,0,0|1,0,0]=3 3365 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100015343762 [1,1,0,0,0,0|1,0,0]=3 3366 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100015343762 [1,1,0,0,0,0|2,0,0]=4 3367 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100015343762 [1,1,0,0,0,0|2,0,0]=4 3368 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100015343762 [1,1,0,0,0,0|2,0,0]=4 3369 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100015343762 [1,1,0,0,0,0|2,0,0]=4 3370 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100015343762 [1,1,0,0,0,0|2,0,0]=4 3371 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100015343762 [1,1,0,0,0,0|2,0,0]=4 3372 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [1,1,0,0,0,0|1,0,0]=3 3373 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [1,1,0,0,0,0|1,0,0]=3 3374 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100015343762 [1,1,0,0,0,0|2,0,0]=4 3375 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100015343762 [1,1,0,0,0,0|2,0,0]=4 3376 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000070787 [1,1,0,0,0,0|2,0,0]=4 3377 B12R1.233 CC(=O)Nc1ccc(cc1C)C 11a_100000736561_100015343762 [1,1,0,0,0,0|1,0,0]=3 3378 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100015343762 [1,1,0,0,0,0|1,0,0]=3 3379 B12R1.233 CC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000070787 [1,1,0,0,0,0|1,0,0]=3 3380 B12R1.233 CC(=O)Nc1ccc(cc1C)C 527a_100000736561_100103153847 [1,1,0,0,0,0|1,0,0]=3 3381 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100015343762 [1,1,0,0,0,0|2,0,0]=4 3382 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100015343762 [1,1,0,0,0,0|2,0,0]=4 3383 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000070787 [1,1,0,0,0,0|2,0,0]=4 3384 B12R1.233 CC(=O)Nc1ccc(cc1C)F 11a_100000211637_100015343762 [1,1,0,0,0,0|2,0,0]=4 3385 B12R1.233 CC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100015343762 [1,1,0,0,0,0|2,0,0]=4 3386 B12R1.233 CC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000070787 [1,1,0,0,0,0|2,0,0]=4 3387 B12R1.233 CC(=O)Nc1ccc(cc1C)F 527a_100000211637_100103153847 [1,1,0,0,0,0|2,0,0]=4 3388 B12R1.233 CC(=O)Nc1ccc(cc1C)I 11a_100000184554_100015343762 [1,1,0,0,0,0|2,0,0]=4 3389 B12R1.233 CC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100015343762 [1,1,0,0,0,0|2,0,0]=4 3390 B12R1.233 CC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000070787 [1,1,0,0,0,0|2,0,0]=4 3391 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [1,1,0,0,0,0|1,0,0]=3 3392 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [1,1,0,0,0,0|1,0,0]=3 3393 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [1,1,0,0,0,0|1,0,0]=3 3394 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100015343762 [1,1,0,0,0,0|2,0,0]=4 3395 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100015343762 [1,1,0,0,0,0|2,0,0]=4 3396 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100015343762 [1,1,0,0,0,0|1,0,0]=3 3397 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100015343762 [1,1,0,0,0,0|1,0,0]=3 3398 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000070787 [1,1,0,0,0,0|1,0,0]=3 3399 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100015343762 [1,1,0,0,0,0|2,0,0]=4 3400 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100015343762 [1,1,0,0,0,0|2,0,0]=4 3401 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000070787 [1,1,0,0,0,0|2,0,0]=4 3402 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100015343762 [1,1,0,0,0,0|2,0,0]=4 3403 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100015343762 [1,1,0,0,0,0|2,0,0]=4 3404 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000070787 [1,1,0,0,0,0|2,0,0]=4 3405 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100015343762 [1,1,0,0,0,0|2,0,0]=4 3406 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100015343762 [1,1,0,0,0,0|2,0,0]=4 3407 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000070787 [1,1,0,0,0,0|2,0,0]=4 3408 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [1,1,0,0,0,0|1,0,0]=3 3409 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [1,1,0,0,0,0|1,0,0]=3 3410 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [1,1,0,0,0,0|1,0,0]=3 3411 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100015343762 [1,1,0,0,0,0|2,0,0]=4 3412 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100015343762 [1,1,0,0,0,0|2,0,0]=4 3413 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000070787 [1,1,0,0,0,0|2,0,0]=4 3414 B12R1.233 CC(=O)Nc1ccc(cc1F)C 11a_100000211023_100015343762 [1,1,0,0,0,0|1,0,0]=3 3415 B12R1.233 CC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100015343762 [1,1,0,0,0,0|1,0,0]=3 3416 B12R1.233 CC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000070787 [1,1,0,0,0,0|1,0,0]=3 3417 B12R1.233 CC(=O)Nc1ccc(cc1F)C 527a_100000211023_100103153847 [1,1,0,0,0,0|1,0,0]=3 3418 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100015343762 [1,1,0,0,0,0|2,0,0]=4 3419 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100015343762 [1,1,0,0,0,0|2,0,0]=4 3420 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000070787 [1,1,0,0,0,0|2,0,0]=4 3421 B12R1.233 CC(=O)Nc1ccc(cc1F)F 11a_100000210720_100015343762 [1,1,0,0,0,0|2,0,0]=4 3422 B12R1.233 CC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100015343762 [1,1,0,0,0,0|2,0,0]=4 3423 B12R1.233 CC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000070787 [1,1,0,0,0,0|2,0,0]=4 3424 B12R1.233 CC(=O)Nc1ccc(cc1F)I 11a_100011215594_100015343762 [1,1,0,0,0,0|2,0,0]=4 3425 B12R1.233 CC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100015343762 [1,1,0,0,0,0|2,0,0]=4 3426 B12R1.233 CC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000070787 [1,1,0,0,0,0|2,0,0]=4 3427 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [1,1,0,0,0,0|1,0,0]=3 3428 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [1,1,0,0,0,0|1,0,0]=3 3429 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [1,1,0,0,0,0|1,0,0]=3 3430 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100015343762 [1,1,0,0,0,0|2,0,0]=4 3431 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100015343762 [1,1,0,0,0,0|2,0,0]=4 3432 B12R1.233 CC(=O)Nc1ccc(cc1I)C 11a_100011356834_100015343762 [1,1,0,0,0,0|1,0,0]=3 3433 B12R1.233 CC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100015343762 [1,1,0,0,0,0|1,0,0]=3 3434 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100015343762 [1,1,0,0,0,0|2,0,0]=4 3435 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100015343762 [1,1,0,0,0,0|2,0,0]=4 3436 B12R1.233 CC(=O)Nc1ccc(cc1I)F 11a_100000760547_100015343762 [1,1,0,0,0,0|2,0,0]=4 3437 B12R1.233 CC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100015343762 [1,1,0,0,0,0|2,0,0]=4 3438 B12R1.233 CC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000070787 [1,1,0,0,0,0|2,0,0]=4 3439 B12R1.233 CC(=O)Nc1ccc(cc1I)I 11a_100010002754_100015343762 [1,1,0,0,0,0|2,0,0]=4 3440 B12R1.233 CC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100015343762 [1,1,0,0,0,0|2,0,0]=4 3441 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [1,1,0,0,0,0|1,0,0]=3 3442 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [1,1,0,0,0,0|1,0,0]=3 3443 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [1,1,0,0,0,0|1,0,0]=3 3444 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [1,1,0,0,0,0|2,0,0]=4 3445 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [1,1,0,0,0,0|2,0,0]=4 3446 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [1,1,0,0,0,0|2,0,0]=4 3447 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [1,1,0,0,0,0|1,0,0]=3 3448 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [1,1,0,0,0,0|1,0,0]=3 3449 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [1,1,0,0,0,0|1,0,0]=3 3450 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [1,1,0,0,0,0|2,0,0]=4 3451 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [1,1,0,0,0,0|2,0,0]=4 3452 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [1,1,0,0,0,0|2,0,0]=4 3453 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [1,1,0,0,0,0|2,0,0]=4 3454 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [1,1,0,0,0,0|2,0,0]=4 3455 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [1,1,0,0,0,0|2,0,0]=4 3456 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [1,1,0,0,0,0|2,0,0]=4 3457 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [1,1,0,0,0,0|1,0,0]=3 3458 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [1,1,0,0,0,0|1,0,0]=3 3459 B12R1.233 CC(=O)Nc1ncc(cc1C)O 271570a_203496583355_200011934169 [1,1,0,0,0,0|2,0,0]=4 3460 B12R1.233 CC(=O)Nc1ncc(cc1O)C 271570a_203496583355_200009816786 [1,1,0,0,0,0|2,0,0]=4 3461 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [1,1,0,0,0,0|1,0,0]=3 3462 B12R1.233 CN(C)Cc1ccc(cc1F)O 271570a_203496583355_100000174744 [1,1,0,0,0,0|2,0,0]=4 3463 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [1,1,0,0,0,0|1,0,0]=3 3464 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [1,1,0,0,0,0|1,0,0]=3 3465 B12R1.233 Cc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000692596 [1,1,0,0,0,0|2,0,0]=4 3466 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [1,1,0,0,0,0|0,0,0]=2 3467 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [1,1,0,0,0,0|2,0,0]=4 3468 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [1,1,0,0,0,0|2,0,0]=4 3469 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [1,1,0,0,0,0|2,0,0]=4 3471 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [1,1,0,0,0,0|2,0,0]=4 3472 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [1,1,0,0,0,0|2,0,0]=4 3473 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [1,1,0,0,0,0|2,0,0]=4 3474 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [1,1,0,0,0,0|2,0,0]=4 3475 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [1,1,0,0,0,0|2,0,0]=4 3476 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_100012349684 [1,1,0,0,0,0|2,0,0]=4 3477 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_100012349684 [1,1,0,0,0,0|2,0,0]=4 3478 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100011935181 [1,1,0,0,0,0|2,0,0]=4 3479 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [1,1,0,0,0,0|0,0,0]=2 3480 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011217900 [1,1,0,0,0,0|2,0,0]=4 3481 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011217900 [1,1,0,0,0,0|2,0,0]=4 3482 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011217368 [1,1,0,0,0,0|2,0,0]=4 3483 B12R1.233 Cc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010150104 [1,1,0,0,0,0|2,0,0]=4 3484 B12R1.233 Cc1ccn(c(=O)c1)CC(=O)[13CH3] 1458a_100000721392_200025704644 [1,1,0,0,0,0|1,0,0]=3 3485 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [1,1,0,0,0,0|1,0,0]=3 3486 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [1,1,0,0,0,0|1,0,0]=3 3487 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [1,1,0,0,0,0|1,0,0]=3 3488 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [1,1,0,0,0,0|0,0,0]=2 3489 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [1,1,0,0,0,0|1,0,0]=3 3490 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [1,1,0,0,0,0|1,0,0]=3 3491 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [1,1,0,0,0,0|1,0,0]=3 3492 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [1,1,0,0,0,0|1,0,0]=3 3493 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [1,1,0,0,0,0|1,0,0]=3 3494 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [1,1,0,0,0,0|1,0,0]=3 3495 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [1,1,0,0,0,0|1,0,0]=3 3496 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [1,1,0,0,0,0|0,0,0]=2 3497 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [1,1,0,0,0,0|1,0,0]=3 3498 B12R1.233 [13CH3]C(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200025704644 [1,1,0,0,0,0|2,0,0]=4 3499 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200025704644 [1,1,0,0,0,0|2,0,0]=4 3500 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200025704644 [1,1,0,0,0,0|2,0,0]=4 3501 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [1,1,0,0,0,0|1,0,1]=4 3502 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [1,1,0,0,0,0|0,0,2]=4 3503 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [1,1,0,0,0,0|0,0,2]=4 3504 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [1,1,0,0,0,0|0,0,2]=4 3505 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [1,1,0,0,0,0|0,0,2]=4 3506 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [1,1,0,0,0,0|0,0,2]=4 3507 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [1,1,0,0,0,0|1,0,1]=4 3508 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [1,1,0,0,0,0|1,0,1]=4 3509 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [1,1,0,0,0,0|1,0,1]=4 3510 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [1,1,0,0,0,0|1,0,1]=4 3511 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [1,1,0,0,0,0|1,0,1]=4 3512 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [1,1,0,0,0,0|1,0,1]=4 3513 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [1,1,0,0,0,0|0,0,1]=3 3514 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [1,1,0,0,0,0|0,0,1]=3 3515 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [1,1,0,0,0,0|0,0,1]=3 3516 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [1,1,0,0,0,0|0,0,1]=3 3517 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [1,1,0,0,0,0|0,1,1]=4 3518 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [1,1,0,0,0,0|0,1,1]=4 3519 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [1,1,0,0,0,0|0,1,1]=4 3520 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [1,1,0,0,0,0|0,1,1]=4 3521 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [1,1,0,0,0,0|0,0,1]=3 3522 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [1,1,0,0,0,0|0,0,1]=3 3523 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_100000246506_200000210301 [1,1,0,0,0,0|0,1,1]=4 3524 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_200000210301_100000246506 [1,1,0,0,0,0|0,1,1]=4 3525 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_100000246506_200025704644 [1,1,0,0,0,0|0,1,1]=4 3526 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000246506 [1,1,0,0,0,0|0,1,1]=4 3527 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [1,1,0,0,0,0|1,0,1]=4 3528 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [1,1,0,0,0,0|1,0,1]=4 3529 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [1,1,0,0,0,0|1,0,1]=4 3530 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_100025736560_200000210301 [1,1,0,0,0,0|0,1,1]=4 3531 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_200000210301_100025736560 [1,1,0,0,0,0|0,1,1]=4 3532 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_100025736560_200025704644 [1,1,0,0,0,0|0,1,1]=4 3533 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100025736560 [1,1,0,0,0,0|0,1,1]=4 3534 B12R1.5 CCc1ccc(cc1)C(C)NC 2230a_100015186439_200000210301 [1,1,0,0,0,0|2,0,0]=4 3535 B12R1.5 CCc1ccc(cc1)C(C)NC 269862a_106832991636_100000211630 [1,1,0,0,0,0|2,0,0]=4 3536 B12R1.5 CCc1ccc(cc1)C(C)NC 34a_100015186439_200000210301 [1,1,0,0,0,0|2,0,0]=4 3537 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 2230a_100015186439_200025704644 [1,1,0,0,0,0|2,0,0]=4 3538 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 34a_100015186439_200025704644 [1,1,0,0,0,0|2,0,0]=4 3539 B12R1.5 CCc1ccc(cc1)C(C)OC 34a_100011232672_200000210301 [1,1,0,0,0,0|2,0,0]=4 3540 B12R1.5 CCc1ccc(cc1)C(C)OC 7a_100011232672_200000210301 [1,1,0,0,0,0|2,0,0]=4 3541 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 34a_100011232672_200025704644 [1,1,0,0,0,0|2,0,0]=4 3542 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 7a_100011232672_200025704644 [1,1,0,0,0,0|2,0,0]=4 3543 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [1,1,0,0,0,0|1,0,1]=4 3544 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [1,1,0,0,0,0|1,0,1]=4 3545 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [1,1,0,0,0,0|1,0,1]=4 3546 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [1,1,0,0,0,0|1,0,1]=4 3547 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [1,1,0,0,0,0|1,0,1]=4 3548 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [1,1,0,0,0,0|1,0,1]=4 3549 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [1,1,0,0,0,0|1,0,1]=4 3550 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [1,1,0,0,0,0|1,0,1]=4 3551 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [1,1,0,0,0,0|1,0,0]=3 3552 B12R1.5 CNC(C)c1ccc(cc1)SC 2230a_100000738722_200000210301 [1,1,0,0,0,0|1,1,0]=4 3553 B12R1.5 CNC(C)c1ccc(cc1)SC 269862a_106832991636_100000185071 [1,1,0,0,0,0|1,1,0]=4 3554 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_100000231103_200000210301 [1,1,0,0,0,0|1,1,0]=4 3555 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_200000210301_100000231103 [1,1,0,0,0,0|1,1,0]=4 3556 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_100000231103_200025704644 [1,1,0,0,0,0|1,1,0]=4 3557 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000231103 [1,1,0,0,0,0|1,1,0]=4 3558 B12R1.5 CNC(C)c1ccc(nc1)OC 269862a_106832991636_100011934396 [1,1,0,0,0,0|2,0,0]=4 3559 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [1,1,0,0,0,0|1,0,0]=3 3560 B12R1.5 CNc1ccc(cc1)C(C)NC 269862a_106832991636_100011806243 [1,1,0,0,0,0|2,0,0]=4 3561 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [1,1,0,0,0,0|1,0,1]=4 3562 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [1,1,0,0,0,0|1,0,1]=4 3563 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [1,1,0,0,0,0|1,0,1]=4 3564 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [1,1,0,0,0,0|1,0,1]=4 3565 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [1,1,0,0,0,0|1,0,0]=3 3566 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [1,1,0,0,0,0|1,0,0]=3 3567 B12R1.5 COC(C)c1ccc(cc1)SC 62a_100010254937_200000210301 [1,1,0,0,0,0|1,1,0]=4 3568 B12R1.5 COC(C)c1ccc(cc1)SC 62a_200000210301_100010254937 [1,1,0,0,0,0|1,1,0]=4 3569 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_100010254937_200025704644 [1,1,0,0,0,0|1,1,0]=4 3570 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100010254937 [1,1,0,0,0,0|1,1,0]=4 3571 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [1,1,0,0,0,0|1,0,1]=4 3572 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [1,1,0,0,0,0|1,0,0]=3 3573 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [1,1,0,0,0,0|1,0,0]=3 3574 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [1,1,0,0,0,0|1,0,0]=3 3575 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [1,1,0,0,0,0|1,0,0]=3 3576 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [1,1,0,0,0,0|1,0,0]=3 3577 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [1,1,0,0,0,0|1,0,0]=3 3578 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [1,1,0,0,0,0|1,0,1]=4 3579 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [1,1,0,0,0,0|1,0,0]=3 3580 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000210301 [1,1,0,0,0,0|0,1,1]=4 3581 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_200000210301_100000725942 [1,1,0,0,0,0|0,1,1]=4 3582 B12R1.5 CSc1ccc(cc1)C(C)N[13CH3] 2230a_100000738722_200025704644 [1,1,0,0,0,0|1,1,0]=4 3583 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [1,1,0,0,0,0|1,0,1]=4 3584 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200025704644 [1,1,0,0,0,0|0,1,1]=4 3585 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_200025704644_100000725942 [1,1,0,0,0,0|0,1,1]=4 3586 B12R1.71 C#CCNc1ccc(cc1)OC 34a_100000184247_100000184674 [1,1,0,0,0,0|0,0,2]=4 3587 B12R1.71 C#CCOc1ccc(cc1)OC 34a_100000210503_100000184674 [1,1,0,0,0,0|0,0,2]=4 3588 B12R1.71 C#CCSc1ccc(cc1)OC 62a_100000038162_100000171711 [1,1,0,0,0,0|0,0,2]=4 3589 B12R1.71 C#Cc1ccc(cc1)NCC=O 34a_100011215031_200009817547 [1,1,0,0,0,0|1,0,1]=4 3590 B12R1.71 C=CCNc1ccc(cc1)CC 2230a_100000211069_100000210623 [1,1,0,0,0,0|1,0,1]=4 3591 B12R1.71 C=CCNc1ccc(cc1)CC 34a_100000211069_100015514636 [1,1,0,0,0,0|1,0,1]=4 3592 B12R1.71 C=CCNc1ccc(cc1)OC 34a_100000184247_100015514636 [1,1,0,0,0,0|0,0,1]=3 3593 B12R1.71 C=CCNc1ccc(cc1)SC 34a_100000212337_100015514636 [1,1,0,0,0,0|0,1,1]=4 3594 B12R1.71 C=CCOc1ccc(cc1)CC 34a_100000211359_100015514636 [1,1,0,0,0,0|1,0,1]=4 3595 B12R1.71 C=CCOc1ccc(cc1)CC 7a_100000211359_100015514636 [1,1,0,0,0,0|1,0,1]=4 3596 B12R1.71 C=CCOc1ccc(cc1)NC 34a_100000182112_100015514636 [1,1,0,0,0,0|1,0,1]=4 3597 B12R1.71 C=CCOc1ccc(cc1)OC 34a_100000210503_100015514636 [1,1,0,0,0,0|0,0,1]=3 3598 B12R1.71 C=CCOc1ccc(cc1)SC 34a_100000211864_100015514636 [1,1,0,0,0,0|0,1,1]=4 3599 B12R1.71 C=CCOc1ccc(cc1)SC 62a_100000172055_200000210301 [1,1,0,0,0,0|0,1,1]=4 3600 B12R1.71 C=CCOc1ccc(cc1)SC 62a_200000210301_100000172055 [1,1,0,0,0,0|0,1,1]=4 3601 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_100000172055_200025704644 [1,1,0,0,0,0|0,1,1]=4 3602 B12R1.71 C=CCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000172055 [1,1,0,0,0,0|0,1,1]=4 3603 B12R1.71 C=CCOc1ccc(cn1)OC 34a_100012002028_100015514636 [1,1,0,0,0,0|1,0,1]=4 3604 B12R1.71 C=CCOc1ccc(nc1)OC 34a_100011934560_100015514636 [1,1,0,0,0,0|1,0,1]=4 3605 B12R1.71 C=CCSc1ccc(cc1)CC 62a_100000210623_100011215824 [1,1,0,0,0,0|1,0,1]=4 3606 B12R1.71 C=CCSc1ccc(cc1)CC 62a_100011215824_100000210623 [1,1,0,0,0,0|1,0,1]=4 3607 B12R1.71 C=CCSc1ccc(cc1)NC 62a_100000210623_100000743151 [1,1,0,0,0,0|1,0,1]=4 3608 B12R1.71 C=CCSc1ccc(cc1)NC 62a_100000743151_100000210623 [1,1,0,0,0,0|1,0,1]=4 3609 B12R1.71 C=CCSc1ccc(cc1)OC 62a_100000210623_100000171711 [1,1,0,0,0,0|0,0,1]=3 3610 B12R1.71 C=CCSc1ccc(cc1)SC 62a_100000210623_100011263217 [1,1,0,0,0,0|0,1,1]=4 3611 B12R1.71 C=CCSc1ccc(cc1)SC 62a_100011263217_100000210623 [1,1,0,0,0,0|0,1,1]=4 3612 B12R1.71 C=CCSc1ccc(cn1)OC 62a_100000210623_100000744180 [1,1,0,0,0,0|1,0,1]=4 3613 B12R1.71 C=CCSc1ccc(cn1)OC 62a_100000755202_100000210623 [1,1,0,0,0,0|1,0,1]=4 3614 B12R1.71 C=CCSc1ccc(nc1)OC 62a_100000047065_100000210623 [1,1,0,0,0,0|1,0,1]=4 3615 B12R1.71 C=CCSc1ccc(nc1)OC 62a_100000210623_100000047065 [1,1,0,0,0,0|1,0,1]=4 3616 B12R1.71 C=Cc1ccc(cc1)CCC=O 271570a_100011290941_100011361538 [1,1,0,0,0,0|1,0,1]=4 3617 B12R1.71 C=Cc1ccc(cc1)NCC=O 34a_100011218248_200009817547 [1,1,0,0,0,0|1,0,1]=4 3618 B12R1.71 C=Cc1ccc(cc1)OCC=O 34a_100000189437_200009817547 [1,1,0,0,0,0|1,0,1]=4 3619 B12R1.71 C=Cc1ccc(cc1)OCC=O 7a_100000189437_200015260668 [1,1,0,0,0,0|1,0,1]=4 3620 B12R1.71 C=Cc1ccc(cc1)SCC=O 62a_100000748128_200015260668 [1,1,0,0,0,0|1,0,1]=4 3621 B12R1.71 C=Cc1ccc(cc1)SCC=O 62a_200015260668_100000748128 [1,1,0,0,0,0|1,0,1]=4 3622 B12R1.71 CC=NNc1ccc(cc1)CC 4a_100015204395_200000210099 [1,1,0,0,0,0|2,0,0]=4 3623 B12R1.71 CC=NNc1ccc(cc1)OC 4a_100000005221_200000210099 [1,1,0,0,0,0|1,0,0]=3 3624 B12R1.71 CC=NNc1ccc(cc1)SC 4a_100000006515_200000210099 [1,1,0,0,0,0|1,1,0]=4 3625 B12R1.71 CC=NNc1ccc(nc1)OC 4a_100102564821_200000210099 [1,1,0,0,0,0|2,0,0]=4 3626 B12R1.71 CCCCc1ccc(cc1)CC 271570a_100020621405_100011215824 [1,1,0,0,0,0|1,0,1]=4 3627 B12R1.71 CCCCc1ccc(cc1)NC 2230a_100000210628_200000210301 [1,1,0,0,0,0|1,0,1]=4 3628 B12R1.71 CCCCc1ccc(cc1)NC 271570a_100020621405_100000219623 [1,1,0,0,0,0|1,0,1]=4 3629 B12R1.71 CCCCc1ccc(cc1)NC 34a_100000210628_200000210301 [1,1,0,0,0,0|1,0,1]=4 3630 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 2230a_100000210628_200025704644 [1,1,0,0,0,0|1,0,1]=4 3631 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 34a_100000210628_200025704644 [1,1,0,0,0,0|1,0,1]=4 3632 B12R1.71 CCCCc1ccc(cc1)OC 271570a_100020621405_100000171711 [1,1,0,0,0,0|0,0,1]=3 3633 B12R1.71 CCCCc1ccc(cc1)OC 34a_100011216022_200000210301 [1,1,0,0,0,0|0,0,1]=3 3634 B12R1.71 CCCCc1ccc(cc1)OC 7a_100011216022_200000210301 [1,1,0,0,0,0|0,0,1]=3 3635 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 34a_100011216022_200025704644 [1,1,0,0,0,0|0,0,1]=3 3636 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 7a_100011216022_200025704644 [1,1,0,0,0,0|0,0,1]=3 3637 B12R1.71 CCCCc1ccc(cc1)SC 271570a_100020621405_100011263217 [1,1,0,0,0,0|0,1,1]=4 3638 B12R1.71 CCCCc1ccc(cc1)SC 62a_100011218101_200000210301 [1,1,0,0,0,0|0,1,1]=4 3639 B12R1.71 CCCCc1ccc(cc1)SC 62a_200000210301_100011218101 [1,1,0,0,0,0|0,1,1]=4 3640 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_100011218101_200025704644 [1,1,0,0,0,0|0,1,1]=4 3641 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_200025704644_100011218101 [1,1,0,0,0,0|0,1,1]=4 3642 B12R1.71 CCCCc1ccc(cn1)OC 271570a_100020621405_100000755202 [1,1,0,0,0,0|1,0,1]=4 3643 B12R1.71 CCCCc1ccc(nc1)OC 271570a_100020621405_100000047065 [1,1,0,0,0,0|1,0,1]=4 3644 B12R1.71 CCCNc1ccc(cc1)CC 2230a_100000211069_100000210303 [1,1,0,0,0,0|1,0,1]=4 3645 B12R1.71 CCCNc1ccc(cc1)CC 34a_100000211069_100000210303 [1,1,0,0,0,0|1,0,1]=4 3646 B12R1.71 CCCNc1ccc(cc1)OC 34a_100000184247_100000210303 [1,1,0,0,0,0|0,0,1]=3 3647 B12R1.71 CCCNc1ccc(cc1)SC 34a_100000212337_100000210303 [1,1,0,0,0,0|0,1,1]=4 3648 B12R1.71 CCCOc1ccc(cc1)CC 34a_100000211359_100000210303 [1,1,0,0,0,0|1,0,1]=4 3649 B12R1.71 CCCOc1ccc(cc1)CC 7a_100000211359_100000210303 [1,1,0,0,0,0|1,0,1]=4 3650 B12R1.71 CCCOc1ccc(cc1)NC 34a_100000182112_100000210303 [1,1,0,0,0,0|1,0,1]=4 3651 B12R1.71 CCCOc1ccc(cc1)NC 34a_100000748631_200000210301 [1,1,0,0,0,0|1,0,1]=4 3652 B12R1.71 CCCOc1ccc(cc1)N[13CH3] 34a_100000748631_200025704644 [1,1,0,0,0,0|1,0,1]=4 3653 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000185468_200000210301 [1,1,0,0,0,0|0,0,1]=3 3654 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000210503_100000210303 [1,1,0,0,0,0|0,0,1]=3 3655 B12R1.71 CCCOc1ccc(cc1)OC 7a_100000185468_200000210301 [1,1,0,0,0,0|0,0,1]=3 3656 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 34a_100000185468_200025704644 [1,1,0,0,0,0|0,0,1]=3 3657 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 7a_100000185468_200025704644 [1,1,0,0,0,0|0,0,1]=3 3658 B12R1.71 CCCOc1ccc(cc1)SC 34a_100000211864_100000210303 [1,1,0,0,0,0|0,1,1]=4 3659 B12R1.71 CCCOc1ccc(cc1)SC 62a_100000169948_200000210301 [1,1,0,0,0,0|0,1,1]=4 3660 B12R1.71 CCCOc1ccc(cc1)SC 62a_200000210301_100000169948 [1,1,0,0,0,0|0,1,1]=4 3661 B12R1.71 CCCOc1ccc(cc1)S[13CH3] 62a_100000169948_200025704644 [1,1,0,0,0,0|0,1,1]=4 3662 B12R1.71 CCCOc1ccc(cc1)S[13CH3] 62a_200025704644_100000169948 [1,1,0,0,0,0|0,1,1]=4 3663 B12R1.71 CCCOc1ccc(cn1)OC 34a_100012002028_100000210303 [1,1,0,0,0,0|1,0,1]=4 3664 B12R1.71 CCCOc1ccc(nc1)OC 34a_100011934560_100000210303 [1,1,0,0,0,0|1,0,1]=4 3665 B12R1.71 CCCSc1ccc(cc1)CC 62a_100000210303_100011215824 [1,1,0,0,0,0|1,0,1]=4 3666 B12R1.71 CCCSc1ccc(cc1)CC 62a_100011215824_100000210303 [1,1,0,0,0,0|1,0,1]=4 3667 B12R1.71 CCCSc1ccc(cc1)NC 34a_100015183887_200000210301 [1,1,0,0,0,0|1,0,1]=4 3668 B12R1.71 CCCSc1ccc(cc1)NC 62a_100000210303_100000743151 [1,1,0,0,0,0|1,0,1]=4 3669 B12R1.71 CCCSc1ccc(cc1)NC 62a_100000743151_100000210303 [1,1,0,0,0,0|1,0,1]=4 3670 B12R1.71 CCCSc1ccc(cc1)NC 7a_100015183887_200000210301 [1,1,0,0,0,0|1,0,1]=4 3671 B12R1.71 CCCSc1ccc(cc1)N[13CH3] 34a_100015183887_200025704644 [1,1,0,0,0,0|1,0,1]=4 3672 B12R1.71 CCCSc1ccc(cc1)N[13CH3] 7a_100015183887_200025704644 [1,1,0,0,0,0|1,0,1]=4 3673 B12R1.71 CCCSc1ccc(cc1)OC 62a_100000210303_100000171711 [1,1,0,0,0,0|0,0,1]=3 3674 B12R1.71 CCCSc1ccc(cc1)SC 62a_100000210303_100011263217 [1,1,0,0,0,0|0,1,1]=4 3675 B12R1.71 CCCSc1ccc(cc1)SC 62a_100011263217_100000210303 [1,1,0,0,0,0|0,1,1]=4 3676 B12R1.71 CCCSc1ccc(cc1)SC 62a_200000210301_200009811899 [1,1,0,0,0,0|0,1,1]=4 3677 B12R1.71 CCCSc1ccc(cc1)SC 62a_200009811899_200000210301 [1,1,0,0,0,0|0,1,1]=4 3678 B12R1.71 CCCSc1ccc(cc1)S[13CH3] 62a_200009811899_200025704644 [1,1,0,0,0,0|0,1,1]=4 3679 B12R1.71 CCCSc1ccc(cc1)S[13CH3] 62a_200025704644_200009811899 [1,1,0,0,0,0|0,1,1]=4 3680 B12R1.71 CCCSc1ccc(cn1)OC 62a_100000210303_100000744180 [1,1,0,0,0,0|1,0,1]=4 3681 B12R1.71 CCCSc1ccc(cn1)OC 62a_100000755202_100000210303 [1,1,0,0,0,0|1,0,1]=4 3682 B12R1.71 CCCSc1ccc(nc1)OC 62a_100000047065_100000210303 [1,1,0,0,0,0|1,0,1]=4 3683 B12R1.71 CCCSc1ccc(nc1)OC 62a_100000210303_100000047065 [1,1,0,0,0,0|1,0,1]=4 3684 B12R1.71 CCNCc1ccc(cc1)CC 207a_100015525214_100000211036 [1,1,0,0,0,0|1,0,1]=4 3685 B12R1.71 CCNCc1ccc(cc1)CC 2230a_100000721222_100000210202 [1,1,0,0,0,0|1,0,1]=4 3686 B12R1.71 CCNCc1ccc(cc1)CC 2230a_100015525214_100000747183 [1,1,0,0,0,0|1,0,1]=4 3687 B12R1.71 CCNCc1ccc(cc1)CC 270004a_100015525214_100000211036 [1,1,0,0,0,0|1,0,1]=4 3688 B12R1.71 CCNCc1ccc(cc1)CC 34a_100000721222_100000210202 [1,1,0,0,0,0|1,0,1]=4 3689 B12R1.71 CCNCc1ccc(cc1)OC 207a_100015525214_100000169835 [1,1,0,0,0,0|0,0,1]=3 3690 B12R1.71 CCNCc1ccc(cc1)OC 2230a_100015525214_100000742318 [1,1,0,0,0,0|0,0,1]=3 3691 B12R1.71 CCNCc1ccc(cc1)OC 270004a_100015525214_100000169835 [1,1,0,0,0,0|0,0,1]=3 3692 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000185587_100000210202 [1,1,0,0,0,0|0,0,1]=3 3693 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000748449_200000210301 [1,1,0,0,0,0|0,0,1]=3 3694 B12R1.71 CCNCc1ccc(cc1)O[13CH3] 34a_100000748449_200025704644 [1,1,0,0,0,0|0,0,1]=3 3695 B12R1.71 CCNCc1ccc(cc1)SC 207a_100015525214_100000211154 [1,1,0,0,0,0|0,1,1]=4 3696 B12R1.71 CCNCc1ccc(cc1)SC 2230a_100000174980_100000210202 [1,1,0,0,0,0|0,1,1]=4 3697 B12R1.71 CCNCc1ccc(cc1)SC 2230a_100015525214_100000181263 [1,1,0,0,0,0|0,1,1]=4 3698 B12R1.71 CCNCc1ccc(cc1)SC 270004a_100015525214_100000211154 [1,1,0,0,0,0|0,1,1]=4 3699 B12R1.71 CCNCc1ccc(cc1)SC 34a_100000174980_100000210202 [1,1,0,0,0,0|0,1,1]=4 3700 B12R1.71 CCNCc1ccc(cc1)SC 62a_100000187385_200000210301 [1,1,0,0,0,0|0,1,1]=4 3701 B12R1.71 CCNCc1ccc(cc1)SC 62a_200000210301_100000187385 [1,1,0,0,0,0|0,1,1]=4 3702 B12R1.71 CCNCc1ccc(cc1)S[13CH3] 62a_100000187385_200025704644 [1,1,0,0,0,0|0,1,1]=4 3703 B12R1.71 CCNCc1ccc(cc1)S[13CH3] 62a_200025704644_100000187385 [1,1,0,0,0,0|0,1,1]=4 3704 B12R1.71 CCNCc1ccc(cn1)OC 207a_100015525214_100000701244 [1,1,0,0,0,0|1,0,1]=4 3705 B12R1.71 CCNCc1ccc(cn1)OC 2230a_100015525214_200000757186 [1,1,0,0,0,0|1,0,1]=4 3706 B12R1.71 CCNCc1ccc(cn1)OC 270004a_100015525214_100000701244 [1,1,0,0,0,0|1,0,1]=4 3707 B12R1.71 CCNCc1ccc(cn1)OC 34a_100000703904_100000210202 [1,1,0,0,0,0|1,0,1]=4 3708 B12R1.71 CCNCc1ccc(nc1)OC 207a_100015525214_100000761633 [1,1,0,0,0,0|1,0,1]=4 3709 B12R1.71 CCNCc1ccc(nc1)OC 2230a_100000241975_100000210202 [1,1,0,0,0,0|1,0,1]=4 3710 B12R1.71 CCNCc1ccc(nc1)OC 2230a_100015525214_100020631284 [1,1,0,0,0,0|1,0,1]=4 3711 B12R1.71 CCNCc1ccc(nc1)OC 270004a_100015525214_100000761633 [1,1,0,0,0,0|1,0,1]=4 3712 B12R1.71 CCOCc1ccc(cc1)CC 34a_100000702245_100000210202 [1,1,0,0,0,0|1,0,1]=4 3713 B12R1.71 CCOCc1ccc(cc1)CC 34a_100121572206_100000747183 [1,1,0,0,0,0|1,0,1]=4 3714 B12R1.71 CCOCc1ccc(cc1)CC 7a_100000702245_100000210202 [1,1,0,0,0,0|1,0,1]=4 3715 B12R1.71 CCOCc1ccc(cc1)OC 34a_100000173359_100000210202 [1,1,0,0,0,0|0,0,1]=3 3716 B12R1.71 CCOCc1ccc(cc1)OC 34a_100121572206_100000742318 [1,1,0,0,0,0|0,0,1]=3 3717 B12R1.71 CCOCc1ccc(cc1)SC 34a_100011215404_100000210202 [1,1,0,0,0,0|0,1,1]=4 3718 B12R1.71 CCOCc1ccc(cc1)SC 34a_100121572206_100000181263 [1,1,0,0,0,0|0,1,1]=4 3719 B12R1.71 CCOCc1ccc(cc1)SC 62a_100000758564_200000210301 [1,1,0,0,0,0|0,1,1]=4 3720 B12R1.71 CCOCc1ccc(cc1)SC 62a_200000210301_100000758564 [1,1,0,0,0,0|0,1,1]=4 3721 B12R1.71 CCOCc1ccc(cc1)SC 7a_100011215404_100000210202 [1,1,0,0,0,0|0,1,1]=4 3722 B12R1.71 CCOCc1ccc(cc1)S[13CH3] 62a_100000758564_200025704644 [1,1,0,0,0,0|0,1,1]=4 3723 B12R1.71 CCOCc1ccc(cc1)S[13CH3] 62a_200025704644_100000758564 [1,1,0,0,0,0|0,1,1]=4 3724 B12R1.71 CCOCc1ccc(cn1)OC 34a_100011998694_100000210202 [1,1,0,0,0,0|1,0,1]=4 3725 B12R1.71 CCOCc1ccc(cn1)OC 34a_100121572206_200000757186 [1,1,0,0,0,0|1,0,1]=4 3726 B12R1.71 CCOCc1ccc(nc1)OC 34a_100000763316_100000210202 [1,1,0,0,0,0|1,0,1]=4 3727 B12R1.71 CCOCc1ccc(nc1)OC 34a_100121572206_100020631284 [1,1,0,0,0,0|1,0,1]=4 3728 B12R1.71 CCSCc1ccc(cc1)CC 62a_100000210202_100000747183 [1,1,0,0,0,0|1,0,1]=4 3729 B12R1.71 CCSCc1ccc(cc1)CC 62a_100000757233_100000210202 [1,1,0,0,0,0|1,0,1]=4 3730 B12R1.71 CCSCc1ccc(cc1)OC 62a_100000210202_100000742318 [1,1,0,0,0,0|0,0,1]=3 3731 B12R1.71 CCSCc1ccc(cc1)SC 62a_100000181263_100000210202 [1,1,0,0,0,0|0,1,1]=4 3732 B12R1.71 CCSCc1ccc(cc1)SC 62a_100000210202_100000181263 [1,1,0,0,0,0|0,1,1]=4 3733 B12R1.71 CCSCc1ccc(cn1)OC 62a_100000210202_200000757186 [1,1,0,0,0,0|1,0,1]=4 3734 B12R1.71 CCSCc1ccc(cn1)OC 62a_200000757186_100000210202 [1,1,0,0,0,0|1,0,1]=4 3735 B12R1.71 CCSCc1ccc(nc1)OC 62a_100000210202_100020631284 [1,1,0,0,0,0|1,0,1]=4 3736 B12R1.71 CCSCc1ccc(nc1)OC 62a_100020631284_100000210202 [1,1,0,0,0,0|1,0,1]=4 3737 B12R1.71 CCc1ccc(cc1)CCNC 2230a_100025712186_200000210301 [1,1,0,0,0,0|1,0,1]=4 3738 B12R1.71 CCc1ccc(cc1)CCNC 34a_100025712186_200000210301 [1,1,0,0,0,0|1,0,1]=4 3739 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 2230a_100025712186_200025704644 [1,1,0,0,0,0|1,0,1]=4 3740 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 34a_100025712186_200025704644 [1,1,0,0,0,0|1,0,1]=4 3741 B12R1.71 CCc1ccc(cc1)CNCF 34a_100000721222_100015361967 [1,1,0,0,0,0|2,0,0]=4 3742 B12R1.71 CCc1ccc(cc1)COCF 34a_100000702245_100015361967 [1,1,0,0,0,0|2,0,0]=4 3743 B12R1.71 CCc1ccc(cc1)COCF 7a_100000702245_100015361967 [1,1,0,0,0,0|2,0,0]=4 3744 B12R1.71 CCc1ccc(cc1)CSCF 62a_100000757233_100015361967 [1,1,0,0,0,0|2,0,0]=4 3745 B12R1.71 CCc1ccc(cc1)CSCF 62a_100015361967_100000747183 [1,1,0,0,0,0|2,0,0]=4 3746 B12R1.71 CCc1ccc(cc1)NCC=O 2230a_100000211069_200015260668 [1,1,0,0,0,0|1,0,0]=3 3747 B12R1.71 CCc1ccc(cc1)NCC=O 34a_100000211069_200009817547 [1,1,0,0,0,0|1,0,0]=3 3748 B12R1.71 CCc1ccc(cc1)NCOC 2230a_100000211069_100000766300 [1,1,0,0,0,0|2,0,0]=4 3749 B12R1.71 CCc1ccc(cc1)NCSC 2230a_100000211069_100011218213 [1,1,0,0,0,0|2,0,0]=4 3750 B12R1.71 CCc1ccc(cc1)NCSC 34a_100000211069_100011218213 [1,1,0,0,0,0|2,0,0]=4 3751 B12R1.71 CCc1ccc(cc1)OCC=O 34a_100000211359_200009817547 [1,1,0,0,0,0|1,0,0]=3 3752 B12R1.71 CCc1ccc(cc1)OCC=O 7a_100000211359_200015260668 [1,1,0,0,0,0|1,0,0]=3 3753 B12R1.71 CCc1ccc(cc1)OCSC 34a_100000211359_100011218213 [1,1,0,0,0,0|2,0,0]=4 3754 B12R1.71 CCc1ccc(cc1)SCC=O 62a_100011215824_200015260668 [1,1,0,0,0,0|1,0,0]=3 3755 B12R1.71 CCc1ccc(cc1)SCC=O 62a_200015260668_100011215824 [1,1,0,0,0,0|1,0,0]=3 3756 B12R1.71 CCc1ccc(cc1)SCOC 62a_100000766300_100011215824 [1,1,0,0,0,0|2,0,0]=4 3757 B12R1.71 CCc1ccc(cc1)SCOC 62a_100011215824_100000766300 [1,1,0,0,0,0|2,0,0]=4 3758 B12R1.71 CCc1ccc(cc1)SCSC 62a_100011215824_100011218213 [1,1,0,0,0,0|2,0,0]=4 3759 B12R1.71 CCc1ccc(cc1)SCSC 62a_100011218213_100011215824 [1,1,0,0,0,0|2,0,0]=4 3760 B12R1.71 CCc1ccc(cn1)SCC=O 62a_100009820025_200015260668 [1,1,0,0,0,0|2,0,0]=4 3761 B12R1.71 CCc1ccc(cn1)SCC=O 62a_200015260668_100009820025 [1,1,0,0,0,0|2,0,0]=4 3762 B12R1.71 CCc1ccc(nc1)SCC=O 62a_100009843584_200015260668 [1,1,0,0,0,0|2,0,0]=4 3763 B12R1.71 CCc1ccc(nc1)SCC=O 62a_200015260668_100009843584 [1,1,0,0,0,0|2,0,0]=4 3764 B12R1.71 CNCCc1ccc(cc1)OC 2230a_100000210796_200000210301 [1,1,0,0,0,0|0,0,1]=3 3765 B12R1.71 CNCCc1ccc(cc1)OC 2230a_106832991635_100011713689 [1,1,0,0,0,0|0,0,1]=3 3766 B12R1.71 CNCCc1ccc(cc1)OC 270004a_106832991635_100011242372 [1,1,0,0,0,0|0,0,1]=3 3767 B12R1.71 CNCCc1ccc(cc1)OC 34a_100000210796_200000210301 [1,1,0,0,0,0|0,0,1]=3 3768 B12R1.71 CNCCc1ccc(cc1)OC 34a_100016989440_200000210301 [1,1,0,0,0,0|0,0,1]=3 3769 B12R1.71 CNCCc1ccc(cc1)OC 34a_100102657272_100000184700 [1,1,0,0,0,0|0,0,1]=3 3770 B12R1.71 CNCCc1ccc(cc1)OC 7a_106832991635_100000184700 [1,1,0,0,0,0|0,0,1]=3 3771 B12R1.71 CNCCc1ccc(cc1)O[13CH3] 34a_100016989440_200025704644 [1,1,0,0,0,0|0,0,1]=3 3772 B12R1.71 CNCCc1ccc(cc1)SC 62a_100000752880_200000210301 [1,1,0,0,0,0|0,1,1]=4 3773 B12R1.71 CNCCc1ccc(cc1)SC 62a_200000210301_100000752880 [1,1,0,0,0,0|0,1,1]=4 3774 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_100000752880_200025704644 [1,1,0,0,0,0|0,1,1]=4 3775 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000752880 [1,1,0,0,0,0|0,1,1]=4 3776 B12R1.71 CNCCc1ccc(nc1)OC 2230a_100011998949_200000210301 [1,1,0,0,0,0|1,0,1]=4 3777 B12R1.71 CNCCc1ccc(nc1)OC 34a_100011998949_200000210301 [1,1,0,0,0,0|1,0,1]=4 3778 B12R1.71 CNc1ccc(cc1)CCSC 2230a_100000750819_200000210301 [1,1,0,0,0,0|1,0,1]=4 3779 B12R1.71 CNc1ccc(cc1)CCSC 34a_100000750819_200000210301 [1,1,0,0,0,0|1,0,1]=4 3780 B12R1.71 CNc1ccc(cc1)CCSC 7a_100000750819_200000210301 [1,1,0,0,0,0|1,0,1]=4 3781 B12R1.71 CNc1ccc(cc1)OCC=O 34a_100000182112_200009817547 [1,1,0,0,0,0|1,0,0]=3 3782 B12R1.71 CNc1ccc(cc1)OCSC 34a_100000182112_100011218213 [1,1,0,0,0,0|2,0,0]=4 3783 B12R1.71 CNc1ccc(cc1)SCC=O 62a_100000743151_200015260668 [1,1,0,0,0,0|1,0,0]=3 3784 B12R1.71 CNc1ccc(cc1)SCC=O 62a_200015260668_100000743151 [1,1,0,0,0,0|1,0,0]=3 3785 B12R1.71 CNc1ccc(cc1)SCOC 62a_100000743151_100000766300 [1,1,0,0,0,0|2,0,0]=4 3786 B12R1.71 CNc1ccc(cc1)SCOC 62a_100000766300_100000743151 [1,1,0,0,0,0|2,0,0]=4 3787 B12R1.71 CNc1ccc(cc1)SCSC 62a_100000743151_100011218213 [1,1,0,0,0,0|2,0,0]=4 3788 B12R1.71 CNc1ccc(cc1)SCSC 62a_100011218213_100000743151 [1,1,0,0,0,0|2,0,0]=4 3789 B12R1.71 CNc1ccc(cn1)SCC=O 62a_100000741341_200015260668 [1,1,0,0,0,0|2,0,0]=4 3790 B12R1.71 CNc1ccc(cn1)SCC=O 62a_200015260668_100000741341 [1,1,0,0,0,0|2,0,0]=4 3791 B12R1.71 CNc1ccc(nc1)SCC=O 62a_100000764248_200015260668 [1,1,0,0,0,0|2,0,0]=4 3792 B12R1.71 CNc1ccc(nc1)SCC=O 62a_200015260668_100000764248 [1,1,0,0,0,0|2,0,0]=4 3793 B12R1.71 COC=Cc1ccc(cc1)SC 62a_100020630460_200000210301 [1,1,0,0,0,0|0,1,1]=4 3794 B12R1.71 COC=Cc1ccc(cc1)SC 62a_200000210301_100020630460 [1,1,0,0,0,0|0,1,1]=4 3795 B12R1.71 COC=Cc1ccc(cc1)S[13CH3] 62a_100020630460_200025704644 [1,1,0,0,0,0|0,1,1]=4 3796 B12R1.71 COC=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100020630460 [1,1,0,0,0,0|0,1,1]=4 3797 B12R1.71 COCCc1ccc(cc1)OC 34a_100000211638_200000210301 [1,1,0,0,0,0|0,0,1]=3 3798 B12R1.71 COCCc1ccc(cc1)OC 34a_100011219623_200000210301 [1,1,0,0,0,0|0,0,1]=3 3799 B12R1.71 COCCc1ccc(cc1)OC 34a_100138415774_100000184700 [1,1,0,0,0,0|0,0,1]=3 3800 B12R1.71 COCCc1ccc(cc1)OC 7a_100000211638_200000210301 [1,1,0,0,0,0|0,0,1]=3 3801 B12R1.71 COCCc1ccc(cc1)OC 7a_100011219623_200000210301 [1,1,0,0,0,0|0,0,1]=3 3802 B12R1.71 COCCc1ccc(cc1)O[13CH3] 34a_100000211638_200025704644 [1,1,0,0,0,0|0,0,1]=3 3803 B12R1.71 COCCc1ccc(cc1)O[13CH3] 7a_100000211638_200025704644 [1,1,0,0,0,0|0,0,1]=3 3804 B12R1.71 COCCc1ccc(cc1)SC 62a_100000739703_200000210301 [1,1,0,0,0,0|0,1,1]=4 3805 B12R1.71 COCCc1ccc(cc1)SC 62a_200000210301_100000739703 [1,1,0,0,0,0|0,1,1]=4 3806 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_100000739703_200025704644 [1,1,0,0,0,0|0,1,1]=4 3807 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000739703 [1,1,0,0,0,0|0,1,1]=4 3808 B12R1.71 COCOc1ccc(cc1)OC 34a_200012265912_200000210301 [1,1,0,0,0,0|1,0,0]=3 3809 B12R1.71 COCOc1ccc(cc1)O[13CH3] 34a_200012265912_200025704644 [1,1,0,0,0,0|1,0,0]=3 3810 B12R1.71 COCOc1ccc(cc1)SC 62a_100012265687_200000210301 [1,1,0,0,0,0|1,1,0]=4 3811 B12R1.71 COCOc1ccc(cc1)SC 62a_200000210301_100012265687 [1,1,0,0,0,0|1,1,0]=4 3812 B12R1.71 COCOc1ccc(cc1)S[13CH3] 62a_100012265687_200025704644 [1,1,0,0,0,0|1,1,0]=4 3813 B12R1.71 COCOc1ccc(cc1)S[13CH3] 62a_200025704644_100012265687 [1,1,0,0,0,0|1,1,0]=4 3814 B12R1.71 COCSc1ccc(cc1)OC 62a_100000766300_100000171711 [1,1,0,0,0,0|1,0,0]=3 3815 B12R1.71 COCSc1ccc(cc1)SC 62a_100000766300_100011263217 [1,1,0,0,0,0|1,1,0]=4 3816 B12R1.71 COCSc1ccc(cc1)SC 62a_100011263217_100000766300 [1,1,0,0,0,0|1,1,0]=4 3817 B12R1.71 COCSc1ccc(cn1)OC 62a_100000755202_100000766300 [1,1,0,0,0,0|2,0,0]=4 3818 B12R1.71 COCSc1ccc(cn1)OC 62a_100000766300_100000744180 [1,1,0,0,0,0|2,0,0]=4 3819 B12R1.71 COCSc1ccc(nc1)OC 62a_100000047065_100000766300 [1,1,0,0,0,0|2,0,0]=4 3820 B12R1.71 COCSc1ccc(nc1)OC 62a_100000766300_100000047065 [1,1,0,0,0,0|2,0,0]=4 3821 B12R1.71 COc1ccc(cc1)CCC#N 34a_200011217972_200000210301 [1,1,0,0,0,0|0,0,2]=4 3822 B12R1.71 COc1ccc(cc1)CCC#N 7a_200011217972_200000210301 [1,1,0,0,0,0|0,0,2]=4 3823 B12R1.71 COc1ccc(cc1)CCCO 34a_100011215268_200000210301 [1,1,0,0,0,0|0,0,1]=3 3824 B12R1.71 COc1ccc(cc1)CCCO 7a_100011215268_200000210301 [1,1,0,0,0,0|0,0,1]=3 3825 B12R1.71 COc1ccc(cc1)CCN[13CH3] 2230a_100000210796_200025704644 [1,1,0,0,0,0|0,0,1]=3 3826 B12R1.71 COc1ccc(cc1)CCN[13CH3] 34a_100000210796_200025704644 [1,1,0,0,0,0|0,0,1]=3 3827 B12R1.71 COc1ccc(cc1)CCO[13CH3] 34a_100011219623_200025704644 [1,1,0,0,0,0|0,0,1]=3 3828 B12R1.71 COc1ccc(cc1)CCO[13CH3] 7a_100011219623_200025704644 [1,1,0,0,0,0|0,0,1]=3 3829 B12R1.71 COc1ccc(cc1)CCSC 62a_100011713689_200000210301 [1,1,0,0,0,0|0,0,1]=3 3830 B12R1.71 COc1ccc(cc1)CCSC 62a_200000210301_100011713689 [1,1,0,0,0,0|0,0,1]=3 3831 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_100011713689_200025704644 [1,1,0,0,0,0|0,0,1]=3 3832 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713689 [1,1,0,0,0,0|0,0,1]=3 3833 B12R1.71 COc1ccc(cc1)CNCF 34a_100000185587_100015361967 [1,1,0,0,0,0|1,0,0]=3 3834 B12R1.71 COc1ccc(cc1)COCF 34a_100000173359_100015361967 [1,1,0,0,0,0|1,0,0]=3 3835 B12R1.71 COc1ccc(cc1)CSCF 62a_100015361967_100000742318 [1,1,0,0,0,0|1,0,0]=3 3836 B12R1.71 COc1ccc(cc1)NCC=O 34a_100000184247_200009817547 [1,1,0,0,0,0|0,0,0]=2 3837 B12R1.71 COc1ccc(cc1)NCCF 34a_100000184247_100011217306 [1,1,0,0,0,0|1,0,1]=4 3838 B12R1.71 COc1ccc(cc1)NCCO 34a_100000184247_100000211926 [1,1,0,0,0,0|0,0,2]=4 3839 B12R1.71 COc1ccc(cc1)NCSC 34a_100000184247_100011218213 [1,1,0,0,0,0|1,0,0]=3 3840 B12R1.71 COc1ccc(cc1)OCC=O 34a_100000210503_200009817547 [1,1,0,0,0,0|0,0,0]=2 3841 B12R1.71 COc1ccc(cc1)OCCF 34a_100000210503_100011217306 [1,1,0,0,0,0|1,0,1]=4 3842 B12R1.71 COc1ccc(cc1)OCCO 34a_100000210503_100000211926 [1,1,0,0,0,0|0,0,2]=4 3843 B12R1.71 COc1ccc(cc1)OCSC 34a_100000210503_100011218213 [1,1,0,0,0,0|1,0,0]=3 3844 B12R1.71 COc1ccc(cc1)SCC#N 62a_100011215382_100000171711 [1,1,0,0,0,0|1,0,1]=4 3845 B12R1.71 COc1ccc(cc1)SCC=O 62a_200015260668_100000171711 [1,1,0,0,0,0|0,0,0]=2 3846 B12R1.71 COc1ccc(cc1)SCCF 62a_100011217306_100000171711 [1,1,0,0,0,0|1,0,1]=4 3847 B12R1.71 COc1ccc(cc1)SCCO 62a_100000211926_100000171711 [1,1,0,0,0,0|0,0,2]=4 3848 B12R1.71 COc1ccc(cc1)SCSC 62a_100011218213_100000171711 [1,1,0,0,0,0|1,0,0]=3 3849 B12R1.71 COc1ccc(cn1)CCN[13CH3] 2230a_100011998949_200025704644 [1,1,0,0,0,0|1,0,1]=4 3850 B12R1.71 COc1ccc(cn1)CCN[13CH3] 34a_100011998949_200025704644 [1,1,0,0,0,0|1,0,1]=4 3851 B12R1.71 COc1ccc(cn1)COCF 34a_100000763316_100015361967 [1,1,0,0,0,0|2,0,0]=4 3852 B12R1.71 COc1ccc(cn1)CSCF 62a_100015361967_100020631284 [1,1,0,0,0,0|2,0,0]=4 3853 B12R1.71 COc1ccc(cn1)CSCF 62a_100020631284_100015361967 [1,1,0,0,0,0|2,0,0]=4 3854 B12R1.71 COc1ccc(cn1)OCC=O 34a_100011934560_200009817547 [1,1,0,0,0,0|1,0,0]=3 3855 B12R1.71 COc1ccc(cn1)OCSC 34a_100011934560_100011218213 [1,1,0,0,0,0|2,0,0]=4 3856 B12R1.71 COc1ccc(cn1)SCC=O 62a_100000047065_200015260668 [1,1,0,0,0,0|1,0,0]=3 3857 B12R1.71 COc1ccc(cn1)SCC=O 62a_200015260668_100000047065 [1,1,0,0,0,0|1,0,0]=3 3858 B12R1.71 COc1ccc(cn1)SCSC 62a_100000047065_100011218213 [1,1,0,0,0,0|2,0,0]=4 3859 B12R1.71 COc1ccc(cn1)SCSC 62a_100011218213_100000047065 [1,1,0,0,0,0|2,0,0]=4 3860 B12R1.71 COc1ccc(nc1)CNCF 34a_100000703904_100015361967 [1,1,0,0,0,0|2,0,0]=4 3861 B12R1.71 COc1ccc(nc1)COCF 34a_100011998694_100015361967 [1,1,0,0,0,0|2,0,0]=4 3862 B12R1.71 COc1ccc(nc1)CSCF 62a_100015361967_200000757186 [1,1,0,0,0,0|2,0,0]=4 3863 B12R1.71 COc1ccc(nc1)CSCF 62a_200000757186_100015361967 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.71 COc1ccc(nc1)OCC=O 34a_100012002028_200009817547 [1,1,0,0,0,0|1,0,0]=3 3865 B12R1.71 COc1ccc(nc1)OCSC 34a_100012002028_100011218213 [1,1,0,0,0,0|2,0,0]=4 3866 B12R1.71 COc1ccc(nc1)SCC=O 62a_100000755202_200015260668 [1,1,0,0,0,0|1,0,0]=3 3867 B12R1.71 COc1ccc(nc1)SCC=O 62a_200015260668_100000744180 [1,1,0,0,0,0|1,0,0]=3 3868 B12R1.71 COc1ccc(nc1)SCSC 62a_100000755202_100011218213 [1,1,0,0,0,0|2,0,0]=4 3869 B12R1.71 COc1ccc(nc1)SCSC 62a_100011218213_100000744180 [1,1,0,0,0,0|2,0,0]=4 3870 B12R1.71 COc1ccc(nn1)SCC=O 62a_100009819040_200015260668 [1,1,0,0,0,0|2,0,0]=4 3871 B12R1.71 COc1ccc(nn1)SCC=O 62a_200015260668_100009819040 [1,1,0,0,0,0|2,0,0]=4 3872 B12R1.71 COc1cnc(cn1)SCC=O 62a_100011998698_200015260668 [1,1,0,0,0,0|2,0,0]=4 3873 B12R1.71 COc1cnc(cn1)SCC=O 62a_200015260668_100011998698 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.71 COc1cnc(nc1)SCC=O 62a_100000069167_200015260668 [1,1,0,0,0,0|2,0,0]=4 3875 B12R1.71 COc1cnc(nc1)SCC=O 62a_200015260668_100000069167 [1,1,0,0,0,0|2,0,0]=4 3876 B12R1.71 COc1ncc(cn1)OCC=O 34a_100000099601_200009817547 [1,1,0,0,0,0|2,0,0]=4 3877 B12R1.71 COc1ncc(cn1)OCC=O 7a_100000099601_200015260668 [1,1,0,0,0,0|2,0,0]=4 3878 B12R1.71 COc1ncc(cn1)SCC=O 62a_100000686852_200015260668 [1,1,0,0,0,0|2,0,0]=4 3879 B12R1.71 COc1ncc(cn1)SCC=O 62a_200015260668_100000686852 [1,1,0,0,0,0|2,0,0]=4 3880 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 2230a_100000750819_200025704644 [1,1,0,0,0,0|1,0,1]=4 3881 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 34a_100000750819_200025704644 [1,1,0,0,0,0|1,0,1]=4 3882 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 7a_100000750819_200025704644 [1,1,0,0,0,0|1,0,1]=4 3883 B12R1.71 CSCNc1ccc(cc1)SC 34a_100000212337_100011218213 [1,1,0,0,0,0|1,1,0]=4 3884 B12R1.71 CSCOc1ccc(cc1)SC 34a_100000211864_100011218213 [1,1,0,0,0,0|1,1,0]=4 3885 B12R1.71 CSCSc1ccc(cc1)SC 62a_100011218213_100011263217 [1,1,0,0,0,0|1,1,0]=4 3886 B12R1.71 CSCSc1ccc(cc1)SC 62a_100011263217_100011218213 [1,1,0,0,0,0|1,1,0]=4 3887 B12R1.71 CSc1ccc(cc1)/C=C/C=O 62a_100016291818_200000210301 [1,1,0,0,0,0|0,1,1]=4 3888 B12R1.71 CSc1ccc(cc1)/C=C/C=O 62a_200000210301_100016291818 [1,1,0,0,0,0|0,1,1]=4 3889 B12R1.71 CSc1ccc(cc1)CCC=O 62a_100011361538_200000210301 [1,1,0,0,0,0|0,1,0]=3 3890 B12R1.71 CSc1ccc(cc1)CCC=O 62a_200000210301_100011361538 [1,1,0,0,0,0|0,1,0]=3 3891 B12R1.71 CSc1ccc(cc1)CCCN 62a_100011297623_200000210301 [1,1,0,0,0,0|0,1,1]=4 3892 B12R1.71 CSc1ccc(cc1)CCCN 62a_200000210301_100011297623 [1,1,0,0,0,0|0,1,1]=4 3893 B12R1.71 CSc1ccc(cc1)CCCO 62a_100011709247_200000210301 [1,1,0,0,0,0|0,1,1]=4 3894 B12R1.71 CSc1ccc(cc1)CCCO 62a_200000210301_100011709247 [1,1,0,0,0,0|0,1,1]=4 3895 B12R1.71 CSc1ccc(cc1)CNCF 34a_100000174980_100015361967 [1,1,0,0,0,0|1,1,0]=4 3896 B12R1.71 CSc1ccc(cc1)COCF 34a_100011215404_100015361967 [1,1,0,0,0,0|1,1,0]=4 3897 B12R1.71 CSc1ccc(cc1)COCF 7a_100011215404_100015361967 [1,1,0,0,0,0|1,1,0]=4 3898 B12R1.71 CSc1ccc(cc1)CSCF 62a_100000181263_100015361967 [1,1,0,0,0,0|1,1,0]=4 3899 B12R1.71 CSc1ccc(cc1)CSCF 62a_100015361967_100000181263 [1,1,0,0,0,0|1,1,0]=4 3900 B12R1.71 CSc1ccc(cc1)NCC=O 34a_100000212337_200009817547 [1,1,0,0,0,0|0,1,0]=3 3901 B12R1.71 CSc1ccc(cc1)OCC=O 34a_100000211864_200009817547 [1,1,0,0,0,0|0,1,0]=3 3902 B12R1.71 CSc1ccc(cc1)SCC=O 62a_100011263217_200015260668 [1,1,0,0,0,0|0,1,0]=3 3903 B12R1.71 CSc1ccc(cc1)SCC=O 62a_200015260668_100011263217 [1,1,0,0,0,0|0,1,0]=3 3904 B12R1.71 CSc1ccc(cn1)SCC=O 62a_100011408404_200015260668 [1,1,0,0,0,0|1,1,0]=4 3905 B12R1.71 CSc1ccc(cn1)SCC=O 62a_200015260668_100011408404 [1,1,0,0,0,0|1,1,0]=4 3906 B12R1.71 CSc1ccc(nc1)SCC=O 62a_100009820866_200015260668 [1,1,0,0,0,0|1,1,0]=4 3907 B12R1.71 CSc1ccc(nc1)SCC=O 62a_200015260668_100009820866 [1,1,0,0,0,0|1,1,0]=4 3908 B12R1.71 N#Cc1ccc(cc1)NCC=O 34a_100000185469_200009817547 [1,1,0,0,0,0|2,0,0]=4 3909 B12R1.71 N#Cc1ccc(cc1)OCC=O 34a_100000210344_200009817547 [1,1,0,0,0,0|2,0,0]=4 3910 B12R1.71 N#Cc1ccc(cc1)OCC=O 7a_100000210344_200015260668 [1,1,0,0,0,0|2,0,0]=4 3911 B12R1.71 N#Cc1ccc(cc1)SCC=O 62a_200015260668_100000184291 [1,1,0,0,0,0|2,0,0]=4 3912 B12R1.71 NCc1ccc(cc1)OCC=O 34a_100000185549_200009817547 [1,1,0,0,0,0|2,0,0]=4 3913 B12R1.71 NCc1ccc(cc1)SCC=O 62a_100016989417_200015260668 [1,1,0,0,0,0|2,0,0]=4 3914 B12R1.71 NCc1ccc(cc1)SCC=O 62a_200015260668_100016989417 [1,1,0,0,0,0|2,0,0]=4 3915 B12R1.71 NNc1ccc(cc1)SCC=O 62a_100016988836_200015260668 [1,1,0,0,0,0|2,0,0]=4 3916 B12R1.71 NNc1ccc(cc1)SCC=O 62a_200015260668_100016988836 [1,1,0,0,0,0|2,0,0]=4 3917 B12R1.71 O=CCNc1ccc(cc1)CO 2230a_100011215238_200015260668 [1,1,0,0,0,0|2,0,0]=4 3918 B12R1.71 O=CCNc1ccc(cc1)CO 34a_100011215238_200009817547 [1,1,0,0,0,0|2,0,0]=4 3919 B12R1.71 O=CCOc1ccc(cc1)CO 34a_100000211755_200009817547 [1,1,0,0,0,0|2,0,0]=4 3920 B12R1.71 O=CCSc1ccc(cc1)C=O 62a_100000188517_200015260668 [1,1,0,0,0,0|2,0,0]=4 3921 B12R1.71 O=CCSc1ccc(cc1)C=O 62a_200015260668_100000188517 [1,1,0,0,0,0|2,0,0]=4 3922 B12R1.71 O=CCSc1ccc(cc1)CF 62a_100010268989_200015260668 [1,1,0,0,0,0|2,0,0]=4 3923 B12R1.71 O=CCSc1ccc(cc1)CF 62a_200015260668_100010268989 [1,1,0,0,0,0|2,0,0]=4 3924 B12R1.71 O=CCSc1ccc(cc1)CO 62a_100000690907_200015260668 [1,1,0,0,0,0|2,0,0]=4 3925 B12R1.71 O=CCSc1ccc(cc1)CO 62a_200015260668_100000690907 [1,1,0,0,0,0|2,0,0]=4 3926 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 34a_200011217972_200025704644 [1,1,0,0,0,0|0,0,2]=4 3927 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 7a_200011217972_200025704644 [1,1,0,0,0,0|0,0,2]=4 3928 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 34a_100011215268_200025704644 [1,1,0,0,0,0|0,0,1]=3 3929 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 7a_100011215268_200025704644 [1,1,0,0,0,0|0,0,1]=3 3930 B12R1.71 [13CH3]Sc1ccc(cc1)/C=C/C=O 62a_100016291818_200025704644 [1,1,0,0,0,0|0,1,1]=4 3931 B12R1.71 [13CH3]Sc1ccc(cc1)/C=C/C=O 62a_200025704644_100016291818 [1,1,0,0,0,0|0,1,1]=4 3932 B12R1.71 [13CH3]Sc1ccc(cc1)CCC=O 62a_100011361538_200025704644 [1,1,0,0,0,0|0,1,0]=3 3933 B12R1.71 [13CH3]Sc1ccc(cc1)CCC=O 62a_200025704644_100011361538 [1,1,0,0,0,0|0,1,0]=3 3934 B12R1.71 [13CH3]Sc1ccc(cc1)CCCN 62a_100011297623_200025704644 [1,1,0,0,0,0|0,1,1]=4 3935 B12R1.71 [13CH3]Sc1ccc(cc1)CCCN 62a_200025704644_100011297623 [1,1,0,0,0,0|0,1,1]=4 3936 B12R1.71 [13CH3]Sc1ccc(cc1)CCCO 62a_100011709247_200025704644 [1,1,0,0,0,0|0,1,1]=4 3937 B12R1.71 [13CH3]Sc1ccc(cc1)CCCO 62a_200025704644_100011709247 [1,1,0,0,0,0|0,1,1]=4 3938 B12R1.113 C=C(C)c1ccc(cc1)/C=C/C 271570a_100000694244_100016259036 [1,1,0,0,0,0|1,0,1]=4 3939 B12R1.113 C=C(C)c1ccc(cc1)C=CC 271570a_100016259895_100000185454 [1,1,0,0,0,0|1,0,1]=4 3940 B12R1.113 C=C(C)c1ccc(cc1)CC=O 271570a_100000694244_100011361690 [1,1,0,0,0,0|1,0,0]=3 3941 B12R1.113 C=C(C)c1ccc(cc1)CCC 271570a_100000694244_100000750032 [1,1,0,0,0,0|1,0,1]=4 3942 B12R1.113 C=C(C)c1ccc(cc1)CNC 26a_100102657272_100009880102 [1,1,0,0,0,0|2,0,0]=4 3943 B12R1.113 C=C(C)c1ccc(cc1)CNC 271570a_100000694244_100000180866 [1,1,0,0,0,0|2,0,0]=4 3944 B12R1.113 C=C(C)c1ccc(cc1)COC 271570a_100000694244_100011493685 [1,1,0,0,0,0|2,0,0]=4 3945 B12R1.113 CC(=O)c1ccc(cc1)CO[13CH3] 7a_100000082505_200025704644 [1,1,0,0,0,0|2,0,0]=4 3946 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_100000756337_200025704644 [1,1,0,0,0,0|2,0,0]=4 3947 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000756337 [1,1,0,0,0,0|2,0,0]=4 3948 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 2230a_100000174979_200025704644 [1,1,0,0,0,0|2,0,0]=4 3949 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 34a_100000174979_200025704644 [1,1,0,0,0,0|2,0,0]=4 3950 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 34a_100000181325_200025704644 [1,1,0,0,0,0|2,0,0]=4 3951 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 7a_100000181325_200025704644 [1,1,0,0,0,0|2,0,0]=4 3952 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_100000181262_200025704644 [1,1,0,0,0,0|2,0,0]=4 3953 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000181262 [1,1,0,0,0,0|2,0,0]=4 3954 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 2230a_200000048501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3955 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 34a_200000048501_200025704644 [1,1,0,0,0,0|2,0,0]=4 3956 B12R1.113 CC=Cc1ccc(cc1)C(=O)C 271570a_100016259895_100000185465 [1,1,0,0,0,0|1,0,1]=4 3957 B12R1.113 CC=Cc1ccc(cc1)C(C)C 271570a_100016259895_100000750031 [1,1,0,0,0,0|1,0,1]=4 3958 B12R1.113 CC=Cc1ccc(cc1)C(C)O 271570a_100016259895_100000745893 [1,1,0,0,0,0|1,0,1]=4 3959 B12R1.113 CC=Cc1ccc(cc1)N(C)C 271570a_100016259895_100000210421 [1,1,0,0,0,0|1,0,1]=4 3960 B12R1.113 CC=Cc1ccc(cc1)S(=O)C 271570a_100016259895_100009816266 [1,1,0,0,0,0|0,1,1]=4 3961 B12R1.113 CC=Cc1ccc(cc1)[C@@H](C)N 271570a_100016259895_100000720352 [1,1,0,0,0,0|1,0,1]=4 3962 B12R1.113 CC=Cc1ccc(cc1)[C@H](C)N 271570a_100016259895_100000753911 [1,1,0,0,0,0|1,0,1]=4 3963 B12R1.113 CCCc1ccc(cc1)C(=O)C 1458a_100011207308_200000210301 [1,1,0,0,0,0|1,0,1]=4 3964 B12R1.113 CCCc1ccc(cc1)C(=O)[13CH3] 1458a_100011207308_200025704644 [1,1,0,0,0,0|1,0,1]=4 3965 B12R1.113 CN(C)c1ccc(cc1)CO[13CH3] 34a_100000238745_200025704644 [1,1,0,0,0,0|2,0,0]=4 3966 B12R1.113 CNCc1ccc(cc1)C(=O)C 2230a_106832991635_100000756337 [1,1,0,0,0,0|2,0,0]=4 3967 B12R1.113 CNCc1ccc(cc1)C(=O)C 26a_100102657272_100000185113 [1,1,0,0,0,0|2,0,0]=4 3968 B12R1.113 CNCc1ccc(cc1)C(=O)C 34a_100102657272_100000756337 [1,1,0,0,0,0|2,0,0]=4 3969 B12R1.113 CNCc1ccc(cc1)C(=O)C 7a_106832991635_100000756337 [1,1,0,0,0,0|2,0,0]=4 3970 B12R1.113 CNCc1ccc(cc1)C(C)C 207a_100102657272_100000210693 [1,1,0,0,0,0|2,0,0]=4 3971 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_100000174979_200000210301 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_106832991635_100000181262 [1,1,0,0,0,0|2,0,0]=4 3973 B12R1.113 CNCc1ccc(cc1)C(C)C 26a_100102657272_100000181308 [1,1,0,0,0,0|2,0,0]=4 3974 B12R1.113 CNCc1ccc(cc1)C(C)C 270004a_106832991635_100000210693 [1,1,0,0,0,0|2,0,0]=4 3975 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100000174979_200000210301 [1,1,0,0,0,0|2,0,0]=4 3976 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100102657272_100000181262 [1,1,0,0,0,0|2,0,0]=4 3977 B12R1.113 CNCc1ccc(cc1)C(C)C 7a_106832991635_100000181262 [1,1,0,0,0,0|2,0,0]=4 3978 B12R1.113 CNCc1ccc(cc1)C(C)O 2230a_200000048501_200000210301 [1,1,0,0,0,0|2,0,0]=4 3979 B12R1.113 CNCc1ccc(cc1)C(C)O 26a_100102657272_100000754508 [1,1,0,0,0,0|2,0,0]=4 3980 B12R1.113 CNCc1ccc(cc1)C(C)O 34a_200000048501_200000210301 [1,1,0,0,0,0|2,0,0]=4 3981 B12R1.113 CNCc1ccc(cc1)N(C)C 207a_100102657272_100000185837 [1,1,0,0,0,0|2,0,0]=4 3982 B12R1.113 CNCc1ccc(cc1)N(C)C 270004a_106832991635_100000185837 [1,1,0,0,0,0|2,0,0]=4 3983 B12R1.113 CNCc1ccc(cc1)S(=O)C 26a_100102657272_200000064373 [1,1,0,0,0,0|1,1,0]=4 3984 B12R1.113 CNCc1ccc(cc1)[S+](C)C 26a_100102657272_100010188728 [1,1,0,0,0,0|1,1,0]=4 3985 B12R1.113 COCc1ccc(cc1)C(=O)C 1458a_100000189608_200000210301 [1,1,0,0,0,0|2,0,0]=4 3986 B12R1.113 COCc1ccc(cc1)C(=O)C 34a_100138415774_100000756337 [1,1,0,0,0,0|2,0,0]=4 3987 B12R1.113 COCc1ccc(cc1)C(=O)C 7a_100000082505_200000210301 [1,1,0,0,0,0|2,0,0]=4 3988 B12R1.113 COCc1ccc(cc1)C(=O)[13CH3] 1458a_100000189608_200025704644 [1,1,0,0,0,0|2,0,0]=4 3989 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100000181325_200000210301 [1,1,0,0,0,0|2,0,0]=4 3990 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100138415774_100000181262 [1,1,0,0,0,0|2,0,0]=4 3991 B12R1.113 COCc1ccc(cc1)C(C)C 7a_100000181325_200000210301 [1,1,0,0,0,0|2,0,0]=4 3992 B12R1.113 COCc1ccc(cc1)N(C)C 34a_100000238745_200000210301 [1,1,0,0,0,0|2,0,0]=4 3993 B12R1.113 CSCc1ccc(cc1)C(=O)C 1458a_100000175442_200000210301 [1,1,0,0,0,0|2,0,0]=4 3994 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_100000756337_200000210301 [1,1,0,0,0,0|2,0,0]=4 3995 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_200000210301_100000756337 [1,1,0,0,0,0|2,0,0]=4 3996 B12R1.113 CSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000175442_200025704644 [1,1,0,0,0,0|2,0,0]=4 3997 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_100000181262_200000210301 [1,1,0,0,0,0|2,0,0]=4 3998 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_200000210301_100000181262 [1,1,0,0,0,0|2,0,0]=4 3999 B12R1.114 CC=Cc1ccc(cc1Br)CC 271570a_100016259895_200009997437 [1,1,0,0,0,0|1,0,1]=4 4000 B12R1.114 CC=Cc1ccc(cc1Br)OC 271570a_100016259895_100012349170 [1,1,0,0,0,0|0,0,1]=3 4001 B12R1.114 CC=Cc1ccc(cc1C)NC 271570a_100016259895_100102888905 [1,1,0,0,0,0|1,0,1]=4 4002 B12R1.114 CC=Cc1ccc(cc1C)OC 271570a_100016259895_100000759875 [1,1,0,0,0,0|0,0,1]=3 4003 B12R1.114 CC=Cc1ccc(cc1F)CC 271570a_100016259895_200010339503 [1,1,0,0,0,0|1,0,1]=4 4004 B12R1.114 CC=Cc1ccc(cc1F)NC 271570a_100016259895_100012285320 [1,1,0,0,0,0|1,0,1]=4 4005 B12R1.114 CC=Cc1ccc(cc1F)OC 271570a_100016259895_100000753793 [1,1,0,0,0,0|0,0,1]=3 4006 B12R1.114 CC=Cc1ccc(cc1F)SC 271570a_100016259895_100009816902 [1,1,0,0,0,0|0,1,1]=4 4007 B12R1.114 CC=Cc1ccc(cc1N)OC 271570a_100016259895_100000748021 [1,1,0,0,0,0|0,0,1]=3 4008 B12R1.114 CC=Cc1ccc(cc1O)OC 271570a_100016259895_100000719091 [1,1,0,0,0,0|0,0,1]=3 4009 B12R1.114 CC=Cc1ccc(nc1C)OC 271570a_100016259895_100000766551 [1,1,0,0,0,0|1,0,1]=4 4010 B12R1.114 CC=Cc1ccc(nc1F)OC 271570a_100016259895_100010067559 [1,1,0,0,0,0|1,0,1]=4 4011 B12R1.114 CC=Cc1ccc(nc1N)OC 271570a_100016259895_100010187629 [1,1,0,0,0,0|1,0,1]=4 4012 B12R1.114 CC=Cc1cnc(cc1C)OC 271570a_100016259895_100011934368 [1,1,0,0,0,0|1,0,1]=4 4013 B12R1.114 CC=Cc1cnc(cc1F)OC 271570a_100016259895_100010136277 [1,1,0,0,0,0|1,0,1]=4 4014 B12R1.114 CC=Cc1cnc(cc1N)OC 271570a_100016259895_100010254562 [1,1,0,0,0,0|1,0,1]=4 4015 B12R1.114 CC=Cc1cnc(cc1O)OC 271570a_100016259895_100010738159 [1,1,0,0,0,0|1,0,1]=4 4016 B12R1.114 CC=Cc1ncc(cc1C)OC 271570a_100016259895_200009851512 [1,1,0,0,0,0|1,0,1]=4 4017 B12R1.114 CC=Cc1ncc(cc1N)OC 271570a_100016259895_100010074831 [1,1,0,0,0,0|1,0,1]=4 4018 B12R1.114 CCNc1ccc(cc1Br)OC 34a_100015195136_100000210202 [1,1,0,0,0,0|1,0,1]=4 4019 B12R1.114 CCNc1ccc(cc1C)OC 34a_100000750285_100000210202 [1,1,0,0,0,0|1,0,1]=4 4020 B12R1.114 CCNc1ccc(cc1Cl)OC 34a_100000747055_100000210202 [1,1,0,0,0,0|1,0,1]=4 4021 B12R1.114 CCNc1ccc(cc1F)OC 34a_100011299463_100000210202 [1,1,0,0,0,0|1,0,1]=4 4022 B12R1.114 CCNc1ccc(cc1I)OC 34a_100000049804_100000210202 [1,1,0,0,0,0|1,0,1]=4 4023 B12R1.114 CCNc1ccc(cc1O)OC 34a_100016989039_100000210202 [1,1,0,0,0,0|1,0,1]=4 4024 B12R1.114 CCOc1ccc(cc1Br)OC 34a_100000685887_100000210202 [1,1,0,0,0,0|1,0,1]=4 4025 B12R1.114 CCOc1ccc(cc1Br)OC 7a_100000685887_100000210202 [1,1,0,0,0,0|1,0,1]=4 4026 B12R1.114 CCOc1ccc(cc1C)OC 34a_100012002223_100000210202 [1,1,0,0,0,0|1,0,1]=4 4027 B12R1.114 CCOc1ccc(cc1C)OC 7a_100012002223_100000210202 [1,1,0,0,0,0|1,0,1]=4 4028 B12R1.114 CCOc1ccc(cc1Cl)OC 34a_100000038596_100000210202 [1,1,0,0,0,0|1,0,1]=4 4029 B12R1.114 CCOc1ccc(cc1Cl)OC 7a_100000038596_100000210202 [1,1,0,0,0,0|1,0,1]=4 4030 B12R1.114 CCOc1ccc(cc1F)OC 34a_100000036999_100000210202 [1,1,0,0,0,0|1,0,1]=4 4031 B12R1.114 CCOc1ccc(cc1F)OC 34a_100012771078_200000210301 [1,1,0,0,0,0|1,0,1]=4 4032 B12R1.114 CCOc1ccc(cc1F)OC 7a_100000036999_100000210202 [1,1,0,0,0,0|1,0,1]=4 4033 B12R1.114 CCOc1ccc(cc1F)OC 7a_100012771078_200000210301 [1,1,0,0,0,0|1,0,1]=4 4034 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 34a_100012771078_200025704644 [1,1,0,0,0,0|1,0,1]=4 4035 B12R1.114 CCOc1ccc(cc1F)O[13CH3] 7a_100012771078_200025704644 [1,1,0,0,0,0|1,0,1]=4 4036 B12R1.114 CCOc1ccc(cc1N)OC 34a_100000188146_100000210202 [1,1,0,0,0,0|1,0,1]=4 4037 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100000210202_100012349170 [1,1,0,0,0,0|1,0,1]=4 4038 B12R1.114 CCSc1ccc(cc1Br)OC 62a_100012349170_100000210202 [1,1,0,0,0,0|1,0,1]=4 4039 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000210202_100000759875 [1,1,0,0,0,0|1,0,1]=4 4040 B12R1.114 CCSc1ccc(cc1C)OC 62a_100000759875_100000210202 [1,1,0,0,0,0|1,0,1]=4 4041 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000210202_100000753793 [1,1,0,0,0,0|1,0,1]=4 4042 B12R1.114 CCSc1ccc(cc1F)OC 62a_100000753793_100000210202 [1,1,0,0,0,0|1,0,1]=4 4043 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000210202_100000748021 [1,1,0,0,0,0|1,0,1]=4 4044 B12R1.114 CCSc1ccc(cc1N)OC 62a_100000748021_100000210202 [1,1,0,0,0,0|1,0,1]=4 4045 B12R1.114 CCSc1ccc(cc1O)OC 62a_100000210202_100000719091 [1,1,0,0,0,0|1,0,1]=4 4046 B12R1.114 CCc1ccc(c(c1)Br)CNC 26a_100102657272_100012339963 [1,1,0,0,0,0|2,0,0]=4 4047 B12R1.114 CCc1ccc(c(c1)F)CNC 207a_100102657272_100011156597 [1,1,0,0,0,0|2,0,0]=4 4048 B12R1.114 CCc1ccc(c(c1)F)CNC 270004a_106832991635_100011156597 [1,1,0,0,0,0|2,0,0]=4 4049 B12R1.114 CNCc1ccc(cc1Br)OC 207a_100102657272_100000723261 [1,1,0,0,0,0|1,0,0]=3 4050 B12R1.114 CNCc1ccc(cc1Br)OC 2230a_106832991635_100011982828 [1,1,0,0,0,0|1,0,0]=3 4051 B12R1.114 CNCc1ccc(cc1Br)OC 26a_100102657272_100000685887 [1,1,0,0,0,0|1,0,0]=3 4052 B12R1.114 CNCc1ccc(cc1Br)OC 270004a_106832991635_100000723261 [1,1,0,0,0,0|1,0,0]=3 4053 B12R1.114 CNCc1ccc(cc1Br)OC 34a_100102657272_100011982828 [1,1,0,0,0,0|1,0,0]=3 4054 B12R1.114 CNCc1ccc(cc1Br)OC 7a_106832991635_100011982828 [1,1,0,0,0,0|1,0,0]=3 4055 B12R1.114 CNCc1ccc(cc1C)OC 207a_100102657272_100011214997 [1,1,0,0,0,0|1,0,0]=3 4056 B12R1.114 CNCc1ccc(cc1C)OC 270004a_106832991635_100011214997 [1,1,0,0,0,0|1,0,0]=3 4057 B12R1.114 CNCc1ccc(cc1Cl)OC 207a_100102657272_100000235372 [1,1,0,0,0,0|1,0,0]=3 4058 B12R1.114 CNCc1ccc(cc1Cl)OC 2230a_106832991635_200011830453 [1,1,0,0,0,0|1,0,0]=3 4059 B12R1.114 CNCc1ccc(cc1Cl)OC 26a_100102657272_100000038596 [1,1,0,0,0,0|1,0,0]=3 4060 B12R1.114 CNCc1ccc(cc1Cl)OC 270004a_106832991635_100000235372 [1,1,0,0,0,0|1,0,0]=3 4061 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100102657272_200011830453 [1,1,0,0,0,0|1,0,0]=3 4062 B12R1.114 CNCc1ccc(cc1Cl)OC 34a_100138410423_200000210301 [1,1,0,0,0,0|1,0,0]=3 4063 B12R1.114 CNCc1ccc(cc1Cl)OC 7a_106832991635_200011830453 [1,1,0,0,0,0|1,0,0]=3 4064 B12R1.114 CNCc1ccc(cc1F)OC 207a_100102657272_100011216087 [1,1,0,0,0,0|1,0,0]=3 4065 B12R1.114 CNCc1ccc(cc1F)OC 2230a_106832991635_100011260761 [1,1,0,0,0,0|1,0,0]=3 4066 B12R1.114 CNCc1ccc(cc1F)OC 26a_100102657272_100000036999 [1,1,0,0,0,0|1,0,0]=3 4067 B12R1.114 CNCc1ccc(cc1F)OC 270004a_106832991635_100011216087 [1,1,0,0,0,0|1,0,0]=3 4068 B12R1.114 CNCc1ccc(cc1F)OC 34a_100000687396_200000210301 [1,1,0,0,0,0|1,0,0]=3 4069 B12R1.114 CNCc1ccc(cc1F)OC 34a_100102657272_100011260761 [1,1,0,0,0,0|1,0,0]=3 4070 B12R1.114 CNCc1ccc(cc1F)OC 7a_106832991635_100011260761 [1,1,0,0,0,0|1,0,0]=3 4071 B12R1.114 CNCc1ccc(cc1I)OC 207a_100102657272_100010159643 [1,1,0,0,0,0|1,0,0]=3 4072 B12R1.114 CNCc1ccc(cc1I)OC 270004a_106832991635_100010159643 [1,1,0,0,0,0|1,0,0]=3 4073 B12R1.114 CNCc1ccc(nc1C)OC 207a_100102657272_100000101190 [1,1,0,0,0,0|2,0,0]=4 4074 B12R1.114 CNCc1ccc(nc1C)OC 270004a_106832991635_100000101190 [1,1,0,0,0,0|2,0,0]=4 4075 B12R1.114 CNCc1ccc(nc1Cl)OC 207a_100102657272_200012001695 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.114 CNCc1cnc(cc1C)OC 207a_100102657272_100000085380 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.114 CNCc1cnc(cc1C)OC 270004a_106832991635_100000085380 [1,1,0,0,0,0|2,0,0]=4 4078 B12R1.114 CNCc1ncc(cc1Br)OC 207a_100102657272_200010135874 [1,1,0,0,0,0|2,0,0]=4 4079 B12R1.114 CNCc1ncc(cc1Br)OC 270004a_106832991635_200010135874 [1,1,0,0,0,0|2,0,0]=4 4080 B12R1.114 CNCc1ncc(cc1C)OC 2230a_200009843444_200000210301 [1,1,0,0,0,0|2,0,0]=4 4081 B12R1.114 CNCc1ncc(cc1C)OC 34a_200009843444_200000210301 [1,1,0,0,0,0|2,0,0]=4 4082 B12R1.114 CNc1ccc(c(c1)F)COC 34a_100012145864_200000210301 [1,1,0,0,0,0|2,0,0]=4 4083 B12R1.114 CNc1ccc(c(c1)F)COC 7a_100012145864_200000210301 [1,1,0,0,0,0|2,0,0]=4 4084 B12R1.114 COCc1ccc(cc1Br)OC 34a_100011982768_200000210301 [1,1,0,0,0,0|1,0,0]=3 4085 B12R1.114 COCc1ccc(cc1Br)OC 34a_100138415774_100011982828 [1,1,0,0,0,0|1,0,0]=3 4086 B12R1.114 COCc1ccc(cc1Br)OC 7a_100011982768_200000210301 [1,1,0,0,0,0|1,0,0]=3 4087 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100011982767_200000210301 [1,1,0,0,0,0|1,0,0]=3 4088 B12R1.114 COCc1ccc(cc1Cl)OC 34a_100138415774_200011830453 [1,1,0,0,0,0|1,0,0]=3 4089 B12R1.114 COCc1ccc(cc1Cl)OC 7a_100011982767_200000210301 [1,1,0,0,0,0|1,0,0]=3 4090 B12R1.114 COCc1ccc(cc1F)N[13CH3] 34a_100012145864_200025704644 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.114 COCc1ccc(cc1F)N[13CH3] 7a_100012145864_200025704644 [1,1,0,0,0,0|2,0,0]=4 4092 B12R1.114 COCc1ccc(cc1F)OC 34a_100011830421_200000210301 [1,1,0,0,0,0|1,0,0]=3 4093 B12R1.114 COCc1ccc(cc1F)OC 34a_100138415774_100011260761 [1,1,0,0,0,0|1,0,0]=3 4094 B12R1.114 COCc1ccc(cc1F)OC 7a_100011830421_200000210301 [1,1,0,0,0,0|1,0,0]=3 4095 B12R1.114 COCc1ccc(cc1N)OC 34a_100011998734_200000210301 [1,1,0,0,0,0|1,0,0]=3 4096 B12R1.114 COCc1ccc(cc1N)SC 62a_100013084866_200000210301 [1,1,0,0,0,0|1,1,0]=4 4097 B12R1.114 COCc1ccc(cc1N)SC 62a_200000210301_100013084866 [1,1,0,0,0,0|1,1,0]=4 4098 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_100013084866_200025704644 [1,1,0,0,0,0|1,1,0]=4 4099 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_200025704644_100013084866 [1,1,0,0,0,0|1,1,0]=4 4100 B12R1.114 COCc1ccc(nc1Cl)OC 34a_100009885603_200000210301 [1,1,0,0,0,0|2,0,0]=4 4101 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 34a_100011982768_200025704644 [1,1,0,0,0,0|1,0,0]=3 4102 B12R1.114 COc1ccc(c(c1)Br)CO[13CH3] 7a_100011982768_200025704644 [1,1,0,0,0,0|1,0,0]=3 4103 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_100011982828_200000210301 [1,1,0,0,0,0|1,0,0]=3 4104 B12R1.114 COc1ccc(c(c1)Br)CSC 62a_200000210301_100011982828 [1,1,0,0,0,0|1,0,0]=3 4105 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_100011982828_200025704644 [1,1,0,0,0,0|1,0,0]=3 4106 B12R1.114 COc1ccc(c(c1)Br)CS[13CH3] 62a_200025704644_100011982828 [1,1,0,0,0,0|1,0,0]=3 4107 B12R1.114 COc1ccc(c(c1)Cl)CN[13CH3] 34a_100138410423_200025704644 [1,1,0,0,0,0|1,0,0]=3 4108 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 34a_100011982767_200025704644 [1,1,0,0,0,0|1,0,0]=3 4109 B12R1.114 COc1ccc(c(c1)Cl)CO[13CH3] 7a_100011982767_200025704644 [1,1,0,0,0,0|1,0,0]=3 4110 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200000210301_200011830453 [1,1,0,0,0,0|1,0,0]=3 4111 B12R1.114 COc1ccc(c(c1)Cl)CSC 62a_200011830453_200000210301 [1,1,0,0,0,0|1,0,0]=3 4112 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200011830453_200025704644 [1,1,0,0,0,0|1,0,0]=3 4113 B12R1.114 COc1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_200011830453 [1,1,0,0,0,0|1,0,0]=3 4114 B12R1.114 COc1ccc(c(c1)F)CN[13CH3] 34a_100000687396_200025704644 [1,1,0,0,0,0|1,0,0]=3 4115 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 34a_100011830421_200025704644 [1,1,0,0,0,0|1,0,0]=3 4116 B12R1.114 COc1ccc(c(c1)F)CO[13CH3] 7a_100011830421_200025704644 [1,1,0,0,0,0|1,0,0]=3 4117 B12R1.114 COc1ccc(c(c1)F)CSC 62a_100011260761_200000210301 [1,1,0,0,0,0|1,0,0]=3 4118 B12R1.114 COc1ccc(c(c1)F)CSC 62a_200000210301_100011260761 [1,1,0,0,0,0|1,0,0]=3 4119 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_100011260761_200025704644 [1,1,0,0,0,0|1,0,0]=3 4120 B12R1.114 COc1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100011260761 [1,1,0,0,0,0|1,0,0]=3 4121 B12R1.114 COc1ccc(c(c1)N)CO[13CH3] 34a_100011998734_200025704644 [1,1,0,0,0,0|1,0,0]=3 4122 B12R1.114 COc1ccc(c(c1)O)CC#N 271570a_203496583355_100010146818 [1,1,0,0,0,0|1,0,1]=4 4123 B12R1.114 COc1ccc(c(n1)Cl)CO[13CH3] 34a_100009885603_200025704644 [1,1,0,0,0,0|2,0,0]=4 4124 B12R1.114 COc1cnc(c(c1)C)CN[13CH3] 2230a_200009843444_200025704644 [1,1,0,0,0,0|2,0,0]=4 4125 B12R1.114 COc1cnc(c(c1)C)CN[13CH3] 34a_200009843444_200025704644 [1,1,0,0,0,0|2,0,0]=4 4126 B12R1.116 C/C=C/c1ccc(cc1)SCC 62a_100000210202_100016259036 [1,1,0,0,0,0|0,1,1]=4 4127 B12R1.116 C/C=C/c1ccc(cc1)SCC 62a_100016259036_100000210202 [1,1,0,0,0,0|0,1,1]=4 4128 B12R1.116 C/C=C/c1ccc(cc1)SCF 62a_100015361967_100016259036 [1,1,0,0,0,0|0,1,1]=4 4129 B12R1.116 C/C=C/c1ccc(cc1)SCF 62a_100016259036_100015361967 [1,1,0,0,0,0|0,1,1]=4 4130 B12R1.116 C=C=Cc1ccc(cc1)CC=O 271570a_100015277604_100011361690 [1,1,0,0,0,0|1,0,1]=4 4131 B12R1.116 C=CCc1ccc(cc1)CNC 26a_100102657272_100000078792 [1,1,0,0,0,0|1,0,1]=4 4132 B12R1.116 C=CCc1ccc(cc1)OCC 34a_100000078792_100000210202 [1,1,0,0,0,0|0,0,1]=3 4133 B12R1.116 C=CCc1ccc(cc1)OCC 7a_100000078792_100000210202 [1,1,0,0,0,0|0,0,1]=3 4134 B12R1.116 C=CCc1ccc(cc1)OCF 34a_100000078792_100015361967 [1,1,0,0,0,0|0,0,1]=3 4135 B12R1.116 C=CCc1ccc(cc1)OCF 7a_100000078792_100015361967 [1,1,0,0,0,0|0,0,1]=3 4136 B12R1.116 CC=Cc1ccc(cc1)/C=C/C 271570a_100016259895_100016259036 [1,1,0,0,0,0|1,0,1]=4 4137 B12R1.116 CC=Cc1ccc(cc1)CC=O 271570a_100016259895_100011361690 [1,1,0,0,0,0|1,0,0]=3 4138 B12R1.116 CC=Cc1ccc(cc1)CCC 271570a_100016259895_100000750032 [1,1,0,0,0,0|1,0,1]=4 4139 B12R1.116 CC=Cc1ccc(cc1)CCN 271570a_100016259895_100000755846 [1,1,0,0,0,0|1,0,1]=4 4140 B12R1.116 CC=Cc1ccc(cc1)CCO 271570a_100016259895_100000766406 [1,1,0,0,0,0|1,0,1]=4 4141 B12R1.116 CC=Cc1ccc(cc1)CNC 271570a_100016259895_100000180866 [1,1,0,0,0,0|1,0,1]=4 4142 B12R1.116 CC=Cc1ccc(cc1)COC 271570a_100016259895_100011493685 [1,1,0,0,0,0|0,0,1]=3 4143 B12R1.116 CC=Cc1ccc(cc1)NCC 271570a_100016259895_100000219632 [1,1,0,0,0,0|1,0,1]=4 4144 B12R1.116 CC=Cc1ccc(cc1)OCC 271570a_100016259895_100000169946 [1,1,0,0,0,0|0,0,1]=3 4145 B12R1.116 CC=Cc1ccc(cc1)SCC 271570a_100016259895_200009811893 [1,1,0,0,0,0|0,1,1]=4 4146 B12R1.116 CC=Cc1ccc(cn1)OCC 271570a_100016259895_100000753957 [1,1,0,0,0,0|1,0,1]=4 4147 B12R1.116 CC=Cc1ccc(nc1)OCC 271570a_100016259895_100011219444 [1,1,0,0,0,0|1,0,1]=4 4148 B12R1.116 CCCc1ccc(cc1)CNC 207a_100102657272_100000229940 [1,1,0,0,0,0|1,0,1]=4 4149 B12R1.116 CCCc1ccc(cc1)CNC 2230a_100020632977_200000210301 [1,1,0,0,0,0|1,0,1]=4 4150 B12R1.116 CCCc1ccc(cc1)CNC 2230a_106832991635_100011982809 [1,1,0,0,0,0|1,0,1]=4 4151 B12R1.116 CCCc1ccc(cc1)CNC 26a_100102657272_100000749406 [1,1,0,0,0,0|1,0,1]=4 4152 B12R1.116 CCCc1ccc(cc1)CNC 270004a_106832991635_100000229940 [1,1,0,0,0,0|1,0,1]=4 4153 B12R1.116 CCCc1ccc(cc1)CNC 34a_100020632977_200000210301 [1,1,0,0,0,0|1,0,1]=4 4154 B12R1.116 CCCc1ccc(cc1)CNC 34a_100102657272_100011982809 [1,1,0,0,0,0|1,0,1]=4 4155 B12R1.116 CCCc1ccc(cc1)CNC 7a_106832991635_100011982809 [1,1,0,0,0,0|1,0,1]=4 4156 B12R1.116 CCCc1ccc(cc1)CN[13CH3] 2230a_100020632977_200025704644 [1,1,0,0,0,0|1,0,1]=4 4157 B12R1.116 CCCc1ccc(cc1)CN[13CH3] 34a_100020632977_200025704644 [1,1,0,0,0,0|1,0,1]=4 4158 B12R1.116 CCCc1ccc(cc1)COC 34a_100138415774_100011982809 [1,1,0,0,0,0|0,0,1]=3 4159 B12R1.116 CCCc1ccc(cc1)CSC 62a_100011982809_200000210301 [1,1,0,0,0,0|0,1,1]=4 4160 B12R1.116 CCCc1ccc(cc1)CSC 62a_200000210301_100011982809 [1,1,0,0,0,0|0,1,1]=4 4161 B12R1.116 CCCc1ccc(cc1)CS[13CH3] 62a_100011982809_200025704644 [1,1,0,0,0,0|0,1,1]=4 4162 B12R1.116 CCCc1ccc(cc1)CS[13CH3] 62a_200025704644_100011982809 [1,1,0,0,0,0|0,1,1]=4 4163 B12R1.116 CCCc1ccc(cc1)NCC 2230a_100000211780_100000210202 [1,1,0,0,0,0|1,0,1]=4 4164 B12R1.116 CCCc1ccc(cc1)NCC 34a_100000211780_100000210202 [1,1,0,0,0,0|1,0,1]=4 4165 B12R1.116 CCCc1ccc(cc1)NCF 34a_100000211780_100015361967 [1,1,0,0,0,0|1,0,1]=4 4166 B12R1.116 CCCc1ccc(cc1)OCC 34a_100000749406_100000210202 [1,1,0,0,0,0|0,0,1]=3 4167 B12R1.116 CCCc1ccc(cc1)OCC 7a_100000749406_100000210202 [1,1,0,0,0,0|0,0,1]=3 4168 B12R1.116 CCCc1ccc(cc1)OCF 34a_100000749406_100015361967 [1,1,0,0,0,0|0,0,1]=3 4169 B12R1.116 CCCc1ccc(cc1)OCF 7a_100000749406_100015361967 [1,1,0,0,0,0|0,0,1]=3 4170 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000210202_100000750032 [1,1,0,0,0,0|0,1,1]=4 4171 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000750032_100000210202 [1,1,0,0,0,0|0,1,1]=4 4172 B12R1.116 CCCc1ccc(cc1)SCF 62a_100000750032_100015361967 [1,1,0,0,0,0|0,1,1]=4 4173 B12R1.116 CCCc1ccc(cc1)SCF 62a_100015361967_100000750032 [1,1,0,0,0,0|0,1,1]=4 4174 B12R1.116 CCNc1ccc(cc1)COC 34a_100000694113_100000210202 [1,1,0,0,0,0|1,0,1]=4 4175 B12R1.116 CCNc1ccc(cc1)CSC 2230a_106726388226_100000210202 [1,1,0,0,0,0|2,0,0]=4 4176 B12R1.116 CCNc1ccc(cc1)CSC 34a_106726388226_100000210202 [1,1,0,0,0,0|2,0,0]=4 4177 B12R1.116 CCNc1ccc(cc1)CSC 7a_106726388226_100000210202 [1,1,0,0,0,0|2,0,0]=4 4178 B12R1.116 CCNc1ccc(cc1)OCC 2230a_100000739623_100000210202 [1,1,0,0,0,0|1,0,1]=4 4179 B12R1.116 CCNc1ccc(cc1)OCC 34a_100000739623_100000210202 [1,1,0,0,0,0|1,0,1]=4 4180 B12R1.116 CCNc1ccc(cc1)OCC 34a_100011337800_100000210202 [1,1,0,0,0,0|1,0,1]=4 4181 B12R1.116 CCNc1ccc(cc1)OCC 7a_100011337800_100000210202 [1,1,0,0,0,0|1,0,1]=4 4182 B12R1.116 CCNc1ccc(cc1)OCF 34a_100011337800_100015361967 [1,1,0,0,0,0|1,0,1]=4 4183 B12R1.116 CCNc1ccc(cc1)OCF 7a_100011337800_100015361967 [1,1,0,0,0,0|1,0,1]=4 4184 B12R1.116 CCOc1ccc(cc1)CC#N 34a_100000198970_100000210202 [1,1,0,0,0,0|1,0,1]=4 4185 B12R1.116 CCOc1ccc(cc1)CC#N 7a_100000198970_100000210202 [1,1,0,0,0,0|1,0,1]=4 4186 B12R1.116 CCOc1ccc(cc1)CCBr 34a_100009816426_100000210202 [1,1,0,0,0,0|1,0,1]=4 4187 B12R1.116 CCOc1ccc(cc1)CCBr 7a_100009816426_100000210202 [1,1,0,0,0,0|1,0,1]=4 4188 B12R1.116 CCOc1ccc(cc1)CCN 34a_100000743037_100000210202 [1,1,0,0,0,0|1,0,1]=4 4189 B12R1.116 CCOc1ccc(cc1)CCO 34a_100011215338_100000210202 [1,1,0,0,0,0|0,0,2]=4 4190 B12R1.116 CCOc1ccc(cc1)CCO 7a_100011215338_100000210202 [1,1,0,0,0,0|0,0,2]=4 4191 B12R1.116 CCOc1ccc(cc1)CNC 207a_100102657272_100000169836 [1,1,0,0,0,0|1,0,0]=3 4192 B12R1.116 CCOc1ccc(cc1)CNC 2230a_100000185588_200000210301 [1,1,0,0,0,0|1,0,0]=3 4193 B12R1.116 CCOc1ccc(cc1)CNC 270004a_106832991635_100000169836 [1,1,0,0,0,0|1,0,0]=3 4194 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000185588_200000210301 [1,1,0,0,0,0|1,0,0]=3 4195 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000207500_100000210202 [1,1,0,0,0,0|1,0,0]=3 4196 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 2230a_100000185588_200025704644 [1,1,0,0,0,0|1,0,0]=3 4197 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 34a_100000185588_200025704644 [1,1,0,0,0,0|1,0,0]=3 4198 B12R1.116 CCOc1ccc(cc1)COC 34a_100000173027_200000210301 [1,1,0,0,0,0|1,0,0]=3 4199 B12R1.116 CCOc1ccc(cc1)COC 34a_200011995677_100000210202 [1,1,0,0,0,0|1,0,0]=3 4200 B12R1.116 CCOc1ccc(cc1)COC 7a_100000173027_200000210301 [1,1,0,0,0,0|1,0,0]=3 4201 B12R1.116 CCOc1ccc(cc1)COC 7a_200011995677_100000210202 [1,1,0,0,0,0|1,0,0]=3 4202 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 34a_100000173027_200025704644 [1,1,0,0,0,0|1,0,0]=3 4203 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 7a_100000173027_200025704644 [1,1,0,0,0,0|1,0,0]=3 4204 B12R1.116 CCOc1ccc(cc1)OCC 34a_100000185467_100000210202 [1,1,0,0,0,0|1,0,1]=4 4205 B12R1.116 CCOc1ccc(cc1)OCF 34a_100000185467_100015361967 [1,1,0,0,0,0|1,0,1]=4 4206 B12R1.116 CCOc1ccc(cc1)SCC 62a_100000210202_100000171712 [1,1,0,0,0,0|1,0,1]=4 4207 B12R1.116 CCOc1ccc(cn1)CNC 207a_100102657272_100012002837 [1,1,0,0,0,0|2,0,0]=4 4208 B12R1.116 CCOc1ccc(cn1)CNC 2230a_100102710506_200000210301 [1,1,0,0,0,0|2,0,0]=4 4209 B12R1.116 CCOc1ccc(cn1)CNC 270004a_106832991635_100012002837 [1,1,0,0,0,0|2,0,0]=4 4210 B12R1.116 CCOc1ccc(cn1)CN[13CH3] 2230a_100102710506_200025704644 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.116 CCOc1ccc(nc1)COC 34a_200012645146_200000210301 [1,1,0,0,0,0|2,0,0]=4 4212 B12R1.116 CCOc1ccc(nc1)CO[13CH3] 34a_200012645146_200025704644 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.116 CCSc1ccc(cc1)CC=O 62a_100000210202_100011361690 [1,1,0,0,0,0|0,1,0]=3 4214 B12R1.116 CCSc1ccc(cc1)CC=O 62a_100011361690_100000210202 [1,1,0,0,0,0|0,1,0]=3 4215 B12R1.116 CCSc1ccc(cc1)CNC 62a_100000180866_100000210202 [1,1,0,0,0,0|1,1,0]=4 4216 B12R1.116 CCSc1ccc(cc1)CNC 62a_100000210202_100000180866 [1,1,0,0,0,0|1,1,0]=4 4217 B12R1.116 CCSc1ccc(cc1)COC 62a_100000210202_100011493685 [1,1,0,0,0,0|1,0,1]=4 4218 B12R1.116 CCSc1ccc(cc1)COC 62a_100011493685_100000210202 [1,1,0,0,0,0|1,0,1]=4 4219 B12R1.116 CNCc1ccc(cc1)CCBr 26a_100102657272_100009816426 [1,1,0,0,0,0|2,0,0]=4 4220 B12R1.116 CNCc1ccc(cc1)CCN 26a_100102657272_100000743037 [1,1,0,0,0,0|2,0,0]=4 4221 B12R1.116 CNCc1ccc(cc1)CCO 26a_100102657272_100011215338 [1,1,0,0,0,0|2,0,0]=4 4222 B12R1.116 CNCc1ccc(cc1)COC 2230a_100000738208_200000210301 [1,1,0,0,0,0|1,0,0]=3 4223 B12R1.116 CNCc1ccc(cc1)COC 26a_100102657272_200011995677 [1,1,0,0,0,0|1,0,0]=3 4224 B12R1.116 CNCc1ccc(cc1)COC 34a_100000738208_200000210301 [1,1,0,0,0,0|1,0,0]=3 4225 B12R1.116 CNCc1ccc(cc1)OCF 34a_100000207500_100015361967 [1,1,0,0,0,0|1,0,0]=3 4226 B12R1.116 CNCc1ccc(cc1)SCF 62a_100000180866_100015361967 [1,1,0,0,0,0|1,1,0]=4 4227 B12R1.116 CNCc1ccc(cc1)SCF 62a_100015361967_100000180866 [1,1,0,0,0,0|1,1,0]=4 4228 B12R1.116 COCc1ccc(cc1)CC#N 7a_100000695229_200000210301 [1,1,0,0,0,0|1,0,1]=4 4229 B12R1.116 COCc1ccc(cc1)CN[13CH3] 2230a_100000738208_200025704644 [1,1,0,0,0,0|1,0,0]=3 4230 B12R1.116 COCc1ccc(cc1)CN[13CH3] 34a_100000738208_200025704644 [1,1,0,0,0,0|1,0,0]=3 4231 B12R1.116 COCc1ccc(cc1)NCF 34a_100000694113_100015361967 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.116 COCc1ccc(cc1)OCF 34a_200011995677_100015361967 [1,1,0,0,0,0|1,0,0]=3 4233 B12R1.116 COCc1ccc(cc1)OCF 7a_200011995677_100015361967 [1,1,0,0,0,0|1,0,0]=3 4234 B12R1.116 COCc1ccc(cc1)SCF 62a_100011493685_100015361967 [1,1,0,0,0,0|1,1,0]=4 4235 B12R1.116 COCc1ccc(cc1)SCF 62a_100015361967_100011493685 [1,1,0,0,0,0|1,1,0]=4 4236 B12R1.116 CSCc1ccc(cc1)NCF 34a_106726388226_100015361967 [1,1,0,0,0,0|2,0,0]=4 4237 B12R1.116 CSCc1ccc(cc1)NCF 7a_106726388226_100015361967 [1,1,0,0,0,0|2,0,0]=4 4238 B12R1.116 FCOc1ccc(cc1)CCBr 34a_100009816426_100015361967 [1,1,0,0,0,0|1,0,1]=4 4239 B12R1.116 FCOc1ccc(cc1)CCBr 7a_100009816426_100015361967 [1,1,0,0,0,0|1,0,1]=4 4240 B12R1.116 N#CCc1ccc(cc1)OCF 34a_100000198970_100015361967 [1,1,0,0,0,0|1,0,1]=4 4241 B12R1.116 N#CCc1ccc(cc1)OCF 7a_100000198970_100015361967 [1,1,0,0,0,0|1,0,1]=4 4242 B12R1.116 NCCc1ccc(cc1)OCF 34a_100000743037_100015361967 [1,1,0,0,0,0|1,0,1]=4 4243 B12R1.116 O=CCc1ccc(cc1)SCF 62a_100011361690_100015361967 [1,1,0,0,0,0|0,1,0]=3 4244 B12R1.116 O=CCc1ccc(cc1)SCF 62a_100015361967_100011361690 [1,1,0,0,0,0|0,1,0]=3 4245 B12R1.116 OCCc1ccc(cc1)OCF 34a_100011215338_100015361967 [1,1,0,0,0,0|0,0,2]=4 4246 B12R1.116 OCCc1ccc(cc1)OCF 7a_100011215338_100015361967 [1,1,0,0,0,0|0,0,2]=4 4247 B12R1.116 [13CH3]OCc1ccc(cc1)CC#N 7a_100000695229_200025704644 [1,1,0,0,0,0|1,0,1]=4 4248 B12R1.288 CC=Cc1cc(c(cn1)OC)N 271570a_100016259895_100010896307 [1,1,0,0,0,0|1,0,1]=4 4249 B12R1.288 CC=Cc1cc(c(cn1)OC)O 271570a_100016259895_100010264082 [1,1,0,0,0,0|1,0,1]=4 4250 B12R1.288 CC=Cc1ccc(c(c1)Br)OC 271570a_100016259895_100011249507 [1,1,0,0,0,0|0,0,1]=3 4251 B12R1.288 CC=Cc1ccc(c(c1)C)NC 271570a_100016259895_100000221803 [1,1,0,0,0,0|1,0,1]=4 4252 B12R1.288 CC=Cc1ccc(c(c1)C)OC 271570a_100016259895_100011219705 [1,1,0,0,0,0|0,0,1]=3 4253 B12R1.288 CC=Cc1ccc(c(c1)Cl)OC 271570a_100016259895_100012355395 [1,1,0,0,0,0|0,0,1]=3 4254 B12R1.288 CC=Cc1ccc(c(c1)Cl)SC 271570a_100016259895_206447510565 [1,1,0,0,0,0|0,1,1]=4 4255 B12R1.288 CC=Cc1ccc(c(c1)F)CC 271570a_100016259895_200010071577 [1,1,0,0,0,0|1,0,1]=4 4256 B12R1.288 CC=Cc1ccc(c(c1)F)NC 271570a_100016259895_100000743884 [1,1,0,0,0,0|1,0,1]=4 4257 B12R1.288 CC=Cc1ccc(c(c1)F)OC 271570a_100016259895_100000185480 [1,1,0,0,0,0|0,0,1]=3 4258 B12R1.288 CC=Cc1ccc(c(c1)F)SC 271570a_100016259895_100010161220 [1,1,0,0,0,0|0,1,1]=4 4259 B12R1.288 CC=Cc1ccc(c(c1)N)CC 271570a_100016259895_100012354963 [1,1,0,0,0,0|1,0,1]=4 4260 B12R1.288 CC=Cc1ccc(c(c1)N)NC 271570a_100016259895_100000741790 [1,1,0,0,0,0|1,0,1]=4 4261 B12R1.288 CC=Cc1ccc(c(c1)N)OC 271570a_100016259895_100000743470 [1,1,0,0,0,0|0,0,1]=3 4262 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [1,1,0,0,0,0|0,0,1]=3 4263 B12R1.288 CC=Cc1ccc(c(n1)Br)OC 271570a_100016259895_100010214827 [1,1,0,0,0,0|1,0,1]=4 4264 B12R1.288 CC=Cc1ccc(c(n1)C)OC 271570a_100016259895_100010244750 [1,1,0,0,0,0|1,0,1]=4 4265 B12R1.288 CC=Cc1ccc(c(n1)Cl)OC 271570a_100016259895_100010233546 [1,1,0,0,0,0|1,0,1]=4 4266 B12R1.288 CC=Cc1ccc(c(n1)F)OC 271570a_100016259895_100010138636 [1,1,0,0,0,0|1,0,1]=4 4267 B12R1.288 CC=Cc1ccc(c(n1)N)OC 271570a_100016259895_100010192976 [1,1,0,0,0,0|1,0,1]=4 4268 B12R1.288 CC=Cc1cnc(c(c1)Br)OC 271570a_100016259895_200010988584 [1,1,0,0,0,0|1,0,1]=4 4269 B12R1.288 CC=Cc1cnc(c(c1)C)OC 271570a_100016259895_100011290809 [1,1,0,0,0,0|1,0,1]=4 4270 B12R1.288 CC=Cc1cnc(c(c1)F)OC 271570a_100016259895_100011880707 [1,1,0,0,0,0|1,0,1]=4 4271 B12R1.288 CC=Cc1cnc(c(c1)N)OC 271570a_100016259895_100000748608 [1,1,0,0,0,0|1,0,1]=4 4272 B12R1.288 CC=Cc1cnc(c(c1)O)OC 271570a_100016259895_100010135713 [1,1,0,0,0,0|1,0,1]=4 4273 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200000210301_200010686677 [1,1,0,0,0,0|0,1,1]=4 4274 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200010686677_200000210301 [1,1,0,0,0,0|0,1,1]=4 4275 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200010686677_200025704644 [1,1,0,0,0,0|0,1,1]=4 4276 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010686677 [1,1,0,0,0,0|0,1,1]=4 4277 B12R1.288 CCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210202 [1,1,0,0,0,0|1,0,1]=4 4278 B12R1.288 CCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210202 [1,1,0,0,0,0|1,0,1]=4 4279 B12R1.288 CCNc1ccc(c(c1)C)OC 34a_100000743268_100000210202 [1,1,0,0,0,0|1,0,1]=4 4280 B12R1.288 CCNc1ccc(c(c1)C)OC 7a_100000743268_100000210202 [1,1,0,0,0,0|1,0,1]=4 4281 B12R1.288 CCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210202 [1,1,0,0,0,0|1,0,1]=4 4282 B12R1.288 CCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210202 [1,1,0,0,0,0|1,0,1]=4 4283 B12R1.288 CCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210202 [1,1,0,0,0,0|1,0,1]=4 4284 B12R1.288 CCNc1ccc(c(c1)F)OC 34a_100000740183_100000210202 [1,1,0,0,0,0|1,0,1]=4 4285 B12R1.288 CCNc1ccc(c(c1)I)OC 34a_100011356947_100000210202 [1,1,0,0,0,0|1,0,1]=4 4286 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [1,1,0,0,0,0|1,0,1]=4 4287 B12R1.288 CCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210202 [1,1,0,0,0,0|1,0,1]=4 4288 B12R1.288 CCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210202 [1,1,0,0,0,0|1,0,1]=4 4289 B12R1.288 CCOc1ccc(c(c1)C)OC 34a_100000759738_100000210202 [1,1,0,0,0,0|1,0,1]=4 4290 B12R1.288 CCOc1ccc(c(c1)C)OC 7a_100000759738_100000210202 [1,1,0,0,0,0|1,0,1]=4 4291 B12R1.288 CCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210202 [1,1,0,0,0,0|1,0,1]=4 4292 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210202 [1,1,0,0,0,0|1,0,1]=4 4293 B12R1.288 CCOc1ccc(c(c1)F)OC 34a_100000746305_100000210202 [1,1,0,0,0,0|1,0,1]=4 4294 B12R1.288 CCOc1ccc(c(c1)F)OC 7a_100000746305_100000210202 [1,1,0,0,0,0|1,0,1]=4 4295 B12R1.288 CCOc1ccc(c(c1)I)OC 34a_100010084122_100000210202 [1,1,0,0,0,0|1,0,1]=4 4296 B12R1.288 CCOc1ccc(c(c1)I)OC 7a_100010084122_100000210202 [1,1,0,0,0,0|1,0,1]=4 4297 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100000210202_100011249507 [1,1,0,0,0,0|1,0,1]=4 4298 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210202 [1,1,0,0,0,0|1,0,1]=4 4299 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100000210202_100011219705 [1,1,0,0,0,0|1,0,1]=4 4300 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100011219705_100000210202 [1,1,0,0,0,0|1,0,1]=4 4301 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100000210202_100012355395 [1,1,0,0,0,0|1,0,1]=4 4302 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210202 [1,1,0,0,0,0|1,0,1]=4 4303 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000171752_100000210202 [1,1,0,0,0,0|1,0,1]=4 4304 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000210202_100000171752 [1,1,0,0,0,0|1,0,1]=4 4305 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100000210202_100011249504 [1,1,0,0,0,0|1,0,1]=4 4306 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100011249504_100000210202 [1,1,0,0,0,0|1,0,1]=4 4307 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [1,1,0,0,0,0|1,0,1]=4 4308 B12R1.288 CCc1ccc(cc1Cl)CNC 26a_100102657272_100009886192 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.288 CNCc1cc(=O)c(co1)OC 2230a_106832991635_100000081511 [1,1,0,0,0,0|2,0,0]=4 4310 B12R1.288 CNCc1cc(=O)c(co1)OC 7a_106832991635_100000081511 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.288 CNCc1cc(c(cn1)OC)Br 207a_100102657272_100010893078 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.288 CNCc1cc(c(cn1)OC)Br 270004a_106832991635_100010893078 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.288 CNCc1ccc(c(c1)Br)OC 207a_100102657272_100000173361 [1,1,0,0,0,0|1,0,0]=3 4314 B12R1.288 CNCc1ccc(c(c1)Br)OC 2230a_106832991635_200011397701 [1,1,0,0,0,0|1,0,0]=3 4315 B12R1.288 CNCc1ccc(c(c1)Br)OC 26a_100102657272_100010234764 [1,1,0,0,0,0|1,0,0]=3 4316 B12R1.288 CNCc1ccc(c(c1)Br)OC 270004a_106832991635_100000173361 [1,1,0,0,0,0|1,0,0]=3 4317 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100102657272_200011397701 [1,1,0,0,0,0|1,0,0]=3 4318 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100159240714_200000210301 [1,1,0,0,0,0|1,0,0]=3 4319 B12R1.288 CNCc1ccc(c(c1)Br)OC 7a_106832991635_200011397701 [1,1,0,0,0,0|1,0,0]=3 4320 B12R1.288 CNCc1ccc(c(c1)C)OC 207a_100102657272_100000239718 [1,1,0,0,0,0|1,0,0]=3 4321 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 4322 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 4323 B12R1.288 CNCc1ccc(c(c1)C)OC 270004a_106832991635_100000239718 [1,1,0,0,0,0|1,0,0]=3 4324 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102657272_200011290836 [1,1,0,0,0,0|1,0,0]=3 4325 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 4326 B12R1.288 CNCc1ccc(c(c1)C)OC 7a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 4327 B12R1.288 CNCc1ccc(c(c1)Cl)OC 207a_100102657272_100000186747 [1,1,0,0,0,0|1,0,0]=3 4328 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_100000008799_200000210301 [1,1,0,0,0,0|1,0,0]=3 4329 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_106832991635_100000693707 [1,1,0,0,0,0|1,0,0]=3 4330 B12R1.288 CNCc1ccc(c(c1)Cl)OC 26a_100102657272_200009861682 [1,1,0,0,0,0|1,0,0]=3 4331 B12R1.288 CNCc1ccc(c(c1)Cl)OC 270004a_106832991635_100000186747 [1,1,0,0,0,0|1,0,0]=3 4332 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100000008799_200000210301 [1,1,0,0,0,0|1,0,0]=3 4333 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100102657272_100000693707 [1,1,0,0,0,0|1,0,0]=3 4334 B12R1.288 CNCc1ccc(c(c1)Cl)OC 7a_106832991635_100000693707 [1,1,0,0,0,0|1,0,0]=3 4335 B12R1.288 CNCc1ccc(c(c1)F)OC 207a_100102657272_100000204617 [1,1,0,0,0,0|1,0,0]=3 4336 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_100000737316_200000210301 [1,1,0,0,0,0|1,0,0]=3 4337 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_106832991635_100000189595 [1,1,0,0,0,0|1,0,0]=3 4338 B12R1.288 CNCc1ccc(c(c1)F)OC 270004a_106832991635_100000204617 [1,1,0,0,0,0|1,0,0]=3 4339 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100000737316_200000210301 [1,1,0,0,0,0|1,0,0]=3 4340 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100102657272_100000189595 [1,1,0,0,0,0|1,0,0]=3 4341 B12R1.288 CNCc1ccc(c(c1)F)OC 7a_106832991635_100000189595 [1,1,0,0,0,0|1,0,0]=3 4342 B12R1.288 CNCc1ccc(c(c1)I)OC 207a_100102657272_100009827998 [1,1,0,0,0,0|1,0,0]=3 4343 B12R1.288 CNCc1ccc(c(c1)I)OC 270004a_106832991635_100009827998 [1,1,0,0,0,0|1,0,0]=3 4344 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [1,1,0,0,0,0|1,0,0]=3 4345 B12R1.288 CNCc1ccc(c(n1)Br)OC 207a_100102657272_100010174741 [1,1,0,0,0,0|2,0,0]=4 4346 B12R1.288 CNCc1ccc(c(n1)Br)OC 270004a_106832991635_100010174741 [1,1,0,0,0,0|2,0,0]=4 4347 B12R1.288 CNCc1cnc(c(c1)Br)OC 207a_100102657272_200010064893 [1,1,0,0,0,0|2,0,0]=4 4348 B12R1.288 CNCc1cnc(c(c1)Br)OC 270004a_106832991635_200010064893 [1,1,0,0,0,0|2,0,0]=4 4349 B12R1.288 CNCc1cnc(c(c1)C)OC 207a_100102657272_100012183433 [1,1,0,0,0,0|2,0,0]=4 4350 B12R1.288 CNCc1cnc(c(c1)C)OC 270004a_106832991635_100012183433 [1,1,0,0,0,0|2,0,0]=4 4351 B12R1.288 CNCc1cnc(c(c1)Cl)OC 207a_100102657272_100000081810 [1,1,0,0,0,0|2,0,0]=4 4352 B12R1.288 CNCc1cnc(c(c1)Cl)OC 270004a_106832991635_100000081810 [1,1,0,0,0,0|2,0,0]=4 4353 B12R1.288 CNCc1cnc(c(c1)F)OC 207a_100102657272_100000081167 [1,1,0,0,0,0|2,0,0]=4 4354 B12R1.288 CNCc1cnc(c(c1)F)OC 270004a_106832991635_100000081167 [1,1,0,0,0,0|2,0,0]=4 4355 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100000246451_200000210301 [1,1,0,0,0,0|1,0,0]=3 4356 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100138415774_200011397701 [1,1,0,0,0,0|1,0,0]=3 4357 B12R1.288 COCc1ccc(c(c1)Br)OC 7a_100000246451_200000210301 [1,1,0,0,0,0|1,0,0]=3 4358 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [1,1,0,0,0,0|1,0,0]=3 4359 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [1,1,0,0,0,0|1,0,0]=3 4360 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [1,1,0,0,0,0|1,0,0]=3 4361 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100000694469_200000210301 [1,1,0,0,0,0|1,0,0]=3 4362 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100138415774_100000693707 [1,1,0,0,0,0|1,0,0]=3 4363 B12R1.288 COCc1ccc(c(c1)Cl)OC 7a_100000694469_200000210301 [1,1,0,0,0,0|1,0,0]=3 4364 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100000246395_200000210301 [1,1,0,0,0,0|1,0,0]=3 4365 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100138415774_100000189595 [1,1,0,0,0,0|1,0,0]=3 4366 B12R1.288 COCc1ccc(c(c1)F)OC 7a_100000246395_200000210301 [1,1,0,0,0,0|1,0,0]=3 4367 B12R1.288 COCc1ccc(c(c1)F)SC 62a_100010177442_200000210301 [1,1,0,0,0,0|1,1,0]=4 4368 B12R1.288 COCc1ccc(c(c1)F)SC 62a_200000210301_100010177442 [1,1,0,0,0,0|1,1,0]=4 4369 B12R1.288 COCc1ccc(c(c1)F)S[13CH3] 62a_100010177442_200025704644 [1,1,0,0,0,0|1,1,0]=4 4370 B12R1.288 COCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100010177442 [1,1,0,0,0,0|1,1,0]=4 4371 B12R1.288 COCc1ccc(c(c1)I)OC 34a_200000013966_200000210301 [1,1,0,0,0,0|1,0,0]=3 4372 B12R1.288 COCc1ccc(c(c1)I)OC 7a_200000013966_200000210301 [1,1,0,0,0,0|1,0,0]=3 4373 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [1,1,0,0,0,0|1,0,0]=3 4374 B12R1.288 COCc1ccc(c(c1)N)SC 62a_200000210301_200013033220 [1,1,0,0,0,0|1,1,0]=4 4375 B12R1.288 COCc1ccc(c(c1)N)SC 62a_200013033220_200000210301 [1,1,0,0,0,0|1,1,0]=4 4376 B12R1.288 COCc1ccc(c(c1)N)S[13CH3] 62a_200013033220_200025704644 [1,1,0,0,0,0|1,1,0]=4 4377 B12R1.288 COCc1ccc(c(c1)N)S[13CH3] 62a_200025704644_200013033220 [1,1,0,0,0,0|1,1,0]=4 4378 B12R1.288 COCc1ccc(c(n1)Br)OC 34a_100010205416_200000210301 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.288 COCc1ccc(c(n1)Br)OC 7a_100010205416_200000210301 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.288 COCc1ccc(c(n1)Cl)OC 34a_100009842956_200000210301 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.288 COCc1ccc(c(n1)Cl)OC 7a_100009842956_200000210301 [1,1,0,0,0,0|2,0,0]=4 4382 B12R1.288 COCc1cnc(c(c1)Cl)OC 34a_200011438738_200000210301 [1,1,0,0,0,0|2,0,0]=4 4383 B12R1.288 COc1ccc(cc1Br)CN[13CH3] 34a_100159240714_200025704644 [1,1,0,0,0,0|1,0,0]=3 4384 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 34a_100000246451_200025704644 [1,1,0,0,0,0|1,0,0]=3 4385 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 7a_100000246451_200025704644 [1,1,0,0,0,0|1,0,0]=3 4386 B12R1.288 COc1ccc(cc1Br)CSC 62a_200000210301_200011397701 [1,1,0,0,0,0|1,0,0]=3 4387 B12R1.288 COc1ccc(cc1Br)CSC 62a_200011397701_200000210301 [1,1,0,0,0,0|1,0,0]=3 4388 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200011397701_200025704644 [1,1,0,0,0,0|1,0,0]=3 4389 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200025704644_200011397701 [1,1,0,0,0,0|1,0,0]=3 4390 B12R1.288 COc1ccc(cc1C)CN[13CH3] 2230a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 4391 B12R1.288 COc1ccc(cc1C)CN[13CH3] 34a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 4392 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [1,1,0,0,0,0|1,0,0]=3 4393 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [1,1,0,0,0,0|1,0,0]=3 4394 B12R1.288 COc1ccc(cc1C)CSC 62a_200000210301_200011290836 [1,1,0,0,0,0|1,0,0]=3 4395 B12R1.288 COc1ccc(cc1C)CSC 62a_200011290836_200000210301 [1,1,0,0,0,0|1,0,0]=3 4396 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200011290836_200025704644 [1,1,0,0,0,0|1,0,0]=3 4397 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200025704644_200011290836 [1,1,0,0,0,0|1,0,0]=3 4398 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 2230a_100000008799_200025704644 [1,1,0,0,0,0|1,0,0]=3 4399 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 34a_100000008799_200025704644 [1,1,0,0,0,0|1,0,0]=3 4400 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 34a_100000694469_200025704644 [1,1,0,0,0,0|1,0,0]=3 4401 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 7a_100000694469_200025704644 [1,1,0,0,0,0|1,0,0]=3 4402 B12R1.288 COc1ccc(cc1Cl)CSC 62a_100000693707_200000210301 [1,1,0,0,0,0|1,0,0]=3 4403 B12R1.288 COc1ccc(cc1Cl)CSC 62a_200000210301_100000693707 [1,1,0,0,0,0|1,0,0]=3 4404 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_100000693707_200025704644 [1,1,0,0,0,0|1,0,0]=3 4405 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100000693707 [1,1,0,0,0,0|1,0,0]=3 4406 B12R1.288 COc1ccc(cc1F)CN[13CH3] 2230a_100000737316_200025704644 [1,1,0,0,0,0|1,0,0]=3 4407 B12R1.288 COc1ccc(cc1F)CN[13CH3] 34a_100000737316_200025704644 [1,1,0,0,0,0|1,0,0]=3 4408 B12R1.288 COc1ccc(cc1F)CO[13CH3] 34a_100000246395_200025704644 [1,1,0,0,0,0|1,0,0]=3 4409 B12R1.288 COc1ccc(cc1F)CO[13CH3] 7a_100000246395_200025704644 [1,1,0,0,0,0|1,0,0]=3 4410 B12R1.288 COc1ccc(cc1F)CSC 62a_100000189595_200000210301 [1,1,0,0,0,0|1,0,0]=3 4411 B12R1.288 COc1ccc(cc1F)CSC 62a_200000210301_100000189595 [1,1,0,0,0,0|1,0,0]=3 4412 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_100000189595_200025704644 [1,1,0,0,0,0|1,0,0]=3 4413 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_200025704644_100000189595 [1,1,0,0,0,0|1,0,0]=3 4414 B12R1.288 COc1ccc(cc1I)CO[13CH3] 34a_200000013966_200025704644 [1,1,0,0,0,0|1,0,0]=3 4415 B12R1.288 COc1ccc(cc1I)CO[13CH3] 7a_200000013966_200025704644 [1,1,0,0,0,0|1,0,0]=3 4416 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [1,1,0,0,0,0|1,0,0]=3 4417 B12R1.288 COc1ccc(cc1O)CC#N 271570a_203496583355_100011215974 [1,1,0,0,0,0|1,0,1]=4 4418 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [1,1,0,0,0,0|1,0,1]=4 4419 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [1,1,0,0,0,0|0,0,2]=4 4420 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [1,1,0,0,0,0|1,0,0]=3 4421 B12R1.288 COc1ccc(nc1Br)CO[13CH3] 34a_100010205416_200025704644 [1,1,0,0,0,0|2,0,0]=4 4422 B12R1.288 COc1ccc(nc1Br)CO[13CH3] 7a_100010205416_200025704644 [1,1,0,0,0,0|2,0,0]=4 4423 B12R1.288 COc1ccc(nc1Cl)CO[13CH3] 34a_100009842956_200025704644 [1,1,0,0,0,0|2,0,0]=4 4424 B12R1.288 COc1ccc(nc1Cl)CO[13CH3] 7a_100009842956_200025704644 [1,1,0,0,0,0|2,0,0]=4 4425 B12R1.288 COc1coc(cc1=O)CSC 62a_200000210301_100000081511 [1,1,0,0,0,0|2,0,0]=4 4426 B12R1.288 COc1coc(cc1=O)CS[13CH3] 62a_200025704644_100000081511 [1,1,0,0,0,0|2,0,0]=4 4427 B12R1.288 COc1ncc(cc1Cl)CO[13CH3] 34a_200011438738_200025704644 [1,1,0,0,0,0|2,0,0]=4 4428 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 34a_100000185729_200025704644 [0,1,0,0,1,0|1,0,1]=4 4429 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 7a_100000185729_200025704644 [0,1,0,0,1,0|1,0,1]=4 4430 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 34a_100000695648_200025704644 [0,1,0,0,1,0|0,0,2]=4 4431 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 7a_100000695648_200025704644 [0,1,0,0,1,0|0,0,2]=4 4432 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 34a_100000195502_200000210301 [0,1,0,0,1,0|2,0,0]=4 4433 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 7a_100000195502_200000210301 [0,1,0,0,1,0|2,0,0]=4 4434 B12R1.6 COc1ccc(cc1)C(C)(C)C 34a_100000185729_200000210301 [0,1,0,0,1,0|1,0,1]=4 4435 B12R1.6 COc1ccc(cc1)C(C)(C)C 7a_100000185729_200000210301 [0,1,0,0,1,0|1,0,1]=4 4436 B12R1.6 COc1ccc(cc1)C(C)(C)O 34a_100000695648_200000210301 [0,1,0,0,1,0|0,0,2]=4 4437 B12R1.6 COc1ccc(cc1)C(C)(C)O 7a_100000695648_200000210301 [0,1,0,0,1,0|0,0,2]=4 4438 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 34a_100000230201_200000210301 [0,1,0,0,1,0|1,0,0]=3 4439 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 7a_100000230201_200000210301 [0,1,0,0,1,0|1,0,0]=3 4440 B12R1.6 COc1ccc(cc1)S(=O)(=O)N 34a_100000738502_200000210301 [0,1,0,0,1,0|2,0,0]=4 4441 B12R1.6 COc1ccc(cc1)S(=O)(=O)N 7a_100000738502_200000210301 [0,1,0,0,1,0|2,0,0]=4 4442 B12R1.6 COc1ccc(cc1)S(=O)(=O)[O-] 7a_100000698548_200000210301 [0,1,0,0,1,0|2,0,0]=4 4443 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 34a_100000195502_200025704644 [0,1,0,0,1,0|2,0,0]=4 4444 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 7a_100000195502_200025704644 [0,1,0,0,1,0|2,0,0]=4 4445 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 34a_100000230201_200025704644 [0,1,0,0,1,0|1,0,0]=3 4446 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 7a_100000230201_200025704644 [0,1,0,0,1,0|1,0,0]=3 4447 B12R1.6 CS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_100000765142_200025704644 [0,1,0,0,1,0|1,1,0]=4 4448 B12R1.6 CS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000765142 [0,1,0,0,1,0|1,1,0]=4 4449 B12R1.6 CSc1ccc(cc1)S(=O)(=O)C 62a_100000765142_200000210301 [0,1,0,0,1,0|1,1,0]=4 4450 B12R1.6 CSc1ccc(cc1)S(=O)(=O)C 62a_200000210301_100000765142 [0,1,0,0,1,0|1,1,0]=4 4451 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)N 34a_100000738502_200025704644 [0,1,0,0,1,0|2,0,0]=4 4452 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)N 7a_100000738502_200025704644 [0,1,0,0,1,0|2,0,0]=4 4453 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)[O-] 7a_100000698548_200025704644 [0,1,0,0,1,0|2,0,0]=4 4454 B12R1.48 C#Cc1ccc(cc1C)C(=O)C 1458a_100013243528_200000210301 [0,1,0,0,1,0|1,0,1]=4 4455 B12R1.48 C#Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100013243528_200025704644 [0,1,0,0,1,0|1,0,1]=4 4456 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)C 1458a_100014797261_200000210301 [0,1,0,0,1,0|1,0,1]=4 4457 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100014797261_200025704644 [0,1,0,0,1,0|1,0,1]=4 4458 B12R1.48 C=C(C)c1cc(c(cn1)OC)N 271570a_100000694244_100010896307 [0,1,0,0,1,0|2,0,0]=4 4459 B12R1.48 C=C(C)c1cc(c(cn1)OC)O 271570a_100000694244_100010264082 [0,1,0,0,1,0|2,0,0]=4 4460 B12R1.48 C=C(C)c1ccc(c(c1)Br)OC 271570a_100000694244_100011249507 [0,1,0,0,1,0|1,0,0]=3 4461 B12R1.48 C=C(C)c1ccc(c(c1)C)NC 271570a_100000694244_100000221803 [0,1,0,0,1,0|2,0,0]=4 4462 B12R1.48 C=C(C)c1ccc(c(c1)C)OC 271570a_100000694244_100011219705 [0,1,0,0,1,0|1,0,0]=3 4463 B12R1.48 C=C(C)c1ccc(c(c1)Cl)OC 271570a_100000694244_100012355395 [0,1,0,0,1,0|1,0,0]=3 4464 B12R1.48 C=C(C)c1ccc(c(c1)Cl)SC 271570a_100000694244_206447510565 [0,1,0,0,1,0|1,1,0]=4 4465 B12R1.48 C=C(C)c1ccc(c(c1)F)CC 271570a_100000694244_200010071577 [0,1,0,0,1,0|2,0,0]=4 4466 B12R1.48 C=C(C)c1ccc(c(c1)F)NC 271570a_100000694244_100000743884 [0,1,0,0,1,0|2,0,0]=4 4467 B12R1.48 C=C(C)c1ccc(c(c1)F)OC 271570a_100000694244_100000185480 [0,1,0,0,1,0|1,0,0]=3 4468 B12R1.48 C=C(C)c1ccc(c(c1)F)SC 271570a_100000694244_100010161220 [0,1,0,0,1,0|1,1,0]=4 4469 B12R1.48 C=C(C)c1ccc(c(c1)N)CC 271570a_100000694244_100012354963 [0,1,0,0,1,0|2,0,0]=4 4470 B12R1.48 C=C(C)c1ccc(c(c1)N)NC 271570a_100000694244_100000741790 [0,1,0,0,1,0|2,0,0]=4 4471 B12R1.48 C=C(C)c1ccc(c(c1)N)OC 271570a_100000694244_100000743470 [0,1,0,0,1,0|1,0,0]=3 4472 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,1,0,0,1,0|1,0,0]=3 4473 B12R1.48 C=C(C)c1ccc(c(n1)Br)OC 271570a_100000694244_100010214827 [0,1,0,0,1,0|2,0,0]=4 4474 B12R1.48 C=C(C)c1ccc(c(n1)C)OC 271570a_100000694244_100010244750 [0,1,0,0,1,0|2,0,0]=4 4475 B12R1.48 C=C(C)c1ccc(c(n1)Cl)OC 271570a_100000694244_100010233546 [0,1,0,0,1,0|2,0,0]=4 4476 B12R1.48 C=C(C)c1ccc(c(n1)F)OC 271570a_100000694244_100010138636 [0,1,0,0,1,0|2,0,0]=4 4477 B12R1.48 C=C(C)c1ccc(c(n1)N)OC 271570a_100000694244_100010192976 [0,1,0,0,1,0|2,0,0]=4 4478 B12R1.48 C=C(C)c1cnc(c(c1)Br)OC 271570a_100000694244_200010988584 [0,1,0,0,1,0|2,0,0]=4 4479 B12R1.48 C=C(C)c1cnc(c(c1)C)OC 271570a_100000694244_100011290809 [0,1,0,0,1,0|2,0,0]=4 4480 B12R1.48 C=C(C)c1cnc(c(c1)F)OC 271570a_100000694244_100011880707 [0,1,0,0,1,0|2,0,0]=4 4481 B12R1.48 C=C(C)c1cnc(c(c1)N)OC 271570a_100000694244_100000748608 [0,1,0,0,1,0|2,0,0]=4 4482 B12R1.48 C=C(C)c1cnc(c(c1)O)OC 271570a_100000694244_100010135713 [0,1,0,0,1,0|2,0,0]=4 4483 B12R1.48 C=Cc1ccc(cc1Br)C(=O)C 271570a_100011290941_100010146554 [0,1,0,0,1,0|1,0,1]=4 4484 B12R1.48 C=Cc1ccc(cc1C)C(=O)C 271570a_100011290941_100000697869 [0,1,0,0,1,0|1,0,1]=4 4485 B12R1.48 C=Cc1ccc(cc1F)C(=O)C 271570a_100011290941_100000690002 [0,1,0,0,1,0|1,0,1]=4 4486 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [0,1,0,0,1,0|1,0,1]=4 4487 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_100011011822_200025704644 [0,1,0,0,1,0|1,1,0]=4 4488 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100011011822 [0,1,0,0,1,0|1,1,0]=4 4489 B12R1.48 CC(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200000210301 [0,1,0,0,1,0|2,0,0]=4 4490 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [0,1,0,0,1,0|0,0,0]=2 4491 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [0,1,0,0,1,0|0,0,0]=2 4492 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100010146554_200025704644 [0,1,0,0,1,0|0,1,0]=3 4493 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100010146554 [0,1,0,0,1,0|0,1,0]=3 4494 B12R1.48 CC(=O)c1ccc(c(c1)C)C#N 1458a_100012180287_200000210301 [0,1,0,0,1,0|2,0,0]=4 4495 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [0,1,0,0,1,0|0,0,0]=2 4496 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [0,1,0,0,1,0|0,0,0]=2 4497 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [0,1,0,0,1,0|0,1,0]=3 4498 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [0,1,0,0,1,0|0,1,0]=3 4499 B12R1.48 CC(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200000210301 [0,1,0,0,1,0|2,0,0]=4 4500 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [0,1,0,0,1,0|0,0,0]=2 4501 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [0,1,0,0,1,0|0,0,0]=2 4502 B12R1.48 CC(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200000210301 [0,1,0,0,1,0|2,0,0]=4 4503 B12R1.48 CC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200000210301 [0,1,0,0,1,0|2,0,0]=4 4504 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [0,1,0,0,1,0|0,0,0]=2 4505 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [0,1,0,0,1,0|0,0,0]=2 4506 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000690002_200025704644 [0,1,0,0,1,0|0,1,0]=3 4507 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000690002 [0,1,0,0,1,0|0,1,0]=3 4508 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [0,1,0,0,1,0|0,0,0]=2 4509 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [0,1,0,0,1,0|0,0,0]=2 4510 B12R1.48 CC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100009816534_200025704644 [0,1,0,0,1,0|0,1,0]=3 4511 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_100009864263_200025704644 [0,1,0,0,1,0|1,1,0]=4 4512 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009864263 [0,1,0,0,1,0|1,1,0]=4 4513 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 34a_100012182850_200025704644 [0,1,0,0,1,0|1,0,1]=4 4514 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 7a_100012182850_200025704644 [0,1,0,0,1,0|1,0,1]=4 4515 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 34a_200000187366_200025704644 [0,1,0,0,1,0|1,0,1]=4 4516 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 7a_200000187366_200025704644 [0,1,0,0,1,0|1,0,1]=4 4517 B12R1.48 CCc1ccc(cc1Br)C(=O)C 1458a_100012340589_200000210301 [0,1,0,0,1,0|1,0,0]=3 4518 B12R1.48 CCc1ccc(cc1Br)C(=O)[13CH3] 1458a_100012340589_200025704644 [0,1,0,0,1,0|1,0,0]=3 4519 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [0,1,0,0,1,0|1,0,0]=3 4520 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [0,1,0,0,1,0|1,0,0]=3 4521 B12R1.48 CNc1ccc(cc1Br)C(=O)N 27a_100102657272_100009814583 [0,1,0,0,1,0|2,0,0]=4 4522 B12R1.48 CNc1ccc(cc1C)C(=O)N 27a_100102657272_100011218126 [0,1,0,0,1,0|2,0,0]=4 4523 B12R1.48 CNc1ccc(cc1C)C(=O)N 34a_100000746439_200000210301 [0,1,0,0,1,0|2,0,0]=4 4524 B12R1.48 CNc1ccc(cc1C)C(=O)N 7a_100000746439_200000210301 [0,1,0,0,1,0|2,0,0]=4 4525 B12R1.48 CNc1ccc(cc1F)C(=O)N 27a_100102657272_100000686215 [0,1,0,0,1,0|2,0,0]=4 4526 B12R1.48 CNc1ncc(cc1C)C(=O)C 27a_100102657272_100009864263 [0,1,0,0,1,0|2,0,0]=4 4527 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [0,1,0,0,1,0|0,0,0]=2 4528 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [0,1,0,0,1,0|0,0,0]=2 4529 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [0,1,0,0,1,0|0,0,0]=2 4530 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [0,1,0,0,1,0|0,0,0]=2 4531 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_200000210301 [0,1,0,0,1,0|2,0,0]=4 4532 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_200000210301 [0,1,0,0,1,0|2,0,0]=4 4533 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [0,1,0,0,1,0|0,0,0]=2 4534 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [0,1,0,0,1,0|0,0,0]=2 4535 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [0,1,0,0,1,0|0,0,0]=2 4536 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [0,1,0,0,1,0|0,0,0]=2 4537 B12R1.48 COc1ccc(cc1C)C(C)C 34a_200012180908_200000210301 [0,1,0,0,1,0|1,0,1]=4 4538 B12R1.48 COc1ccc(cc1C)C(C)C 7a_200012180908_200000210301 [0,1,0,0,1,0|1,0,1]=4 4539 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 34a_100000744956_200000210301 [0,1,0,0,1,0|2,0,0]=4 4540 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 7a_100000744956_200000210301 [0,1,0,0,1,0|2,0,0]=4 4541 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [0,1,0,0,1,0|0,0,0]=2 4542 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [0,1,0,0,1,0|0,0,0]=2 4543 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [0,1,0,0,1,0|0,0,0]=2 4544 B12R1.48 COc1ccc(cc1Cl)C(=O)N 34a_200000192832_200000210301 [0,1,0,0,1,0|1,0,0]=3 4545 B12R1.48 COc1ccc(cc1Cl)C(=O)N 7a_200000192832_200000210301 [0,1,0,0,1,0|1,0,0]=3 4546 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [0,1,0,0,1,0|0,0,0]=2 4547 B12R1.48 COc1ccc(cc1Cl)C(C)C 34a_100012182850_200000210301 [0,1,0,0,1,0|1,0,1]=4 4548 B12R1.48 COc1ccc(cc1Cl)C(C)C 7a_100012182850_200000210301 [0,1,0,0,1,0|1,0,1]=4 4549 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_200000210301 [0,1,0,0,1,0|2,0,0]=4 4550 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_200000210301 [0,1,0,0,1,0|2,0,0]=4 4551 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [0,1,0,0,1,0|0,0,0]=2 4552 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [0,1,0,0,1,0|0,0,0]=2 4553 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [0,1,0,0,1,0|0,0,0]=2 4554 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [0,1,0,0,1,0|0,0,0]=2 4555 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_200000210301 [0,1,0,0,1,0|2,0,0]=4 4556 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_200000210301 [0,1,0,0,1,0|2,0,0]=4 4557 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [0,1,0,0,1,0|0,0,0]=2 4558 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [0,1,0,0,1,0|0,0,0]=2 4559 B12R1.48 COc1ccc(cc1I)N(C)C 269982a_114948341033_200000210301 [0,1,0,0,1,0|2,0,0]=4 4560 B12R1.48 COc1ccc(cc1I)N(C)C 34a_114948341033_200000210301 [0,1,0,0,1,0|2,0,0]=4 4561 B12R1.48 COc1ccc(cc1I)N(C)C 38a_114948341033_200000210301 [0,1,0,0,1,0|2,0,0]=4 4562 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 269982a_114948341033_200025704644 [0,1,0,0,1,0|2,0,0]=4 4563 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 34a_114948341033_200025704644 [0,1,0,0,1,0|2,0,0]=4 4564 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 38a_114948341033_200025704644 [0,1,0,0,1,0|2,0,0]=4 4565 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_200000210301 [0,1,0,0,1,0|2,0,0]=4 4566 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_200000210301 [0,1,0,0,1,0|2,0,0]=4 4567 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [0,1,0,0,1,0|0,0,0]=2 4568 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [0,1,0,0,1,0|0,0,0]=2 4569 B12R1.48 COc1ccc(cc1N)C(C)C 34a_200000187366_200000210301 [0,1,0,0,1,0|1,0,1]=4 4570 B12R1.48 COc1ccc(cc1N)C(C)C 7a_200000187366_200000210301 [0,1,0,0,1,0|1,0,1]=4 4571 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_200000210301 [0,1,0,0,1,0|2,0,0]=4 4572 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_200000210301 [0,1,0,0,1,0|2,0,0]=4 4573 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,1,0,0,1,0|0,0,0]=2 4574 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,1,0,0,1,0|0,0,0]=2 4575 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,1,0,0,1,0|0,0,0]=2 4576 B12R1.48 COc1ccc(cc1O)C(C)O 271570a_203496583355_100000246541 [0,1,0,0,1,0|0,0,2]=4 4577 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_100010146554_200000210301 [0,1,0,0,1,0|0,1,0]=3 4578 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_200000210301_100010146554 [0,1,0,0,1,0|0,1,0]=3 4579 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_100009814583_200000210301 [0,1,0,0,1,0|1,1,0]=4 4580 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_200000210301_100009814583 [0,1,0,0,1,0|1,1,0]=4 4581 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [0,1,0,0,1,0|0,1,0]=3 4582 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [0,1,0,0,1,0|0,1,0]=3 4583 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_100011218126_200000210301 [0,1,0,0,1,0|1,1,0]=4 4584 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_200000210301_100011218126 [0,1,0,0,1,0|1,1,0]=4 4585 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_100000690002_200000210301 [0,1,0,0,1,0|0,1,0]=3 4586 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_200000210301_100000690002 [0,1,0,0,1,0|0,1,0]=3 4587 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_100000686215_200000210301 [0,1,0,0,1,0|1,1,0]=4 4588 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_200000210301_100000686215 [0,1,0,0,1,0|1,1,0]=4 4589 B12R1.48 CSc1ccc(cc1N)C(=O)C 62a_100009816534_200000210301 [0,1,0,0,1,0|0,1,0]=3 4590 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_100012344895_200000210301 [0,1,0,0,1,0|1,1,0]=4 4591 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_200000210301_100012344895 [0,1,0,0,1,0|1,1,0]=4 4592 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_100011011822_200000210301 [0,1,0,0,1,0|1,1,0]=4 4593 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_200000210301_100011011822 [0,1,0,0,1,0|1,1,0]=4 4594 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_100009864263_200000210301 [0,1,0,0,1,0|1,1,0]=4 4595 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_200000210301_100009864263 [0,1,0,0,1,0|1,1,0]=4 4596 B12R1.48 Cc1cc(ccc1C#N)C(=O)[13CH3] 1458a_100012180287_200025704644 [0,1,0,0,1,0|2,0,0]=4 4597 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 34a_100000746439_200025704644 [0,1,0,0,1,0|2,0,0]=4 4598 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 7a_100000746439_200025704644 [0,1,0,0,1,0|2,0,0]=4 4599 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 34a_200012180908_200025704644 [0,1,0,0,1,0|1,0,1]=4 4600 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 7a_200012180908_200025704644 [0,1,0,0,1,0|1,0,1]=4 4601 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 34a_100000744956_200025704644 [0,1,0,0,1,0|2,0,0]=4 4602 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 7a_100000744956_200025704644 [0,1,0,0,1,0|2,0,0]=4 4603 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_100011218126_200025704644 [0,1,0,0,1,0|1,1,0]=4 4604 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_200025704644_100011218126 [0,1,0,0,1,0|1,1,0]=4 4605 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200025704644 [0,1,0,0,1,0|2,0,0]=4 4606 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200025704644 [0,1,0,0,1,0|2,0,0]=4 4607 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200025704644 [0,1,0,0,1,0|2,0,0]=4 4608 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200025704644 [0,1,0,0,1,0|2,0,0]=4 4609 B12R1.48 [13CH3]Oc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_200025704644 [0,1,0,0,1,0|2,0,0]=4 4610 B12R1.48 [13CH3]Oc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_200025704644 [0,1,0,0,1,0|2,0,0]=4 4611 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 34a_200000192832_200025704644 [0,1,0,0,1,0|1,0,0]=3 4612 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 7a_200000192832_200025704644 [0,1,0,0,1,0|1,0,0]=3 4613 B12R1.48 [13CH3]Oc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_200025704644 [0,1,0,0,1,0|2,0,0]=4 4614 B12R1.48 [13CH3]Oc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_200025704644 [0,1,0,0,1,0|2,0,0]=4 4615 B12R1.48 [13CH3]Oc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_200025704644 [0,1,0,0,1,0|2,0,0]=4 4616 B12R1.48 [13CH3]Oc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_200025704644 [0,1,0,0,1,0|2,0,0]=4 4617 B12R1.48 [13CH3]Oc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_200025704644 [0,1,0,0,1,0|2,0,0]=4 4618 B12R1.48 [13CH3]Oc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_200025704644 [0,1,0,0,1,0|2,0,0]=4 4619 B12R1.48 [13CH3]Oc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_200025704644 [0,1,0,0,1,0|2,0,0]=4 4620 B12R1.48 [13CH3]Oc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_200025704644 [0,1,0,0,1,0|2,0,0]=4 4621 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_100009814583_200025704644 [0,1,0,0,1,0|1,1,0]=4 4622 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_200025704644_100009814583 [0,1,0,0,1,0|1,1,0]=4 4623 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_100000686215_200025704644 [0,1,0,0,1,0|1,1,0]=4 4624 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_200025704644_100000686215 [0,1,0,0,1,0|1,1,0]=4 4625 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_100012344895_200025704644 [0,1,0,0,1,0|1,1,0]=4 4626 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_200025704644_100012344895 [0,1,0,0,1,0|1,1,0]=4 4627 B12R1.256 C=C(C)c1ccc(cc1)C(=C)C 271570a_100000694244_100000185454 [0,1,0,0,1,0|2,0,0]=4 4628 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 1458a_200009908186_200000210301 [0,1,0,0,1,0|1,0,0]=3 4629 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 271570a_100000694244_100000185465 [0,1,0,0,1,0|1,0,0]=3 4630 B12R1.256 C=C(C)c1ccc(cc1)C(=O)N 271570a_100000694244_100000162191 [0,1,0,0,1,0|2,0,0]=4 4631 B12R1.256 C=C(C)c1ccc(cc1)C(=O)[13CH3] 1458a_200009908186_200025704644 [0,1,0,0,1,0|1,0,0]=3 4632 B12R1.256 C=C(C)c1ccc(cc1)C(C)C 271570a_100000694244_100000750031 [0,1,0,0,1,0|2,0,0]=4 4633 B12R1.256 C=C(C)c1ccc(cc1)C(C)O 271570a_100000694244_100000745893 [0,1,0,0,1,0|2,0,0]=4 4634 B12R1.256 C=C(C)c1ccc(cc1)N(C)C 271570a_100000694244_100000210421 [0,1,0,0,1,0|2,0,0]=4 4635 B12R1.256 C=C(C)c1ccc(cc1)S(=O)C 271570a_100000694244_100009816266 [0,1,0,0,1,0|1,1,0]=4 4636 B12R1.256 C=C(C)c1ccc(cc1)[C@@H](C)N 271570a_100000694244_100000720352 [0,1,0,0,1,0|2,0,0]=4 4637 B12R1.256 C=C(C)c1ccc(cc1)[C@H](C)N 271570a_100000694244_100000753911 [0,1,0,0,1,0|2,0,0]=4 4638 B12R1.256 C=C(C)c1ccc(cn1)C(=O)C 271570a_100000694244_100000684857 [0,1,0,0,1,0|2,0,0]=4 4639 B12R1.256 C=C(C)c1ccc(nc1)C(=O)C 271570a_100000694244_100000686046 [0,1,0,0,1,0|2,0,0]=4 4640 B12R1.256 CC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200000210301 [0,1,0,0,1,0|2,0,0]=4 4641 B12R1.256 CC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_200000210301 [0,1,0,0,1,0|1,0,0]=3 4642 B12R1.256 CC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_200000210301 [0,1,0,0,1,0|1,0,0]=3 4643 B12R1.256 CC(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200000210301 [0,1,0,0,1,0|2,0,0]=4 4644 B12R1.256 CC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_200000210301 [0,1,0,0,1,0|1,0,0]=3 4645 B12R1.256 CC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_200000210301 [0,1,0,0,1,0|0,1,0]=3 4646 B12R1.256 CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200000210301 [0,1,0,0,1,0|2,0,0]=4 4647 B12R1.256 CC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000690552 [0,1,0,0,1,0|2,0,0]=4 4648 B12R1.256 CC(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210772_200025704644 [0,1,0,0,1,0|1,0,0]=3 4649 B12R1.256 CC(O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000076921_200025704644 [0,1,0,0,1,0|1,0,0]=3 4650 B12R1.256 CN(C)c1ccc(cc1)C(=O)N 27a_100102631434_100000162191 [0,1,0,0,1,0|2,0,0]=4 4651 B12R1.256 CN(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210873_200025704644 [0,1,0,0,1,0|1,0,0]=3 4652 B12R1.256 CS(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_200000217594_200025704644 [0,1,0,0,1,0|0,1,0]=3 4653 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200025704644 [0,1,0,0,1,0|2,0,0]=4 4654 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200025704644 [0,1,0,0,1,0|2,0,0]=4 4655 B12R1.256 [13CH3]C(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200025704644 [0,1,0,0,1,0|2,0,0]=4 4656 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)C 1458a_100103168756_200000210301 [0,1,0,0,1,0|1,0,1]=4 4657 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100103168756_200025704644 [0,1,0,0,1,0|1,0,1]=4 4658 B12R1.452 C=C(C)c1ccc(cc1Br)CC 271570a_100000694244_200009997437 [0,1,0,0,1,0|2,0,0]=4 4659 B12R1.452 C=C(C)c1ccc(cc1Br)OC 271570a_100000694244_100012349170 [0,1,0,0,1,0|1,0,0]=3 4660 B12R1.452 C=C(C)c1ccc(cc1C)NC 271570a_100000694244_100102888905 [0,1,0,0,1,0|2,0,0]=4 4661 B12R1.452 C=C(C)c1ccc(cc1C)OC 271570a_100000694244_100000759875 [0,1,0,0,1,0|1,0,0]=3 4662 B12R1.452 C=C(C)c1ccc(cc1F)CC 271570a_100000694244_200010339503 [0,1,0,0,1,0|2,0,0]=4 4663 B12R1.452 C=C(C)c1ccc(cc1F)NC 271570a_100000694244_100012285320 [0,1,0,0,1,0|2,0,0]=4 4664 B12R1.452 C=C(C)c1ccc(cc1F)OC 271570a_100000694244_100000753793 [0,1,0,0,1,0|1,0,0]=3 4665 B12R1.452 C=C(C)c1ccc(cc1F)SC 271570a_100000694244_100009816902 [0,1,0,0,1,0|1,1,0]=4 4666 B12R1.452 C=C(C)c1ccc(cc1N)OC 271570a_100000694244_100000748021 [0,1,0,0,1,0|1,0,0]=3 4667 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [0,1,0,0,1,0|1,0,0]=3 4668 B12R1.452 C=C(C)c1ccc(nc1C)OC 271570a_100000694244_100000766551 [0,1,0,0,1,0|2,0,0]=4 4669 B12R1.452 C=C(C)c1ccc(nc1F)OC 271570a_100000694244_100010067559 [0,1,0,0,1,0|2,0,0]=4 4670 B12R1.452 C=C(C)c1ccc(nc1N)OC 271570a_100000694244_100010187629 [0,1,0,0,1,0|2,0,0]=4 4671 B12R1.452 C=C(C)c1cnc(cc1C)OC 271570a_100000694244_100011934368 [0,1,0,0,1,0|2,0,0]=4 4672 B12R1.452 C=C(C)c1cnc(cc1F)OC 271570a_100000694244_100010136277 [0,1,0,0,1,0|2,0,0]=4 4673 B12R1.452 C=C(C)c1cnc(cc1N)OC 271570a_100000694244_100010254562 [0,1,0,0,1,0|2,0,0]=4 4674 B12R1.452 C=C(C)c1cnc(cc1O)OC 271570a_100000694244_100010738159 [0,1,0,0,1,0|2,0,0]=4 4675 B12R1.452 C=C(C)c1ncc(cc1C)OC 271570a_100000694244_200009851512 [0,1,0,0,1,0|2,0,0]=4 4676 B12R1.452 C=C(C)c1ncc(cc1N)OC 271570a_100000694244_100010074831 [0,1,0,0,1,0|2,0,0]=4 4677 B12R1.452 C=Cc1ccc(c(c1)C)C(=O)C 271570a_100011290941_100012360112 [0,1,0,0,1,0|1,0,1]=4 4678 B12R1.452 C=Cc1ccc(c(c1)F)C(=O)C 271570a_100011290941_100000690205 [0,1,0,0,1,0|1,0,1]=4 4679 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)C 271570a_100011290941_100011590516 [0,1,0,0,1,0|1,0,1]=4 4680 B12R1.452 C=Cc1ccc(c(c1)O)C(=O)C 271570a_100011290941_100000188348 [0,1,0,0,1,0|1,0,1]=4 4681 B12R1.452 CC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200000210301 [0,1,0,0,1,0|2,0,0]=4 4682 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [0,1,0,0,1,0|0,0,0]=2 4683 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [0,1,0,0,1,0|0,0,0]=2 4684 B12R1.452 CC(=O)c1ccc(cc1C)C#N 1458a_100000691869_200000210301 [0,1,0,0,1,0|2,0,0]=4 4685 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [0,1,0,0,1,0|0,0,0]=2 4686 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [0,1,0,0,1,0|0,0,0]=2 4687 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_100012360112_200025704644 [0,1,0,0,1,0|0,1,0]=3 4688 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100012360112 [0,1,0,0,1,0|0,1,0]=3 4689 B12R1.452 CC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200000210301 [0,1,0,0,1,0|2,0,0]=4 4690 B12R1.452 CC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200000210301 [0,1,0,0,1,0|2,0,0]=4 4691 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [0,1,0,0,1,0|0,0,0]=2 4692 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [0,1,0,0,1,0|0,0,0]=2 4693 B12R1.452 CC(=O)c1ccc(cc1F)C#N 1458a_100000238375_200000210301 [0,1,0,0,1,0|2,0,0]=4 4694 B12R1.452 CC(=O)c1ccc(cc1F)CO 1458a_100011934814_200000210301 [0,1,0,0,1,0|2,0,0]=4 4695 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [0,1,0,0,1,0|0,0,0]=2 4696 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [0,1,0,0,1,0|0,0,0]=2 4697 B12R1.452 CC(=O)c1ccc(cc1F)S[13CH3] 62a_100000690205_200025704644 [0,1,0,0,1,0|0,1,0]=3 4698 B12R1.452 CC(=O)c1ccc(cc1N)S[13CH3] 62a_100011590516_200025704644 [0,1,0,0,1,0|0,1,0]=3 4699 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_100000696590_200025704644 [0,1,0,0,1,0|1,1,0]=4 4700 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_200025704644_100000696590 [0,1,0,0,1,0|1,1,0]=4 4701 B12R1.452 CCc1ccc(c(c1)F)C(=O)C 1458a_200009867912_200000210301 [0,1,0,0,1,0|1,0,0]=3 4702 B12R1.452 CCc1ccc(c(c1)F)C(=O)[13CH3] 1458a_200009867912_200025704644 [0,1,0,0,1,0|1,0,0]=3 4703 B12R1.452 CNc1ccc(c(c1)Br)C(=O)N 27a_100102657272_200010146565 [0,1,0,0,1,0|2,0,0]=4 4704 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 27a_100102657272_100011327924 [0,1,0,0,1,0|2,0,0]=4 4705 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 34a_200000751758_200000210301 [0,1,0,0,1,0|2,0,0]=4 4706 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 7a_200000751758_200000210301 [0,1,0,0,1,0|2,0,0]=4 4707 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200000210301 [0,1,0,0,1,0|2,0,0]=4 4708 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200000210301 [0,1,0,0,1,0|2,0,0]=4 4709 B12R1.452 CNc1ccc(c(c1)F)C(=O)C 27a_100102657272_100000690205 [0,1,0,0,1,0|1,0,0]=3 4710 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 27a_100102657272_100000216903 [0,1,0,0,1,0|2,0,0]=4 4711 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 34a_100000749959_200000210301 [0,1,0,0,1,0|2,0,0]=4 4712 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 7a_100000749959_200000210301 [0,1,0,0,1,0|2,0,0]=4 4713 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 34a_100000223280_200000210301 [0,1,0,0,1,0|2,0,0]=4 4714 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 7a_100000223280_200000210301 [0,1,0,0,1,0|2,0,0]=4 4715 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [0,1,0,0,1,0|0,0,0]=2 4716 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [0,1,0,0,1,0|0,0,0]=2 4717 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [0,1,0,0,1,0|0,0,0]=2 4718 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [0,1,0,0,1,0|0,0,0]=2 4719 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200000210301 [0,1,0,0,1,0|2,0,0]=4 4720 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200000210301 [0,1,0,0,1,0|2,0,0]=4 4721 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [0,1,0,0,1,0|0,0,0]=2 4722 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [0,1,0,0,1,0|0,0,0]=2 4723 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [0,1,0,0,1,0|0,0,0]=2 4724 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [0,1,0,0,1,0|0,0,0]=2 4725 B12R1.452 COc1ccc(c(c1)C)C(C)C 34a_100000210824_200000210301 [0,1,0,0,1,0|1,0,1]=4 4726 B12R1.452 COc1ccc(c(c1)C)C(C)C 7a_100000210824_200000210301 [0,1,0,0,1,0|1,0,1]=4 4727 B12R1.452 COc1ccc(c(c1)C)N(C)C 2230a_103496583619_200000210301 [0,1,0,0,1,0|2,0,0]=4 4728 B12R1.452 COc1ccc(c(c1)C)N(C)C 269982a_103496583619_200000210301 [0,1,0,0,1,0|2,0,0]=4 4729 B12R1.452 COc1ccc(c(c1)C)N(C)C 34a_103496583619_200000210301 [0,1,0,0,1,0|2,0,0]=4 4730 B12R1.452 COc1ccc(c(c1)C)N(C)C 38a_103496583619_200000210301 [0,1,0,0,1,0|2,0,0]=4 4731 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 2230a_103496583619_200025704644 [0,1,0,0,1,0|2,0,0]=4 4732 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 269982a_103496583619_200025704644 [0,1,0,0,1,0|2,0,0]=4 4733 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 34a_103496583619_200025704644 [0,1,0,0,1,0|2,0,0]=4 4734 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 38a_103496583619_200025704644 [0,1,0,0,1,0|2,0,0]=4 4735 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000195451_200000210301 [0,1,0,0,1,0|2,0,0]=4 4736 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000195451_200000210301 [0,1,0,0,1,0|2,0,0]=4 4737 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [0,1,0,0,1,0|0,0,0]=2 4738 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [0,1,0,0,1,0|0,0,0]=2 4739 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [0,1,0,0,1,0|0,0,0]=2 4740 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200000210301 [0,1,0,0,1,0|1,0,0]=3 4741 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200000210301 [0,1,0,0,1,0|1,0,0]=3 4742 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [0,1,0,0,1,0|0,0,0]=2 4743 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200000210301 [0,1,0,0,1,0|2,0,0]=4 4744 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200000210301 [0,1,0,0,1,0|2,0,0]=4 4745 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [0,1,0,0,1,0|0,0,0]=2 4746 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [0,1,0,0,1,0|0,0,0]=2 4747 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [0,1,0,0,1,0|0,0,0]=2 4748 B12R1.452 COc1ccc(c(c1)F)C(=O)N 34a_200012186767_200000210301 [0,1,0,0,1,0|1,0,0]=3 4749 B12R1.452 COc1ccc(c(c1)F)C(=O)N 7a_200012186767_200000210301 [0,1,0,0,1,0|1,0,0]=3 4750 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [0,1,0,0,1,0|0,0,0]=2 4751 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200000210301 [0,1,0,0,1,0|2,0,0]=4 4752 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [0,1,0,0,1,0|0,0,0]=2 4753 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [0,1,0,0,1,0|0,0,0]=2 4754 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200000210301 [0,1,0,0,1,0|2,0,0]=4 4755 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [0,1,0,0,1,0|1,0,0]=3 4756 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [0,1,0,0,1,0|1,0,0]=3 4757 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200000210301 [0,1,0,0,1,0|2,0,0]=4 4758 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [0,1,0,0,1,0|0,0,0]=2 4759 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [0,1,0,0,1,0|0,0,0]=2 4760 B12R1.452 COc1ccc(c(c1)O)C(=O)N 271570a_203496583355_200009815664 [0,1,0,0,1,0|1,0,0]=3 4761 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [0,1,0,0,1,0|0,0,0]=2 4762 B12R1.452 COc1ccc(c(c1)O)C(C)O 271570a_203496583355_100000697252 [0,1,0,0,1,0|0,0,2]=4 4763 B12R1.452 CSc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200000210301 [0,1,0,0,1,0|1,1,0]=4 4764 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 1458a_100012278374_200000210301 [0,1,0,0,1,0|0,1,0]=3 4765 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_100012360112_200000210301 [0,1,0,0,1,0|0,1,0]=3 4766 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_200000210301_100012360112 [0,1,0,0,1,0|0,1,0]=3 4767 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_100011327924_200000210301 [0,1,0,0,1,0|1,1,0]=4 4768 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_200000210301_100011327924 [0,1,0,0,1,0|1,1,0]=4 4769 B12R1.452 CSc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100012278374_200025704644 [0,1,0,0,1,0|0,1,0]=3 4770 B12R1.452 CSc1ccc(c(c1)F)C(=O)C 62a_100000690205_200000210301 [0,1,0,0,1,0|0,1,0]=3 4771 B12R1.452 CSc1ccc(c(c1)F)C(=O)N 62a_100000216903_200000210301 [0,1,0,0,1,0|1,1,0]=4 4772 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_200000210301 [0,1,0,0,1,0|0,1,0]=3 4773 B12R1.452 CSc1ccc(c(c1)N)C(=O)N 62a_100012349972_200000210301 [0,1,0,0,1,0|1,1,0]=4 4774 B12R1.452 CSc1ccc(c(c1)O)C(=O)N 62a_100011550861_200000210301 [0,1,0,0,1,0|1,1,0]=4 4775 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_100000696590_200000210301 [0,1,0,0,1,0|1,1,0]=4 4776 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_200000210301_100000696590 [0,1,0,0,1,0|1,1,0]=4 4777 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 34a_200000751758_200025704644 [0,1,0,0,1,0|2,0,0]=4 4778 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 7a_200000751758_200025704644 [0,1,0,0,1,0|2,0,0]=4 4779 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_100011327924_200025704644 [0,1,0,0,1,0|1,1,0]=4 4780 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_200025704644_100011327924 [0,1,0,0,1,0|1,1,0]=4 4781 B12R1.452 Cc1cc(ccc1C(=O)[13CH3])C#N 1458a_100000691869_200025704644 [0,1,0,0,1,0|2,0,0]=4 4782 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 34a_100000210824_200025704644 [0,1,0,0,1,0|1,0,1]=4 4783 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 7a_100000210824_200025704644 [0,1,0,0,1,0|1,0,1]=4 4784 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 34a_100000195451_200025704644 [0,1,0,0,1,0|2,0,0]=4 4785 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 7a_100000195451_200025704644 [0,1,0,0,1,0|2,0,0]=4 4786 B12R1.452 [13CH3]C(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200025704644 [0,1,0,0,1,0|2,0,0]=4 4787 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200025704644 [0,1,0,0,1,0|2,0,0]=4 4788 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200025704644 [0,1,0,0,1,0|2,0,0]=4 4789 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)C#N 1458a_100000238375_200025704644 [0,1,0,0,1,0|2,0,0]=4 4790 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)CO 1458a_100011934814_200025704644 [0,1,0,0,1,0|2,0,0]=4 4791 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200025704644 [0,1,0,0,1,0|2,0,0]=4 4792 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200025704644 [0,1,0,0,1,0|2,0,0]=4 4793 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 34a_100000749959_200025704644 [0,1,0,0,1,0|2,0,0]=4 4794 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 7a_100000749959_200025704644 [0,1,0,0,1,0|2,0,0]=4 4795 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 34a_100000223280_200025704644 [0,1,0,0,1,0|2,0,0]=4 4796 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 7a_100000223280_200025704644 [0,1,0,0,1,0|2,0,0]=4 4797 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200025704644 [0,1,0,0,1,0|2,0,0]=4 4798 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200025704644 [0,1,0,0,1,0|2,0,0]=4 4799 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200025704644 [0,1,0,0,1,0|1,0,0]=3 4800 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200025704644 [0,1,0,0,1,0|1,0,0]=3 4801 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200025704644 [0,1,0,0,1,0|2,0,0]=4 4802 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200025704644 [0,1,0,0,1,0|2,0,0]=4 4803 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 34a_200012186767_200025704644 [0,1,0,0,1,0|1,0,0]=3 4804 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 7a_200012186767_200025704644 [0,1,0,0,1,0|1,0,0]=3 4805 B12R1.452 [13CH3]Oc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200025704644 [0,1,0,0,1,0|2,0,0]=4 4806 B12R1.452 [13CH3]Oc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200025704644 [0,1,0,0,1,0|2,0,0]=4 4807 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [0,1,0,0,1,0|1,0,0]=3 4808 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [0,1,0,0,1,0|1,0,0]=3 4809 B12R1.452 [13CH3]Oc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200025704644 [0,1,0,0,1,0|2,0,0]=4 4810 B12R1.452 [13CH3]Sc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200025704644 [0,1,0,0,1,0|1,1,0]=4 4811 B12R1.452 [13CH3]Sc1ccc(c(c1)F)C(=O)N 62a_100000216903_200025704644 [0,1,0,0,1,0|1,1,0]=4 4812 B12R1.452 [13CH3]Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_200025704644 [0,1,0,0,1,0|1,1,0]=4 4813 B12R1.452 [13CH3]Sc1ccc(c(c1)O)C(=O)N 62a_100011550861_200025704644 [0,1,0,0,1,0|1,1,0]=4 4814 B12R1.61 COC(=O)Cc1ccc(s1)SC 62a_100012028946_200000210301 [0,1,0,0,1,0|1,1,0]=4 4815 B12R1.61 COC(=O)Cc1ccc(s1)SC 62a_200000210301_100012028946 [0,1,0,0,1,0|1,1,0]=4 4816 B12R1.61 COC(=O)Cc1ccc(s1)S[13CH3] 62a_100012028946_200025704644 [0,1,0,0,1,0|1,1,0]=4 4817 B12R1.61 COC(=O)Cc1ccc(s1)S[13CH3] 62a_200025704644_100012028946 [0,1,0,0,1,0|1,1,0]=4 4818 B12R1.389 CC(=O)Cc1csc(c1)C(=O)C 1458a_100000070787_200000067479 [0,1,0,0,1,0|2,0,0]=4 4819 B14R1.2 C=C(C)CC(=O)c1ccc(cc1)CC 1458a_100000211226_100000748629 [0,1,0,0,0,1|2,0,0]=4 4820 B14R1.2 C=C(C)CC(=O)c1ccc(cc1)OC 1458a_100000184203_100000748629 [0,1,0,0,0,1|1,0,0]=3 4821 B14R1.2 C=C(C)CC(=O)c1ccc(cc1)SC 1458a_100000189692_100000748629 [0,1,0,0,0,1|1,1,0]=4 4822 B14R1.2 C=C(C)CN(C)c1ccc(cc1)OC 2230a_100000220023_100000748629 [0,1,0,0,0,1|1,0,0]=3 4823 B14R1.2 C=C(C)CN(C)c1ccc(cc1)OC 269982a_100000220023_100000748629 [0,1,0,0,0,1|1,0,0]=3 4824 B14R1.2 C=C(C)CN(C)c1ccc(cc1)OC 34a_100000220023_100000748629 [0,1,0,0,0,1|1,0,0]=3 4825 B14R1.2 C=C(F)CC(=O)c1ccc(cc1)OC 1458a_100000184203_100009893438 [0,1,0,0,0,1|1,0,1]=4 4826 B14R1.2 C=C(F)CN(C)c1ccc(cc1)OC 2230a_100000220023_100009893438 [0,1,0,0,0,1|1,0,1]=4 4827 B14R1.2 C=C(F)CN(C)c1ccc(cc1)OC 269982a_100000220023_100009893438 [0,1,0,0,0,1|1,0,1]=4 4828 B14R1.2 C=C(F)CN(C)c1ccc(cc1)OC 34a_100000220023_100009893438 [0,1,0,0,0,1|1,0,1]=4 4829 B14R1.2 C=Cc1ccc(cc1)C(=O)CC(=O)C 271570a_100011290941_100000184285 [0,1,0,0,0,1|1,0,1]=4 4830 B14R1.2 C=Cc1ccc(cc1)C(C)NC(=O)C 11a_200012023546_100015343762 [0,1,0,0,0,1|1,0,1]=4 4831 B14R1.2 C=Cc1ccc(cc1)C(C)NC(=O)C 1626a_200012023546_100015343762 [0,1,0,0,0,1|1,0,1]=4 4832 B14R1.2 C=Cc1ccc(cc1)C(C)NC(=O)C 240690a_200012023546_100015343762 [0,1,0,0,0,1|1,0,1]=4 4833 B14R1.2 C=Cc1ccc(cc1)C(C)NC(=O)C 271570a_100011290941_100000153805 [0,1,0,0,0,1|1,0,1]=4 4834 B14R1.2 C=Cc1ccc(cc1)C(C)NC(=O)C 527a_200012023546_100103153847 [0,1,0,0,0,1|1,0,1]=4 4835 B14R1.2 CC(=O)CC(=O)c1ccc(cc1)C#N 1458a_100000070787_100000212069 [0,1,0,0,0,1|2,0,0]=4 4836 B14R1.2 CC(=O)CC(=O)c1ccc(cc1)S[13CH3] 62a_100000184285_200025704644 [0,1,0,0,0,1|0,1,0]=3 4837 B14R1.2 CC(=O)NC(C)c1ccc(cc1)S[13CH3] 62a_100000153805_200025704644 [0,1,0,0,0,1|0,1,0]=3 4838 B14R1.2 CC(=O)NC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000153805 [0,1,0,0,0,1|0,1,0]=3 4839 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N 11a_100016991473_100015343762 [0,1,0,0,0,1|2,0,0]=4 4840 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N 1626a_100016991473_100015343762 [0,1,0,0,0,1|2,0,0]=4 4841 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N 240690a_100016991473_100015343762 [0,1,0,0,0,1|2,0,0]=4 4842 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N 527a_100016991473_100103153847 [0,1,0,0,0,1|2,0,0]=4 4843 B14R1.2 CCc1ccc(cc1)C(=O)CC(=O)C 1458a_100000070787_100000689809 [0,1,0,0,0,1|1,0,0]=3 4844 B14R1.2 CCc1ccc(cc1)C(=O)CC(=O)N 1458a_100000211226_100000187820 [0,1,0,0,0,1|2,0,0]=4 4845 B14R1.2 CCc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000211226_100020667443 [0,1,0,0,0,1|2,0,0]=4 4846 B14R1.2 CCc1ccc(cc1)C(C)NC(=O)C 11a_100015186439_100015343762 [0,1,0,0,0,1|1,0,0]=3 4847 B14R1.2 CCc1ccc(cc1)C(C)NC(=O)C 1626a_100015186439_100015343762 [0,1,0,0,0,1|1,0,0]=3 4848 B14R1.2 CCc1ccc(cc1)C(C)NC(=O)C 240690a_100015186439_100015343762 [0,1,0,0,0,1|1,0,0]=3 4849 B14R1.2 CCc1ccc(cc1)C(C)NC(=O)C 527a_100015186439_100103153847 [0,1,0,0,0,1|1,0,0]=3 4850 B14R1.2 COc1ccc(cc1)C(=O)CC(=O)C 1458a_100000070787_100000212054 [0,1,0,0,0,1|0,0,0]=2 4851 B14R1.2 COc1ccc(cc1)C(=O)CC(=O)N 1458a_100000184203_100000187820 [0,1,0,0,0,1|1,0,0]=3 4852 B14R1.2 COc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000184203_100020667443 [0,1,0,0,0,1|1,0,0]=3 4853 B14R1.2 COc1ccc(cc1)C(=O)CC(C)C 1458a_100000184203_100000210624 [0,1,0,0,0,1|1,0,1]=4 4854 B14R1.2 COc1ccc(cc1)C(=O)CC(C)O 1458a_100000184203_100011218427 [0,1,0,0,0,1|0,0,2]=4 4855 B14R1.2 COc1ccc(cc1)C(=O)CN(C)C 2230a_100102631434_100000212054 [0,1,0,0,0,1|2,0,0]=4 4856 B14R1.2 COc1ccc(cc1)C(=O)CN(C)C 269982a_100102631434_100000212054 [0,1,0,0,0,1|2,0,0]=4 4857 B14R1.2 COc1ccc(cc1)C(=O)C[N+](=O)[O-] 1458a_100000184203_100000761209 [0,1,0,0,0,1|2,0,0]=4 4858 B14R1.2 COc1ccc(cc1)C(C)OC(C)C 34a_100000742907_100000210206 [0,1,0,0,0,1|1,0,1]=4 4859 B14R1.2 COc1ccc(cc1)C(C)OC(C)C 7a_100000742907_100000210206 [0,1,0,0,0,1|1,0,1]=4 4860 B14R1.2 COc1ccc(cc1)C(O)CN(C)C 2230a_100011290904_200000210301 [0,1,0,0,0,1|2,0,0]=4 4861 B14R1.2 COc1ccc(cc1)C(O)CN(C)C 269982a_100011290904_200000210301 [0,1,0,0,0,1|2,0,0]=4 4862 B14R1.2 COc1ccc(cc1)C(O)CN(C)[13CH3] 2230a_100011290904_200025704644 [0,1,0,0,0,1|2,0,0]=4 4863 B14R1.2 COc1ccc(cc1)C(O)CN(C)[13CH3] 269982a_100011290904_200025704644 [0,1,0,0,0,1|2,0,0]=4 4864 B14R1.2 COc1ccc(cc1)N(C)CC(=O)N 2230a_100000220023_100000747473 [0,1,0,0,0,1|1,0,0]=3 4865 B14R1.2 COc1ccc(cc1)N(C)CC(=O)N 269982a_100000220023_100000187820 [0,1,0,0,0,1|1,0,0]=3 4866 B14R1.2 COc1ccc(cc1)N(C)CC(=O)N 34a_100000220023_100000187820 [0,1,0,0,0,1|1,0,0]=3 4867 B14R1.2 COc1ccc(cc1)N(C)CC(=O)O 269956a_200011202415_200000210301 [0,1,0,0,0,1|1,0,0]=3 4868 B14R1.2 COc1ccc(cc1)N(C)CC(=O)[O-] 269982a_100000220023_100020667443 [0,1,0,0,0,1|1,0,0]=3 4869 B14R1.2 COc1ccc(cc1)N(C)CC(=O)[O-] 34a_100000220023_100020667443 [0,1,0,0,0,1|1,0,0]=3 4870 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 2230a_100000220023_100000210760 [0,1,0,0,0,1|1,0,1]=4 4871 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 2230a_100015205907_200000210301 [0,1,0,0,0,1|1,0,1]=4 4872 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 269982a_100000220023_100000210624 [0,1,0,0,0,1|1,0,1]=4 4873 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 269982a_100015205907_200000210301 [0,1,0,0,0,1|1,0,1]=4 4874 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 34a_100000220023_100000210624 [0,1,0,0,0,1|1,0,1]=4 4875 B14R1.2 COc1ccc(cc1)N(C)CC(C)C 34a_100015205907_200000210301 [0,1,0,0,0,1|1,0,1]=4 4876 B14R1.2 COc1ccc(cc1)N(C)CC(C)O 2230a_100000220023_100011218427 [0,1,0,0,0,1|0,0,2]=4 4877 B14R1.2 COc1ccc(cc1)N(C)CC(C)O 269982a_100000220023_100011218427 [0,1,0,0,0,1|0,0,2]=4 4878 B14R1.2 COc1ccc(cc1)N(C)CC(C)O 34a_100000220023_100011218427 [0,1,0,0,0,1|0,0,2]=4 4879 B14R1.2 COc1ccc(cc1)N(C)C[C@@H](C)O 2230a_100000220023_100009817552 [0,1,0,0,0,1|0,0,2]=4 4880 B14R1.2 COc1ccc(cc1)N(C)C[C@@H](C)O 269982a_100000220023_100009817552 [0,1,0,0,0,1|0,0,2]=4 4881 B14R1.2 COc1ccc(cc1)N(C)C[C@@H](C)O 34a_100000220023_100009817552 [0,1,0,0,0,1|0,0,2]=4 4882 B14R1.2 COc1ccc(cc1)N(C)C[N+](=O)[O-] 269982a_100000220023_100000761209 [0,1,0,0,0,1|2,0,0]=4 4883 B14R1.2 COc1ccc(cc1)N(C)C[N+](=O)[O-] 34a_100000220023_100000761209 [0,1,0,0,0,1|2,0,0]=4 4884 B14R1.2 COc1ccc(cc1)N([13CH3])CC(=O)O 269956a_200011202415_200025704644 [0,1,0,0,0,1|1,0,0]=3 4885 B14R1.2 COc1ccc(cc1)N([13CH3])CC(C)C 2230a_100015205907_200025704644 [0,1,0,0,0,1|1,0,1]=4 4886 B14R1.2 COc1ccc(cc1)N([13CH3])CC(C)C 269982a_100015205907_200025704644 [0,1,0,0,0,1|1,0,1]=4 4887 B14R1.2 COc1ccc(cc1)N([13CH3])CC(C)C 34a_100015205907_200025704644 [0,1,0,0,0,1|1,0,1]=4 4888 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C 11a_100011830352_100015343762 [0,1,0,0,0,1|0,0,0]=2 4889 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C 1626a_100011830352_100015343762 [0,1,0,0,0,1|0,0,0]=2 4890 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C 240690a_100011830352_100015343762 [0,1,0,0,0,1|0,0,0]=2 4891 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(=O)C 527a_100011830352_100103153847 [0,1,0,0,0,1|0,0,0]=2 4892 B14R1.2 COc1ccc(cc1)[C@@H](C)NC(C)C 2230a_100011830352_100000210206 [0,1,0,0,0,1|1,0,1]=4 4893 B14R1.2 COc1ccc(cc1)[C@@H](N)CC(C)C 271570a_100015190218_100000171711 [0,1,0,0,0,1|1,0,1]=4 4894 B14R1.2 CSc1ccc(cc1)C(=O)CC(=O)C 62a_100000184285_200000210301 [0,1,0,0,0,1|0,1,0]=3 4895 B14R1.2 CSc1ccc(cc1)C(=O)CC(=O)N 1458a_100000189692_100000187820 [0,1,0,0,0,1|1,1,0]=4 4896 B14R1.2 CSc1ccc(cc1)C(=O)CC(=O)[O-] 1458a_100000189692_100020667443 [0,1,0,0,0,1|1,1,0]=4 4897 B14R1.2 CSc1ccc(cc1)C(C)NC(=O)C 11a_100000738722_100015343762 [0,1,0,0,0,1|0,1,0]=3 4898 B14R1.2 CSc1ccc(cc1)C(C)NC(=O)C 240690a_100000738722_100015343762 [0,1,0,0,0,1|0,1,0]=3 4899 B14R1.2 CSc1ccc(cc1)C(C)NC(=O)C 527a_100000738722_100103153847 [0,1,0,0,0,1|0,1,0]=3 4900 B14R1.2 CSc1ccc(cc1)C(C)NC(=O)C 62a_100000153805_200000210301 [0,1,0,0,0,1|0,1,0]=3 4901 B14R1.2 CSc1ccc(cc1)C(C)NC(=O)C 62a_200000210301_100000153805 [0,1,0,0,0,1|0,1,0]=3 4902 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)CC 1458a_100000185857_100000747183 [0,1,0,0,0,1|2,0,0]=4 4903 B14R1.3 C=C(C)C(=O)Cc1ccc(cc1)SC 1458a_100000185857_100000181263 [0,1,0,0,0,1|1,1,0]=4 4904 B14R1.3 C=C(C)C(=O)Cc1ccc(cn1)OC 1458a_100000185857_200000757186 [0,1,0,0,0,1|2,0,0]=4 4905 B14R1.3 C=C(C)C(=O)Cc1ccc(nc1)OC 1458a_100000185857_100020631284 [0,1,0,0,0,1|2,0,0]=4 4906 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 11a_100000184247_100000185857 [0,1,0,0,0,1|1,0,1]=4 4907 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000185857 [0,1,0,0,0,1|1,0,1]=4 4908 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 22a_100000184247_100000185857 [0,1,0,0,0,1|1,0,1]=4 4909 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)OC 34a_200000065598_200000210301 [0,1,0,0,0,1|1,0,1]=4 4910 B14R1.3 C=C(C)C(=O)Nc1ccc(cc1)O[13CH3] 34a_200000065598_200025704644 [0,1,0,0,0,1|1,0,1]=4 4911 B14R1.3 C=Cc1ccc(cc1)OC(C)C(=O)C 7a_100000189437_100000179758 [0,1,0,0,0,1|1,0,1]=4 4912 B14R1.3 C=Cc1ccc(cc1)SC(C)C(=O)C 62a_100000748128_100009814033 [0,1,0,0,0,1|1,0,1]=4 4913 B14R1.3 C=Cc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000748128 [0,1,0,0,0,1|1,0,1]=4 4914 B14R1.3 CC(=O)C(C)Cc1ccc(cc1)C#N 1458a_200000109623_200000210301 [0,1,0,0,0,1|2,0,0]=4 4915 B14R1.3 CC(=O)C(C)Nc1ccc(cc1)CO 2230a_100011215238_100009814033 [0,1,0,0,0,1|2,0,0]=4 4916 B14R1.3 CC(=O)C(C)Oc1ccc(cc1)C#N 1458a_100000191206_200000210301 [0,1,0,0,0,1|2,0,0]=4 4917 B14R1.3 CC(=O)C(C)Oc1ccc(cc1)C#N 7a_100000210344_100000179758 [0,1,0,0,0,1|2,0,0]=4 4918 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C#N 62a_100009814033_100000184291 [0,1,0,0,0,1|2,0,0]=4 4919 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C=O 62a_100000188517_100009814033 [0,1,0,0,0,1|2,0,0]=4 4920 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C=O 62a_100009814033_100000188517 [0,1,0,0,0,1|2,0,0]=4 4921 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CF 62a_100009814033_100010268989 [0,1,0,0,0,1|2,0,0]=4 4922 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CF 62a_100010268989_100009814033 [0,1,0,0,0,1|2,0,0]=4 4923 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CN 62a_100009814033_100016989417 [0,1,0,0,0,1|2,0,0]=4 4924 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CN 62a_100016989417_100009814033 [0,1,0,0,0,1|2,0,0]=4 4925 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CO 62a_100000690907_100009814033 [0,1,0,0,0,1|2,0,0]=4 4926 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CO 62a_100009814033_100000690907 [0,1,0,0,0,1|2,0,0]=4 4927 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)NN 62a_100009814033_100016988836 [0,1,0,0,0,1|2,0,0]=4 4928 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)NN 62a_100016988836_100009814033 [0,1,0,0,0,1|2,0,0]=4 4929 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 11a_100000217971_100015343762 [0,1,0,0,0,1|2,0,0]=4 4930 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 1626a_100000217971_100015343762 [0,1,0,0,0,1|2,0,0]=4 4931 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 240690a_100000217971_100015343762 [0,1,0,0,0,1|2,0,0]=4 4932 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 527a_100000217971_100103153847 [0,1,0,0,0,1|2,0,0]=4 4933 B14R1.3 CC(Cc1ccc(cc1)C#N)C(=O)[13CH3] 1458a_200000109623_200025704644 [0,1,0,0,0,1|2,0,0]=4 4934 B14R1.3 CC(Oc1ccc(cc1)C#N)C(=O)[13CH3] 1458a_100000191206_200025704644 [0,1,0,0,0,1|2,0,0]=4 4935 B14R1.3 CC(Oc1ccc(cc1)O[13CH3])C(=O)[O-] 34a_203549785325_200025704644 [0,1,0,0,0,1|1,0,0]=3 4936 B14R1.3 CC(Oc1ccc(cc1)S[13CH3])C(=O)N 62a_100000150412_200025704644 [0,1,0,0,0,1|1,1,0]=4 4937 B14R1.3 CC(Oc1ccc(cc1)S[13CH3])C(=O)N 62a_200025704644_100000150412 [0,1,0,0,0,1|1,1,0]=4 4938 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 11a_100000683253_100015343762 [0,1,0,0,0,1|1,0,0]=3 4939 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 1626a_100000683253_100015343762 [0,1,0,0,0,1|1,0,0]=3 4940 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 240690a_100000683253_100015343762 [0,1,0,0,0,1|1,0,0]=3 4941 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 527a_100000683253_100103153847 [0,1,0,0,0,1|1,0,0]=3 4942 B14R1.3 CCc1ccc(cc1)NC(C)C(=O)C 2230a_100000211069_100009814033 [0,1,0,0,0,1|1,0,0]=3 4943 B14R1.3 CCc1ccc(cc1)NC(C)C(=O)N 2230a_100000211069_100000702099 [0,1,0,0,0,1|2,0,0]=4 4944 B14R1.3 CCc1ccc(cc1)NC(C)C(=O)N 34a_100000211069_100000702099 [0,1,0,0,0,1|2,0,0]=4 4945 B14R1.3 CCc1ccc(cc1)NC(F)C(=O)N 2230a_100000211069_100009813875 [0,1,0,0,0,1|2,0,0]=4 4946 B14R1.3 CCc1ccc(cc1)NC(F)C(=O)N 34a_100000211069_100009813875 [0,1,0,0,0,1|2,0,0]=4 4947 B14R1.3 CCc1ccc(cc1)NC(F)C(=O)[O-] 34a_100000211069_100020610796 [0,1,0,0,0,1|2,0,0]=4 4948 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)C 1458a_200000216327_200000210301 [0,1,0,0,0,1|1,0,0]=3 4949 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)C 7a_100000211359_100000179758 [0,1,0,0,0,1|1,0,0]=3 4950 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)N 34a_100000211359_100000702099 [0,1,0,0,0,1|2,0,0]=4 4951 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)N 7a_100000211359_100000702099 [0,1,0,0,0,1|2,0,0]=4 4952 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_200000216327_200025704644 [0,1,0,0,0,1|1,0,0]=3 4953 B14R1.3 CCc1ccc(cc1)OC(F)C(=O)N 34a_100000211359_100009813875 [0,1,0,0,0,1|2,0,0]=4 4954 B14R1.3 CCc1ccc(cc1)OC(F)C(=O)N 7a_100000211359_100009813875 [0,1,0,0,0,1|2,0,0]=4 4955 B14R1.3 CCc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000211359_100020610796 [0,1,0,0,0,1|2,0,0]=4 4956 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100011215824 [0,1,0,0,0,1|1,0,0]=3 4957 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)C 62a_100011215824_100009814033 [0,1,0,0,0,1|1,0,0]=3 4958 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100011215824 [0,1,0,0,0,1|2,0,0]=4 4959 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)N 62a_100011215824_100000702099 [0,1,0,0,0,1|2,0,0]=4 4960 B14R1.3 CCc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100011215824 [0,1,0,0,0,1|2,0,0]=4 4961 B14R1.3 CCc1ccc(cc1)SC(F)C(=O)N 62a_100011215824_100009813875 [0,1,0,0,0,1|2,0,0]=4 4962 B14R1.3 CCc1ccc(cc1)SC(F)C(=O)[O-] 62a_100011215824_100020610796 [0,1,0,0,0,1|2,0,0]=4 4963 B14R1.3 CCc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100011215824 [0,1,0,0,0,1|2,0,0]=4 4964 B14R1.3 CCc1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100009820025 [0,1,0,0,0,1|2,0,0]=4 4965 B14R1.3 CCc1ccc(cn1)SC(C)C(=O)C 62a_100009820025_100009814033 [0,1,0,0,0,1|2,0,0]=4 4966 B14R1.3 CCc1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100009843584 [0,1,0,0,0,1|2,0,0]=4 4967 B14R1.3 CCc1ccc(nc1)SC(C)C(=O)C 62a_100009843584_100009814033 [0,1,0,0,0,1|2,0,0]=4 4968 B14R1.3 CNc1ccc(cc1)OC(C)C(=O)N 34a_100000182112_100000702099 [0,1,0,0,0,1|2,0,0]=4 4969 B14R1.3 CNc1ccc(cc1)OC(F)C(=O)N 34a_100000182112_100009813875 [0,1,0,0,0,1|2,0,0]=4 4970 B14R1.3 CNc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000182112_100020610796 [0,1,0,0,0,1|2,0,0]=4 4971 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)C 62a_100000743151_100009814033 [0,1,0,0,0,1|1,0,0]=3 4972 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000743151 [0,1,0,0,0,1|1,0,0]=3 4973 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000743151 [0,1,0,0,0,1|2,0,0]=4 4974 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)N 62a_100000743151_100000702099 [0,1,0,0,0,1|2,0,0]=4 4975 B14R1.3 CNc1ccc(cc1)SC(F)C(=O)N 62a_100000743151_100009813875 [0,1,0,0,0,1|2,0,0]=4 4976 B14R1.3 CNc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000743151 [0,1,0,0,0,1|2,0,0]=4 4977 B14R1.3 CNc1ccc(cc1)SC(F)C(=O)[O-] 62a_100000743151_100020610796 [0,1,0,0,0,1|2,0,0]=4 4978 B14R1.3 CNc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000743151 [0,1,0,0,0,1|2,0,0]=4 4979 B14R1.3 CNc1ccc(cn1)SC(C)C(=O)C 62a_100000741341_100009814033 [0,1,0,0,0,1|2,0,0]=4 4980 B14R1.3 CNc1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100000741341 [0,1,0,0,0,1|2,0,0]=4 4981 B14R1.3 CNc1ccc(nc1)SC(C)C(=O)C 62a_100000764248_100009814033 [0,1,0,0,0,1|2,0,0]=4 4982 B14R1.3 CNc1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100000764248 [0,1,0,0,0,1|2,0,0]=4 4983 B14R1.3 COc1ccc(cc1)CC(=O)C(C)C 1458a_100000210706_100000210206 [0,1,0,0,0,1|1,0,1]=4 4984 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 11a_100102631434_100000210706 [0,1,0,0,0,1|2,0,0]=4 4985 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 240690a_100102631434_100000210706 [0,1,0,0,0,1|2,0,0]=4 4986 B14R1.3 COc1ccc(cc1)CC(=O)N(C)C 527a_100102631434_100000210706 [0,1,0,0,0,1|2,0,0]=4 4987 B14R1.3 COc1ccc(cc1)CC(C)N(C)C 270004a_100102631434_100000211147 [0,1,0,0,0,1|2,0,0]=4 4988 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 11a_100000184145_100015343762 [0,1,0,0,0,1|0,0,0]=2 4989 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 1626a_100000184145_100015343762 [0,1,0,0,0,1|0,0,0]=2 4990 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 240690a_100000184145_100015343762 [0,1,0,0,0,1|0,0,0]=2 4991 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 527a_100000184145_100103153847 [0,1,0,0,0,1|0,0,0]=2 4992 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 2230a_100000184145_100000210206 [0,1,0,0,0,1|1,0,1]=4 4993 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 2230a_100000195754_200000210301 [0,1,0,0,0,1|1,0,1]=4 4994 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 269982a_100000184145_100000210206 [0,1,0,0,0,1|1,0,1]=4 4995 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 269982a_100000195754_200000210301 [0,1,0,0,0,1|1,0,1]=4 4996 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 269982a_200000211004_100000742318 [0,1,0,0,0,1|1,0,1]=4 4997 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 270004a_200000211004_100000169835 [0,1,0,0,0,1|1,0,1]=4 4998 B14R1.3 COc1ccc(cc1)CN(C)C(C)C 34a_100000195754_200000210301 [0,1,0,0,0,1|1,0,1]=4 4999 B14R1.3 COc1ccc(cc1)CN([13CH3])C(C)C 2230a_100000195754_200025704644 [0,1,0,0,0,1|1,0,1]=4 5000 B14R1.3 COc1ccc(cc1)CN([13CH3])C(C)C 269982a_100000195754_200025704644 [0,1,0,0,0,1|1,0,1]=4 5001 B14R1.3 COc1ccc(cc1)CN([13CH3])C(C)C 34a_100000195754_200025704644 [0,1,0,0,0,1|1,0,1]=4 5002 B14R1.3 COc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200000210301 [0,1,0,0,0,1|1,0,0]=3 5003 B14R1.3 COc1ccc(cc1)NC(=O)C(=O)N 22a_100000184247_100011215815 [0,1,0,0,0,1|1,0,1]=4 5004 B14R1.3 COc1ccc(cc1)NC(C)C(=O)N 34a_100000184247_100000702099 [0,1,0,0,0,1|1,0,0]=3 5005 B14R1.3 COc1ccc(cc1)NC(F)C(=O)N 34a_100000184247_100009813875 [0,1,0,0,0,1|1,0,0]=3 5006 B14R1.3 COc1ccc(cc1)NC(F)C(=O)[O-] 34a_100000184247_100020610796 [0,1,0,0,0,1|1,0,0]=3 5007 B14R1.3 COc1ccc(cc1)OC(C)C(=O)C 1458a_100000188420_200000210301 [0,1,0,0,0,1|0,0,0]=2 5008 B14R1.3 COc1ccc(cc1)OC(C)C(=O)N 34a_100000210503_100000702099 [0,1,0,0,0,1|1,0,0]=3 5009 B14R1.3 COc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000188420_200025704644 [0,1,0,0,0,1|0,0,0]=2 5010 B14R1.3 COc1ccc(cc1)OC(C)C(=O)[O-] 34a_203549785325_200000210301 [0,1,0,0,0,1|1,0,0]=3 5011 B14R1.3 COc1ccc(cc1)OC(F)C(=O)N 34a_100000210503_100009813875 [0,1,0,0,0,1|1,0,0]=3 5012 B14R1.3 COc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000210503_100020610796 [0,1,0,0,0,1|1,0,0]=3 5013 B14R1.3 COc1ccc(cc1)SC(C)C(=O)C 1458a_100000230843_200000210301 [0,1,0,0,0,1|0,0,0]=2 5014 B14R1.3 COc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000171711 [0,1,0,0,0,1|0,0,0]=2 5015 B14R1.3 COc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000171711 [0,1,0,0,0,1|1,0,0]=3 5016 B14R1.3 COc1ccc(cc1)SC(C)C(=O)[13CH3] 1458a_100000230843_200025704644 [0,1,0,0,0,1|0,0,0]=2 5017 B14R1.3 COc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100000171711 [0,1,0,0,0,1|1,0,0]=3 5018 B14R1.3 COc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100000171711 [0,1,0,0,0,1|1,0,0]=3 5019 B14R1.3 COc1ccc(cn1)OC(C)C(=O)N 34a_100011934560_100000702099 [0,1,0,0,0,1|2,0,0]=4 5020 B14R1.3 COc1ccc(cn1)OC(F)C(=O)N 34a_100011934560_100009813875 [0,1,0,0,0,1|2,0,0]=4 5021 B14R1.3 COc1ccc(cn1)OC(F)C(=O)[O-] 34a_100011934560_100020610796 [0,1,0,0,0,1|2,0,0]=4 5022 B14R1.3 COc1ccc(cn1)SC(C)C(=O)C 62a_100000047065_100009814033 [0,1,0,0,0,1|1,0,0]=3 5023 B14R1.3 COc1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100000047065 [0,1,0,0,0,1|1,0,0]=3 5024 B14R1.3 COc1ccc(cn1)SC(C)C(=O)N 62a_100000047065_100000702099 [0,1,0,0,0,1|2,0,0]=4 5025 B14R1.3 COc1ccc(cn1)SC(C)C(=O)N 62a_100000702099_100000047065 [0,1,0,0,0,1|2,0,0]=4 5026 B14R1.3 COc1ccc(cn1)SC(F)C(=O)N 62a_100000047065_100009813875 [0,1,0,0,0,1|2,0,0]=4 5027 B14R1.3 COc1ccc(cn1)SC(F)C(=O)N 62a_100009813875_100000047065 [0,1,0,0,0,1|2,0,0]=4 5028 B14R1.3 COc1ccc(cn1)SC(F)C(=O)[O-] 62a_100000047065_100020610796 [0,1,0,0,0,1|2,0,0]=4 5029 B14R1.3 COc1ccc(cn1)SC(F)C(=O)[O-] 62a_100020610796_100000047065 [0,1,0,0,0,1|2,0,0]=4 5030 B14R1.3 COc1ccc(nc1)OC(C)C(=O)N 34a_100012002028_100000702099 [0,1,0,0,0,1|2,0,0]=4 5031 B14R1.3 COc1ccc(nc1)OC(F)C(=O)N 34a_100012002028_100009813875 [0,1,0,0,0,1|2,0,0]=4 5032 B14R1.3 COc1ccc(nc1)OC(F)C(=O)[O-] 34a_100012002028_100020610796 [0,1,0,0,0,1|2,0,0]=4 5033 B14R1.3 COc1ccc(nc1)SC(C)C(=O)C 62a_100000755202_100009814033 [0,1,0,0,0,1|1,0,0]=3 5034 B14R1.3 COc1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100000744180 [0,1,0,0,0,1|1,0,0]=3 5035 B14R1.3 COc1ccc(nc1)SC(C)C(=O)N 62a_100000702099_100000744180 [0,1,0,0,0,1|2,0,0]=4 5036 B14R1.3 COc1ccc(nc1)SC(C)C(=O)N 62a_100000755202_100000702099 [0,1,0,0,0,1|2,0,0]=4 5037 B14R1.3 COc1ccc(nc1)SC(F)C(=O)N 62a_100000755202_100009813875 [0,1,0,0,0,1|2,0,0]=4 5038 B14R1.3 COc1ccc(nc1)SC(F)C(=O)N 62a_100009813875_100000744180 [0,1,0,0,0,1|2,0,0]=4 5039 B14R1.3 COc1ccc(nc1)SC(F)C(=O)[O-] 62a_100000755202_100020610796 [0,1,0,0,0,1|2,0,0]=4 5040 B14R1.3 COc1ccc(nc1)SC(F)C(=O)[O-] 62a_100020610796_100000744180 [0,1,0,0,0,1|2,0,0]=4 5041 B14R1.3 COc1ccc(nn1)SC(C)C(=O)C 62a_100009814033_100009819040 [0,1,0,0,0,1|2,0,0]=4 5042 B14R1.3 COc1ccc(nn1)SC(C)C(=O)C 62a_100009819040_100009814033 [0,1,0,0,0,1|2,0,0]=4 5043 B14R1.3 COc1cnc(cn1)SC(C)C(=O)C 62a_100009814033_100011998698 [0,1,0,0,0,1|2,0,0]=4 5044 B14R1.3 COc1cnc(cn1)SC(C)C(=O)C 62a_100011998698_100009814033 [0,1,0,0,0,1|2,0,0]=4 5045 B14R1.3 COc1cnc(nc1)SC(C)C(=O)C 62a_100000069167_100009814033 [0,1,0,0,0,1|2,0,0]=4 5046 B14R1.3 COc1cnc(nc1)SC(C)C(=O)C 62a_100009814033_100000069167 [0,1,0,0,0,1|2,0,0]=4 5047 B14R1.3 COc1ncc(cn1)OC(C)C(=O)C 7a_100000099601_100000179758 [0,1,0,0,0,1|2,0,0]=4 5048 B14R1.3 COc1ncc(cn1)SC(C)C(=O)C 62a_100000686852_100009814033 [0,1,0,0,0,1|2,0,0]=4 5049 B14R1.3 COc1ncc(cn1)SC(C)C(=O)C 62a_100009814033_100000686852 [0,1,0,0,0,1|2,0,0]=4 5050 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 11a_102495365258_100015343762 [0,1,0,0,0,1|0,1,0]=3 5051 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 1626a_102495365258_100015343762 [0,1,0,0,0,1|0,1,0]=3 5052 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 240690a_102495365258_100015343762 [0,1,0,0,0,1|0,1,0]=3 5053 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 527a_102495365258_100103153847 [0,1,0,0,0,1|0,1,0]=3 5054 B14R1.3 CSc1ccc(cc1)NC(C)C(=O)N 34a_100000212337_100000702099 [0,1,0,0,0,1|1,1,0]=4 5055 B14R1.3 CSc1ccc(cc1)NC(F)C(=O)N 34a_100000212337_100009813875 [0,1,0,0,0,1|1,1,0]=4 5056 B14R1.3 CSc1ccc(cc1)NC(F)C(=O)[O-] 34a_100000212337_100020610796 [0,1,0,0,0,1|1,1,0]=4 5057 B14R1.3 CSc1ccc(cc1)OC(C)C(=O)N 34a_100000211864_100000702099 [0,1,0,0,0,1|1,1,0]=4 5058 B14R1.3 CSc1ccc(cc1)OC(C)C(=O)N 62a_100000150412_200000210301 [0,1,0,0,0,1|1,1,0]=4 5059 B14R1.3 CSc1ccc(cc1)OC(C)C(=O)N 62a_200000210301_100000150412 [0,1,0,0,0,1|1,1,0]=4 5060 B14R1.3 CSc1ccc(cc1)OC(F)C(=O)N 34a_100000211864_100009813875 [0,1,0,0,0,1|1,1,0]=4 5061 B14R1.3 CSc1ccc(cc1)OC(F)C(=O)[O-] 34a_100000211864_100020610796 [0,1,0,0,0,1|1,1,0]=4 5062 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100011263217 [0,1,0,0,0,1|0,1,0]=3 5063 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)C 62a_100011263217_100009814033 [0,1,0,0,0,1|0,1,0]=3 5064 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100011263217 [0,1,0,0,0,1|1,1,0]=4 5065 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)N 62a_100011263217_100000702099 [0,1,0,0,0,1|1,1,0]=4 5066 B14R1.3 CSc1ccc(cc1)SC(F)C(=O)N 62a_100009813875_100011263217 [0,1,0,0,0,1|1,1,0]=4 5067 B14R1.3 CSc1ccc(cc1)SC(F)C(=O)N 62a_100011263217_100009813875 [0,1,0,0,0,1|1,1,0]=4 5068 B14R1.3 CSc1ccc(cc1)SC(F)C(=O)[O-] 62a_100011263217_100020610796 [0,1,0,0,0,1|1,1,0]=4 5069 B14R1.3 CSc1ccc(cc1)SC(F)C(=O)[O-] 62a_100020610796_100011263217 [0,1,0,0,0,1|1,1,0]=4 5070 B14R1.3 CSc1ccc(cn1)SC(C)C(=O)C 62a_100009814033_100011408404 [0,1,0,0,0,1|1,1,0]=4 5071 B14R1.3 CSc1ccc(cn1)SC(C)C(=O)C 62a_100011408404_100009814033 [0,1,0,0,0,1|1,1,0]=4 5072 B14R1.3 CSc1ccc(nc1)SC(C)C(=O)C 62a_100009814033_100009820866 [0,1,0,0,0,1|1,1,0]=4 5073 B14R1.3 CSc1ccc(nc1)SC(C)C(=O)C 62a_100009820866_100009814033 [0,1,0,0,0,1|1,1,0]=4 5074 B14R1.3 [13CH3]Oc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_200025704644 [0,1,0,0,0,1|1,0,0]=3 5075 B14R1.5 C#CC(=NNc1ccc(cc1)OC)C 4a_100000005221_100000690481 [0,1,0,0,0,1|2,0,0]=4 5076 B14R1.5 C#CC(=O)CCc1ccc(cc1)OC 1458a_100000211873_100000184700 [0,1,0,0,0,1|0,0,1]=3 5077 B14R1.5 C#CC(C)NCc1ccc(cc1)OC 2230a_100000707721_100000742318 [0,1,0,0,0,1|1,0,1]=4 5078 B14R1.5 C#CC(C)NCc1ccc(cc1)OC 270004a_100000707721_100000169835 [0,1,0,0,0,1|1,0,1]=4 5079 B14R1.5 C#CC(C)NCc1ccc(cc1)OC 34a_100000185587_200000035995 [0,1,0,0,0,1|1,0,1]=4 5080 B14R1.5 C#CC(C)NCc1ccc(cc1)OC 34a_100000707721_100000742318 [0,1,0,0,0,1|1,0,1]=4 5081 B14R1.5 C#CC(C)OCc1ccc(cc1)OC 34a_100000173359_200000035995 [0,1,0,0,0,1|1,0,1]=4 5082 B14R1.5 C#CC(C)SCc1ccc(cc1)OC 62a_200000035995_100000742318 [0,1,0,0,0,1|1,0,1]=4 5083 B14R1.5 C#C[C@@H](C)OCc1ccc(cc1)OC 34a_100009815206_100000742318 [0,1,0,0,0,1|1,0,1]=4 5084 B14R1.5 C#C[C@@H](C)OCc1ccc(cc1)OC 7a_100009815206_100000742318 [0,1,0,0,0,1|1,0,1]=4 5085 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CC 11a_100015199678_100000210414 [0,1,0,0,0,1|1,0,1]=4 5086 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CC 1626a_100015199678_100000210414 [0,1,0,0,0,1|1,0,1]=4 5087 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CC 240690a_100015199678_100000210414 [0,1,0,0,0,1|1,0,1]=4 5088 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CC 527a_100015199678_100000210414 [0,1,0,0,0,1|1,0,1]=4 5089 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CO 240690a_100015199678_100000210174 [0,1,0,0,0,1|1,0,1]=4 5090 B14R1.5 C#Cc1ccc(cc1)CNC(=O)CO 527a_100015199678_100000210174 [0,1,0,0,0,1|1,0,1]=4 5091 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 2708a_100015199678_106832991635 [0,1,0,0,0,1|1,0,1]=4 5092 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 2708a_100102657272_100015199678 [0,1,0,0,0,1|1,0,1]=4 5093 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 273464a_100015199678_100102657272 [0,1,0,0,0,1|1,0,1]=4 5094 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 273464a_100102657272_100015199678 [0,1,0,0,0,1|1,0,1]=4 5095 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 512a_100015199678_100102657272 [0,1,0,0,0,1|1,0,1]=4 5096 B14R1.5 C#Cc1ccc(cc1)CNC(=O)NC 512a_106832991638_100015199678 [0,1,0,0,0,1|1,0,1]=4 5097 B14R1.5 C#Cc1ccc(cc1)NCC(=O)NC 34a_100011215031_100000183359 [0,1,0,0,0,1|1,0,1]=4 5098 B14R1.5 C#Cc1ccc(cc1)NCC(=O)OC 34a_100011215031_100000747449 [0,1,0,0,0,1|1,0,1]=4 5099 B14R1.5 C=C(C#N)CNc1ccc(cc1)OC 34a_100000184247_100000694840 [0,1,0,0,0,1|1,0,1]=4 5100 B14R1.5 C=C(C#N)COc1ccc(cc1)OC 34a_100000210503_100000694840 [0,1,0,0,0,1|1,0,1]=4 5101 B14R1.5 C=CC(=NNc1ccc(cc1)OC)C 4a_100000005221_200015361842 [0,1,0,0,0,1|2,0,0]=4 5102 B14R1.5 C=CC(=O)CCc1ccc(cc1)OC 1458a_100000185746_100000184700 [0,1,0,0,0,1|0,0,1]=3 5103 B14R1.5 C=CC(=O)NCc1ccc(cc1)CC 1626a_100000721222_100000185746 [0,1,0,0,0,1|1,0,1]=4 5104 B14R1.5 C=CC(=O)NCc1ccc(cc1)CC 240690a_100000721222_200121576911 [0,1,0,0,0,1|1,0,1]=4 5105 B14R1.5 C=CC(=O)NCc1ccc(cc1)OC 1626a_100000185587_100000185746 [0,1,0,0,0,1|0,0,1]=3 5106 B14R1.5 C=CC(=O)NCc1ccc(cc1)OC 240690a_100000185587_200121576911 [0,1,0,0,0,1|0,0,1]=3 5107 B14R1.5 C=CC(=O)NCc1ccc(cc1)SC 240690a_100000174980_200121576911 [0,1,0,0,0,1|0,1,1]=4 5108 B14R1.5 C=CC(=O)NCc1ccc(cn1)OC 1626a_100000703904_100000185746 [0,1,0,0,0,1|1,0,1]=4 5109 B14R1.5 C=CC(=O)NCc1ccc(cn1)OC 240690a_100000703904_200121576911 [0,1,0,0,0,1|1,0,1]=4 5110 B14R1.5 C=CC(=O)NCc1ccc(nc1)OC 1626a_100000241975_100000185746 [0,1,0,0,0,1|1,0,1]=4 5111 B14R1.5 C=CC(=O)NCc1ccc(nc1)OC 240690a_100000241975_200121576911 [0,1,0,0,0,1|1,0,1]=4 5112 B14R1.5 C=CC(=O)NNc1ccc(cc1)OC 22a_100000005221_100000185746 [0,1,0,0,0,1|1,0,1]=4 5113 B14R1.5 C=CC(C)OCc1ccc(cc1)OC 34a_100000695699_100000742318 [0,1,0,0,0,1|1,0,1]=4 5114 B14R1.5 C=CC(C)SCc1ccc(cc1)OC 62a_100011215867_100000742318 [0,1,0,0,0,1|1,0,1]=4 5115 B14R1.5 C=Cc1ccc(cc1)CCC(=O)CC 1458a_100000210414_100000142037 [0,1,0,0,0,1|1,0,1]=4 5116 B14R1.5 C=Cc1ccc(cc1)CCC(=O)CO 1458a_100000210174_100000142037 [0,1,0,0,0,1|1,0,1]=4 5117 B14R1.5 C=Cc1ccc(cc1)CCC(=O)NC 271570a_100011290941_200010273138 [0,1,0,0,0,1|1,0,1]=4 5118 B14R1.5 C=Cc1ccc(cc1)CCC(=O)OC 271570a_100011290941_100012357364 [0,1,0,0,0,1|1,0,1]=4 5119 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CC 11a_200011934891_100000210414 [0,1,0,0,0,1|1,0,1]=4 5120 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CC 1626a_200011934891_100000210414 [0,1,0,0,0,1|1,0,1]=4 5121 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CC 240690a_200011934891_100000210414 [0,1,0,0,0,1|1,0,1]=4 5122 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CC 527a_200011934891_100000210414 [0,1,0,0,0,1|1,0,1]=4 5123 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CO 240690a_200011934891_100000210174 [0,1,0,0,0,1|1,0,1]=4 5124 B14R1.5 C=Cc1ccc(cc1)CNC(=O)CO 527a_200011934891_100000210174 [0,1,0,0,0,1|1,0,1]=4 5125 B14R1.5 C=Cc1ccc(cc1)CNC(=O)NC 2708a_100102657272_200011934891 [0,1,0,0,0,1|1,0,1]=4 5126 B14R1.5 C=Cc1ccc(cc1)CNC(=O)NC 2708a_200011934891_106832991635 [0,1,0,0,0,1|1,0,1]=4 5127 B14R1.5 C=Cc1ccc(cc1)CNC(=O)NC 273464a_100102657272_200011934891 [0,1,0,0,0,1|1,0,1]=4 5128 B14R1.5 C=Cc1ccc(cc1)CNC(=O)NC 273464a_200011934891_100102657272 [0,1,0,0,0,1|1,0,1]=4 5129 B14R1.5 C=Cc1ccc(cc1)CNC(=O)NC 512a_106832991638_200011934891 [0,1,0,0,0,1|1,0,1]=4 5130 B14R1.5 C=Cc1ccc(cc1)NCC(=O)NC 34a_100011218248_100000183359 [0,1,0,0,0,1|1,0,1]=4 5131 B14R1.5 C=Cc1ccc(cc1)NCC(=O)OC 34a_100011218248_100000747449 [0,1,0,0,0,1|1,0,1]=4 5132 B14R1.5 C=Cc1ccc(cc1)OCC(=O)CC 7a_100000189437_100000747405 [0,1,0,0,0,1|1,0,1]=4 5133 B14R1.5 C=Cc1ccc(cc1)OCC(=O)NC 271570a_100011290941_200000150405 [0,1,0,0,0,1|1,0,1]=4 5134 B14R1.5 C=Cc1ccc(cc1)OCC(=O)NC 34a_100000189437_100000183359 [0,1,0,0,0,1|1,0,1]=4 5135 B14R1.5 C=Cc1ccc(cc1)OCC(=O)NC 7a_100000189437_100000183359 [0,1,0,0,0,1|1,0,1]=4 5136 B14R1.5 C=Cc1ccc(cc1)OCC(=O)OC 271570a_100011290941_100000149925 [0,1,0,0,0,1|1,0,1]=4 5137 B14R1.5 C=Cc1ccc(cc1)OCC(=O)OC 34a_100000189437_100000747449 [0,1,0,0,0,1|1,0,1]=4 5138 B14R1.5 C=Cc1ccc(cc1)OCC(=O)OC 7a_100000189437_100000747449 [0,1,0,0,0,1|1,0,1]=4 5139 B14R1.5 C=Cc1ccc(cc1)SCC(=O)CC 62a_100000747405_100000748128 [0,1,0,0,0,1|1,0,1]=4 5140 B14R1.5 C=Cc1ccc(cc1)SCC(=O)CC 62a_100000748128_100000747405 [0,1,0,0,0,1|1,0,1]=4 5141 B14R1.5 C=Cc1ccc(cc1)SCC(=O)NC 62a_100000183359_100000748128 [0,1,0,0,0,1|1,0,1]=4 5142 B14R1.5 C=Cc1ccc(cc1)SCC(=O)NC 62a_100000748128_100000183359 [0,1,0,0,0,1|1,0,1]=4 5143 B14R1.5 C=Cc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000748128 [0,1,0,0,0,1|1,0,1]=4 5144 B14R1.5 C=Cc1ccc(cc1)SCC(=O)OC 62a_100000748128_100000747449 [0,1,0,0,0,1|1,0,1]=4 5145 B14R1.5 CCC(=O)C#Cc1ccc(cc1)OC 1458a_100000185621_100000210202 [0,1,0,0,0,1|0,0,1]=3 5146 B14R1.5 CCC(=O)C=Cc1ccc(cc1)CC 1458a_100000187855_100000210202 [0,1,0,0,0,1|1,0,1]=4 5147 B14R1.5 CCC(=O)C=Cc1ccc(cc1)OC 1458a_100000184205_100000210202 [0,1,0,0,0,1|0,0,1]=3 5148 B14R1.5 CCC(=O)C=Cc1ccc(cc1)SC 1458a_100102526083_100000210202 [0,1,0,0,0,1|0,1,1]=4 5149 B14R1.5 CCC(=O)CCc1ccc(cc1)C#N 1458a_100000021948_100000210202 [0,1,0,0,0,1|2,0,0]=4 5150 B14R1.5 CCC(=O)CCc1ccc(cc1)C#N 1458a_100000210414_100012161189 [0,1,0,0,0,1|2,0,0]=4 5151 B14R1.5 CCC(=O)CCc1ccc(cc1)CC 1458a_100000195522_100000210202 [0,1,0,0,0,1|1,0,0]=3 5152 B14R1.5 CCC(=O)CCc1ccc(cc1)OC 1458a_100000210414_100000184700 [0,1,0,0,0,1|0,0,0]=2 5153 B14R1.5 CCC(=O)CCc1ccc(cc1)OC 1458a_100000211712_100000210202 [0,1,0,0,0,1|0,0,0]=2 5154 B14R1.5 CCC(=O)CCc1ccc(cc1)SC 1458a_100011252364_100000210202 [0,1,0,0,0,1|0,1,0]=3 5155 B14R1.5 CCC(=O)COc1ccc(cc1)C#N 1458a_100000182482_100000210202 [0,1,0,0,0,1|2,0,0]=4 5156 B14R1.5 CCC(=O)COc1ccc(cc1)C#N 7a_100000210344_100000747405 [0,1,0,0,0,1|2,0,0]=4 5157 B14R1.5 CCC(=O)COc1ccc(cc1)CC 1458a_100000182499_100000210202 [0,1,0,0,0,1|1,0,0]=3 5158 B14R1.5 CCC(=O)COc1ccc(cc1)CC 7a_100000211359_100000747405 [0,1,0,0,0,1|1,0,0]=3 5159 B14R1.5 CCC(=O)COc1ccc(cc1)CO 1458a_100000730898_100000210202 [0,1,0,0,0,1|2,0,0]=4 5160 B14R1.5 CCC(=O)COc1ccc(cc1)OC 1458a_100000186439_100000210202 [0,1,0,0,0,1|0,0,0]=2 5161 B14R1.5 CCC(=O)COc1cnc(nc1)OC 7a_100000099601_100000747405 [0,1,0,0,0,1|2,0,0]=4 5162 B14R1.5 CCC(=O)CSc1ccc(cc1)C#N 62a_100000747405_100000184291 [0,1,0,0,0,1|2,0,0]=4 5163 B14R1.5 CCC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000747405 [0,1,0,0,0,1|2,0,0]=4 5164 B14R1.5 CCC(=O)CSc1ccc(cc1)C=O 62a_100000747405_100000188517 [0,1,0,0,0,1|2,0,0]=4 5165 B14R1.5 CCC(=O)CSc1ccc(cc1)CC 62a_100000747405_100011215824 [0,1,0,0,0,1|1,0,0]=3 5166 B14R1.5 CCC(=O)CSc1ccc(cc1)CC 62a_100011215824_100000747405 [0,1,0,0,0,1|1,0,0]=3 5167 B14R1.5 CCC(=O)CSc1ccc(cc1)CF 62a_100000747405_100010268989 [0,1,0,0,0,1|2,0,0]=4 5168 B14R1.5 CCC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000747405 [0,1,0,0,0,1|2,0,0]=4 5169 B14R1.5 CCC(=O)CSc1ccc(cc1)CN 62a_100000747405_100016989417 [0,1,0,0,0,1|2,0,0]=4 5170 B14R1.5 CCC(=O)CSc1ccc(cc1)CN 62a_100016989417_100000747405 [0,1,0,0,0,1|2,0,0]=4 5171 B14R1.5 CCC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000747405 [0,1,0,0,0,1|2,0,0]=4 5172 B14R1.5 CCC(=O)CSc1ccc(cc1)CO 62a_100000747405_100000690907 [0,1,0,0,0,1|2,0,0]=4 5173 B14R1.5 CCC(=O)CSc1ccc(cc1)NC 62a_100000743151_100000747405 [0,1,0,0,0,1|1,0,0]=3 5174 B14R1.5 CCC(=O)CSc1ccc(cc1)NC 62a_100000747405_100000743151 [0,1,0,0,0,1|1,0,0]=3 5175 B14R1.5 CCC(=O)CSc1ccc(cc1)NN 62a_100000747405_100016988836 [0,1,0,0,0,1|2,0,0]=4 5176 B14R1.5 CCC(=O)CSc1ccc(cc1)NN 62a_100016988836_100000747405 [0,1,0,0,0,1|2,0,0]=4 5177 B14R1.5 CCC(=O)CSc1ccc(cc1)OC 1458a_100000182033_100000210202 [0,1,0,0,0,1|0,0,0]=2 5178 B14R1.5 CCC(=O)CSc1ccc(cc1)OC 62a_100000747405_100000171711 [0,1,0,0,0,1|0,0,0]=2 5179 B14R1.5 CCC(=O)CSc1ccc(cc1)SC 62a_100000747405_100011263217 [0,1,0,0,0,1|0,1,0]=3 5180 B14R1.5 CCC(=O)CSc1ccc(cc1)SC 62a_100011263217_100000747405 [0,1,0,0,0,1|0,1,0]=3 5181 B14R1.5 CCC(=O)CSc1ccc(cn1)CC 62a_100000747405_100009843584 [0,1,0,0,0,1|2,0,0]=4 5182 B14R1.5 CCC(=O)CSc1ccc(cn1)CC 62a_100009843584_100000747405 [0,1,0,0,0,1|2,0,0]=4 5183 B14R1.5 CCC(=O)CSc1ccc(cn1)NC 62a_100000747405_100000764248 [0,1,0,0,0,1|2,0,0]=4 5184 B14R1.5 CCC(=O)CSc1ccc(cn1)NC 62a_100000764248_100000747405 [0,1,0,0,0,1|2,0,0]=4 5185 B14R1.5 CCC(=O)CSc1ccc(cn1)OC 62a_100000747405_100000744180 [0,1,0,0,0,1|1,0,0]=3 5186 B14R1.5 CCC(=O)CSc1ccc(cn1)OC 62a_100000755202_100000747405 [0,1,0,0,0,1|1,0,0]=3 5187 B14R1.5 CCC(=O)CSc1ccc(cn1)SC 62a_100000747405_100009820866 [0,1,0,0,0,1|1,1,0]=4 5188 B14R1.5 CCC(=O)CSc1ccc(cn1)SC 62a_100009820866_100000747405 [0,1,0,0,0,1|1,1,0]=4 5189 B14R1.5 CCC(=O)CSc1ccc(nc1)CC 62a_100000747405_100009820025 [0,1,0,0,0,1|2,0,0]=4 5190 B14R1.5 CCC(=O)CSc1ccc(nc1)CC 62a_100009820025_100000747405 [0,1,0,0,0,1|2,0,0]=4 5191 B14R1.5 CCC(=O)CSc1ccc(nc1)NC 62a_100000741341_100000747405 [0,1,0,0,0,1|2,0,0]=4 5192 B14R1.5 CCC(=O)CSc1ccc(nc1)NC 62a_100000747405_100000741341 [0,1,0,0,0,1|2,0,0]=4 5193 B14R1.5 CCC(=O)CSc1ccc(nc1)OC 62a_100000047065_100000747405 [0,1,0,0,0,1|1,0,0]=3 5194 B14R1.5 CCC(=O)CSc1ccc(nc1)OC 62a_100000747405_100000047065 [0,1,0,0,0,1|1,0,0]=3 5195 B14R1.5 CCC(=O)CSc1ccc(nc1)SC 62a_100000747405_100011408404 [0,1,0,0,0,1|1,1,0]=4 5196 B14R1.5 CCC(=O)CSc1ccc(nc1)SC 62a_100011408404_100000747405 [0,1,0,0,0,1|1,1,0]=4 5197 B14R1.5 CCC(=O)CSc1ccc(nn1)OC 62a_100000747405_100009819040 [0,1,0,0,0,1|2,0,0]=4 5198 B14R1.5 CCC(=O)CSc1ccc(nn1)OC 62a_100009819040_100000747405 [0,1,0,0,0,1|2,0,0]=4 5199 B14R1.5 CCC(=O)CSc1cnc(cn1)OC 62a_100000747405_100011998698 [0,1,0,0,0,1|2,0,0]=4 5200 B14R1.5 CCC(=O)CSc1cnc(cn1)OC 62a_100011998698_100000747405 [0,1,0,0,0,1|2,0,0]=4 5201 B14R1.5 CCC(=O)CSc1cnc(nc1)OC 62a_100000686852_100000747405 [0,1,0,0,0,1|2,0,0]=4 5202 B14R1.5 CCC(=O)CSc1cnc(nc1)OC 62a_100000747405_100000686852 [0,1,0,0,0,1|2,0,0]=4 5203 B14R1.5 CCC(=O)CSc1ncc(cn1)OC 62a_100000069167_100000747405 [0,1,0,0,0,1|2,0,0]=4 5204 B14R1.5 CCC(=O)CSc1ncc(cn1)OC 62a_100000747405_100000069167 [0,1,0,0,0,1|2,0,0]=4 5205 B14R1.5 CCC(=O)NCc1ccc(cc1)C#N 11a_100015207190_100000210414 [0,1,0,0,0,1|2,0,0]=4 5206 B14R1.5 CCC(=O)NCc1ccc(cc1)C#N 1626a_100015207190_100000210414 [0,1,0,0,0,1|2,0,0]=4 5207 B14R1.5 CCC(=O)NCc1ccc(cc1)C#N 240690a_100015207190_100000210414 [0,1,0,0,0,1|2,0,0]=4 5208 B14R1.5 CCC(=O)NCc1ccc(cc1)C#N 527a_100015207190_100000210414 [0,1,0,0,0,1|2,0,0]=4 5209 B14R1.5 CCC(=O)NCc1ccc(cc1)CC 11a_100000721222_100000210414 [0,1,0,0,0,1|1,0,0]=3 5210 B14R1.5 CCC(=O)NCc1ccc(cc1)CC 1626a_100000721222_100000210414 [0,1,0,0,0,1|1,0,0]=3 5211 B14R1.5 CCC(=O)NCc1ccc(cc1)CC 240690a_100000721222_100000210414 [0,1,0,0,0,1|1,0,0]=3 5212 B14R1.5 CCC(=O)NCc1ccc(cc1)CC 527a_100000721222_100000210414 [0,1,0,0,0,1|1,0,0]=3 5213 B14R1.5 CCC(=O)NCc1ccc(cc1)CO 240690a_100015189231_100000210414 [0,1,0,0,0,1|2,0,0]=4 5214 B14R1.5 CCC(=O)NCc1ccc(cc1)CO 527a_100015189231_100000210414 [0,1,0,0,0,1|2,0,0]=4 5215 B14R1.5 CCC(=O)NCc1ccc(cc1)OC 11a_100000185587_100000210414 [0,1,0,0,0,1|0,0,0]=2 5216 B14R1.5 CCC(=O)NCc1ccc(cc1)OC 1626a_100000185587_100000210414 [0,1,0,0,0,1|0,0,0]=2 5217 B14R1.5 CCC(=O)NCc1ccc(cc1)OC 240690a_100000185587_100000210414 [0,1,0,0,0,1|0,0,0]=2 5218 B14R1.5 CCC(=O)NCc1ccc(cc1)OC 527a_100000185587_100000210414 [0,1,0,0,0,1|0,0,0]=2 5219 B14R1.5 CCC(=O)NCc1ccc(cc1)SC 11a_100000174980_100000210414 [0,1,0,0,0,1|0,1,0]=3 5220 B14R1.5 CCC(=O)NCc1ccc(cc1)SC 240690a_100000174980_100000210414 [0,1,0,0,0,1|0,1,0]=3 5221 B14R1.5 CCC(=O)NCc1ccc(cc1)SC 527a_100000174980_100000210414 [0,1,0,0,0,1|0,1,0]=3 5222 B14R1.5 CCC(=O)NCc1ccc(cn1)CC 11a_100000069493_100000210414 [0,1,0,0,0,1|2,0,0]=4 5223 B14R1.5 CCC(=O)NCc1ccc(cn1)CC 1626a_100000069493_100000210414 [0,1,0,0,0,1|2,0,0]=4 5224 B14R1.5 CCC(=O)NCc1ccc(cn1)CC 240690a_100000069493_100000210414 [0,1,0,0,0,1|2,0,0]=4 5225 B14R1.5 CCC(=O)NCc1ccc(cn1)CC 527a_100000069493_100000210414 [0,1,0,0,0,1|2,0,0]=4 5226 B14R1.5 CCC(=O)NCc1ccc(cn1)OC 11a_100000703904_100000210414 [0,1,0,0,0,1|1,0,0]=3 5227 B14R1.5 CCC(=O)NCc1ccc(cn1)OC 1626a_100000703904_100000210414 [0,1,0,0,0,1|1,0,0]=3 5228 B14R1.5 CCC(=O)NCc1ccc(cn1)OC 240690a_100000703904_100000210414 [0,1,0,0,0,1|1,0,0]=3 5229 B14R1.5 CCC(=O)NCc1ccc(cn1)OC 527a_100000703904_100000210414 [0,1,0,0,0,1|1,0,0]=3 5230 B14R1.5 CCC(=O)NCc1ccc(nc1)OC 11a_100000241975_100000210414 [0,1,0,0,0,1|1,0,0]=3 5231 B14R1.5 CCC(=O)NCc1ccc(nc1)OC 1626a_100000241975_100000210414 [0,1,0,0,0,1|1,0,0]=3 5232 B14R1.5 CCC(=O)NCc1ccc(nc1)OC 240690a_100000241975_100000210414 [0,1,0,0,0,1|1,0,0]=3 5233 B14R1.5 CCC(=O)NCc1ccc(nc1)OC 527a_100000241975_100000210414 [0,1,0,0,0,1|1,0,0]=3 5234 B14R1.5 CCC(=O)NNc1ccc(cc1)CC 22a_100015204395_100000210414 [0,1,0,0,0,1|2,0,0]=4 5235 B14R1.5 CCC(=O)NNc1ccc(cc1)OC 22a_100000005221_100000210414 [0,1,0,0,0,1|1,0,0]=3 5236 B14R1.5 CCC(=O)NNc1ccc(cc1)SC 22a_100000006515_100000210414 [0,1,0,0,0,1|1,1,0]=4 5237 B14R1.5 CCC(=O)NNc1ccc(nc1)OC 22a_100102564821_100000210414 [0,1,0,0,0,1|2,0,0]=4 5238 B14R1.5 CCC(C)CNc1ccc(cc1)OC 34a_100000184247_100000748023 [0,1,0,0,0,1|1,0,1]=4 5239 B14R1.5 CCC(C)COc1ccc(cc1)OC 34a_100000210503_100000748023 [0,1,0,0,0,1|1,0,1]=4 5240 B14R1.5 CCC(C)CSc1ccc(cc1)OC 62a_100000748023_100000171711 [0,1,0,0,0,1|1,0,1]=4 5241 B14R1.5 CCC(C)NCc1ccc(cc1)OC 207a_100000209981_100000169835 [0,1,0,0,0,1|1,0,1]=4 5242 B14R1.5 CCC(C)NCc1ccc(cc1)OC 2230a_100000209981_100000742318 [0,1,0,0,0,1|1,0,1]=4 5243 B14R1.5 CCC(C)NCc1ccc(cc1)OC 270004a_100000209981_100000169835 [0,1,0,0,0,1|1,0,1]=4 5244 B14R1.5 CCC(C)NCc1ccc(cc1)OC 34a_100000185587_100011215416 [0,1,0,0,0,1|1,0,1]=4 5245 B14R1.5 CCC(C)OCc1ccc(cc1)OC 34a_100000173359_100011215416 [0,1,0,0,0,1|1,0,1]=4 5246 B14R1.5 CCC(C)OCc1ccc(cc1)OC 7a_100000210228_100000742318 [0,1,0,0,0,1|1,0,1]=4 5247 B14R1.5 CCC(C)SCc1ccc(cc1)OC 62a_100000758301_100000742318 [0,1,0,0,0,1|1,0,1]=4 5248 B14R1.5 CCC(O)CNc1ccc(cc1)OC 34a_100000184247_100011218378 [0,1,0,0,0,1|0,0,2]=4 5249 B14R1.5 CCC(O)COc1ccc(cc1)OC 34a_100000210503_100011218378 [0,1,0,0,0,1|0,0,2]=4 5250 B14R1.5 CCC(O)CSc1ccc(cc1)OC 62a_100011218378_100000171711 [0,1,0,0,0,1|0,0,2]=4 5251 B14R1.5 CCN(C)CCc1ccc(cc1)OC 2230a_100000225621_100011713689 [0,1,0,0,0,1|2,0,0]=4 5252 B14R1.5 CCN(C)CCc1ccc(cc1)OC 2230a_100000225672_100000210202 [0,1,0,0,0,1|2,0,0]=4 5253 B14R1.5 CCN(C)CCc1ccc(cc1)OC 269982a_100000225621_100000184700 [0,1,0,0,0,1|2,0,0]=4 5254 B14R1.5 CCN(C)CCc1ccc(cc1)OC 269982a_100000225672_100000204670 [0,1,0,0,0,1|2,0,0]=4 5255 B14R1.5 CCN(C)CCc1ccc(cc1)OC 34a_100000225672_100000210202 [0,1,0,0,0,1|2,0,0]=4 5256 B14R1.5 CC[C@H](C)CNc1ccc(cc1)OC 34a_100000184247_100009816398 [0,1,0,0,0,1|1,0,1]=4 5257 B14R1.5 CC[C@H](C)COc1ccc(cc1)OC 34a_100000210503_100009816398 [0,1,0,0,0,1|1,0,1]=4 5258 B14R1.5 CC[C@H](C)CSc1ccc(cc1)OC 62a_100009816398_100000171711 [0,1,0,0,0,1|1,0,1]=4 5259 B14R1.5 CCc1ccc(cc1)C=CC(=O)CF 1458a_100000187855_100015361967 [0,1,0,0,0,1|1,0,1]=4 5260 B14R1.5 CCc1ccc(cc1)C=CC(=O)NC 11a_106832991635_100000187855 [0,1,0,0,0,1|1,0,1]=4 5261 B14R1.5 CCc1ccc(cc1)C=CC(=O)NC 1626a_100102657272_100000187855 [0,1,0,0,0,1|1,0,1]=4 5262 B14R1.5 CCc1ccc(cc1)C=CC(=O)NC 240690a_100102657272_100000187855 [0,1,0,0,0,1|1,0,1]=4 5263 B14R1.5 CCc1ccc(cc1)CCC(=O)CF 1458a_100000195522_100015361967 [0,1,0,0,0,1|1,0,0]=3 5264 B14R1.5 CCc1ccc(cc1)CCC(=O)NC 11a_106832991635_100000195522 [0,1,0,0,0,1|1,0,0]=3 5265 B14R1.5 CCc1ccc(cc1)CCC(=O)NC 1626a_100102657272_100000195522 [0,1,0,0,0,1|1,0,0]=3 5266 B14R1.5 CCc1ccc(cc1)CCC(=O)NC 240690a_100102657272_100000195522 [0,1,0,0,0,1|1,0,0]=3 5267 B14R1.5 CCc1ccc(cc1)CCC(=O)NC 527a_100102657272_100000195522 [0,1,0,0,0,1|1,0,0]=3 5268 B14R1.5 CCc1ccc(cc1)CNC(=O)CO 240690a_100000721222_100000210174 [0,1,0,0,0,1|1,0,0]=3 5269 B14R1.5 CCc1ccc(cc1)CNC(=O)CO 527a_100000721222_100000210174 [0,1,0,0,0,1|1,0,0]=3 5270 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 2708a_100000721222_106832991635 [0,1,0,0,0,1|1,0,0]=3 5271 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 2708a_100102657272_100000721222 [0,1,0,0,0,1|1,0,0]=3 5272 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 273464a_100000721222_100102657272 [0,1,0,0,0,1|1,0,0]=3 5273 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 273464a_100102657272_100000721222 [0,1,0,0,0,1|1,0,0]=3 5274 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 512a_100000721222_100102657272 [0,1,0,0,0,1|1,0,0]=3 5275 B14R1.5 CCc1ccc(cc1)CNC(=O)NC 512a_106832991638_100000721222 [0,1,0,0,0,1|1,0,0]=3 5276 B14R1.5 CCc1ccc(cc1)NCC(=O)NC 2230a_100000211069_100000183359 [0,1,0,0,0,1|1,0,0]=3 5277 B14R1.5 CCc1ccc(cc1)NCC(=O)NC 34a_100000211069_100000183359 [0,1,0,0,0,1|1,0,0]=3 5278 B14R1.5 CCc1ccc(cc1)NCC(=O)OC 2230a_100000211069_100000747449 [0,1,0,0,0,1|1,0,0]=3 5279 B14R1.5 CCc1ccc(cc1)NCC(=O)OC 34a_100000211069_100000747449 [0,1,0,0,0,1|1,0,0]=3 5280 B14R1.5 CCc1ccc(cc1)NNC(=O)CO 22a_100015204395_100000210174 [0,1,0,0,0,1|2,0,0]=4 5281 B14R1.5 CCc1ccc(cc1)NNC(=O)NC 273464a_100102657272_100015204395 [0,1,0,0,0,1|2,0,0]=4 5282 B14R1.5 CCc1ccc(cc1)NNC(=O)NC 512a_106832991638_100015204395 [0,1,0,0,0,1|2,0,0]=4 5283 B14R1.5 CCc1ccc(cc1)OCC(=O)CF 1458a_100000182499_100015361967 [0,1,0,0,0,1|1,0,0]=3 5284 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 11a_106832991635_100000182499 [0,1,0,0,0,1|1,0,0]=3 5285 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 1626a_100102657272_100000182499 [0,1,0,0,0,1|1,0,0]=3 5286 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 240690a_100102657272_100000182499 [0,1,0,0,0,1|1,0,0]=3 5287 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 34a_100000211359_100000183359 [0,1,0,0,0,1|1,0,0]=3 5288 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 527a_100102657272_100000182499 [0,1,0,0,0,1|1,0,0]=3 5289 B14R1.5 CCc1ccc(cc1)OCC(=O)NC 7a_100000211359_100000183359 [0,1,0,0,0,1|1,0,0]=3 5290 B14R1.5 CCc1ccc(cc1)OCC(=O)OC 34a_100000211359_100000747449 [0,1,0,0,0,1|1,0,0]=3 5291 B14R1.5 CCc1ccc(cc1)OCC(=O)OC 7a_100000211359_100000747449 [0,1,0,0,0,1|1,0,0]=3 5292 B14R1.5 CCc1ccc(cc1)SCC(=O)NC 62a_100000183359_100011215824 [0,1,0,0,0,1|1,0,0]=3 5293 B14R1.5 CCc1ccc(cc1)SCC(=O)NC 62a_100011215824_100000183359 [0,1,0,0,0,1|1,0,0]=3 5294 B14R1.5 CCc1ccc(cc1)SCC(=O)OC 62a_100000747449_100011215824 [0,1,0,0,0,1|1,0,0]=3 5295 B14R1.5 CCc1ccc(cc1)SCC(=O)OC 62a_100011215824_100000747449 [0,1,0,0,0,1|1,0,0]=3 5296 B14R1.5 CCc1ccc(cn1)SCC(=O)NC 62a_100000183359_100009820025 [0,1,0,0,0,1|2,0,0]=4 5297 B14R1.5 CCc1ccc(cn1)SCC(=O)NC 62a_100009820025_100000183359 [0,1,0,0,0,1|2,0,0]=4 5298 B14R1.5 CCc1ccc(cn1)SCC(=O)OC 62a_100000747449_100009820025 [0,1,0,0,0,1|2,0,0]=4 5299 B14R1.5 CCc1ccc(cn1)SCC(=O)OC 62a_100009820025_100000747449 [0,1,0,0,0,1|2,0,0]=4 5300 B14R1.5 CCc1ccc(nc1)CNC(=O)CO 240690a_100000069493_100000210174 [0,1,0,0,0,1|2,0,0]=4 5301 B14R1.5 CCc1ccc(nc1)CNC(=O)CO 527a_100000069493_100000210174 [0,1,0,0,0,1|2,0,0]=4 5302 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 2708a_100000069493_106832991635 [0,1,0,0,0,1|2,0,0]=4 5303 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 2708a_100102657272_100000069493 [0,1,0,0,0,1|2,0,0]=4 5304 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 273464a_100000069493_100102657272 [0,1,0,0,0,1|2,0,0]=4 5305 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 273464a_100102657272_100000069493 [0,1,0,0,0,1|2,0,0]=4 5306 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 512a_100000069493_100102657272 [0,1,0,0,0,1|2,0,0]=4 5307 B14R1.5 CCc1ccc(nc1)CNC(=O)NC 512a_106832991638_100000069493 [0,1,0,0,0,1|2,0,0]=4 5308 B14R1.5 CCc1ccc(nc1)SCC(=O)NC 62a_100000183359_100009843584 [0,1,0,0,0,1|2,0,0]=4 5309 B14R1.5 CCc1ccc(nc1)SCC(=O)NC 62a_100009843584_100000183359 [0,1,0,0,0,1|2,0,0]=4 5310 B14R1.5 CCc1ccc(nc1)SCC(=O)OC 62a_100000747449_100009843584 [0,1,0,0,0,1|2,0,0]=4 5311 B14R1.5 CCc1ccc(nc1)SCC(=O)OC 62a_100009843584_100000747449 [0,1,0,0,0,1|2,0,0]=4 5312 B14R1.5 CNC(=O)C=Cc1ccc(cc1)OC 11a_106832991635_100000184205 [0,1,0,0,0,1|0,0,1]=3 5313 B14R1.5 CNC(=O)C=Cc1ccc(cc1)OC 1626a_100102657272_100000184205 [0,1,0,0,0,1|0,0,1]=3 5314 B14R1.5 CNC(=O)C=Cc1ccc(cc1)OC 527a_100102657272_100000184205 [0,1,0,0,0,1|0,0,1]=3 5315 B14R1.5 CNC(=O)C=Cc1ccc(cc1)SC 11a_106832991635_100102526083 [0,1,0,0,0,1|0,1,1]=4 5316 B14R1.5 CNC(=O)C=Cc1ccc(cc1)SC 1626a_100102657272_100102526083 [0,1,0,0,0,1|0,1,1]=4 5317 B14R1.5 CNC(=O)C=Cc1ccc(cc1)SC 240690a_100102657272_100102526083 [0,1,0,0,0,1|0,1,1]=4 5318 B14R1.5 CNC(=O)CCc1ccc(cc1)C#N 11a_106832991635_100000021948 [0,1,0,0,0,1|2,0,0]=4 5319 B14R1.5 CNC(=O)CCc1ccc(cc1)C#N 1626a_100102657272_100000021948 [0,1,0,0,0,1|2,0,0]=4 5320 B14R1.5 CNC(=O)CCc1ccc(cc1)C#N 240690a_100102657272_100000021948 [0,1,0,0,0,1|2,0,0]=4 5321 B14R1.5 CNC(=O)CCc1ccc(cc1)C#N 527a_100102657272_100000021948 [0,1,0,0,0,1|2,0,0]=4 5322 B14R1.5 CNC(=O)CCc1ccc(cc1)OC 11a_106832991635_100000211712 [0,1,0,0,0,1|0,0,0]=2 5323 B14R1.5 CNC(=O)CCc1ccc(cc1)OC 1626a_100102657272_100000211712 [0,1,0,0,0,1|0,0,0]=2 5324 B14R1.5 CNC(=O)CCc1ccc(cc1)OC 240690a_100102657272_100000211712 [0,1,0,0,0,1|0,0,0]=2 5325 B14R1.5 CNC(=O)CCc1ccc(cc1)OC 527a_100102657272_100000211712 [0,1,0,0,0,1|0,0,0]=2 5326 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 11a_106832991635_100011252364 [0,1,0,0,0,1|0,1,0]=3 5327 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 1626a_100102657272_100011252364 [0,1,0,0,0,1|0,1,0]=3 5328 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 240690a_100102657272_100011252364 [0,1,0,0,0,1|0,1,0]=3 5329 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 527a_100102657272_100011252364 [0,1,0,0,0,1|0,1,0]=3 5330 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 62a_200000210301_200010273138 [0,1,0,0,0,1|0,1,0]=3 5331 B14R1.5 CNC(=O)CCc1ccc(cc1)SC 62a_200010273138_200000210301 [0,1,0,0,0,1|0,1,0]=3 5332 B14R1.5 CNC(=O)CCc1ccc(cc1)S[13CH3] 62a_200010273138_200025704644 [0,1,0,0,0,1|0,1,0]=3 5333 B14R1.5 CNC(=O)CCc1ccc(cc1)S[13CH3] 62a_200025704644_200010273138 [0,1,0,0,0,1|0,1,0]=3 5334 B14R1.5 CNC(=O)CNc1ccc(cc1)C#N 34a_100000185469_100000183359 [0,1,0,0,0,1|2,0,0]=4 5335 B14R1.5 CNC(=O)CNc1ccc(cc1)CO 2230a_100011215238_100000183359 [0,1,0,0,0,1|2,0,0]=4 5336 B14R1.5 CNC(=O)CNc1ccc(cc1)CO 34a_100011215238_100000183359 [0,1,0,0,0,1|2,0,0]=4 5337 B14R1.5 CNC(=O)CNc1ccc(cc1)OC 34a_100000184247_100000183359 [0,1,0,0,0,1|0,0,0]=2 5338 B14R1.5 CNC(=O)CNc1ccc(cc1)SC 34a_100000212337_100000183359 [0,1,0,0,0,1|0,1,0]=3 5339 B14R1.5 CNC(=O)CNc1ccc(cn1)SC 27a_100000693194_100009820866 [0,1,0,0,0,1|1,1,0]=4 5340 B14R1.5 CNC(=O)CNc1ccc(nn1)OC 27a_100000693194_100010231723 [0,1,0,0,0,1|2,0,0]=4 5341 B14R1.5 CNC(=O)CNc1ncc(cn1)OC 27a_100000693194_100000069167 [0,1,0,0,0,1|2,0,0]=4 5342 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 11a_106832991635_100000182482 [0,1,0,0,0,1|2,0,0]=4 5343 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 1626a_100102657272_100000182482 [0,1,0,0,0,1|2,0,0]=4 5344 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 240690a_100102657272_100000182482 [0,1,0,0,0,1|2,0,0]=4 5345 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 34a_100000210344_100000183359 [0,1,0,0,0,1|2,0,0]=4 5346 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 527a_100102657272_100000182482 [0,1,0,0,0,1|2,0,0]=4 5347 B14R1.5 CNC(=O)COc1ccc(cc1)C#N 7a_100000210344_100000183359 [0,1,0,0,0,1|2,0,0]=4 5348 B14R1.5 CNC(=O)COc1ccc(cc1)CN 34a_100000185549_100000183359 [0,1,0,0,0,1|2,0,0]=4 5349 B14R1.5 CNC(=O)COc1ccc(cc1)CO 240690a_100102657272_100000730898 [0,1,0,0,0,1|2,0,0]=4 5350 B14R1.5 CNC(=O)COc1ccc(cc1)CO 34a_100000211755_100000183359 [0,1,0,0,0,1|2,0,0]=4 5351 B14R1.5 CNC(=O)COc1ccc(cc1)NC 2230a_100000752409_200000210301 [0,1,0,0,0,1|1,0,0]=3 5352 B14R1.5 CNC(=O)COc1ccc(cc1)NC 34a_100000182112_100000183359 [0,1,0,0,0,1|1,0,0]=3 5353 B14R1.5 CNC(=O)COc1ccc(cc1)NC 34a_100000752409_200000210301 [0,1,0,0,0,1|1,0,0]=3 5354 B14R1.5 CNC(=O)COc1ccc(cc1)N[13CH3] 2230a_100000752409_200025704644 [0,1,0,0,0,1|1,0,0]=3 5355 B14R1.5 CNC(=O)COc1ccc(cc1)N[13CH3] 34a_100000752409_200025704644 [0,1,0,0,0,1|1,0,0]=3 5356 B14R1.5 CNC(=O)COc1ccc(cc1)OC 11a_106832991635_100000186439 [0,1,0,0,0,1|0,0,0]=2 5357 B14R1.5 CNC(=O)COc1ccc(cc1)OC 1626a_100102657272_100000186439 [0,1,0,0,0,1|0,0,0]=2 5358 B14R1.5 CNC(=O)COc1ccc(cc1)OC 240690a_100102657272_100000186439 [0,1,0,0,0,1|0,0,0]=2 5359 B14R1.5 CNC(=O)COc1ccc(cc1)OC 34a_100000210503_100000183359 [0,1,0,0,0,1|0,0,0]=2 5360 B14R1.5 CNC(=O)COc1ccc(cc1)OC 527a_100102657272_100000186439 [0,1,0,0,0,1|0,0,0]=2 5361 B14R1.5 CNC(=O)COc1ccc(cc1)SC 34a_100000211864_100000183359 [0,1,0,0,0,1|0,1,0]=3 5362 B14R1.5 CNC(=O)COc1ccc(cc1)SC 62a_200000150405_200000210301 [0,1,0,0,0,1|0,1,0]=3 5363 B14R1.5 CNC(=O)COc1ccc(cc1)SC 62a_200000210301_200000150405 [0,1,0,0,0,1|0,1,0]=3 5364 B14R1.5 CNC(=O)COc1ccc(cc1)S[13CH3] 62a_200000150405_200025704644 [0,1,0,0,0,1|0,1,0]=3 5365 B14R1.5 CNC(=O)COc1ccc(cc1)S[13CH3] 62a_200025704644_200000150405 [0,1,0,0,0,1|0,1,0]=3 5366 B14R1.5 CNC(=O)COc1ccc(cn1)OC 34a_100012002028_100000183359 [0,1,0,0,0,1|1,0,0]=3 5367 B14R1.5 CNC(=O)COc1ccc(nc1)OC 34a_100011934560_100000183359 [0,1,0,0,0,1|1,0,0]=3 5368 B14R1.5 CNC(=O)COc1cnc(nc1)OC 34a_100000099601_100000183359 [0,1,0,0,0,1|2,0,0]=4 5369 B14R1.5 CNC(=O)COc1cnc(nc1)OC 7a_100000099601_100000183359 [0,1,0,0,0,1|2,0,0]=4 5370 B14R1.5 CNC(=O)CSc1ccc(cc1)C#N 62a_100000183359_100000184291 [0,1,0,0,0,1|2,0,0]=4 5371 B14R1.5 CNC(=O)CSc1ccc(cc1)C=O 62a_100000183359_100000188517 [0,1,0,0,0,1|2,0,0]=4 5372 B14R1.5 CNC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000183359 [0,1,0,0,0,1|2,0,0]=4 5373 B14R1.5 CNC(=O)CSc1ccc(cc1)CF 62a_100000183359_100010268989 [0,1,0,0,0,1|2,0,0]=4 5374 B14R1.5 CNC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000183359 [0,1,0,0,0,1|2,0,0]=4 5375 B14R1.5 CNC(=O)CSc1ccc(cc1)CN 62a_100000183359_100016989417 [0,1,0,0,0,1|2,0,0]=4 5376 B14R1.5 CNC(=O)CSc1ccc(cc1)CN 62a_100016989417_100000183359 [0,1,0,0,0,1|2,0,0]=4 5377 B14R1.5 CNC(=O)CSc1ccc(cc1)CO 62a_100000183359_100000690907 [0,1,0,0,0,1|2,0,0]=4 5378 B14R1.5 CNC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000183359 [0,1,0,0,0,1|2,0,0]=4 5379 B14R1.5 CNC(=O)CSc1ccc(cc1)NC 62a_100000183359_100000743151 [0,1,0,0,0,1|1,0,0]=3 5380 B14R1.5 CNC(=O)CSc1ccc(cc1)NC 62a_100000743151_100000183359 [0,1,0,0,0,1|1,0,0]=3 5381 B14R1.5 CNC(=O)CSc1ccc(cc1)NN 62a_100000183359_100016988836 [0,1,0,0,0,1|2,0,0]=4 5382 B14R1.5 CNC(=O)CSc1ccc(cc1)NN 62a_100016988836_100000183359 [0,1,0,0,0,1|2,0,0]=4 5383 B14R1.5 CNC(=O)CSc1ccc(cc1)OC 11a_106832991635_100000182033 [0,1,0,0,0,1|0,0,0]=2 5384 B14R1.5 CNC(=O)CSc1ccc(cc1)OC 1626a_100102657272_100000182033 [0,1,0,0,0,1|0,0,0]=2 5385 B14R1.5 CNC(=O)CSc1ccc(cc1)OC 240690a_100102657272_100000182033 [0,1,0,0,0,1|0,0,0]=2 5386 B14R1.5 CNC(=O)CSc1ccc(cc1)OC 527a_100102657272_100000182033 [0,1,0,0,0,1|0,0,0]=2 5387 B14R1.5 CNC(=O)CSc1ccc(cc1)OC 62a_100000183359_100000171711 [0,1,0,0,0,1|0,0,0]=2 5388 B14R1.5 CNC(=O)CSc1ccc(cc1)SC 62a_100000183359_100011263217 [0,1,0,0,0,1|0,1,0]=3 5389 B14R1.5 CNC(=O)CSc1ccc(cc1)SC 62a_100011263217_100000183359 [0,1,0,0,0,1|0,1,0]=3 5390 B14R1.5 CNC(=O)CSc1ccc(cn1)NC 62a_100000183359_100000764248 [0,1,0,0,0,1|2,0,0]=4 5391 B14R1.5 CNC(=O)CSc1ccc(cn1)NC 62a_100000764248_100000183359 [0,1,0,0,0,1|2,0,0]=4 5392 B14R1.5 CNC(=O)CSc1ccc(cn1)OC 62a_100000183359_100000744180 [0,1,0,0,0,1|1,0,0]=3 5393 B14R1.5 CNC(=O)CSc1ccc(cn1)OC 62a_100000755202_100000183359 [0,1,0,0,0,1|1,0,0]=3 5394 B14R1.5 CNC(=O)CSc1ccc(cn1)SC 62a_100000183359_100009820866 [0,1,0,0,0,1|1,1,0]=4 5395 B14R1.5 CNC(=O)CSc1ccc(cn1)SC 62a_100009820866_100000183359 [0,1,0,0,0,1|1,1,0]=4 5396 B14R1.5 CNC(=O)CSc1ccc(nc1)NC 62a_100000183359_100000741341 [0,1,0,0,0,1|2,0,0]=4 5397 B14R1.5 CNC(=O)CSc1ccc(nc1)NC 62a_100000741341_100000183359 [0,1,0,0,0,1|2,0,0]=4 5398 B14R1.5 CNC(=O)CSc1ccc(nc1)OC 62a_100000047065_100000183359 [0,1,0,0,0,1|1,0,0]=3 5399 B14R1.5 CNC(=O)CSc1ccc(nc1)OC 62a_100000183359_100000047065 [0,1,0,0,0,1|1,0,0]=3 5400 B14R1.5 CNC(=O)CSc1ccc(nc1)SC 62a_100000183359_100011408404 [0,1,0,0,0,1|1,1,0]=4 5401 B14R1.5 CNC(=O)CSc1ccc(nc1)SC 62a_100011408404_100000183359 [0,1,0,0,0,1|1,1,0]=4 5402 B14R1.5 CNC(=O)CSc1ccc(nn1)OC 62a_100000183359_100009819040 [0,1,0,0,0,1|2,0,0]=4 5403 B14R1.5 CNC(=O)CSc1ccc(nn1)OC 62a_100009819040_100000183359 [0,1,0,0,0,1|2,0,0]=4 5404 B14R1.5 CNC(=O)CSc1cnc(cn1)OC 62a_100000183359_100011998698 [0,1,0,0,0,1|2,0,0]=4 5405 B14R1.5 CNC(=O)CSc1cnc(cn1)OC 62a_100011998698_100000183359 [0,1,0,0,0,1|2,0,0]=4 5406 B14R1.5 CNC(=O)CSc1cnc(nc1)OC 62a_100000183359_100000686852 [0,1,0,0,0,1|2,0,0]=4 5407 B14R1.5 CNC(=O)CSc1cnc(nc1)OC 62a_100000686852_100000183359 [0,1,0,0,0,1|2,0,0]=4 5408 B14R1.5 CNC(=O)CSc1ncc(cn1)OC 62a_100000069167_100000183359 [0,1,0,0,0,1|2,0,0]=4 5409 B14R1.5 CNC(=O)CSc1ncc(cn1)OC 62a_100000183359_100000069167 [0,1,0,0,0,1|2,0,0]=4 5410 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 2708a_100015207190_106832991635 [0,1,0,0,0,1|2,0,0]=4 5411 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 2708a_100102657272_100015207190 [0,1,0,0,0,1|2,0,0]=4 5412 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 273464a_100015207190_100102657272 [0,1,0,0,0,1|2,0,0]=4 5413 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 273464a_100102657272_100015207190 [0,1,0,0,0,1|2,0,0]=4 5414 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 512a_100015207190_100102657272 [0,1,0,0,0,1|2,0,0]=4 5415 B14R1.5 CNC(=O)NCc1ccc(cc1)C#N 512a_106832991638_100015207190 [0,1,0,0,0,1|2,0,0]=4 5416 B14R1.5 CNC(=O)NCc1ccc(cc1)CO 2708a_100102657272_100015189231 [0,1,0,0,0,1|2,0,0]=4 5417 B14R1.5 CNC(=O)NCc1ccc(cc1)CO 273464a_100015189231_100102657272 [0,1,0,0,0,1|2,0,0]=4 5418 B14R1.5 CNC(=O)NCc1ccc(cc1)CO 273464a_100102657272_100015189231 [0,1,0,0,0,1|2,0,0]=4 5419 B14R1.5 CNC(=O)NCc1ccc(cc1)CO 512a_106832991638_100015189231 [0,1,0,0,0,1|2,0,0]=4 5420 B14R1.5 CNC(=O)NCc1ccc(cc1)OC 2708a_100000185587_106832991635 [0,1,0,0,0,1|0,0,0]=2 5421 B14R1.5 CNC(=O)NCc1ccc(cc1)OC 2708a_100102657272_100000185587 [0,1,0,0,0,1|0,0,0]=2 5422 B14R1.5 CNC(=O)NCc1ccc(cc1)OC 273464a_100000185587_100102657272 [0,1,0,0,0,1|0,0,0]=2 5423 B14R1.5 CNC(=O)NCc1ccc(cc1)OC 273464a_100102657272_100000185587 [0,1,0,0,0,1|0,0,0]=2 5424 B14R1.5 CNC(=O)NCc1ccc(cc1)OC 512a_106832991638_100000185587 [0,1,0,0,0,1|0,0,0]=2 5425 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 2708a_100000174980_106832991635 [0,1,0,0,0,1|0,1,0]=3 5426 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 2708a_100102657272_100000174980 [0,1,0,0,0,1|0,1,0]=3 5427 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 273464a_100000174980_100102657272 [0,1,0,0,0,1|0,1,0]=3 5428 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 273464a_100102657272_100000174980 [0,1,0,0,0,1|0,1,0]=3 5429 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 512a_100000174980_100102657272 [0,1,0,0,0,1|0,1,0]=3 5430 B14R1.5 CNC(=O)NCc1ccc(cc1)SC 512a_106832991638_100000174980 [0,1,0,0,0,1|0,1,0]=3 5431 B14R1.5 CNC(=O)NCc1ccc(cn1)OC 2708a_100000703904_106832991635 [0,1,0,0,0,1|1,0,0]=3 5432 B14R1.5 CNC(=O)NCc1ccc(cn1)OC 2708a_100102657272_100000703904 [0,1,0,0,0,1|1,0,0]=3 5433 B14R1.5 CNC(=O)NCc1ccc(cn1)OC 273464a_100000703904_100102657272 [0,1,0,0,0,1|1,0,0]=3 5434 B14R1.5 CNC(=O)NCc1ccc(cn1)OC 273464a_100102657272_100000703904 [0,1,0,0,0,1|1,0,0]=3 5435 B14R1.5 CNC(=O)NCc1ccc(cn1)OC 512a_106832991638_100000703904 [0,1,0,0,0,1|1,0,0]=3 5436 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 2708a_100000241975_106832991635 [0,1,0,0,0,1|1,0,0]=3 5437 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 2708a_100102657272_100000241975 [0,1,0,0,0,1|1,0,0]=3 5438 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 273464a_100000241975_100102657272 [0,1,0,0,0,1|1,0,0]=3 5439 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 273464a_100102657272_100000241975 [0,1,0,0,0,1|1,0,0]=3 5440 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 512a_100000241975_100102657272 [0,1,0,0,0,1|1,0,0]=3 5441 B14R1.5 CNC(=O)NCc1ccc(nc1)OC 512a_106832991638_100000241975 [0,1,0,0,0,1|1,0,0]=3 5442 B14R1.5 CNC(=O)NNc1ccc(cc1)OC 273464a_100102657272_100000005221 [0,1,0,0,0,1|1,0,0]=3 5443 B14R1.5 CNC(=O)NNc1ccc(cc1)OC 512a_106832991638_100000005221 [0,1,0,0,0,1|1,0,0]=3 5444 B14R1.5 CNC(=O)NNc1ccc(cc1)SC 273464a_100102657272_100000006515 [0,1,0,0,0,1|1,1,0]=4 5445 B14R1.5 CNC(=O)NNc1ccc(cc1)SC 512a_106832991638_100000006515 [0,1,0,0,0,1|1,1,0]=4 5446 B14R1.5 CNC(=O)NNc1ccc(nc1)OC 273464a_100102657272_100102564821 [0,1,0,0,0,1|2,0,0]=4 5447 B14R1.5 CNC(=O)NNc1ccc(nc1)OC 512a_106832991638_100102564821 [0,1,0,0,0,1|2,0,0]=4 5448 B14R1.5 CNC(C)CCc1ccc(cc1)OC 2230a_100000746351_200000210301 [0,1,0,0,0,1|1,0,1]=4 5449 B14R1.5 CNC(C)CCc1ccc(cc1)OC 270004a_106832991635_100000170882 [0,1,0,0,0,1|1,0,1]=4 5450 B14R1.5 CNC(C)CCc1ccc(cc1)OC 34a_100000746351_200000210301 [0,1,0,0,0,1|1,0,1]=4 5451 B14R1.5 CNC(C)COc1ccc(cc1)OC 270004a_106832991635_200000150802 [0,1,0,0,0,1|1,0,1]=4 5452 B14R1.5 CNc1ccc(cc1)OCC(=O)OC 34a_100000182112_100000747449 [0,1,0,0,0,1|1,0,0]=3 5453 B14R1.5 CNc1ccc(cc1)SCC(=O)OC 62a_100000743151_100000747449 [0,1,0,0,0,1|1,0,0]=3 5454 B14R1.5 CNc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000743151 [0,1,0,0,0,1|1,0,0]=3 5455 B14R1.5 CNc1ccc(cn1)SCC(=O)OC 62a_100000741341_100000747449 [0,1,0,0,0,1|2,0,0]=4 5456 B14R1.5 CNc1ccc(cn1)SCC(=O)OC 62a_100000747449_100000741341 [0,1,0,0,0,1|2,0,0]=4 5457 B14R1.5 CNc1ccc(nc1)SCC(=O)OC 62a_100000747449_100000764248 [0,1,0,0,0,1|2,0,0]=4 5458 B14R1.5 CNc1ccc(nc1)SCC(=O)OC 62a_100000764248_100000747449 [0,1,0,0,0,1|2,0,0]=4 5459 B14R1.5 COC(=O)/C=C/c1ccc(cc1)SC 62a_100000148628_200000210301 [0,1,0,0,0,1|0,1,1]=4 5460 B14R1.5 COC(=O)/C=C/c1ccc(cc1)SC 62a_200000210301_100000148628 [0,1,0,0,0,1|0,1,1]=4 5461 B14R1.5 COC(=O)/C=C/c1ccc(cc1)S[13CH3] 62a_100000148628_200025704644 [0,1,0,0,0,1|0,1,1]=4 5462 B14R1.5 COC(=O)/C=C/c1ccc(cc1)S[13CH3] 62a_200025704644_100000148628 [0,1,0,0,0,1|0,1,1]=4 5463 B14R1.5 COC(=O)C#Cc1ccc(cc1)SC 62a_200000210301_100012100070 [0,1,0,0,0,1|0,1,1]=4 5464 B14R1.5 COC(=O)C#Cc1ccc(cc1)S[13CH3] 62a_200025704644_100012100070 [0,1,0,0,0,1|0,1,1]=4 5465 B14R1.5 COC(=O)C=Cc1ccc(cc1)OC 34a_100000151162_200000210301 [0,1,0,0,0,1|0,0,1]=3 5466 B14R1.5 COC(=O)C=Cc1ccc(cc1)O[13CH3] 34a_100000151162_200025704644 [0,1,0,0,0,1|0,0,1]=3 5467 B14R1.5 COC(=O)CCc1ccc(cc1)OC 34a_100000032826_200000210301 [0,1,0,0,0,1|0,0,0]=2 5468 B14R1.5 COC(=O)CCc1ccc(cc1)OC 7a_100000032826_200000210301 [0,1,0,0,0,1|0,0,0]=2 5469 B14R1.5 COC(=O)CCc1ccc(cc1)O[13CH3] 34a_100000032826_200025704644 [0,1,0,0,0,1|0,0,0]=2 5470 B14R1.5 COC(=O)CCc1ccc(cc1)O[13CH3] 7a_100000032826_200025704644 [0,1,0,0,0,1|0,0,0]=2 5471 B14R1.5 COC(=O)CCc1ccc(cc1)SC 62a_100012357364_200000210301 [0,1,0,0,0,1|0,1,0]=3 5472 B14R1.5 COC(=O)CCc1ccc(cc1)SC 62a_200000210301_100012357364 [0,1,0,0,0,1|0,1,0]=3 5473 B14R1.5 COC(=O)CCc1ccc(cc1)S[13CH3] 62a_100012357364_200025704644 [0,1,0,0,0,1|0,1,0]=3 5474 B14R1.5 COC(=O)CCc1ccc(cc1)S[13CH3] 62a_200025704644_100012357364 [0,1,0,0,0,1|0,1,0]=3 5475 B14R1.5 COC(=O)CNc1ccc(cc1)C#N 34a_100000185469_100000747449 [0,1,0,0,0,1|2,0,0]=4 5476 B14R1.5 COC(=O)CNc1ccc(cc1)CO 2230a_100011215238_100000747449 [0,1,0,0,0,1|2,0,0]=4 5477 B14R1.5 COC(=O)CNc1ccc(cc1)CO 34a_100011215238_100000747449 [0,1,0,0,0,1|2,0,0]=4 5478 B14R1.5 COC(=O)CNc1ccc(cc1)OC 34a_100000184247_100000747449 [0,1,0,0,0,1|0,0,0]=2 5479 B14R1.5 COC(=O)CNc1ccc(cc1)OC 34a_100016989482_200000210301 [0,1,0,0,0,1|0,0,0]=2 5480 B14R1.5 COC(=O)CNc1ccc(cc1)O[13CH3] 34a_100016989482_200025704644 [0,1,0,0,0,1|0,0,0]=2 5481 B14R1.5 COC(=O)CNc1ccc(cc1)SC 34a_100000212337_100000747449 [0,1,0,0,0,1|0,1,0]=3 5482 B14R1.5 COC(=O)COc1ccc(cc1)C#N 34a_100000210344_100000747449 [0,1,0,0,0,1|2,0,0]=4 5483 B14R1.5 COC(=O)COc1ccc(cc1)C#N 7a_100000210344_100000747449 [0,1,0,0,0,1|2,0,0]=4 5484 B14R1.5 COC(=O)COc1ccc(cc1)CN 34a_100000185549_100000747449 [0,1,0,0,0,1|2,0,0]=4 5485 B14R1.5 COC(=O)COc1ccc(cc1)CO 34a_100000211755_100000747449 [0,1,0,0,0,1|2,0,0]=4 5486 B14R1.5 COC(=O)COc1ccc(cc1)OC 34a_100000210503_100000747449 [0,1,0,0,0,1|0,0,0]=2 5487 B14R1.5 COC(=O)COc1ccc(cc1)SC 34a_100000211864_100000747449 [0,1,0,0,0,1|0,1,0]=3 5488 B14R1.5 COC(=O)COc1ccc(cc1)SC 62a_100000149925_200000210301 [0,1,0,0,0,1|0,1,0]=3 5489 B14R1.5 COC(=O)COc1ccc(cc1)SC 62a_200000210301_100000149925 [0,1,0,0,0,1|0,1,0]=3 5490 B14R1.5 COC(=O)COc1ccc(cc1)S[13CH3] 62a_100000149925_200025704644 [0,1,0,0,0,1|0,1,0]=3 5491 B14R1.5 COC(=O)COc1ccc(cc1)S[13CH3] 62a_200025704644_100000149925 [0,1,0,0,0,1|0,1,0]=3 5492 B14R1.5 COC(=O)COc1ccc(cn1)OC 34a_100012002028_100000747449 [0,1,0,0,0,1|1,0,0]=3 5493 B14R1.5 COC(=O)COc1ccc(nc1)OC 34a_100011934560_100000747449 [0,1,0,0,0,1|1,0,0]=3 5494 B14R1.5 COC(=O)COc1ccc(nc1)SC 62a_100010870986_200000210301 [0,1,0,0,0,1|1,1,0]=4 5495 B14R1.5 COC(=O)COc1ccc(nc1)SC 62a_200000210301_100010870986 [0,1,0,0,0,1|1,1,0]=4 5496 B14R1.5 COC(=O)COc1ccc(nc1)S[13CH3] 62a_100010870986_200025704644 [0,1,0,0,0,1|1,1,0]=4 5497 B14R1.5 COC(=O)COc1ccc(nc1)S[13CH3] 62a_200025704644_100010870986 [0,1,0,0,0,1|1,1,0]=4 5498 B14R1.5 COC(=O)COc1cnc(nc1)OC 34a_100000099601_100000747449 [0,1,0,0,0,1|2,0,0]=4 5499 B14R1.5 COC(=O)COc1cnc(nc1)OC 7a_100000099601_100000747449 [0,1,0,0,0,1|2,0,0]=4 5500 B14R1.5 COC(=O)CSc1ccc(cc1)C#N 62a_100000747449_100000184291 [0,1,0,0,0,1|2,0,0]=4 5501 B14R1.5 COC(=O)CSc1ccc(cc1)C=O 62a_100000188517_100000747449 [0,1,0,0,0,1|2,0,0]=4 5502 B14R1.5 COC(=O)CSc1ccc(cc1)C=O 62a_100000747449_100000188517 [0,1,0,0,0,1|2,0,0]=4 5503 B14R1.5 COC(=O)CSc1ccc(cc1)CF 62a_100000747449_100010268989 [0,1,0,0,0,1|2,0,0]=4 5504 B14R1.5 COC(=O)CSc1ccc(cc1)CF 62a_100010268989_100000747449 [0,1,0,0,0,1|2,0,0]=4 5505 B14R1.5 COC(=O)CSc1ccc(cc1)CN 62a_100000747449_100016989417 [0,1,0,0,0,1|2,0,0]=4 5506 B14R1.5 COC(=O)CSc1ccc(cc1)CN 62a_100016989417_100000747449 [0,1,0,0,0,1|2,0,0]=4 5507 B14R1.5 COC(=O)CSc1ccc(cc1)CO 62a_100000690907_100000747449 [0,1,0,0,0,1|2,0,0]=4 5508 B14R1.5 COC(=O)CSc1ccc(cc1)CO 62a_100000747449_100000690907 [0,1,0,0,0,1|2,0,0]=4 5509 B14R1.5 COC(=O)CSc1ccc(cc1)NN 62a_100000747449_100016988836 [0,1,0,0,0,1|2,0,0]=4 5510 B14R1.5 COC(=O)CSc1ccc(cc1)NN 62a_100016988836_100000747449 [0,1,0,0,0,1|2,0,0]=4 5511 B14R1.5 COC(=O)CSc1ccc(cc1)OC 62a_100000747449_100000171711 [0,1,0,0,0,1|0,0,0]=2 5512 B14R1.5 COC(=O)CSc1ccc(cc1)SC 62a_100000747449_100011263217 [0,1,0,0,0,1|0,1,0]=3 5513 B14R1.5 COC(=O)CSc1ccc(cc1)SC 62a_100011263217_100000747449 [0,1,0,0,0,1|0,1,0]=3 5514 B14R1.5 COC(=O)CSc1ccc(cn1)OC 62a_100000747449_100000744180 [0,1,0,0,0,1|1,0,0]=3 5515 B14R1.5 COC(=O)CSc1ccc(cn1)OC 62a_100000755202_100000747449 [0,1,0,0,0,1|1,0,0]=3 5516 B14R1.5 COC(=O)CSc1ccc(cn1)SC 62a_100000747449_100009820866 [0,1,0,0,0,1|1,1,0]=4 5517 B14R1.5 COC(=O)CSc1ccc(cn1)SC 62a_100009820866_100000747449 [0,1,0,0,0,1|1,1,0]=4 5518 B14R1.5 COC(=O)CSc1ccc(nc1)OC 62a_100000047065_100000747449 [0,1,0,0,0,1|1,0,0]=3 5519 B14R1.5 COC(=O)CSc1ccc(nc1)OC 62a_100000747449_100000047065 [0,1,0,0,0,1|1,0,0]=3 5520 B14R1.5 COC(=O)CSc1ccc(nc1)SC 62a_100000747449_100011408404 [0,1,0,0,0,1|1,1,0]=4 5521 B14R1.5 COC(=O)CSc1ccc(nc1)SC 62a_100011408404_100000747449 [0,1,0,0,0,1|1,1,0]=4 5522 B14R1.5 COC(=O)CSc1ccc(nn1)OC 62a_100000747449_100009819040 [0,1,0,0,0,1|2,0,0]=4 5523 B14R1.5 COC(=O)CSc1ccc(nn1)OC 62a_100009819040_100000747449 [0,1,0,0,0,1|2,0,0]=4 5524 B14R1.5 COC(=O)CSc1cnc(cn1)OC 62a_100000747449_100011998698 [0,1,0,0,0,1|2,0,0]=4 5525 B14R1.5 COC(=O)CSc1cnc(cn1)OC 62a_100011998698_100000747449 [0,1,0,0,0,1|2,0,0]=4 5526 B14R1.5 COC(=O)CSc1cnc(nc1)OC 62a_100000686852_100000747449 [0,1,0,0,0,1|2,0,0]=4 5527 B14R1.5 COC(=O)CSc1cnc(nc1)OC 62a_100000747449_100000686852 [0,1,0,0,0,1|2,0,0]=4 5528 B14R1.5 COC(=O)CSc1ncc(cn1)OC 62a_100000069167_100000747449 [0,1,0,0,0,1|2,0,0]=4 5529 B14R1.5 COC(=O)CSc1ncc(cn1)OC 62a_100000747449_100000069167 [0,1,0,0,0,1|2,0,0]=4 5530 B14R1.5 COc1ccc(cc1)C#CC(=O)CF 1458a_100000185621_100015361967 [0,1,0,0,0,1|0,0,1]=3 5531 B14R1.5 COc1ccc(cc1)C=CC(=O)CF 1458a_100000184205_100015361967 [0,1,0,0,0,1|0,0,1]=3 5532 B14R1.5 COc1ccc(cc1)CCC(=O)CF 1458a_100000211712_100015361967 [0,1,0,0,0,1|0,0,0]=2 5533 B14R1.5 COc1ccc(cc1)CCC(=O)CO 1458a_100000210174_100000184700 [0,1,0,0,0,1|0,0,0]=2 5534 B14R1.5 COc1ccc(cc1)CCC(=O)NN 34a_100000048474_200000210301 [0,1,0,0,0,1|1,0,0]=3 5535 B14R1.5 COc1ccc(cc1)CCC(C)N[13CH3] 2230a_100000746351_200025704644 [0,1,0,0,0,1|1,0,1]=4 5536 B14R1.5 COc1ccc(cc1)CCC(C)N[13CH3] 34a_100000746351_200025704644 [0,1,0,0,0,1|1,0,1]=4 5537 B14R1.5 COc1ccc(cc1)CCC(C)OC 34a_200000246499_200000210301 [0,1,0,0,0,1|0,0,2]=4 5538 B14R1.5 COc1ccc(cc1)CCC(C)OC 7a_200000246499_200000210301 [0,1,0,0,0,1|0,0,2]=4 5539 B14R1.5 COc1ccc(cc1)CCC(C)O[13CH3] 34a_200000246499_200025704644 [0,1,0,0,0,1|0,0,2]=4 5540 B14R1.5 COc1ccc(cc1)CCC(C)O[13CH3] 7a_200000246499_200025704644 [0,1,0,0,0,1|0,0,2]=4 5541 B14R1.5 COc1ccc(cc1)CCN(C)CF 269982a_100000225672_100015361967 [0,1,0,0,0,1|2,0,0]=4 5542 B14R1.5 COc1ccc(cc1)CCN(C)CF 34a_100000225672_100015361967 [0,1,0,0,0,1|2,0,0]=4 5543 B14R1.5 COc1ccc(cc1)CNC(=O)CO 240690a_100000185587_100000210174 [0,1,0,0,0,1|0,0,0]=2 5544 B14R1.5 COc1ccc(cc1)CNC(=O)CO 527a_100000185587_100000210174 [0,1,0,0,0,1|0,0,0]=2 5545 B14R1.5 COc1ccc(cc1)CNC(C)C#N 2230a_100000737613_100000742318 [0,1,0,0,0,1|1,0,1]=4 5546 B14R1.5 COc1ccc(cc1)CNC(C)CO 34a_100000185587_100012180447 [0,1,0,0,0,1|0,0,2]=4 5547 B14R1.5 COc1ccc(cc1)CN[C@H](C)CF 207a_100102880703_100000169835 [0,1,0,0,0,1|1,0,1]=4 5548 B14R1.5 COc1ccc(cc1)CN[C@H](C)CF 270004a_100102880703_100000169835 [0,1,0,0,0,1|1,0,1]=4 5549 B14R1.5 COc1ccc(cc1)CN[C@H](C)CO 207a_100000737577_100000169835 [0,1,0,0,0,1|0,0,2]=4 5550 B14R1.5 COc1ccc(cc1)CN[C@H](C)CO 2230a_100000737577_100000742318 [0,1,0,0,0,1|0,0,2]=4 5551 B14R1.5 COc1ccc(cc1)CN[C@H](C)CO 270004a_100000737577_100000169835 [0,1,0,0,0,1|0,0,2]=4 5552 B14R1.5 COc1ccc(cc1)COC(C)C#N 34a_100011218135_100000742318 [0,1,0,0,0,1|1,0,1]=4 5553 B14R1.5 COc1ccc(cc1)COC(C)CF 34a_100016041109_100000742318 [0,1,0,0,0,1|1,0,1]=4 5554 B14R1.5 COc1ccc(cc1)COC(C)CF 7a_100016041109_100000742318 [0,1,0,0,0,1|1,0,1]=4 5555 B14R1.5 COc1ccc(cc1)COC(C)CN 34a_100000210904_100000742318 [0,1,0,0,0,1|1,0,1]=4 5556 B14R1.5 COc1ccc(cc1)COC(C)CO 34a_100000173359_100012180447 [0,1,0,0,0,1|0,0,2]=4 5557 B14R1.5 COc1ccc(cc1)CSC(C)C#N 62a_100000703298_100000742318 [0,1,0,0,0,1|1,0,1]=4 5558 B14R1.5 COc1ccc(cc1)CSC(C)CO 62a_100012180447_100000742318 [0,1,0,0,0,1|0,0,2]=4 5559 B14R1.5 COc1ccc(cc1)CSC(C)OC 62a_100009879195_100000742318 [0,1,0,0,0,1|0,0,2]=4 5560 B14R1.5 COc1ccc(cc1)CS[C@H](C)CO 62a_100016084084_100000742318 [0,1,0,0,0,1|0,0,2]=4 5561 B14R1.5 COc1ccc(cc1)NCC(O)CO 34a_100000184247_100011219619 [0,1,0,0,0,1|0,0,2]=4 5562 B14R1.5 COc1ccc(cc1)NC[C@@H](C)CO 34a_100000184247_100000059175 [0,1,0,0,0,1|0,0,2]=4 5563 B14R1.5 COc1ccc(cc1)NC[C@@H](O)CF 34a_100000184247_100015614560 [0,1,0,0,0,1|0,0,2]=4 5564 B14R1.5 COc1ccc(cc1)NC[C@@H](O)CO 34a_100000184247_100009815848 [0,1,0,0,0,1|0,0,2]=4 5565 B14R1.5 COc1ccc(cc1)NN=C(C)CF 4a_100000005221_100000039719 [0,1,0,0,0,1|2,0,0]=4 5566 B14R1.5 COc1ccc(cc1)NN=C(C)CO 4a_100000005221_100000211253 [0,1,0,0,0,1|1,0,1]=4 5567 B14R1.5 COc1ccc(cc1)NNC(=O)CO 22a_100000005221_100000210174 [0,1,0,0,0,1|1,0,0]=3 5568 B14R1.5 COc1ccc(cc1)OCC(=O)CF 1458a_100000186439_100015361967 [0,1,0,0,0,1|0,0,0]=2 5569 B14R1.5 COc1ccc(cc1)OCC(C)OC 34a_200011216264_200000210301 [0,1,0,0,0,1|0,0,2]=4 5570 B14R1.5 COc1ccc(cc1)OCC(C)OC 7a_200011216264_200000210301 [0,1,0,0,0,1|0,0,2]=4 5571 B14R1.5 COc1ccc(cc1)OCC(C)O[13CH3] 34a_200011216264_200025704644 [0,1,0,0,0,1|0,0,2]=4 5572 B14R1.5 COc1ccc(cc1)OCC(C)O[13CH3] 7a_200011216264_200025704644 [0,1,0,0,0,1|0,0,2]=4 5573 B14R1.5 COc1ccc(cc1)OCC(O)CO 34a_100000210503_100011219619 [0,1,0,0,0,1|0,0,2]=4 5574 B14R1.5 COc1ccc(cc1)OC[C@@H](C)CO 34a_100000210503_100000059175 [0,1,0,0,0,1|0,0,2]=4 5575 B14R1.5 COc1ccc(cc1)OC[C@@H](O)CF 34a_100000210503_100015614560 [0,1,0,0,0,1|0,0,2]=4 5576 B14R1.5 COc1ccc(cc1)OC[C@@H](O)CO 34a_100000210503_100009815848 [0,1,0,0,0,1|0,0,2]=4 5577 B14R1.5 COc1ccc(cc1)SCC(=O)CF 1458a_100000182033_100015361967 [0,1,0,0,0,1|0,0,0]=2 5578 B14R1.5 COc1ccc(cc1)SCC(O)CO 62a_100011219619_100000171711 [0,1,0,0,0,1|0,0,2]=4 5579 B14R1.5 COc1ccc(cc1)SC[C@@H](C)CO 62a_100000059175_100000171711 [0,1,0,0,0,1|0,0,2]=4 5580 B14R1.5 COc1ccc(cc1)SC[C@@H](O)CF 62a_100015614560_100000171711 [0,1,0,0,0,1|0,0,2]=4 5581 B14R1.5 COc1ccc(cc1)SC[C@@H](O)CO 62a_100009815848_100000171711 [0,1,0,0,0,1|0,0,2]=4 5582 B14R1.5 COc1ccc(cn1)CNC(=O)CO 240690a_100000241975_100000210174 [0,1,0,0,0,1|1,0,0]=3 5583 B14R1.5 COc1ccc(cn1)CNC(=O)CO 527a_100000241975_100000210174 [0,1,0,0,0,1|1,0,0]=3 5584 B14R1.5 COc1ccc(cn1)NNC(=O)CO 22a_100102564821_100000210174 [0,1,0,0,0,1|2,0,0]=4 5585 B14R1.5 COc1ccc(nc1)CNC(=O)CO 240690a_100000703904_100000210174 [0,1,0,0,0,1|1,0,0]=3 5586 B14R1.5 COc1ccc(nc1)CNC(=O)CO 527a_100000703904_100000210174 [0,1,0,0,0,1|1,0,0]=3 5587 B14R1.5 CSc1ccc(cc1)C=CC(=O)CF 1458a_100102526083_100015361967 [0,1,0,0,0,1|0,1,1]=4 5588 B14R1.5 CSc1ccc(cc1)CCC(=O)CF 1458a_100011252364_100015361967 [0,1,0,0,0,1|0,1,0]=3 5589 B14R1.5 CSc1ccc(cc1)CNC(=O)CO 240690a_100000174980_100000210174 [0,1,0,0,0,1|0,1,0]=3 5590 B14R1.5 CSc1ccc(cc1)CNC(=O)CO 527a_100000174980_100000210174 [0,1,0,0,0,1|0,1,0]=3 5591 B14R1.5 CSc1ccc(cc1)NNC(=O)CO 22a_100000006515_100000210174 [0,1,0,0,0,1|1,1,0]=4 5592 B14R1.5 CSc1ccc(cc1)OCC(=O)NN 62a_100000182278_200000210301 [0,1,0,0,0,1|1,1,0]=4 5593 B14R1.5 CSc1ccc(cc1)OCC(=O)NN 62a_200000210301_100000182278 [0,1,0,0,0,1|1,1,0]=4 5594 B14R1.5 N#Cc1ccc(cc1)CCC(=O)CF 1458a_100000021948_100015361967 [0,1,0,0,0,1|2,0,0]=4 5595 B14R1.5 N#Cc1ccc(cc1)CCC(=O)CO 1458a_100000210174_100012161189 [0,1,0,0,0,1|2,0,0]=4 5596 B14R1.5 N#Cc1ccc(cc1)CNC(=O)CO 240690a_100015207190_100000210174 [0,1,0,0,0,1|2,0,0]=4 5597 B14R1.5 N#Cc1ccc(cc1)CNC(=O)CO 527a_100015207190_100000210174 [0,1,0,0,0,1|2,0,0]=4 5598 B14R1.5 N#Cc1ccc(cc1)OCC(=O)CF 1458a_100000182482_100015361967 [0,1,0,0,0,1|2,0,0]=4 5599 B14R1.5 O=C(CF)COc1ccc(cc1)CO 1458a_100000730898_100015361967 [0,1,0,0,0,1|2,0,0]=4 5600 B14R1.5 O=C(CO)NCc1ccc(cc1)CO 240690a_100015189231_100000210174 [0,1,0,0,0,1|2,0,0]=4 5601 B14R1.5 O=C(CO)NCc1ccc(cc1)CO 527a_100015189231_100000210174 [0,1,0,0,0,1|2,0,0]=4 5602 B14R1.5 [13CH3]Oc1ccc(cc1)CCC(=O)NN 34a_100000048474_200025704644 [0,1,0,0,0,1|1,0,0]=3 5603 B14R1.5 [13CH3]Sc1ccc(cc1)OCC(=O)NN 62a_100000182278_200025704644 [0,1,0,0,0,1|1,1,0]=4 5604 B14R1.5 [13CH3]Sc1ccc(cc1)OCC(=O)NN 62a_200025704644_100000182278 [0,1,0,0,0,1|1,1,0]=4 5605 B14R1.103 C=C(C)CNc1ccc(cc1Br)CC 2230a_100012339725_100000748629 [0,1,0,0,0,1|2,0,0]=4 5606 B14R1.103 C=C(C)CNc1ccc(cc1Br)CC 34a_100012339725_100000748629 [0,1,0,0,0,1|2,0,0]=4 5607 B14R1.103 C=C(C)CNc1ccc(cc1Br)OC 34a_100015195136_100000748629 [0,1,0,0,0,1|1,0,0]=3 5608 B14R1.103 C=C(C)CNc1ccc(cc1C)CC 2230a_100011226020_100000748629 [0,1,0,0,0,1|2,0,0]=4 5609 B14R1.103 C=C(C)CNc1ccc(cc1C)CC 34a_100011226020_100000748629 [0,1,0,0,0,1|2,0,0]=4 5610 B14R1.103 C=C(C)CNc1ccc(cc1C)CC 7a_100011226020_100000748629 [0,1,0,0,0,1|2,0,0]=4 5611 B14R1.103 C=C(C)CNc1ccc(cc1C)OC 34a_100000750285_100000748629 [0,1,0,0,0,1|1,0,0]=3 5612 B14R1.103 C=C(C)CNc1ccc(cc1Cl)OC 34a_100000747055_100000748629 [0,1,0,0,0,1|1,0,0]=3 5613 B14R1.103 C=C(C)CNc1ccc(cc1F)CC 2230a_100016177294_100000748629 [0,1,0,0,0,1|2,0,0]=4 5614 B14R1.103 C=C(C)CNc1ccc(cc1F)CC 34a_100016177294_100000748629 [0,1,0,0,0,1|2,0,0]=4 5615 B14R1.103 C=C(C)CNc1ccc(cc1F)OC 34a_100011299463_100000748629 [0,1,0,0,0,1|1,0,0]=3 5616 B14R1.103 C=C(C)CNc1ccc(cc1F)SC 34a_100012056844_100000748629 [0,1,0,0,0,1|1,1,0]=4 5617 B14R1.103 C=C(C)CNc1ccc(cc1I)OC 34a_100000049804_100000748629 [0,1,0,0,0,1|1,0,0]=3 5618 B14R1.103 C=C(C)CNc1ccc(cc1O)CC 34a_100000124328_100000748629 [0,1,0,0,0,1|2,0,0]=4 5619 B14R1.103 C=C(C)CNc1ccc(cc1O)OC 34a_100016989039_100000748629 [0,1,0,0,0,1|1,0,0]=3 5620 B14R1.103 C=C(C)COc1ccc(cc1Br)CC 34a_100012339963_100000748629 [0,1,0,0,0,1|2,0,0]=4 5621 B14R1.103 C=C(C)COc1ccc(cc1Br)CC 7a_100012339963_100000748629 [0,1,0,0,0,1|2,0,0]=4 5622 B14R1.103 C=C(C)COc1ccc(cc1Br)OC 34a_100000685887_100000748629 [0,1,0,0,0,1|1,0,0]=3 5623 B14R1.103 C=C(C)COc1ccc(cc1Br)OC 7a_100000685887_100000748629 [0,1,0,0,0,1|1,0,0]=3 5624 B14R1.103 C=C(C)COc1ccc(cc1C)OC 34a_100012002223_100000748629 [0,1,0,0,0,1|1,0,0]=3 5625 B14R1.103 C=C(C)COc1ccc(cc1C)OC 7a_100012002223_100000748629 [0,1,0,0,0,1|1,0,0]=3 5626 B14R1.103 C=C(C)COc1ccc(cc1Cl)OC 34a_100000038596_100000748629 [0,1,0,0,0,1|1,0,0]=3 5627 B14R1.103 C=C(C)COc1ccc(cc1Cl)OC 7a_100000038596_100000748629 [0,1,0,0,0,1|1,0,0]=3 5628 B14R1.103 C=C(C)COc1ccc(cc1F)OC 34a_100000036999_100000748629 [0,1,0,0,0,1|1,0,0]=3 5629 B14R1.103 C=C(C)COc1ccc(cc1F)OC 7a_100000036999_100000748629 [0,1,0,0,0,1|1,0,0]=3 5630 B14R1.103 C=C(C)COc1ccc(cc1N)CC 34a_100000765835_100000748629 [0,1,0,0,0,1|2,0,0]=4 5631 B14R1.103 C=C(C)COc1ccc(cc1N)CC 7a_100000765835_100000748629 [0,1,0,0,0,1|2,0,0]=4 5632 B14R1.103 C=C(C)COc1ccc(cc1N)OC 34a_100000188146_100000748629 [0,1,0,0,0,1|1,0,0]=3 5633 B14R1.103 C=C(C)COc1ccc(nc1C)OC 34a_200009873766_100000748629 [0,1,0,0,0,1|2,0,0]=4 5634 B14R1.103 C=C(C)CSc1ccc(cc1Br)CC 62a_100000748629_200009997437 [0,1,0,0,0,1|2,0,0]=4 5635 B14R1.103 C=C(C)CSc1ccc(cc1Br)CC 62a_200009997437_100000211660 [0,1,0,0,0,1|2,0,0]=4 5636 B14R1.103 C=C(C)CSc1ccc(cc1Br)OC 62a_100000748629_100012349170 [0,1,0,0,0,1|1,0,0]=3 5637 B14R1.103 C=C(C)CSc1ccc(cc1Br)OC 62a_100012349170_100000211660 [0,1,0,0,0,1|1,0,0]=3 5638 B14R1.103 C=C(C)CSc1ccc(cc1C)NC 62a_100000748629_100102888905 [0,1,0,0,0,1|2,0,0]=4 5639 B14R1.103 C=C(C)CSc1ccc(cc1C)NC 62a_100102888905_100000211660 [0,1,0,0,0,1|2,0,0]=4 5640 B14R1.103 C=C(C)CSc1ccc(cc1C)OC 62a_100000748629_100000759875 [0,1,0,0,0,1|1,0,0]=3 5641 B14R1.103 C=C(C)CSc1ccc(cc1C)OC 62a_100000759875_100000211660 [0,1,0,0,0,1|1,0,0]=3 5642 B14R1.103 C=C(C)CSc1ccc(cc1F)CC 62a_100000748629_200010339503 [0,1,0,0,0,1|2,0,0]=4 5643 B14R1.103 C=C(C)CSc1ccc(cc1F)CC 62a_200010339503_100000211660 [0,1,0,0,0,1|2,0,0]=4 5644 B14R1.103 C=C(C)CSc1ccc(cc1F)NC 62a_100000748629_100012285320 [0,1,0,0,0,1|2,0,0]=4 5645 B14R1.103 C=C(C)CSc1ccc(cc1F)NC 62a_100012285320_100000211660 [0,1,0,0,0,1|2,0,0]=4 5646 B14R1.103 C=C(C)CSc1ccc(cc1F)OC 62a_100000748629_100000753793 [0,1,0,0,0,1|1,0,0]=3 5647 B14R1.103 C=C(C)CSc1ccc(cc1F)OC 62a_100000753793_100000211660 [0,1,0,0,0,1|1,0,0]=3 5648 B14R1.103 C=C(C)CSc1ccc(cc1F)SC 62a_100000748629_100009816902 [0,1,0,0,0,1|1,1,0]=4 5649 B14R1.103 C=C(C)CSc1ccc(cc1F)SC 62a_100009816902_100000211660 [0,1,0,0,0,1|1,1,0]=4 5650 B14R1.103 C=C(C)CSc1ccc(cc1N)OC 62a_100000748021_100000211660 [0,1,0,0,0,1|1,0,0]=3 5651 B14R1.103 C=C(C)CSc1ccc(cc1N)OC 62a_100000748629_100000748021 [0,1,0,0,0,1|1,0,0]=3 5652 B14R1.103 C=C(C)CSc1ccc(cc1O)OC 62a_100000748629_100000719091 [0,1,0,0,0,1|1,0,0]=3 5653 B14R1.103 C=C(C)CSc1ccc(nc1C)OC 62a_100000748629_100000766551 [0,1,0,0,0,1|2,0,0]=4 5654 B14R1.103 C=C(C)CSc1ccc(nc1C)OC 62a_100000766551_100000211660 [0,1,0,0,0,1|2,0,0]=4 5655 B14R1.103 C=C(C)CSc1ccc(nc1F)OC 62a_100000748629_100010067559 [0,1,0,0,0,1|2,0,0]=4 5656 B14R1.103 C=C(C)CSc1ccc(nc1F)OC 62a_100010067559_100000211660 [0,1,0,0,0,1|2,0,0]=4 5657 B14R1.103 C=C(C)CSc1ccc(nc1N)OC 62a_100010187629_100000211660 [0,1,0,0,0,1|2,0,0]=4 5658 B14R1.103 C=C(C)CSc1cnc(cc1C)OC 62a_100000748629_100011934368 [0,1,0,0,0,1|2,0,0]=4 5659 B14R1.103 C=C(C)CSc1cnc(cc1C)OC 62a_100011934368_100000211660 [0,1,0,0,0,1|2,0,0]=4 5660 B14R1.103 C=C(C)CSc1cnc(cc1F)OC 62a_100000748629_100010136277 [0,1,0,0,0,1|2,0,0]=4 5661 B14R1.103 C=C(C)CSc1cnc(cc1F)OC 62a_100010136277_100000211660 [0,1,0,0,0,1|2,0,0]=4 5662 B14R1.103 C=C(C)CSc1cnc(cc1N)OC 62a_100000748629_100010254562 [0,1,0,0,0,1|2,0,0]=4 5663 B14R1.103 C=C(C)CSc1cnc(cc1N)OC 62a_100010254562_100000211660 [0,1,0,0,0,1|2,0,0]=4 5664 B14R1.103 C=C(C)CSc1cnc(cc1O)OC 62a_100000748629_100010738159 [0,1,0,0,0,1|2,0,0]=4 5665 B14R1.103 C=C(C)CSc1cnc(cc1O)OC 62a_100010738159_100000211660 [0,1,0,0,0,1|2,0,0]=4 5666 B14R1.103 C=C(C)CSc1ncc(cc1C)OC 62a_100000748629_200009851512 [0,1,0,0,0,1|2,0,0]=4 5667 B14R1.103 C=C(C)CSc1ncc(cc1N)OC 62a_100000748629_100010074831 [0,1,0,0,0,1|2,0,0]=4 5668 B14R1.103 C=C(C)CSc1ncc(cc1N)OC 62a_100010074831_100000211660 [0,1,0,0,0,1|2,0,0]=4 5669 B14R1.103 C=C(F)CNc1ccc(cc1Br)OC 34a_100015195136_100009893438 [0,1,0,0,0,1|1,0,1]=4 5670 B14R1.103 C=C(F)CNc1ccc(cc1C)OC 34a_100000750285_100009893438 [0,1,0,0,0,1|1,0,1]=4 5671 B14R1.103 C=C(F)CNc1ccc(cc1Cl)OC 34a_100000747055_100009893438 [0,1,0,0,0,1|1,0,1]=4 5672 B14R1.103 C=C(F)CNc1ccc(cc1F)OC 34a_100011299463_100009893438 [0,1,0,0,0,1|1,0,1]=4 5673 B14R1.103 C=C(F)CNc1ccc(cc1I)OC 34a_100000049804_100009893438 [0,1,0,0,0,1|1,0,1]=4 5674 B14R1.103 C=C(F)CNc1ccc(cc1O)OC 34a_100016989039_100009893438 [0,1,0,0,0,1|1,0,1]=4 5675 B14R1.103 C=C(F)COc1ccc(cc1Br)OC 34a_100000685887_100009893438 [0,1,0,0,0,1|1,0,1]=4 5676 B14R1.103 C=C(F)COc1ccc(cc1Br)OC 7a_100000685887_100000042424 [0,1,0,0,0,1|1,0,1]=4 5677 B14R1.103 C=C(F)COc1ccc(cc1C)OC 34a_100012002223_100009893438 [0,1,0,0,0,1|1,0,1]=4 5678 B14R1.103 C=C(F)COc1ccc(cc1C)OC 7a_100012002223_100000042424 [0,1,0,0,0,1|1,0,1]=4 5679 B14R1.103 C=C(F)COc1ccc(cc1Cl)OC 34a_100000038596_100009893438 [0,1,0,0,0,1|1,0,1]=4 5680 B14R1.103 C=C(F)COc1ccc(cc1Cl)OC 7a_100000038596_100000042424 [0,1,0,0,0,1|1,0,1]=4 5681 B14R1.103 C=C(F)COc1ccc(cc1F)OC 34a_100000036999_100009893438 [0,1,0,0,0,1|1,0,1]=4 5682 B14R1.103 C=C(F)COc1ccc(cc1F)OC 7a_100000036999_100000042424 [0,1,0,0,0,1|1,0,1]=4 5683 B14R1.103 C=C(F)COc1ccc(cc1N)OC 34a_100000188146_100009893438 [0,1,0,0,0,1|1,0,1]=4 5684 B14R1.103 C=C(F)CSc1ccc(cc1Br)OC 62a_100000042424_100012349170 [0,1,0,0,0,1|1,0,1]=4 5685 B14R1.103 C=C(F)CSc1ccc(cc1Br)OC 62a_100012349170_100000042424 [0,1,0,0,0,1|1,0,1]=4 5686 B14R1.103 C=C(F)CSc1ccc(cc1C)OC 62a_100000042424_100000759875 [0,1,0,0,0,1|1,0,1]=4 5687 B14R1.103 C=C(F)CSc1ccc(cc1C)OC 62a_100000759875_100000042424 [0,1,0,0,0,1|1,0,1]=4 5688 B14R1.103 C=C(F)CSc1ccc(cc1F)OC 62a_100000042424_100000753793 [0,1,0,0,0,1|1,0,1]=4 5689 B14R1.103 C=C(F)CSc1ccc(cc1F)OC 62a_100000753793_100000042424 [0,1,0,0,0,1|1,0,1]=4 5690 B14R1.103 C=C(F)CSc1ccc(cc1N)OC 62a_100000042424_100000748021 [0,1,0,0,0,1|1,0,1]=4 5691 B14R1.103 C=C(F)CSc1ccc(cc1N)OC 62a_100000748021_100000042424 [0,1,0,0,0,1|1,0,1]=4 5692 B14R1.103 C=C(F)CSc1ccc(cc1O)OC 62a_100000042424_100000719091 [0,1,0,0,0,1|1,0,1]=4 5693 B14R1.103 CC(=O)NCc1ccc(cc1Br)C#N 11a_114948178924_100015343762 [0,1,0,0,0,1|2,0,0]=4 5694 B14R1.103 CC(=O)NCc1ccc(cc1Br)C#N 1626a_114948178924_100015343762 [0,1,0,0,0,1|2,0,0]=4 5695 B14R1.103 CC(=O)NCc1ccc(cc1Br)C#N 240690a_114948178924_100015343762 [0,1,0,0,0,1|2,0,0]=4 5696 B14R1.103 CC(=O)NCc1ccc(cc1Br)C#N 527a_114948178924_100103153847 [0,1,0,0,0,1|2,0,0]=4 5697 B14R1.103 CC(=O)NCc1ccc(cc1F)C#N 11a_100000749714_100015343762 [0,1,0,0,0,1|2,0,0]=4 5698 B14R1.103 CC(=O)NCc1ccc(cc1F)C#N 1626a_100000749714_100015343762 [0,1,0,0,0,1|2,0,0]=4 5699 B14R1.103 CC(=O)NCc1ccc(cc1F)C#N 240690a_100000749714_100015343762 [0,1,0,0,0,1|2,0,0]=4 5700 B14R1.103 CC(=O)NCc1ccc(cc1F)C#N 527a_100000749714_100103153847 [0,1,0,0,0,1|2,0,0]=4 5701 B14R1.103 CCc1ccc(c(c1)Br)NCC(=O)N 2230a_100012339725_100000747473 [0,1,0,0,0,1|2,0,0]=4 5702 B14R1.103 CCc1ccc(c(c1)Br)NCC(=O)N 34a_100012339725_100000187820 [0,1,0,0,0,1|2,0,0]=4 5703 B14R1.103 CCc1ccc(c(c1)Br)NCC(=O)[O-] 34a_100012339725_100020667443 [0,1,0,0,0,1|2,0,0]=4 5704 B14R1.103 CCc1ccc(c(c1)Br)OCC(=O)N 34a_100012339963_100000187820 [0,1,0,0,0,1|2,0,0]=4 5705 B14R1.103 CCc1ccc(c(c1)Br)OCC(=O)N 7a_100012339963_100000187820 [0,1,0,0,0,1|2,0,0]=4 5706 B14R1.103 CCc1ccc(c(c1)Br)OCC(=O)[O-] 34a_100012339963_100020667443 [0,1,0,0,0,1|2,0,0]=4 5707 B14R1.103 CCc1ccc(c(c1)Br)SCC(=O)N 62a_100000747473_200009997437 [0,1,0,0,0,1|2,0,0]=4 5708 B14R1.103 CCc1ccc(c(c1)Br)SCC(=O)N 62a_200009997437_100000747473 [0,1,0,0,0,1|2,0,0]=4 5709 B14R1.103 CCc1ccc(c(c1)Br)SCC(=O)[O-] 62a_100020667443_200009997437 [0,1,0,0,0,1|2,0,0]=4 5710 B14R1.103 CCc1ccc(c(c1)Br)SCC(=O)[O-] 62a_200009997437_100020667443 [0,1,0,0,0,1|2,0,0]=4 5711 B14R1.103 CCc1ccc(c(c1)C)NCC(=O)N 2230a_100011226020_100000747473 [0,1,0,0,0,1|2,0,0]=4 5712 B14R1.103 CCc1ccc(c(c1)C)NCC(=O)N 34a_100011226020_100000187820 [0,1,0,0,0,1|2,0,0]=4 5713 B14R1.103 CCc1ccc(c(c1)C)NCC(=O)N 7a_100011226020_100000187820 [0,1,0,0,0,1|2,0,0]=4 5714 B14R1.103 CCc1ccc(c(c1)C)NCC(=O)[O-] 34a_100011226020_100020667443 [0,1,0,0,0,1|2,0,0]=4 5715 B14R1.103 CCc1ccc(c(c1)F)NCC(=O)N 2230a_100016177294_100000747473 [0,1,0,0,0,1|2,0,0]=4 5716 B14R1.103 CCc1ccc(c(c1)F)NCC(=O)N 34a_100016177294_100000187820 [0,1,0,0,0,1|2,0,0]=4 5717 B14R1.103 CCc1ccc(c(c1)F)NCC(=O)[O-] 34a_100016177294_100020667443 [0,1,0,0,0,1|2,0,0]=4 5718 B14R1.103 CCc1ccc(c(c1)F)SCC(=O)N 62a_100000747473_200010339503 [0,1,0,0,0,1|2,0,0]=4 5719 B14R1.103 CCc1ccc(c(c1)F)SCC(=O)N 62a_200010339503_100000747473 [0,1,0,0,0,1|2,0,0]=4 5720 B14R1.103 CCc1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_200010339503 [0,1,0,0,0,1|2,0,0]=4 5721 B14R1.103 CCc1ccc(c(c1)F)SCC(=O)[O-] 62a_200010339503_100020667443 [0,1,0,0,0,1|2,0,0]=4 5722 B14R1.103 CCc1ccc(c(c1)N)OCC(=O)N 34a_100000765835_100000187820 [0,1,0,0,0,1|2,0,0]=4 5723 B14R1.103 CCc1ccc(c(c1)N)OCC(=O)N 7a_100000765835_100000187820 [0,1,0,0,0,1|2,0,0]=4 5724 B14R1.103 CCc1ccc(c(c1)N)OCC(=O)[O-] 34a_100000765835_100020667443 [0,1,0,0,0,1|2,0,0]=4 5725 B14R1.103 CCc1ccc(c(c1)O)NCC(=O)N 34a_100000124328_100000187820 [0,1,0,0,0,1|2,0,0]=4 5726 B14R1.103 CCc1ccc(c(c1)O)NCC(=O)[O-] 34a_100000124328_100020667443 [0,1,0,0,0,1|2,0,0]=4 5727 B14R1.103 CNc1ccc(c(c1)C)SCC(=O)N 62a_100000747473_100102888905 [0,1,0,0,0,1|2,0,0]=4 5728 B14R1.103 CNc1ccc(c(c1)C)SCC(=O)N 62a_100102888905_100000747473 [0,1,0,0,0,1|2,0,0]=4 5729 B14R1.103 CNc1ccc(c(c1)C)SCC(=O)[O-] 62a_100020667443_100102888905 [0,1,0,0,0,1|2,0,0]=4 5730 B14R1.103 CNc1ccc(c(c1)C)SCC(=O)[O-] 62a_100102888905_100020667443 [0,1,0,0,0,1|2,0,0]=4 5731 B14R1.103 CNc1ccc(c(c1)F)SCC(=O)N 62a_100000747473_100012285320 [0,1,0,0,0,1|2,0,0]=4 5732 B14R1.103 CNc1ccc(c(c1)F)SCC(=O)N 62a_100012285320_100000747473 [0,1,0,0,0,1|2,0,0]=4 5733 B14R1.103 CNc1ccc(c(c1)F)SCC(=O)[O-] 62a_100012285320_100020667443 [0,1,0,0,0,1|2,0,0]=4 5734 B14R1.103 CNc1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_100012285320 [0,1,0,0,0,1|2,0,0]=4 5735 B14R1.103 COc1cc(c(cn1)SCC(=O)N)C 62a_100000747473_100011934368 [0,1,0,0,0,1|2,0,0]=4 5736 B14R1.103 COc1cc(c(cn1)SCC(=O)N)C 62a_100011934368_100000747473 [0,1,0,0,0,1|2,0,0]=4 5737 B14R1.103 COc1cc(c(cn1)SCC(=O)N)F 62a_100000747473_100010136277 [0,1,0,0,0,1|2,0,0]=4 5738 B14R1.103 COc1cc(c(cn1)SCC(=O)N)F 62a_100010136277_100000747473 [0,1,0,0,0,1|2,0,0]=4 5739 B14R1.103 COc1cc(c(cn1)SCC(=O)N)N 62a_100000747473_100010254562 [0,1,0,0,0,1|2,0,0]=4 5740 B14R1.103 COc1cc(c(cn1)SCC(=O)N)N 62a_100010254562_100000747473 [0,1,0,0,0,1|2,0,0]=4 5741 B14R1.103 COc1cc(c(cn1)SCC(=O)N)O 62a_100000747473_100010738159 [0,1,0,0,0,1|2,0,0]=4 5742 B14R1.103 COc1cc(c(cn1)SCC(=O)N)O 62a_100010738159_100000747473 [0,1,0,0,0,1|2,0,0]=4 5743 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])C 62a_100011934368_100020667443 [0,1,0,0,0,1|2,0,0]=4 5744 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])C 62a_100020667443_100011934368 [0,1,0,0,0,1|2,0,0]=4 5745 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])F 62a_100010136277_100020667443 [0,1,0,0,0,1|2,0,0]=4 5746 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])F 62a_100020667443_100010136277 [0,1,0,0,0,1|2,0,0]=4 5747 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])N 62a_100010254562_100020667443 [0,1,0,0,0,1|2,0,0]=4 5748 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])N 62a_100020667443_100010254562 [0,1,0,0,0,1|2,0,0]=4 5749 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])O 62a_100010738159_100020667443 [0,1,0,0,0,1|2,0,0]=4 5750 B14R1.103 COc1cc(c(cn1)SCC(=O)[O-])O 62a_100020667443_100010738159 [0,1,0,0,0,1|2,0,0]=4 5751 B14R1.103 COc1ccc(c(c1)Br)CNC(C)C 207a_100138425928_100000723261 [0,1,0,0,0,1|1,0,1]=4 5752 B14R1.103 COc1ccc(c(c1)Br)CNC(C)C 2230a_100138425928_100011982828 [0,1,0,0,0,1|1,0,1]=4 5753 B14R1.103 COc1ccc(c(c1)Br)CNC(C)C 34a_100138425928_100011982828 [0,1,0,0,0,1|1,0,1]=4 5754 B14R1.103 COc1ccc(c(c1)Br)COC(C)C 34a_100000212225_100011982828 [0,1,0,0,0,1|1,0,1]=4 5755 B14R1.103 COc1ccc(c(c1)Br)COC(C)C 34a_100011982768_100000210206 [0,1,0,0,0,1|1,0,1]=4 5756 B14R1.103 COc1ccc(c(c1)Br)COC(C)C 7a_100011982768_100000210206 [0,1,0,0,0,1|1,0,1]=4 5757 B14R1.103 COc1ccc(c(c1)Br)CSC(C)C 62a_100000210206_100011982828 [0,1,0,0,0,1|1,0,1]=4 5758 B14R1.103 COc1ccc(c(c1)Br)CSC(C)C 62a_100011982828_100000210206 [0,1,0,0,0,1|1,0,1]=4 5759 B14R1.103 COc1ccc(c(c1)Br)NCC(=O)N 34a_100015195136_100000187820 [0,1,0,0,0,1|1,0,0]=3 5760 B14R1.103 COc1ccc(c(c1)Br)NCC(=O)[O-] 34a_100015195136_100020667443 [0,1,0,0,0,1|1,0,0]=3 5761 B14R1.103 COc1ccc(c(c1)Br)NCC(C)C 34a_100015195136_100000210624 [0,1,0,0,0,1|1,0,1]=4 5762 B14R1.103 COc1ccc(c(c1)Br)NCC(C)O 34a_100015195136_100011218427 [0,1,0,0,0,1|0,0,2]=4 5763 B14R1.103 COc1ccc(c(c1)Br)NC[C@@H](C)O 34a_100015195136_100009817552 [0,1,0,0,0,1|0,0,2]=4 5764 B14R1.103 COc1ccc(c(c1)Br)NC[N+](=O)[O-] 34a_100015195136_100000761209 [0,1,0,0,0,1|2,0,0]=4 5765 B14R1.103 COc1ccc(c(c1)Br)OCC(=O)N 34a_100000685887_100000187820 [0,1,0,0,0,1|1,0,0]=3 5766 B14R1.103 COc1ccc(c(c1)Br)OCC(=O)N 7a_100000685887_100000187820 [0,1,0,0,0,1|1,0,0]=3 5767 B14R1.103 COc1ccc(c(c1)Br)OCC(=O)[O-] 34a_100000685887_100020667443 [0,1,0,0,0,1|1,0,0]=3 5768 B14R1.103 COc1ccc(c(c1)Br)OCC(C)C 34a_100000685887_100000210624 [0,1,0,0,0,1|1,0,1]=4 5769 B14R1.103 COc1ccc(c(c1)Br)OCC(C)C 7a_100000685887_100000210760 [0,1,0,0,0,1|1,0,1]=4 5770 B14R1.103 COc1ccc(c(c1)Br)OCC(C)O 34a_100000685887_100011218427 [0,1,0,0,0,1|0,0,2]=4 5771 B14R1.103 COc1ccc(c(c1)Br)OCC(C)O 7a_100000685887_100011218427 [0,1,0,0,0,1|0,0,2]=4 5772 B14R1.103 COc1ccc(c(c1)Br)OC[C@@H](C)O 34a_100000685887_100009817552 [0,1,0,0,0,1|0,0,2]=4 5773 B14R1.103 COc1ccc(c(c1)Br)OC[C@@H](C)O 7a_100000685887_100009817552 [0,1,0,0,0,1|0,0,2]=4 5774 B14R1.103 COc1ccc(c(c1)Br)OC[N+](=O)[O-] 34a_100000685887_100000761209 [0,1,0,0,0,1|2,0,0]=4 5775 B14R1.103 COc1ccc(c(c1)Br)SCC(=O)N 62a_100000747473_100012349170 [0,1,0,0,0,1|1,0,0]=3 5776 B14R1.103 COc1ccc(c(c1)Br)SCC(=O)N 62a_100012349170_100000747473 [0,1,0,0,0,1|1,0,0]=3 5777 B14R1.103 COc1ccc(c(c1)Br)SCC(=O)[O-] 62a_100012349170_100020667443 [0,1,0,0,0,1|1,0,0]=3 5778 B14R1.103 COc1ccc(c(c1)Br)SCC(=O)[O-] 62a_100020667443_100012349170 [0,1,0,0,0,1|1,0,0]=3 5779 B14R1.103 COc1ccc(c(c1)Br)SCC(C)C 62a_100000210624_100012349170 [0,1,0,0,0,1|1,0,1]=4 5780 B14R1.103 COc1ccc(c(c1)Br)SCC(C)C 62a_100012349170_100000210760 [0,1,0,0,0,1|1,0,1]=4 5781 B14R1.103 COc1ccc(c(c1)Br)SCC(C)O 62a_100011218427_100012349170 [0,1,0,0,0,1|0,0,2]=4 5782 B14R1.103 COc1ccc(c(c1)Br)SCC(C)O 62a_100012349170_100011218427 [0,1,0,0,0,1|0,0,2]=4 5783 B14R1.103 COc1ccc(c(c1)Br)SC[C@@H](C)O 62a_100009817552_100012349170 [0,1,0,0,0,1|0,0,2]=4 5784 B14R1.103 COc1ccc(c(c1)Br)SC[C@@H](C)O 62a_100012349170_100009817552 [0,1,0,0,0,1|0,0,2]=4 5785 B14R1.103 COc1ccc(c(c1)Br)SC[N+](=O)[O-] 62a_100012349170_100000761209 [0,1,0,0,0,1|2,0,0]=4 5786 B14R1.103 COc1ccc(c(c1)C)CNC(C)C 207a_100138425928_100011214997 [0,1,0,0,0,1|1,0,1]=4 5787 B14R1.103 COc1ccc(c(c1)C)NCC(=O)N 34a_100000750285_100000187820 [0,1,0,0,0,1|1,0,0]=3 5788 B14R1.103 COc1ccc(c(c1)C)NCC(=O)[O-] 34a_100000750285_100020667443 [0,1,0,0,0,1|1,0,0]=3 5789 B14R1.103 COc1ccc(c(c1)C)NCC(C)C 34a_100000750285_100000210624 [0,1,0,0,0,1|1,0,1]=4 5790 B14R1.103 COc1ccc(c(c1)C)NCC(C)O 34a_100000750285_100011218427 [0,1,0,0,0,1|0,0,2]=4 5791 B14R1.103 COc1ccc(c(c1)C)NC[C@@H](C)O 34a_100000750285_100009817552 [0,1,0,0,0,1|0,0,2]=4 5792 B14R1.103 COc1ccc(c(c1)C)NC[N+](=O)[O-] 34a_100000750285_100000761209 [0,1,0,0,0,1|2,0,0]=4 5793 B14R1.103 COc1ccc(c(c1)C)NNC(=O)C 22a_115082355441_100000070787 [0,1,0,0,0,1|1,0,0]=3 5794 B14R1.103 COc1ccc(c(c1)C)OCC(=O)N 34a_100012002223_100000187820 [0,1,0,0,0,1|1,0,0]=3 5795 B14R1.103 COc1ccc(c(c1)C)OCC(=O)N 7a_100012002223_100000187820 [0,1,0,0,0,1|1,0,0]=3 5796 B14R1.103 COc1ccc(c(c1)C)OCC(=O)[O-] 34a_100012002223_100020667443 [0,1,0,0,0,1|1,0,0]=3 5797 B14R1.103 COc1ccc(c(c1)C)OCC(C)C 34a_100012002223_100000210624 [0,1,0,0,0,1|1,0,1]=4 5798 B14R1.103 COc1ccc(c(c1)C)OCC(C)C 7a_100012002223_100000210760 [0,1,0,0,0,1|1,0,1]=4 5799 B14R1.103 COc1ccc(c(c1)C)OCC(C)O 34a_100012002223_100011218427 [0,1,0,0,0,1|0,0,2]=4 5800 B14R1.103 COc1ccc(c(c1)C)OCC(C)O 7a_100012002223_100011218427 [0,1,0,0,0,1|0,0,2]=4 5801 B14R1.103 COc1ccc(c(c1)C)OC[C@@H](C)O 34a_100012002223_100009817552 [0,1,0,0,0,1|0,0,2]=4 5802 B14R1.103 COc1ccc(c(c1)C)OC[C@@H](C)O 7a_100012002223_100009817552 [0,1,0,0,0,1|0,0,2]=4 5803 B14R1.103 COc1ccc(c(c1)C)OC[N+](=O)[O-] 34a_100012002223_100000761209 [0,1,0,0,0,1|2,0,0]=4 5804 B14R1.103 COc1ccc(c(c1)C)SCC(=O)N 62a_100000747473_100000759875 [0,1,0,0,0,1|1,0,0]=3 5805 B14R1.103 COc1ccc(c(c1)C)SCC(=O)N 62a_100000759875_100000747473 [0,1,0,0,0,1|1,0,0]=3 5806 B14R1.103 COc1ccc(c(c1)C)SCC(=O)[O-] 62a_100000759875_100020667443 [0,1,0,0,0,1|1,0,0]=3 5807 B14R1.103 COc1ccc(c(c1)C)SCC(=O)[O-] 62a_100020667443_100000759875 [0,1,0,0,0,1|1,0,0]=3 5808 B14R1.103 COc1ccc(c(c1)C)SCC(C)C 62a_100000210624_100000759875 [0,1,0,0,0,1|1,0,1]=4 5809 B14R1.103 COc1ccc(c(c1)C)SCC(C)C 62a_100000759875_100000210760 [0,1,0,0,0,1|1,0,1]=4 5810 B14R1.103 COc1ccc(c(c1)C)SCC(C)O 62a_100000759875_100011218427 [0,1,0,0,0,1|0,0,2]=4 5811 B14R1.103 COc1ccc(c(c1)C)SCC(C)O 62a_100011218427_100000759875 [0,1,0,0,0,1|0,0,2]=4 5812 B14R1.103 COc1ccc(c(c1)C)SC[C@@H](C)O 62a_100000759875_100009817552 [0,1,0,0,0,1|0,0,2]=4 5813 B14R1.103 COc1ccc(c(c1)C)SC[C@@H](C)O 62a_100009817552_100000759875 [0,1,0,0,0,1|0,0,2]=4 5814 B14R1.103 COc1ccc(c(c1)C)SC[N+](=O)[O-] 62a_100000759875_100000761209 [0,1,0,0,0,1|2,0,0]=4 5815 B14R1.103 COc1ccc(c(c1)Cl)CNC(=O)C 11a_100138410423_100015343762 [0,1,0,0,0,1|0,0,0]=2 5816 B14R1.103 COc1ccc(c(c1)Cl)CNC(=O)C 1626a_100138410423_100015343762 [0,1,0,0,0,1|0,0,0]=2 5817 B14R1.103 COc1ccc(c(c1)Cl)CNC(=O)C 240690a_100138410423_100015343762 [0,1,0,0,0,1|0,0,0]=2 5818 B14R1.103 COc1ccc(c(c1)Cl)CNC(=O)C 527a_100138410423_100103153847 [0,1,0,0,0,1|0,0,0]=2 5819 B14R1.103 COc1ccc(c(c1)Cl)CNC(C)C 207a_100138425928_100000235372 [0,1,0,0,0,1|1,0,1]=4 5820 B14R1.103 COc1ccc(c(c1)Cl)CNC(C)C 2230a_100138425928_200011830453 [0,1,0,0,0,1|1,0,1]=4 5821 B14R1.103 COc1ccc(c(c1)Cl)CNC(C)C 34a_100138410423_100000210206 [0,1,0,0,0,1|1,0,1]=4 5822 B14R1.103 COc1ccc(c(c1)Cl)CNC(C)C 34a_100138425928_200011830453 [0,1,0,0,0,1|1,0,1]=4 5823 B14R1.103 COc1ccc(c(c1)Cl)COC(C)C 34a_100000212225_200011830453 [0,1,0,0,0,1|1,0,1]=4 5824 B14R1.103 COc1ccc(c(c1)Cl)COC(C)C 34a_100011982767_100000210206 [0,1,0,0,0,1|1,0,1]=4 5825 B14R1.103 COc1ccc(c(c1)Cl)COC(C)C 7a_100011982767_100000210206 [0,1,0,0,0,1|1,0,1]=4 5826 B14R1.103 COc1ccc(c(c1)Cl)CSC(C)C 62a_100000210206_200011830453 [0,1,0,0,0,1|1,0,1]=4 5827 B14R1.103 COc1ccc(c(c1)Cl)CSC(C)C 62a_200011830453_100000210206 [0,1,0,0,0,1|1,0,1]=4 5828 B14R1.103 COc1ccc(c(c1)Cl)NCC(=O)N 34a_100000747055_100000187820 [0,1,0,0,0,1|1,0,0]=3 5829 B14R1.103 COc1ccc(c(c1)Cl)NCC(=O)[O-] 34a_100000747055_100020667443 [0,1,0,0,0,1|1,0,0]=3 5830 B14R1.103 COc1ccc(c(c1)Cl)NCC(C)C 34a_100000747055_100000210624 [0,1,0,0,0,1|1,0,1]=4 5831 B14R1.103 COc1ccc(c(c1)Cl)NCC(C)O 34a_100000747055_100011218427 [0,1,0,0,0,1|0,0,2]=4 5832 B14R1.103 COc1ccc(c(c1)Cl)NC[C@@H](C)O 34a_100000747055_100009817552 [0,1,0,0,0,1|0,0,2]=4 5833 B14R1.103 COc1ccc(c(c1)Cl)NC[N+](=O)[O-] 34a_100000747055_100000761209 [0,1,0,0,0,1|2,0,0]=4 5834 B14R1.103 COc1ccc(c(c1)Cl)OCC(=O)N 34a_100000038596_100000187820 [0,1,0,0,0,1|1,0,0]=3 5835 B14R1.103 COc1ccc(c(c1)Cl)OCC(=O)N 7a_100000038596_100000187820 [0,1,0,0,0,1|1,0,0]=3 5836 B14R1.103 COc1ccc(c(c1)Cl)OCC(=O)[O-] 34a_100000038596_100020667443 [0,1,0,0,0,1|1,0,0]=3 5837 B14R1.103 COc1ccc(c(c1)Cl)OCC(C)C 34a_100000038596_100000210624 [0,1,0,0,0,1|1,0,1]=4 5838 B14R1.103 COc1ccc(c(c1)Cl)OCC(C)C 7a_100000038596_100000210760 [0,1,0,0,0,1|1,0,1]=4 5839 B14R1.103 COc1ccc(c(c1)Cl)OCC(C)O 34a_100000038596_100011218427 [0,1,0,0,0,1|0,0,2]=4 5840 B14R1.103 COc1ccc(c(c1)Cl)OCC(C)O 7a_100000038596_100011218427 [0,1,0,0,0,1|0,0,2]=4 5841 B14R1.103 COc1ccc(c(c1)Cl)OC[C@@H](C)O 34a_100000038596_100009817552 [0,1,0,0,0,1|0,0,2]=4 5842 B14R1.103 COc1ccc(c(c1)Cl)OC[C@@H](C)O 7a_100000038596_100009817552 [0,1,0,0,0,1|0,0,2]=4 5843 B14R1.103 COc1ccc(c(c1)Cl)OC[N+](=O)[O-] 34a_100000038596_100000761209 [0,1,0,0,0,1|2,0,0]=4 5844 B14R1.103 COc1ccc(c(c1)F)C=CC(=O)C 1458a_200102525171_200000210301 [0,1,0,0,0,1|0,0,1]=3 5845 B14R1.103 COc1ccc(c(c1)F)C=CC(=O)[13CH3] 1458a_200102525171_200025704644 [0,1,0,0,0,1|0,0,1]=3 5846 B14R1.103 COc1ccc(c(c1)F)CCC(=O)C 1458a_200012180015_200000210301 [0,1,0,0,0,1|0,0,0]=2 5847 B14R1.103 COc1ccc(c(c1)F)CCC(=O)[13CH3] 1458a_200012180015_200025704644 [0,1,0,0,0,1|0,0,0]=2 5848 B14R1.103 COc1ccc(c(c1)F)CNC(=O)C 11a_100000687396_100015343762 [0,1,0,0,0,1|0,0,0]=2 5849 B14R1.103 COc1ccc(c(c1)F)CNC(=O)C 1626a_100000687396_100015343762 [0,1,0,0,0,1|0,0,0]=2 5850 B14R1.103 COc1ccc(c(c1)F)CNC(=O)C 240690a_100000687396_100015343762 [0,1,0,0,0,1|0,0,0]=2 5851 B14R1.103 COc1ccc(c(c1)F)CNC(=O)C 527a_100000687396_100103153847 [0,1,0,0,0,1|0,0,0]=2 5852 B14R1.103 COc1ccc(c(c1)F)CNC(C)C 207a_100138425928_100011216087 [0,1,0,0,0,1|1,0,1]=4 5853 B14R1.103 COc1ccc(c(c1)F)CNC(C)C 2230a_100138425928_100011260761 [0,1,0,0,0,1|1,0,1]=4 5854 B14R1.103 COc1ccc(c(c1)F)CNC(C)C 34a_100000687396_100000210206 [0,1,0,0,0,1|1,0,1]=4 5855 B14R1.103 COc1ccc(c(c1)F)CNC(C)C 34a_100138425928_100011260761 [0,1,0,0,0,1|1,0,1]=4 5856 B14R1.103 COc1ccc(c(c1)F)COC(C)C 34a_100000212225_100011260761 [0,1,0,0,0,1|1,0,1]=4 5857 B14R1.103 COc1ccc(c(c1)F)COC(C)C 34a_100011830421_100000210206 [0,1,0,0,0,1|1,0,1]=4 5858 B14R1.103 COc1ccc(c(c1)F)COC(C)C 7a_100011830421_100000210206 [0,1,0,0,0,1|1,0,1]=4 5859 B14R1.103 COc1ccc(c(c1)F)CSC(C)C 62a_100000210206_100011260761 [0,1,0,0,0,1|1,0,1]=4 5860 B14R1.103 COc1ccc(c(c1)F)CSC(C)C 62a_100011260761_100000210206 [0,1,0,0,0,1|1,0,1]=4 5861 B14R1.103 COc1ccc(c(c1)F)NCC(=O)N 34a_100011299463_100000187820 [0,1,0,0,0,1|1,0,0]=3 5862 B14R1.103 COc1ccc(c(c1)F)NCC(=O)[O-] 34a_100011299463_100020667443 [0,1,0,0,0,1|1,0,0]=3 5863 B14R1.103 COc1ccc(c(c1)F)NCC(C)C 34a_100011299463_100000210624 [0,1,0,0,0,1|1,0,1]=4 5864 B14R1.103 COc1ccc(c(c1)F)NCC(C)O 34a_100011299463_100011218427 [0,1,0,0,0,1|0,0,2]=4 5865 B14R1.103 COc1ccc(c(c1)F)NC[C@@H](C)O 34a_100011299463_100009817552 [0,1,0,0,0,1|0,0,2]=4 5866 B14R1.103 COc1ccc(c(c1)F)NC[N+](=O)[O-] 34a_100011299463_100000761209 [0,1,0,0,0,1|2,0,0]=4 5867 B14R1.103 COc1ccc(c(c1)F)NNC(=O)C 22a_100015191252_100000070787 [0,1,0,0,0,1|1,0,0]=3 5868 B14R1.103 COc1ccc(c(c1)F)OCC(=O)N 34a_100000036999_100000187820 [0,1,0,0,0,1|1,0,0]=3 5869 B14R1.103 COc1ccc(c(c1)F)OCC(=O)N 7a_100000036999_100000187820 [0,1,0,0,0,1|1,0,0]=3 5870 B14R1.103 COc1ccc(c(c1)F)OCC(=O)[O-] 34a_100000036999_100020667443 [0,1,0,0,0,1|1,0,0]=3 5871 B14R1.103 COc1ccc(c(c1)F)OCC(C)C 34a_100000036999_100000210624 [0,1,0,0,0,1|1,0,1]=4 5872 B14R1.103 COc1ccc(c(c1)F)OCC(C)C 7a_100000036999_100000210760 [0,1,0,0,0,1|1,0,1]=4 5873 B14R1.103 COc1ccc(c(c1)F)OCC(C)O 34a_100000036999_100011218427 [0,1,0,0,0,1|0,0,2]=4 5874 B14R1.103 COc1ccc(c(c1)F)OCC(C)O 7a_100000036999_100011218427 [0,1,0,0,0,1|0,0,2]=4 5875 B14R1.103 COc1ccc(c(c1)F)OC[C@@H](C)O 34a_100000036999_100009817552 [0,1,0,0,0,1|0,0,2]=4 5876 B14R1.103 COc1ccc(c(c1)F)OC[C@@H](C)O 7a_100000036999_100009817552 [0,1,0,0,0,1|0,0,2]=4 5877 B14R1.103 COc1ccc(c(c1)F)OC[N+](=O)[O-] 34a_100000036999_100000761209 [0,1,0,0,0,1|2,0,0]=4 5878 B14R1.103 COc1ccc(c(c1)F)SCC(=O)N 62a_100000747473_100000753793 [0,1,0,0,0,1|1,0,0]=3 5879 B14R1.103 COc1ccc(c(c1)F)SCC(=O)N 62a_100000753793_100000747473 [0,1,0,0,0,1|1,0,0]=3 5880 B14R1.103 COc1ccc(c(c1)F)SCC(=O)[O-] 62a_100000753793_100020667443 [0,1,0,0,0,1|1,0,0]=3 5881 B14R1.103 COc1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_100000753793 [0,1,0,0,0,1|1,0,0]=3 5882 B14R1.103 COc1ccc(c(c1)F)SCC(C)C 62a_100000210624_100000753793 [0,1,0,0,0,1|1,0,1]=4 5883 B14R1.103 COc1ccc(c(c1)F)SCC(C)C 62a_100000753793_100000210760 [0,1,0,0,0,1|1,0,1]=4 5884 B14R1.103 COc1ccc(c(c1)F)SCC(C)O 62a_100000753793_100011218427 [0,1,0,0,0,1|0,0,2]=4 5885 B14R1.103 COc1ccc(c(c1)F)SCC(C)O 62a_100011218427_100000753793 [0,1,0,0,0,1|0,0,2]=4 5886 B14R1.103 COc1ccc(c(c1)F)SC[C@@H](C)O 62a_100000753793_100009817552 [0,1,0,0,0,1|0,0,2]=4 5887 B14R1.103 COc1ccc(c(c1)F)SC[C@@H](C)O 62a_100009817552_100000753793 [0,1,0,0,0,1|0,0,2]=4 5888 B14R1.103 COc1ccc(c(c1)F)SC[N+](=O)[O-] 62a_100000753793_100000761209 [0,1,0,0,0,1|2,0,0]=4 5889 B14R1.103 COc1ccc(c(c1)I)CNC(C)C 207a_100138425928_100010159643 [0,1,0,0,0,1|1,0,1]=4 5890 B14R1.103 COc1ccc(c(c1)I)NCC(=O)N 34a_100000049804_100000187820 [0,1,0,0,0,1|1,0,0]=3 5891 B14R1.103 COc1ccc(c(c1)I)NCC(=O)[O-] 34a_100000049804_100020667443 [0,1,0,0,0,1|1,0,0]=3 5892 B14R1.103 COc1ccc(c(c1)I)NCC(C)C 34a_100000049804_100000210624 [0,1,0,0,0,1|1,0,1]=4 5893 B14R1.103 COc1ccc(c(c1)I)NCC(C)O 34a_100000049804_100011218427 [0,1,0,0,0,1|0,0,2]=4 5894 B14R1.103 COc1ccc(c(c1)I)NC[C@@H](C)O 34a_100000049804_100009817552 [0,1,0,0,0,1|0,0,2]=4 5895 B14R1.103 COc1ccc(c(c1)I)NC[N+](=O)[O-] 34a_100000049804_100000761209 [0,1,0,0,0,1|2,0,0]=4 5896 B14R1.103 COc1ccc(c(c1)N)COC(C)C 34a_100011998734_100000210206 [0,1,0,0,0,1|1,0,1]=4 5897 B14R1.103 COc1ccc(c(c1)N)OCC(=O)N 34a_100000188146_100000187820 [0,1,0,0,0,1|1,0,0]=3 5898 B14R1.103 COc1ccc(c(c1)N)OCC(=O)[O-] 34a_100000188146_100020667443 [0,1,0,0,0,1|1,0,0]=3 5899 B14R1.103 COc1ccc(c(c1)N)OCC(C)C 34a_100000188146_100000210624 [0,1,0,0,0,1|1,0,1]=4 5900 B14R1.103 COc1ccc(c(c1)N)OCC(C)O 34a_100000188146_100011218427 [0,1,0,0,0,1|0,0,2]=4 5901 B14R1.103 COc1ccc(c(c1)N)OC[C@@H](C)O 34a_100000188146_100009817552 [0,1,0,0,0,1|0,0,2]=4 5902 B14R1.103 COc1ccc(c(c1)N)OC[N+](=O)[O-] 34a_100000188146_100000761209 [0,1,0,0,0,1|2,0,0]=4 5903 B14R1.103 COc1ccc(c(c1)N)SCC(=O)N 62a_100000747473_100000748021 [0,1,0,0,0,1|1,0,0]=3 5904 B14R1.103 COc1ccc(c(c1)N)SCC(=O)N 62a_100000748021_100000747473 [0,1,0,0,0,1|1,0,0]=3 5905 B14R1.103 COc1ccc(c(c1)N)SCC(=O)[O-] 62a_100000748021_100020667443 [0,1,0,0,0,1|1,0,0]=3 5906 B14R1.103 COc1ccc(c(c1)N)SCC(=O)[O-] 62a_100020667443_100000748021 [0,1,0,0,0,1|1,0,0]=3 5907 B14R1.103 COc1ccc(c(c1)N)SCC(C)C 62a_100000210624_100000748021 [0,1,0,0,0,1|1,0,1]=4 5908 B14R1.103 COc1ccc(c(c1)N)SCC(C)C 62a_100000748021_100000210760 [0,1,0,0,0,1|1,0,1]=4 5909 B14R1.103 COc1ccc(c(c1)N)SCC(C)O 62a_100000748021_100011218427 [0,1,0,0,0,1|0,0,2]=4 5910 B14R1.103 COc1ccc(c(c1)N)SCC(C)O 62a_100011218427_100000748021 [0,1,0,0,0,1|0,0,2]=4 5911 B14R1.103 COc1ccc(c(c1)N)SC[C@@H](C)O 62a_100000748021_100009817552 [0,1,0,0,0,1|0,0,2]=4 5912 B14R1.103 COc1ccc(c(c1)N)SC[C@@H](C)O 62a_100009817552_100000748021 [0,1,0,0,0,1|0,0,2]=4 5913 B14R1.103 COc1ccc(c(c1)N)SC[N+](=O)[O-] 62a_100000748021_100000761209 [0,1,0,0,0,1|2,0,0]=4 5914 B14R1.103 COc1ccc(c(c1)O)NCC(=O)N 34a_100016989039_100000187820 [0,1,0,0,0,1|1,0,0]=3 5915 B14R1.103 COc1ccc(c(c1)O)NCC(=O)[O-] 34a_100016989039_100020667443 [0,1,0,0,0,1|1,0,0]=3 5916 B14R1.103 COc1ccc(c(c1)O)NCC(C)C 34a_100016989039_100000210624 [0,1,0,0,0,1|1,0,1]=4 5917 B14R1.103 COc1ccc(c(c1)O)NCC(C)O 34a_100016989039_100011218427 [0,1,0,0,0,1|0,0,2]=4 5918 B14R1.103 COc1ccc(c(c1)O)NC[C@@H](C)O 34a_100016989039_100009817552 [0,1,0,0,0,1|0,0,2]=4 5919 B14R1.103 COc1ccc(c(c1)O)NC[N+](=O)[O-] 34a_100016989039_100000761209 [0,1,0,0,0,1|2,0,0]=4 5920 B14R1.103 COc1ccc(c(c1)O)SCC(=O)N 62a_100000747473_100000719091 [0,1,0,0,0,1|1,0,0]=3 5921 B14R1.103 COc1ccc(c(c1)O)SCC(=O)[O-] 62a_100020667443_100000719091 [0,1,0,0,0,1|1,0,0]=3 5922 B14R1.103 COc1ccc(c(c1)O)SCC(C)C 62a_100000210624_100000719091 [0,1,0,0,0,1|1,0,1]=4 5923 B14R1.103 COc1ccc(c(c1)O)SCC(C)O 62a_100011218427_100000719091 [0,1,0,0,0,1|0,0,2]=4 5924 B14R1.103 COc1ccc(c(c1)O)SC[C@@H](C)O 62a_100009817552_100000719091 [0,1,0,0,0,1|0,0,2]=4 5925 B14R1.103 COc1ccc(c(n1)C)OCC(=O)N 34a_200009873766_100000187820 [0,1,0,0,0,1|2,0,0]=4 5926 B14R1.103 COc1ccc(c(n1)C)OCC(=O)[O-] 34a_200009873766_100020667443 [0,1,0,0,0,1|2,0,0]=4 5927 B14R1.103 COc1ccc(c(n1)C)SCC(=O)N 62a_100000747473_100000766551 [0,1,0,0,0,1|2,0,0]=4 5928 B14R1.103 COc1ccc(c(n1)C)SCC(=O)N 62a_100000766551_100000747473 [0,1,0,0,0,1|2,0,0]=4 5929 B14R1.103 COc1ccc(c(n1)C)SCC(=O)[O-] 62a_100000766551_100020667443 [0,1,0,0,0,1|2,0,0]=4 5930 B14R1.103 COc1ccc(c(n1)C)SCC(=O)[O-] 62a_100020667443_100000766551 [0,1,0,0,0,1|2,0,0]=4 5931 B14R1.103 COc1ccc(c(n1)F)SCC(=O)N 62a_100000747473_100010067559 [0,1,0,0,0,1|2,0,0]=4 5932 B14R1.103 COc1ccc(c(n1)F)SCC(=O)N 62a_100010067559_100000747473 [0,1,0,0,0,1|2,0,0]=4 5933 B14R1.103 COc1ccc(c(n1)F)SCC(=O)[O-] 62a_100010067559_100020667443 [0,1,0,0,0,1|2,0,0]=4 5934 B14R1.103 COc1ccc(c(n1)F)SCC(=O)[O-] 62a_100020667443_100010067559 [0,1,0,0,0,1|2,0,0]=4 5935 B14R1.103 COc1ccc(c(n1)N)SCC(=O)N 62a_100010187629_100000747473 [0,1,0,0,0,1|2,0,0]=4 5936 B14R1.103 COc1ccc(c(n1)N)SCC(=O)[O-] 62a_100010187629_100020667443 [0,1,0,0,0,1|2,0,0]=4 5937 B14R1.103 COc1cnc(c(c1)C)CNC(=O)C 11a_200009843444_100015343762 [0,1,0,0,0,1|1,0,0]=3 5938 B14R1.103 COc1cnc(c(c1)C)CNC(=O)C 1626a_200009843444_100015343762 [0,1,0,0,0,1|1,0,0]=3 5939 B14R1.103 COc1cnc(c(c1)C)CNC(=O)C 240690a_200009843444_100015343762 [0,1,0,0,0,1|1,0,0]=3 5940 B14R1.103 COc1cnc(c(c1)C)CNC(=O)C 527a_200009843444_100103153847 [0,1,0,0,0,1|1,0,0]=3 5941 B14R1.103 COc1cnc(c(c1)C)SCC(=O)N 62a_100000747473_200009851512 [0,1,0,0,0,1|2,0,0]=4 5942 B14R1.103 COc1cnc(c(c1)C)SCC(=O)[O-] 62a_100020667443_200009851512 [0,1,0,0,0,1|2,0,0]=4 5943 B14R1.103 COc1cnc(c(c1)N)SCC(=O)N 62a_100000747473_100010074831 [0,1,0,0,0,1|2,0,0]=4 5944 B14R1.103 COc1cnc(c(c1)N)SCC(=O)N 62a_100010074831_100000747473 [0,1,0,0,0,1|2,0,0]=4 5945 B14R1.103 COc1cnc(c(c1)N)SCC(=O)[O-] 62a_100010074831_100020667443 [0,1,0,0,0,1|2,0,0]=4 5946 B14R1.103 COc1cnc(c(c1)N)SCC(=O)[O-] 62a_100020667443_100010074831 [0,1,0,0,0,1|2,0,0]=4 5947 B14R1.103 CSc1ccc(c(c1)F)NCC(=O)N 34a_100012056844_100000187820 [0,1,0,0,0,1|1,1,0]=4 5948 B14R1.103 CSc1ccc(c(c1)F)NCC(=O)[O-] 34a_100012056844_100020667443 [0,1,0,0,0,1|1,1,0]=4 5949 B14R1.103 CSc1ccc(c(c1)F)SCC(=O)N 62a_100000747473_100009816902 [0,1,0,0,0,1|1,1,0]=4 5950 B14R1.103 CSc1ccc(c(c1)F)SCC(=O)N 62a_100009816902_100000747473 [0,1,0,0,0,1|1,1,0]=4 5951 B14R1.103 CSc1ccc(c(c1)F)SCC(=O)[O-] 62a_100009816902_100020667443 [0,1,0,0,0,1|1,1,0]=4 5952 B14R1.103 CSc1ccc(c(c1)F)SCC(=O)[O-] 62a_100020667443_100009816902 [0,1,0,0,0,1|1,1,0]=4 5953 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)N 62a_100000747473_100016259036 [0,1,0,0,0,1|2,0,0]=4 5954 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)N 62a_100016259036_100000747473 [0,1,0,0,0,1|2,0,0]=4 5955 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_100016259036_100020667443 [0,1,0,0,0,1|2,0,0]=4 5956 B14R1.142 C/C=C/c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100016259036 [0,1,0,0,0,1|2,0,0]=4 5957 B14R1.142 C=C(C)CNc1ccc(cc1)CCC 2230a_100000211780_100000748629 [0,1,0,0,0,1|2,0,0]=4 5958 B14R1.142 C=C(C)CNc1ccc(cc1)CCC 34a_100000211780_100000748629 [0,1,0,0,0,1|2,0,0]=4 5959 B14R1.142 C=C(C)CNc1ccc(cc1)CCO 2230a_100011204434_100000748629 [0,1,0,0,0,1|2,0,0]=4 5960 B14R1.142 C=C(C)CNc1ccc(cc1)CCO 34a_100011204434_100000748629 [0,1,0,0,0,1|2,0,0]=4 5961 B14R1.142 C=C(C)CNc1ccc(cc1)COC 34a_100000694113_100000748629 [0,1,0,0,0,1|1,0,0]=3 5962 B14R1.142 C=C(C)CNc1ccc(cc1)CSC 2230a_106726388226_100000748629 [0,1,0,0,0,1|1,1,0]=4 5963 B14R1.142 C=C(C)CNc1ccc(cc1)CSC 34a_106726388226_100000748629 [0,1,0,0,0,1|1,1,0]=4 5964 B14R1.142 C=C(C)CNc1ccc(cc1)CSC 7a_106726388226_100000748629 [0,1,0,0,0,1|1,1,0]=4 5965 B14R1.142 C=C(C)CNc1ccc(cc1)OCC 2230a_100000739623_100000748629 [0,1,0,0,0,1|1,0,0]=3 5966 B14R1.142 C=C(C)CNc1ccc(cc1)OCC 34a_100000739623_100000748629 [0,1,0,0,0,1|1,0,0]=3 5967 B14R1.142 C=C(C)CNc1ccc(cc1)SCC 34a_100015187087_100000748629 [0,1,0,0,0,1|1,1,0]=4 5968 B14R1.142 C=C(C)COc1ccc(cc1)CCBr 34a_100009816426_100000748629 [0,1,0,0,0,1|2,0,0]=4 5969 B14R1.142 C=C(C)COc1ccc(cc1)CCBr 7a_100009816426_100000748629 [0,1,0,0,0,1|2,0,0]=4 5970 B14R1.142 C=C(C)COc1ccc(cc1)CCC 34a_100000749406_100000748629 [0,1,0,0,0,1|2,0,0]=4 5971 B14R1.142 C=C(C)COc1ccc(cc1)CCC 7a_100000749406_100000748629 [0,1,0,0,0,1|2,0,0]=4 5972 B14R1.142 C=C(C)COc1ccc(cc1)CCN 34a_100000743037_100000748629 [0,1,0,0,0,1|2,0,0]=4 5973 B14R1.142 C=C(C)COc1ccc(cc1)CCO 34a_100011215338_100000748629 [0,1,0,0,0,1|2,0,0]=4 5974 B14R1.142 C=C(C)COc1ccc(cc1)CCO 7a_100011215338_100000748629 [0,1,0,0,0,1|2,0,0]=4 5975 B14R1.142 C=C(C)COc1ccc(cc1)CNC 207a_100102657272_200000171501 [0,1,0,0,0,1|2,0,0]=4 5976 B14R1.142 C=C(C)COc1ccc(cc1)CNC 270004a_106832991635_200000171501 [0,1,0,0,0,1|2,0,0]=4 5977 B14R1.142 C=C(C)COc1ccc(cc1)CNC 34a_100000207500_100000748629 [0,1,0,0,0,1|2,0,0]=4 5978 B14R1.142 C=C(C)COc1ccc(cc1)COC 34a_100000173090_200000210301 [0,1,0,0,0,1|1,0,0]=3 5979 B14R1.142 C=C(C)COc1ccc(cc1)COC 34a_200011995677_100000748629 [0,1,0,0,0,1|1,0,0]=3 5980 B14R1.142 C=C(C)COc1ccc(cc1)COC 7a_100000173090_200000210301 [0,1,0,0,0,1|1,0,0]=3 5981 B14R1.142 C=C(C)COc1ccc(cc1)COC 7a_200011995677_100000748629 [0,1,0,0,0,1|1,0,0]=3 5982 B14R1.142 C=C(C)COc1ccc(cc1)CO[13CH3] 34a_100000173090_200025704644 [0,1,0,0,0,1|1,0,0]=3 5983 B14R1.142 C=C(C)COc1ccc(cc1)CO[13CH3] 7a_100000173090_200025704644 [0,1,0,0,0,1|1,0,0]=3 5984 B14R1.142 C=C(C)COc1ccc(cc1)NCC 2230a_200015186533_100000210202 [0,1,0,0,0,1|2,0,0]=4 5985 B14R1.142 C=C(C)COc1ccc(cc1)NCC 34a_100011337800_100000748629 [0,1,0,0,0,1|2,0,0]=4 5986 B14R1.142 C=C(C)COc1ccc(cc1)NCC 34a_200015186533_100000210202 [0,1,0,0,0,1|2,0,0]=4 5987 B14R1.142 C=C(C)COc1ccc(cc1)NCC 7a_100011337800_100000748629 [0,1,0,0,0,1|2,0,0]=4 5988 B14R1.142 C=C(C)COc1ccc(cc1)NCF 34a_200015186533_100015361967 [0,1,0,0,0,1|2,0,0]=4 5989 B14R1.142 C=C(C)COc1ccc(cc1)OCC 34a_100000185467_100000748629 [0,1,0,0,0,1|1,0,0]=3 5990 B14R1.142 C=C(C)CSc1ccc(cc1)/C=C/C 62a_100000748629_100016259036 [0,1,0,0,0,1|2,0,0]=4 5991 B14R1.142 C=C(C)CSc1ccc(cc1)/C=C/C 62a_100016259036_100000211660 [0,1,0,0,0,1|2,0,0]=4 5992 B14R1.142 C=C(C)CSc1ccc(cc1)CCC 62a_100000748629_100000750032 [0,1,0,0,0,1|2,0,0]=4 5993 B14R1.142 C=C(C)CSc1ccc(cc1)CCC 62a_100000750032_100000211660 [0,1,0,0,0,1|2,0,0]=4 5994 B14R1.142 C=C(C)CSc1ccc(cc1)CCN 62a_100000748629_100000755846 [0,1,0,0,0,1|2,0,0]=4 5995 B14R1.142 C=C(C)CSc1ccc(cc1)CCN 62a_100000755846_100000211660 [0,1,0,0,0,1|2,0,0]=4 5996 B14R1.142 C=C(C)CSc1ccc(cc1)CCO 62a_100000748629_100000766406 [0,1,0,0,0,1|2,0,0]=4 5997 B14R1.142 C=C(C)CSc1ccc(cc1)CCO 62a_100000766406_100000211660 [0,1,0,0,0,1|2,0,0]=4 5998 B14R1.142 C=C(C)CSc1ccc(cc1)CNC 62a_100000180866_100000211660 [0,1,0,0,0,1|2,0,0]=4 5999 B14R1.142 C=C(C)CSc1ccc(cc1)CNC 62a_100000748629_100000180866 [0,1,0,0,0,1|2,0,0]=4 6000 B14R1.142 C=C(C)CSc1ccc(cc1)COC 62a_100000748629_100011493685 [0,1,0,0,0,1|1,0,0]=3 6001 B14R1.142 C=C(C)CSc1ccc(cc1)COC 62a_100011493685_100000211660 [0,1,0,0,0,1|1,0,0]=3 6002 B14R1.142 C=C(C)CSc1ccc(cc1)NCC 62a_100000748629_100000219632 [0,1,0,0,0,1|2,0,0]=4 6003 B14R1.142 C=C(C)CSc1ccc(cc1)OCC 62a_100000748629_100000171712 [0,1,0,0,0,1|1,0,0]=3 6004 B14R1.142 C=C(C)CSc1ccc(cc1)SCC 62a_100000748629_200009811893 [0,1,0,0,0,1|1,1,0]=4 6005 B14R1.142 C=C(C)CSc1ccc(cc1)SCC 62a_200009811893_100000211660 [0,1,0,0,0,1|1,1,0]=4 6006 B14R1.142 C=C(C)CSc1ccc(cn1)OCC 62a_100000748629_100000753957 [0,1,0,0,0,1|2,0,0]=4 6007 B14R1.142 C=C(C)CSc1ccc(cn1)OCC 62a_100012355646_100000211660 [0,1,0,0,0,1|2,0,0]=4 6008 B14R1.142 C=C(C)CSc1ccc(nc1)OCC 62a_100000748629_100011219444 [0,1,0,0,0,1|2,0,0]=4 6009 B14R1.142 C=C(C)CSc1ccc(nc1)OCC 62a_100011219444_100000211660 [0,1,0,0,0,1|2,0,0]=4 6010 B14R1.142 C=C(F)CNc1ccc(cc1)COC 34a_100000694113_100009893438 [0,1,0,0,0,1|1,0,1]=4 6011 B14R1.142 C=C(F)CNc1ccc(cc1)OCC 2230a_100000739623_100009893438 [0,1,0,0,0,1|1,0,1]=4 6012 B14R1.142 C=C(F)CNc1ccc(cc1)OCC 34a_100000739623_100009893438 [0,1,0,0,0,1|1,0,1]=4 6013 B14R1.142 C=C(F)COc1ccc(cc1)COC 34a_200011995677_100009893438 [0,1,0,0,0,1|1,0,1]=4 6014 B14R1.142 C=C(F)COc1ccc(cc1)COC 7a_200011995677_100000042424 [0,1,0,0,0,1|1,0,1]=4 6015 B14R1.142 C=C(F)COc1ccc(cc1)OCC 34a_100000185467_100009893438 [0,1,0,0,0,1|1,0,1]=4 6016 B14R1.142 C=C(F)CSc1ccc(cc1)COC 62a_100000042424_100011493685 [0,1,0,0,0,1|1,0,1]=4 6017 B14R1.142 C=C(F)CSc1ccc(cc1)COC 62a_100011493685_100000042424 [0,1,0,0,0,1|1,0,1]=4 6018 B14R1.142 C=C(F)CSc1ccc(cc1)OCC 62a_100000042424_100000171712 [0,1,0,0,0,1|1,0,1]=4 6019 B14R1.142 C=C=Cc1ccc(cc1)CCC(=O)C 271570a_100015277604_100000723691 [0,1,0,0,0,1|1,0,1]=4 6020 B14R1.142 C=C=Cc1ccc(cc1)CNC(=O)C 271570a_100015277604_200000685173 [0,1,0,0,0,1|1,0,1]=4 6021 B14R1.142 C=COc1ccc(cc1)SCC(=C)C 62a_100000704263_100000211660 [0,1,0,0,0,1|1,0,1]=4 6022 B14R1.142 C=COc1ccc(cc1)SCC(=C)C 62a_100000748629_100000704263 [0,1,0,0,0,1|1,0,1]=4 6023 B14R1.142 C=COc1ccc(cc1)SCC(=O)N 62a_100000704263_100000747473 [0,1,0,0,0,1|1,0,1]=4 6024 B14R1.142 C=COc1ccc(cc1)SCC(=O)N 62a_100000747473_100000704263 [0,1,0,0,0,1|1,0,1]=4 6025 B14R1.142 C=COc1ccc(cc1)SCC(=O)[O-] 62a_100000704263_100020667443 [0,1,0,0,0,1|1,0,1]=4 6026 B14R1.142 C=COc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000704263 [0,1,0,0,0,1|1,0,1]=4 6027 B14R1.142 CC(=O)/C=C/c1ccc(cc1)OCF 34a_100000189429_100015361967 [0,1,0,0,0,1|0,0,1]=3 6028 B14R1.142 CC(=O)/C=C/c1ccc(cc1)SCF 62a_100015361967_200016259395 [0,1,0,0,0,1|0,1,1]=4 6029 B14R1.142 CC(=O)/C=C/c1ccc(cc1)SCF 62a_200016259395_100015361967 [0,1,0,0,0,1|0,1,1]=4 6030 B14R1.142 CC(=O)CCc1ccc(cc1)OCF 34a_100000198047_100015361967 [0,1,0,0,0,1|0,0,0]=2 6031 B14R1.142 CC(=O)CCc1ccc(cc1)OCF 7a_100000198047_100015361967 [0,1,0,0,0,1|0,0,0]=2 6032 B14R1.142 CC(=O)CCc1ccc(cc1)SCF 62a_100000723691_100015361967 [0,1,0,0,0,1|0,1,0]=3 6033 B14R1.142 CC(=O)CCc1ccc(cc1)SCF 62a_100015361967_100000723691 [0,1,0,0,0,1|0,1,0]=3 6034 B14R1.142 CC(=O)COc1ccc(cc1)CC#N 1458a_100000745489_200000210301 [0,1,0,0,0,1|1,0,1]=4 6035 B14R1.142 CC(=O)NCc1ccc(cc1)NCF 34a_100000755463_100015361967 [0,1,0,0,0,1|1,0,0]=3 6036 B14R1.142 CC(=O)NCc1ccc(cc1)SCF 62a_100015361967_200000685173 [0,1,0,0,0,1|0,1,0]=3 6037 B14R1.142 CC(=O)NCc1ccc(cc1)SCF 62a_200000685173_100015361967 [0,1,0,0,0,1|0,1,0]=3 6038 B14R1.142 CC(=O)NNc1ccc(cc1)SCF 62a_100015361967_200009815283 [0,1,0,0,0,1|1,1,0]=4 6039 B14R1.142 CC(=O)NNc1ccc(cc1)SCF 62a_200009815283_100015361967 [0,1,0,0,0,1|1,1,0]=4 6040 B14R1.142 CC(O)CCc1ccc(cc1)OCF 34a_100000189425_100015361967 [0,1,0,0,0,1|0,0,2]=4 6041 B14R1.142 CC(O)CCc1ccc(cc1)OCF 7a_100000189425_100015361967 [0,1,0,0,0,1|0,0,2]=4 6042 B14R1.142 CC=Cc1ccc(cc1)/C=C/C(=O)C 271570a_100016259895_200016259395 [0,1,0,0,0,1|1,0,1]=4 6043 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)C 271570a_100016259895_100000723691 [0,1,0,0,0,1|1,0,0]=3 6044 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)N 271570a_100016259895_200010110666 [0,1,0,0,0,1|2,0,0]=4 6045 B14R1.142 CC=Cc1ccc(cc1)CNC(=O)C 271570a_100016259895_200000685173 [0,1,0,0,0,1|1,0,0]=3 6046 B14R1.142 CC=Cc1ccc(cc1)NNC(=O)C 271570a_100016259895_200009815283 [0,1,0,0,0,1|2,0,0]=4 6047 B14R1.142 CC=Cc1ccc(cc1)SCC(=O)N 271570a_100016259895_100000149456 [0,1,0,0,0,1|2,0,0]=4 6048 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 11a_100020632977_100015343762 [0,1,0,0,0,1|1,0,0]=3 6049 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 1626a_100020632977_100015343762 [0,1,0,0,0,1|1,0,0]=3 6050 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 240690a_100020632977_100015343762 [0,1,0,0,0,1|1,0,0]=3 6051 B14R1.142 CCCc1ccc(cc1)CNC(=O)C 527a_100020632977_100103153847 [0,1,0,0,0,1|1,0,0]=3 6052 B14R1.142 CCCc1ccc(cc1)NCC(=O)N 2230a_100000211780_100000747473 [0,1,0,0,0,1|2,0,0]=4 6053 B14R1.142 CCCc1ccc(cc1)NCC(=O)N 34a_100000211780_100000187820 [0,1,0,0,0,1|2,0,0]=4 6054 B14R1.142 CCCc1ccc(cc1)NCC(=O)[O-] 34a_100000211780_100020667443 [0,1,0,0,0,1|2,0,0]=4 6055 B14R1.142 CCCc1ccc(cc1)NNC(=O)C 22a_100015306804_100000070787 [0,1,0,0,0,1|2,0,0]=4 6056 B14R1.142 CCCc1ccc(cc1)OCC(=O)N 34a_100000749406_100000187820 [0,1,0,0,0,1|2,0,0]=4 6057 B14R1.142 CCCc1ccc(cc1)OCC(=O)N 7a_100000749406_100000187820 [0,1,0,0,0,1|2,0,0]=4 6058 B14R1.142 CCCc1ccc(cc1)OCC(=O)[O-] 34a_100000749406_100020667443 [0,1,0,0,0,1|2,0,0]=4 6059 B14R1.142 CCCc1ccc(cc1)SCC(=O)N 62a_100000747473_100000750032 [0,1,0,0,0,1|2,0,0]=4 6060 B14R1.142 CCCc1ccc(cc1)SCC(=O)N 62a_100000750032_100000747473 [0,1,0,0,0,1|2,0,0]=4 6061 B14R1.142 CCCc1ccc(cc1)SCC(=O)[O-] 62a_100000750032_100020667443 [0,1,0,0,0,1|2,0,0]=4 6062 B14R1.142 CCCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000750032 [0,1,0,0,0,1|2,0,0]=4 6063 B14R1.142 CCNc1ccc(cc1)CNC(=O)C 34a_100000755463_100000210202 [0,1,0,0,0,1|1,0,0]=3 6064 B14R1.142 CCNc1ccc(cc1)CNC(=O)N 34a_100000747042_100000210202 [0,1,0,0,0,1|2,0,0]=4 6065 B14R1.142 CCNc1ccc(cc1)OCC(=O)N 2230a_100000238760_100000210202 [0,1,0,0,0,1|2,0,0]=4 6066 B14R1.142 CCNc1ccc(cc1)OCC(=O)N 34a_100000238760_100000210202 [0,1,0,0,0,1|2,0,0]=4 6067 B14R1.142 CCNc1ccc(cc1)OCC(=O)N 34a_100011337800_100000187820 [0,1,0,0,0,1|2,0,0]=4 6068 B14R1.142 CCNc1ccc(cc1)OCC(=O)N 7a_100011337800_100000187820 [0,1,0,0,0,1|2,0,0]=4 6069 B14R1.142 CCNc1ccc(cc1)OCC(=O)[O-] 34a_100011337800_100020667443 [0,1,0,0,0,1|2,0,0]=4 6070 B14R1.142 CCNc1ccc(cc1)SCC(=O)N 62a_100000747473_100000219632 [0,1,0,0,0,1|2,0,0]=4 6071 B14R1.142 CCNc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000219632 [0,1,0,0,0,1|2,0,0]=4 6072 B14R1.142 CCOc1ccc(cc1)/C=C/C(=O)C 34a_100000189429_100000210202 [0,1,0,0,0,1|0,0,1]=3 6073 B14R1.142 CCOc1ccc(cc1)C=CC(=O)C 1458a_100000690215_200000210301 [0,1,0,0,0,1|0,0,1]=3 6074 B14R1.142 CCOc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000690215_200025704644 [0,1,0,0,0,1|0,0,1]=3 6075 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 1458a_100000743745_200000210301 [0,1,0,0,0,1|0,0,0]=2 6076 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 34a_100000198047_100000210202 [0,1,0,0,0,1|0,0,0]=2 6077 B14R1.142 CCOc1ccc(cc1)CCC(=O)C 7a_100000198047_100000210202 [0,1,0,0,0,1|0,0,0]=2 6078 B14R1.142 CCOc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000743745_200025704644 [0,1,0,0,0,1|0,0,0]=2 6079 B14R1.142 CCOc1ccc(cc1)CCC(C)O 34a_100000189425_100000210202 [0,1,0,0,0,1|0,0,2]=4 6080 B14R1.142 CCOc1ccc(cc1)CCC(C)O 7a_100000189425_100000210202 [0,1,0,0,0,1|0,0,2]=4 6081 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 11a_100000185588_100015343762 [0,1,0,0,0,1|0,0,0]=2 6082 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 1626a_100000185588_100015343762 [0,1,0,0,0,1|0,0,0]=2 6083 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 240690a_100000185588_100015343762 [0,1,0,0,0,1|0,0,0]=2 6084 B14R1.142 CCOc1ccc(cc1)CNC(=O)C 527a_100000185588_100103153847 [0,1,0,0,0,1|0,0,0]=2 6085 B14R1.142 CCOc1ccc(cc1)CNC(C)C 207a_100138425928_100000169836 [0,1,0,0,0,1|1,0,1]=4 6086 B14R1.142 CCOc1ccc(cc1)CNC(C)C 2230a_100000185588_100000210206 [0,1,0,0,0,1|1,0,1]=4 6087 B14R1.142 CCOc1ccc(cc1)CNC(C)C 34a_100000185588_100000210206 [0,1,0,0,0,1|1,0,1]=4 6088 B14R1.142 CCOc1ccc(cc1)COC(C)C 34a_100000173027_100000210206 [0,1,0,0,0,1|1,0,1]=4 6089 B14R1.142 CCOc1ccc(cc1)COC(C)C 7a_100000173027_100000210206 [0,1,0,0,0,1|1,0,1]=4 6090 B14R1.142 CCOc1ccc(cc1)NCC(=O)N 2230a_100000739623_100000747473 [0,1,0,0,0,1|1,0,0]=3 6091 B14R1.142 CCOc1ccc(cc1)NCC(=O)N 34a_100000739623_100000187820 [0,1,0,0,0,1|1,0,0]=3 6092 B14R1.142 CCOc1ccc(cc1)NCC(=O)[O-] 34a_100000739623_100020667443 [0,1,0,0,0,1|1,0,0]=3 6093 B14R1.142 CCOc1ccc(cc1)NCC(C)C 2230a_100000739623_100000210760 [0,1,0,0,0,1|1,0,1]=4 6094 B14R1.142 CCOc1ccc(cc1)NCC(C)C 34a_100000739623_100000210624 [0,1,0,0,0,1|1,0,1]=4 6095 B14R1.142 CCOc1ccc(cc1)NCC(C)O 2230a_100000739623_100011218427 [0,1,0,0,0,1|0,0,2]=4 6096 B14R1.142 CCOc1ccc(cc1)NCC(C)O 34a_100000739623_100011218427 [0,1,0,0,0,1|0,0,2]=4 6097 B14R1.142 CCOc1ccc(cc1)NC[C@@H](C)O 2230a_100000739623_100009817552 [0,1,0,0,0,1|0,0,2]=4 6098 B14R1.142 CCOc1ccc(cc1)NC[C@@H](C)O 34a_100000739623_100009817552 [0,1,0,0,0,1|0,0,2]=4 6099 B14R1.142 CCOc1ccc(cc1)NC[N+](=O)[O-] 34a_100000739623_100000761209 [0,1,0,0,0,1|2,0,0]=4 6100 B14R1.142 CCOc1ccc(cc1)NNC(=O)C 22a_100000738955_100000070787 [0,1,0,0,0,1|1,0,0]=3 6101 B14R1.142 CCOc1ccc(cc1)OCC(=O)C 1458a_100000183567_200000210301 [0,1,0,0,0,1|0,0,0]=2 6102 B14R1.142 CCOc1ccc(cc1)OCC(=O)N 34a_100000185467_100000187820 [0,1,0,0,0,1|1,0,0]=3 6103 B14R1.142 CCOc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000183567_200025704644 [0,1,0,0,0,1|0,0,0]=2 6104 B14R1.142 CCOc1ccc(cc1)OCC(=O)[O-] 34a_100000185467_100020667443 [0,1,0,0,0,1|1,0,0]=3 6105 B14R1.142 CCOc1ccc(cc1)OCC(C)C 34a_100000185467_100000210624 [0,1,0,0,0,1|1,0,1]=4 6106 B14R1.142 CCOc1ccc(cc1)OCC(C)O 34a_100000185467_100011218427 [0,1,0,0,0,1|0,0,2]=4 6107 B14R1.142 CCOc1ccc(cc1)OC[C@@H](C)O 34a_100000185467_100009817552 [0,1,0,0,0,1|0,0,2]=4 6108 B14R1.142 CCOc1ccc(cc1)OC[N+](=O)[O-] 34a_100000185467_100000761209 [0,1,0,0,0,1|2,0,0]=4 6109 B14R1.142 CCOc1ccc(cc1)SCC(=O)C 1458a_100000016182_200000210301 [0,1,0,0,0,1|0,0,0]=2 6110 B14R1.142 CCOc1ccc(cc1)SCC(=O)N 62a_100000747473_100000171712 [0,1,0,0,0,1|1,0,0]=3 6111 B14R1.142 CCOc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000016182_200025704644 [0,1,0,0,0,1|0,0,0]=2 6112 B14R1.142 CCOc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000171712 [0,1,0,0,0,1|1,0,0]=3 6113 B14R1.142 CCOc1ccc(cc1)SCC(C)C 62a_100000210624_100000171712 [0,1,0,0,0,1|1,0,1]=4 6114 B14R1.142 CCOc1ccc(cc1)SCC(C)O 62a_100011218427_100000171712 [0,1,0,0,0,1|0,0,2]=4 6115 B14R1.142 CCOc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000171712 [0,1,0,0,0,1|0,0,2]=4 6116 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 11a_100102710506_100015343762 [0,1,0,0,0,1|1,0,0]=3 6117 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 1626a_100102710506_100015343762 [0,1,0,0,0,1|1,0,0]=3 6118 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 240690a_100102710506_100015343762 [0,1,0,0,0,1|1,0,0]=3 6119 B14R1.142 CCOc1ccc(cn1)CNC(=O)C 527a_100102710506_100103153847 [0,1,0,0,0,1|1,0,0]=3 6120 B14R1.142 CCOc1ccc(cn1)SCC(=O)N 62a_100000747473_100011219444 [0,1,0,0,0,1|2,0,0]=4 6121 B14R1.142 CCOc1ccc(cn1)SCC(=O)N 62a_100011219444_100000747473 [0,1,0,0,0,1|2,0,0]=4 6122 B14R1.142 CCOc1ccc(cn1)SCC(=O)[O-] 62a_100011219444_100020667443 [0,1,0,0,0,1|2,0,0]=4 6123 B14R1.142 CCOc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100011219444 [0,1,0,0,0,1|2,0,0]=4 6124 B14R1.142 CCOc1ccc(nc1)SCC(=O)N 62a_100000747473_100000753957 [0,1,0,0,0,1|2,0,0]=4 6125 B14R1.142 CCOc1ccc(nc1)SCC(=O)N 62a_100012355646_100000747473 [0,1,0,0,0,1|2,0,0]=4 6126 B14R1.142 CCOc1ccc(nc1)SCC(=O)[O-] 62a_100012355646_100020667443 [0,1,0,0,0,1|2,0,0]=4 6127 B14R1.142 CCOc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000753957 [0,1,0,0,0,1|2,0,0]=4 6128 B14R1.142 CCSc1ccc(cc1)/C=C/C(=O)C 62a_100000210202_200016259395 [0,1,0,0,0,1|0,1,1]=4 6129 B14R1.142 CCSc1ccc(cc1)/C=C/C(=O)C 62a_200016259395_100000210202 [0,1,0,0,0,1|0,1,1]=4 6130 B14R1.142 CCSc1ccc(cc1)CCC(=O)C 62a_100000210202_100000723691 [0,1,0,0,0,1|0,1,0]=3 6131 B14R1.142 CCSc1ccc(cc1)CCC(=O)C 62a_100000723691_100000210202 [0,1,0,0,0,1|0,1,0]=3 6132 B14R1.142 CCSc1ccc(cc1)CCC(=O)N 62a_100000210202_200010110666 [0,1,0,0,0,1|1,1,0]=4 6133 B14R1.142 CCSc1ccc(cc1)CCC(=O)N 62a_200010110666_100000210202 [0,1,0,0,0,1|1,1,0]=4 6134 B14R1.142 CCSc1ccc(cc1)CNC(=O)C 62a_100000210202_200000685173 [0,1,0,0,0,1|0,1,0]=3 6135 B14R1.142 CCSc1ccc(cc1)CNC(=O)C 62a_200000685173_100000210202 [0,1,0,0,0,1|0,1,0]=3 6136 B14R1.142 CCSc1ccc(cc1)NCC(=O)N 34a_100015187087_100000187820 [0,1,0,0,0,1|1,1,0]=4 6137 B14R1.142 CCSc1ccc(cc1)NCC(=O)[O-] 34a_100015187087_100020667443 [0,1,0,0,0,1|1,1,0]=4 6138 B14R1.142 CCSc1ccc(cc1)NNC(=O)C 62a_100000210202_200009815283 [0,1,0,0,0,1|1,1,0]=4 6139 B14R1.142 CCSc1ccc(cc1)NNC(=O)C 62a_200009815283_100000210202 [0,1,0,0,0,1|1,1,0]=4 6140 B14R1.142 CCSc1ccc(cc1)SCC(=O)N 62a_100000149456_100000210202 [0,1,0,0,0,1|1,1,0]=4 6141 B14R1.142 CCSc1ccc(cc1)SCC(=O)N 62a_100000210202_100000149456 [0,1,0,0,0,1|1,1,0]=4 6142 B14R1.142 CCSc1ccc(cc1)SCC(=O)N 62a_100000747473_200009811893 [0,1,0,0,0,1|1,1,0]=4 6143 B14R1.142 CCSc1ccc(cc1)SCC(=O)N 62a_200009811893_100000747473 [0,1,0,0,0,1|1,1,0]=4 6144 B14R1.142 CCSc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_200009811893 [0,1,0,0,0,1|1,1,0]=4 6145 B14R1.142 CCSc1ccc(cc1)SCC(=O)[O-] 62a_200009811893_100020667443 [0,1,0,0,0,1|1,1,0]=4 6146 B14R1.142 CNCc1ccc(cc1)/C=C/C(=O)C 26a_100102657272_100000189429 [0,1,0,0,0,1|1,0,1]=4 6147 B14R1.142 CNCc1ccc(cc1)OCC(=O)N 207a_100102657272_100000150092 [0,1,0,0,0,1|2,0,0]=4 6148 B14R1.142 CNCc1ccc(cc1)OCC(=O)N 2230a_100000244766_200000210301 [0,1,0,0,0,1|2,0,0]=4 6149 B14R1.142 CNCc1ccc(cc1)OCC(=O)N 270004a_106832991635_100000150092 [0,1,0,0,0,1|2,0,0]=4 6150 B14R1.142 CNCc1ccc(cc1)OCC(=O)N 34a_100000207500_100000187820 [0,1,0,0,0,1|2,0,0]=4 6151 B14R1.142 CNCc1ccc(cc1)OCC(=O)[O-] 34a_100000207500_100020667443 [0,1,0,0,0,1|2,0,0]=4 6152 B14R1.142 CNCc1ccc(cc1)SCC(=O)N 62a_100000180866_100000747473 [0,1,0,0,0,1|2,0,0]=4 6153 B14R1.142 CNCc1ccc(cc1)SCC(=O)N 62a_100000747473_100000180866 [0,1,0,0,0,1|2,0,0]=4 6154 B14R1.142 CNCc1ccc(cc1)SCC(=O)[O-] 62a_100000180866_100020667443 [0,1,0,0,0,1|2,0,0]=4 6155 B14R1.142 CNCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000180866 [0,1,0,0,0,1|2,0,0]=4 6156 B14R1.142 COCc1ccc(cc1)CNC(=O)C 11a_100000738208_100015343762 [0,1,0,0,0,1|0,0,0]=2 6157 B14R1.142 COCc1ccc(cc1)CNC(=O)C 1626a_100000738208_100015343762 [0,1,0,0,0,1|0,0,0]=2 6158 B14R1.142 COCc1ccc(cc1)CNC(=O)C 240690a_100000738208_100015343762 [0,1,0,0,0,1|0,0,0]=2 6159 B14R1.142 COCc1ccc(cc1)CNC(=O)C 527a_100000738208_100103153847 [0,1,0,0,0,1|0,0,0]=2 6160 B14R1.142 COCc1ccc(cc1)CNC(C)C 2230a_100000738208_100000210206 [0,1,0,0,0,1|1,0,1]=4 6161 B14R1.142 COCc1ccc(cc1)CNC(C)C 34a_100000738208_100000210206 [0,1,0,0,0,1|1,0,1]=4 6162 B14R1.142 COCc1ccc(cc1)NCC(=O)N 34a_100000694113_100000187820 [0,1,0,0,0,1|1,0,0]=3 6163 B14R1.142 COCc1ccc(cc1)NCC(=O)[O-] 34a_100000694113_100020667443 [0,1,0,0,0,1|1,0,0]=3 6164 B14R1.142 COCc1ccc(cc1)NCC(C)C 34a_100000694113_100000210624 [0,1,0,0,0,1|1,0,1]=4 6165 B14R1.142 COCc1ccc(cc1)NCC(C)O 34a_100000694113_100011218427 [0,1,0,0,0,1|0,0,2]=4 6166 B14R1.142 COCc1ccc(cc1)NC[C@@H](C)O 34a_100000694113_100009817552 [0,1,0,0,0,1|0,0,2]=4 6167 B14R1.142 COCc1ccc(cc1)NC[N+](=O)[O-] 34a_100000694113_100000761209 [0,1,0,0,0,1|2,0,0]=4 6168 B14R1.142 COCc1ccc(cc1)OCC(=O)N 34a_200011995677_100000187820 [0,1,0,0,0,1|1,0,0]=3 6169 B14R1.142 COCc1ccc(cc1)OCC(=O)N 7a_200011995677_100000187820 [0,1,0,0,0,1|1,0,0]=3 6170 B14R1.142 COCc1ccc(cc1)OCC(=O)[O-] 34a_200011995677_100020667443 [0,1,0,0,0,1|1,0,0]=3 6171 B14R1.142 COCc1ccc(cc1)OCC(C)C 34a_200011995677_100000210624 [0,1,0,0,0,1|1,0,1]=4 6172 B14R1.142 COCc1ccc(cc1)OCC(C)C 7a_200011995677_100000210760 [0,1,0,0,0,1|1,0,1]=4 6173 B14R1.142 COCc1ccc(cc1)OCC(C)O 34a_200011995677_100011218427 [0,1,0,0,0,1|0,0,2]=4 6174 B14R1.142 COCc1ccc(cc1)OCC(C)O 7a_200011995677_100011218427 [0,1,0,0,0,1|0,0,2]=4 6175 B14R1.142 COCc1ccc(cc1)OC[C@@H](C)O 34a_200011995677_100009817552 [0,1,0,0,0,1|0,0,2]=4 6176 B14R1.142 COCc1ccc(cc1)OC[C@@H](C)O 7a_200011995677_100009817552 [0,1,0,0,0,1|0,0,2]=4 6177 B14R1.142 COCc1ccc(cc1)OC[N+](=O)[O-] 34a_200011995677_100000761209 [0,1,0,0,0,1|2,0,0]=4 6178 B14R1.142 COCc1ccc(cc1)SCC(=O)N 62a_100000747473_100011493685 [0,1,0,0,0,1|1,0,0]=3 6179 B14R1.142 COCc1ccc(cc1)SCC(=O)N 62a_100011493685_100000747473 [0,1,0,0,0,1|1,0,0]=3 6180 B14R1.142 COCc1ccc(cc1)SCC(=O)[O-] 62a_100011493685_100020667443 [0,1,0,0,0,1|1,0,0]=3 6181 B14R1.142 COCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100011493685 [0,1,0,0,0,1|1,0,0]=3 6182 B14R1.142 COCc1ccc(cc1)SCC(C)C 62a_100000210624_100011493685 [0,1,0,0,0,1|1,0,1]=4 6183 B14R1.142 COCc1ccc(cc1)SCC(C)C 62a_100011493685_100000210760 [0,1,0,0,0,1|1,0,1]=4 6184 B14R1.142 COCc1ccc(cc1)SCC(C)O 62a_100011218427_100011493685 [0,1,0,0,0,1|0,0,2]=4 6185 B14R1.142 COCc1ccc(cc1)SCC(C)O 62a_100011493685_100011218427 [0,1,0,0,0,1|0,0,2]=4 6186 B14R1.142 COCc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100011493685 [0,1,0,0,0,1|0,0,2]=4 6187 B14R1.142 COCc1ccc(cc1)SC[C@@H](C)O 62a_100011493685_100009817552 [0,1,0,0,0,1|0,0,2]=4 6188 B14R1.142 COCc1ccc(cc1)SC[N+](=O)[O-] 62a_100011493685_100000761209 [0,1,0,0,0,1|2,0,0]=4 6189 B14R1.142 CSCc1ccc(cc1)NCC(=O)N 2230a_106726388226_100000747473 [0,1,0,0,0,1|1,1,0]=4 6190 B14R1.142 CSCc1ccc(cc1)NCC(=O)N 34a_106726388226_100000187820 [0,1,0,0,0,1|1,1,0]=4 6191 B14R1.142 CSCc1ccc(cc1)NCC(=O)N 7a_106726388226_100000187820 [0,1,0,0,0,1|1,1,0]=4 6192 B14R1.142 CSCc1ccc(cc1)NCC(=O)[O-] 34a_106726388226_100020667443 [0,1,0,0,0,1|1,1,0]=4 6193 B14R1.142 NC(=O)CCc1ccc(cc1)SCF 62a_100015361967_200010110666 [0,1,0,0,0,1|1,1,0]=4 6194 B14R1.142 NC(=O)CCc1ccc(cc1)SCF 62a_200010110666_100015361967 [0,1,0,0,0,1|1,1,0]=4 6195 B14R1.142 NC(=O)CNc1ccc(cc1)CCO 2230a_100011204434_100000747473 [0,1,0,0,0,1|2,0,0]=4 6196 B14R1.142 NC(=O)CNc1ccc(cc1)CCO 34a_100011204434_100000187820 [0,1,0,0,0,1|2,0,0]=4 6197 B14R1.142 NC(=O)COc1ccc(cc1)CCBr 34a_100009816426_100000187820 [0,1,0,0,0,1|2,0,0]=4 6198 B14R1.142 NC(=O)COc1ccc(cc1)CCBr 7a_100009816426_100000187820 [0,1,0,0,0,1|2,0,0]=4 6199 B14R1.142 NC(=O)COc1ccc(cc1)CCO 34a_100011215338_100000187820 [0,1,0,0,0,1|2,0,0]=4 6200 B14R1.142 NC(=O)COc1ccc(cc1)CCO 7a_100011215338_100000187820 [0,1,0,0,0,1|2,0,0]=4 6201 B14R1.142 NC(=O)COc1ccc(cc1)NCF 34a_100000238760_100015361967 [0,1,0,0,0,1|2,0,0]=4 6202 B14R1.142 NC(=O)CSc1ccc(cc1)CCO 62a_100000747473_100000766406 [0,1,0,0,0,1|2,0,0]=4 6203 B14R1.142 NC(=O)CSc1ccc(cc1)CCO 62a_100000766406_100000747473 [0,1,0,0,0,1|2,0,0]=4 6204 B14R1.142 NC(=O)CSc1ccc(cc1)SCF 62a_100000149456_100015361967 [0,1,0,0,0,1|1,1,0]=4 6205 B14R1.142 NC(=O)CSc1ccc(cc1)SCF 62a_100015361967_100000149456 [0,1,0,0,0,1|1,1,0]=4 6206 B14R1.142 NC(=O)NCc1ccc(cc1)NCF 34a_100000747042_100015361967 [0,1,0,0,0,1|2,0,0]=4 6207 B14R1.142 NCCc1ccc(cc1)OCC(=O)N 34a_100000743037_100000187820 [0,1,0,0,0,1|2,0,0]=4 6208 B14R1.142 NCCc1ccc(cc1)OCC(=O)[O-] 34a_100000743037_100020667443 [0,1,0,0,0,1|2,0,0]=4 6209 B14R1.142 NCCc1ccc(cc1)SCC(=O)N 62a_100000747473_100000755846 [0,1,0,0,0,1|2,0,0]=4 6210 B14R1.142 NCCc1ccc(cc1)SCC(=O)N 62a_100000755846_100000747473 [0,1,0,0,0,1|2,0,0]=4 6211 B14R1.142 NCCc1ccc(cc1)SCC(=O)[O-] 62a_100000755846_100020667443 [0,1,0,0,0,1|2,0,0]=4 6212 B14R1.142 NCCc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000755846 [0,1,0,0,0,1|2,0,0]=4 6213 B14R1.142 O=C([O-])CNc1ccc(cc1)CCO 34a_100011204434_100020667443 [0,1,0,0,0,1|2,0,0]=4 6214 B14R1.142 O=C([O-])COc1ccc(cc1)CCBr 34a_100009816426_100020667443 [0,1,0,0,0,1|2,0,0]=4 6215 B14R1.142 O=C([O-])COc1ccc(cc1)CCO 34a_100011215338_100020667443 [0,1,0,0,0,1|2,0,0]=4 6216 B14R1.142 O=C([O-])CSc1ccc(cc1)CCO 62a_100000766406_100020667443 [0,1,0,0,0,1|2,0,0]=4 6217 B14R1.142 O=C([O-])CSc1ccc(cc1)CCO 62a_100020667443_100000766406 [0,1,0,0,0,1|2,0,0]=4 6218 B14R1.142 [13CH3]C(=O)COc1ccc(cc1)CC#N 1458a_100000745489_200025704644 [0,1,0,0,0,1|1,0,1]=4 6219 B14R1.142 [13CH3]NCc1ccc(cc1)OCC(=O)N 2230a_100000244766_200025704644 [0,1,0,0,0,1|2,0,0]=4 6220 B14R1.211 CC(C)(C)NCc1ccc(cc1)O[13CH3] 7a_100000744446_200025704644 [0,1,0,0,0,1|1,0,1]=4 6221 B14R1.211 CCc1ccc(cc1)CNS(=O)(=O)C 40a_100000721222_100000738038 [0,1,0,0,0,1|2,0,0]=4 6222 B14R1.211 COc1ccc(cc1)CNC(C)(C)C 207a_100000715429_100000169835 [0,1,0,0,0,1|1,0,1]=4 6223 B14R1.211 COc1ccc(cc1)CNC(C)(C)C 2230a_100000715429_100000742318 [0,1,0,0,0,1|1,0,1]=4 6224 B14R1.211 COc1ccc(cc1)CNC(C)(C)C 34a_100000185587_100000210625 [0,1,0,0,0,1|1,0,1]=4 6225 B14R1.211 COc1ccc(cc1)CNC(C)(C)C 7a_100000744446_200000210301 [0,1,0,0,0,1|1,0,1]=4 6226 B14R1.211 COc1ccc(cc1)CNS(=O)(=O)C 40a_100000185587_100000738038 [0,1,0,0,0,1|1,0,0]=3 6227 B14R1.211 COc1ccc(cc1)COC(C)(C)C 34a_100000173359_100000210625 [0,1,0,0,0,1|1,0,1]=4 6228 B14R1.211 COc1ccc(cc1)COC(C)(C)C 34a_100015890283_100000742318 [0,1,0,0,0,1|1,0,1]=4 6229 B14R1.211 COc1ccc(cc1)COC(C)(C)C 7a_100015890283_100000742318 [0,1,0,0,0,1|1,0,1]=4 6230 B14R1.211 COc1ccc(cc1)CSC(C)(C)C 62a_100000211941_100000742318 [0,1,0,0,0,1|1,0,1]=4 6231 B14R1.211 COc1ccc(cc1)NCC(C)(C)C 34a_100000184247_100011219605 [0,1,0,0,0,1|1,0,1]=4 6232 B14R1.211 COc1ccc(cc1)NCC(C)(C)F 34a_100000184247_100011997219 [0,1,0,0,0,1|1,0,1]=4 6233 B14R1.211 COc1ccc(cc1)NCC(C)(C)O 34a_100000184247_100000764493 [0,1,0,0,0,1|0,0,2]=4 6234 B14R1.211 COc1ccc(cc1)NCS(=O)(=O)[O-] 34a_100000184247_100009817235 [0,1,0,0,0,1|2,0,0]=4 6235 B14R1.211 COc1ccc(cc1)NNS(=O)(=O)C 40a_100000005221_100000738038 [0,1,0,0,0,1|2,0,0]=4 6236 B14R1.211 COc1ccc(cc1)OCC(C)(C)C 34a_100000210503_100011219605 [0,1,0,0,0,1|1,0,1]=4 6237 B14R1.211 COc1ccc(cc1)OCC(C)(C)F 34a_100000210503_100011997219 [0,1,0,0,0,1|1,0,1]=4 6238 B14R1.211 COc1ccc(cc1)OCC(C)(C)O 34a_100000210503_100000764493 [0,1,0,0,0,1|0,0,2]=4 6239 B14R1.211 COc1ccc(cc1)OCS(=O)(=O)[O-] 34a_100000210503_100009817235 [0,1,0,0,0,1|2,0,0]=4 6240 B14R1.211 COc1ccc(cc1)SCC(C)(C)C 62a_100011219605_100000171711 [0,1,0,0,0,1|1,0,1]=4 6241 B14R1.211 COc1ccc(cc1)SCC(C)(C)F 62a_100011997219_100000171711 [0,1,0,0,0,1|1,0,1]=4 6242 B14R1.211 COc1ccc(cc1)SCC(C)(C)O 62a_100000764493_100000171711 [0,1,0,0,0,1|0,0,2]=4 6243 B14R1.211 COc1ccc(cc1)SCS(=O)(=O)N 62a_100000741382_100000171711 [0,1,0,0,0,1|2,0,0]=4 6244 B14R1.211 COc1ccc(cc1)SCS(=O)(=O)[O-] 62a_100009817235_100000171711 [0,1,0,0,0,1|2,0,0]=4 6245 B14R1.211 COc1ccc(cc1)SC[N+](C)(C)C 62a_200000036245_100000171711 [0,1,0,0,0,1|2,0,0]=4 6246 B14R1.211 COc1ccc(cc1)SC[Si](C)(C)C 62a_100000037933_100000171711 [0,1,0,0,0,1|1,1,0]=4 6247 B14R1.211 COc1ccc(cn1)CNS(=O)(=O)C 40a_100000241975_100000738038 [0,1,0,0,0,1|2,0,0]=4 6248 B14R1.211 COc1ccc(nc1)CNS(=O)(=O)C 40a_100000703904_100000738038 [0,1,0,0,0,1|2,0,0]=4 6249 B14R1.211 CSc1ccc(cc1)CNS(=O)(=O)C 40a_100000174980_100000738038 [0,1,0,0,0,1|1,1,0]=4 6250 B14R1.419 C=C(C)CNc1ccc(cc1)C(C)C 2230a_100000210773_100000748629 [0,1,0,0,0,1|2,0,0]=4 6251 B14R1.419 C=C(C)CNc1ccc(cc1)C(C)C 34a_100000210773_100000748629 [0,1,0,0,0,1|2,0,0]=4 6252 B14R1.419 C=C(C)CNc1ccc(cc1)C(C)C 7a_100000210773_100000748629 [0,1,0,0,0,1|2,0,0]=4 6253 B14R1.419 C=C(C)CNc1ccc(cc1)C(C)O 2230a_100011216399_100000748629 [0,1,0,0,0,1|2,0,0]=4 6254 B14R1.419 C=C(C)CNc1ccc(cc1)C(C)O 34a_100011216399_100000748629 [0,1,0,0,0,1|2,0,0]=4 6255 B14R1.419 C=C(C)CNc1ccc(cc1)N(C)C 34a_100016997997_100000748629 [0,1,0,0,0,1|2,0,0]=4 6256 B14R1.419 C=C(C)COc1ccc(cc1)C(=C)C 34a_100009880102_100000748629 [0,1,0,0,0,1|2,0,0]=4 6257 B14R1.419 C=C(C)COc1ccc(cc1)C(=C)C 7a_100009880102_100000748629 [0,1,0,0,0,1|2,0,0]=4 6258 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)C 34a_100000185113_100000748629 [0,1,0,0,0,1|2,0,0]=4 6259 B14R1.419 C=C(C)COc1ccc(cc1)C(=O)C 7a_100000185113_100000748629 [0,1,0,0,0,1|2,0,0]=4 6260 B14R1.419 C=C(C)COc1ccc(cc1)C(C)C 34a_100000181308_100000748629 [0,1,0,0,0,1|2,0,0]=4 6261 B14R1.419 C=C(C)COc1ccc(cc1)C(C)C 7a_100000181308_100000748629 [0,1,0,0,0,1|2,0,0]=4 6262 B14R1.419 C=C(C)COc1ccc(cc1)C(C)O 34a_100000754508_100000748629 [0,1,0,0,0,1|2,0,0]=4 6263 B14R1.419 C=C(C)COc1ccc(cc1)C(C)O 7a_100000754508_100000748629 [0,1,0,0,0,1|2,0,0]=4 6264 B14R1.419 C=C(C)COc1ccc(cc1)N(C)C 34a_100000718910_100000748629 [0,1,0,0,0,1|2,0,0]=4 6265 B14R1.419 C=C(C)COc1ccc(cc1)S(=O)C 34a_200000064373_100000748629 [0,1,0,0,0,1|1,1,0]=4 6266 B14R1.419 C=C(C)COc1ccc(cc1)S(=O)C 7a_200000064373_100000748629 [0,1,0,0,0,1|1,1,0]=4 6267 B14R1.419 C=C(C)COc1ccc(cc1)[C@H](C)N 34a_100161106496_100000748629 [0,1,0,0,0,1|2,0,0]=4 6268 B14R1.419 C=C(C)COc1ccc(cc1)[S+](C)C 34a_100010188728_100000748629 [0,1,0,0,0,1|1,1,0]=4 6269 B14R1.419 C=C(C)COc1ccc(cc1)[S+](C)C 7a_100010188728_100000748629 [0,1,0,0,0,1|1,1,0]=4 6270 B14R1.419 C=C(C)CSc1ccc(cc1)C(=C)C 62a_100000185454_100000211660 [0,1,0,0,0,1|2,0,0]=4 6271 B14R1.419 C=C(C)CSc1ccc(cc1)C(=C)C 62a_100000748629_100000185454 [0,1,0,0,0,1|2,0,0]=4 6272 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)C 62a_100000185465_100000211660 [0,1,0,0,0,1|2,0,0]=4 6273 B14R1.419 C=C(C)CSc1ccc(cc1)C(=O)C 62a_100000748629_100000185465 [0,1,0,0,0,1|2,0,0]=4 6274 B14R1.419 C=C(C)CSc1ccc(cc1)C(C)C 62a_100000748629_100000750031 [0,1,0,0,0,1|2,0,0]=4 6275 B14R1.419 C=C(C)CSc1ccc(cc1)C(C)C 62a_100000750031_100000211660 [0,1,0,0,0,1|2,0,0]=4 6276 B14R1.419 C=C(C)CSc1ccc(cc1)C(C)O 62a_100000745893_100000211660 [0,1,0,0,0,1|2,0,0]=4 6277 B14R1.419 C=C(C)CSc1ccc(cc1)C(C)O 62a_100000748629_100000745893 [0,1,0,0,0,1|2,0,0]=4 6278 B14R1.419 C=C(C)CSc1ccc(cc1)N(C)C 62a_100000210421_100000211660 [0,1,0,0,0,1|2,0,0]=4 6279 B14R1.419 C=C(C)CSc1ccc(cc1)N(C)C 62a_100000748629_100000210421 [0,1,0,0,0,1|2,0,0]=4 6280 B14R1.419 C=C(C)CSc1ccc(cc1)S(=O)C 62a_100009816266_100000211660 [0,1,0,0,0,1|1,1,0]=4 6281 B14R1.419 C=C(C)CSc1ccc(cc1)[C@@H](C)N 62a_100000720352_100000211660 [0,1,0,0,0,1|2,0,0]=4 6282 B14R1.419 C=C(C)CSc1ccc(cc1)[C@@H](C)N 62a_100000748629_100000720352 [0,1,0,0,0,1|2,0,0]=4 6283 B14R1.419 C=C(C)CSc1ccc(cc1)[C@H](C)N 62a_100000748629_100000753911 [0,1,0,0,0,1|2,0,0]=4 6284 B14R1.419 C=C(C)CSc1ccc(cc1)[C@H](C)N 62a_100000753911_100000211660 [0,1,0,0,0,1|2,0,0]=4 6285 B14R1.419 C=C(C)c1ccc(cc1)/C=C/C(=O)C 271570a_100000694244_200016259395 [0,1,0,0,0,1|1,0,1]=4 6286 B14R1.419 C=C(C)c1ccc(cc1)CCC(=O)C 271570a_100000694244_100000723691 [0,1,0,0,0,1|1,0,0]=3 6287 B14R1.419 C=C(C)c1ccc(cc1)CCC(=O)N 271570a_100000694244_200010110666 [0,1,0,0,0,1|2,0,0]=4 6288 B14R1.419 C=C(C)c1ccc(cc1)CNC(=O)C 271570a_100000694244_200000685173 [0,1,0,0,0,1|1,0,0]=3 6289 B14R1.419 C=C(C)c1ccc(cc1)NNC(=O)C 271570a_100000694244_200009815283 [0,1,0,0,0,1|2,0,0]=4 6290 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)N 34a_100009880102_100000187820 [0,1,0,0,0,1|2,0,0]=4 6291 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)N 7a_100009880102_100000187820 [0,1,0,0,0,1|2,0,0]=4 6292 B14R1.419 C=C(C)c1ccc(cc1)OCC(=O)[O-] 34a_100009880102_100020667443 [0,1,0,0,0,1|2,0,0]=4 6293 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 271570a_100000694244_100000149456 [0,1,0,0,0,1|2,0,0]=4 6294 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 62a_100000185454_100000747473 [0,1,0,0,0,1|2,0,0]=4 6295 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000185454 [0,1,0,0,0,1|2,0,0]=4 6296 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000185454_100020667443 [0,1,0,0,0,1|2,0,0]=4 6297 B14R1.419 C=C(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185454 [0,1,0,0,0,1|2,0,0]=4 6298 B14R1.419 CC(=O)C=Cc1ccc(cc1)C(C)C 1458a_100000185018_200000210301 [0,1,0,0,0,1|1,0,1]=4 6299 B14R1.419 CC(=O)C=Cc1ccc(cc1)N(C)C 1458a_100016270256_200000210301 [0,1,0,0,0,1|1,0,1]=4 6300 B14R1.419 CC(=O)CCc1ccc(cc1)C(=O)C 1458a_100000070787_200000038727 [0,1,0,0,0,1|1,0,0]=3 6301 B14R1.419 CC(=O)CCc1ccc(cc1)C(C)C 1458a_100000234928_200000210301 [0,1,0,0,0,1|1,0,0]=3 6302 B14R1.419 CC(=O)CCc1ccc(cc1)N(C)C 1458a_100000205957_200000210301 [0,1,0,0,0,1|1,0,0]=3 6303 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000736421 [0,1,0,0,0,1|2,0,0]=4 6304 B14R1.419 CC(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200000210301 [0,1,0,0,0,1|2,0,0]=4 6305 B14R1.419 CC(=O)COc1ccc(cc1)C(C)C 1458a_100000189144_200000210301 [0,1,0,0,0,1|1,0,0]=3 6306 B14R1.419 CC(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200000210301 [0,1,0,0,0,1|2,0,0]=4 6307 B14R1.419 CC(=O)CSc1ccc(cc1)C(C)C 1458a_100000740577_200000210301 [0,1,0,0,0,1|1,0,0]=3 6308 B14R1.419 CC(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200000210301 [0,1,0,0,0,1|2,0,0]=4 6309 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)C 1458a_100000193300_200000210301 [0,1,0,0,0,1|1,0,0]=3 6310 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 11a_100000185037_100015343762 [0,1,0,0,0,1|2,0,0]=4 6311 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 1626a_100000185037_100015343762 [0,1,0,0,0,1|2,0,0]=4 6312 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 240690a_100000185037_100015343762 [0,1,0,0,0,1|2,0,0]=4 6313 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)N 527a_100000185037_100103153847 [0,1,0,0,0,1|2,0,0]=4 6314 B14R1.419 CC(=O)NCc1ccc(cc1)C(=O)[13CH3] 1458a_100000193300_200025704644 [0,1,0,0,0,1|1,0,0]=3 6315 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 11a_100000174979_100015343762 [0,1,0,0,0,1|1,0,0]=3 6316 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 1626a_100000174979_100015343762 [0,1,0,0,0,1|1,0,0]=3 6317 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 240690a_100000174979_100015343762 [0,1,0,0,0,1|1,0,0]=3 6318 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)C 527a_100000174979_100103153847 [0,1,0,0,0,1|1,0,0]=3 6319 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)O 240690a_200000048501_100015343762 [0,1,0,0,0,1|1,0,0]=3 6320 B14R1.419 CC(=O)NCc1ccc(cc1)C(C)O 527a_200000048501_100103153847 [0,1,0,0,0,1|1,0,0]=3 6321 B14R1.419 CC(=O)NCc1ccc(cc1)C(F)F 11a_100025706676_100015343762 [0,1,0,0,0,1|2,0,0]=4 6322 B14R1.419 CC(=O)NCc1ccc(cc1)C(F)F 1626a_100025706676_100015343762 [0,1,0,0,0,1|2,0,0]=4 6323 B14R1.419 CC(=O)NCc1ccc(cc1)C(F)F 240690a_100025706676_100015343762 [0,1,0,0,0,1|2,0,0]=4 6324 B14R1.419 CC(=O)NCc1ccc(cc1)C(F)F 527a_100025706676_100103153847 [0,1,0,0,0,1|2,0,0]=4 6325 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 11a_100000199032_100015343762 [0,1,0,0,0,1|1,0,0]=3 6326 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 1626a_100000199032_100015343762 [0,1,0,0,0,1|1,0,0]=3 6327 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 240690a_100000199032_100015343762 [0,1,0,0,0,1|1,0,0]=3 6328 B14R1.419 CC(=O)NCc1ccc(cc1)N(C)C 527a_100000199032_100103153847 [0,1,0,0,0,1|1,0,0]=3 6329 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 11a_100000742766_100015343762 [0,1,0,0,0,1|2,0,0]=4 6330 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 240690a_100000742766_100015343762 [0,1,0,0,0,1|2,0,0]=4 6331 B14R1.419 CC(=O)NCc1ccc(cc1)[N+](=O)[O-] 527a_100000742766_100103153847 [0,1,0,0,0,1|2,0,0]=4 6332 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 11a_100000738136_100015343762 [0,1,0,0,0,1|2,0,0]=4 6333 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 1626a_100000738136_100015343762 [0,1,0,0,0,1|2,0,0]=4 6334 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 240690a_100000738136_100015343762 [0,1,0,0,0,1|2,0,0]=4 6335 B14R1.419 CC(=O)NCc1ccc(nc1)N(C)C 527a_100000738136_100103153847 [0,1,0,0,0,1|2,0,0]=4 6336 B14R1.419 CC(=O)NNc1ccc(cc1)C(C)C 22a_100000005945_100000070787 [0,1,0,0,0,1|2,0,0]=4 6337 B14R1.419 CC(=O)NNc1ccc(cc1)N(C)C 22a_100134618393_100000070787 [0,1,0,0,0,1|2,0,0]=4 6338 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)C 1458a_100000006716_200000210301 [0,1,0,0,0,1|1,0,0]=3 6339 B14R1.419 CC(=O)OCc1ccc(cc1)C(=O)[13CH3] 1458a_100000006716_200025704644 [0,1,0,0,0,1|1,0,0]=3 6340 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200000210301 [0,1,0,0,0,1|2,0,0]=4 6341 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 34a_100000185113_100000187820 [0,1,0,0,0,1|2,0,0]=4 6342 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)N 7a_100000185113_100000187820 [0,1,0,0,0,1|2,0,0]=4 6343 B14R1.419 CC(=O)c1ccc(cc1)OCC(=O)[O-] 34a_100000185113_100020667443 [0,1,0,0,0,1|2,0,0]=4 6344 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000185465_100000747473 [0,1,0,0,0,1|2,0,0]=4 6345 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000185465 [0,1,0,0,0,1|2,0,0]=4 6346 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100000185465_100020667443 [0,1,0,0,0,1|2,0,0]=4 6347 B14R1.419 CC(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185465 [0,1,0,0,0,1|2,0,0]=4 6348 B14R1.419 CC(C)c1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000185018_200025704644 [0,1,0,0,0,1|1,0,1]=4 6349 B14R1.419 CC(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234928_200025704644 [0,1,0,0,0,1|1,0,0]=3 6350 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 2230a_100000210773_100000747473 [0,1,0,0,0,1|2,0,0]=4 6351 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 34a_100000210773_100000187820 [0,1,0,0,0,1|2,0,0]=4 6352 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)N 7a_100000210773_100000187820 [0,1,0,0,0,1|2,0,0]=4 6353 B14R1.419 CC(C)c1ccc(cc1)NCC(=O)[O-] 34a_100000210773_100020667443 [0,1,0,0,0,1|2,0,0]=4 6354 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)N 34a_100000181308_100000187820 [0,1,0,0,0,1|2,0,0]=4 6355 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)N 7a_100000181308_100000187820 [0,1,0,0,0,1|2,0,0]=4 6356 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)[13CH3] 1458a_100000189144_200025704644 [0,1,0,0,0,1|1,0,0]=3 6357 B14R1.419 CC(C)c1ccc(cc1)OCC(=O)[O-] 34a_100000181308_100020667443 [0,1,0,0,0,1|2,0,0]=4 6358 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000750031 [0,1,0,0,0,1|2,0,0]=4 6359 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)N 62a_100000750031_100000747473 [0,1,0,0,0,1|2,0,0]=4 6360 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[13CH3] 1458a_100000740577_200025704644 [0,1,0,0,0,1|1,0,0]=3 6361 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000750031_100020667443 [0,1,0,0,0,1|2,0,0]=4 6362 B14R1.419 CC(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000750031 [0,1,0,0,0,1|2,0,0]=4 6363 B14R1.419 CC(O)c1ccc(cc1)NCC(=O)N 2230a_100011216399_100000747473 [0,1,0,0,0,1|2,0,0]=4 6364 B14R1.419 CC(O)c1ccc(cc1)NCC(=O)N 34a_100011216399_100000187820 [0,1,0,0,0,1|2,0,0]=4 6365 B14R1.419 CC(O)c1ccc(cc1)NCC(=O)[O-] 34a_100011216399_100020667443 [0,1,0,0,0,1|2,0,0]=4 6366 B14R1.419 CC(O)c1ccc(cc1)OCC(=O)N 34a_100000754508_100000187820 [0,1,0,0,0,1|2,0,0]=4 6367 B14R1.419 CC(O)c1ccc(cc1)OCC(=O)N 7a_100000754508_100000187820 [0,1,0,0,0,1|2,0,0]=4 6368 B14R1.419 CC(O)c1ccc(cc1)OCC(=O)[O-] 34a_100000754508_100020667443 [0,1,0,0,0,1|2,0,0]=4 6369 B14R1.419 CC(O)c1ccc(cc1)SCC(=O)N 62a_100000745893_100000747473 [0,1,0,0,0,1|2,0,0]=4 6370 B14R1.419 CC(O)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000745893 [0,1,0,0,0,1|2,0,0]=4 6371 B14R1.419 CC(O)c1ccc(cc1)SCC(=O)[O-] 62a_100000745893_100020667443 [0,1,0,0,0,1|2,0,0]=4 6372 B14R1.419 CC(O)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000745893 [0,1,0,0,0,1|2,0,0]=4 6373 B14R1.419 CN(C)c1ccc(cc1)C=CC(=O)[13CH3] 1458a_100016270256_200025704644 [0,1,0,0,0,1|1,0,1]=4 6374 B14R1.419 CN(C)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000205957_200025704644 [0,1,0,0,0,1|1,0,0]=3 6375 B14R1.419 CN(C)c1ccc(cc1)NCC(=O)N 34a_100016997997_100000187820 [0,1,0,0,0,1|2,0,0]=4 6376 B14R1.419 CN(C)c1ccc(cc1)NCC(=O)[O-] 34a_100016997997_100020667443 [0,1,0,0,0,1|2,0,0]=4 6377 B14R1.419 CN(C)c1ccc(cc1)OCC(=O)N 34a_100000718910_100000187820 [0,1,0,0,0,1|2,0,0]=4 6378 B14R1.419 CN(C)c1ccc(cc1)OCC(=O)[O-] 34a_100000718910_100020667443 [0,1,0,0,0,1|2,0,0]=4 6379 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)N 62a_100000210421_100000747473 [0,1,0,0,0,1|2,0,0]=4 6380 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000210421 [0,1,0,0,0,1|2,0,0]=4 6381 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)[O-] 62a_100000210421_100020667443 [0,1,0,0,0,1|2,0,0]=4 6382 B14R1.419 CN(C)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000210421 [0,1,0,0,0,1|2,0,0]=4 6383 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 34a_200000064373_100000187820 [0,1,0,0,0,1|1,1,0]=4 6384 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)N 7a_200000064373_100000187820 [0,1,0,0,0,1|1,1,0]=4 6385 B14R1.419 CS(=O)c1ccc(cc1)OCC(=O)[O-] 34a_200000064373_100020667443 [0,1,0,0,0,1|1,1,0]=4 6386 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)N 62a_100009816266_100000747473 [0,1,0,0,0,1|1,1,0]=4 6387 B14R1.419 CS(=O)c1ccc(cc1)SCC(=O)[O-] 62a_100009816266_100020667443 [0,1,0,0,0,1|1,1,0]=4 6388 B14R1.419 C[C@@H](N)c1ccc(cc1)SCC(=O)N 62a_100000720352_100000747473 [0,1,0,0,0,1|2,0,0]=4 6389 B14R1.419 C[C@@H](N)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000720352 [0,1,0,0,0,1|2,0,0]=4 6390 B14R1.419 C[C@@H](N)c1ccc(cc1)SCC(=O)[O-] 62a_100000720352_100020667443 [0,1,0,0,0,1|2,0,0]=4 6391 B14R1.419 C[C@@H](N)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000720352 [0,1,0,0,0,1|2,0,0]=4 6392 B14R1.419 C[C@H](N)c1ccc(cc1)OCC(=O)N 34a_100161106496_100000187820 [0,1,0,0,0,1|2,0,0]=4 6393 B14R1.419 C[C@H](N)c1ccc(cc1)OCC(=O)[O-] 34a_100161106496_100020667443 [0,1,0,0,0,1|2,0,0]=4 6394 B14R1.419 C[C@H](N)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000753911 [0,1,0,0,0,1|2,0,0]=4 6395 B14R1.419 C[C@H](N)c1ccc(cc1)SCC(=O)N 62a_100000753911_100000747473 [0,1,0,0,0,1|2,0,0]=4 6396 B14R1.419 C[C@H](N)c1ccc(cc1)SCC(=O)[O-] 62a_100000753911_100020667443 [0,1,0,0,0,1|2,0,0]=4 6397 B14R1.419 C[C@H](N)c1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000753911 [0,1,0,0,0,1|2,0,0]=4 6398 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)N 34a_100010188728_100000187820 [0,1,0,0,0,1|1,1,0]=4 6399 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)N 7a_100010188728_100000187820 [0,1,0,0,0,1|1,1,0]=4 6400 B14R1.419 C[S+](C)c1ccc(cc1)OCC(=O)[O-] 34a_100010188728_100020667443 [0,1,0,0,0,1|1,1,0]=4 6401 B14R1.419 [13CH3]C(=O)CCc1ccc(cc1)[N+](=O)[O-] 1458a_100000741710_200025704644 [0,1,0,0,0,1|2,0,0]=4 6402 B14R1.419 [13CH3]C(=O)COc1ccc(cc1)[N+](=O)[O-] 1458a_100000181393_200025704644 [0,1,0,0,0,1|2,0,0]=4 6403 B14R1.419 [13CH3]C(=O)CSc1ccc(cc1)[N+](=O)[O-] 1458a_100000156286_200025704644 [0,1,0,0,0,1|2,0,0]=4 6404 B14R1.419 [13CH3]C(=O)c1ccc(cc1)OCC(=O)N 1458a_100000186835_200025704644 [0,1,0,0,0,1|2,0,0]=4 6405 B14R1.3653 C=C(C)CNc1ccc(c(c1)Br)OC 34a_100000187427_100000748629 [0,1,0,0,0,1|1,0,0]=3 6406 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 2230a_100000743268_100000748629 [0,1,0,0,0,1|1,0,0]=3 6407 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 34a_100000743268_100000748629 [0,1,0,0,0,1|1,0,0]=3 6408 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 7a_100000743268_100000748629 [0,1,0,0,0,1|1,0,0]=3 6409 B14R1.3653 C=C(C)CNc1ccc(c(c1)Cl)CC 2230a_100000766362_100000748629 [0,1,0,0,0,1|2,0,0]=4 6410 B14R1.3653 C=C(C)CNc1ccc(c(c1)Cl)CC 34a_100000766362_100000748629 [0,1,0,0,0,1|2,0,0]=4 6411 B14R1.3653 C=C(C)CNc1ccc(c(c1)Cl)CC 7a_100000766362_100000748629 [0,1,0,0,0,1|2,0,0]=4 6412 B14R1.3653 C=C(C)CNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000748629 [0,1,0,0,0,1|1,0,0]=3 6413 B14R1.3653 C=C(C)CNc1ccc(c(c1)Cl)OC 34a_100000211044_100000748629 [0,1,0,0,0,1|1,0,0]=3 6414 B14R1.3653 C=C(C)CNc1ccc(c(c1)F)OC 2230a_100000740183_100000748629 [0,1,0,0,0,1|1,0,0]=3 6415 B14R1.3653 C=C(C)CNc1ccc(c(c1)F)OC 34a_100000740183_100000748629 [0,1,0,0,0,1|1,0,0]=3 6416 B14R1.3653 C=C(C)CNc1ccc(c(c1)F)SC 2230a_100000762756_100000748629 [0,1,0,0,0,1|1,1,0]=4 6417 B14R1.3653 C=C(C)CNc1ccc(c(c1)F)SC 34a_100000762756_100000748629 [0,1,0,0,0,1|1,1,0]=4 6418 B14R1.3653 C=C(C)CNc1ccc(c(c1)I)OC 34a_100011356947_100000748629 [0,1,0,0,0,1|1,0,0]=3 6419 B14R1.3653 C=C(C)CNc1ccc(c(c1)O)OC 34a_100000211920_100000748629 [0,1,0,0,0,1|1,0,0]=3 6420 B14R1.3653 C=C(C)CNc1ccc(c(n1)F)OC 27a_100000765925_100010138636 [0,1,0,0,0,1|2,0,0]=4 6421 B14R1.3653 C=C(C)COc1ccc(c(c1)Br)OC 34a_100010234764_100000748629 [0,1,0,0,0,1|1,0,0]=3 6422 B14R1.3653 C=C(C)COc1ccc(c(c1)Br)OC 7a_100010234764_100000748629 [0,1,0,0,0,1|1,0,0]=3 6423 B14R1.3653 C=C(C)COc1ccc(c(c1)C)NC 34a_100161107805_100000748629 [0,1,0,0,0,1|2,0,0]=4 6424 B14R1.3653 C=C(C)COc1ccc(c(c1)C)NC 7a_100161107805_100000748629 [0,1,0,0,0,1|2,0,0]=4 6425 B14R1.3653 C=C(C)COc1ccc(c(c1)C)OC 34a_100000759738_100000748629 [0,1,0,0,0,1|1,0,0]=3 6426 B14R1.3653 C=C(C)COc1ccc(c(c1)C)OC 7a_100000759738_100000748629 [0,1,0,0,0,1|1,0,0]=3 6427 B14R1.3653 C=C(C)COc1ccc(c(c1)C)SC 34a_100000030144_100000748629 [0,1,0,0,0,1|1,1,0]=4 6428 B14R1.3653 C=C(C)COc1ccc(c(c1)Cl)CC 34a_100009886192_100000748629 [0,1,0,0,0,1|2,0,0]=4 6429 B14R1.3653 C=C(C)COc1ccc(c(c1)Cl)CC 7a_100009886192_100000748629 [0,1,0,0,0,1|2,0,0]=4 6430 B14R1.3653 C=C(C)COc1ccc(c(c1)Cl)OC 34a_200009861682_100000748629 [0,1,0,0,0,1|1,0,0]=3 6431 B14R1.3653 C=C(C)COc1ccc(c(c1)Cl)OC 7a_200009861682_100000748629 [0,1,0,0,0,1|1,0,0]=3 6432 B14R1.3653 C=C(C)COc1ccc(c(c1)F)OC 34a_100000746305_100000748629 [0,1,0,0,0,1|1,0,0]=3 6433 B14R1.3653 C=C(C)COc1ccc(c(c1)F)OC 7a_100000746305_100000748629 [0,1,0,0,0,1|1,0,0]=3 6434 B14R1.3653 C=C(C)COc1ccc(c(c1)I)OC 34a_100010084122_100000748629 [0,1,0,0,0,1|1,0,0]=3 6435 B14R1.3653 C=C(C)COc1ccc(c(c1)I)OC 7a_100010084122_100000748629 [0,1,0,0,0,1|1,0,0]=3 6436 B14R1.3653 C=C(C)CSc1cc(c(cn1)OC)N 62a_100000748629_100010896307 [0,1,0,0,0,1|2,0,0]=4 6437 B14R1.3653 C=C(C)CSc1cc(c(cn1)OC)N 62a_100010896307_100000211660 [0,1,0,0,0,1|2,0,0]=4 6438 B14R1.3653 C=C(C)CSc1cc(c(cn1)OC)O 62a_100000748629_100010264082 [0,1,0,0,0,1|2,0,0]=4 6439 B14R1.3653 C=C(C)CSc1ccc(c(c1)Br)OC 62a_100000748629_100011249507 [0,1,0,0,0,1|1,0,0]=3 6440 B14R1.3653 C=C(C)CSc1ccc(c(c1)Br)OC 62a_100011249507_100000211660 [0,1,0,0,0,1|1,0,0]=3 6441 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)NC 62a_100000221803_100000211660 [0,1,0,0,0,1|2,0,0]=4 6442 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)NC 62a_100000748629_100000221803 [0,1,0,0,0,1|2,0,0]=4 6443 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)OC 62a_100000748629_100011219705 [0,1,0,0,0,1|1,0,0]=3 6444 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)OC 62a_100011219705_100000211660 [0,1,0,0,0,1|1,0,0]=3 6445 B14R1.3653 C=C(C)CSc1ccc(c(c1)Cl)OC 62a_100000748629_100012355395 [0,1,0,0,0,1|1,0,0]=3 6446 B14R1.3653 C=C(C)CSc1ccc(c(c1)Cl)OC 62a_100012355395_100000211660 [0,1,0,0,0,1|1,0,0]=3 6447 B14R1.3653 C=C(C)CSc1ccc(c(c1)Cl)SC 62a_100000748629_206447510565 [0,1,0,0,0,1|1,1,0]=4 6448 B14R1.3653 C=C(C)CSc1ccc(c(c1)Cl)SC 62a_206447510565_100000211660 [0,1,0,0,0,1|1,1,0]=4 6449 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)CC 62a_100000748629_200010071577 [0,1,0,0,0,1|2,0,0]=4 6450 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)CC 62a_200010071577_100000211660 [0,1,0,0,0,1|2,0,0]=4 6451 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)NC 62a_100000743884_100000211660 [0,1,0,0,0,1|2,0,0]=4 6452 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)NC 62a_100000748629_100000743884 [0,1,0,0,0,1|2,0,0]=4 6453 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)OC 62a_100000171752_100000211660 [0,1,0,0,0,1|1,0,0]=3 6454 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)OC 62a_100000748629_100000171752 [0,1,0,0,0,1|1,0,0]=3 6455 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)SC 62a_100000748629_100010161220 [0,1,0,0,0,1|1,1,0]=4 6456 B14R1.3653 C=C(C)CSc1ccc(c(c1)F)SC 62a_100010161220_100000211660 [0,1,0,0,0,1|1,1,0]=4 6457 B14R1.3653 C=C(C)CSc1ccc(c(c1)N)CC 62a_100000748629_100012354963 [0,1,0,0,0,1|2,0,0]=4 6458 B14R1.3653 C=C(C)CSc1ccc(c(c1)N)CC 62a_100012354963_100000211660 [0,1,0,0,0,1|2,0,0]=4 6459 B14R1.3653 C=C(C)CSc1ccc(c(c1)N)NC 62a_100000741790_100000211660 [0,1,0,0,0,1|2,0,0]=4 6460 B14R1.3653 C=C(C)CSc1ccc(c(c1)N)OC 62a_100000748629_100011249504 [0,1,0,0,0,1|1,0,0]=3 6461 B14R1.3653 C=C(C)CSc1ccc(c(c1)N)OC 62a_100011249504_100000211660 [0,1,0,0,0,1|1,0,0]=3 6462 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)OC 62a_100000748629_100009816560 [0,1,0,0,0,1|1,0,0]=3 6463 B14R1.3653 C=C(C)CSc1ccc(c(n1)Br)OC 62a_100000748629_100010214827 [0,1,0,0,0,1|2,0,0]=4 6464 B14R1.3653 C=C(C)CSc1ccc(c(n1)Br)OC 62a_100010214827_100000211660 [0,1,0,0,0,1|2,0,0]=4 6465 B14R1.3653 C=C(C)CSc1ccc(c(n1)C)OC 62a_100000748629_100010244750 [0,1,0,0,0,1|2,0,0]=4 6466 B14R1.3653 C=C(C)CSc1ccc(c(n1)C)OC 62a_100010244750_100000211660 [0,1,0,0,0,1|2,0,0]=4 6467 B14R1.3653 C=C(C)CSc1ccc(c(n1)Cl)OC 62a_100000748629_100010233546 [0,1,0,0,0,1|2,0,0]=4 6468 B14R1.3653 C=C(C)CSc1ccc(c(n1)F)OC 62a_100000748629_100010138636 [0,1,0,0,0,1|2,0,0]=4 6469 B14R1.3653 C=C(C)CSc1ccc(c(n1)F)OC 62a_100010138636_100000211660 [0,1,0,0,0,1|2,0,0]=4 6470 B14R1.3653 C=C(C)CSc1ccc(c(n1)N)OC 62a_100010192976_100000211660 [0,1,0,0,0,1|2,0,0]=4 6471 B14R1.3653 C=C(C)CSc1cnc(c(c1)Br)OC 62a_100000748629_200010988584 [0,1,0,0,0,1|2,0,0]=4 6472 B14R1.3653 C=C(C)CSc1cnc(c(c1)Br)OC 62a_200010988584_100000211660 [0,1,0,0,0,1|2,0,0]=4 6473 B14R1.3653 C=C(C)CSc1cnc(c(c1)C)OC 62a_100000748629_100011290809 [0,1,0,0,0,1|2,0,0]=4 6474 B14R1.3653 C=C(C)CSc1cnc(c(c1)C)OC 62a_100011290809_100000211660 [0,1,0,0,0,1|2,0,0]=4 6475 B14R1.3653 C=C(C)CSc1cnc(c(c1)F)OC 62a_100000748629_100011880707 [0,1,0,0,0,1|2,0,0]=4 6476 B14R1.3653 C=C(C)CSc1cnc(c(c1)F)OC 62a_100011880707_100000211660 [0,1,0,0,0,1|2,0,0]=4 6477 B14R1.3653 C=C(C)CSc1cnc(c(c1)N)OC 62a_100000748608_100000211660 [0,1,0,0,0,1|2,0,0]=4 6478 B14R1.3653 C=C(C)CSc1cnc(c(c1)N)OC 62a_100000748629_100000748608 [0,1,0,0,0,1|2,0,0]=4 6479 B14R1.3653 C=C(C)CSc1cnc(c(c1)O)OC 62a_100000748629_100010135713 [0,1,0,0,0,1|2,0,0]=4 6480 B14R1.3653 C=C(F)CNc1ccc(c(c1)Br)OC 34a_100000187427_100009893438 [0,1,0,0,0,1|1,0,1]=4 6481 B14R1.3653 C=C(F)CNc1ccc(c(c1)C)OC 2230a_100000743268_100009893438 [0,1,0,0,0,1|1,0,1]=4 6482 B14R1.3653 C=C(F)CNc1ccc(c(c1)C)OC 34a_100000743268_100009893438 [0,1,0,0,0,1|1,0,1]=4 6483 B14R1.3653 C=C(F)CNc1ccc(c(c1)C)OC 7a_100000743268_100000042424 [0,1,0,0,0,1|1,0,1]=4 6484 B14R1.3653 C=C(F)CNc1ccc(c(c1)Cl)OC 2230a_100000211044_100009893438 [0,1,0,0,0,1|1,0,1]=4 6485 B14R1.3653 C=C(F)CNc1ccc(c(c1)Cl)OC 34a_100000211044_100009893438 [0,1,0,0,0,1|1,0,1]=4 6486 B14R1.3653 C=C(F)CNc1ccc(c(c1)F)OC 2230a_100000740183_100009893438 [0,1,0,0,0,1|1,0,1]=4 6487 B14R1.3653 C=C(F)CNc1ccc(c(c1)F)OC 34a_100000740183_100009893438 [0,1,0,0,0,1|1,0,1]=4 6488 B14R1.3653 C=C(F)CNc1ccc(c(c1)I)OC 34a_100011356947_100009893438 [0,1,0,0,0,1|1,0,1]=4 6489 B14R1.3653 C=C(F)CNc1ccc(c(c1)O)OC 34a_100000211920_100009893438 [0,1,0,0,0,1|1,0,1]=4 6490 B14R1.3653 C=C(F)COc1ccc(c(c1)Br)OC 34a_100010234764_100009893438 [0,1,0,0,0,1|1,0,1]=4 6491 B14R1.3653 C=C(F)COc1ccc(c(c1)Br)OC 7a_100010234764_100000042424 [0,1,0,0,0,1|1,0,1]=4 6492 B14R1.3653 C=C(F)COc1ccc(c(c1)C)OC 34a_100000759738_100009893438 [0,1,0,0,0,1|1,0,1]=4 6493 B14R1.3653 C=C(F)COc1ccc(c(c1)C)OC 7a_100000759738_100000042424 [0,1,0,0,0,1|1,0,1]=4 6494 B14R1.3653 C=C(F)COc1ccc(c(c1)Cl)OC 34a_200009861682_100009893438 [0,1,0,0,0,1|1,0,1]=4 6495 B14R1.3653 C=C(F)COc1ccc(c(c1)Cl)OC 7a_200009861682_100000042424 [0,1,0,0,0,1|1,0,1]=4 6496 B14R1.3653 C=C(F)COc1ccc(c(c1)F)OC 34a_100000746305_100009893438 [0,1,0,0,0,1|1,0,1]=4 6497 B14R1.3653 C=C(F)COc1ccc(c(c1)F)OC 7a_100000746305_100000042424 [0,1,0,0,0,1|1,0,1]=4 6498 B14R1.3653 C=C(F)COc1ccc(c(c1)I)OC 34a_100010084122_100009893438 [0,1,0,0,0,1|1,0,1]=4 6499 B14R1.3653 C=C(F)COc1ccc(c(c1)I)OC 7a_100010084122_100000042424 [0,1,0,0,0,1|1,0,1]=4 6500 B14R1.3653 C=C(F)CSc1ccc(c(c1)Br)OC 62a_100000042424_100011249507 [0,1,0,0,0,1|1,0,1]=4 6501 B14R1.3653 C=C(F)CSc1ccc(c(c1)Br)OC 62a_100011249507_100000042424 [0,1,0,0,0,1|1,0,1]=4 6502 B14R1.3653 C=C(F)CSc1ccc(c(c1)C)OC 62a_100000042424_100011219705 [0,1,0,0,0,1|1,0,1]=4 6503 B14R1.3653 C=C(F)CSc1ccc(c(c1)C)OC 62a_100011219705_100000042424 [0,1,0,0,0,1|1,0,1]=4 6504 B14R1.3653 C=C(F)CSc1ccc(c(c1)Cl)OC 62a_100000042424_100012355395 [0,1,0,0,0,1|1,0,1]=4 6505 B14R1.3653 C=C(F)CSc1ccc(c(c1)Cl)OC 62a_100012355395_100000042424 [0,1,0,0,0,1|1,0,1]=4 6506 B14R1.3653 C=C(F)CSc1ccc(c(c1)F)OC 62a_100000042424_100000171752 [0,1,0,0,0,1|1,0,1]=4 6507 B14R1.3653 C=C(F)CSc1ccc(c(c1)F)OC 62a_100000171752_100000042424 [0,1,0,0,0,1|1,0,1]=4 6508 B14R1.3653 C=C(F)CSc1ccc(c(c1)N)OC 62a_100000042424_100011249504 [0,1,0,0,0,1|1,0,1]=4 6509 B14R1.3653 C=C(F)CSc1ccc(c(c1)N)OC 62a_100011249504_100000042424 [0,1,0,0,0,1|1,0,1]=4 6510 B14R1.3653 C=C(F)CSc1ccc(c(c1)O)OC 62a_100000042424_100009816560 [0,1,0,0,0,1|1,0,1]=4 6511 B14R1.3653 CC(=O)NCc1ccc(c(c1)F)C#N 11a_100015204769_100015343762 [0,1,0,0,0,1|2,0,0]=4 6512 B14R1.3653 CC(=O)NCc1ccc(c(c1)F)C#N 1626a_100015204769_100015343762 [0,1,0,0,0,1|2,0,0]=4 6513 B14R1.3653 CC(=O)NCc1ccc(c(c1)F)C#N 240690a_100015204769_100015343762 [0,1,0,0,0,1|2,0,0]=4 6514 B14R1.3653 CC(=O)NCc1ccc(c(c1)F)C#N 527a_100015204769_100103153847 [0,1,0,0,0,1|2,0,0]=4 6515 B14R1.3653 CCc1ccc(cc1Cl)NCC(=O)N 2230a_100000766362_100000747473 [0,1,0,0,0,1|2,0,0]=4 6516 B14R1.3653 CCc1ccc(cc1Cl)NCC(=O)N 34a_100000766362_100000187820 [0,1,0,0,0,1|2,0,0]=4 6517 B14R1.3653 CCc1ccc(cc1Cl)NCC(=O)N 7a_100000766362_100000187820 [0,1,0,0,0,1|2,0,0]=4 6518 B14R1.3653 CCc1ccc(cc1Cl)NCC(=O)[O-] 34a_100000766362_100020667443 [0,1,0,0,0,1|2,0,0]=4 6519 B14R1.3653 CCc1ccc(cc1Cl)OCC(=O)N 34a_100009886192_100000187820 [0,1,0,0,0,1|2,0,0]=4 6520 B14R1.3653 CCc1ccc(cc1Cl)OCC(=O)N 7a_100009886192_100000187820 [0,1,0,0,0,1|2,0,0]=4 6521 B14R1.3653 CCc1ccc(cc1Cl)OCC(=O)[O-] 34a_100009886192_100020667443 [0,1,0,0,0,1|2,0,0]=4 6522 B14R1.3653 CCc1ccc(cc1F)SCC(=O)N 62a_100000747473_200010071577 [0,1,0,0,0,1|2,0,0]=4 6523 B14R1.3653 CCc1ccc(cc1F)SCC(=O)N 62a_200010071577_100000747473 [0,1,0,0,0,1|2,0,0]=4 6524 B14R1.3653 CCc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_200010071577 [0,1,0,0,0,1|2,0,0]=4 6525 B14R1.3653 CCc1ccc(cc1F)SCC(=O)[O-] 62a_200010071577_100020667443 [0,1,0,0,0,1|2,0,0]=4 6526 B14R1.3653 CCc1ccc(cc1N)SCC(=O)N 62a_100000747473_100012354963 [0,1,0,0,0,1|2,0,0]=4 6527 B14R1.3653 CCc1ccc(cc1N)SCC(=O)N 62a_100012354963_100000747473 [0,1,0,0,0,1|2,0,0]=4 6528 B14R1.3653 CCc1ccc(cc1N)SCC(=O)[O-] 62a_100012354963_100020667443 [0,1,0,0,0,1|2,0,0]=4 6529 B14R1.3653 CCc1ccc(cc1N)SCC(=O)[O-] 62a_100020667443_100012354963 [0,1,0,0,0,1|2,0,0]=4 6530 B14R1.3653 CNc1ccc(cc1C)OCC(=O)N 34a_100161107805_100000187820 [0,1,0,0,0,1|2,0,0]=4 6531 B14R1.3653 CNc1ccc(cc1C)OCC(=O)N 7a_100161107805_100000187820 [0,1,0,0,0,1|2,0,0]=4 6532 B14R1.3653 CNc1ccc(cc1C)OCC(=O)[O-] 34a_100161107805_100020667443 [0,1,0,0,0,1|2,0,0]=4 6533 B14R1.3653 CNc1ccc(cc1C)SCC(=O)N 62a_100000221803_100000747473 [0,1,0,0,0,1|2,0,0]=4 6534 B14R1.3653 CNc1ccc(cc1C)SCC(=O)N 62a_100000747473_100000221803 [0,1,0,0,0,1|2,0,0]=4 6535 B14R1.3653 CNc1ccc(cc1C)SCC(=O)[O-] 62a_100000221803_100020667443 [0,1,0,0,0,1|2,0,0]=4 6536 B14R1.3653 CNc1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100000221803 [0,1,0,0,0,1|2,0,0]=4 6537 B14R1.3653 CNc1ccc(cc1F)SCC(=O)N 62a_100000743884_100000747473 [0,1,0,0,0,1|2,0,0]=4 6538 B14R1.3653 CNc1ccc(cc1F)SCC(=O)N 62a_100000747473_100000743884 [0,1,0,0,0,1|2,0,0]=4 6539 B14R1.3653 CNc1ccc(cc1F)SCC(=O)[O-] 62a_100000743884_100020667443 [0,1,0,0,0,1|2,0,0]=4 6540 B14R1.3653 CNc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_100000743884 [0,1,0,0,0,1|2,0,0]=4 6541 B14R1.3653 CNc1ccc(cc1N)SCC(=O)N 62a_100000741790_100000747473 [0,1,0,0,0,1|2,0,0]=4 6542 B14R1.3653 CNc1ccc(cc1N)SCC(=O)[O-] 62a_100000741790_100020667443 [0,1,0,0,0,1|2,0,0]=4 6543 B14R1.3653 COc1ccc(cc1Br)C=CC(=O)C 1458a_200000186738_200000210301 [0,1,0,0,0,1|0,0,1]=3 6544 B14R1.3653 COc1ccc(cc1Br)C=CC(=O)[13CH3] 1458a_200000186738_200025704644 [0,1,0,0,0,1|0,0,1]=3 6545 B14R1.3653 COc1ccc(cc1Br)CCC(=O)C 1458a_100000736731_200000210301 [0,1,0,0,0,1|0,0,0]=2 6546 B14R1.3653 COc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100000736731_200025704644 [0,1,0,0,0,1|0,0,0]=2 6547 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 11a_100159240714_100015343762 [0,1,0,0,0,1|0,0,0]=2 6548 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 1626a_100159240714_100015343762 [0,1,0,0,0,1|0,0,0]=2 6549 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 240690a_100159240714_100015343762 [0,1,0,0,0,1|0,0,0]=2 6550 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 527a_100159240714_100103153847 [0,1,0,0,0,1|0,0,0]=2 6551 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 207a_100138425928_100000173361 [0,1,0,0,0,1|1,0,1]=4 6552 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 2230a_100138425928_200011397701 [0,1,0,0,0,1|1,0,1]=4 6553 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 34a_100138425928_200011397701 [0,1,0,0,0,1|1,0,1]=4 6554 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 34a_100159240714_100000210206 [0,1,0,0,0,1|1,0,1]=4 6555 B14R1.3653 COc1ccc(cc1Br)COC(C)C 34a_100000212225_200011397701 [0,1,0,0,0,1|1,0,1]=4 6556 B14R1.3653 COc1ccc(cc1Br)COC(C)C 34a_100000246451_100000210206 [0,1,0,0,0,1|1,0,1]=4 6557 B14R1.3653 COc1ccc(cc1Br)COC(C)C 7a_100000246451_100000210206 [0,1,0,0,0,1|1,0,1]=4 6558 B14R1.3653 COc1ccc(cc1Br)CSC(C)C 62a_100000210206_200011397701 [0,1,0,0,0,1|1,0,1]=4 6559 B14R1.3653 COc1ccc(cc1Br)CSC(C)C 62a_200011397701_100000210206 [0,1,0,0,0,1|1,0,1]=4 6560 B14R1.3653 COc1ccc(cc1Br)NCC(=O)N 34a_100000187427_100000187820 [0,1,0,0,0,1|1,0,0]=3 6561 B14R1.3653 COc1ccc(cc1Br)NCC(=O)[O-] 34a_100000187427_100020667443 [0,1,0,0,0,1|1,0,0]=3 6562 B14R1.3653 COc1ccc(cc1Br)NCC(C)C 34a_100000187427_100000210624 [0,1,0,0,0,1|1,0,1]=4 6563 B14R1.3653 COc1ccc(cc1Br)NCC(C)O 34a_100000187427_100011218427 [0,1,0,0,0,1|0,0,2]=4 6564 B14R1.3653 COc1ccc(cc1Br)NC[C@@H](C)O 34a_100000187427_100009817552 [0,1,0,0,0,1|0,0,2]=4 6565 B14R1.3653 COc1ccc(cc1Br)NC[N+](=O)[O-] 34a_100000187427_100000761209 [0,1,0,0,0,1|2,0,0]=4 6566 B14R1.3653 COc1ccc(cc1Br)OCC(=O)N 34a_100010234764_100000187820 [0,1,0,0,0,1|1,0,0]=3 6567 B14R1.3653 COc1ccc(cc1Br)OCC(=O)N 7a_100010234764_100000187820 [0,1,0,0,0,1|1,0,0]=3 6568 B14R1.3653 COc1ccc(cc1Br)OCC(=O)[O-] 34a_100010234764_100020667443 [0,1,0,0,0,1|1,0,0]=3 6569 B14R1.3653 COc1ccc(cc1Br)OCC(C)C 34a_100010234764_100000210624 [0,1,0,0,0,1|1,0,1]=4 6570 B14R1.3653 COc1ccc(cc1Br)OCC(C)C 7a_100010234764_100000210760 [0,1,0,0,0,1|1,0,1]=4 6571 B14R1.3653 COc1ccc(cc1Br)OCC(C)O 34a_100010234764_100011218427 [0,1,0,0,0,1|0,0,2]=4 6572 B14R1.3653 COc1ccc(cc1Br)OCC(C)O 7a_100010234764_100011218427 [0,1,0,0,0,1|0,0,2]=4 6573 B14R1.3653 COc1ccc(cc1Br)OC[C@@H](C)O 34a_100010234764_100009817552 [0,1,0,0,0,1|0,0,2]=4 6574 B14R1.3653 COc1ccc(cc1Br)OC[C@@H](C)O 7a_100010234764_100009817552 [0,1,0,0,0,1|0,0,2]=4 6575 B14R1.3653 COc1ccc(cc1Br)OC[N+](=O)[O-] 34a_100010234764_100000761209 [0,1,0,0,0,1|2,0,0]=4 6576 B14R1.3653 COc1ccc(cc1Br)SCC(=O)N 62a_100000747473_100011249507 [0,1,0,0,0,1|1,0,0]=3 6577 B14R1.3653 COc1ccc(cc1Br)SCC(=O)N 62a_100011249507_100000747473 [0,1,0,0,0,1|1,0,0]=3 6578 B14R1.3653 COc1ccc(cc1Br)SCC(=O)[O-] 62a_100011249507_100020667443 [0,1,0,0,0,1|1,0,0]=3 6579 B14R1.3653 COc1ccc(cc1Br)SCC(=O)[O-] 62a_100020667443_100011249507 [0,1,0,0,0,1|1,0,0]=3 6580 B14R1.3653 COc1ccc(cc1Br)SCC(C)C 62a_100000210624_100011249507 [0,1,0,0,0,1|1,0,1]=4 6581 B14R1.3653 COc1ccc(cc1Br)SCC(C)C 62a_100011249507_100000210760 [0,1,0,0,0,1|1,0,1]=4 6582 B14R1.3653 COc1ccc(cc1Br)SCC(C)O 62a_100011218427_100011249507 [0,1,0,0,0,1|0,0,2]=4 6583 B14R1.3653 COc1ccc(cc1Br)SCC(C)O 62a_100011249507_100011218427 [0,1,0,0,0,1|0,0,2]=4 6584 B14R1.3653 COc1ccc(cc1Br)SC[C@@H](C)O 62a_100009817552_100011249507 [0,1,0,0,0,1|0,0,2]=4 6585 B14R1.3653 COc1ccc(cc1Br)SC[C@@H](C)O 62a_100011249507_100009817552 [0,1,0,0,0,1|0,0,2]=4 6586 B14R1.3653 COc1ccc(cc1Br)SC[N+](=O)[O-] 62a_100011249507_100000761209 [0,1,0,0,0,1|2,0,0]=4 6587 B14R1.3653 COc1ccc(cc1C)C=CC(=O)C 1458a_100116352456_200000210301 [0,1,0,0,0,1|0,0,1]=3 6588 B14R1.3653 COc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100116352456_200025704644 [0,1,0,0,0,1|0,0,1]=3 6589 B14R1.3653 COc1ccc(cc1C)CCC(=O)C 1458a_100011616661_200000210301 [0,1,0,0,0,1|0,0,0]=2 6590 B14R1.3653 COc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011616661_200025704644 [0,1,0,0,0,1|0,0,0]=2 6591 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 11a_100102679029_100015343762 [0,1,0,0,0,1|0,0,0]=2 6592 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 1626a_100102679029_100015343762 [0,1,0,0,0,1|0,0,0]=2 6593 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 240690a_100102679029_100015343762 [0,1,0,0,0,1|0,0,0]=2 6594 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 527a_100102679029_100103153847 [0,1,0,0,0,1|0,0,0]=2 6595 B14R1.3653 COc1ccc(cc1C)CNC(C)C 207a_100138425928_100000239718 [0,1,0,0,0,1|1,0,1]=4 6596 B14R1.3653 COc1ccc(cc1C)CNC(C)C 2230a_100102679029_100000210206 [0,1,0,0,0,1|1,0,1]=4 6597 B14R1.3653 COc1ccc(cc1C)CNC(C)C 2230a_100138425928_200011290836 [0,1,0,0,0,1|1,0,1]=4 6598 B14R1.3653 COc1ccc(cc1C)CNC(C)C 34a_100102679029_100000210206 [0,1,0,0,0,1|1,0,1]=4 6599 B14R1.3653 COc1ccc(cc1C)CNC(C)C 34a_100138425928_200011290836 [0,1,0,0,0,1|1,0,1]=4 6600 B14R1.3653 COc1ccc(cc1C)COC(C)C 34a_100000212225_200011290836 [0,1,0,0,0,1|1,0,1]=4 6601 B14R1.3653 COc1ccc(cc1C)COC(C)C 34a_200011290855_100000210206 [0,1,0,0,0,1|1,0,1]=4 6602 B14R1.3653 COc1ccc(cc1C)COC(C)C 7a_200011290855_100000210206 [0,1,0,0,0,1|1,0,1]=4 6603 B14R1.3653 COc1ccc(cc1C)CSC(C)C 62a_100000210206_200011290836 [0,1,0,0,0,1|1,0,1]=4 6604 B14R1.3653 COc1ccc(cc1C)CSC(C)C 62a_200011290836_100000210206 [0,1,0,0,0,1|1,0,1]=4 6605 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 2230a_100000743268_100000747473 [0,1,0,0,0,1|1,0,0]=3 6606 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 34a_100000743268_100000187820 [0,1,0,0,0,1|1,0,0]=3 6607 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 7a_100000743268_100000187820 [0,1,0,0,0,1|1,0,0]=3 6608 B14R1.3653 COc1ccc(cc1C)NCC(=O)[O-] 34a_100000743268_100020667443 [0,1,0,0,0,1|1,0,0]=3 6609 B14R1.3653 COc1ccc(cc1C)NCC(C)C 2230a_100000743268_100000210760 [0,1,0,0,0,1|1,0,1]=4 6610 B14R1.3653 COc1ccc(cc1C)NCC(C)C 34a_100000743268_100000210624 [0,1,0,0,0,1|1,0,1]=4 6611 B14R1.3653 COc1ccc(cc1C)NCC(C)C 7a_100000743268_100000210760 [0,1,0,0,0,1|1,0,1]=4 6612 B14R1.3653 COc1ccc(cc1C)NCC(C)O 2230a_100000743268_100011218427 [0,1,0,0,0,1|0,0,2]=4 6613 B14R1.3653 COc1ccc(cc1C)NCC(C)O 34a_100000743268_100011218427 [0,1,0,0,0,1|0,0,2]=4 6614 B14R1.3653 COc1ccc(cc1C)NCC(C)O 7a_100000743268_100011218427 [0,1,0,0,0,1|0,0,2]=4 6615 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 2230a_100000743268_100009817552 [0,1,0,0,0,1|0,0,2]=4 6616 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 34a_100000743268_100009817552 [0,1,0,0,0,1|0,0,2]=4 6617 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 7a_100000743268_100009817552 [0,1,0,0,0,1|0,0,2]=4 6618 B14R1.3653 COc1ccc(cc1C)NC[N+](=O)[O-] 34a_100000743268_100000761209 [0,1,0,0,0,1|2,0,0]=4 6619 B14R1.3653 COc1ccc(cc1C)OCC(=O)N 34a_100000759738_100000187820 [0,1,0,0,0,1|1,0,0]=3 6620 B14R1.3653 COc1ccc(cc1C)OCC(=O)N 7a_100000759738_100000187820 [0,1,0,0,0,1|1,0,0]=3 6621 B14R1.3653 COc1ccc(cc1C)OCC(=O)[O-] 34a_100000759738_100020667443 [0,1,0,0,0,1|1,0,0]=3 6622 B14R1.3653 COc1ccc(cc1C)OCC(C)C 34a_100000759738_100000210624 [0,1,0,0,0,1|1,0,1]=4 6623 B14R1.3653 COc1ccc(cc1C)OCC(C)C 7a_100000759738_100000210760 [0,1,0,0,0,1|1,0,1]=4 6624 B14R1.3653 COc1ccc(cc1C)OCC(C)O 34a_100000759738_100011218427 [0,1,0,0,0,1|0,0,2]=4 6625 B14R1.3653 COc1ccc(cc1C)OCC(C)O 7a_100000759738_100011218427 [0,1,0,0,0,1|0,0,2]=4 6626 B14R1.3653 COc1ccc(cc1C)OC[C@@H](C)O 34a_100000759738_100009817552 [0,1,0,0,0,1|0,0,2]=4 6627 B14R1.3653 COc1ccc(cc1C)OC[C@@H](C)O 7a_100000759738_100009817552 [0,1,0,0,0,1|0,0,2]=4 6628 B14R1.3653 COc1ccc(cc1C)OC[N+](=O)[O-] 34a_100000759738_100000761209 [0,1,0,0,0,1|2,0,0]=4 6629 B14R1.3653 COc1ccc(cc1C)SCC(=O)N 62a_100000747473_100011219705 [0,1,0,0,0,1|1,0,0]=3 6630 B14R1.3653 COc1ccc(cc1C)SCC(=O)N 62a_100011219705_100000747473 [0,1,0,0,0,1|1,0,0]=3 6631 B14R1.3653 COc1ccc(cc1C)SCC(=O)[O-] 62a_100011219705_100020667443 [0,1,0,0,0,1|1,0,0]=3 6632 B14R1.3653 COc1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100011219705 [0,1,0,0,0,1|1,0,0]=3 6633 B14R1.3653 COc1ccc(cc1C)SCC(C)C 62a_100000210624_100011219705 [0,1,0,0,0,1|1,0,1]=4 6634 B14R1.3653 COc1ccc(cc1C)SCC(C)C 62a_100011219705_100000210760 [0,1,0,0,0,1|1,0,1]=4 6635 B14R1.3653 COc1ccc(cc1C)SCC(C)O 62a_100011218427_100011219705 [0,1,0,0,0,1|0,0,2]=4 6636 B14R1.3653 COc1ccc(cc1C)SCC(C)O 62a_100011219705_100011218427 [0,1,0,0,0,1|0,0,2]=4 6637 B14R1.3653 COc1ccc(cc1C)SC[C@@H](C)O 62a_100009817552_100011219705 [0,1,0,0,0,1|0,0,2]=4 6638 B14R1.3653 COc1ccc(cc1C)SC[C@@H](C)O 62a_100011219705_100009817552 [0,1,0,0,0,1|0,0,2]=4 6639 B14R1.3653 COc1ccc(cc1C)SC[N+](=O)[O-] 62a_100011219705_100000761209 [0,1,0,0,0,1|2,0,0]=4 6640 B14R1.3653 COc1ccc(cc1Cl)C=CC(=O)C 1458a_100000735007_200000210301 [0,1,0,0,0,1|0,0,1]=3 6641 B14R1.3653 COc1ccc(cc1Cl)C=CC(=O)[13CH3] 1458a_100000735007_200025704644 [0,1,0,0,0,1|0,0,1]=3 6642 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)C 1458a_100000735577_200000210301 [0,1,0,0,0,1|0,0,0]=2 6643 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)[13CH3] 1458a_100000735577_200025704644 [0,1,0,0,0,1|0,0,0]=2 6644 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 11a_100000008799_100015343762 [0,1,0,0,0,1|0,0,0]=2 6645 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 1626a_100000008799_100015343762 [0,1,0,0,0,1|0,0,0]=2 6646 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 240690a_100000008799_100015343762 [0,1,0,0,0,1|0,0,0]=2 6647 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 527a_100000008799_100103153847 [0,1,0,0,0,1|0,0,0]=2 6648 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 207a_100138425928_100000186747 [0,1,0,0,0,1|1,0,1]=4 6649 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 2230a_100000008799_100000210206 [0,1,0,0,0,1|1,0,1]=4 6650 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 2230a_100138425928_100000693707 [0,1,0,0,0,1|1,0,1]=4 6651 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 34a_100000008799_100000210206 [0,1,0,0,0,1|1,0,1]=4 6652 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 34a_100138425928_100000693707 [0,1,0,0,0,1|1,0,1]=4 6653 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 34a_100000212225_100000693707 [0,1,0,0,0,1|1,0,1]=4 6654 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 34a_100000694469_100000210206 [0,1,0,0,0,1|1,0,1]=4 6655 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 7a_100000694469_100000210206 [0,1,0,0,0,1|1,0,1]=4 6656 B14R1.3653 COc1ccc(cc1Cl)CSC(C)C 62a_100000210206_100000693707 [0,1,0,0,0,1|1,0,1]=4 6657 B14R1.3653 COc1ccc(cc1Cl)CSC(C)C 62a_100000693707_100000210206 [0,1,0,0,0,1|1,0,1]=4 6658 B14R1.3653 COc1ccc(cc1Cl)NCC(=O)N 2230a_100000211044_100000747473 [0,1,0,0,0,1|1,0,0]=3 6659 B14R1.3653 COc1ccc(cc1Cl)NCC(=O)N 34a_100000211044_100000187820 [0,1,0,0,0,1|1,0,0]=3 6660 B14R1.3653 COc1ccc(cc1Cl)NCC(=O)[O-] 34a_100000211044_100020667443 [0,1,0,0,0,1|1,0,0]=3 6661 B14R1.3653 COc1ccc(cc1Cl)NCC(C)C 2230a_100000211044_100000210760 [0,1,0,0,0,1|1,0,1]=4 6662 B14R1.3653 COc1ccc(cc1Cl)NCC(C)C 34a_100000211044_100000210624 [0,1,0,0,0,1|1,0,1]=4 6663 B14R1.3653 COc1ccc(cc1Cl)NCC(C)O 2230a_100000211044_100011218427 [0,1,0,0,0,1|0,0,2]=4 6664 B14R1.3653 COc1ccc(cc1Cl)NCC(C)O 34a_100000211044_100011218427 [0,1,0,0,0,1|0,0,2]=4 6665 B14R1.3653 COc1ccc(cc1Cl)NC[C@@H](C)O 2230a_100000211044_100009817552 [0,1,0,0,0,1|0,0,2]=4 6666 B14R1.3653 COc1ccc(cc1Cl)NC[C@@H](C)O 34a_100000211044_100009817552 [0,1,0,0,0,1|0,0,2]=4 6667 B14R1.3653 COc1ccc(cc1Cl)NC[N+](=O)[O-] 34a_100000211044_100000761209 [0,1,0,0,0,1|2,0,0]=4 6668 B14R1.3653 COc1ccc(cc1Cl)NNC(=O)C 22a_100000699481_100000070787 [0,1,0,0,0,1|1,0,0]=3 6669 B14R1.3653 COc1ccc(cc1Cl)OCC(=O)N 34a_200009861682_100000187820 [0,1,0,0,0,1|1,0,0]=3 6670 B14R1.3653 COc1ccc(cc1Cl)OCC(=O)N 7a_200009861682_100000187820 [0,1,0,0,0,1|1,0,0]=3 6671 B14R1.3653 COc1ccc(cc1Cl)OCC(=O)[O-] 34a_200009861682_100020667443 [0,1,0,0,0,1|1,0,0]=3 6672 B14R1.3653 COc1ccc(cc1Cl)OCC(C)C 34a_200009861682_100000210624 [0,1,0,0,0,1|1,0,1]=4 6673 B14R1.3653 COc1ccc(cc1Cl)OCC(C)C 7a_200009861682_100000210760 [0,1,0,0,0,1|1,0,1]=4 6674 B14R1.3653 COc1ccc(cc1Cl)OCC(C)O 34a_200009861682_100011218427 [0,1,0,0,0,1|0,0,2]=4 6675 B14R1.3653 COc1ccc(cc1Cl)OCC(C)O 7a_200009861682_100011218427 [0,1,0,0,0,1|0,0,2]=4 6676 B14R1.3653 COc1ccc(cc1Cl)OC[C@@H](C)O 34a_200009861682_100009817552 [0,1,0,0,0,1|0,0,2]=4 6677 B14R1.3653 COc1ccc(cc1Cl)OC[C@@H](C)O 7a_200009861682_100009817552 [0,1,0,0,0,1|0,0,2]=4 6678 B14R1.3653 COc1ccc(cc1Cl)OC[N+](=O)[O-] 34a_200009861682_100000761209 [0,1,0,0,0,1|2,0,0]=4 6679 B14R1.3653 COc1ccc(cc1Cl)SCC(=O)N 62a_100000747473_100012355395 [0,1,0,0,0,1|1,0,0]=3 6680 B14R1.3653 COc1ccc(cc1Cl)SCC(=O)N 62a_100012355395_100000747473 [0,1,0,0,0,1|1,0,0]=3 6681 B14R1.3653 COc1ccc(cc1Cl)SCC(=O)[O-] 62a_100012355395_100020667443 [0,1,0,0,0,1|1,0,0]=3 6682 B14R1.3653 COc1ccc(cc1Cl)SCC(=O)[O-] 62a_100020667443_100012355395 [0,1,0,0,0,1|1,0,0]=3 6683 B14R1.3653 COc1ccc(cc1Cl)SCC(C)C 62a_100000210624_100012355395 [0,1,0,0,0,1|1,0,1]=4 6684 B14R1.3653 COc1ccc(cc1Cl)SCC(C)C 62a_100012355395_100000210760 [0,1,0,0,0,1|1,0,1]=4 6685 B14R1.3653 COc1ccc(cc1Cl)SCC(C)O 62a_100011218427_100012355395 [0,1,0,0,0,1|0,0,2]=4 6686 B14R1.3653 COc1ccc(cc1Cl)SCC(C)O 62a_100012355395_100011218427 [0,1,0,0,0,1|0,0,2]=4 6687 B14R1.3653 COc1ccc(cc1Cl)SC[C@@H](C)O 62a_100009817552_100012355395 [0,1,0,0,0,1|0,0,2]=4 6688 B14R1.3653 COc1ccc(cc1Cl)SC[C@@H](C)O 62a_100012355395_100009817552 [0,1,0,0,0,1|0,0,2]=4 6689 B14R1.3653 COc1ccc(cc1Cl)SC[N+](=O)[O-] 62a_100012355395_100000761209 [0,1,0,0,0,1|2,0,0]=4 6690 B14R1.3653 COc1ccc(cc1F)C=CC(=O)C 1458a_100102526129_200000210301 [0,1,0,0,0,1|0,0,1]=3 6691 B14R1.3653 COc1ccc(cc1F)C=CC(=O)[13CH3] 1458a_100102526129_200025704644 [0,1,0,0,0,1|0,0,1]=3 6692 B14R1.3653 COc1ccc(cc1F)CCC(=O)C 1458a_100000234888_200000210301 [0,1,0,0,0,1|0,0,0]=2 6693 B14R1.3653 COc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100000234888_200025704644 [0,1,0,0,0,1|0,0,0]=2 6694 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 11a_100000737316_100015343762 [0,1,0,0,0,1|0,0,0]=2 6695 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 1626a_100000737316_100015343762 [0,1,0,0,0,1|0,0,0]=2 6696 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 240690a_100000737316_100015343762 [0,1,0,0,0,1|0,0,0]=2 6697 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 527a_100000737316_100103153847 [0,1,0,0,0,1|0,0,0]=2 6698 B14R1.3653 COc1ccc(cc1F)CNC(C)C 207a_100138425928_100000204617 [0,1,0,0,0,1|1,0,1]=4 6699 B14R1.3653 COc1ccc(cc1F)CNC(C)C 2230a_100000737316_100000210206 [0,1,0,0,0,1|1,0,1]=4 6700 B14R1.3653 COc1ccc(cc1F)CNC(C)C 2230a_100138425928_100000189595 [0,1,0,0,0,1|1,0,1]=4 6701 B14R1.3653 COc1ccc(cc1F)CNC(C)C 34a_100000737316_100000210206 [0,1,0,0,0,1|1,0,1]=4 6702 B14R1.3653 COc1ccc(cc1F)CNC(C)C 34a_100138425928_100000189595 [0,1,0,0,0,1|1,0,1]=4 6703 B14R1.3653 COc1ccc(cc1F)COC(C)C 34a_100000212225_100000189595 [0,1,0,0,0,1|1,0,1]=4 6704 B14R1.3653 COc1ccc(cc1F)COC(C)C 34a_100000246395_100000210206 [0,1,0,0,0,1|1,0,1]=4 6705 B14R1.3653 COc1ccc(cc1F)COC(C)C 7a_100000246395_100000210206 [0,1,0,0,0,1|1,0,1]=4 6706 B14R1.3653 COc1ccc(cc1F)CSC(C)C 62a_100000189595_100000210206 [0,1,0,0,0,1|1,0,1]=4 6707 B14R1.3653 COc1ccc(cc1F)CSC(C)C 62a_100000210206_100000189595 [0,1,0,0,0,1|1,0,1]=4 6708 B14R1.3653 COc1ccc(cc1F)NCC(=O)N 2230a_100000740183_100000747473 [0,1,0,0,0,1|1,0,0]=3 6709 B14R1.3653 COc1ccc(cc1F)NCC(=O)N 34a_100000740183_100000187820 [0,1,0,0,0,1|1,0,0]=3 6710 B14R1.3653 COc1ccc(cc1F)NCC(=O)[O-] 34a_100000740183_100020667443 [0,1,0,0,0,1|1,0,0]=3 6711 B14R1.3653 COc1ccc(cc1F)NCC(C)C 2230a_100000740183_100000210760 [0,1,0,0,0,1|1,0,1]=4 6712 B14R1.3653 COc1ccc(cc1F)NCC(C)C 34a_100000740183_100000210624 [0,1,0,0,0,1|1,0,1]=4 6713 B14R1.3653 COc1ccc(cc1F)NCC(C)O 2230a_100000740183_100011218427 [0,1,0,0,0,1|0,0,2]=4 6714 B14R1.3653 COc1ccc(cc1F)NCC(C)O 34a_100000740183_100011218427 [0,1,0,0,0,1|0,0,2]=4 6715 B14R1.3653 COc1ccc(cc1F)NC[C@@H](C)O 2230a_100000740183_100009817552 [0,1,0,0,0,1|0,0,2]=4 6716 B14R1.3653 COc1ccc(cc1F)NC[C@@H](C)O 34a_100000740183_100009817552 [0,1,0,0,0,1|0,0,2]=4 6717 B14R1.3653 COc1ccc(cc1F)NC[N+](=O)[O-] 34a_100000740183_100000761209 [0,1,0,0,0,1|2,0,0]=4 6718 B14R1.3653 COc1ccc(cc1F)OCC(=O)N 34a_100000746305_100000187820 [0,1,0,0,0,1|1,0,0]=3 6719 B14R1.3653 COc1ccc(cc1F)OCC(=O)N 7a_100000746305_100000187820 [0,1,0,0,0,1|1,0,0]=3 6720 B14R1.3653 COc1ccc(cc1F)OCC(=O)[O-] 34a_100000746305_100020667443 [0,1,0,0,0,1|1,0,0]=3 6721 B14R1.3653 COc1ccc(cc1F)OCC(C)C 34a_100000746305_100000210624 [0,1,0,0,0,1|1,0,1]=4 6722 B14R1.3653 COc1ccc(cc1F)OCC(C)C 7a_100000746305_100000210760 [0,1,0,0,0,1|1,0,1]=4 6723 B14R1.3653 COc1ccc(cc1F)OCC(C)O 34a_100000746305_100011218427 [0,1,0,0,0,1|0,0,2]=4 6724 B14R1.3653 COc1ccc(cc1F)OCC(C)O 7a_100000746305_100011218427 [0,1,0,0,0,1|0,0,2]=4 6725 B14R1.3653 COc1ccc(cc1F)OC[C@@H](C)O 34a_100000746305_100009817552 [0,1,0,0,0,1|0,0,2]=4 6726 B14R1.3653 COc1ccc(cc1F)OC[C@@H](C)O 7a_100000746305_100009817552 [0,1,0,0,0,1|0,0,2]=4 6727 B14R1.3653 COc1ccc(cc1F)OC[N+](=O)[O-] 34a_100000746305_100000761209 [0,1,0,0,0,1|2,0,0]=4 6728 B14R1.3653 COc1ccc(cc1F)SCC(=O)N 62a_100000171752_100000747473 [0,1,0,0,0,1|1,0,0]=3 6729 B14R1.3653 COc1ccc(cc1F)SCC(=O)N 62a_100000747473_100000171752 [0,1,0,0,0,1|1,0,0]=3 6730 B14R1.3653 COc1ccc(cc1F)SCC(=O)[O-] 62a_100000171752_100020667443 [0,1,0,0,0,1|1,0,0]=3 6731 B14R1.3653 COc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_100000171752 [0,1,0,0,0,1|1,0,0]=3 6732 B14R1.3653 COc1ccc(cc1F)SCC(C)C 62a_100000171752_100000210760 [0,1,0,0,0,1|1,0,1]=4 6733 B14R1.3653 COc1ccc(cc1F)SCC(C)C 62a_100000210624_100000171752 [0,1,0,0,0,1|1,0,1]=4 6734 B14R1.3653 COc1ccc(cc1F)SCC(C)O 62a_100000171752_100011218427 [0,1,0,0,0,1|0,0,2]=4 6735 B14R1.3653 COc1ccc(cc1F)SCC(C)O 62a_100011218427_100000171752 [0,1,0,0,0,1|0,0,2]=4 6736 B14R1.3653 COc1ccc(cc1F)SC[C@@H](C)O 62a_100000171752_100009817552 [0,1,0,0,0,1|0,0,2]=4 6737 B14R1.3653 COc1ccc(cc1F)SC[C@@H](C)O 62a_100009817552_100000171752 [0,1,0,0,0,1|0,0,2]=4 6738 B14R1.3653 COc1ccc(cc1F)SC[N+](=O)[O-] 62a_100000171752_100000761209 [0,1,0,0,0,1|2,0,0]=4 6739 B14R1.3653 COc1ccc(cc1I)CNC(C)C 207a_100138425928_100009827998 [0,1,0,0,0,1|1,0,1]=4 6740 B14R1.3653 COc1ccc(cc1I)COC(C)C 34a_200000013966_100000210206 [0,1,0,0,0,1|1,0,1]=4 6741 B14R1.3653 COc1ccc(cc1I)COC(C)C 7a_200000013966_100000210206 [0,1,0,0,0,1|1,0,1]=4 6742 B14R1.3653 COc1ccc(cc1I)NCC(=O)N 34a_100011356947_100000187820 [0,1,0,0,0,1|1,0,0]=3 6743 B14R1.3653 COc1ccc(cc1I)NCC(=O)[O-] 34a_100011356947_100020667443 [0,1,0,0,0,1|1,0,0]=3 6744 B14R1.3653 COc1ccc(cc1I)NCC(C)C 34a_100011356947_100000210624 [0,1,0,0,0,1|1,0,1]=4 6745 B14R1.3653 COc1ccc(cc1I)NCC(C)O 34a_100011356947_100011218427 [0,1,0,0,0,1|0,0,2]=4 6746 B14R1.3653 COc1ccc(cc1I)NC[C@@H](C)O 34a_100011356947_100009817552 [0,1,0,0,0,1|0,0,2]=4 6747 B14R1.3653 COc1ccc(cc1I)NC[N+](=O)[O-] 34a_100011356947_100000761209 [0,1,0,0,0,1|2,0,0]=4 6748 B14R1.3653 COc1ccc(cc1I)OCC(=O)N 34a_100010084122_100000187820 [0,1,0,0,0,1|1,0,0]=3 6749 B14R1.3653 COc1ccc(cc1I)OCC(=O)N 7a_100010084122_100000187820 [0,1,0,0,0,1|1,0,0]=3 6750 B14R1.3653 COc1ccc(cc1I)OCC(=O)[O-] 34a_100010084122_100020667443 [0,1,0,0,0,1|1,0,0]=3 6751 B14R1.3653 COc1ccc(cc1I)OCC(C)C 34a_100010084122_100000210624 [0,1,0,0,0,1|1,0,1]=4 6752 B14R1.3653 COc1ccc(cc1I)OCC(C)C 7a_100010084122_100000210760 [0,1,0,0,0,1|1,0,1]=4 6753 B14R1.3653 COc1ccc(cc1I)OCC(C)O 34a_100010084122_100011218427 [0,1,0,0,0,1|0,0,2]=4 6754 B14R1.3653 COc1ccc(cc1I)OCC(C)O 7a_100010084122_100011218427 [0,1,0,0,0,1|0,0,2]=4 6755 B14R1.3653 COc1ccc(cc1I)OC[C@@H](C)O 34a_100010084122_100009817552 [0,1,0,0,0,1|0,0,2]=4 6756 B14R1.3653 COc1ccc(cc1I)OC[C@@H](C)O 7a_100010084122_100009817552 [0,1,0,0,0,1|0,0,2]=4 6757 B14R1.3653 COc1ccc(cc1I)OC[N+](=O)[O-] 34a_100010084122_100000761209 [0,1,0,0,0,1|2,0,0]=4 6758 B14R1.3653 COc1ccc(cc1N)COC(C)C 34a_100011269841_100000210206 [0,1,0,0,0,1|1,0,1]=4 6759 B14R1.3653 COc1ccc(cc1N)SCC(=O)N 62a_100000747473_100011249504 [0,1,0,0,0,1|1,0,0]=3 6760 B14R1.3653 COc1ccc(cc1N)SCC(=O)N 62a_100011249504_100000747473 [0,1,0,0,0,1|1,0,0]=3 6761 B14R1.3653 COc1ccc(cc1N)SCC(=O)[O-] 62a_100011249504_100020667443 [0,1,0,0,0,1|1,0,0]=3 6762 B14R1.3653 COc1ccc(cc1N)SCC(=O)[O-] 62a_100020667443_100011249504 [0,1,0,0,0,1|1,0,0]=3 6763 B14R1.3653 COc1ccc(cc1N)SCC(C)C 62a_100000210624_100011249504 [0,1,0,0,0,1|1,0,1]=4 6764 B14R1.3653 COc1ccc(cc1N)SCC(C)C 62a_100011249504_100000210760 [0,1,0,0,0,1|1,0,1]=4 6765 B14R1.3653 COc1ccc(cc1N)SCC(C)O 62a_100011218427_100011249504 [0,1,0,0,0,1|0,0,2]=4 6766 B14R1.3653 COc1ccc(cc1N)SCC(C)O 62a_100011249504_100011218427 [0,1,0,0,0,1|0,0,2]=4 6767 B14R1.3653 COc1ccc(cc1N)SC[C@@H](C)O 62a_100009817552_100011249504 [0,1,0,0,0,1|0,0,2]=4 6768 B14R1.3653 COc1ccc(cc1N)SC[C@@H](C)O 62a_100011249504_100009817552 [0,1,0,0,0,1|0,0,2]=4 6769 B14R1.3653 COc1ccc(cc1N)SC[N+](=O)[O-] 62a_100011249504_100000761209 [0,1,0,0,0,1|2,0,0]=4 6770 B14R1.3653 COc1ccc(cc1O)/C=C/C(=O)C 271570a_203496583355_200016254069 [0,1,0,0,0,1|0,0,1]=3 6771 B14R1.3653 COc1ccc(cc1O)C=CC(=O)C 1458a_100000184920_200000210301 [0,1,0,0,0,1|0,0,1]=3 6772 B14R1.3653 COc1ccc(cc1O)C=CC(=O)[13CH3] 1458a_100000184920_200025704644 [0,1,0,0,0,1|0,0,1]=3 6773 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [0,1,0,0,0,1|0,0,0]=2 6774 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [0,1,0,0,0,1|0,0,0]=2 6775 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [0,1,0,0,0,1|0,0,0]=2 6776 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [0,1,0,0,0,1|0,0,0]=2 6777 B14R1.3653 COc1ccc(cc1O)CNC(C)C 34a_100000740000_100000210206 [0,1,0,0,0,1|1,0,1]=4 6778 B14R1.3653 COc1ccc(cc1O)NCC(=O)N 34a_100000211920_100000187820 [0,1,0,0,0,1|1,0,0]=3 6779 B14R1.3653 COc1ccc(cc1O)NCC(=O)[O-] 34a_100000211920_100020667443 [0,1,0,0,0,1|1,0,0]=3 6780 B14R1.3653 COc1ccc(cc1O)NCC(C)C 34a_100000211920_100000210624 [0,1,0,0,0,1|1,0,1]=4 6781 B14R1.3653 COc1ccc(cc1O)NCC(C)O 34a_100000211920_100011218427 [0,1,0,0,0,1|0,0,2]=4 6782 B14R1.3653 COc1ccc(cc1O)NC[C@@H](C)O 34a_100000211920_100009817552 [0,1,0,0,0,1|0,0,2]=4 6783 B14R1.3653 COc1ccc(cc1O)NC[N+](=O)[O-] 34a_100000211920_100000761209 [0,1,0,0,0,1|2,0,0]=4 6784 B14R1.3653 COc1ccc(cc1O)SCC(=O)N 62a_100000747473_100009816560 [0,1,0,0,0,1|1,0,0]=3 6785 B14R1.3653 COc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100009816560 [0,1,0,0,0,1|1,0,0]=3 6786 B14R1.3653 COc1ccc(cc1O)SCC(C)C 62a_100000210624_100009816560 [0,1,0,0,0,1|1,0,1]=4 6787 B14R1.3653 COc1ccc(cc1O)SCC(C)O 62a_100011218427_100009816560 [0,1,0,0,0,1|0,0,2]=4 6788 B14R1.3653 COc1ccc(cc1O)SC[C@@H](C)O 62a_100009817552_100009816560 [0,1,0,0,0,1|0,0,2]=4 6789 B14R1.3653 COc1ccc(nc1Br)SCC(=O)N 62a_100000747473_100010214827 [0,1,0,0,0,1|2,0,0]=4 6790 B14R1.3653 COc1ccc(nc1Br)SCC(=O)N 62a_100010214827_100000747473 [0,1,0,0,0,1|2,0,0]=4 6791 B14R1.3653 COc1ccc(nc1Br)SCC(=O)[O-] 62a_100010214827_100020667443 [0,1,0,0,0,1|2,0,0]=4 6792 B14R1.3653 COc1ccc(nc1Br)SCC(=O)[O-] 62a_100020667443_100010214827 [0,1,0,0,0,1|2,0,0]=4 6793 B14R1.3653 COc1ccc(nc1C)SCC(=O)N 62a_100000747473_100010244750 [0,1,0,0,0,1|2,0,0]=4 6794 B14R1.3653 COc1ccc(nc1C)SCC(=O)N 62a_100010244750_100000747473 [0,1,0,0,0,1|2,0,0]=4 6795 B14R1.3653 COc1ccc(nc1C)SCC(=O)[O-] 62a_100010244750_100020667443 [0,1,0,0,0,1|2,0,0]=4 6796 B14R1.3653 COc1ccc(nc1C)SCC(=O)[O-] 62a_100020667443_100010244750 [0,1,0,0,0,1|2,0,0]=4 6797 B14R1.3653 COc1ccc(nc1Cl)SCC(=O)N 62a_100000747473_100010233546 [0,1,0,0,0,1|2,0,0]=4 6798 B14R1.3653 COc1ccc(nc1Cl)SCC(=O)[O-] 62a_100020667443_100010233546 [0,1,0,0,0,1|2,0,0]=4 6799 B14R1.3653 COc1ccc(nc1F)SCC(=O)N 62a_100000747473_100010138636 [0,1,0,0,0,1|2,0,0]=4 6800 B14R1.3653 COc1ccc(nc1F)SCC(=O)N 62a_100010138636_100000747473 [0,1,0,0,0,1|2,0,0]=4 6801 B14R1.3653 COc1ccc(nc1F)SCC(=O)[O-] 62a_100010138636_100020667443 [0,1,0,0,0,1|2,0,0]=4 6802 B14R1.3653 COc1ccc(nc1F)SCC(=O)[O-] 62a_100020667443_100010138636 [0,1,0,0,0,1|2,0,0]=4 6803 B14R1.3653 COc1ccc(nc1N)SCC(=O)N 62a_100010192976_100000747473 [0,1,0,0,0,1|2,0,0]=4 6804 B14R1.3653 COc1ccc(nc1N)SCC(=O)[O-] 62a_100010192976_100020667443 [0,1,0,0,0,1|2,0,0]=4 6805 B14R1.3653 COc1cnc(cc1N)SCC(=O)N 62a_100000747473_100010896307 [0,1,0,0,0,1|2,0,0]=4 6806 B14R1.3653 COc1cnc(cc1N)SCC(=O)N 62a_100010896307_100000747473 [0,1,0,0,0,1|2,0,0]=4 6807 B14R1.3653 COc1cnc(cc1N)SCC(=O)[O-] 62a_100010896307_100020667443 [0,1,0,0,0,1|2,0,0]=4 6808 B14R1.3653 COc1cnc(cc1N)SCC(=O)[O-] 62a_100020667443_100010896307 [0,1,0,0,0,1|2,0,0]=4 6809 B14R1.3653 COc1cnc(cc1O)SCC(=O)N 62a_100000747473_100010264082 [0,1,0,0,0,1|2,0,0]=4 6810 B14R1.3653 COc1cnc(cc1O)SCC(=O)[O-] 62a_100020667443_100010264082 [0,1,0,0,0,1|2,0,0]=4 6811 B14R1.3653 COc1ncc(cc1Br)SCC(=O)N 62a_100000747473_200010988584 [0,1,0,0,0,1|2,0,0]=4 6812 B14R1.3653 COc1ncc(cc1Br)SCC(=O)N 62a_200010988584_100000747473 [0,1,0,0,0,1|2,0,0]=4 6813 B14R1.3653 COc1ncc(cc1Br)SCC(=O)[O-] 62a_100020667443_200010988584 [0,1,0,0,0,1|2,0,0]=4 6814 B14R1.3653 COc1ncc(cc1Br)SCC(=O)[O-] 62a_200010988584_100020667443 [0,1,0,0,0,1|2,0,0]=4 6815 B14R1.3653 COc1ncc(cc1C)SCC(=O)N 62a_100000747473_100011290809 [0,1,0,0,0,1|2,0,0]=4 6816 B14R1.3653 COc1ncc(cc1C)SCC(=O)N 62a_100011290809_100000747473 [0,1,0,0,0,1|2,0,0]=4 6817 B14R1.3653 COc1ncc(cc1C)SCC(=O)[O-] 62a_100011290809_100020667443 [0,1,0,0,0,1|2,0,0]=4 6818 B14R1.3653 COc1ncc(cc1C)SCC(=O)[O-] 62a_100020667443_100011290809 [0,1,0,0,0,1|2,0,0]=4 6819 B14R1.3653 COc1ncc(cc1F)SCC(=O)N 62a_100000747473_100011880707 [0,1,0,0,0,1|2,0,0]=4 6820 B14R1.3653 COc1ncc(cc1F)SCC(=O)N 62a_100011880707_100000747473 [0,1,0,0,0,1|2,0,0]=4 6821 B14R1.3653 COc1ncc(cc1F)SCC(=O)[O-] 62a_100011880707_100020667443 [0,1,0,0,0,1|2,0,0]=4 6822 B14R1.3653 COc1ncc(cc1F)SCC(=O)[O-] 62a_100020667443_100011880707 [0,1,0,0,0,1|2,0,0]=4 6823 B14R1.3653 COc1ncc(cc1N)SCC(=O)N 62a_100000747473_100000748608 [0,1,0,0,0,1|2,0,0]=4 6824 B14R1.3653 COc1ncc(cc1N)SCC(=O)N 62a_100000748608_100000747473 [0,1,0,0,0,1|2,0,0]=4 6825 B14R1.3653 COc1ncc(cc1N)SCC(=O)[O-] 62a_100000748608_100020667443 [0,1,0,0,0,1|2,0,0]=4 6826 B14R1.3653 COc1ncc(cc1N)SCC(=O)[O-] 62a_100020667443_100000748608 [0,1,0,0,0,1|2,0,0]=4 6827 B14R1.3653 COc1ncc(cc1O)SCC(=O)N 62a_100000747473_100010135713 [0,1,0,0,0,1|2,0,0]=4 6828 B14R1.3653 COc1ncc(cc1O)SCC(=O)[O-] 62a_100020667443_100010135713 [0,1,0,0,0,1|2,0,0]=4 6829 B14R1.3653 CSc1ccc(cc1C)OCC(=O)N 34a_100000030144_100000187820 [0,1,0,0,0,1|1,1,0]=4 6830 B14R1.3653 CSc1ccc(cc1C)OCC(=O)[O-] 34a_100000030144_100020667443 [0,1,0,0,0,1|1,1,0]=4 6831 B14R1.3653 CSc1ccc(cc1Cl)SCC(=O)N 62a_100000747473_206447510565 [0,1,0,0,0,1|1,1,0]=4 6832 B14R1.3653 CSc1ccc(cc1Cl)SCC(=O)N 62a_206447510565_100000747473 [0,1,0,0,0,1|1,1,0]=4 6833 B14R1.3653 CSc1ccc(cc1Cl)SCC(=O)[O-] 62a_100020667443_206447510565 [0,1,0,0,0,1|1,1,0]=4 6834 B14R1.3653 CSc1ccc(cc1Cl)SCC(=O)[O-] 62a_206447510565_100020667443 [0,1,0,0,0,1|1,1,0]=4 6835 B14R1.3653 CSc1ccc(cc1F)NCC(=O)N 2230a_100000762756_100000747473 [0,1,0,0,0,1|1,1,0]=4 6836 B14R1.3653 CSc1ccc(cc1F)NCC(=O)N 34a_100000762756_100000187820 [0,1,0,0,0,1|1,1,0]=4 6837 B14R1.3653 CSc1ccc(cc1F)NCC(=O)[O-] 34a_100000762756_100020667443 [0,1,0,0,0,1|1,1,0]=4 6838 B14R1.3653 CSc1ccc(cc1F)SCC(=O)N 62a_100000747473_100010161220 [0,1,0,0,0,1|1,1,0]=4 6839 B14R1.3653 CSc1ccc(cc1F)SCC(=O)N 62a_100010161220_100000747473 [0,1,0,0,0,1|1,1,0]=4 6840 B14R1.3653 CSc1ccc(cc1F)SCC(=O)[O-] 62a_100010161220_100020667443 [0,1,0,0,0,1|1,1,0]=4 6841 B14R1.3653 CSc1ccc(cc1F)SCC(=O)[O-] 62a_100020667443_100010161220 [0,1,0,0,0,1|1,1,0]=4 6842 B14R1.23 CC=Cc1ccc(cc1)CS(=O)(=O)C 271570a_100016259895_100009814647 [0,2,0,0,0,0|2,0,0]=4 6843 B14R1.23 CCNc1ccc(cc1)CS(=O)(=O)C 2230a_100000747337_100000210202 [0,2,0,0,0,0|2,0,0]=4 6844 B14R1.23 CCNc1ccc(cc1)CS(=O)(=O)C 34a_100000747337_100000210202 [0,2,0,0,0,0|2,0,0]=4 6845 B14R1.23 CCOc1ccc(cc1)NS(=O)(=O)C 34a_100000165719_100000210202 [0,2,0,0,0,0|2,0,0]=4 6846 B14R1.23 CCOc1ccc(cc1)NS(=O)(=O)C 40a_100000739623_100000738038 [0,2,0,0,0,0|2,0,0]=4 6847 B14R1.23 CCSc1ccc(cc1)CS(=O)(=O)C 62a_100000210202_100009814647 [0,2,0,0,0,0|1,1,0]=4 6848 B14R1.23 CCSc1ccc(cc1)CS(=O)(=O)C 62a_100009814647_100000210202 [0,2,0,0,0,0|1,1,0]=4 6849 B14R1.23 COCc1ccc(cc1)NS(=O)(=O)C 34a_100011266447_200000210301 [0,2,0,0,0,0|2,0,0]=4 6850 B14R1.23 COCc1ccc(cc1)NS(=O)(=O)C 40a_100000694113_100000738038 [0,2,0,0,0,0|2,0,0]=4 6851 B14R1.23 CS(=O)(=O)Cc1ccc(cc1)NCF 34a_100000747337_100015361967 [0,2,0,0,0,0|2,0,0]=4 6852 B14R1.23 CS(=O)(=O)Cc1ccc(cc1)SCF 62a_100009814647_100015361967 [0,2,0,0,0,0|1,1,0]=4 6853 B14R1.23 CS(=O)(=O)Cc1ccc(cc1)SCF 62a_100015361967_100009814647 [0,2,0,0,0,0|1,1,0]=4 6854 B14R1.23 CS(=O)(=O)Nc1ccc(cc1)CO[13CH3] 34a_100011266447_200025704644 [0,2,0,0,0,0|2,0,0]=4 6855 B14R1.23 CS(=O)(=O)Nc1ccc(cc1)OCF 34a_100000165719_100015361967 [0,2,0,0,0,0|2,0,0]=4 6856 B14R1.212 CN(c1ccc(cc1)O[13CH3])S(=O)(=O)C 34a_100000187494_200025704644 [0,2,0,0,0,0|2,0,0]=4 6857 B14R1.212 COc1ccc(cc1)N(C)S(=O)(=O)C 34a_100000187494_200000210301 [0,2,0,0,0,0|2,0,0]=4 6858 B14R1.215 CCS(=O)(=O)Nc1ccc(cc1)OC 40a_100000184247_100000053943 [0,2,0,0,0,0|2,0,0]=4 6859 B14R1.215 CNS(=O)(=O)Cc1ccc(cc1)N[13CH3] 2230a_200011218302_200025704644 [0,2,0,0,0,0|2,0,0]=4 6860 B14R1.215 CNS(=O)(=O)Cc1ccc(cc1)N[13CH3] 34a_200011218302_200025704644 [0,2,0,0,0,0|2,0,0]=4 6861 B14R1.215 CNc1ccc(cc1)CS(=O)(=O)NC 2230a_200011218302_200000210301 [0,2,0,0,0,0|2,0,0]=4 6862 B14R1.215 CNc1ccc(cc1)CS(=O)(=O)NC 34a_200011218302_200000210301 [0,2,0,0,0,0|2,0,0]=4 6863 B14R1.215 COc1ccc(cc1)CC(C)(C)OC 7a_100011835641_200000210301 [0,2,0,0,0,0|0,0,2]=4 6864 B14R1.215 COc1ccc(cc1)CC(C)(C)O[13CH3] 7a_100011835641_200025704644 [0,2,0,0,0,0|0,0,2]=4 6865 B14R1.414 C=C(C)c1ccc(cc1)CS(=O)(=O)C 271570a_100000694244_100009814647 [0,2,0,0,0,0|2,0,0]=4 6866 B14R1.2311 COc1ccc(c(c1)C)NS(=O)(=O)C 34a_100011934622_200000210301 [0,2,0,0,0,0|2,0,0]=4 6867 B14R1.2311 COc1ccc(c(c1)C)NS(=O)(=O)C 40a_100000750285_100000738038 [0,2,0,0,0,0|2,0,0]=4 6868 B14R1.2311 COc1ccc(c(c1)C)NS(=O)(=O)C 7a_100011934622_200000210301 [0,2,0,0,0,0|2,0,0]=4 6869 B14R1.2311 COc1ccc(c(c1)Cl)NS(=O)(=O)C 40a_100000747055_100000738038 [0,2,0,0,0,0|2,0,0]=4 6870 B14R1.2311 COc1ccc(c(c1)F)NS(=O)(=O)C 40a_100011299463_100000738038 [0,2,0,0,0,0|2,0,0]=4 6871 B14R1.2311 COc1ccc(c(c1)I)NS(=O)(=O)C 40a_100000049804_100000738038 [0,2,0,0,0,0|2,0,0]=4 6872 B14R1.2311 CS(=O)(=O)Cc1ccc(cc1F)S[13CH3] 62a_100009814645_200025704644 [0,2,0,0,0,0|1,1,0]=4 6873 B14R1.2311 CS(=O)(=O)Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100009814645 [0,2,0,0,0,0|1,1,0]=4 6874 B14R1.2311 CSc1ccc(c(c1)F)CS(=O)(=O)C 62a_100009814645_200000210301 [0,2,0,0,0,0|1,1,0]=4 6875 B14R1.2311 CSc1ccc(c(c1)F)CS(=O)(=O)C 62a_200000210301_100009814645 [0,2,0,0,0,0|1,1,0]=4 6876 B14R1.2311 Cc1cc(ccc1NS(=O)(=O)C)O[13CH3] 34a_100011934622_200025704644 [0,2,0,0,0,0|2,0,0]=4 6877 B14R1.2311 Cc1cc(ccc1NS(=O)(=O)C)O[13CH3] 7a_100011934622_200025704644 [0,2,0,0,0,0|2,0,0]=4 6878 B14R1.3275 COc1ccc(cc1Br)NS(=O)(=O)C 40a_100000187427_100000738038 [0,2,0,0,0,0|2,0,0]=4 6879 B14R1.3275 COc1ccc(cc1C)NS(=O)(=O)C 40a_100000743268_100000738038 [0,2,0,0,0,0|2,0,0]=4 6880 B14R1.3275 COc1ccc(cc1Cl)NS(=O)(=O)C 40a_100000211044_100000738038 [0,2,0,0,0,0|2,0,0]=4 6881 B14R1.3275 COc1ccc(cc1F)NS(=O)(=O)C 40a_100000740183_100000738038 [0,2,0,0,0,0|2,0,0]=4 6882 B14R1.3275 COc1ccc(cc1I)NS(=O)(=O)C 40a_100011356947_100000738038 [0,2,0,0,0,0|2,0,0]=4 6883 B14R1.3275 COc1ccc(cc1N)CS(=O)(=O)N 34a_200010686696_200000210301 [0,2,0,0,0,0|2,0,0]=4 6884 B14R1.3275 COc1ccc(cc1O)NS(=O)(=O)C 40a_100000211920_100000738038 [0,2,0,0,0,0|2,0,0]=4 6885 B14R1.3275 COc1ccc(cc1O)OS(=O)(=O)C 271570a_203496583355_200010208287 [0,2,0,0,0,0|2,0,0]=4 6886 B14R1.3275 [13CH3]Oc1ccc(cc1N)CS(=O)(=O)N 34a_200010686696_200025704644 [0,2,0,0,0,0|2,0,0]=4 6887 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 2230a_100000724800_100000742318 [0,2,0,0,0,0|2,0,0]=4 6888 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 2230a_100000741509_100000210202 [0,2,0,0,0,0|2,0,0]=4 6889 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 269956a_100000042499_100000742318 [0,2,0,0,0,0|2,0,0]=4 6890 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 269982a_100000724800_100000742318 [0,2,0,0,0,0|2,0,0]=4 6891 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 269982a_100000741509_100000204670 [0,2,0,0,0,0|2,0,0]=4 6892 B14R1.6 CCN(CC)Cc1ccc(cc1)OC 270004a_100000724800_100000169835 [0,2,0,0,0,0|2,0,0]=4 6893 B14R1.6 CCN(CF)Cc1ccc(cc1)OC 269982a_100000741509_100015361967 [0,2,0,0,0,0|2,0,0]=4 6894 B14R1.7 C=CC(=O)N(C)c1ccc(cc1)OC 1626a_100000220023_100000185746 [0,2,0,0,0,0|1,0,1]=4 6895 B14R1.7 C=CC(=O)N(C)c1ccc(cc1)OC 22a_100000220023_100000185746 [0,2,0,0,0,0|1,0,1]=4 6896 B14R1.7 C=Cc1ccc(cc1)C(N)C(=O)OC 271570a_100011290941_100000747369 [0,2,0,0,0,0|1,0,1]=4 6897 B14R1.7 CCC(=O)C(C)c1ccc(cc1)OC 1458a_100000753396_100000210202 [0,2,0,0,0,0|0,0,0]=2 6898 B14R1.7 CCC(=O)C(O)c1ccc(cc1)OC 1458a_100011218652_100000210202 [0,2,0,0,0,0|0,0,0]=2 6899 B14R1.7 CCC(=O)N(C)c1ccc(cc1)NC 34a_100011243721_200000210301 [0,2,0,0,0,0|2,0,0]=4 6900 B14R1.7 CCC(=O)N(C)c1ccc(cc1)N[13CH3] 34a_100011243721_200025704644 [0,2,0,0,0,0|2,0,0]=4 6901 B14R1.7 CCC(=O)N(C)c1ccc(cc1)OC 11a_100000220023_100000210414 [0,2,0,0,0,0|1,0,0]=3 6902 B14R1.7 CCC(=O)N(C)c1ccc(cc1)OC 1626a_100000220023_100000210414 [0,2,0,0,0,0|1,0,0]=3 6903 B14R1.7 CCC(=O)N(C)c1ccc(cc1)OC 22a_100000220023_100000210414 [0,2,0,0,0,0|1,0,0]=3 6904 B14R1.7 CCC(=O)N(C)c1ccc(cc1)OC 527a_100000220023_100000210414 [0,2,0,0,0,0|1,0,0]=3 6905 B14R1.7 CCN(C)C(C)c1ccc(cc1)OC 2230a_100000736477_100000210202 [0,2,0,0,0,0|2,0,0]=4 6906 B14R1.7 CCN(C)C(C)c1ccc(cc1)OC 269982a_100000736477_100000204670 [0,2,0,0,0,0|2,0,0]=4 6907 B14R1.7 CNC(=O)C(C)c1ccc(cc1)OC 11a_106832991635_100000753396 [0,2,0,0,0,0|0,0,0]=2 6908 B14R1.7 CNC(=O)C(C)c1ccc(cc1)OC 1626a_100102657272_100000753396 [0,2,0,0,0,0|0,0,0]=2 6909 B14R1.7 CNC(=O)C(C)c1ccc(cc1)OC 240690a_100102657272_100000753396 [0,2,0,0,0,0|0,0,0]=2 6910 B14R1.7 CNC(=O)C(C)c1ccc(cc1)OC 527a_100102657272_100000753396 [0,2,0,0,0,0|0,0,0]=2 6911 B14R1.7 CNC(=O)C(O)c1ccc(cc1)OC 240690a_100102657272_100011218652 [0,2,0,0,0,0|0,0,0]=2 6912 B14R1.7 CNC(=O)N(C)c1ccc(cc1)OC 512a_106832991638_100000220023 [0,2,0,0,0,0|1,0,0]=3 6913 B14R1.7 COC(=O)C(=O)c1ccc(cc1)OC 34a_100010658548_200000210301 [0,2,0,0,0,0|0,0,1]=3 6914 B14R1.7 COC(=O)C(=O)c1ccc(cc1)O[13CH3] 34a_100010658548_200025704644 [0,2,0,0,0,0|0,0,1]=3 6915 B14R1.7 COC(=O)C(=O)c1ccc(cc1)SC 62a_100012339527_200000210301 [0,2,0,0,0,0|0,1,1]=4 6916 B14R1.7 COC(=O)C(=O)c1ccc(cc1)SC 62a_200000210301_100012339527 [0,2,0,0,0,0|0,1,1]=4 6917 B14R1.7 COC(=O)C(=O)c1ccc(cc1)S[13CH3] 62a_100012339527_200025704644 [0,2,0,0,0,0|0,1,1]=4 6918 B14R1.7 COC(=O)C(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100012339527 [0,2,0,0,0,0|0,1,1]=4 6919 B14R1.7 COC(=O)C(N)c1ccc(cc1)SC 62a_100000747369_200000210301 [0,2,0,0,0,0|0,1,0]=3 6920 B14R1.7 COC(=O)C(N)c1ccc(cc1)SC 62a_200000210301_100000747369 [0,2,0,0,0,0|0,1,0]=3 6921 B14R1.7 COC(=O)C(N)c1ccc(cc1)S[13CH3] 62a_100000747369_200025704644 [0,2,0,0,0,0|0,1,0]=3 6922 B14R1.7 COC(=O)C(N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000747369 [0,2,0,0,0,0|0,1,0]=3 6923 B14R1.7 COC(=O)[C@H](N)c1ccc(cc1)OC 34a_100009816592_200000210301 [0,2,0,0,0,0|0,0,0]=2 6924 B14R1.7 COC(=O)[C@H](N)c1ccc(cc1)O[13CH3] 34a_100009816592_200025704644 [0,2,0,0,0,0|0,0,0]=2 6925 B14R1.7 COc1ccc(cc1)C(C)C(=O)CF 1458a_100000753396_100015361967 [0,2,0,0,0,0|0,0,0]=2 6926 B14R1.7 COc1ccc(cc1)C(C)N(C)CF 269982a_100000736477_100015361967 [0,2,0,0,0,0|2,0,0]=4 6927 B14R1.7 COc1ccc(cc1)C(O)C(=O)CF 1458a_100011218652_100015361967 [0,2,0,0,0,0|0,0,0]=2 6928 B14R1.7 COc1ccc(cc1)N(C)C(=O)CO 22a_100000220023_100000210174 [0,2,0,0,0,0|1,0,0]=3 6929 B14R1.7 COc1ccc(cc1)N(C)C(=O)CO 527a_100000220023_100000210174 [0,2,0,0,0,0|1,0,0]=3 6930 B14R1.24 C#CC(=O)Cc1ccc(cc1)CCC 1458a_100000211873_100011982809 [0,2,0,0,0,0|1,0,1]=4 6931 B14R1.24 C=C=Cc1ccc(cc1)CC(=O)NC 271570a_100015277604_100000155101 [0,2,0,0,0,0|1,0,1]=4 6932 B14R1.24 C=C=Cc1ccc(cc1)CC(=O)OC 271570a_100015277604_100000149743 [0,2,0,0,0,0|1,0,1]=4 6933 B14R1.24 C=CC(=O)Cc1ccc(cc1)CCC 1458a_100000185746_100011982809 [0,2,0,0,0,0|1,0,1]=4 6934 B14R1.24 C=CC(=O)Nc1ccc(cc1)COC 1626a_100000694113_100000185746 [0,2,0,0,0,0|1,0,1]=4 6935 B14R1.24 C=CC(=O)Nc1ccc(cc1)COC 22a_100000694113_100000185746 [0,2,0,0,0,0|1,0,1]=4 6936 B14R1.24 C=CC(=O)Nc1ccc(cc1)OCC 1626a_100000739623_100000185746 [0,2,0,0,0,0|1,0,1]=4 6937 B14R1.24 C=CC(=O)Nc1ccc(cc1)OCC 22a_100000739623_100000185746 [0,2,0,0,0,0|1,0,1]=4 6938 B14R1.24 C=CC(=O)Nc1ccc(cc1)OCC 34a_100011235904_100000210202 [0,2,0,0,0,0|1,0,1]=4 6939 B14R1.24 C=CC(=O)Nc1ccc(cc1)OCF 34a_100011235904_100015361967 [0,2,0,0,0,0|1,0,1]=4 6940 B14R1.24 CC=Cc1ccc(cc1)CC(=O)NC 271570a_100016259895_100000155101 [0,2,0,0,0,0|1,0,0]=3 6941 B14R1.24 CC=Cc1ccc(cc1)CC(=O)OC 271570a_100016259895_100000149743 [0,2,0,0,0,0|1,0,0]=3 6942 B14R1.24 CC=Cc1ccc(cc1)NC(=O)OC 271570a_100016259895_100000181880 [0,2,0,0,0,0|2,0,0]=4 6943 B14R1.24 CC=Cc1ccc(cc1)OC(=O)CC 271570a_100016259895_200009811598 [0,2,0,0,0,0|2,0,0]=4 6944 B14R1.24 CC=Cc1ccc(cn1)CC(=O)OC 271570a_100016259895_100000071674 [0,2,0,0,0,0|2,0,0]=4 6945 B14R1.24 CC=Cc1ccc(nc1)CC(=O)OC 271570a_100016259895_100012362609 [0,2,0,0,0,0|2,0,0]=4 6946 B14R1.24 CCC(=O)Cc1ccc(cc1)COC 1458a_100011290826_100000210202 [0,2,0,0,0,0|0,0,0]=2 6947 B14R1.24 CCC(=O)Cc1ccc(cc1)N=[N+]=[N-] 1458a_100010395652_100000210202 [0,2,0,0,0,0|2,0,0]=4 6948 B14R1.24 CCC(=O)Nc1ccc(cc1)CCO 22a_100011204434_100000210414 [0,2,0,0,0,0|2,0,0]=4 6949 B14R1.24 CCC(=O)Nc1ccc(cc1)CCO 527a_100011204434_100000210414 [0,2,0,0,0,0|2,0,0]=4 6950 B14R1.24 CCC(=O)Nc1ccc(cc1)COC 11a_100000694113_100000210414 [0,2,0,0,0,0|1,0,0]=3 6951 B14R1.24 CCC(=O)Nc1ccc(cc1)COC 1626a_100000694113_100000210414 [0,2,0,0,0,0|1,0,0]=3 6952 B14R1.24 CCC(=O)Nc1ccc(cc1)COC 22a_100000694113_100000210414 [0,2,0,0,0,0|1,0,0]=3 6953 B14R1.24 CCC(=O)Nc1ccc(cc1)COC 527a_100000694113_100000210414 [0,2,0,0,0,0|1,0,0]=3 6954 B14R1.24 CCC(=O)Nc1ccc(cc1)CSC 11a_106726388226_100000210414 [0,2,0,0,0,0|1,1,0]=4 6955 B14R1.24 CCC(=O)Nc1ccc(cc1)CSC 1626a_106726388226_100000210414 [0,2,0,0,0,0|1,1,0]=4 6956 B14R1.24 CCC(=O)Nc1ccc(cc1)CSC 22a_106726388226_100000210414 [0,2,0,0,0,0|1,1,0]=4 6957 B14R1.24 CCC(=O)Nc1ccc(cc1)CSC 527a_106726388226_100000210414 [0,2,0,0,0,0|1,1,0]=4 6958 B14R1.24 CCC(=O)Nc1ccc(cc1)NCF 34a_100000186511_100015361967 [0,2,0,0,0,0|2,0,0]=4 6959 B14R1.24 CCC(=O)Nc1ccc(cc1)OCF 34a_200000243810_100015361967 [0,2,0,0,0,0|1,0,0]=3 6960 B14R1.24 CCC(=O)Nc1ccc(cc1)OCF 7a_200000243810_100015361967 [0,2,0,0,0,0|1,0,0]=3 6961 B14R1.24 CCC(=O)Oc1ccc(cc1)CNC 270004a_106832991635_200000014686 [0,2,0,0,0,0|2,0,0]=4 6962 B14R1.24 CCC(=O)Oc1ccc(cc1)SCF 62a_100015361967_200009811598 [0,2,0,0,0,0|1,1,0]=4 6963 B14R1.24 CCCc1ccc(cc1)CC(=O)CC 1458a_100000186164_100000210202 [0,2,0,0,0,0|1,0,0]=3 6964 B14R1.24 CCCc1ccc(cc1)CC(=O)CC 1458a_100000210414_100011982809 [0,2,0,0,0,0|1,0,0]=3 6965 B14R1.24 CCCc1ccc(cc1)CC(=O)CF 1458a_100000186164_100015361967 [0,2,0,0,0,0|1,0,0]=3 6966 B14R1.24 CCCc1ccc(cc1)CC(=O)CO 1458a_100000210174_100011982809 [0,2,0,0,0,0|1,0,0]=3 6967 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 11a_106832991635_100000186164 [0,2,0,0,0,0|1,0,0]=3 6968 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000186164 [0,2,0,0,0,0|1,0,0]=3 6969 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000186164 [0,2,0,0,0,0|1,0,0]=3 6970 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 527a_100102657272_100000186164 [0,2,0,0,0,0|1,0,0]=3 6971 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 11a_100000211780_100000210414 [0,2,0,0,0,0|2,0,0]=4 6972 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 1626a_100000211780_100000210414 [0,2,0,0,0,0|2,0,0]=4 6973 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 22a_100000211780_100000210414 [0,2,0,0,0,0|2,0,0]=4 6974 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 527a_100000211780_100000210414 [0,2,0,0,0,0|2,0,0]=4 6975 B14R1.24 CCCc1ccc(cc1)NC(=O)CO 22a_100000211780_100000210174 [0,2,0,0,0,0|2,0,0]=4 6976 B14R1.24 CCCc1ccc(cc1)NC(=O)CO 527a_100000211780_100000210174 [0,2,0,0,0,0|2,0,0]=4 6977 B14R1.24 CCCc1ccc(cc1)NC(=O)NC 2430a_100000211780_100102657272 [0,2,0,0,0,0|2,0,0]=4 6978 B14R1.24 CCN(C)Cc1ccc(cc1)COC 26a_100000225621_200011995677 [0,2,0,0,0,0|2,0,0]=4 6979 B14R1.24 CCNc1ccc(cc1)CC(=O)NC 2230a_100000736799_100000210202 [0,2,0,0,0,0|1,0,0]=3 6980 B14R1.24 CCNc1ccc(cc1)CC(=O)NC 34a_100000736799_100000210202 [0,2,0,0,0,0|1,0,0]=3 6981 B14R1.24 CCNc1ccc(cc1)NC(=O)CC 34a_100000186511_100000210202 [0,2,0,0,0,0|2,0,0]=4 6982 B14R1.24 CCNc1ccc(cc1)NC(=O)CO 34a_100011269904_100000210202 [0,2,0,0,0,0|2,0,0]=4 6983 B14R1.24 CCOc1ccc(cc1)CC(=O)CC 1458a_100000183096_100000210202 [0,2,0,0,0,0|0,0,0]=2 6984 B14R1.24 CCOc1ccc(cc1)CC(=O)CF 1458a_100000183096_100015361967 [0,2,0,0,0,0|0,0,0]=2 6985 B14R1.24 CCOc1ccc(cc1)CC(=O)NC 11a_106832991635_100000183096 [0,2,0,0,0,0|0,0,0]=2 6986 B14R1.24 CCOc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000183096 [0,2,0,0,0,0|0,0,0]=2 6987 B14R1.24 CCOc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000183096 [0,2,0,0,0,0|0,0,0]=2 6988 B14R1.24 CCOc1ccc(cc1)CC(=O)NC 34a_200000020795_100000210202 [0,2,0,0,0,0|0,0,0]=2 6989 B14R1.24 CCOc1ccc(cc1)CC(=O)NC 527a_100102657272_100000183096 [0,2,0,0,0,0|0,0,0]=2 6990 B14R1.24 CCOc1ccc(cc1)CC(=O)NN 34a_100000020777_100000210202 [0,2,0,0,0,0|1,0,0]=3 6991 B14R1.24 CCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000210202 [0,2,0,0,0,0|0,0,0]=2 6992 B14R1.24 CCOc1ccc(cc1)CC(C)NC 270004a_106832991635_200011996056 [0,2,0,0,0,0|1,0,1]=4 6993 B14R1.24 CCOc1ccc(cc1)CN(C)CC 2230a_100000180828_100000210202 [0,2,0,0,0,0|2,0,0]=4 6994 B14R1.24 CCOc1ccc(cc1)CN(C)CC 2230a_200015185875_200000210301 [0,2,0,0,0,0|2,0,0]=4 6995 B14R1.24 CCOc1ccc(cc1)CN(C)CC 269982a_100000180828_100000204670 [0,2,0,0,0,0|2,0,0]=4 6996 B14R1.24 CCOc1ccc(cc1)CN(C)CC 269982a_200015185875_200000210301 [0,2,0,0,0,0|2,0,0]=4 6997 B14R1.24 CCOc1ccc(cc1)CN(C)CF 269982a_100000180828_100015361967 [0,2,0,0,0,0|2,0,0]=4 6998 B14R1.24 CCOc1ccc(cc1)CN([13CH3])CC 2230a_200015185875_200025704644 [0,2,0,0,0,0|2,0,0]=4 6999 B14R1.24 CCOc1ccc(cc1)CN([13CH3])CC 269982a_200015185875_200025704644 [0,2,0,0,0,0|2,0,0]=4 7000 B14R1.24 CCOc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_100000210202 [0,2,0,0,0,0|1,0,1]=4 7001 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 11a_100000739623_100000210414 [0,2,0,0,0,0|1,0,0]=3 7002 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 1626a_100000739623_100000210414 [0,2,0,0,0,0|1,0,0]=3 7003 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 22a_100000739623_100000210414 [0,2,0,0,0,0|1,0,0]=3 7004 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 34a_200000243810_100000210202 [0,2,0,0,0,0|1,0,0]=3 7005 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 527a_100000739623_100000210414 [0,2,0,0,0,0|1,0,0]=3 7006 B14R1.24 CCOc1ccc(cc1)NC(=O)CC 7a_200000243810_100000210202 [0,2,0,0,0,0|1,0,0]=3 7007 B14R1.24 CCOc1ccc(cc1)NC(=O)CCl 34a_100000233757_100000210202 [0,2,0,0,0,0|1,0,0]=3 7008 B14R1.24 CCOc1ccc(cc1)NC(=O)CO 22a_100000739623_100000210174 [0,2,0,0,0,0|1,0,0]=3 7009 B14R1.24 CCOc1ccc(cc1)NC(=O)CO 527a_100000739623_100000210174 [0,2,0,0,0,0|1,0,0]=3 7010 B14R1.24 CCOc1ccc(cc1)NC(=O)NC 2430a_100000739623_100102657272 [0,2,0,0,0,0|1,0,0]=3 7011 B14R1.24 CCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000210202 [0,2,0,0,0,0|1,0,0]=3 7012 B14R1.24 CCSc1ccc(cc1)CC(=O)NC 62a_100000155101_100000210202 [0,2,0,0,0,0|0,1,0]=3 7013 B14R1.24 CCSc1ccc(cc1)CC(=O)NC 62a_100000210202_100000155101 [0,2,0,0,0,0|0,1,0]=3 7014 B14R1.24 CCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000210202 [0,2,0,0,0,0|0,1,0]=3 7015 B14R1.24 CCSc1ccc(cc1)CC(=O)OC 62a_100000210202_100000149743 [0,2,0,0,0,0|0,1,0]=3 7016 B14R1.24 CCSc1ccc(cc1)NC(=O)CC 11a_100015187087_100000210414 [0,2,0,0,0,0|1,1,0]=4 7017 B14R1.24 CCSc1ccc(cc1)NC(=O)CC 1626a_100015187087_100000210414 [0,2,0,0,0,0|1,1,0]=4 7018 B14R1.24 CCSc1ccc(cc1)NC(=O)CC 22a_100015187087_100000210414 [0,2,0,0,0,0|1,1,0]=4 7019 B14R1.24 CCSc1ccc(cc1)NC(=O)CC 527a_100015187087_100000210414 [0,2,0,0,0,0|1,1,0]=4 7020 B14R1.24 CCSc1ccc(cc1)NC(=O)CN 62a_100000210202_100000741985 [0,2,0,0,0,0|1,1,0]=4 7021 B14R1.24 CCSc1ccc(cc1)NC(=O)CO 22a_100015187087_100000210174 [0,2,0,0,0,0|1,1,0]=4 7022 B14R1.24 CCSc1ccc(cc1)NC(=O)CO 527a_100015187087_100000210174 [0,2,0,0,0,0|1,1,0]=4 7023 B14R1.24 CCSc1ccc(cc1)NC(=O)NC 2430a_100015187087_100102657272 [0,2,0,0,0,0|1,1,0]=4 7024 B14R1.24 CCSc1ccc(cc1)NC(=O)OC 62a_100000210202_100000181880 [0,2,0,0,0,0|1,1,0]=4 7025 B14R1.24 CCSc1ccc(cc1)OC(=O)CC 62a_100000210202_200009811598 [0,2,0,0,0,0|1,1,0]=4 7026 B14R1.24 CCSc1ccc(cn1)CC(=O)OC 62a_100000071674_100000210202 [0,2,0,0,0,0|1,1,0]=4 7027 B14R1.24 CCSc1ccc(cn1)CC(=O)OC 62a_100000210202_100000071674 [0,2,0,0,0,0|1,1,0]=4 7028 B14R1.24 CCSc1ccc(nc1)CC(=O)OC 62a_100000210202_100012362609 [0,2,0,0,0,0|1,1,0]=4 7029 B14R1.24 CCSc1ccc(nc1)CC(=O)OC 62a_100012362609_100000210202 [0,2,0,0,0,0|1,1,0]=4 7030 B14R1.24 CNC(=O)Cc1ccc(cc1)COC 11a_106832991635_100011290826 [0,2,0,0,0,0|0,0,0]=2 7031 B14R1.24 CNC(=O)Cc1ccc(cc1)COC 1626a_100102657272_100011290826 [0,2,0,0,0,0|0,0,0]=2 7032 B14R1.24 CNC(=O)Cc1ccc(cc1)COC 240690a_100102657272_100011290826 [0,2,0,0,0,0|0,0,0]=2 7033 B14R1.24 CNC(=O)Cc1ccc(cc1)COC 527a_100102657272_100011290826 [0,2,0,0,0,0|0,0,0]=2 7034 B14R1.24 CNC(=O)Cc1ccc(cc1)N=[N+]=[N-] 11a_106832991635_100010395652 [0,2,0,0,0,0|2,0,0]=4 7035 B14R1.24 CNC(=O)Cc1ccc(cc1)N=[N+]=[N-] 240690a_100102657272_100010395652 [0,2,0,0,0,0|2,0,0]=4 7036 B14R1.24 CNC(=O)Cc1ccc(cc1)NCF 34a_100000736799_100015361967 [0,2,0,0,0,0|1,0,0]=3 7037 B14R1.24 CNC(=O)Cc1ccc(cc1)OCF 34a_200000020795_100015361967 [0,2,0,0,0,0|0,0,0]=2 7038 B14R1.24 CNC(=O)Cc1ccc(cc1)SCF 62a_100000155101_100015361967 [0,2,0,0,0,0|0,1,0]=3 7039 B14R1.24 CNC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000155101 [0,2,0,0,0,0|0,1,0]=3 7040 B14R1.24 CNC(=O)Nc1ccc(cc1)COC 2430a_100000694113_100102657272 [0,2,0,0,0,0|1,0,0]=3 7041 B14R1.24 CNC(=O)Nc1ccc(cc1)CSC 2430a_106726388226_100102657272 [0,2,0,0,0,0|1,1,0]=4 7042 B14R1.24 CNC(=O)Nc1ccc(cc1)CSC 512a_106726388226_100102657272 [0,2,0,0,0,0|1,1,0]=4 7043 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 2230a_106832991635_100009816886 [0,2,0,0,0,0|1,0,0]=3 7044 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 270004a_106832991635_100009886798 [0,2,0,0,0,0|1,0,0]=3 7045 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 34a_100102657272_100009816886 [0,2,0,0,0,0|1,0,0]=3 7046 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 7a_106832991635_100009816886 [0,2,0,0,0,0|1,0,0]=3 7047 B14R1.24 COC(=O)Cc1ccc(cc1)CO[13CH3] 34a_100000087118_200025704644 [0,2,0,0,0,0|0,0,0]=2 7048 B14R1.24 COC(=O)Cc1ccc(cc1)CSC 62a_100009816886_200000210301 [0,2,0,0,0,0|0,1,0]=3 7049 B14R1.24 COC(=O)Cc1ccc(cc1)CSC 62a_200000210301_100009816886 [0,2,0,0,0,0|0,1,0]=3 7050 B14R1.24 COC(=O)Cc1ccc(cc1)CS[13CH3] 62a_100009816886_200025704644 [0,2,0,0,0,0|0,1,0]=3 7051 B14R1.24 COC(=O)Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100009816886 [0,2,0,0,0,0|0,1,0]=3 7052 B14R1.24 COC(=O)Cc1ccc(cc1)OCF 34a_100000211648_100015361967 [0,2,0,0,0,0|0,0,0]=2 7053 B14R1.24 COC(=O)Cc1ccc(cc1)SCF 62a_100000149743_100015361967 [0,2,0,0,0,0|0,1,0]=3 7054 B14R1.24 COC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000149743 [0,2,0,0,0,0|0,1,0]=3 7055 B14R1.24 COC(=O)Cc1ccc(cn1)SCF 62a_100012362609_100015361967 [0,2,0,0,0,0|1,1,0]=4 7056 B14R1.24 COC(=O)Cc1ccc(cn1)SCF 62a_100015361967_100012362609 [0,2,0,0,0,0|1,1,0]=4 7057 B14R1.24 COC(=O)Cc1ccc(nc1)SCF 62a_100000071674_100015361967 [0,2,0,0,0,0|1,1,0]=4 7058 B14R1.24 COC(=O)Cc1ccc(nc1)SCF 62a_100015361967_100000071674 [0,2,0,0,0,0|1,1,0]=4 7059 B14R1.24 COC(=O)Nc1ccc(cc1)OCF 34a_100011235918_100015361967 [0,2,0,0,0,0|1,0,0]=3 7060 B14R1.24 COC(=O)Nc1ccc(cc1)SCF 62a_100015361967_100000181880 [0,2,0,0,0,0|1,1,0]=4 7061 B14R1.24 COCc1ccc(cc1)CC(=O)CF 1458a_100011290826_100015361967 [0,2,0,0,0,0|0,0,0]=2 7062 B14R1.24 COCc1ccc(cc1)CC(=O)OC 34a_100000087118_200000210301 [0,2,0,0,0,0|0,0,0]=2 7063 B14R1.24 COCc1ccc(cc1)CC(=O)OC 34a_100138415774_100009816886 [0,2,0,0,0,0|0,0,0]=2 7064 B14R1.24 COCc1ccc(cc1)NC(=O)CO 22a_100000694113_100000210174 [0,2,0,0,0,0|1,0,0]=3 7065 B14R1.24 COCc1ccc(cc1)NC(=O)CO 527a_100000694113_100000210174 [0,2,0,0,0,0|1,0,0]=3 7066 B14R1.24 CSCc1ccc(cc1)NC(=O)CO 22a_106726388226_100000210174 [0,2,0,0,0,0|1,1,0]=4 7067 B14R1.24 CSCc1ccc(cc1)NC(=O)CO 527a_106726388226_100000210174 [0,2,0,0,0,0|1,1,0]=4 7068 B14R1.24 NCC(=O)Nc1ccc(cc1)SCF 62a_100015361967_100000741985 [0,2,0,0,0,0|1,1,0]=4 7069 B14R1.24 NNC(=O)Cc1ccc(cc1)OCF 34a_100000020777_100015361967 [0,2,0,0,0,0|1,0,0]=3 7070 B14R1.24 N[C@@H](CO)Cc1ccc(cc1)OCF 34a_100020629837_100015361967 [0,2,0,0,0,0|1,0,1]=4 7071 B14R1.24 O=C(CCl)Nc1ccc(cc1)OCF 34a_100000233757_100015361967 [0,2,0,0,0,0|1,0,0]=3 7072 B14R1.24 O=C(CO)Nc1ccc(cc1)CCO 22a_100011204434_100000210174 [0,2,0,0,0,0|2,0,0]=4 7073 B14R1.24 O=C(CO)Nc1ccc(cc1)CCO 527a_100011204434_100000210174 [0,2,0,0,0,0|2,0,0]=4 7074 B14R1.24 O=C(CO)Nc1ccc(cc1)NCF 34a_100011269904_100015361967 [0,2,0,0,0,0|2,0,0]=4 7075 B14R1.24 [N-]=[N+]=Nc1ccc(cc1)CC(=O)CF 1458a_100010395652_100015361967 [0,2,0,0,0,0|2,0,0]=4 7076 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C#C 1458a_100011220946_100000140223 [0,2,0,0,0,0|1,0,1]=4 7077 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C#C 1458a_200009884166_100000184674 [0,2,0,0,0,0|1,0,1]=4 7078 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000184674 [0,2,0,0,0,0|2,0,0]=4 7079 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C#N 1458a_100011220946_100000184898 [0,2,0,0,0,0|2,0,0]=4 7080 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C=C 1458a_100011220946_100000034074 [0,2,0,0,0,0|1,0,1]=4 7081 B14R1.954 C#CCC(=O)Cc1ccc(cc1)C=O 1458a_100011220946_100000075337 [0,2,0,0,0,0|2,0,0]=4 7082 B14R1.954 C#CCC(=O)Cc1ccc(cc1)CC 1458a_100011220946_100000747183 [0,2,0,0,0,0|1,0,0]=3 7083 B14R1.954 C#CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000184674 [0,2,0,0,0,0|1,0,0]=3 7084 B14R1.954 C#CCC(=O)Cc1ccc(cc1)CO 1458a_100011220946_100000067286 [0,2,0,0,0,0|2,0,0]=4 7085 B14R1.954 C#CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000184674 [0,2,0,0,0,0|2,0,0]=4 7086 B14R1.954 C#CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000184674 [0,2,0,0,0,0|0,0,0]=2 7087 B14R1.954 C#CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000184674 [0,2,0,0,0,0|0,1,0]=3 7088 B14R1.954 C#CCC(=O)Cc1ccc(cc1)SC 1458a_100011220946_100000181263 [0,2,0,0,0,0|0,1,0]=3 7089 B14R1.954 C#CCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000184674 [0,2,0,0,0,0|1,0,0]=3 7090 B14R1.954 C#CCC(=O)Cc1ccc(cn1)OC 1458a_100011220946_200000757186 [0,2,0,0,0,0|1,0,0]=3 7091 B14R1.954 C#CCC(=O)Cc1ccc(nc1)OC 1458a_100011220946_100020631284 [0,2,0,0,0,0|1,0,0]=3 7092 B14R1.954 C#CCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000184674 [0,2,0,0,0,0|1,0,0]=3 7093 B14R1.954 C#CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100011220946 [0,2,0,0,0,0|2,0,0]=4 7094 B14R1.954 C#CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100011220946 [0,2,0,0,0,0|2,0,0]=4 7095 B14R1.954 C#CCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100011220946 [0,2,0,0,0,0|1,0,0]=3 7096 B14R1.954 C#CCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100011220946 [0,2,0,0,0,0|1,0,0]=3 7097 B14R1.954 C#CCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100011220946 [0,2,0,0,0,0|1,1,0]=4 7098 B14R1.954 C#CCN(C)Cc1ccc(cc1)OC 2230a_100000184145_100000038162 [0,2,0,0,0,0|2,0,0]=4 7099 B14R1.954 C#CCN(C)Cc1ccc(cc1)OC 2230a_100000225692_100000742318 [0,2,0,0,0,0|2,0,0]=4 7100 B14R1.954 C#CCN(C)Cc1ccc(cc1)OC 26a_100000225692_100000210503 [0,2,0,0,0,0|2,0,0]=4 7101 B14R1.954 C#CCN(C)Cc1ccc(cc1)OC 270004a_100000225692_100000169835 [0,2,0,0,0,0|2,0,0]=4 7102 B14R1.954 C#CCN(C)Cc1ccc(cc1)OC 34a_100000225692_100000742318 [0,2,0,0,0,0|2,0,0]=4 7103 B14R1.954 C#Cc1ccc(cc1)CC(=O)C#CC 1458a_100000763181_100000140223 [0,2,0,0,0,0|1,0,1]=4 7104 B14R1.954 C#Cc1ccc(cc1)CC(=O)C=CC 1458a_100000210699_100000140223 [0,2,0,0,0,0|1,0,1]=4 7105 B14R1.954 C#Cc1ccc(cc1)CC(=O)CC#N 1458a_100051588842_100000140223 [0,2,0,0,0,0|1,0,1]=4 7106 B14R1.954 C#Cc1ccc(cc1)CC(=O)CC#N 1458a_200009884166_100011214920 [0,2,0,0,0,0|1,0,1]=4 7107 B14R1.954 C#Cc1ccc(cc1)CC(=O)CC=C 1458a_100000210193_100000140223 [0,2,0,0,0,0|1,0,1]=4 7108 B14R1.954 C#Cc1ccc(cc1)CC(=O)CC=C 1458a_200009884166_100000210623 [0,2,0,0,0,0|1,0,1]=4 7109 B14R1.954 C#Cc1ccc(cc1)CC(=O)CCC 1458a_100000211992_100000140223 [0,2,0,0,0,0|1,0,1]=4 7110 B14R1.954 C#Cc1ccc(cc1)CC(=O)CCC 1458a_200009884166_100000210303 [0,2,0,0,0,0|1,0,1]=4 7111 B14R1.954 C#Cc1ccc(cc1)CC(=O)CCF 1458a_200009884166_100011217306 [0,2,0,0,0,0|1,0,1]=4 7112 B14R1.954 C#Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000140223 [0,2,0,0,0,0|1,0,1]=4 7113 B14R1.954 C#Cc1ccc(cc1)CC(=O)CCO 1458a_200009884166_100000211926 [0,2,0,0,0,0|1,0,1]=4 7114 B14R1.954 C#Cc1ccc(cc1)CC(=O)COC 1458a_100000210968_100000140223 [0,2,0,0,0,0|1,0,1]=4 7115 B14R1.954 C#Cc1ccc(cc1)CC(=O)CSC 1458a_100000184570_100000140223 [0,2,0,0,0,0|1,0,1]=4 7116 B14R1.954 C#Cc1ccc(cc1)CC(=O)NCC 11a_100015525214_200009884166 [0,2,0,0,0,0|1,0,1]=4 7117 B14R1.954 C#Cc1ccc(cc1)CC(=O)NCC 240690a_100015525214_200009884166 [0,2,0,0,0,0|1,0,1]=4 7118 B14R1.954 C#Cc1ccc(cc1)CC(=O)NCC 527a_100015525214_200009884166 [0,2,0,0,0,0|1,0,1]=4 7119 B14R1.954 C#Cc1ccc(cc1)CC(=O)NNC 22a_100016993582_200009884166 [0,2,0,0,0,0|1,0,1]=4 7120 B14R1.954 C=CCC(=O)Cc1ccc(cc1)C#N 1458a_100000210193_100000184898 [0,2,0,0,0,0|2,0,0]=4 7121 B14R1.954 C=CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210623 [0,2,0,0,0,0|2,0,0]=4 7122 B14R1.954 C=CCC(=O)Cc1ccc(cc1)C=C 1458a_100000210193_100000034074 [0,2,0,0,0,0|1,0,1]=4 7123 B14R1.954 C=CCC(=O)Cc1ccc(cc1)C=O 1458a_100000210193_100000075337 [0,2,0,0,0,0|2,0,0]=4 7124 B14R1.954 C=CCC(=O)Cc1ccc(cc1)CC 1458a_100000210193_100000747183 [0,2,0,0,0,0|1,0,0]=3 7125 B14R1.954 C=CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210623 [0,2,0,0,0,0|1,0,0]=3 7126 B14R1.954 C=CCC(=O)Cc1ccc(cc1)CO 1458a_100000210193_100000067286 [0,2,0,0,0,0|2,0,0]=4 7127 B14R1.954 C=CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210623 [0,2,0,0,0,0|2,0,0]=4 7128 B14R1.954 C=CCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210623 [0,2,0,0,0,0|0,0,0]=2 7129 B14R1.954 C=CCC(=O)Cc1ccc(cc1)SC 1458a_100000210193_100000181263 [0,2,0,0,0,0|0,1,0]=3 7130 B14R1.954 C=CCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210623 [0,2,0,0,0,0|0,1,0]=3 7131 B14R1.954 C=CCC(=O)Cc1ccc(cn1)OC 1458a_100000210193_200000757186 [0,2,0,0,0,0|1,0,0]=3 7132 B14R1.954 C=CCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000210623 [0,2,0,0,0,0|1,0,0]=3 7133 B14R1.954 C=CCC(=O)Cc1ccc(nc1)OC 1458a_100000210193_100020631284 [0,2,0,0,0,0|1,0,0]=3 7134 B14R1.954 C=CCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000210623 [0,2,0,0,0,0|1,0,0]=3 7135 B14R1.954 C=CCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210193 [0,2,0,0,0,0|2,0,0]=4 7136 B14R1.954 C=CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210193 [0,2,0,0,0,0|2,0,0]=4 7137 B14R1.954 C=CCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210193 [0,2,0,0,0,0|2,0,0]=4 7138 B14R1.954 C=CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000210193 [0,2,0,0,0,0|2,0,0]=4 7139 B14R1.954 C=CCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210193 [0,2,0,0,0,0|1,0,0]=3 7140 B14R1.954 C=CCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210193 [0,2,0,0,0,0|1,0,0]=3 7141 B14R1.954 C=CCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210193 [0,2,0,0,0,0|1,0,0]=3 7142 B14R1.954 C=CCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000210193 [0,2,0,0,0,0|1,0,0]=3 7143 B14R1.954 C=CCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210193 [0,2,0,0,0,0|1,1,0]=4 7144 B14R1.954 C=CCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210193 [0,2,0,0,0,0|1,1,0]=4 7145 B14R1.954 C=CCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000210193 [0,2,0,0,0,0|1,1,0]=4 7146 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 2230a_100000184145_100000210623 [0,2,0,0,0,0|2,0,0]=4 7147 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 2230a_100000196214_200000210301 [0,2,0,0,0,0|2,0,0]=4 7148 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 2230a_100000225617_100000742318 [0,2,0,0,0,0|2,0,0]=4 7149 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 269982a_100000184145_100000210623 [0,2,0,0,0,0|2,0,0]=4 7150 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 269982a_100000196214_200000210301 [0,2,0,0,0,0|2,0,0]=4 7151 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 269982a_100000225617_100000742318 [0,2,0,0,0,0|2,0,0]=4 7152 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 26a_100000225617_100000210503 [0,2,0,0,0,0|2,0,0]=4 7153 B14R1.954 C=CCN(C)Cc1ccc(cc1)OC 270004a_100000225617_100000169835 [0,2,0,0,0,0|2,0,0]=4 7154 B14R1.954 C=CCN([13CH3])Cc1ccc(cc1)OC 2230a_100000196214_200025704644 [0,2,0,0,0,0|2,0,0]=4 7155 B14R1.954 C=CCN([13CH3])Cc1ccc(cc1)OC 269982a_100000196214_200025704644 [0,2,0,0,0,0|2,0,0]=4 7156 B14R1.954 C=Cc1ccc(cc1)CC(=O)C#CC 1458a_100000763181_100000034074 [0,2,0,0,0,0|1,0,1]=4 7157 B14R1.954 C=Cc1ccc(cc1)CC(=O)C=CC 1458a_100000210699_100000034074 [0,2,0,0,0,0|1,0,1]=4 7158 B14R1.954 C=Cc1ccc(cc1)CC(=O)CC#N 1458a_100051588842_100000034074 [0,2,0,0,0,0|1,0,1]=4 7159 B14R1.954 C=Cc1ccc(cc1)CC(=O)CCC 1458a_100000211992_100000034074 [0,2,0,0,0,0|1,0,1]=4 7160 B14R1.954 C=Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000034074 [0,2,0,0,0,0|1,0,1]=4 7161 B14R1.954 C=Cc1ccc(cc1)CC(=O)COC 1458a_100000210968_100000034074 [0,2,0,0,0,0|1,0,1]=4 7162 B14R1.954 C=Cc1ccc(cc1)CC(=O)CSC 1458a_100000184570_100000034074 [0,2,0,0,0,0|1,0,1]=4 7163 B14R1.954 C=Cc1ccc(cc1)CC(=O)OCC 271570a_100011290941_100000170549 [0,2,0,0,0,0|1,0,1]=4 7164 B14R1.954 CC#CC(=O)Cc1ccc(cc1)C#N 1458a_100000763181_100000184898 [0,2,0,0,0,0|2,0,0]=4 7165 B14R1.954 CC#CC(=O)Cc1ccc(cc1)C=O 1458a_100000763181_100000075337 [0,2,0,0,0,0|2,0,0]=4 7166 B14R1.954 CC#CC(=O)Cc1ccc(cc1)CC 1458a_100000763181_100000747183 [0,2,0,0,0,0|1,0,0]=3 7167 B14R1.954 CC#CC(=O)Cc1ccc(cc1)CO 1458a_100000763181_100000067286 [0,2,0,0,0,0|2,0,0]=4 7168 B14R1.954 CC#CC(=O)Cc1ccc(cc1)SC 1458a_100000763181_100000181263 [0,2,0,0,0,0|0,1,0]=3 7169 B14R1.954 CC#CC(=O)Cc1ccc(cn1)OC 1458a_100000763181_200000757186 [0,2,0,0,0,0|1,0,0]=3 7170 B14R1.954 CC#CC(=O)Cc1ccc(nc1)OC 1458a_100000763181_100020631284 [0,2,0,0,0,0|1,0,0]=3 7171 B14R1.954 CC#CC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000763181 [0,2,0,0,0,0|2,0,0]=4 7172 B14R1.954 CC#CC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000763181 [0,2,0,0,0,0|1,0,0]=3 7173 B14R1.954 CC#CC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000763181 [0,2,0,0,0,0|1,1,0]=4 7174 B14R1.954 CC=CC(=O)Cc1ccc(cc1)C#N 1458a_100000210699_100000184898 [0,2,0,0,0,0|2,0,0]=4 7175 B14R1.954 CC=CC(=O)Cc1ccc(cc1)C=O 1458a_100000210699_100000075337 [0,2,0,0,0,0|2,0,0]=4 7176 B14R1.954 CC=CC(=O)Cc1ccc(cc1)CC 1458a_100000210699_100000747183 [0,2,0,0,0,0|1,0,0]=3 7177 B14R1.954 CC=CC(=O)Cc1ccc(cc1)CO 1458a_100000210699_100000067286 [0,2,0,0,0,0|2,0,0]=4 7178 B14R1.954 CC=CC(=O)Cc1ccc(cc1)SC 1458a_100000210699_100000181263 [0,2,0,0,0,0|0,1,0]=3 7179 B14R1.954 CC=CC(=O)Cc1ccc(cn1)OC 1458a_100000210699_200000757186 [0,2,0,0,0,0|1,0,0]=3 7180 B14R1.954 CC=CC(=O)Cc1ccc(nc1)OC 1458a_100000210699_100020631284 [0,2,0,0,0,0|1,0,0]=3 7181 B14R1.954 CC=CC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210699 [0,2,0,0,0,0|2,0,0]=4 7182 B14R1.954 CC=CC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210699 [0,2,0,0,0,0|2,0,0]=4 7183 B14R1.954 CC=CC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210699 [0,2,0,0,0,0|2,0,0]=4 7184 B14R1.954 CC=CC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210699 [0,2,0,0,0,0|1,0,0]=3 7185 B14R1.954 CC=CC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210699 [0,2,0,0,0,0|1,0,0]=3 7186 B14R1.954 CC=CC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210699 [0,2,0,0,0,0|1,0,0]=3 7187 B14R1.954 CC=CC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210699 [0,2,0,0,0,0|1,1,0]=4 7188 B14R1.954 CC=CC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210699 [0,2,0,0,0,0|1,1,0]=4 7189 B14R1.954 CCCC(=O)Cc1ccc(cc1)C#N 1458a_100000211992_100000184898 [0,2,0,0,0,0|2,0,0]=4 7190 B14R1.954 CCCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100000210303 [0,2,0,0,0,0|2,0,0]=4 7191 B14R1.954 CCCC(=O)Cc1ccc(cc1)C=O 1458a_100000211992_100000075337 [0,2,0,0,0,0|2,0,0]=4 7192 B14R1.954 CCCC(=O)Cc1ccc(cc1)CC 1458a_100000211992_100000747183 [0,2,0,0,0,0|1,0,0]=3 7193 B14R1.954 CCCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210303 [0,2,0,0,0,0|1,0,0]=3 7194 B14R1.954 CCCC(=O)Cc1ccc(cc1)CO 1458a_100000211992_100000067286 [0,2,0,0,0,0|2,0,0]=4 7195 B14R1.954 CCCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100000210303 [0,2,0,0,0,0|2,0,0]=4 7196 B14R1.954 CCCC(=O)Cc1ccc(cc1)OC 1458a_100000210706_100000210303 [0,2,0,0,0,0|0,0,0]=2 7197 B14R1.954 CCCC(=O)Cc1ccc(cc1)SC 1458a_100000211992_100000181263 [0,2,0,0,0,0|0,1,0]=3 7198 B14R1.954 CCCC(=O)Cc1ccc(cc1)SC 1458a_100000756958_100000210303 [0,2,0,0,0,0|0,1,0]=3 7199 B14R1.954 CCCC(=O)Cc1ccc(cn1)OC 1458a_100000211992_200000757186 [0,2,0,0,0,0|1,0,0]=3 7200 B14R1.954 CCCC(=O)Cc1ccc(cn1)OC 1458a_100000722272_100000210303 [0,2,0,0,0,0|1,0,0]=3 7201 B14R1.954 CCCC(=O)Cc1ccc(nc1)OC 1458a_100000211992_100020631284 [0,2,0,0,0,0|1,0,0]=3 7202 B14R1.954 CCCC(=O)Cc1ccc(nc1)OC 1458a_100012001117_100000210303 [0,2,0,0,0,0|1,0,0]=3 7203 B14R1.954 CCCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000211992 [0,2,0,0,0,0|2,0,0]=4 7204 B14R1.954 CCCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000211992 [0,2,0,0,0,0|2,0,0]=4 7205 B14R1.954 CCCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000211992 [0,2,0,0,0,0|2,0,0]=4 7206 B14R1.954 CCCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000211992 [0,2,0,0,0,0|2,0,0]=4 7207 B14R1.954 CCCC(=O)Nc1ccc(cc1)NC 34a_200000186512_200000210301 [0,2,0,0,0,0|2,0,0]=4 7208 B14R1.954 CCCC(=O)Nc1ccc(cc1)N[13CH3] 34a_200000186512_200025704644 [0,2,0,0,0,0|2,0,0]=4 7209 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000211992 [0,2,0,0,0,0|1,0,0]=3 7210 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000211992 [0,2,0,0,0,0|1,0,0]=3 7211 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000211992 [0,2,0,0,0,0|1,0,0]=3 7212 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 34a_200011217123_200000210301 [0,2,0,0,0,0|1,0,0]=3 7213 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000211992 [0,2,0,0,0,0|1,0,0]=3 7214 B14R1.954 CCCC(=O)Nc1ccc(cc1)OC 7a_200011217123_200000210301 [0,2,0,0,0,0|1,0,0]=3 7215 B14R1.954 CCCC(=O)Nc1ccc(cc1)O[13CH3] 34a_200011217123_200025704644 [0,2,0,0,0,0|1,0,0]=3 7216 B14R1.954 CCCC(=O)Nc1ccc(cc1)O[13CH3] 7a_200011217123_200025704644 [0,2,0,0,0,0|1,0,0]=3 7217 B14R1.954 CCCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000211992 [0,2,0,0,0,0|1,1,0]=4 7218 B14R1.954 CCCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000211992 [0,2,0,0,0,0|1,1,0]=4 7219 B14R1.954 CCCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000211992 [0,2,0,0,0,0|1,1,0]=4 7220 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 2230a_100000184145_100000210303 [0,2,0,0,0,0|2,0,0]=4 7221 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 2230a_100000747261_100000742318 [0,2,0,0,0,0|2,0,0]=4 7222 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 2230a_100015185267_200000210301 [0,2,0,0,0,0|2,0,0]=4 7223 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 269982a_100000184145_100000210303 [0,2,0,0,0,0|2,0,0]=4 7224 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 269982a_100000747261_100000742318 [0,2,0,0,0,0|2,0,0]=4 7225 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 269982a_100015185267_200000210301 [0,2,0,0,0,0|2,0,0]=4 7226 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 26a_100000747261_100000210503 [0,2,0,0,0,0|2,0,0]=4 7227 B14R1.954 CCCN(C)Cc1ccc(cc1)OC 270004a_100000747261_100000169835 [0,2,0,0,0,0|2,0,0]=4 7228 B14R1.954 CCCN([13CH3])Cc1ccc(cc1)OC 2230a_100015185267_200025704644 [0,2,0,0,0,0|2,0,0]=4 7229 B14R1.954 CCCN([13CH3])Cc1ccc(cc1)OC 269982a_100015185267_200025704644 [0,2,0,0,0,0|2,0,0]=4 7230 B14R1.954 CCNC(=O)Cc1ccc(cc1)C#N 11a_100015525214_100000748677 [0,2,0,0,0,0|2,0,0]=4 7231 B14R1.954 CCNC(=O)Cc1ccc(cc1)C#N 240690a_100015525214_100000748677 [0,2,0,0,0,0|2,0,0]=4 7232 B14R1.954 CCNC(=O)Cc1ccc(cc1)C#N 527a_100015525214_100000748677 [0,2,0,0,0,0|2,0,0]=4 7233 B14R1.954 CCNC(=O)Cc1ccc(cc1)CC 11a_100015525214_200000759805 [0,2,0,0,0,0|1,0,0]=3 7234 B14R1.954 CCNC(=O)Cc1ccc(cc1)CC 240690a_100015525214_200000759805 [0,2,0,0,0,0|1,0,0]=3 7235 B14R1.954 CCNC(=O)Cc1ccc(cc1)CC 527a_100015525214_200000759805 [0,2,0,0,0,0|1,0,0]=3 7236 B14R1.954 CCNC(=O)Cc1ccc(cc1)CO 240690a_100015525214_100011356463 [0,2,0,0,0,0|2,0,0]=4 7237 B14R1.954 CCNC(=O)Cc1ccc(cc1)OC 11a_100015525214_100000210706 [0,2,0,0,0,0|0,0,0]=2 7238 B14R1.954 CCNC(=O)Cc1ccc(cc1)OC 240690a_100015525214_100000210706 [0,2,0,0,0,0|0,0,0]=2 7239 B14R1.954 CCNC(=O)Cc1ccc(cc1)OC 527a_100015525214_100000210706 [0,2,0,0,0,0|0,0,0]=2 7240 B14R1.954 CCNC(=O)Cc1ccc(cc1)SC 11a_100015525214_100000756958 [0,2,0,0,0,0|0,1,0]=3 7241 B14R1.954 CCNC(=O)Cc1ccc(cc1)SC 240690a_100015525214_100000756958 [0,2,0,0,0,0|0,1,0]=3 7242 B14R1.954 CCNC(=O)Cc1ccc(cc1)SC 527a_100015525214_100000756958 [0,2,0,0,0,0|0,1,0]=3 7243 B14R1.954 CCNC(=O)Cc1ccc(cn1)OC 11a_100015525214_100000722272 [0,2,0,0,0,0|1,0,0]=3 7244 B14R1.954 CCNC(=O)Cc1ccc(cn1)OC 240690a_100015525214_100000722272 [0,2,0,0,0,0|1,0,0]=3 7245 B14R1.954 CCNC(=O)Cc1ccc(cn1)OC 527a_100015525214_100000722272 [0,2,0,0,0,0|1,0,0]=3 7246 B14R1.954 CCNC(=O)Cc1ccc(nc1)OC 11a_100015525214_100012001117 [0,2,0,0,0,0|1,0,0]=3 7247 B14R1.954 CCNC(=O)Cc1ccc(nc1)OC 240690a_100015525214_100012001117 [0,2,0,0,0,0|1,0,0]=3 7248 B14R1.954 CCNC(=O)Cc1ccc(nc1)OC 527a_100015525214_100012001117 [0,2,0,0,0,0|1,0,0]=3 7249 B14R1.954 CCNC(=O)Nc1ccc(cc1)CC 2430a_100000211069_100015525214 [0,2,0,0,0,0|2,0,0]=4 7250 B14R1.954 CCNC(=O)Nc1ccc(cc1)OC 2430a_100000184247_100015525214 [0,2,0,0,0,0|1,0,0]=3 7251 B14R1.954 CCNC(=O)Nc1ccc(cc1)SC 2430a_100000212337_100015525214 [0,2,0,0,0,0|1,1,0]=4 7252 B14R1.954 CCNC(C)Cc1ccc(cc1)OC 270004a_100015525214_100000211147 [0,2,0,0,0,0|1,0,1]=4 7253 B14R1.954 CCOC(=O)Cc1ccc(cc1)OC 34a_100011212766_200000210301 [0,2,0,0,0,0|0,0,0]=2 7254 B14R1.954 CCOC(=O)Cc1ccc(cc1)OC 7a_100011212766_200000210301 [0,2,0,0,0,0|0,0,0]=2 7255 B14R1.954 CCOC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011212766_200025704644 [0,2,0,0,0,0|0,0,0]=2 7256 B14R1.954 CCOC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011212766_200025704644 [0,2,0,0,0,0|0,0,0]=2 7257 B14R1.954 CCOC(=O)Cc1ccc(cc1)SC 62a_100000170549_200000210301 [0,2,0,0,0,0|0,1,0]=3 7258 B14R1.954 CCOC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000170549 [0,2,0,0,0,0|0,1,0]=3 7259 B14R1.954 CCOC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000170549_200025704644 [0,2,0,0,0,0|0,1,0]=3 7260 B14R1.954 CCOC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000170549 [0,2,0,0,0,0|0,1,0]=3 7261 B14R1.954 CCOC(=O)Cc1ccc(cn1)SC 62a_100012359163_200000210301 [0,2,0,0,0,0|1,1,0]=4 7262 B14R1.954 CCOC(=O)Cc1ccc(cn1)SC 62a_200000210301_100012359163 [0,2,0,0,0,0|1,1,0]=4 7263 B14R1.954 CCOC(=O)Cc1ccc(cn1)S[13CH3] 62a_100012359163_200025704644 [0,2,0,0,0,0|1,1,0]=4 7264 B14R1.954 CCOC(=O)Cc1ccc(cn1)S[13CH3] 62a_200025704644_100012359163 [0,2,0,0,0,0|1,1,0]=4 7265 B14R1.954 CCOC(=O)Cc1ccc(nc1)SC 62a_100000071673_200000210301 [0,2,0,0,0,0|1,1,0]=4 7266 B14R1.954 CCOC(=O)Cc1ccc(nc1)SC 62a_200000210301_100000071673 [0,2,0,0,0,0|1,1,0]=4 7267 B14R1.954 CCOC(=O)Cc1ccc(nc1)S[13CH3] 62a_100000071673_200025704644 [0,2,0,0,0,0|1,1,0]=4 7268 B14R1.954 CCOC(=O)Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000071673 [0,2,0,0,0,0|1,1,0]=4 7269 B14R1.954 CCOC(=O)Nc1ccc(cc1)OC 34a_100000190837_200000210301 [0,2,0,0,0,0|1,0,0]=3 7270 B14R1.954 CCOC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000190837_200025704644 [0,2,0,0,0,0|1,0,0]=3 7271 B14R1.954 CCOC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000158341 [0,2,0,0,0,0|1,1,0]=4 7272 B14R1.954 CCOC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000158341 [0,2,0,0,0,0|1,1,0]=4 7273 B14R1.954 CCc1ccc(cc1)CC(=O)C=CBr 1458a_100016273825_100000747183 [0,2,0,0,0,0|1,0,1]=4 7274 B14R1.954 CCc1ccc(cc1)CC(=O)C=CCl 1458a_200016279998_100000747183 [0,2,0,0,0,0|1,0,1]=4 7275 B14R1.954 CCc1ccc(cc1)CC(=O)C=CI 1458a_100016256311_100000747183 [0,2,0,0,0,0|1,0,1]=4 7276 B14R1.954 CCc1ccc(cc1)CC(=O)CC#N 1458a_100051588842_100000747183 [0,2,0,0,0,0|1,0,0]=3 7277 B14R1.954 CCc1ccc(cc1)CC(=O)CC#N 1458a_200000759805_100011214920 [0,2,0,0,0,0|1,0,0]=3 7278 B14R1.954 CCc1ccc(cc1)CC(=O)CCF 1458a_200000759805_100011217306 [0,2,0,0,0,0|1,0,0]=3 7279 B14R1.954 CCc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000747183 [0,2,0,0,0,0|1,0,0]=3 7280 B14R1.954 CCc1ccc(cc1)CC(=O)CCO 1458a_200000759805_100000211926 [0,2,0,0,0,0|1,0,0]=3 7281 B14R1.954 CCc1ccc(cc1)CC(=O)COC 1458a_100000210968_100000747183 [0,2,0,0,0,0|1,0,0]=3 7282 B14R1.954 CCc1ccc(cc1)CC(=O)CSC 1458a_100000184570_100000747183 [0,2,0,0,0,0|1,0,0]=3 7283 B14R1.954 CCc1ccc(cc1)CC(=O)NNC 22a_100016993582_200000759805 [0,2,0,0,0,0|1,0,0]=3 7284 B14R1.954 CCc1ccc(cc1)CN(C)CC=O 2230a_100000683253_200015260668 [0,2,0,0,0,0|2,0,0]=4 7285 B14R1.954 CCc1ccc(cc1)CN(C)CC=O 269982a_100000683253_200015260668 [0,2,0,0,0,0|2,0,0]=4 7286 B14R1.954 CCc1ccc(cc1)NC(=O)CC#N 1626a_100000211069_100051588842 [0,2,0,0,0,0|2,0,0]=4 7287 B14R1.954 CCc1ccc(cc1)NC(=O)CC#N 22a_100000211069_100051588842 [0,2,0,0,0,0|2,0,0]=4 7288 B14R1.954 CCc1ccc(cc1)NC(=O)CCO 22a_100000211069_100011216618 [0,2,0,0,0,0|2,0,0]=4 7289 B14R1.954 CCc1ccc(cc1)NC(=O)CNC 2230a_106832991635_100000183192 [0,2,0,0,0,0|2,0,0]=4 7290 B14R1.954 CCc1ccc(cc1)NC(=O)CNC 34a_100102657272_100000183192 [0,2,0,0,0,0|2,0,0]=4 7291 B14R1.954 CCc1ccc(cc1)NC(=O)CNC 7a_106832991635_100000183192 [0,2,0,0,0,0|2,0,0]=4 7292 B14R1.954 CCc1ccc(cc1)NC(=O)COC 11a_100000211069_100000210968 [0,2,0,0,0,0|2,0,0]=4 7293 B14R1.954 CCc1ccc(cc1)NC(=O)COC 1626a_100000211069_100000210968 [0,2,0,0,0,0|2,0,0]=4 7294 B14R1.954 CCc1ccc(cc1)NC(=O)COC 22a_100000211069_100000210968 [0,2,0,0,0,0|2,0,0]=4 7295 B14R1.954 CCc1ccc(cc1)NC(=O)COC 34a_100138415774_100000183192 [0,2,0,0,0,0|2,0,0]=4 7296 B14R1.954 CCc1ccc(cc1)NC(=O)COC 527a_100000211069_100000210968 [0,2,0,0,0,0|2,0,0]=4 7297 B14R1.954 CCc1ccc(cc1)NC(=O)CSC 11a_100000211069_100000184570 [0,2,0,0,0,0|2,0,0]=4 7298 B14R1.954 CCc1ccc(cc1)NC(=O)CSC 1626a_100000211069_100000184570 [0,2,0,0,0,0|2,0,0]=4 7299 B14R1.954 CCc1ccc(cc1)NC(=O)CSC 22a_100000211069_100000184570 [0,2,0,0,0,0|2,0,0]=4 7300 B14R1.954 CCc1ccc(cc1)NC(=O)CSC 527a_100000211069_100000184570 [0,2,0,0,0,0|2,0,0]=4 7301 B14R1.954 CCc1ccc(cc1)NC(=O)CSC 62a_200000210301_100000183192 [0,2,0,0,0,0|2,0,0]=4 7302 B14R1.954 CCc1ccc(cc1)NC(=O)CS[13CH3] 62a_200025704644_100000183192 [0,2,0,0,0,0|2,0,0]=4 7303 B14R1.954 CNCC(=O)Nc1ccc(cc1)OC 2230a_100025754840_200000210301 [0,2,0,0,0,0|1,0,0]=3 7304 B14R1.954 CNCC(=O)Nc1ccc(cc1)OC 2230a_106832991635_100000182860 [0,2,0,0,0,0|1,0,0]=3 7305 B14R1.954 CNCC(=O)Nc1ccc(cc1)OC 34a_100102657272_100000182860 [0,2,0,0,0,0|1,0,0]=3 7306 B14R1.954 CNCC(=O)Nc1ccc(cc1)OC 7a_106832991635_100000182860 [0,2,0,0,0,0|1,0,0]=3 7307 B14R1.954 CNCC(=O)Nc1ccc(cc1)SC 2230a_106832991635_100000239573 [0,2,0,0,0,0|1,1,0]=4 7308 B14R1.954 CNCC(=O)Nc1ccc(cc1)SC 34a_100102657272_100000239573 [0,2,0,0,0,0|1,1,0]=4 7309 B14R1.954 CNCC(=O)Nc1ccc(cc1)SC 7a_106832991635_100000239573 [0,2,0,0,0,0|1,1,0]=4 7310 B14R1.954 CNCC(=O)Nc1ccc(nc1)OC 2230a_106832991635_100000737755 [0,2,0,0,0,0|2,0,0]=4 7311 B14R1.954 CNCC(=O)Nc1ccc(nc1)OC 34a_100102657272_100000737755 [0,2,0,0,0,0|2,0,0]=4 7312 B14R1.954 CNCC(=O)Oc1ccc(cc1)OC 2230a_106832991635_100010004613 [0,2,0,0,0,0|1,0,0]=3 7313 B14R1.954 CNCC(=O)Oc1ccc(cc1)OC 34a_100102657272_100010004613 [0,2,0,0,0,0|1,0,0]=3 7314 B14R1.954 CNCC(=O)Oc1ccc(cc1)OC 7a_106832991635_100010004613 [0,2,0,0,0,0|1,0,0]=3 7315 B14R1.954 CNNC(=O)Cc1ccc(cc1)C#N 22a_100016993582_100000748677 [0,2,0,0,0,0|2,0,0]=4 7316 B14R1.954 CNNC(=O)Cc1ccc(cc1)CO 22a_100016993582_100011356463 [0,2,0,0,0,0|2,0,0]=4 7317 B14R1.954 CNNC(=O)Cc1ccc(cc1)OC 22a_100016993582_100000210706 [0,2,0,0,0,0|0,0,0]=2 7318 B14R1.954 CNNC(=O)Cc1ccc(cc1)SC 22a_100016993582_100000756958 [0,2,0,0,0,0|0,1,0]=3 7319 B14R1.954 CNNC(=O)Cc1ccc(cn1)OC 22a_100016993582_100000722272 [0,2,0,0,0,0|1,0,0]=3 7320 B14R1.954 CNNC(=O)Cc1ccc(nc1)OC 22a_100016993582_100012001117 [0,2,0,0,0,0|1,0,0]=3 7321 B14R1.954 CNc1ccc(cc1)NC(=O)COC 34a_100000736724_200000210301 [0,2,0,0,0,0|2,0,0]=4 7322 B14R1.954 COCC(=O)Cc1ccc(cc1)C#N 1458a_100000210968_100000184898 [0,2,0,0,0,0|2,0,0]=4 7323 B14R1.954 COCC(=O)Cc1ccc(cc1)C=O 1458a_100000210968_100000075337 [0,2,0,0,0,0|2,0,0]=4 7324 B14R1.954 COCC(=O)Cc1ccc(cc1)CO 1458a_100000210968_100000067286 [0,2,0,0,0,0|2,0,0]=4 7325 B14R1.954 COCC(=O)Cc1ccc(cc1)SC 1458a_100000210968_100000181263 [0,2,0,0,0,0|0,1,0]=3 7326 B14R1.954 COCC(=O)Cc1ccc(cn1)OC 1458a_100000210968_200000757186 [0,2,0,0,0,0|1,0,0]=3 7327 B14R1.954 COCC(=O)Cc1ccc(nc1)OC 1458a_100000210968_100020631284 [0,2,0,0,0,0|1,0,0]=3 7328 B14R1.954 COCC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000736724_200025704644 [0,2,0,0,0,0|2,0,0]=4 7329 B14R1.954 COCC(=O)Nc1ccc(cc1)OC 11a_100000184247_100000210968 [0,2,0,0,0,0|1,0,0]=3 7330 B14R1.954 COCC(=O)Nc1ccc(cc1)OC 1626a_100000184247_100000210968 [0,2,0,0,0,0|1,0,0]=3 7331 B14R1.954 COCC(=O)Nc1ccc(cc1)OC 22a_100000184247_100000210968 [0,2,0,0,0,0|1,0,0]=3 7332 B14R1.954 COCC(=O)Nc1ccc(cc1)OC 34a_100138415774_100000182860 [0,2,0,0,0,0|1,0,0]=3 7333 B14R1.954 COCC(=O)Nc1ccc(cc1)OC 527a_100000184247_100000210968 [0,2,0,0,0,0|1,0,0]=3 7334 B14R1.954 COCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000210968 [0,2,0,0,0,0|1,1,0]=4 7335 B14R1.954 COCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000210968 [0,2,0,0,0,0|1,1,0]=4 7336 B14R1.954 COCC(=O)Nc1ccc(cc1)SC 34a_100138415774_100000239573 [0,2,0,0,0,0|1,1,0]=4 7337 B14R1.954 COCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000210968 [0,2,0,0,0,0|1,1,0]=4 7338 B14R1.954 COCC(=O)Nc1ccc(nc1)OC 34a_100138415774_100000737755 [0,2,0,0,0,0|2,0,0]=4 7339 B14R1.954 COCC(=O)Oc1ccc(cc1)OC 34a_100138415774_100010004613 [0,2,0,0,0,0|1,0,0]=3 7340 B14R1.954 COCN(C)Cc1ccc(cc1)OC 2230a_100000184145_100000766300 [0,2,0,0,0,0|1,0,1]=4 7341 B14R1.954 COCN(C)Cc1ccc(cc1)OC 269982a_100000184145_100000766300 [0,2,0,0,0,0|1,0,1]=4 7342 B14R1.954 COc1ccc(cc1)CC(=O)CC#N 1458a_100000210706_100011214920 [0,2,0,0,0,0|0,0,0]=2 7343 B14R1.954 COc1ccc(cc1)CC(=O)CCF 1458a_100000210706_100011217306 [0,2,0,0,0,0|0,0,0]=2 7344 B14R1.954 COc1ccc(cc1)CC(=O)CCO 1458a_100000210706_100000211926 [0,2,0,0,0,0|0,0,0]=2 7345 B14R1.954 COc1ccc(cc1)CN(C)CC#N 2230a_100000184145_100011215382 [0,2,0,0,0,0|2,0,0]=4 7346 B14R1.954 COc1ccc(cc1)CN(C)CC#N 2230a_100000748184_100000742318 [0,2,0,0,0,0|2,0,0]=4 7347 B14R1.954 COc1ccc(cc1)CN(C)CC#N 269982a_100000184145_100011214920 [0,2,0,0,0,0|2,0,0]=4 7348 B14R1.954 COc1ccc(cc1)CN(C)CC#N 26a_100000748184_100000210503 [0,2,0,0,0,0|2,0,0]=4 7349 B14R1.954 COc1ccc(cc1)CN(C)CC=O 2230a_100000184145_200015260668 [0,2,0,0,0,0|1,0,0]=3 7350 B14R1.954 COc1ccc(cc1)CN(C)CC=O 269982a_100000184145_200015260668 [0,2,0,0,0,0|1,0,0]=3 7351 B14R1.954 COc1ccc(cc1)CN(C)CCF 2230a_100000184145_100011217306 [0,2,0,0,0,0|2,0,0]=4 7352 B14R1.954 COc1ccc(cc1)CN(C)CCF 269982a_100000184145_100011217306 [0,2,0,0,0,0|2,0,0]=4 7353 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000184145_100000211926 [0,2,0,0,0,0|1,0,1]=4 7354 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000200446_200000210301 [0,2,0,0,0,0|1,0,1]=4 7355 B14R1.954 COc1ccc(cc1)CN(C)CCO 2230a_100000210263_100000742318 [0,2,0,0,0,0|1,0,1]=4 7356 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000184145_100000211926 [0,2,0,0,0,0|1,0,1]=4 7357 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000200446_200000210301 [0,2,0,0,0,0|1,0,1]=4 7358 B14R1.954 COc1ccc(cc1)CN(C)CCO 269982a_100000210263_100000742318 [0,2,0,0,0,0|1,0,1]=4 7359 B14R1.954 COc1ccc(cc1)CN(C)CCO 26a_100000210263_100000210503 [0,2,0,0,0,0|1,0,1]=4 7360 B14R1.954 COc1ccc(cc1)CN(C)CCO 270004a_100000210263_100000169835 [0,2,0,0,0,0|1,0,1]=4 7361 B14R1.954 COc1ccc(cc1)CN(C)CSC 2230a_100000184145_100011218213 [0,2,0,0,0,0|1,1,0]=4 7362 B14R1.954 COc1ccc(cc1)CN(C)CSC 269982a_100000184145_100011218213 [0,2,0,0,0,0|1,1,0]=4 7363 B14R1.954 COc1ccc(cc1)CN([13CH3])CCO 2230a_100000200446_200025704644 [0,2,0,0,0,0|1,0,1]=4 7364 B14R1.954 COc1ccc(cc1)CN([13CH3])CCO 269982a_100000200446_200025704644 [0,2,0,0,0,0|1,0,1]=4 7365 B14R1.954 COc1ccc(cc1)NC(=O)C=CBr 1626a_100000184247_100016273825 [0,2,0,0,0,0|1,0,1]=4 7366 B14R1.954 COc1ccc(cc1)NC(=O)C=CCl 11a_100000184247_200016279998 [0,2,0,0,0,0|1,0,1]=4 7367 B14R1.954 COc1ccc(cc1)NC(=O)C=CCl 1626a_100000184247_200016279998 [0,2,0,0,0,0|1,0,1]=4 7368 B14R1.954 COc1ccc(cc1)NC(=O)C=CI 1626a_100000184247_100016256311 [0,2,0,0,0,0|1,0,1]=4 7369 B14R1.954 COc1ccc(cc1)NC(=O)CC#N 1626a_100000184247_100051588842 [0,2,0,0,0,0|1,0,0]=3 7370 B14R1.954 COc1ccc(cc1)NC(=O)CC#N 22a_100000184247_100051588842 [0,2,0,0,0,0|1,0,0]=3 7371 B14R1.954 COc1ccc(cc1)NC(=O)CCCl 34a_100011302330_200000210301 [0,2,0,0,0,0|1,0,0]=3 7372 B14R1.954 COc1ccc(cc1)NC(=O)CCCl 7a_100011302330_200000210301 [0,2,0,0,0,0|1,0,0]=3 7373 B14R1.954 COc1ccc(cc1)NC(=O)CCO 22a_100000184247_100011216618 [0,2,0,0,0,0|1,0,0]=3 7374 B14R1.954 COc1ccc(cc1)NC(=O)CN[13CH3] 2230a_100025754840_200025704644 [0,2,0,0,0,0|1,0,0]=3 7375 B14R1.954 COc1ccc(cc1)NC(=O)CSC 11a_100000184247_100000184570 [0,2,0,0,0,0|1,0,0]=3 7376 B14R1.954 COc1ccc(cc1)NC(=O)CSC 1626a_100000184247_100000184570 [0,2,0,0,0,0|1,0,0]=3 7377 B14R1.954 COc1ccc(cc1)NC(=O)CSC 22a_100000184247_100000184570 [0,2,0,0,0,0|1,0,0]=3 7378 B14R1.954 COc1ccc(cc1)NC(=O)CSC 527a_100000184247_100000184570 [0,2,0,0,0,0|1,0,0]=3 7379 B14R1.954 COc1ccc(cc1)NC(=O)CSC 62a_200000210301_100000182860 [0,2,0,0,0,0|1,0,0]=3 7380 B14R1.954 COc1ccc(cc1)NC(=O)CSC 62a_200000243728_200000210301 [0,2,0,0,0,0|1,0,0]=3 7381 B14R1.954 COc1ccc(cc1)NC(=O)CS[13CH3] 62a_200000243728_200025704644 [0,2,0,0,0,0|1,0,0]=3 7382 B14R1.954 COc1ccc(cc1)NC(=O)CS[13CH3] 62a_200025704644_100000182860 [0,2,0,0,0,0|1,0,0]=3 7383 B14R1.954 COc1ccc(cc1)OC(=O)CSC 62a_200000210301_100010004613 [0,2,0,0,0,0|1,0,0]=3 7384 B14R1.954 COc1ccc(cc1)OC(=O)CS[13CH3] 62a_200025704644_100010004613 [0,2,0,0,0,0|1,0,0]=3 7385 B14R1.954 COc1ccc(cn1)CC(=O)C=CBr 1458a_100016273825_100020631284 [0,2,0,0,0,0|1,0,1]=4 7386 B14R1.954 COc1ccc(cn1)CC(=O)C=CCl 1458a_200016279998_100020631284 [0,2,0,0,0,0|1,0,1]=4 7387 B14R1.954 COc1ccc(cn1)CC(=O)C=CI 1458a_100016256311_100020631284 [0,2,0,0,0,0|1,0,1]=4 7388 B14R1.954 COc1ccc(cn1)CC(=O)CC#N 1458a_100012001117_100011214920 [0,2,0,0,0,0|1,0,0]=3 7389 B14R1.954 COc1ccc(cn1)CC(=O)CC#N 1458a_100051588842_100020631284 [0,2,0,0,0,0|1,0,0]=3 7390 B14R1.954 COc1ccc(cn1)CC(=O)CCF 1458a_100012001117_100011217306 [0,2,0,0,0,0|1,0,0]=3 7391 B14R1.954 COc1ccc(cn1)CC(=O)CCO 1458a_100011216618_100020631284 [0,2,0,0,0,0|1,0,0]=3 7392 B14R1.954 COc1ccc(cn1)CC(=O)CCO 1458a_100012001117_100000211926 [0,2,0,0,0,0|1,0,0]=3 7393 B14R1.954 COc1ccc(cn1)CC(=O)CSC 1458a_100000184570_100020631284 [0,2,0,0,0,0|1,0,0]=3 7394 B14R1.954 COc1ccc(cn1)NC(=O)CSC 62a_200000210301_100000737755 [0,2,0,0,0,0|2,0,0]=4 7395 B14R1.954 COc1ccc(cn1)NC(=O)CS[13CH3] 62a_200025704644_100000737755 [0,2,0,0,0,0|2,0,0]=4 7396 B14R1.954 COc1ccc(nc1)CC(=O)C=CBr 1458a_100016273825_200000757186 [0,2,0,0,0,0|1,0,1]=4 7397 B14R1.954 COc1ccc(nc1)CC(=O)C=CCl 1458a_200016279998_200000757186 [0,2,0,0,0,0|1,0,1]=4 7398 B14R1.954 COc1ccc(nc1)CC(=O)C=CI 1458a_100016256311_200000757186 [0,2,0,0,0,0|1,0,1]=4 7399 B14R1.954 COc1ccc(nc1)CC(=O)CC#N 1458a_100000722272_100011214920 [0,2,0,0,0,0|1,0,0]=3 7400 B14R1.954 COc1ccc(nc1)CC(=O)CC#N 1458a_100051588842_200000757186 [0,2,0,0,0,0|1,0,0]=3 7401 B14R1.954 COc1ccc(nc1)CC(=O)CCF 1458a_100000722272_100011217306 [0,2,0,0,0,0|1,0,0]=3 7402 B14R1.954 COc1ccc(nc1)CC(=O)CCO 1458a_100000722272_100000211926 [0,2,0,0,0,0|1,0,0]=3 7403 B14R1.954 COc1ccc(nc1)CC(=O)CCO 1458a_100011216618_200000757186 [0,2,0,0,0,0|1,0,0]=3 7404 B14R1.954 COc1ccc(nc1)CC(=O)CSC 1458a_100000184570_200000757186 [0,2,0,0,0,0|1,0,0]=3 7405 B14R1.954 CSCC(=O)Cc1ccc(cc1)C#N 1458a_100000184570_100000184898 [0,2,0,0,0,0|2,0,0]=4 7406 B14R1.954 CSCC(=O)Cc1ccc(cc1)C=O 1458a_100000184570_100000075337 [0,2,0,0,0,0|2,0,0]=4 7407 B14R1.954 CSCC(=O)Cc1ccc(cc1)CO 1458a_100000184570_100000067286 [0,2,0,0,0,0|2,0,0]=4 7408 B14R1.954 CSCC(=O)Cc1ccc(cc1)SC 1458a_100000184570_100000181263 [0,2,0,0,0,0|0,1,0]=3 7409 B14R1.954 CSCC(=O)Nc1ccc(cc1)SC 11a_100000212337_100000184570 [0,2,0,0,0,0|1,1,0]=4 7410 B14R1.954 CSCC(=O)Nc1ccc(cc1)SC 22a_100000212337_100000184570 [0,2,0,0,0,0|1,1,0]=4 7411 B14R1.954 CSCC(=O)Nc1ccc(cc1)SC 527a_100000212337_100000184570 [0,2,0,0,0,0|1,1,0]=4 7412 B14R1.954 CSCC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000239573 [0,2,0,0,0,0|1,1,0]=4 7413 B14R1.954 CSc1ccc(cc1)CC(=O)C=CBr 1458a_100016273825_100000181263 [0,2,0,0,0,0|0,1,1]=4 7414 B14R1.954 CSc1ccc(cc1)CC(=O)C=CCl 1458a_200016279998_100000181263 [0,2,0,0,0,0|0,1,1]=4 7415 B14R1.954 CSc1ccc(cc1)CC(=O)C=CI 1458a_100016256311_100000181263 [0,2,0,0,0,0|0,1,1]=4 7416 B14R1.954 CSc1ccc(cc1)CC(=O)CC#N 1458a_100000756958_100011214920 [0,2,0,0,0,0|0,1,0]=3 7417 B14R1.954 CSc1ccc(cc1)CC(=O)CC#N 1458a_100051588842_100000181263 [0,2,0,0,0,0|0,1,0]=3 7418 B14R1.954 CSc1ccc(cc1)CC(=O)CCF 1458a_100000756958_100011217306 [0,2,0,0,0,0|0,1,0]=3 7419 B14R1.954 CSc1ccc(cc1)CC(=O)CCO 1458a_100000756958_100000211926 [0,2,0,0,0,0|0,1,0]=3 7420 B14R1.954 CSc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000181263 [0,2,0,0,0,0|0,1,0]=3 7421 B14R1.954 CSc1ccc(cc1)CN(C)CC=O 2230a_102495365258_200015260668 [0,2,0,0,0,0|1,1,0]=4 7422 B14R1.954 CSc1ccc(cc1)CN(C)CC=O 269982a_102495365258_200015260668 [0,2,0,0,0,0|1,1,0]=4 7423 B14R1.954 CSc1ccc(cc1)NC(=O)CC#N 22a_100000212337_100051588842 [0,2,0,0,0,0|1,1,0]=4 7424 B14R1.954 CSc1ccc(cc1)NC(=O)CC#N 62a_200000210301_100000187967 [0,2,0,0,0,0|1,1,0]=4 7425 B14R1.954 CSc1ccc(cc1)NC(=O)CCN 62a_200000210301_100000743120 [0,2,0,0,0,0|1,1,0]=4 7426 B14R1.954 CSc1ccc(cc1)NC(=O)CCO 22a_100000212337_100011216618 [0,2,0,0,0,0|1,1,0]=4 7427 B14R1.954 CSc1ccc(cc1)NC(=O)CS[13CH3] 62a_200025704644_100000239573 [0,2,0,0,0,0|1,1,0]=4 7428 B14R1.954 N#CCC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_100011214920 [0,2,0,0,0,0|2,0,0]=4 7429 B14R1.954 N#CCC(=O)Cc1ccc(cc1)C#N 1458a_100051588842_100000184898 [0,2,0,0,0,0|2,0,0]=4 7430 B14R1.954 N#CCC(=O)Cc1ccc(cc1)C=O 1458a_100051588842_100000075337 [0,2,0,0,0,0|2,0,0]=4 7431 B14R1.954 N#CCC(=O)Cc1ccc(cc1)CO 1458a_100011356463_100011214920 [0,2,0,0,0,0|2,0,0]=4 7432 B14R1.954 N#CCC(=O)Cc1ccc(cc1)CO 1458a_100051588842_100000067286 [0,2,0,0,0,0|2,0,0]=4 7433 B14R1.954 N#Cc1ccc(cc1)CC(=O)CCF 1458a_100000748677_100011217306 [0,2,0,0,0,0|2,0,0]=4 7434 B14R1.954 N#Cc1ccc(cc1)CC(=O)CCO 1458a_100000748677_100000211926 [0,2,0,0,0,0|2,0,0]=4 7435 B14R1.954 N#Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000184898 [0,2,0,0,0,0|2,0,0]=4 7436 B14R1.954 O=C(CCF)Cc1ccc(cc1)CO 1458a_100011356463_100011217306 [0,2,0,0,0,0|2,0,0]=4 7437 B14R1.954 O=C(CCO)Cc1ccc(cc1)CO 1458a_100011216618_100000067286 [0,2,0,0,0,0|2,0,0]=4 7438 B14R1.954 O=C(CCO)Cc1ccc(cc1)CO 1458a_100011356463_100000211926 [0,2,0,0,0,0|2,0,0]=4 7439 B14R1.954 O=Cc1ccc(cc1)CC(=O)CCO 1458a_100011216618_100000075337 [0,2,0,0,0,0|2,0,0]=4 7440 B14R1.954 [13CH3]Oc1ccc(cc1)NC(=O)CCCl 34a_100011302330_200025704644 [0,2,0,0,0,0|1,0,0]=3 7441 B14R1.954 [13CH3]Oc1ccc(cc1)NC(=O)CCCl 7a_100011302330_200025704644 [0,2,0,0,0,0|1,0,0]=3 7442 B14R1.954 [13CH3]Sc1ccc(cc1)NC(=O)CC#N 62a_200025704644_100000187967 [0,2,0,0,0,0|1,1,0]=4 7443 B14R1.954 [13CH3]Sc1ccc(cc1)NC(=O)CCN 62a_200025704644_100000743120 [0,2,0,0,0,0|1,1,0]=4 7444 B14R1.2879 C#CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000211873_100000756337 [0,2,0,0,0,0|1,0,1]=4 7445 B14R1.2879 C#CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000211873_100000181262 [0,2,0,0,0,0|1,0,1]=4 7446 B14R1.2879 C=C(C)c1ccc(cc1)CC(=O)NC 271570a_100000694244_100000155101 [0,2,0,0,0,0|1,0,0]=3 7447 B14R1.2879 C=C(C)c1ccc(cc1)CC(=O)OC 271570a_100000694244_100000149743 [0,2,0,0,0,0|1,0,0]=3 7448 B14R1.2879 C=C(C)c1ccc(cc1)NC(=O)OC 271570a_100000694244_100000181880 [0,2,0,0,0,0|2,0,0]=4 7449 B14R1.2879 C=C(C)c1ccc(cc1)OC(=O)CC 271570a_100000694244_200009811598 [0,2,0,0,0,0|2,0,0]=4 7450 B14R1.2879 C=C(C)c1ccc(cn1)CC(=O)OC 271570a_100000694244_100000071674 [0,2,0,0,0,0|2,0,0]=4 7451 B14R1.2879 C=C(C)c1ccc(nc1)CC(=O)OC 271570a_100000694244_100012362609 [0,2,0,0,0,0|2,0,0]=4 7452 B14R1.2879 C=CC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000185746_100000756337 [0,2,0,0,0,0|1,0,1]=4 7453 B14R1.2879 C=CC(=O)Cc1ccc(cc1)C(C)C 1458a_100000185746_100000181262 [0,2,0,0,0,0|1,0,1]=4 7454 B14R1.2879 CC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000756337 [0,2,0,0,0,0|1,0,0]=3 7455 B14R1.2879 CC(C)c1ccc(cc1)CC(=O)CF 1458a_100000689720_100015361967 [0,2,0,0,0,0|1,0,0]=3 7456 B14R1.2879 CC(C)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000181262 [0,2,0,0,0,0|1,0,0]=3 7457 B14R1.2879 CC(C)c1ccc(cc1)NC(=O)CO 22a_100000210773_100000210174 [0,2,0,0,0,0|2,0,0]=4 7458 B14R1.2879 CC(C)c1ccc(cc1)NC(=O)CO 527a_100000210773_100000210174 [0,2,0,0,0,0|2,0,0]=4 7459 B14R1.2879 CC(O)c1ccc(cc1)NC(=O)CO 22a_100011216399_100000210174 [0,2,0,0,0,0|2,0,0]=4 7460 B14R1.2879 CC(O)c1ccc(cc1)NC(=O)CO 527a_100011216399_100000210174 [0,2,0,0,0,0|2,0,0]=4 7461 B14R1.2879 CCC(=O)Cc1ccc(cc1)B(O)O 1458a_100000210414_100009813762 [0,2,0,0,0,0|2,0,0]=4 7462 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000210414_100000756337 [0,2,0,0,0,0|1,0,0]=3 7463 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(=O)N 1458a_100000210414_100000231043 [0,2,0,0,0,0|2,0,0]=4 7464 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(C)C 1458a_100000210414_100000181262 [0,2,0,0,0,0|1,0,0]=3 7465 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(C)C 1458a_100000689720_100000210202 [0,2,0,0,0,0|1,0,0]=3 7466 B14R1.2879 CCC(=O)Cc1ccc(cc1)C(F)F 1458a_100000210414_200012343607 [0,2,0,0,0,0|2,0,0]=4 7467 B14R1.2879 CCC(=O)Cc1ccc(cc1)N(C)C 1458a_100011218386_100000210202 [0,2,0,0,0,0|1,0,0]=3 7468 B14R1.2879 CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210414_100000181861 [0,2,0,0,0,0|2,0,0]=4 7469 B14R1.2879 CCC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100000210202 [0,2,0,0,0,0|2,0,0]=4 7470 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(=O)C 1458a_100000194459_200000210301 [0,2,0,0,0,0|2,0,0]=4 7471 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(=O)[13CH3] 1458a_100000194459_200025704644 [0,2,0,0,0,0|2,0,0]=4 7472 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 11a_100000210773_100000210414 [0,2,0,0,0,0|2,0,0]=4 7473 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 1626a_100000210773_100000210414 [0,2,0,0,0,0|2,0,0]=4 7474 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 22a_100000210773_100000210414 [0,2,0,0,0,0|2,0,0]=4 7475 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)C 527a_100000210773_100000210414 [0,2,0,0,0,0|2,0,0]=4 7476 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)O 22a_100011216399_100000210414 [0,2,0,0,0,0|2,0,0]=4 7477 B14R1.2879 CCC(=O)Nc1ccc(cc1)C(C)O 527a_100011216399_100000210414 [0,2,0,0,0,0|2,0,0]=4 7478 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 11a_100016997997_100000210414 [0,2,0,0,0,0|2,0,0]=4 7479 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 1626a_100016997997_100000210414 [0,2,0,0,0,0|2,0,0]=4 7480 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 22a_100016997997_100000210414 [0,2,0,0,0,0|2,0,0]=4 7481 B14R1.2879 CCC(=O)Nc1ccc(cc1)N(C)C 527a_100016997997_100000210414 [0,2,0,0,0,0|2,0,0]=4 7482 B14R1.2879 CN(C)c1ccc(cc1)CC(=O)CF 1458a_100011218386_100015361967 [0,2,0,0,0,0|1,0,0]=3 7483 B14R1.2879 CN(C)c1ccc(cc1)NC(=O)CO 22a_100016997997_100000210174 [0,2,0,0,0,0|2,0,0]=4 7484 B14R1.2879 CN(C)c1ccc(cc1)NC(=O)CO 527a_100016997997_100000210174 [0,2,0,0,0,0|2,0,0]=4 7485 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 11a_106832991635_100000689720 [0,2,0,0,0,0|1,0,0]=3 7486 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 1626a_100102657272_100000689720 [0,2,0,0,0,0|1,0,0]=3 7487 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 240690a_100102657272_100000689720 [0,2,0,0,0,0|1,0,0]=3 7488 B14R1.2879 CNC(=O)Cc1ccc(cc1)C(C)C 527a_100102657272_100000689720 [0,2,0,0,0,0|1,0,0]=3 7489 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 11a_106832991635_100011218386 [0,2,0,0,0,0|1,0,0]=3 7490 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 1626a_100102657272_100011218386 [0,2,0,0,0,0|1,0,0]=3 7491 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 240690a_100102657272_100011218386 [0,2,0,0,0,0|1,0,0]=3 7492 B14R1.2879 CNC(=O)Cc1ccc(cc1)N(C)C 527a_100102657272_100011218386 [0,2,0,0,0,0|1,0,0]=3 7493 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 11a_106832991635_100000210908 [0,2,0,0,0,0|2,0,0]=4 7494 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 1626a_100102657272_100000210908 [0,2,0,0,0,0|2,0,0]=4 7495 B14R1.2879 CNC(=O)Cc1ccc(cc1)[N+](=O)[O-] 240690a_100102657272_100000210908 [0,2,0,0,0,0|2,0,0]=4 7496 B14R1.2879 CNC(=O)Nc1ccc(cc1)C(C)C 2430a_100000210773_100102657272 [0,2,0,0,0,0|2,0,0]=4 7497 B14R1.2879 CNC(=O)Nc1ccc(cc1)C(C)O 2430a_100011216399_100102657272 [0,2,0,0,0,0|2,0,0]=4 7498 B14R1.2879 CNC(=O)Nc1ccc(cc1)C(C)O 512a_106832991638_100011216399 [0,2,0,0,0,0|2,0,0]=4 7499 B14R1.2879 CNC(=O)Nc1ccc(cc1)N(C)C 2430a_100016997997_100102657272 [0,2,0,0,0,0|2,0,0]=4 7500 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)C 1458a_100000111013_200000210301 [0,2,0,0,0,0|1,0,0]=3 7501 B14R1.2879 COC(=O)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000111013_200025704644 [0,2,0,0,0,0|1,0,0]=3 7502 B14R1.2879 NC(=O)c1ccc(cc1)CC(=O)CO 1458a_100000210174_100000231043 [0,2,0,0,0,0|2,0,0]=4 7503 B14R1.2879 O=C(CF)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210908_100015361967 [0,2,0,0,0,0|2,0,0]=4 7504 B14R1.2879 O=C(CO)Cc1ccc(cc1)B(O)O 1458a_100000210174_100009813762 [0,2,0,0,0,0|2,0,0]=4 7505 B14R1.2879 O=C(CO)Cc1ccc(cc1)C(F)F 1458a_100000210174_200012343607 [0,2,0,0,0,0|2,0,0]=4 7506 B14R1.2879 O=C(CO)Cc1ccc(cc1)[N+](=O)[O-] 1458a_100000210174_100000181861 [0,2,0,0,0,0|2,0,0]=4 7507 B14R1.3276 C#CC(=O)Cc1cc(=O)c(co1)OC 1458a_100000211873_100000081511 [0,2,0,0,0,0|1,0,1]=4 7508 B14R1.3276 C#CC(=O)Cc1ccc(c(c1)Br)OC 1458a_100000211873_200011397701 [0,2,0,0,0,0|0,0,1]=3 7509 B14R1.3276 C#CC(=O)Cc1ccc(c(c1)C)OC 1458a_100000211873_200011290836 [0,2,0,0,0,0|0,0,1]=3 7510 B14R1.3276 C#CC(=O)Cc1ccc(c(c1)Cl)OC 1458a_100000211873_100000693707 [0,2,0,0,0,0|0,0,1]=3 7511 B14R1.3276 C#CC(=O)Cc1ccc(c(c1)F)OC 1458a_100000211873_100000189595 [0,2,0,0,0,0|0,0,1]=3 7512 B14R1.3276 C=CC(=O)Cc1cc(=O)c(co1)OC 1458a_100000185746_100000081511 [0,2,0,0,0,0|1,0,1]=4 7513 B14R1.3276 C=CC(=O)Cc1ccc(c(c1)Br)OC 1458a_100000185746_200011397701 [0,2,0,0,0,0|0,0,1]=3 7514 B14R1.3276 C=CC(=O)Cc1ccc(c(c1)C)OC 1458a_100000185746_200011290836 [0,2,0,0,0,0|0,0,1]=3 7515 B14R1.3276 C=CC(=O)Cc1ccc(c(c1)Cl)OC 1458a_100000185746_100000693707 [0,2,0,0,0,0|0,0,1]=3 7516 B14R1.3276 C=CC(=O)Cc1ccc(c(c1)F)OC 1458a_100000185746_100000189595 [0,2,0,0,0,0|0,0,1]=3 7517 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)Br)OC 1626a_100000187427_100000185746 [0,2,0,0,0,0|1,0,1]=4 7518 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)Br)OC 22a_100000187427_100000185746 [0,2,0,0,0,0|1,0,1]=4 7519 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)C)OC 1626a_100000743268_100000185746 [0,2,0,0,0,0|1,0,1]=4 7520 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)C)OC 22a_100000743268_100000185746 [0,2,0,0,0,0|1,0,1]=4 7521 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)Cl)OC 1626a_100000211044_100000185746 [0,2,0,0,0,0|1,0,1]=4 7522 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)Cl)OC 22a_100000211044_100000185746 [0,2,0,0,0,0|1,0,1]=4 7523 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)F)OC 1626a_100000740183_100000185746 [0,2,0,0,0,0|1,0,1]=4 7524 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)F)OC 22a_100000740183_100000185746 [0,2,0,0,0,0|1,0,1]=4 7525 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)I)OC 1626a_100011356947_100000185746 [0,2,0,0,0,0|1,0,1]=4 7526 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)I)OC 22a_100011356947_100000185746 [0,2,0,0,0,0|1,0,1]=4 7527 B14R1.3276 C=CC(=O)Nc1ccc(c(c1)O)OC 22a_100000211920_100000185746 [0,2,0,0,0,0|1,0,1]=4 7528 B14R1.3276 C=Cc1ccc(cc1F)CC(=O)OC 271570a_100011290941_100010371902 [0,2,0,0,0,0|1,0,1]=4 7529 B14R1.3276 CCC(=O)Cc1cc(=O)c(co1)OC 1458a_100000210414_100000081511 [0,2,0,0,0,0|1,0,0]=3 7530 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Br)C#N 1458a_100000210414_100012355662 [0,2,0,0,0,0|2,0,0]=4 7531 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Br)OC 1458a_100000210414_200011397701 [0,2,0,0,0,0|0,0,0]=2 7532 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Br)OC 1458a_100011202338_100000210202 [0,2,0,0,0,0|0,0,0]=2 7533 B14R1.3276 CCC(=O)Cc1ccc(c(c1)C)OC 1458a_100000210414_200011290836 [0,2,0,0,0,0|0,0,0]=2 7534 B14R1.3276 CCC(=O)Cc1ccc(c(c1)C)OC 1458a_100011356478_100000210202 [0,2,0,0,0,0|0,0,0]=2 7535 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Cl)C#N 1458a_100000210414_100010147163 [0,2,0,0,0,0|2,0,0]=4 7536 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Cl)OC 1458a_100000210414_100000693707 [0,2,0,0,0,0|0,0,0]=2 7537 B14R1.3276 CCC(=O)Cc1ccc(c(c1)Cl)OC 1458a_100012026953_100000210202 [0,2,0,0,0,0|0,0,0]=2 7538 B14R1.3276 CCC(=O)Cc1ccc(c(c1)F)C#N 1458a_100000210414_100011217145 [0,2,0,0,0,0|2,0,0]=4 7539 B14R1.3276 CCC(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_100000210202 [0,2,0,0,0,0|2,0,0]=4 7540 B14R1.3276 CCC(=O)Cc1ccc(c(c1)F)C=O 1458a_100000210414_100010142638 [0,2,0,0,0,0|2,0,0]=4 7541 B14R1.3276 CCC(=O)Cc1ccc(c(c1)F)OC 1458a_100000204603_100000210202 [0,2,0,0,0,0|0,0,0]=2 7542 B14R1.3276 CCC(=O)Cc1ccc(c(c1)F)OC 1458a_100000210414_100000189595 [0,2,0,0,0,0|0,0,0]=2 7543 B14R1.3276 CCC(=O)Cc1ccc(c(c1)O)OC 1458a_100000049095_100000210202 [0,2,0,0,0,0|0,0,0]=2 7544 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Br)OC 11a_100000187427_100000210414 [0,2,0,0,0,0|1,0,0]=3 7545 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Br)OC 1626a_100000187427_100000210414 [0,2,0,0,0,0|1,0,0]=3 7546 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Br)OC 22a_100000187427_100000210414 [0,2,0,0,0,0|1,0,0]=3 7547 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Br)OC 527a_100000187427_100000210414 [0,2,0,0,0,0|1,0,0]=3 7548 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)NC 34a_100011203062_200000210301 [0,2,0,0,0,0|2,0,0]=4 7549 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)NC 7a_100011203062_200000210301 [0,2,0,0,0,0|2,0,0]=4 7550 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)N[13CH3] 34a_100011203062_200025704644 [0,2,0,0,0,0|2,0,0]=4 7551 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)N[13CH3] 7a_100011203062_200025704644 [0,2,0,0,0,0|2,0,0]=4 7552 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)OC 11a_100000743268_100000210414 [0,2,0,0,0,0|1,0,0]=3 7553 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)OC 1626a_100000743268_100000210414 [0,2,0,0,0,0|1,0,0]=3 7554 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)OC 22a_100000743268_100000210414 [0,2,0,0,0,0|1,0,0]=3 7555 B14R1.3276 CCC(=O)Nc1ccc(c(c1)C)OC 527a_100000743268_100000210414 [0,2,0,0,0,0|1,0,0]=3 7556 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 11a_100000766362_100000210414 [0,2,0,0,0,0|2,0,0]=4 7557 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 1626a_100000766362_100000210414 [0,2,0,0,0,0|2,0,0]=4 7558 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 22a_100000766362_100000210414 [0,2,0,0,0,0|2,0,0]=4 7559 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 527a_100000766362_100000210414 [0,2,0,0,0,0|2,0,0]=4 7560 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)OC 11a_100000211044_100000210414 [0,2,0,0,0,0|1,0,0]=3 7561 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)OC 1626a_100000211044_100000210414 [0,2,0,0,0,0|1,0,0]=3 7562 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)OC 22a_100000211044_100000210414 [0,2,0,0,0,0|1,0,0]=3 7563 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)OC 527a_100000211044_100000210414 [0,2,0,0,0,0|1,0,0]=3 7564 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)OC 11a_100000740183_100000210414 [0,2,0,0,0,0|1,0,0]=3 7565 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)OC 1626a_100000740183_100000210414 [0,2,0,0,0,0|1,0,0]=3 7566 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)OC 22a_100000740183_100000210414 [0,2,0,0,0,0|1,0,0]=3 7567 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)OC 527a_100000740183_100000210414 [0,2,0,0,0,0|1,0,0]=3 7568 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)SC 11a_100000762756_100000210414 [0,2,0,0,0,0|1,1,0]=4 7569 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)SC 1626a_100000762756_100000210414 [0,2,0,0,0,0|1,1,0]=4 7570 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)SC 22a_100000762756_100000210414 [0,2,0,0,0,0|1,1,0]=4 7571 B14R1.3276 CCC(=O)Nc1ccc(c(c1)F)SC 527a_100000762756_100000210414 [0,2,0,0,0,0|1,1,0]=4 7572 B14R1.3276 CCC(=O)Nc1ccc(c(c1)I)OC 11a_100011356947_100000210414 [0,2,0,0,0,0|1,0,0]=3 7573 B14R1.3276 CCC(=O)Nc1ccc(c(c1)I)OC 1626a_100011356947_100000210414 [0,2,0,0,0,0|1,0,0]=3 7574 B14R1.3276 CCC(=O)Nc1ccc(c(c1)I)OC 22a_100011356947_100000210414 [0,2,0,0,0,0|1,0,0]=3 7575 B14R1.3276 CCC(=O)Nc1ccc(c(c1)I)OC 527a_100011356947_100000210414 [0,2,0,0,0,0|1,0,0]=3 7576 B14R1.3276 CCC(=O)Nc1ccc(c(c1)O)OC 22a_100000211920_100000210414 [0,2,0,0,0,0|1,0,0]=3 7577 B14R1.3276 CCC(=O)Nc1ccc(c(c1)O)OC 527a_100000211920_100000210414 [0,2,0,0,0,0|1,0,0]=3 7578 B14R1.3276 CCN(C)Cc1ccc(c(c1)Br)OC 2230a_100000225621_200011397701 [0,2,0,0,0,0|2,0,0]=4 7579 B14R1.3276 CCN(C)Cc1ccc(c(c1)Br)OC 269982a_100000225621_200011397701 [0,2,0,0,0,0|2,0,0]=4 7580 B14R1.3276 CCN(C)Cc1ccc(c(c1)Br)OC 26a_100000225621_100010234764 [0,2,0,0,0,0|2,0,0]=4 7581 B14R1.3276 CCN(C)Cc1ccc(c(c1)C)OC 2230a_100000225621_200011290836 [0,2,0,0,0,0|2,0,0]=4 7582 B14R1.3276 CCN(C)Cc1ccc(c(c1)C)OC 2230a_100000241087_100000210202 [0,2,0,0,0,0|2,0,0]=4 7583 B14R1.3276 CCN(C)Cc1ccc(c(c1)C)OC 269982a_100000225621_200011290836 [0,2,0,0,0,0|2,0,0]=4 7584 B14R1.3276 CCN(C)Cc1ccc(c(c1)C)OC 269982a_100000241087_100000204670 [0,2,0,0,0,0|2,0,0]=4 7585 B14R1.3276 CCN(C)Cc1ccc(c(c1)C)OC 34a_100000241087_100000210202 [0,2,0,0,0,0|2,0,0]=4 7586 B14R1.3276 CCN(C)Cc1ccc(c(c1)Cl)OC 2230a_100000225621_100000693707 [0,2,0,0,0,0|2,0,0]=4 7587 B14R1.3276 CCN(C)Cc1ccc(c(c1)Cl)OC 269982a_100000225621_100000693707 [0,2,0,0,0,0|2,0,0]=4 7588 B14R1.3276 CCN(C)Cc1ccc(c(c1)Cl)OC 26a_100000225621_200009861682 [0,2,0,0,0,0|2,0,0]=4 7589 B14R1.3276 CCN(C)Cc1ccc(c(c1)F)OC 2230a_100000225621_100000189595 [0,2,0,0,0,0|2,0,0]=4 7590 B14R1.3276 CCN(C)Cc1ccc(c(c1)F)OC 269982a_100000225621_100000189595 [0,2,0,0,0,0|2,0,0]=4 7591 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 2230a_100000188468_100000210202 [0,2,0,0,0,0|2,0,0]=4 7592 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 269982a_100000188468_100000204670 [0,2,0,0,0,0|2,0,0]=4 7593 B14R1.3276 CCc1ccc(cc1Cl)NC(=O)CO 22a_100000766362_100000210174 [0,2,0,0,0,0|2,0,0]=4 7594 B14R1.3276 CCc1ccc(cc1Cl)NC(=O)CO 527a_100000766362_100000210174 [0,2,0,0,0,0|2,0,0]=4 7595 B14R1.3276 CCc1ccc(cc1Cl)NC(=O)NC 2430a_100000766362_100102657272 [0,2,0,0,0,0|2,0,0]=4 7596 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 11a_106832991635_100011202338 [0,2,0,0,0,0|0,0,0]=2 7597 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 1626a_100102657272_100011202338 [0,2,0,0,0,0|0,0,0]=2 7598 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 240690a_100102657272_100011202338 [0,2,0,0,0,0|0,0,0]=2 7599 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 527a_100102657272_100011202338 [0,2,0,0,0,0|0,0,0]=2 7600 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 11a_106832991635_100011356478 [0,2,0,0,0,0|0,0,0]=2 7601 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 1626a_100102657272_100011356478 [0,2,0,0,0,0|0,0,0]=2 7602 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 240690a_100102657272_100011356478 [0,2,0,0,0,0|0,0,0]=2 7603 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 527a_100102657272_100011356478 [0,2,0,0,0,0|0,0,0]=2 7604 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 11a_106832991635_100012026953 [0,2,0,0,0,0|0,0,0]=2 7605 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 1626a_100102657272_100012026953 [0,2,0,0,0,0|0,0,0]=2 7606 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 240690a_100102657272_100012026953 [0,2,0,0,0,0|0,0,0]=2 7607 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 527a_100102657272_100012026953 [0,2,0,0,0,0|0,0,0]=2 7608 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)C#N 11a_106832991635_100009864126 [0,2,0,0,0,0|2,0,0]=4 7609 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)C#N 240690a_100102657272_100009864126 [0,2,0,0,0,0|2,0,0]=4 7610 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)C#N 527a_100102657272_100009864126 [0,2,0,0,0,0|2,0,0]=4 7611 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 11a_106832991635_100000204603 [0,2,0,0,0,0|0,0,0]=2 7612 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 1626a_100102657272_100000204603 [0,2,0,0,0,0|0,0,0]=2 7613 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 240690a_100102657272_100000204603 [0,2,0,0,0,0|0,0,0]=2 7614 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 527a_100102657272_100000204603 [0,2,0,0,0,0|0,0,0]=2 7615 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 240690a_100102657272_100000049095 [0,2,0,0,0,0|0,0,0]=2 7616 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 527a_100102657272_100000049095 [0,2,0,0,0,0|0,0,0]=2 7617 B14R1.3276 CNC(=O)Nc1ccc(c(c1)Br)OC 2430a_100000187427_100102657272 [0,2,0,0,0,0|1,0,0]=3 7618 B14R1.3276 CNC(=O)Nc1ccc(c(c1)C)OC 2430a_100000743268_100102657272 [0,2,0,0,0,0|1,0,0]=3 7619 B14R1.3276 CNC(=O)Nc1ccc(c(c1)Cl)OC 2430a_100000211044_100102657272 [0,2,0,0,0,0|1,0,0]=3 7620 B14R1.3276 CNC(=O)Nc1ccc(c(c1)F)OC 2430a_100000740183_100102657272 [0,2,0,0,0,0|1,0,0]=3 7621 B14R1.3276 CNC(=O)Nc1ccc(c(c1)F)SC 2430a_100000762756_100102657272 [0,2,0,0,0,0|1,1,0]=4 7622 B14R1.3276 CNC(=O)Nc1ccc(c(c1)F)SC 512a_100000762756_100102657272 [0,2,0,0,0,0|1,1,0]=4 7623 B14R1.3276 CNC(=O)Nc1ccc(c(c1)I)OC 2430a_100011356947_100102657272 [0,2,0,0,0,0|1,0,0]=3 7624 B14R1.3276 CNC(=O)Nc1ccc(c(c1)O)OC 2430a_100000211920_100102657272 [0,2,0,0,0,0|1,0,0]=3 7625 B14R1.3276 CNC(C)Cc1ccc(c(c1)Br)OC 270004a_106832991635_100011493462 [0,2,0,0,0,0|1,0,1]=4 7626 B14R1.3276 CNC(C)Cc1ccc(c(c1)Cl)OC 270004a_106832991635_200000078656 [0,2,0,0,0,0|1,0,1]=4 7627 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)OC 34a_100010222482_200000210301 [0,2,0,0,0,0|0,0,0]=2 7628 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)OC 7a_100010222482_200000210301 [0,2,0,0,0,0|0,0,0]=2 7629 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010222482_200025704644 [0,2,0,0,0,0|0,0,0]=2 7630 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010222482_200025704644 [0,2,0,0,0,0|0,0,0]=2 7631 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)OC 34a_100000087474_200000210301 [0,2,0,0,0,0|0,0,0]=2 7632 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)OC 7a_100000087474_200000210301 [0,2,0,0,0,0|0,0,0]=2 7633 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_100000087474_200025704644 [0,2,0,0,0,0|0,0,0]=2 7634 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_100000087474_200025704644 [0,2,0,0,0,0|0,0,0]=2 7635 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)OC 34a_100009994800_200000210301 [0,2,0,0,0,0|0,0,0]=2 7636 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)OC 7a_100009994800_200000210301 [0,2,0,0,0,0|0,0,0]=2 7637 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_100009994800_200025704644 [0,2,0,0,0,0|0,0,0]=2 7638 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_100009994800_200025704644 [0,2,0,0,0,0|0,0,0]=2 7639 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)OC 34a_100000699185_200000210301 [0,2,0,0,0,0|0,0,0]=2 7640 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)OC 7a_100000699185_200000210301 [0,2,0,0,0,0|0,0,0]=2 7641 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)O[13CH3] 34a_100000699185_200025704644 [0,2,0,0,0,0|0,0,0]=2 7642 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)O[13CH3] 7a_100000699185_200025704644 [0,2,0,0,0,0|0,0,0]=2 7643 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)SC 62a_100010371902_200000210301 [0,2,0,0,0,0|0,1,0]=3 7644 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)SC 62a_200000210301_100010371902 [0,2,0,0,0,0|0,1,0]=3 7645 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)S[13CH3] 62a_100010371902_200025704644 [0,2,0,0,0,0|0,1,0]=3 7646 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100010371902 [0,2,0,0,0,0|0,1,0]=3 7647 B14R1.3276 COC(=O)Cc1ccc(c(c1)N)OC 34a_100000067991_200000210301 [0,2,0,0,0,0|0,0,0]=2 7648 B14R1.3276 COC(=O)Cc1ccc(c(c1)N)O[13CH3] 34a_100000067991_200025704644 [0,2,0,0,0,0|0,0,0]=2 7649 B14R1.3276 COC(=O)Cc1ccc(c(c1)O)OC 271570a_203496583355_200012357789 [0,2,0,0,0,0|0,0,0]=2 7650 B14R1.3276 COC(=O)Nc1ccc(c(c1)N)SC 62a_200000210301_100012639261 [0,2,0,0,0,0|1,1,0]=4 7651 B14R1.3276 COC(=O)Nc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100012639261 [0,2,0,0,0,0|1,1,0]=4 7652 B14R1.3276 COc1ccc(cc1Br)C=C(C)C#N 6a_100000173361_200000212204 [0,2,0,0,0,0|1,0,1]=4 7653 B14R1.3276 COc1ccc(cc1Br)CC(=O)CF 1458a_100011202338_100015361967 [0,2,0,0,0,0|0,0,0]=2 7654 B14R1.3276 COc1ccc(cc1Br)CC(=O)CO 1458a_100000210174_200011397701 [0,2,0,0,0,0|0,0,0]=2 7655 B14R1.3276 COc1ccc(cc1Br)NC(=O)CO 22a_100000187427_100000210174 [0,2,0,0,0,0|1,0,0]=3 7656 B14R1.3276 COc1ccc(cc1Br)NC(=O)CO 527a_100000187427_100000210174 [0,2,0,0,0,0|1,0,0]=3 7657 B14R1.3276 COc1ccc(cc1C)C=C(C)C#N 6a_100000239718_200000212204 [0,2,0,0,0,0|1,0,1]=4 7658 B14R1.3276 COc1ccc(cc1C)CC(=O)CF 1458a_100011356478_100015361967 [0,2,0,0,0,0|0,0,0]=2 7659 B14R1.3276 COc1ccc(cc1C)CC(=O)CO 1458a_100000210174_200011290836 [0,2,0,0,0,0|0,0,0]=2 7660 B14R1.3276 COc1ccc(cc1C)CN(C)CF 269982a_100000241087_100015361967 [0,2,0,0,0,0|2,0,0]=4 7661 B14R1.3276 COc1ccc(cc1C)CN(C)CF 34a_100000241087_100015361967 [0,2,0,0,0,0|2,0,0]=4 7662 B14R1.3276 COc1ccc(cc1C)NC(=O)CO 22a_100000743268_100000210174 [0,2,0,0,0,0|1,0,0]=3 7663 B14R1.3276 COc1ccc(cc1C)NC(=O)CO 527a_100000743268_100000210174 [0,2,0,0,0,0|1,0,0]=3 7664 B14R1.3276 COc1ccc(cc1Cl)C=C(C)C#N 6a_100000186747_200000212204 [0,2,0,0,0,0|1,0,1]=4 7665 B14R1.3276 COc1ccc(cc1Cl)CC(=O)CF 1458a_100012026953_100015361967 [0,2,0,0,0,0|0,0,0]=2 7666 B14R1.3276 COc1ccc(cc1Cl)CC(=O)CO 1458a_100000210174_100000693707 [0,2,0,0,0,0|0,0,0]=2 7667 B14R1.3276 COc1ccc(cc1Cl)NC(=O)CO 22a_100000211044_100000210174 [0,2,0,0,0,0|1,0,0]=3 7668 B14R1.3276 COc1ccc(cc1Cl)NC(=O)CO 527a_100000211044_100000210174 [0,2,0,0,0,0|1,0,0]=3 7669 B14R1.3276 COc1ccc(cc1F)C=C(C)C#N 6a_100000204617_200000212204 [0,2,0,0,0,0|1,0,1]=4 7670 B14R1.3276 COc1ccc(cc1F)CC(=O)CF 1458a_100000204603_100015361967 [0,2,0,0,0,0|0,0,0]=2 7671 B14R1.3276 COc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100000189595 [0,2,0,0,0,0|0,0,0]=2 7672 B14R1.3276 COc1ccc(cc1F)NC(=O)CO 22a_100000740183_100000210174 [0,2,0,0,0,0|1,0,0]=3 7673 B14R1.3276 COc1ccc(cc1F)NC(=O)CO 527a_100000740183_100000210174 [0,2,0,0,0,0|1,0,0]=3 7674 B14R1.3276 COc1ccc(cc1I)C=C(C)C#N 6a_100009827998_200000212204 [0,2,0,0,0,0|1,0,1]=4 7675 B14R1.3276 COc1ccc(cc1I)NC(=O)CO 22a_100011356947_100000210174 [0,2,0,0,0,0|1,0,0]=3 7676 B14R1.3276 COc1ccc(cc1I)NC(=O)CO 527a_100011356947_100000210174 [0,2,0,0,0,0|1,0,0]=3 7677 B14R1.3276 COc1ccc(cc1O)CC(=O)CF 1458a_100000049095_100015361967 [0,2,0,0,0,0|0,0,0]=2 7678 B14R1.3276 COc1ccc(cc1O)CN(C)CF 269982a_100000188468_100015361967 [0,2,0,0,0,0|2,0,0]=4 7679 B14R1.3276 COc1ccc(cc1O)NC(=O)CO 22a_100000211920_100000210174 [0,2,0,0,0,0|1,0,0]=3 7680 B14R1.3276 COc1ccc(cc1O)NC(=O)CO 527a_100000211920_100000210174 [0,2,0,0,0,0|1,0,0]=3 7681 B14R1.3276 COc1coc(cc1=O)CC(=O)CO 1458a_100000210174_100000081511 [0,2,0,0,0,0|1,0,0]=3 7682 B14R1.3276 CSc1ccc(cc1F)NC(=O)CO 22a_100000762756_100000210174 [0,2,0,0,0,0|1,1,0]=4 7683 B14R1.3276 CSc1ccc(cc1F)NC(=O)CO 527a_100000762756_100000210174 [0,2,0,0,0,0|1,1,0]=4 7684 B14R1.3276 N#Cc1ccc(cc1Br)CC(=O)CO 1458a_100000210174_100012355662 [0,2,0,0,0,0|2,0,0]=4 7685 B14R1.3276 N#Cc1ccc(cc1Cl)CC(=O)CO 1458a_100000210174_100010147163 [0,2,0,0,0,0|2,0,0]=4 7686 B14R1.3276 N#Cc1ccc(cc1F)CC(=O)CF 1458a_100009864126_100015361967 [0,2,0,0,0,0|2,0,0]=4 7687 B14R1.3276 N#Cc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100011217145 [0,2,0,0,0,0|2,0,0]=4 7688 B14R1.3276 O=Cc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100010142638 [0,2,0,0,0,0|2,0,0]=4 7689 B14R1.3714 C#CC(=O)Cc1ccc(cc1Br)OC 1458a_100000211873_100011982828 [0,2,0,0,0,0|0,0,1]=3 7690 B14R1.3714 C#CC(=O)Cc1ccc(cc1Cl)OC 1458a_100000211873_200011830453 [0,2,0,0,0,0|0,0,1]=3 7691 B14R1.3714 C#CC(=O)Cc1ccc(cc1F)OC 1458a_100000211873_100011260761 [0,2,0,0,0,0|0,0,1]=3 7692 B14R1.3714 C=CC(=O)Cc1ccc(cc1Br)OC 1458a_100000185746_100011982828 [0,2,0,0,0,0|0,0,1]=3 7693 B14R1.3714 C=CC(=O)Cc1ccc(cc1Cl)OC 1458a_100000185746_200011830453 [0,2,0,0,0,0|0,0,1]=3 7694 B14R1.3714 C=CC(=O)Cc1ccc(cc1F)OC 1458a_100000185746_100011260761 [0,2,0,0,0,0|0,0,1]=3 7695 B14R1.3714 C=CC(=O)Nc1ccc(cc1Br)OC 1626a_100015195136_100000185746 [0,2,0,0,0,0|1,0,1]=4 7696 B14R1.3714 C=CC(=O)Nc1ccc(cc1Br)OC 22a_100015195136_100000185746 [0,2,0,0,0,0|1,0,1]=4 7697 B14R1.3714 C=CC(=O)Nc1ccc(cc1C)OC 1626a_100000750285_100000185746 [0,2,0,0,0,0|1,0,1]=4 7698 B14R1.3714 C=CC(=O)Nc1ccc(cc1C)OC 22a_100000750285_100000185746 [0,2,0,0,0,0|1,0,1]=4 7699 B14R1.3714 C=CC(=O)Nc1ccc(cc1Cl)OC 1626a_100000747055_100000185746 [0,2,0,0,0,0|1,0,1]=4 7700 B14R1.3714 C=CC(=O)Nc1ccc(cc1Cl)OC 22a_100000747055_100000185746 [0,2,0,0,0,0|1,0,1]=4 7701 B14R1.3714 C=CC(=O)Nc1ccc(cc1F)OC 1626a_100011299463_100000185746 [0,2,0,0,0,0|1,0,1]=4 7702 B14R1.3714 C=CC(=O)Nc1ccc(cc1F)OC 22a_100011299463_100000185746 [0,2,0,0,0,0|1,0,1]=4 7703 B14R1.3714 C=CC(=O)Nc1ccc(cc1I)OC 1626a_100000049804_100000185746 [0,2,0,0,0,0|1,0,1]=4 7704 B14R1.3714 C=CC(=O)Nc1ccc(cc1I)OC 22a_100000049804_100000185746 [0,2,0,0,0,0|1,0,1]=4 7705 B14R1.3714 C=CC(=O)Nc1ccc(cc1O)OC 22a_100016989039_100000185746 [0,2,0,0,0,0|1,0,1]=4 7706 B14R1.3714 C=Cc1ccc(c(c1)F)CC(=O)OC 271570a_100011290941_100013023952 [0,2,0,0,0,0|1,0,1]=4 7707 B14R1.3714 C=Cc1ccc(c(c1)O)CC(=O)OC 271570a_100011290941_100010150832 [0,2,0,0,0,0|1,0,1]=4 7708 B14R1.3714 CCC(=O)Cc1ccc(cc1Br)C#N 1458a_100000210414_100000694769 [0,2,0,0,0,0|2,0,0]=4 7709 B14R1.3714 CCC(=O)Cc1ccc(cc1Br)OC 1458a_100000210414_100011982828 [0,2,0,0,0,0|0,0,0]=2 7710 B14R1.3714 CCC(=O)Cc1ccc(cc1Br)OC 1458a_100000238646_100000210202 [0,2,0,0,0,0|0,0,0]=2 7711 B14R1.3714 CCC(=O)Cc1ccc(cc1C)OC 1458a_100011996676_100000210202 [0,2,0,0,0,0|0,0,0]=2 7712 B14R1.3714 CCC(=O)Cc1ccc(cc1Cl)C#N 1458a_100000210414_100000709902 [0,2,0,0,0,0|2,0,0]=4 7713 B14R1.3714 CCC(=O)Cc1ccc(cc1Cl)OC 1458a_100000210414_200011830453 [0,2,0,0,0,0|0,0,0]=2 7714 B14R1.3714 CCC(=O)Cc1ccc(cc1Cl)OC 1458a_100000688043_100000210202 [0,2,0,0,0,0|0,0,0]=2 7715 B14R1.3714 CCC(=O)Cc1ccc(cc1F)C#N 1458a_100000210414_100000239720 [0,2,0,0,0,0|2,0,0]=4 7716 B14R1.3714 CCC(=O)Cc1ccc(cc1F)OC 1458a_100000210414_100011260761 [0,2,0,0,0,0|0,0,0]=2 7717 B14R1.3714 CCC(=O)Cc1ccc(cc1F)OC 1458a_100000709196_100000210202 [0,2,0,0,0,0|0,0,0]=2 7718 B14R1.3714 CCC(=O)Cc1ccc(cc1I)C#N 1458a_100000210414_100010079267 [0,2,0,0,0,0|2,0,0]=4 7719 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)CC 11a_100012339725_100000210414 [0,2,0,0,0,0|2,0,0]=4 7720 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)CC 1626a_100012339725_100000210414 [0,2,0,0,0,0|2,0,0]=4 7721 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)CC 527a_100012339725_100000210414 [0,2,0,0,0,0|2,0,0]=4 7722 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)OC 11a_100015195136_100000210414 [0,2,0,0,0,0|1,0,0]=3 7723 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)OC 1626a_100015195136_100000210414 [0,2,0,0,0,0|1,0,0]=3 7724 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)OC 22a_100015195136_100000210414 [0,2,0,0,0,0|1,0,0]=3 7725 B14R1.3714 CCC(=O)Nc1ccc(cc1Br)OC 527a_100015195136_100000210414 [0,2,0,0,0,0|1,0,0]=3 7726 B14R1.3714 CCC(=O)Nc1ccc(cc1C)CC 11a_100011226020_100000210414 [0,2,0,0,0,0|2,0,0]=4 7727 B14R1.3714 CCC(=O)Nc1ccc(cc1C)CC 1626a_100011226020_100000210414 [0,2,0,0,0,0|2,0,0]=4 7728 B14R1.3714 CCC(=O)Nc1ccc(cc1C)CC 22a_100011226020_100000210414 [0,2,0,0,0,0|2,0,0]=4 7729 B14R1.3714 CCC(=O)Nc1ccc(cc1C)CC 527a_100011226020_100000210414 [0,2,0,0,0,0|2,0,0]=4 7730 B14R1.3714 CCC(=O)Nc1ccc(cc1C)OC 11a_100000750285_100000210414 [0,2,0,0,0,0|1,0,0]=3 7731 B14R1.3714 CCC(=O)Nc1ccc(cc1C)OC 1626a_100000750285_100000210414 [0,2,0,0,0,0|1,0,0]=3 7732 B14R1.3714 CCC(=O)Nc1ccc(cc1C)OC 22a_100000750285_100000210414 [0,2,0,0,0,0|1,0,0]=3 7733 B14R1.3714 CCC(=O)Nc1ccc(cc1C)OC 527a_100000750285_100000210414 [0,2,0,0,0,0|1,0,0]=3 7734 B14R1.3714 CCC(=O)Nc1ccc(cc1Cl)OC 11a_100000747055_100000210414 [0,2,0,0,0,0|1,0,0]=3 7735 B14R1.3714 CCC(=O)Nc1ccc(cc1Cl)OC 1626a_100000747055_100000210414 [0,2,0,0,0,0|1,0,0]=3 7736 B14R1.3714 CCC(=O)Nc1ccc(cc1Cl)OC 22a_100000747055_100000210414 [0,2,0,0,0,0|1,0,0]=3 7737 B14R1.3714 CCC(=O)Nc1ccc(cc1Cl)OC 527a_100000747055_100000210414 [0,2,0,0,0,0|1,0,0]=3 7738 B14R1.3714 CCC(=O)Nc1ccc(cc1F)CC 11a_100016177294_100000210414 [0,2,0,0,0,0|2,0,0]=4 7739 B14R1.3714 CCC(=O)Nc1ccc(cc1F)CC 1626a_100016177294_100000210414 [0,2,0,0,0,0|2,0,0]=4 7740 B14R1.3714 CCC(=O)Nc1ccc(cc1F)CC 22a_100016177294_100000210414 [0,2,0,0,0,0|2,0,0]=4 7741 B14R1.3714 CCC(=O)Nc1ccc(cc1F)CC 527a_100016177294_100000210414 [0,2,0,0,0,0|2,0,0]=4 7742 B14R1.3714 CCC(=O)Nc1ccc(cc1F)OC 11a_100011299463_100000210414 [0,2,0,0,0,0|1,0,0]=3 7743 B14R1.3714 CCC(=O)Nc1ccc(cc1F)OC 1626a_100011299463_100000210414 [0,2,0,0,0,0|1,0,0]=3 7744 B14R1.3714 CCC(=O)Nc1ccc(cc1F)OC 22a_100011299463_100000210414 [0,2,0,0,0,0|1,0,0]=3 7745 B14R1.3714 CCC(=O)Nc1ccc(cc1F)OC 527a_100011299463_100000210414 [0,2,0,0,0,0|1,0,0]=3 7746 B14R1.3714 CCC(=O)Nc1ccc(cc1F)SC 11a_100012056844_100000210414 [0,2,0,0,0,0|1,1,0]=4 7747 B14R1.3714 CCC(=O)Nc1ccc(cc1F)SC 1626a_100012056844_100000210414 [0,2,0,0,0,0|1,1,0]=4 7748 B14R1.3714 CCC(=O)Nc1ccc(cc1F)SC 22a_100012056844_100000210414 [0,2,0,0,0,0|1,1,0]=4 7749 B14R1.3714 CCC(=O)Nc1ccc(cc1F)SC 527a_100012056844_100000210414 [0,2,0,0,0,0|1,1,0]=4 7750 B14R1.3714 CCC(=O)Nc1ccc(cc1I)OC 11a_100000049804_100000210414 [0,2,0,0,0,0|1,0,0]=3 7751 B14R1.3714 CCC(=O)Nc1ccc(cc1I)OC 1626a_100000049804_100000210414 [0,2,0,0,0,0|1,0,0]=3 7752 B14R1.3714 CCC(=O)Nc1ccc(cc1I)OC 22a_100000049804_100000210414 [0,2,0,0,0,0|1,0,0]=3 7753 B14R1.3714 CCC(=O)Nc1ccc(cc1I)OC 527a_100000049804_100000210414 [0,2,0,0,0,0|1,0,0]=3 7754 B14R1.3714 CCC(=O)Nc1ccc(cc1O)CC 22a_100000124328_100000210414 [0,2,0,0,0,0|2,0,0]=4 7755 B14R1.3714 CCC(=O)Nc1ccc(cc1O)CC 527a_100000124328_100000210414 [0,2,0,0,0,0|2,0,0]=4 7756 B14R1.3714 CCC(=O)Nc1ccc(cc1O)OC 22a_100016989039_100000210414 [0,2,0,0,0,0|1,0,0]=3 7757 B14R1.3714 CCC(=O)Nc1ccc(cc1O)OC 527a_100016989039_100000210414 [0,2,0,0,0,0|1,0,0]=3 7758 B14R1.3714 CCN(C)Cc1ccc(cc1Br)OC 2230a_100000225621_100011982828 [0,2,0,0,0,0|2,0,0]=4 7759 B14R1.3714 CCN(C)Cc1ccc(cc1Br)OC 269982a_100000225621_100011982828 [0,2,0,0,0,0|2,0,0]=4 7760 B14R1.3714 CCN(C)Cc1ccc(cc1Br)OC 26a_100000225621_100000685887 [0,2,0,0,0,0|2,0,0]=4 7761 B14R1.3714 CCN(C)Cc1ccc(cc1Cl)OC 2230a_100000225621_200011830453 [0,2,0,0,0,0|2,0,0]=4 7762 B14R1.3714 CCN(C)Cc1ccc(cc1Cl)OC 269982a_100000225621_200011830453 [0,2,0,0,0,0|2,0,0]=4 7763 B14R1.3714 CCN(C)Cc1ccc(cc1Cl)OC 26a_100000225621_100000038596 [0,2,0,0,0,0|2,0,0]=4 7764 B14R1.3714 CCN(C)Cc1ccc(cc1F)OC 2230a_100000225621_100011260761 [0,2,0,0,0,0|2,0,0]=4 7765 B14R1.3714 CCN(C)Cc1ccc(cc1F)OC 269982a_100000225621_100011260761 [0,2,0,0,0,0|2,0,0]=4 7766 B14R1.3714 CCN(C)Cc1ccc(cc1F)OC 26a_100000225621_100000036999 [0,2,0,0,0,0|2,0,0]=4 7767 B14R1.3714 CCc1ccc(c(c1)Br)NC(=O)CO 527a_100012339725_100000210174 [0,2,0,0,0,0|2,0,0]=4 7768 B14R1.3714 CCc1ccc(c(c1)Br)NC(=O)NC 2430a_100012339725_100102657272 [0,2,0,0,0,0|2,0,0]=4 7769 B14R1.3714 CCc1ccc(c(c1)C)NC(=O)CO 22a_100011226020_100000210174 [0,2,0,0,0,0|2,0,0]=4 7770 B14R1.3714 CCc1ccc(c(c1)C)NC(=O)CO 527a_100011226020_100000210174 [0,2,0,0,0,0|2,0,0]=4 7771 B14R1.3714 CCc1ccc(c(c1)C)NC(=O)NC 2430a_100011226020_100102657272 [0,2,0,0,0,0|2,0,0]=4 7772 B14R1.3714 CCc1ccc(c(c1)C)NC(=O)NC 512a_106832991638_100011226020 [0,2,0,0,0,0|2,0,0]=4 7773 B14R1.3714 CCc1ccc(c(c1)F)NC(=O)CO 22a_100016177294_100000210174 [0,2,0,0,0,0|2,0,0]=4 7774 B14R1.3714 CCc1ccc(c(c1)F)NC(=O)CO 527a_100016177294_100000210174 [0,2,0,0,0,0|2,0,0]=4 7775 B14R1.3714 CCc1ccc(c(c1)F)NC(=O)NC 2430a_100016177294_100102657272 [0,2,0,0,0,0|2,0,0]=4 7776 B14R1.3714 CCc1ccc(c(c1)O)NC(=O)CO 22a_100000124328_100000210174 [0,2,0,0,0,0|2,0,0]=4 7777 B14R1.3714 CCc1ccc(c(c1)O)NC(=O)CO 527a_100000124328_100000210174 [0,2,0,0,0,0|2,0,0]=4 7778 B14R1.3714 CCc1ccc(c(c1)O)NC(=O)NC 2430a_100000124328_100102657272 [0,2,0,0,0,0|2,0,0]=4 7779 B14R1.3714 CNC(=O)Cc1ccc(cc1Br)OC 11a_106832991635_100000238646 [0,2,0,0,0,0|0,0,0]=2 7780 B14R1.3714 CNC(=O)Cc1ccc(cc1Br)OC 240690a_100102657272_100000238646 [0,2,0,0,0,0|0,0,0]=2 7781 B14R1.3714 CNC(=O)Cc1ccc(cc1Br)OC 527a_100102657272_100000238646 [0,2,0,0,0,0|0,0,0]=2 7782 B14R1.3714 CNC(=O)Cc1ccc(cc1C)OC 11a_106832991635_100011996676 [0,2,0,0,0,0|0,0,0]=2 7783 B14R1.3714 CNC(=O)Cc1ccc(cc1C)OC 1626a_100102657272_100011996676 [0,2,0,0,0,0|0,0,0]=2 7784 B14R1.3714 CNC(=O)Cc1ccc(cc1C)OC 240690a_100102657272_100011996676 [0,2,0,0,0,0|0,0,0]=2 7785 B14R1.3714 CNC(=O)Cc1ccc(cc1C)OC 527a_100102657272_100011996676 [0,2,0,0,0,0|0,0,0]=2 7786 B14R1.3714 CNC(=O)Cc1ccc(cc1Cl)OC 11a_106832991635_100000688043 [0,2,0,0,0,0|0,0,0]=2 7787 B14R1.3714 CNC(=O)Cc1ccc(cc1Cl)OC 1626a_100102657272_100000688043 [0,2,0,0,0,0|0,0,0]=2 7788 B14R1.3714 CNC(=O)Cc1ccc(cc1Cl)OC 240690a_100102657272_100000688043 [0,2,0,0,0,0|0,0,0]=2 7789 B14R1.3714 CNC(=O)Cc1ccc(cc1Cl)OC 527a_100102657272_100000688043 [0,2,0,0,0,0|0,0,0]=2 7790 B14R1.3714 CNC(=O)Cc1ccc(cc1F)OC 11a_106832991635_100000709196 [0,2,0,0,0,0|0,0,0]=2 7791 B14R1.3714 CNC(=O)Cc1ccc(cc1F)OC 1626a_100102657272_100000709196 [0,2,0,0,0,0|0,0,0]=2 7792 B14R1.3714 CNC(=O)Cc1ccc(cc1F)OC 240690a_100102657272_100000709196 [0,2,0,0,0,0|0,0,0]=2 7793 B14R1.3714 CNC(=O)Cc1ccc(cc1F)OC 527a_100102657272_100000709196 [0,2,0,0,0,0|0,0,0]=2 7794 B14R1.3714 CNC(=O)Nc1ccc(cc1Br)OC 2430a_100015195136_100102657272 [0,2,0,0,0,0|1,0,0]=3 7795 B14R1.3714 CNC(=O)Nc1ccc(cc1C)OC 2430a_100000750285_100102657272 [0,2,0,0,0,0|1,0,0]=3 7796 B14R1.3714 CNC(=O)Nc1ccc(cc1Cl)OC 2430a_100000747055_100102657272 [0,2,0,0,0,0|1,0,0]=3 7797 B14R1.3714 CNC(=O)Nc1ccc(cc1F)OC 2430a_100011299463_100102657272 [0,2,0,0,0,0|1,0,0]=3 7798 B14R1.3714 CNC(=O)Nc1ccc(cc1F)SC 2430a_100012056844_100102657272 [0,2,0,0,0,0|1,1,0]=4 7799 B14R1.3714 CNC(=O)Nc1ccc(cc1I)OC 2430a_100000049804_100102657272 [0,2,0,0,0,0|1,0,0]=3 7800 B14R1.3714 CNC(=O)Nc1ccc(cc1O)OC 2430a_100016989039_100102657272 [0,2,0,0,0,0|1,0,0]=3 7801 B14R1.3714 CNC(C)Cc1ccc(cc1F)OC 270004a_106832991635_200000084592 [0,2,0,0,0,0|1,0,1]=4 7802 B14R1.3714 COC(=O)Cc1ccc(cc1F)OC 34a_100009869613_200000210301 [0,2,0,0,0,0|0,0,0]=2 7803 B14R1.3714 COC(=O)Cc1ccc(cc1F)OC 7a_100009869613_200000210301 [0,2,0,0,0,0|0,0,0]=2 7804 B14R1.3714 COC(=O)Cc1ccc(cc1F)O[13CH3] 34a_100009869613_200025704644 [0,2,0,0,0,0|0,0,0]=2 7805 B14R1.3714 COC(=O)Cc1ccc(cc1F)O[13CH3] 7a_100009869613_200025704644 [0,2,0,0,0,0|0,0,0]=2 7806 B14R1.3714 COC(=O)Cc1ccc(cc1F)SC 62a_100013023952_200000210301 [0,2,0,0,0,0|0,1,0]=3 7807 B14R1.3714 COC(=O)Cc1ccc(cc1F)SC 62a_200000210301_100013023952 [0,2,0,0,0,0|0,1,0]=3 7808 B14R1.3714 COC(=O)Cc1ccc(cc1F)S[13CH3] 62a_100013023952_200025704644 [0,2,0,0,0,0|0,1,0]=3 7809 B14R1.3714 COC(=O)Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100013023952 [0,2,0,0,0,0|0,1,0]=3 7810 B14R1.3714 COC(=O)Cc1ccc(cc1O)C#N 271570a_203496583355_200010150797 [0,2,0,0,0,0|2,0,0]=4 7811 B14R1.3714 COC(=O)Cc1ccc(cc1O)SC 62a_100010150832_200000210301 [0,2,0,0,0,0|0,1,0]=3 7812 B14R1.3714 COC(=O)Cc1ccc(cc1O)SC 62a_200000210301_100010150832 [0,2,0,0,0,0|0,1,0]=3 7813 B14R1.3714 COC(=O)Cc1ccc(cc1O)S[13CH3] 62a_100010150832_200025704644 [0,2,0,0,0,0|0,1,0]=3 7814 B14R1.3714 COC(=O)Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100010150832 [0,2,0,0,0,0|0,1,0]=3 7815 B14R1.3714 COc1ccc(c(c1)Br)CC(=O)CF 1458a_100000238646_100015361967 [0,2,0,0,0,0|0,0,0]=2 7816 B14R1.3714 COc1ccc(c(c1)Br)CC(=O)CO 1458a_100000210174_100011982828 [0,2,0,0,0,0|0,0,0]=2 7817 B14R1.3714 COc1ccc(c(c1)Br)NC(=O)CO 22a_100015195136_100000210174 [0,2,0,0,0,0|1,0,0]=3 7818 B14R1.3714 COc1ccc(c(c1)Br)NC(=O)CO 527a_100015195136_100000210174 [0,2,0,0,0,0|1,0,0]=3 7819 B14R1.3714 COc1ccc(c(c1)C)CC(=O)CF 1458a_100011996676_100015361967 [0,2,0,0,0,0|0,0,0]=2 7820 B14R1.3714 COc1ccc(c(c1)C)NC(=O)CO 22a_100000750285_100000210174 [0,2,0,0,0,0|1,0,0]=3 7821 B14R1.3714 COc1ccc(c(c1)C)NC(=O)CO 527a_100000750285_100000210174 [0,2,0,0,0,0|1,0,0]=3 7822 B14R1.3714 COc1ccc(c(c1)Cl)CC(=O)CF 1458a_100000688043_100015361967 [0,2,0,0,0,0|0,0,0]=2 7823 B14R1.3714 COc1ccc(c(c1)Cl)CC(=O)CO 1458a_100000210174_200011830453 [0,2,0,0,0,0|0,0,0]=2 7824 B14R1.3714 COc1ccc(c(c1)Cl)NC(=O)CO 22a_100000747055_100000210174 [0,2,0,0,0,0|1,0,0]=3 7825 B14R1.3714 COc1ccc(c(c1)Cl)NC(=O)CO 527a_100000747055_100000210174 [0,2,0,0,0,0|1,0,0]=3 7826 B14R1.3714 COc1ccc(c(c1)F)CC(=O)CF 1458a_100000709196_100015361967 [0,2,0,0,0,0|0,0,0]=2 7827 B14R1.3714 COc1ccc(c(c1)F)CC(=O)CO 1458a_100000210174_100011260761 [0,2,0,0,0,0|0,0,0]=2 7828 B14R1.3714 COc1ccc(c(c1)F)NC(=O)CO 22a_100011299463_100000210174 [0,2,0,0,0,0|1,0,0]=3 7829 B14R1.3714 COc1ccc(c(c1)F)NC(=O)CO 527a_100011299463_100000210174 [0,2,0,0,0,0|1,0,0]=3 7830 B14R1.3714 COc1ccc(c(c1)I)C=C(C)C#N 6a_100010159643_200000212204 [0,2,0,0,0,0|1,0,1]=4 7831 B14R1.3714 COc1ccc(c(c1)I)NC(=O)CO 22a_100000049804_100000210174 [0,2,0,0,0,0|1,0,0]=3 7832 B14R1.3714 COc1ccc(c(c1)I)NC(=O)CO 527a_100000049804_100000210174 [0,2,0,0,0,0|1,0,0]=3 7833 B14R1.3714 COc1ccc(c(c1)O)NC(=O)CO 22a_100016989039_100000210174 [0,2,0,0,0,0|1,0,0]=3 7834 B14R1.3714 COc1ccc(c(c1)O)NC(=O)CO 527a_100016989039_100000210174 [0,2,0,0,0,0|1,0,0]=3 7835 B14R1.3714 CSc1ccc(c(c1)C)NC(=O)CN 62a_200000210301_100000684459 [0,2,0,0,0,0|1,1,0]=4 7836 B14R1.3714 CSc1ccc(c(c1)F)NC(=O)CN 62a_200000210301_100015183277 [0,2,0,0,0,0|1,1,0]=4 7837 B14R1.3714 CSc1ccc(c(c1)F)NC(=O)CO 22a_100012056844_100000210174 [0,2,0,0,0,0|1,1,0]=4 7838 B14R1.3714 CSc1ccc(c(c1)F)NC(=O)CO 527a_100012056844_100000210174 [0,2,0,0,0,0|1,1,0]=4 7839 B14R1.3714 Cc1cc(ccc1NC(=O)CN)S[13CH3] 62a_200025704644_100000684459 [0,2,0,0,0,0|1,1,0]=4 7840 B14R1.3714 N#Cc1ccc(c(c1)Br)CC(=O)CO 1458a_100000210174_100000694769 [0,2,0,0,0,0|2,0,0]=4 7841 B14R1.3714 N#Cc1ccc(c(c1)Cl)CC(=O)CO 1458a_100000210174_100000709902 [0,2,0,0,0,0|2,0,0]=4 7842 B14R1.3714 N#Cc1ccc(c(c1)F)CC(=O)CO 1458a_100000210174_100000239720 [0,2,0,0,0,0|2,0,0]=4 7843 B14R1.3714 N#Cc1ccc(c(c1)I)CC(=O)CO 1458a_100000210174_100010079267 [0,2,0,0,0,0|2,0,0]=4 7844 B14R1.3714 [13CH3]Sc1ccc(c(c1)F)NC(=O)CN 62a_200025704644_100015183277 [0,2,0,0,0,0|1,1,0]=4 7845 B14R1.140 CC(=O)Cc1ccc(c(c1)Br)OCF 34a_100010141077_100015361967 [0,2,0,0,0,0|0,0,0]=2 7846 B14R1.140 CC(=O)Cc1ccc(c(c1)Br)OCF 7a_100010141077_100015361967 [0,2,0,0,0,0|0,0,0]=2 7847 B14R1.140 CC(=O)Cc1ccc(c(c1)C)OCF 34a_200000080089_100015361967 [0,2,0,0,0,0|0,0,0]=2 7848 B14R1.140 CC(=O)Cc1ccc(c(c1)C)OCF 7a_200000080089_100015361967 [0,2,0,0,0,0|0,0,0]=2 7849 B14R1.140 CC(=O)Cc1ccc(c(c1)Cl)OCF 34a_200000080078_100015361967 [0,2,0,0,0,0|0,0,0]=2 7850 B14R1.140 CC(=O)Cc1ccc(c(c1)Cl)OCF 7a_200000080078_100015361967 [0,2,0,0,0,0|0,0,0]=2 7851 B14R1.140 CC(=O)Nc1ccc(c(c1)C)OCF 34a_100012186693_100015361967 [0,2,0,0,0,0|1,0,0]=3 7852 B14R1.140 CC(=O)Nc1ccc(c(c1)C)OCF 7a_100012186693_100015361967 [0,2,0,0,0,0|1,0,0]=3 7853 B14R1.140 CC(=O)Nc1ccc(c(c1)C)SCF 62a_100015361967_100000155607 [0,2,0,0,0,0|1,1,0]=4 7854 B14R1.140 CC(=O)Nc1ccc(c(c1)Cl)OCF 34a_100011215158_100015361967 [0,2,0,0,0,0|1,0,0]=3 7855 B14R1.140 CC(=O)Nc1ccc(c(c1)Cl)OCF 7a_100011215158_100015361967 [0,2,0,0,0,0|1,0,0]=3 7856 B14R1.140 CC(=O)Nc1ccc(c(c1)F)SCF 62a_100015361967_100011219590 [0,2,0,0,0,0|1,1,0]=4 7857 B14R1.140 CC=Cc1ccc(cc1C)NC(=O)C 271570a_100016259895_100000155607 [0,2,0,0,0,0|2,0,0]=4 7858 B14R1.140 CC=Cc1ccc(cc1F)NC(=O)C 271570a_100016259895_100011219590 [0,2,0,0,0,0|2,0,0]=4 7859 B14R1.140 CCOc1ccc(cc1Br)CC(=O)C 34a_100010141077_100000210202 [0,2,0,0,0,0|0,0,0]=2 7860 B14R1.140 CCOc1ccc(cc1Br)CC(=O)C 7a_100010141077_100000210202 [0,2,0,0,0,0|0,0,0]=2 7861 B14R1.140 CCOc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000173028 [0,2,0,0,0,0|2,0,0]=4 7862 B14R1.140 CCOc1ccc(cc1C)C=C(C)C 271570a_100102525489_100011308936 [0,2,0,0,0,0|1,0,1]=4 7863 B14R1.140 CCOc1ccc(cc1C)CC(=O)C 34a_200000080089_100000210202 [0,2,0,0,0,0|0,0,0]=2 7864 B14R1.140 CCOc1ccc(cc1C)CC(=O)C 7a_200000080089_100000210202 [0,2,0,0,0,0|0,0,0]=2 7865 B14R1.140 CCOc1ccc(cc1C)CN(C)C 270004a_100102631434_100012017204 [0,2,0,0,0,0|2,0,0]=4 7866 B14R1.140 CCOc1ccc(cc1C)NC(=O)C 34a_100012186693_100000210202 [0,2,0,0,0,0|1,0,0]=3 7867 B14R1.140 CCOc1ccc(cc1C)NC(=O)C 7a_100012186693_100000210202 [0,2,0,0,0,0|1,0,0]=3 7868 B14R1.140 CCOc1ccc(cc1Cl)CC(=O)C 34a_200000080078_100000210202 [0,2,0,0,0,0|0,0,0]=2 7869 B14R1.140 CCOc1ccc(cc1Cl)CC(=O)C 7a_200000080078_100000210202 [0,2,0,0,0,0|0,0,0]=2 7870 B14R1.140 CCOc1ccc(cc1Cl)CN(C)C 270004a_100102631434_200000188301 [0,2,0,0,0,0|2,0,0]=4 7871 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 11a_100000741444_100015343762 [0,2,0,0,0,0|1,0,0]=3 7872 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 1626a_100000741444_100015343762 [0,2,0,0,0,0|1,0,0]=3 7873 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 22a_100000741444_100000070787 [0,2,0,0,0,0|1,0,0]=3 7874 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 34a_100011215158_100000210202 [0,2,0,0,0,0|1,0,0]=3 7875 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 527a_100000741444_100103153847 [0,2,0,0,0,0|1,0,0]=3 7876 B14R1.140 CCOc1ccc(cc1Cl)NC(=O)C 7a_100011215158_100000210202 [0,2,0,0,0,0|1,0,0]=3 7877 B14R1.140 CCOc1ccc(cc1F)C=C(C)C 271570a_100102525489_200000171753 [0,2,0,0,0,0|1,0,1]=4 7878 B14R1.140 CCOc1ccc(cc1I)CN(C)C 270004a_100102631434_200000123116 [0,2,0,0,0,0|2,0,0]=4 7879 B14R1.140 CCOc1ccc(cc1N)C=C(C)C 271570a_100102525489_100000751366 [0,2,0,0,0,0|1,0,1]=4 7880 B14R1.140 CCSc1ccc(cc1C)NC(=O)C 62a_100000210202_100000155607 [0,2,0,0,0,0|1,1,0]=4 7881 B14R1.140 CCSc1ccc(cc1F)NC(=O)C 62a_100000210202_100011219590 [0,2,0,0,0,0|1,1,0]=4 7882 B14R1.140 CNCc1ccc(cc1Br)CC(=O)C 26a_100102657272_100010141077 [0,2,0,0,0,0|1,0,0]=3 7883 B14R1.140 CNCc1ccc(cc1Cl)CC(=O)C 26a_100102657272_200000080078 [0,2,0,0,0,0|1,0,0]=3 7884 B14R1.140 CNCc1ccc(cc1Cl)NC(=O)C 26a_100102657272_100011215158 [0,2,0,0,0,0|2,0,0]=4 7885 B14R1.140 COCc1ccc(cc1F)NC(=O)C 11a_100012145864_100015343762 [0,2,0,0,0,0|1,0,0]=3 7886 B14R1.140 COCc1ccc(cc1F)NC(=O)C 1626a_100012145864_100015343762 [0,2,0,0,0,0|1,0,0]=3 7887 B14R1.140 COCc1ccc(cc1F)NC(=O)C 22a_100012145864_100000070787 [0,2,0,0,0,0|1,0,0]=3 7888 B14R1.140 COCc1ccc(cc1F)NC(=O)C 527a_100012145864_100103153847 [0,2,0,0,0,0|1,0,0]=3 7889 B14R1.140 COCc1ccc(cc1N)C=C(C)C 271570a_100102525489_100013084866 [0,2,0,0,0,0|1,0,1]=4 7890 B14R1.2284 CC(=O)Nc1cc(c(cc1C)S[13CH3])C 62a_200025704644_100009992581 [0,2,0,0,0,0|1,1,0]=4 7891 B14R1.2284 CC(=O)Nc1cc(c(cc1C)S[13CH3])F 62a_200013212116_200025704644 [0,2,0,0,0,0|1,1,0]=4 7892 B14R1.2284 CC(=O)Nc1cc(c(cc1C)S[13CH3])F 62a_200025704644_200013212116 [0,2,0,0,0,0|1,1,0]=4 7893 B14R1.2284 CC(=O)Nc1cc(c(cc1F)S[13CH3])F 62a_200012359909_200025704644 [0,2,0,0,0,0|1,1,0]=4 7894 B14R1.2284 CC(=O)Nc1cc(c(cc1F)S[13CH3])F 62a_200025704644_200012359909 [0,2,0,0,0,0|1,1,0]=4 7895 B14R1.2284 COc1cc(c(cc1Br)CN(C)C)F 270004a_100102631434_100010244998 [0,2,0,0,0,0|2,0,0]=4 7896 B14R1.2284 COc1cc(c(cc1Br)NC(=O)C)C 11a_106657271712_100015343762 [0,2,0,0,0,0|1,0,0]=3 7897 B14R1.2284 COc1cc(c(cc1Br)NC(=O)C)C 1626a_106657271712_100015343762 [0,2,0,0,0,0|1,0,0]=3 7898 B14R1.2284 COc1cc(c(cc1Br)NC(=O)C)C 22a_106657271712_100000070787 [0,2,0,0,0,0|1,0,0]=3 7899 B14R1.2284 COc1cc(c(cc1Br)NC(=O)C)C 527a_106657271712_100103153847 [0,2,0,0,0,0|1,0,0]=3 7900 B14R1.2284 COc1cc(c(cc1C)C=C(C)C)C 271570a_100102525489_100000698960 [0,2,0,0,0,0|1,0,1]=4 7901 B14R1.2284 COc1cc(c(cc1C)C=C(C)C)N 271570a_100102525489_100010244135 [0,2,0,0,0,0|1,0,1]=4 7902 B14R1.2284 COc1cc(c(cc1C)CN(C)C)C 270004a_100102631434_100000186736 [0,2,0,0,0,0|2,0,0]=4 7903 B14R1.2284 COc1cc(c(cc1C)NC(=O)C)Br 11a_200010584344_100015343762 [0,2,0,0,0,0|1,0,0]=3 7904 B14R1.2284 COc1cc(c(cc1C)NC(=O)C)Br 1626a_200010584344_100015343762 [0,2,0,0,0,0|1,0,0]=3 7905 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)C 11a_100012039520_100015343762 [0,2,0,0,0,0|1,0,0]=3 7906 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)C 1626a_100012039520_100015343762 [0,2,0,0,0,0|1,0,0]=3 7907 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)C 22a_100012039520_100000070787 [0,2,0,0,0,0|1,0,0]=3 7908 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)C 527a_100012039520_100103153847 [0,2,0,0,0,0|1,0,0]=3 7909 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)Cl 11a_100011935304_100015343762 [0,2,0,0,0,0|1,0,0]=3 7910 B14R1.2284 COc1cc(c(cc1Cl)NC(=O)C)Cl 1626a_100011935304_100015343762 [0,2,0,0,0,0|1,0,0]=3 7911 B14R1.2284 COc1cc(c(cc1F)C=C(C)C)C 271570a_100102525489_100010074640 [0,2,0,0,0,0|1,0,1]=4 7912 B14R1.2284 COc1cc(c(cc1F)C=C(C)C)F 271570a_100102525489_100009813720 [0,2,0,0,0,0|1,0,1]=4 7913 B14R1.2284 COc1cc(c(cc1F)C=C(C)C)N 271570a_100102525489_100010208193 [0,2,0,0,0,0|1,0,1]=4 7914 B14R1.2284 COc1cc(c(cc1F)CN(C)C)F 270004a_100102631434_100000061656 [0,2,0,0,0,0|2,0,0]=4 7915 B14R1.2284 COc1cc(c(cc1F)NC(=O)C)Br 11a_100010365326_100015343762 [0,2,0,0,0,0|1,0,0]=3 7916 B14R1.2284 COc1cc(c(cc1F)NC(=O)C)Br 1626a_100010365326_100015343762 [0,2,0,0,0,0|1,0,0]=3 7917 B14R1.2284 COc1cc(c(cc1N)C=C(C)C)Cl 271570a_100102525489_100011011177 [0,2,0,0,0,0|1,0,1]=4 7918 B14R1.2284 COc1cc(c(cc1N)C=C(C)C)F 271570a_100102525489_100012361397 [0,2,0,0,0,0|1,0,1]=4 7919 B14R1.2284 CSc1cc(c(cc1C)NC(=O)C)C 62a_200000210301_100009992581 [0,2,0,0,0,0|1,1,0]=4 7920 B14R1.2284 CSc1cc(c(cc1F)NC(=O)C)C 62a_200000210301_200013212116 [0,2,0,0,0,0|1,1,0]=4 7921 B14R1.2284 CSc1cc(c(cc1F)NC(=O)C)C 62a_200013212116_200000210301 [0,2,0,0,0,0|1,1,0]=4 7922 B14R1.2284 CSc1cc(c(cc1F)NC(=O)C)F 62a_200000210301_200012359909 [0,2,0,0,0,0|1,1,0]=4 7923 B14R1.2284 CSc1cc(c(cc1F)NC(=O)C)F 62a_200012359909_200000210301 [0,2,0,0,0,0|1,1,0]=4 7924 B14R1.3651 C=Cc1cc(ccc1OC)CC(=O)C 271570a_100011290941_100011493462 [0,2,0,0,0,0|0,0,0]=2 7925 B14R1.3651 CC(=O)Oc1ccc(c(c1)C=O)S[13CH3] 62a_100009816906_200025704644 [0,2,0,0,0,0|1,1,0]=4 7926 B14R1.3651 CC(=O)Oc1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100009816906 [0,2,0,0,0,0|1,1,0]=4 7927 B14R1.3651 CCc1cc(ccc1OC)C=C(C)C 271570a_100102525489_200010179862 [0,2,0,0,0,0|1,0,1]=4 7928 B14R1.3651 CNc1cc(ccc1OC)NC(=O)C 34a_100000211725_200000210301 [0,2,0,0,0,0|1,0,0]=3 7929 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,2,0,0,0,0|0,0,0]=2 7930 B14R1.3651 COc1ccc(cc1C#N)C=C(C)C 271570a_100102525489_100000188252 [0,2,0,0,0,0|1,0,1]=4 7931 B14R1.3651 COc1ccc(cc1C#N)NC(=O)C 11a_100011204338_100015343762 [0,2,0,0,0,0|1,0,0]=3 7932 B14R1.3651 COc1ccc(cc1C#N)NC(=O)C 1626a_100011204338_100015343762 [0,2,0,0,0,0|1,0,0]=3 7933 B14R1.3651 COc1ccc(cc1C#N)NC(=O)C 22a_100011204338_100000070787 [0,2,0,0,0,0|1,0,0]=3 7934 B14R1.3651 COc1ccc(cc1C#N)NC(=O)C 527a_100011204338_100103153847 [0,2,0,0,0,0|1,0,0]=3 7935 B14R1.3651 COc1ccc(cc1C=O)C=C(C)C 271570a_100102525489_100000170026 [0,2,0,0,0,0|1,0,1]=4 7936 B14R1.3651 COc1ccc(cc1CN)C=C(C)C 271570a_100102525489_100000690498 [0,2,0,0,0,0|1,0,1]=4 7937 B14R1.3651 COc1ccc(cc1CO)C=C(C)C 271570a_100102525489_100000204679 [0,2,0,0,0,0|1,0,1]=4 7938 B14R1.3651 COc1ccc(cc1CO)CN(C)C 270004a_100102631434_100011361677 [0,2,0,0,0,0|2,0,0]=4 7939 B14R1.3651 COc1ccc(cc1N[13CH3])NC(=O)C 34a_100000211725_200025704644 [0,2,0,0,0,0|1,0,0]=3 7940 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [0,2,0,0,0,0|1,0,1]=4 7941 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,2,0,0,0,0|0,0,0]=2 7942 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,2,0,0,0,0|0,0,0]=2 7943 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,2,0,0,0,0|0,0,0]=2 7944 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [0,2,0,0,0,0|2,0,0]=4 7945 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [0,2,0,0,0,0|2,0,0]=4 7946 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [0,2,0,0,0,0|2,0,0]=4 7947 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [0,2,0,0,0,0|2,0,0]=4 7948 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [0,2,0,0,0,0|2,0,0]=4 7949 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [0,2,0,0,0,0|2,0,0]=4 7950 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [0,2,0,0,0,0|2,0,0]=4 7951 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 11a_100000187404_100015343762 [0,2,0,0,0,0|1,0,0]=3 7952 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 1626a_100000187404_100015343762 [0,2,0,0,0,0|1,0,0]=3 7953 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 22a_100000187404_100000070787 [0,2,0,0,0,0|1,0,0]=3 7954 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 527a_100000187404_100103153847 [0,2,0,0,0,0|1,0,0]=3 7955 B14R1.3651 COc1ccc(cc1SC)C=C(C)C 271570a_100102525489_200009892704 [0,2,0,0,0,0|1,0,1]=4 7956 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_100011493462_200000210301 [0,2,0,0,0,0|0,0,0]=2 7957 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_200000210301_100011493462 [0,2,0,0,0,0|0,0,0]=2 7958 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_100011493462_200025704644 [0,2,0,0,0,0|0,0,0]=2 7959 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_200025704644_100011493462 [0,2,0,0,0,0|0,0,0]=2 7960 B14R1.3651 CSc1ccc(cc1C=O)OC(=O)C 62a_100009816906_200000210301 [0,2,0,0,0,0|1,1,0]=4 7961 B14R1.3651 CSc1ccc(cc1C=O)OC(=O)C 62a_200000210301_100009816906 [0,2,0,0,0,0|1,1,0]=4 7962 B14R1.3652 COc1ccc(cc1Br)C(=C(C)C)C 271570a_200000049429_100011249507 [0,2,0,0,0,0|1,0,1]=4 7963 B14R1.3652 COc1ccc(cc1C)C(=C(C)C)C 271570a_200000049429_100011219705 [0,2,0,0,0,0|1,0,1]=4 7964 B14R1.3652 COc1ccc(cc1Cl)C(=C(C)C)C 271570a_200000049429_100012355395 [0,2,0,0,0,0|1,0,1]=4 7965 B14R1.3652 COc1ccc(cc1F)C(=C(C)C)C 271570a_200000049429_100000185480 [0,2,0,0,0,0|1,0,1]=4 7966 B14R1.3652 COc1ccc(cc1I)N(C)C(=O)C 11a_114948341033_100015343762 [0,2,0,0,0,0|1,0,0]=3 7967 B14R1.3652 COc1ccc(cc1I)N(C)C(=O)C 1626a_114948341033_100015343762 [0,2,0,0,0,0|1,0,0]=3 7968 B14R1.3652 COc1ccc(cc1I)N(C)C(=O)C 22a_114948341033_100000070787 [0,2,0,0,0,0|1,0,0]=3 7969 B14R1.3652 COc1ccc(cc1I)N(C)C(=O)C 527a_114948341033_100103153847 [0,2,0,0,0,0|1,0,0]=3 7970 B14R1.3652 COc1ccc(cc1N)C(=C(C)C)C 271570a_200000049429_100000743470 [0,2,0,0,0,0|1,0,1]=4 7971 B14R1.3652 COc1ccc(cc1O)C(=C(C)C)C 271570a_200000049429_100009816560 [0,2,0,0,0,0|1,0,1]=4 7972 B14R1.3662 COc1ccc(c(c1C)C)C=C(C)C 271570a_100102525489_100000049725 [0,2,0,0,0,0|1,0,1]=4 7973 B14R1.3662 COc1ccc(c(c1C)C)CN(C)C 270004a_100102631434_100000032066 [0,2,0,0,0,0|2,0,0]=4 7974 B14R1.3662 COc1ccc(c(c1C)C)NC(=O)C 11a_100025755787_100015343762 [0,2,0,0,0,0|1,0,0]=3 7975 B14R1.3662 COc1ccc(c(c1C)C)NC(=O)C 1626a_100025755787_100015343762 [0,2,0,0,0,0|1,0,0]=3 7976 B14R1.3662 COc1ccc(c(c1C)C)NC(=O)C 22a_100025755787_100000070787 [0,2,0,0,0,0|1,0,0]=3 7977 B14R1.3662 COc1ccc(c(c1C)C)NC(=O)C 527a_100025755787_100103153847 [0,2,0,0,0,0|1,0,0]=3 7978 B14R1.3662 COc1ccc(c(c1Cl)Cl)CN(C)C 270004a_100102631434_100010688703 [0,2,0,0,0,0|2,0,0]=4 7979 B14R1.3662 COc1ccc(c(c1F)F)C=C(C)C 271570a_100102525489_100009816879 [0,2,0,0,0,0|1,0,1]=4 7980 B14R1.3662 COc1ccc(c(c1F)F)CC(=O)C 1458a_100000062200_200000210301 [0,2,0,0,0,0|0,0,0]=2 7981 B14R1.3662 COc1ccc(c(c1F)F)CC(=O)C 1458a_100000070787_100009814551 [0,2,0,0,0,0|0,0,0]=2 7982 B14R1.3662 COc1ccc(c(c1F)F)CC(=O)[13CH3] 1458a_100000062200_200025704644 [0,2,0,0,0,0|0,0,0]=2 7983 B14R1.3662 COc1ccc(c(c1F)F)CN(C)C 2230a_100102631434_100009814551 [0,2,0,0,0,0|2,0,0]=4 7984 B14R1.3662 COc1ccc(c(c1F)F)CN(C)C 269982a_100102631434_100009814551 [0,2,0,0,0,0|2,0,0]=4 7985 B14R1.3662 COc1ccc(c(c1F)F)NC(=O)C 11a_100000062114_100015343762 [0,2,0,0,0,0|1,0,0]=3 7986 B14R1.3662 COc1ccc(c(c1F)F)NC(=O)C 1626a_100000062114_100015343762 [0,2,0,0,0,0|1,0,0]=3 7987 B14R1.3662 COc1ccc(c(c1F)F)NC(=O)C 22a_100000062114_100000070787 [0,2,0,0,0,0|1,0,0]=3 7988 B14R1.3662 COc1ccc(c(c1F)F)NC(=O)C 527a_100000062114_100103153847 [0,2,0,0,0,0|1,0,0]=3 7989 B14R1.5801 C=C(C)c1ccc(cc1C)NC(=O)C 271570a_100000694244_100000155607 [0,2,0,0,0,0|2,0,0]=4 7990 B14R1.5801 C=C(C)c1ccc(cc1F)NC(=O)C 271570a_100000694244_100011219590 [0,2,0,0,0,0|2,0,0]=4 7991 B14R1.5801 CC(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_200000210301 [0,2,0,0,0,0|2,0,0]=4 7992 B14R1.5801 CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100000070787_100009816690 [0,2,0,0,0,0|2,0,0]=4 7993 B14R1.5801 CC(=O)Cc1ccc(c(c1)C)[N+](=O)[O-] 1458a_100011935184_200000210301 [0,2,0,0,0,0|2,0,0]=4 7994 B14R1.5801 CC(=O)Cc1ccc(c(c1)F)[N+](=O)[O-] 1458a_100000070787_100000687068 [0,2,0,0,0,0|2,0,0]=4 7995 B14R1.5801 CC(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_200000210301 [0,2,0,0,0,0|2,0,0]=4 7996 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 11a_100011534197_100015343762 [0,2,0,0,0,0|2,0,0]=4 7997 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 1626a_100011534197_100015343762 [0,2,0,0,0,0|2,0,0]=4 7998 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 22a_100011534197_100000070787 [0,2,0,0,0,0|2,0,0]=4 7999 B14R1.5801 CC(=O)Nc1ccc(c(c1)Br)N(C)C 527a_100011534197_100103153847 [0,2,0,0,0,0|2,0,0]=4 8000 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(=O)C 1458a_100011218334_200000210301 [0,2,0,0,0,0|2,0,0]=4 8001 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100011218334_200025704644 [0,2,0,0,0,0|2,0,0]=4 8002 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 11a_100000005830_100015343762 [0,2,0,0,0,0|2,0,0]=4 8003 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 1626a_100000005830_100015343762 [0,2,0,0,0,0|2,0,0]=4 8004 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 22a_100000005830_100000070787 [0,2,0,0,0,0|2,0,0]=4 8005 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)C(C)C 527a_100000005830_100103153847 [0,2,0,0,0,0|2,0,0]=4 8006 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 11a_100000738307_100015343762 [0,2,0,0,0,0|2,0,0]=4 8007 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 1626a_100000738307_100015343762 [0,2,0,0,0,0|2,0,0]=4 8008 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 22a_100000738307_100000070787 [0,2,0,0,0,0|2,0,0]=4 8009 B14R1.5801 CC(=O)Nc1ccc(c(c1)C)N(C)C 527a_100000738307_100103153847 [0,2,0,0,0,0|2,0,0]=4 8010 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)C(=O)C 1458a_100000690302_200000210301 [0,2,0,0,0,0|2,0,0]=4 8011 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000690302_200025704644 [0,2,0,0,0,0|2,0,0]=4 8012 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 11a_100000742791_100015343762 [0,2,0,0,0,0|2,0,0]=4 8013 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 1626a_100000742791_100015343762 [0,2,0,0,0,0|2,0,0]=4 8014 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 22a_100000742791_100000070787 [0,2,0,0,0,0|2,0,0]=4 8015 B14R1.5801 CC(=O)Nc1ccc(c(c1)Cl)N(C)C 527a_100000742791_100103153847 [0,2,0,0,0,0|2,0,0]=4 8016 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)C(=O)C 1458a_100012179589_200000210301 [0,2,0,0,0,0|2,0,0]=4 8017 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100012179589_200025704644 [0,2,0,0,0,0|2,0,0]=4 8018 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 11a_100011248830_100015343762 [0,2,0,0,0,0|2,0,0]=4 8019 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 1626a_100011248830_100015343762 [0,2,0,0,0,0|2,0,0]=4 8020 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 22a_100011248830_100000070787 [0,2,0,0,0,0|2,0,0]=4 8021 B14R1.5801 CC(=O)Nc1ccc(c(c1)F)N(C)C 527a_100011248830_100103153847 [0,2,0,0,0,0|2,0,0]=4 8022 B14R1.5801 CC(=O)Nc1ccc(c(c1)O)C(=O)C 1458a_100011194132_200000210301 [0,2,0,0,0,0|2,0,0]=4 8023 B14R1.5801 CC(=O)Nc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100011194132_200025704644 [0,2,0,0,0,0|2,0,0]=4 8024 B14R1.5801 Cc1cc(ccc1[N+](=O)[O-])CC(=O)[13CH3] 1458a_100011935184_200025704644 [0,2,0,0,0,0|2,0,0]=4 8025 B14R1.5801 [13CH3]C(=O)Cc1ccc(c(c1)Br)[N+](=O)[O-] 1458a_100010245527_200025704644 [0,2,0,0,0,0|2,0,0]=4 8026 B14R1.5801 [13CH3]C(=O)Cc1ccc(c(c1)O)[N+](=O)[O-] 1458a_100009873053_200025704644 [0,2,0,0,0,0|2,0,0]=4 8027 B14R1.12535 CC(=O)Cc1cc(c(c(c1)C)O[13CH3])C 34a_200000080086_200025704644 [0,2,0,0,0,0|0,0,0]=2 8028 B14R1.12535 CC(=O)Cc1cc(c(c(c1)C)O[13CH3])C 7a_200000080086_200025704644 [0,2,0,0,0,0|0,0,0]=2 8029 B14R1.12535 CC(=O)Nc1cc(c(c(c1)C)S[13CH3])C 62a_200025704644_200012340666 [0,2,0,0,0,0|1,1,0]=4 8030 B14R1.12535 CC(=O)Nc1cc(c(c(c1)Cl)S[13CH3])Cl 62a_200025704644_106256037338 [0,2,0,0,0,0|1,1,0]=4 8031 B14R1.12535 CC(=O)Nc1cc(c(c(c1)F)S[13CH3])F 62a_200009813856_200025704644 [0,2,0,0,0,0|1,1,0]=4 8032 B14R1.12535 CC(=O)Nc1cc(c(c(c1)F)S[13CH3])F 62a_200025704644_200009813856 [0,2,0,0,0,0|1,1,0]=4 8033 B14R1.12535 COc1c(cc(cc1Br)C=C(C)C)C 271570a_100102525489_100010997178 [0,2,0,0,0,0|1,0,1]=4 8034 B14R1.12535 COc1c(cc(cc1Br)CN(C)C)Br 270004a_100102631434_100000188323 [0,2,0,0,0,0|2,0,0]=4 8035 B14R1.12535 COc1c(cc(cc1Br)CN(C)C)Cl 270004a_100102631434_200009816618 [0,2,0,0,0,0|2,0,0]=4 8036 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)Br 11a_100011274243_100015343762 [0,2,0,0,0,0|1,0,0]=3 8037 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)Br 1626a_100011274243_100015343762 [0,2,0,0,0,0|1,0,0]=3 8038 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)Br 22a_100011274243_100000070787 [0,2,0,0,0,0|1,0,0]=3 8039 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)Br 527a_100011274243_100103153847 [0,2,0,0,0,0|1,0,0]=3 8040 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)C 11a_100010071304_100015343762 [0,2,0,0,0,0|1,0,0]=3 8041 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)C 1626a_100010071304_100015343762 [0,2,0,0,0,0|1,0,0]=3 8042 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)C 22a_100010071304_100000070787 [0,2,0,0,0,0|1,0,0]=3 8043 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)C 527a_100010071304_100103153847 [0,2,0,0,0,0|1,0,0]=3 8044 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)F 11a_200009816006_100015343762 [0,2,0,0,0,0|1,0,0]=3 8045 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)F 1626a_200009816006_100015343762 [0,2,0,0,0,0|1,0,0]=3 8046 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)F 22a_200009816006_100000070787 [0,2,0,0,0,0|1,0,0]=3 8047 B14R1.12535 COc1c(cc(cc1Br)NC(=O)C)F 527a_200009816006_100103153847 [0,2,0,0,0,0|1,0,0]=3 8048 B14R1.12535 COc1c(cc(cc1C)C=C(C)C)C 271570a_100102525489_100000211903 [0,2,0,0,0,0|1,0,1]=4 8049 B14R1.12535 COc1c(cc(cc1C)CC(=O)C)C 34a_200000080086_200000210301 [0,2,0,0,0,0|0,0,0]=2 8050 B14R1.12535 COc1c(cc(cc1C)CC(=O)C)C 7a_200000080086_200000210301 [0,2,0,0,0,0|0,0,0]=2 8051 B14R1.12535 COc1c(cc(cc1C)CN(C)C)C 2230a_106454645570_200000210301 [0,2,0,0,0,0|2,0,0]=4 8052 B14R1.12535 COc1c(cc(cc1C)CN(C)C)C 269982a_106454645570_200000210301 [0,2,0,0,0,0|2,0,0]=4 8053 B14R1.12535 COc1c(cc(cc1C)CN(C)C)C 270004a_100102631434_100000744411 [0,2,0,0,0,0|2,0,0]=4 8054 B14R1.12535 COc1c(cc(cc1C)CN(C)C)C 34a_106454645570_200000210301 [0,2,0,0,0,0|2,0,0]=4 8055 B14R1.12535 COc1c(cc(cc1C)CN(C)[13CH3])C 2230a_106454645570_200025704644 [0,2,0,0,0,0|2,0,0]=4 8056 B14R1.12535 COc1c(cc(cc1C)CN(C)[13CH3])C 269982a_106454645570_200025704644 [0,2,0,0,0,0|2,0,0]=4 8057 B14R1.12535 COc1c(cc(cc1C)CN(C)[13CH3])C 34a_106454645570_200025704644 [0,2,0,0,0,0|2,0,0]=4 8058 B14R1.12535 COc1c(cc(cc1C)NC(=O)C)C 11a_100000187574_100015343762 [0,2,0,0,0,0|1,0,0]=3 8059 B14R1.12535 COc1c(cc(cc1C)NC(=O)C)C 1626a_100000187574_100015343762 [0,2,0,0,0,0|1,0,0]=3 8060 B14R1.12535 COc1c(cc(cc1C)NC(=O)C)C 22a_100000187574_100000070787 [0,2,0,0,0,0|1,0,0]=3 8061 B14R1.12535 COc1c(cc(cc1C)NC(=O)C)C 527a_100000187574_100103153847 [0,2,0,0,0,0|1,0,0]=3 8062 B14R1.12535 COc1c(cc(cc1Cl)C=C(C)C)Cl 271570a_100102525489_200010110313 [0,2,0,0,0,0|1,0,1]=4 8063 B14R1.12535 COc1c(cc(cc1Cl)CC(=O)C)F 1458a_100000070787_100009815999 [0,2,0,0,0,0|0,0,0]=2 8064 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)Cl 270004a_100102631434_200000015791 [0,2,0,0,0,0|2,0,0]=4 8065 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)F 2230a_100102631434_100009815999 [0,2,0,0,0,0|2,0,0]=4 8066 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)F 269982a_100102631434_100009815999 [0,2,0,0,0,0|2,0,0]=4 8067 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)F 270004a_100102631434_100000050411 [0,2,0,0,0,0|2,0,0]=4 8068 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)O 270004a_100102631434_200010620221 [0,2,0,0,0,0|2,0,0]=4 8069 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)Cl 11a_100000749172_100015343762 [0,2,0,0,0,0|1,0,0]=3 8070 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)Cl 1626a_100000749172_100015343762 [0,2,0,0,0,0|1,0,0]=3 8071 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)Cl 22a_100000749172_100000070787 [0,2,0,0,0,0|1,0,0]=3 8072 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)Cl 527a_100000749172_100103153847 [0,2,0,0,0,0|1,0,0]=3 8073 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)F 11a_200000094053_100015343762 [0,2,0,0,0,0|1,0,0]=3 8074 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)F 1626a_200000094053_100015343762 [0,2,0,0,0,0|1,0,0]=3 8075 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)F 22a_200000094053_100000070787 [0,2,0,0,0,0|1,0,0]=3 8076 B14R1.12535 COc1c(cc(cc1Cl)NC(=O)C)F 527a_200000094053_100103153847 [0,2,0,0,0,0|1,0,0]=3 8077 B14R1.12535 COc1c(cc(cc1F)C=C(C)C)F 271570a_100102525489_100009813559 [0,2,0,0,0,0|1,0,1]=4 8078 B14R1.12535 COc1c(cc(cc1F)C=C(C)C)N 271570a_100102525489_200010245146 [0,2,0,0,0,0|1,0,1]=4 8079 B14R1.12535 COc1c(cc(cc1F)CC(=O)C)F 1458a_100000062059_200000210301 [0,2,0,0,0,0|0,0,0]=2 8080 B14R1.12535 COc1c(cc(cc1F)CC(=O)C)F 1458a_100000070787_100011830405 [0,2,0,0,0,0|0,0,0]=2 8081 B14R1.12535 COc1c(cc(cc1F)CC(=O)[13CH3])F 1458a_100000062059_200025704644 [0,2,0,0,0,0|0,0,0]=2 8082 B14R1.12535 COc1c(cc(cc1F)CN(C)C)F 2230a_100102631434_100011830405 [0,2,0,0,0,0|2,0,0]=4 8083 B14R1.12535 COc1c(cc(cc1F)CN(C)C)F 269982a_100102631434_100011830405 [0,2,0,0,0,0|2,0,0]=4 8084 B14R1.12535 COc1c(cc(cc1F)CN(C)C)F 270004a_100102631434_100011830402 [0,2,0,0,0,0|2,0,0]=4 8085 B14R1.12535 COc1c(cc(cc1F)NC(=O)C)F 11a_100000742718_100015343762 [0,2,0,0,0,0|1,0,0]=3 8086 B14R1.12535 COc1c(cc(cc1F)NC(=O)C)F 1626a_100000742718_100015343762 [0,2,0,0,0,0|1,0,0]=3 8087 B14R1.12535 COc1c(cc(cc1F)NC(=O)C)F 22a_100000742718_100000070787 [0,2,0,0,0,0|1,0,0]=3 8088 B14R1.12535 COc1c(cc(cc1F)NC(=O)C)F 527a_100000742718_100103153847 [0,2,0,0,0,0|1,0,0]=3 8089 B14R1.12535 CSc1c(cc(cc1C)NC(=O)C)C 62a_200000210301_200012340666 [0,2,0,0,0,0|1,1,0]=4 8090 B14R1.12535 CSc1c(cc(cc1Cl)NC(=O)C)Cl 62a_200000210301_106256037338 [0,2,0,0,0,0|1,1,0]=4 8091 B14R1.12535 CSc1c(cc(cc1F)NC(=O)C)F 62a_200000210301_200009813856 [0,2,0,0,0,0|1,1,0]=4 8092 B14R1.12535 CSc1c(cc(cc1F)NC(=O)C)F 62a_200009813856_200000210301 [0,2,0,0,0,0|1,1,0]=4 8093 B14R1.8 CCC(C(=O)C)c1ccc(cc1)OC 1458a_200000687490_200000210301 [0,2,0,0,0,0|0,0,0]=2 8094 B14R1.8 CCC(C(=O)[13CH3])c1ccc(cc1)OC 1458a_200000687490_200025704644 [0,2,0,0,0,0|0,0,0]=2 8095 B14R1.8 CCC(c1ccc(cc1)OC)N(C)C 2230a_100000233341_200000210301 [0,2,0,0,0,0|2,0,0]=4 8096 B14R1.8 CCC(c1ccc(cc1)OC)N(C)C 269982a_100000233341_200000210301 [0,2,0,0,0,0|2,0,0]=4 8097 B14R1.8 CCC(c1ccc(cc1)OC)N(C)[13CH3] 2230a_100000233341_200025704644 [0,2,0,0,0,0|2,0,0]=4 8098 B14R1.8 CCC(c1ccc(cc1)OC)N(C)[13CH3] 269982a_100000233341_200025704644 [0,2,0,0,0,0|2,0,0]=4 8099 B14R1.8 CCc1ccc(cc1)C(NC)C(=O)O 269956a_200000761548_200000210301 [0,2,0,0,0,0|2,0,0]=4 8100 B14R1.8 CCc1ccc(cc1)C(N[13CH3])C(=O)O 269956a_200000761548_200025704644 [0,2,0,0,0,0|2,0,0]=4 8101 B14R1.8 CNC(C(=O)O)c1ccc(cc1)OC 269956a_100000181765_200000210301 [0,2,0,0,0,0|1,0,0]=3 8102 B14R1.8 CNC(C(=O)O)c1ccc(cc1)SC 269956a_106359897980_200000210301 [0,2,0,0,0,0|1,1,0]=4 8103 B14R1.8 CNC(c1ccc(cc1)OC)C(C)C 2230a_100000205938_200000210301 [0,2,0,0,0,0|1,0,1]=4 8104 B14R1.8 CNC(c1ccc(cc1)OC)C(C)C 34a_100000205938_200000210301 [0,2,0,0,0,0|1,0,1]=4 8105 B14R1.8 COc1ccc(cc1)C(N[13CH3])C(=O)O 269956a_100000181765_200025704644 [0,2,0,0,0,0|1,0,0]=3 8106 B14R1.8 COc1ccc(cc1)C(N[13CH3])C(C)C 2230a_100000205938_200025704644 [0,2,0,0,0,0|1,0,1]=4 8107 B14R1.8 COc1ccc(cc1)C(N[13CH3])C(C)C 34a_100000205938_200025704644 [0,2,0,0,0,0|1,0,1]=4 8108 B14R1.8 COc1ccc(cc1)C(OC)C(C)C 34a_200011350851_200000210301 [0,2,0,0,0,0|1,0,1]=4 8109 B14R1.8 COc1ccc(cc1)C(OC)C(C)C 7a_200011350851_200000210301 [0,2,0,0,0,0|1,0,1]=4 8110 B14R1.8 COc1ccc(cc1)C(O[13CH3])C(C)C 34a_200011350851_200025704644 [0,2,0,0,0,0|1,0,1]=4 8111 B14R1.8 COc1ccc(cc1)C(O[13CH3])C(C)C 7a_200011350851_200025704644 [0,2,0,0,0,0|1,0,1]=4 8112 B14R1.8 CSc1ccc(cc1)C(N[13CH3])C(=O)O 269956a_106359897980_200025704644 [0,2,0,0,0,0|1,1,0]=4 8113 B14R1.102 COc1ccc(c(c1)Br)C(=C(C)C)C 271570a_200000049429_100012349170 [0,2,0,0,0,0|1,0,1]=4 8114 B14R1.102 COc1ccc(c(c1)C)C(=C(C)C)C 271570a_200000049429_100000759875 [0,2,0,0,0,0|1,0,1]=4 8115 B14R1.102 COc1ccc(c(c1)C)N(C)C(=O)C 11a_103496583619_100015343762 [0,2,0,0,0,0|1,0,0]=3 8116 B14R1.102 COc1ccc(c(c1)C)N(C)C(=O)C 1626a_103496583619_100015343762 [0,2,0,0,0,0|1,0,0]=3 8117 B14R1.102 COc1ccc(c(c1)C)N(C)C(=O)C 22a_103496583619_100000070787 [0,2,0,0,0,0|1,0,0]=3 8118 B14R1.102 COc1ccc(c(c1)C)N(C)C(=O)C 527a_103496583619_100103153847 [0,2,0,0,0,0|1,0,0]=3 8119 B14R1.102 COc1ccc(c(c1)F)C(=C(C)C)C 271570a_200000049429_100000753793 [0,2,0,0,0,0|1,0,1]=4 8120 B14R1.102 COc1ccc(c(c1)N)C(=C(C)C)C 271570a_200000049429_100000748021 [0,2,0,0,0,0|1,0,1]=4 8121 B14R1.102 COc1ccc(c(c1)O)C(=C(C)C)C 271570a_200000049429_100000719091 [0,2,0,0,0,0|1,0,1]=4 8122 B14R1.141 CC(=O)N(C)c1ccc(cc1)NCF 34a_100000229935_100015361967 [0,2,0,0,0,0|2,0,0]=4 8123 B14R1.141 CC(=O)N(C)c1ccc(cc1)OCF 34a_100000743460_100015361967 [0,2,0,0,0,0|1,0,0]=3 8124 B14R1.141 CC(=O)N(C)c1ccc(cc1)SCF 62a_200009816415_100015361967 [0,2,0,0,0,0|1,1,0]=4 8125 B14R1.141 CC=Cc1ccc(cc1)N(C)C(=O)C 271570a_100016259895_200009816415 [0,2,0,0,0,0|2,0,0]=4 8126 B14R1.141 CCNc1ccc(cc1)N(C)C(=O)C 34a_100000229935_100000210202 [0,2,0,0,0,0|2,0,0]=4 8127 B14R1.141 CCOc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100000169946 [0,2,0,0,0,0|1,0,1]=4 8128 B14R1.141 CCOc1ccc(cc1)C(C)N(C)C 2230a_100015187113_200000210301 [0,2,0,0,0,0|2,0,0]=4 8129 B14R1.141 CCOc1ccc(cc1)C(C)N(C)C 269982a_100015187113_200000210301 [0,2,0,0,0,0|2,0,0]=4 8130 B14R1.141 CCOc1ccc(cc1)C(C)N(C)[13CH3] 2230a_100015187113_200025704644 [0,2,0,0,0,0|2,0,0]=4 8131 B14R1.141 CCOc1ccc(cc1)C(C)N(C)[13CH3] 269982a_100015187113_200025704644 [0,2,0,0,0,0|2,0,0]=4 8132 B14R1.141 CCOc1ccc(cc1)N(C)C(=O)C 11a_100025784348_100015343762 [0,2,0,0,0,0|1,0,0]=3 8133 B14R1.141 CCOc1ccc(cc1)N(C)C(=O)C 1626a_100025784348_100015343762 [0,2,0,0,0,0|1,0,0]=3 8134 B14R1.141 CCOc1ccc(cc1)N(C)C(=O)C 22a_100025784348_100000070787 [0,2,0,0,0,0|1,0,0]=3 8135 B14R1.141 CCOc1ccc(cc1)N(C)C(=O)C 34a_100000743460_100000210202 [0,2,0,0,0,0|1,0,0]=3 8136 B14R1.141 CCOc1ccc(cc1)N(C)C(=O)C 527a_100025784348_100103153847 [0,2,0,0,0,0|1,0,0]=3 8137 B14R1.141 CCSc1ccc(cc1)N(C)C(=O)C 62a_200009816415_100000210202 [0,2,0,0,0,0|1,1,0]=4 8138 B14R1.141 COCc1ccc(cc1)C(=C(C)C)C 271570a_200000049429_100011493685 [0,2,0,0,0,0|1,0,1]=4 8139 B14R1.213 CC(=O)C(C)(C)c1ccc(cc1)C#N 1458a_100009891144_200000210301 [0,2,0,0,0,0|2,0,0]=4 8140 B14R1.213 CC(C)(C(=O)[13CH3])c1ccc(cc1)C#N 1458a_100009891144_200025704644 [0,2,0,0,0,0|2,0,0]=4 8141 B14R1.213 CCc1ccc(cc1)C(C)(C)C(=O)C 1458a_100000685079_200000210301 [0,2,0,0,0,0|1,0,0]=3 8142 B14R1.213 CCc1ccc(cc1)C(C)(C)C(=O)[13CH3] 1458a_100000685079_200025704644 [0,2,0,0,0,0|1,0,0]=3 8143 B14R1.213 COc1ccc(cc1)C(C)(C)C(=O)C 1458a_100000689946_200000210301 [0,2,0,0,0,0|0,0,0]=2 8144 B14R1.213 COc1ccc(cc1)C(C)(C)C(=O)[13CH3] 1458a_100000689946_200025704644 [0,2,0,0,0,0|0,0,0]=2 8145 B14R1.213 COc1ccc(cc1)C(C)(O)C(=O)C 1458a_200011434898_200000210301 [0,2,0,0,0,0|0,0,0]=2 8146 B14R1.213 COc1ccc(cc1)C(C)(O)C(=O)[13CH3] 1458a_200011434898_200025704644 [0,2,0,0,0,0|0,0,0]=2 8147 B14R1.6402 C=C(C)c1ccc(cc1)N(C)C(=O)C 271570a_100000694244_200009816415 [0,2,0,0,0,0|2,0,0]=4 8148 B14R1.6402 CC(=O)C(C)c1ccc(cc1)C(=O)N 1458a_200011092970_200000210301 [0,2,0,0,0,0|2,0,0]=4 8149 B14R1.6402 CC(=O)C(C)c1ccc(cc1)C(C)C 1458a_100000070787_200000700246 [0,2,0,0,0,0|1,0,0]=3 8150 B14R1.6402 CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100000070787_100000684656 [0,2,0,0,0,0|2,0,0]=4 8151 B14R1.6402 CC(=O)C(C)c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_200000210301 [0,2,0,0,0,0|2,0,0]=4 8152 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 11a_100000688768_100015343762 [0,2,0,0,0,0|2,0,0]=4 8153 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 1626a_100000688768_100015343762 [0,2,0,0,0,0|2,0,0]=4 8154 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 22a_100000688768_100000070787 [0,2,0,0,0,0|2,0,0]=4 8155 B14R1.6402 CC(=O)N(C)c1ccc(cc1)C(C)C 527a_100000688768_100103153847 [0,2,0,0,0,0|2,0,0]=4 8156 B14R1.6402 CC(C(=O)[13CH3])c1ccc(cc1)C(=O)N 1458a_200011092970_200025704644 [0,2,0,0,0,0|2,0,0]=4 8157 B14R1.6402 CC(C(=O)[13CH3])c1ccc(cc1)[N+](=O)[O-] 1458a_100011215393_200025704644 [0,2,0,0,0,0|2,0,0]=4 8158 B14R1.68 C#CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000038162 [0,2,0,0,0,0|2,0,0]=4 8159 B14R1.68 C#CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000184674 [0,2,0,0,0,0|2,0,0]=4 8160 B14R1.68 C#CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000184674 [0,2,0,0,0,0|2,0,0]=4 8161 B14R1.68 C#CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000184674 [0,2,0,0,0,0|0,0,0]=2 8162 B14R1.68 C#CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000038162 [0,2,0,0,0,0|0,0,0]=2 8163 B14R1.68 C#CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000184674 [0,2,0,0,0,0|1,0,0]=3 8164 B14R1.68 C#CCOc1ccc(cc1)CC(C)N 34a_100102634573_100000184674 [0,2,0,0,0,0|1,0,1]=4 8165 B14R1.68 C#CCOc1ccc(cc1)CN(C)C 270004a_100102631434_100000172624 [0,2,0,0,0,0|2,0,0]=4 8166 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 11a_100000753246_100015343762 [0,2,0,0,0,0|1,0,0]=3 8167 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 1626a_100000753246_100015343762 [0,2,0,0,0,0|1,0,0]=3 8168 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 22a_100000753246_100000070787 [0,2,0,0,0,0|1,0,0]=3 8169 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000184674 [0,2,0,0,0,0|1,0,0]=3 8170 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 527a_100000753246_100103153847 [0,2,0,0,0,0|1,0,0]=3 8171 B14R1.68 C#CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000038162 [0,2,0,0,0,0|1,0,0]=3 8172 B14R1.68 C#CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000184674 [0,2,0,0,0,0|2,0,0]=4 8173 B14R1.68 C#CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000038162 [0,2,0,0,0,0|2,0,0]=4 8174 B14R1.68 C#CCSc1ccc(cc1)CC(=O)C 62a_100000038162_100000691760 [0,2,0,0,0,0|0,1,0]=3 8175 B14R1.68 C#CCSc1ccc(cc1)CC(=O)N 62a_100000038162_100000162331 [0,2,0,0,0,0|1,1,0]=4 8176 B14R1.68 C#CCSc1ccc(cc1)NC(=O)C 62a_100000038162_100000155215 [0,2,0,0,0,0|1,1,0]=4 8177 B14R1.68 C#CCSc1ccc(cc1)OC(=O)C 62a_100000038162_100000002173 [0,2,0,0,0,0|1,1,0]=4 8178 B14R1.68 C=CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000210623 [0,2,0,0,0,0|2,0,0]=4 8179 B14R1.68 C=CCNc1ccc(cc1)CC(=O)N 34a_100000738315_100015514636 [0,2,0,0,0,0|2,0,0]=4 8180 B14R1.68 C=CCNc1ccc(cc1)NC(=O)C 34a_100000184111_100015514636 [0,2,0,0,0,0|2,0,0]=4 8181 B14R1.68 C=CCOc1ccc(cc1)C=C(C)C 271570a_100102525489_100000172055 [0,2,0,0,0,0|1,0,1]=4 8182 B14R1.68 C=CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100015514636 [0,2,0,0,0,0|0,0,0]=2 8183 B14R1.68 C=CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100015514636 [0,2,0,0,0,0|0,0,0]=2 8184 B14R1.68 C=CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100015514636 [0,2,0,0,0,0|1,0,0]=3 8185 B14R1.68 C=CCOc1ccc(cc1)CC(C)N 34a_100102634573_100015514636 [0,2,0,0,0,0|1,0,1]=4 8186 B14R1.68 C=CCOc1ccc(cc1)CN(C)C 2230a_114901603746_200000210301 [0,2,0,0,0,0|2,0,0]=4 8187 B14R1.68 C=CCOc1ccc(cc1)CN(C)C 269982a_114901603746_200000210301 [0,2,0,0,0,0|2,0,0]=4 8188 B14R1.68 C=CCOc1ccc(cc1)CN(C)C 270004a_100102631434_100000172049 [0,2,0,0,0,0|2,0,0]=4 8189 B14R1.68 C=CCOc1ccc(cc1)CN(C)[13CH3] 2230a_114901603746_200025704644 [0,2,0,0,0,0|2,0,0]=4 8190 B14R1.68 C=CCOc1ccc(cc1)CN(C)[13CH3] 269982a_114901603746_200025704644 [0,2,0,0,0,0|2,0,0]=4 8191 B14R1.68 C=CCOc1ccc(cc1)NC(=O)C 34a_100000184395_100015514636 [0,2,0,0,0,0|1,0,0]=3 8192 B14R1.68 C=CCOc1ccc(cc1)NC(=O)C 7a_100000184395_100015514636 [0,2,0,0,0,0|1,0,0]=3 8193 B14R1.68 C=CCOc1ccc(nc1)NC(=O)C 34a_200000094647_100015514636 [0,2,0,0,0,0|2,0,0]=4 8194 B14R1.68 C=CCOc1ccc(nc1)NC(=O)C 7a_200000094647_100015514636 [0,2,0,0,0,0|2,0,0]=4 8195 B14R1.68 C=CCSc1ccc(cc1)CC(=O)C 62a_100000210623_100000691760 [0,2,0,0,0,0|0,1,0]=3 8196 B14R1.68 C=CCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210623 [0,2,0,0,0,0|0,1,0]=3 8197 B14R1.68 C=CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000210623 [0,2,0,0,0,0|1,1,0]=4 8198 B14R1.68 C=CCSc1ccc(cc1)CC(=O)N 62a_100000210623_100000162331 [0,2,0,0,0,0|1,1,0]=4 8199 B14R1.68 C=CCSc1ccc(cc1)NC(=O)C 62a_100000210623_100000155215 [0,2,0,0,0,0|1,1,0]=4 8200 B14R1.68 C=CCSc1ccc(cc1)OC(=O)C 62a_100000210623_100000002173 [0,2,0,0,0,0|1,1,0]=4 8201 B14R1.68 C=CCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210623 [0,2,0,0,0,0|1,1,0]=4 8202 B14R1.68 CC(=Cc1ccc(cc1)OCC#N)C 271570a_100102525489_200000169425 [0,2,0,0,0,0|1,0,1]=4 8203 B14R1.68 CC(=Cc1ccc(cc1)OCCF)C 271570a_100102525489_100012347556 [0,2,0,0,0,0|1,0,1]=4 8204 B14R1.68 CC(=Cc1ccc(cc1)OCCN)C 271570a_100102525489_100000746992 [0,2,0,0,0,0|1,0,1]=4 8205 B14R1.68 CC(=Cc1ccc(cc1)OCCO)C 271570a_100102525489_100000686261 [0,2,0,0,0,0|1,0,1]=4 8206 B14R1.68 CC(=O)Cc1ccc(cc1)OCC#N 7a_100011218180_100011215382 [0,2,0,0,0,0|0,0,0]=2 8207 B14R1.68 CC(=O)Cc1ccc(cc1)OCC=O 34a_100011218180_200009817547 [0,2,0,0,0,0|0,0,0]=2 8208 B14R1.68 CC(=O)Cc1ccc(cc1)OCC=O 7a_100011218180_200015260668 [0,2,0,0,0,0|0,0,0]=2 8209 B14R1.68 CC(=O)Cc1ccc(cc1)OCCF 34a_100011218180_100011217306 [0,2,0,0,0,0|0,0,0]=2 8210 B14R1.68 CC(=O)Cc1ccc(cc1)OCCF 7a_100011218180_100011217306 [0,2,0,0,0,0|0,0,0]=2 8211 B14R1.68 CC(=O)Cc1ccc(cc1)OCCO 34a_100011218180_100000211926 [0,2,0,0,0,0|0,0,0]=2 8212 B14R1.68 CC(=O)Cc1ccc(cc1)OCCO 7a_100011218180_100000211926 [0,2,0,0,0,0|0,0,0]=2 8213 B14R1.68 CC(=O)Cc1ccc(cc1)SCC#N 62a_100000691760_100011215382 [0,2,0,0,0,0|0,1,0]=3 8214 B14R1.68 CC(=O)Cc1ccc(cc1)SCC#N 62a_100011215382_100000691760 [0,2,0,0,0,0|0,1,0]=3 8215 B14R1.68 CC(=O)Cc1ccc(cc1)SCC=O 62a_100000691760_200015260668 [0,2,0,0,0,0|0,1,0]=3 8216 B14R1.68 CC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000691760 [0,2,0,0,0,0|0,1,0]=3 8217 B14R1.68 CC(=O)Cc1ccc(cc1)SCCF 62a_100000691760_100011217306 [0,2,0,0,0,0|0,1,0]=3 8218 B14R1.68 CC(=O)Cc1ccc(cc1)SCCF 62a_100011217306_100000691760 [0,2,0,0,0,0|0,1,0]=3 8219 B14R1.68 CC(=O)Cc1ccc(cc1)SCCO 62a_100000211926_100000691760 [0,2,0,0,0,0|0,1,0]=3 8220 B14R1.68 CC(=O)Cc1ccc(cc1)SCCO 62a_100000691760_100000211926 [0,2,0,0,0,0|0,1,0]=3 8221 B14R1.68 CC(=O)Nc1ccc(cc1)CCO[13CH3] 34a_100000752260_200025704644 [0,2,0,0,0,0|1,0,0]=3 8222 B14R1.68 CC(=O)Nc1ccc(cc1)CCO[13CH3] 7a_100000752260_200025704644 [0,2,0,0,0,0|1,0,0]=3 8223 B14R1.68 CC(=O)Nc1ccc(cc1)CNCF 34a_100000735448_100015361967 [0,2,0,0,0,0|2,0,0]=4 8224 B14R1.68 CC(=O)Nc1ccc(cc1)COCF 34a_100000246270_100015361967 [0,2,0,0,0,0|1,0,0]=3 8225 B14R1.68 CC(=O)Nc1ccc(cc1)COCF 7a_100000246270_100015361967 [0,2,0,0,0,0|1,0,0]=3 8226 B14R1.68 CC(=O)Nc1ccc(cc1)CSCF 62a_100015361967_100000731167 [0,2,0,0,0,0|1,1,0]=4 8227 B14R1.68 CC(=O)Nc1ccc(cc1)NCC=O 34a_100000184111_200009817547 [0,2,0,0,0,0|2,0,0]=4 8228 B14R1.68 CC(=O)Nc1ccc(cc1)NCCF 34a_100000184111_100011217306 [0,2,0,0,0,0|2,0,0]=4 8229 B14R1.68 CC(=O)Nc1ccc(cc1)NCCO 34a_100000184111_100000211926 [0,2,0,0,0,0|2,0,0]=4 8230 B14R1.68 CC(=O)Nc1ccc(cc1)OCC#N 7a_100000184395_100011215382 [0,2,0,0,0,0|1,0,0]=3 8231 B14R1.68 CC(=O)Nc1ccc(cc1)OCC=O 34a_100000184395_200009817547 [0,2,0,0,0,0|1,0,0]=3 8232 B14R1.68 CC(=O)Nc1ccc(cc1)OCC=O 7a_100000184395_200015260668 [0,2,0,0,0,0|1,0,0]=3 8233 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 11a_100012282086_100015343762 [0,2,0,0,0,0|1,0,0]=3 8234 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 1626a_100012282086_100015343762 [0,2,0,0,0,0|1,0,0]=3 8235 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 22a_100012282086_100000070787 [0,2,0,0,0,0|1,0,0]=3 8236 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 34a_100000184395_100011217306 [0,2,0,0,0,0|1,0,0]=3 8237 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 527a_100012282086_100103153847 [0,2,0,0,0,0|1,0,0]=3 8238 B14R1.68 CC(=O)Nc1ccc(cc1)OCCF 7a_100000184395_100011217306 [0,2,0,0,0,0|1,0,0]=3 8239 B14R1.68 CC(=O)Nc1ccc(cc1)OCCO 22a_100000754363_100000070787 [0,2,0,0,0,0|1,0,0]=3 8240 B14R1.68 CC(=O)Nc1ccc(cc1)OCCO 34a_100000184395_100000211926 [0,2,0,0,0,0|1,0,0]=3 8241 B14R1.68 CC(=O)Nc1ccc(cc1)OCCO 527a_100000754363_100103153847 [0,2,0,0,0,0|1,0,0]=3 8242 B14R1.68 CC(=O)Nc1ccc(cc1)OCCO 7a_100000184395_100000211926 [0,2,0,0,0,0|1,0,0]=3 8243 B14R1.68 CC(=O)Nc1ccc(cc1)SCC#N 62a_100011215382_100000155215 [0,2,0,0,0,0|1,1,0]=4 8244 B14R1.68 CC(=O)Nc1ccc(cc1)SCC=O 62a_200015260668_100000155215 [0,2,0,0,0,0|1,1,0]=4 8245 B14R1.68 CC(=O)Nc1ccc(cc1)SCCF 62a_100011217306_100000155215 [0,2,0,0,0,0|1,1,0]=4 8246 B14R1.68 CC(=O)Nc1ccc(cc1)SCCO 62a_100000211926_100000155215 [0,2,0,0,0,0|1,1,0]=4 8247 B14R1.68 CC(=O)Nc1ccc(cn1)OCC#N 7a_200000094647_100011215382 [0,2,0,0,0,0|2,0,0]=4 8248 B14R1.68 CC(=O)Nc1ccc(cn1)OCC=O 34a_200000094647_200009817547 [0,2,0,0,0,0|2,0,0]=4 8249 B14R1.68 CC(=O)Nc1ccc(cn1)OCC=O 7a_200000094647_200015260668 [0,2,0,0,0,0|2,0,0]=4 8250 B14R1.68 CC(=O)Nc1ccc(cn1)OCCF 34a_200000094647_100011217306 [0,2,0,0,0,0|2,0,0]=4 8251 B14R1.68 CC(=O)Nc1ccc(cn1)OCCF 7a_200000094647_100011217306 [0,2,0,0,0,0|2,0,0]=4 8252 B14R1.68 CC(=O)Nc1ccc(cn1)OCCO 34a_200000094647_100000211926 [0,2,0,0,0,0|2,0,0]=4 8253 B14R1.68 CC(=O)Nc1ccc(cn1)OCCO 7a_200000094647_100000211926 [0,2,0,0,0,0|2,0,0]=4 8254 B14R1.68 CC(=O)Oc1ccc(cc1)CSCF 62a_100015361967_100000033664 [0,2,0,0,0,0|1,1,0]=4 8255 B14R1.68 CC(=O)Oc1ccc(cc1)SCC#N 62a_100011215382_100000002173 [0,2,0,0,0,0|1,1,0]=4 8256 B14R1.68 CC(=O)Oc1ccc(cc1)SCC=O 62a_200015260668_100000002173 [0,2,0,0,0,0|1,1,0]=4 8257 B14R1.68 CC(=O)Oc1ccc(cc1)SCCF 62a_100011217306_100000002173 [0,2,0,0,0,0|1,1,0]=4 8258 B14R1.68 CC(=O)Oc1ccc(cc1)SCCO 62a_100000211926_100000002173 [0,2,0,0,0,0|1,1,0]=4 8259 B14R1.68 CC(=O)Sc1ccc(cc1)SCC#N 62a_200009995050_100011215382 [0,2,0,0,0,0|1,1,0]=4 8260 B14R1.68 CC(=O)Sc1ccc(cc1)SCC=O 62a_200009995050_200015260668 [0,2,0,0,0,0|1,1,0]=4 8261 B14R1.68 CC(=O)Sc1ccc(cc1)SCCF 62a_200009995050_100011217306 [0,2,0,0,0,0|1,1,0]=4 8262 B14R1.68 CC(=O)Sc1ccc(cc1)SCCO 62a_200009995050_100000211926 [0,2,0,0,0,0|1,1,0]=4 8263 B14R1.68 CC(C)Cc1ccc(cc1)COCF 34a_200011266444_100015361967 [0,2,0,0,0,0|1,0,1]=4 8264 B14R1.68 CC(C)Cc1ccc(cc1)COCF 7a_200011266444_100015361967 [0,2,0,0,0,0|1,0,1]=4 8265 B14R1.68 CC(N)Cc1ccc(cc1)OCC=O 34a_100102634573_200009817547 [0,2,0,0,0,0|1,0,1]=4 8266 B14R1.68 CC(N)Cc1ccc(cc1)OCCF 34a_100102634573_100011217306 [0,2,0,0,0,0|1,0,1]=4 8267 B14R1.68 CC(N)Cc1ccc(cc1)OCCO 34a_100102634573_100000211926 [0,2,0,0,0,0|1,0,1]=4 8268 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 1458a_100000070787_100011934885 [0,2,0,0,0,0|1,0,0]=3 8269 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 1458a_100000185461_200000210301 [0,2,0,0,0,0|1,0,0]=3 8270 B14R1.68 CCCCc1ccc(cc1)CC(=O)C 271570a_100020621405_100000691760 [0,2,0,0,0,0|1,0,0]=3 8271 B14R1.68 CCCCc1ccc(cc1)CC(=O)N 271570a_100020621405_100000162331 [0,2,0,0,0,0|2,0,0]=4 8272 B14R1.68 CCCCc1ccc(cc1)CC(=O)[13CH3] 1458a_100000185461_200025704644 [0,2,0,0,0,0|1,0,0]=3 8273 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 11a_100000210628_100015343762 [0,2,0,0,0,0|2,0,0]=4 8274 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 1626a_100000210628_100015343762 [0,2,0,0,0,0|2,0,0]=4 8275 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 22a_100000210628_100000070787 [0,2,0,0,0,0|2,0,0]=4 8276 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 271570a_100020621405_100000155215 [0,2,0,0,0,0|2,0,0]=4 8277 B14R1.68 CCCCc1ccc(cc1)NC(=O)C 527a_100000210628_100103153847 [0,2,0,0,0,0|2,0,0]=4 8278 B14R1.68 CCCCc1ccc(cc1)OC(=O)C 271570a_100020621405_100000002173 [0,2,0,0,0,0|2,0,0]=4 8279 B14R1.68 CCCCc1ccc(cc1)SC(=O)C 271570a_100020621405_200009995050 [0,2,0,0,0,0|2,0,0]=4 8280 B14R1.68 CCCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000210303 [0,2,0,0,0,0|2,0,0]=4 8281 B14R1.68 CCCNc1ccc(cc1)CC(=O)N 34a_100000738315_100000210303 [0,2,0,0,0,0|2,0,0]=4 8282 B14R1.68 CCCNc1ccc(cc1)NC(=O)C 34a_100000184111_100000210303 [0,2,0,0,0,0|2,0,0]=4 8283 B14R1.68 CCCOc1ccc(cc1)C=C(C)C 271570a_100102525489_100000169948 [0,2,0,0,0,0|1,0,1]=4 8284 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 1458a_100000070787_100000691472 [0,2,0,0,0,0|0,0,0]=2 8285 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 1458a_200000230827_200000210301 [0,2,0,0,0,0|0,0,0]=2 8286 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210303 [0,2,0,0,0,0|0,0,0]=2 8287 B14R1.68 CCCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210303 [0,2,0,0,0,0|0,0,0]=2 8288 B14R1.68 CCCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000210303 [0,2,0,0,0,0|1,0,0]=3 8289 B14R1.68 CCCOc1ccc(cc1)CC(=O)[13CH3] 1458a_200000230827_200025704644 [0,2,0,0,0,0|0,0,0]=2 8290 B14R1.68 CCCOc1ccc(cc1)CC(C)N 34a_100102634573_100000210303 [0,2,0,0,0,0|1,0,1]=4 8291 B14R1.68 CCCOc1ccc(cc1)CN(C)C 2230a_100102631434_100000691472 [0,2,0,0,0,0|2,0,0]=4 8292 B14R1.68 CCCOc1ccc(cc1)CN(C)C 269982a_100102631434_100000691472 [0,2,0,0,0,0|2,0,0]=4 8293 B14R1.68 CCCOc1ccc(cc1)CN(C)C 270004a_100102631434_100000169838 [0,2,0,0,0,0|2,0,0]=4 8294 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 11a_100000748631_100015343762 [0,2,0,0,0,0|1,0,0]=3 8295 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 1626a_100000748631_100015343762 [0,2,0,0,0,0|1,0,0]=3 8296 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 22a_100000748631_100000070787 [0,2,0,0,0,0|1,0,0]=3 8297 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 34a_100000184395_100000210303 [0,2,0,0,0,0|1,0,0]=3 8298 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 527a_100000748631_100103153847 [0,2,0,0,0,0|1,0,0]=3 8299 B14R1.68 CCCOc1ccc(cc1)NC(=O)C 7a_100000184395_100000210303 [0,2,0,0,0,0|1,0,0]=3 8300 B14R1.68 CCCOc1ccc(nc1)NC(=O)C 34a_200000094647_100000210303 [0,2,0,0,0,0|2,0,0]=4 8301 B14R1.68 CCCOc1ccc(nc1)NC(=O)C 7a_200000094647_100000210303 [0,2,0,0,0,0|2,0,0]=4 8302 B14R1.68 CCCSc1ccc(cc1)CC(=O)C 62a_100000210303_100000691760 [0,2,0,0,0,0|0,1,0]=3 8303 B14R1.68 CCCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000210303 [0,2,0,0,0,0|0,1,0]=3 8304 B14R1.68 CCCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000210303 [0,2,0,0,0,0|1,1,0]=4 8305 B14R1.68 CCCSc1ccc(cc1)CC(=O)N 62a_100000210303_100000162331 [0,2,0,0,0,0|1,1,0]=4 8306 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 11a_100015183887_100015343762 [0,2,0,0,0,0|1,1,0]=4 8307 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 22a_100015183887_100000070787 [0,2,0,0,0,0|1,1,0]=4 8308 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 527a_100015183887_100103153847 [0,2,0,0,0,0|1,1,0]=4 8309 B14R1.68 CCCSc1ccc(cc1)NC(=O)C 62a_100000210303_100000155215 [0,2,0,0,0,0|1,1,0]=4 8310 B14R1.68 CCCSc1ccc(cc1)OC(=O)C 62a_100000210303_100000002173 [0,2,0,0,0,0|1,1,0]=4 8311 B14R1.68 CCCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000210303 [0,2,0,0,0,0|1,1,0]=4 8312 B14R1.68 CCNCc1ccc(cc1)CC(=O)O 269956a_100016989728_100000210202 [0,2,0,0,0,0|2,0,0]=4 8313 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 207a_100015525214_100000210072 [0,2,0,0,0,0|2,0,0]=4 8314 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 2230a_100015525214_100000731167 [0,2,0,0,0,0|2,0,0]=4 8315 B14R1.68 CCNCc1ccc(cc1)NC(=O)C 34a_100000735448_100000210202 [0,2,0,0,0,0|2,0,0]=4 8316 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 207a_100015525214_100000014718 [0,2,0,0,0,0|2,0,0]=4 8317 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 2230a_100015525214_100000033664 [0,2,0,0,0,0|2,0,0]=4 8318 B14R1.68 CCNCc1ccc(cc1)OC(=O)C 270004a_100015525214_100000014718 [0,2,0,0,0,0|2,0,0]=4 8319 B14R1.68 CCOCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000758564 [0,2,0,0,0,0|1,0,1]=4 8320 B14R1.68 CCOCc1ccc(cc1)CC(C)C 34a_100121572206_100011982790 [0,2,0,0,0,0|1,0,1]=4 8321 B14R1.68 CCOCc1ccc(cc1)CC(C)C 34a_200011266444_100000210202 [0,2,0,0,0,0|1,0,1]=4 8322 B14R1.68 CCOCc1ccc(cc1)CC(C)C 7a_200011266444_100000210202 [0,2,0,0,0,0|1,0,1]=4 8323 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 34a_100000246270_100000210202 [0,2,0,0,0,0|1,0,0]=3 8324 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 34a_100121572206_100000731167 [0,2,0,0,0,0|1,0,0]=3 8325 B14R1.68 CCOCc1ccc(cc1)NC(=O)C 7a_100000246270_100000210202 [0,2,0,0,0,0|1,0,0]=3 8326 B14R1.68 CCSCc1ccc(cc1)NC(=O)C 62a_100000210202_100000731167 [0,2,0,0,0,0|1,1,0]=4 8327 B14R1.68 CCSCc1ccc(cc1)OC(=O)C 62a_100000210202_100000033664 [0,2,0,0,0,0|1,1,0]=4 8328 B14R1.68 CN(C)Cc1ccc(cc1)OCC#N 270004a_100102631434_100000169417 [0,2,0,0,0,0|2,0,0]=4 8329 B14R1.68 CN(C)Cc1ccc(cc1)OCCO 270004a_100102631434_100011219967 [0,2,0,0,0,0|2,0,0]=4 8330 B14R1.68 COC=Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100020630460 [0,2,0,0,0,0|1,0,1]=4 8331 B14R1.68 COCCc1ccc(cc1)C=C(C)C 271570a_100102525489_100000739703 [0,2,0,0,0,0|1,0,1]=4 8332 B14R1.68 COCCc1ccc(cc1)NC(=O)C 34a_100000752260_200000210301 [0,2,0,0,0,0|1,0,0]=3 8333 B14R1.68 COCCc1ccc(cc1)NC(=O)C 7a_100000752260_200000210301 [0,2,0,0,0,0|1,0,0]=3 8334 B14R1.68 COCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100000766300 [0,2,0,0,0,0|1,0,0]=3 8335 B14R1.68 COCNc1ccc(cc1)CC(C)C 2230a_100000687309_100000766300 [0,2,0,0,0,0|1,0,1]=4 8336 B14R1.68 COCOc1ccc(cc1)C=C(C)C 271570a_100102525489_100012265687 [0,2,0,0,0,0|1,0,1]=4 8337 B14R1.68 COCSc1ccc(cc1)CC(=O)C 62a_100000691760_100000766300 [0,2,0,0,0,0|0,0,0]=2 8338 B14R1.68 COCSc1ccc(cc1)CC(=O)C 62a_100000766300_100000691760 [0,2,0,0,0,0|0,0,0]=2 8339 B14R1.68 COCSc1ccc(cc1)CC(=O)N 62a_100000162331_100000766300 [0,2,0,0,0,0|1,0,0]=3 8340 B14R1.68 COCSc1ccc(cc1)CC(=O)N 62a_100000766300_100000162331 [0,2,0,0,0,0|1,0,0]=3 8341 B14R1.68 COCSc1ccc(cc1)CC(C)C 62a_100000766300_100011221366 [0,2,0,0,0,0|1,0,1]=4 8342 B14R1.68 COCSc1ccc(cc1)CC(C)C 62a_100011221366_100000766300 [0,2,0,0,0,0|1,0,1]=4 8343 B14R1.68 COCSc1ccc(cc1)CN(C)C 62a_100000174694_100000766300 [0,2,0,0,0,0|2,0,0]=4 8344 B14R1.68 COCSc1ccc(cc1)CN(C)C 62a_100000766300_100000174694 [0,2,0,0,0,0|2,0,0]=4 8345 B14R1.68 COCSc1ccc(cc1)NC(=O)C 62a_100000766300_100000155215 [0,2,0,0,0,0|1,0,0]=3 8346 B14R1.68 COCSc1ccc(cc1)NC(=O)N 62a_100000766300_100000198584 [0,2,0,0,0,0|2,0,0]=4 8347 B14R1.68 COCSc1ccc(cc1)OC(=O)C 62a_100000766300_100000002173 [0,2,0,0,0,0|1,0,0]=3 8348 B14R1.68 COCSc1ccc(cc1)OC(=S)C 62a_100000766300_200009816735 [0,2,0,0,0,0|1,1,0]=4 8349 B14R1.68 COCSc1ccc(cc1)SC(=O)C 62a_200009995050_100000766300 [0,2,0,0,0,0|1,0,0]=3 8350 B14R1.68 COCSc1ccc(cn1)CC(=O)N 62a_100000766300_200000071513 [0,2,0,0,0,0|2,0,0]=4 8351 B14R1.68 COCSc1ccc(cn1)CC(=O)N 62a_200000071513_100000766300 [0,2,0,0,0,0|2,0,0]=4 8352 B14R1.68 COCSc1ccc(cn1)NC(=O)C 62a_100000766300_100011934715 [0,2,0,0,0,0|2,0,0]=4 8353 B14R1.68 COCSc1ccc(nc1)CC(=O)N 62a_100000766300_200010888337 [0,2,0,0,0,0|2,0,0]=4 8354 B14R1.68 COCSc1ccc(nc1)CC(=O)N 62a_200010888337_100000766300 [0,2,0,0,0,0|2,0,0]=4 8355 B14R1.68 COCSc1ccc(nc1)NC(=O)C 62a_100000766300_100000193312 [0,2,0,0,0,0|2,0,0]=4 8356 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 11a_100000750819_100015343762 [0,2,0,0,0,0|1,1,0]=4 8357 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 1626a_100000750819_100015343762 [0,2,0,0,0,0|1,1,0]=4 8358 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 22a_100000750819_100000070787 [0,2,0,0,0,0|1,1,0]=4 8359 B14R1.68 CSCCc1ccc(cc1)NC(=O)C 527a_100000750819_100103153847 [0,2,0,0,0,0|1,1,0]=4 8360 B14R1.68 CSCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100011218213 [0,2,0,0,0,0|1,1,0]=4 8361 B14R1.68 CSCNc1ccc(cc1)CC(=O)N 34a_100000738315_100011218213 [0,2,0,0,0,0|1,1,0]=4 8362 B14R1.68 CSCNc1ccc(cc1)NC(=O)C 34a_100000184111_100011218213 [0,2,0,0,0,0|1,1,0]=4 8363 B14R1.68 CSCOc1ccc(cc1)CC(=O)C 34a_100011218180_100011218213 [0,2,0,0,0,0|0,0,0]=2 8364 B14R1.68 CSCOc1ccc(cc1)CC(=O)N 34a_100000020825_100011218213 [0,2,0,0,0,0|1,0,0]=3 8365 B14R1.68 CSCOc1ccc(cc1)CC(C)N 34a_100102634573_100011218213 [0,2,0,0,0,0|1,0,1]=4 8366 B14R1.68 CSCOc1ccc(cc1)NC(=O)C 34a_100000184395_100011218213 [0,2,0,0,0,0|1,0,0]=3 8367 B14R1.68 CSCOc1ccc(nc1)NC(=O)C 34a_200000094647_100011218213 [0,2,0,0,0,0|2,0,0]=4 8368 B14R1.68 CSCSc1ccc(cc1)CC(=O)C 62a_100000691760_100011218213 [0,2,0,0,0,0|0,1,0]=3 8369 B14R1.68 CSCSc1ccc(cc1)CC(=O)C 62a_100011218213_100000691760 [0,2,0,0,0,0|0,1,0]=3 8370 B14R1.68 CSCSc1ccc(cc1)CC(=O)N 62a_100000162331_100011218213 [0,2,0,0,0,0|1,1,0]=4 8371 B14R1.68 CSCSc1ccc(cc1)CC(=O)N 62a_100011218213_100000162331 [0,2,0,0,0,0|1,1,0]=4 8372 B14R1.68 CSCSc1ccc(cc1)NC(=O)C 62a_100011218213_100000155215 [0,2,0,0,0,0|1,1,0]=4 8373 B14R1.68 CSCSc1ccc(cc1)OC(=O)C 62a_100011218213_100000002173 [0,2,0,0,0,0|1,1,0]=4 8374 B14R1.68 CSCSc1ccc(cc1)SC(=O)C 62a_200009995050_100011218213 [0,2,0,0,0,0|1,1,0]=4 8375 B14R1.68 N#CCNc1ccc(cc1)CC(=O)N 2230a_100000738315_100011215382 [0,2,0,0,0,0|2,0,0]=4 8376 B14R1.68 N#CCSc1ccc(cc1)CC(=O)N 62a_100000162331_100011215382 [0,2,0,0,0,0|1,1,0]=4 8377 B14R1.68 N#CCSc1ccc(cc1)CC(=O)N 62a_100011215382_100000162331 [0,2,0,0,0,0|1,1,0]=4 8378 B14R1.68 NC(=O)Cc1ccc(cc1)NCC=O 2230a_100000738315_200015260668 [0,2,0,0,0,0|2,0,0]=4 8379 B14R1.68 NC(=O)Cc1ccc(cc1)NCC=O 34a_100000738315_200009817547 [0,2,0,0,0,0|2,0,0]=4 8380 B14R1.68 NC(=O)Cc1ccc(cc1)NCCF 2230a_100000738315_100011217306 [0,2,0,0,0,0|2,0,0]=4 8381 B14R1.68 NC(=O)Cc1ccc(cc1)NCCF 34a_100000738315_100011217306 [0,2,0,0,0,0|2,0,0]=4 8382 B14R1.68 NC(=O)Cc1ccc(cc1)NCCO 2230a_100000738315_100000211926 [0,2,0,0,0,0|2,0,0]=4 8383 B14R1.68 NC(=O)Cc1ccc(cc1)NCCO 34a_100000738315_100000211926 [0,2,0,0,0,0|2,0,0]=4 8384 B14R1.68 NC(=O)Cc1ccc(cc1)OCC=O 34a_100000020825_200009817547 [0,2,0,0,0,0|1,0,0]=3 8385 B14R1.68 NC(=O)Cc1ccc(cc1)OCCF 34a_100000020825_100011217306 [0,2,0,0,0,0|1,0,0]=3 8386 B14R1.68 NC(=O)Cc1ccc(cc1)OCCO 34a_100000020825_100000211926 [0,2,0,0,0,0|1,0,0]=3 8387 B14R1.68 NC(=O)Cc1ccc(cc1)SCC=O 62a_100000162331_200015260668 [0,2,0,0,0,0|1,1,0]=4 8388 B14R1.68 NC(=O)Cc1ccc(cc1)SCC=O 62a_200015260668_100000162331 [0,2,0,0,0,0|1,1,0]=4 8389 B14R1.68 NC(=O)Cc1ccc(cc1)SCCF 62a_100000162331_100011217306 [0,2,0,0,0,0|1,1,0]=4 8390 B14R1.68 NC(=O)Cc1ccc(cc1)SCCF 62a_100011217306_100000162331 [0,2,0,0,0,0|1,1,0]=4 8391 B14R1.68 NC(=O)Cc1ccc(cc1)SCCO 62a_100000162331_100000211926 [0,2,0,0,0,0|1,1,0]=4 8392 B14R1.68 NC(=O)Cc1ccc(cc1)SCCO 62a_100000211926_100000162331 [0,2,0,0,0,0|1,1,0]=4 8393 B14R1.68 O=C(O)Cc1ccc(cc1)CNCF 269956a_100016989728_100015361967 [0,2,0,0,0,0|2,0,0]=4 8394 B14R1.490 CC(=O)Cc1ccc(cc1Cl)OCF 34a_200000084595_100015361967 [0,2,0,0,0,0|0,0,0]=2 8395 B14R1.490 CC(=O)Cc1ccc(cc1Cl)OCF 7a_200000084595_100015361967 [0,2,0,0,0,0|0,0,0]=2 8396 B14R1.490 CC(=O)Nc1ccc(cc1C)NCF 34a_100000736504_100015361967 [0,2,0,0,0,0|2,0,0]=4 8397 B14R1.490 CC(=O)Nc1ccc(cc1C)NCF 7a_100000736504_100015361967 [0,2,0,0,0,0|2,0,0]=4 8398 B14R1.490 CC(=O)Nc1ccc(cc1C)SCF 62a_100015361967_100000152120 [0,2,0,0,0,0|1,1,0]=4 8399 B14R1.490 CC(=O)Nc1ccc(cc1Cl)NCF 34a_100000244014_100015361967 [0,2,0,0,0,0|2,0,0]=4 8400 B14R1.490 CC(=O)Nc1ccc(cc1Cl)NCF 7a_100000244014_100015361967 [0,2,0,0,0,0|2,0,0]=4 8401 B14R1.490 CC(=O)Nc1ccc(cc1Cl)SCF 62a_100015361967_100011273303 [0,2,0,0,0,0|1,1,0]=4 8402 B14R1.490 CC(=O)Nc1ccc(cc1F)SCF 62a_100015361967_100000155584 [0,2,0,0,0,0|1,1,0]=4 8403 B14R1.490 CC(=O)Oc1ccc(cc1F)SCF 62a_100009811628_100015361967 [0,2,0,0,0,0|1,1,0]=4 8404 B14R1.490 CC(=O)Oc1ccc(cc1F)SCF 62a_100015361967_100009811628 [0,2,0,0,0,0|1,1,0]=4 8405 B14R1.490 CC=Cc1ccc(c(c1)C)NC(=O)C 271570a_100016259895_100000152120 [0,2,0,0,0,0|2,0,0]=4 8406 B14R1.490 CC=Cc1ccc(c(c1)Cl)NC(=O)C 271570a_100016259895_100011273303 [0,2,0,0,0,0|2,0,0]=4 8407 B14R1.490 CC=Cc1ccc(c(c1)F)NC(=O)C 271570a_100016259895_100000155584 [0,2,0,0,0,0|2,0,0]=4 8408 B14R1.490 CC=Cc1ccc(c(c1)F)OC(=O)C 271570a_100016259895_100009811628 [0,2,0,0,0,0|2,0,0]=4 8409 B14R1.490 CC=Cc1ccc(c(c1)N)NC(=O)C 271570a_100016259895_100000749274 [0,2,0,0,0,0|2,0,0]=4 8410 B14R1.490 CCNc1ccc(c(c1)C)NC(=O)C 34a_100000736504_100000210202 [0,2,0,0,0,0|2,0,0]=4 8411 B14R1.490 CCNc1ccc(c(c1)C)NC(=O)C 7a_100000736504_100000210202 [0,2,0,0,0,0|2,0,0]=4 8412 B14R1.490 CCNc1ccc(c(c1)Cl)NC(=O)C 34a_100000244014_100000210202 [0,2,0,0,0,0|2,0,0]=4 8413 B14R1.490 CCNc1ccc(c(c1)Cl)NC(=O)C 7a_100000244014_100000210202 [0,2,0,0,0,0|2,0,0]=4 8414 B14R1.490 CCOc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_200012721597 [0,2,0,0,0,0|2,0,0]=4 8415 B14R1.490 CCOc1ccc(c(c1)C)C=C(C)C 271570a_100102525489_100012344538 [0,2,0,0,0,0|1,0,1]=4 8416 B14R1.490 CCOc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100011361535 [0,2,0,0,0,0|2,0,0]=4 8417 B14R1.490 CCOc1ccc(c(c1)C)NC(=O)C 11a_100000742753_100015343762 [0,2,0,0,0,0|1,0,0]=3 8418 B14R1.490 CCOc1ccc(c(c1)C)NC(=O)C 1626a_100000742753_100015343762 [0,2,0,0,0,0|1,0,0]=3 8419 B14R1.490 CCOc1ccc(c(c1)C)NC(=O)C 22a_100000742753_100000070787 [0,2,0,0,0,0|1,0,0]=3 8420 B14R1.490 CCOc1ccc(c(c1)C)NC(=O)C 527a_100000742753_100103153847 [0,2,0,0,0,0|1,0,0]=3 8421 B14R1.490 CCOc1ccc(c(c1)Cl)CC(=O)C 34a_200000084595_100000210202 [0,2,0,0,0,0|0,0,0]=2 8422 B14R1.490 CCOc1ccc(c(c1)Cl)CC(=O)C 7a_200000084595_100000210202 [0,2,0,0,0,0|0,0,0]=2 8423 B14R1.490 CCOc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100000692347 [0,2,0,0,0,0|1,0,1]=4 8424 B14R1.490 CCOc1ccc(c(c1)F)CC(=O)C 1458a_100000070787_200016184943 [0,2,0,0,0,0|0,0,0]=2 8425 B14R1.490 CCOc1ccc(c(c1)F)CN(C)C 2230a_100102631434_200016184943 [0,2,0,0,0,0|2,0,0]=4 8426 B14R1.490 CCOc1ccc(c(c1)F)CN(C)C 269982a_100102631434_200016184943 [0,2,0,0,0,0|2,0,0]=4 8427 B14R1.490 CCOc1ccc(c(c1)F)NC(=O)C 11a_100015186438_100015343762 [0,2,0,0,0,0|1,0,0]=3 8428 B14R1.490 CCOc1ccc(c(c1)F)NC(=O)C 1626a_100015186438_100015343762 [0,2,0,0,0,0|1,0,0]=3 8429 B14R1.490 CCOc1ccc(c(c1)F)NC(=O)C 22a_100015186438_100000070787 [0,2,0,0,0,0|1,0,0]=3 8430 B14R1.490 CCOc1ccc(c(c1)F)NC(=O)C 527a_100015186438_100103153847 [0,2,0,0,0,0|1,0,0]=3 8431 B14R1.490 CCSc1ccc(c(c1)C)NC(=O)C 62a_100000210202_100000152120 [0,2,0,0,0,0|1,1,0]=4 8432 B14R1.490 CCSc1ccc(c(c1)Cl)NC(=O)C 62a_100000210202_100011273303 [0,2,0,0,0,0|1,1,0]=4 8433 B14R1.490 CCSc1ccc(c(c1)F)NC(=O)C 62a_100000210202_100000155584 [0,2,0,0,0,0|1,1,0]=4 8434 B14R1.490 CCSc1ccc(c(c1)F)OC(=O)C 62a_100000210202_100009811628 [0,2,0,0,0,0|1,1,0]=4 8435 B14R1.490 CCSc1ccc(c(c1)F)OC(=O)C 62a_100009811628_100000210202 [0,2,0,0,0,0|1,1,0]=4 8436 B14R1.490 CNCc1ccc(c(c1)Cl)CC(=O)C 26a_100102657272_200000084595 [0,2,0,0,0,0|1,0,0]=3 8437 B14R1.490 COCc1ccc(c(c1)F)C=C(C)C 271570a_100102525489_100010177442 [0,2,0,0,0,0|1,0,1]=4 8438 B14R1.490 COCc1ccc(c(c1)N)C=C(C)C 271570a_100102525489_200013033220 [0,2,0,0,0,0|1,0,1]=4 8439 B14R1.717 CC(=O)Nc1ccc(cc1)C(=O)CF 1458a_100000185149_100015361967 [0,2,0,0,0,0|2,0,0]=4 8440 B14R1.717 CC(=O)Nc1ccc(cc1)C(C)C#N 11a_100000069498_100015343762 [0,2,0,0,0,0|2,0,0]=4 8441 B14R1.717 CC(=O)Nc1ccc(cc1)C(C)C#N 1626a_100000069498_100015343762 [0,2,0,0,0,0|2,0,0]=4 8442 B14R1.717 CC(=O)Nc1ccc(cc1)C(C)C#N 22a_100000069498_100000070787 [0,2,0,0,0,0|2,0,0]=4 8443 B14R1.717 CC(=O)Nc1ccc(cc1)C(C)C#N 527a_100000069498_100103153847 [0,2,0,0,0,0|2,0,0]=4 8444 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 269982a_100000219403_100015361967 [0,2,0,0,0,0|2,0,0]=4 8445 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 34a_100000219403_100015361967 [0,2,0,0,0,0|2,0,0]=4 8446 B14R1.717 CC(=O)Nc1ccc(cc1)N(C)CF 38a_100000219403_100015361967 [0,2,0,0,0,0|2,0,0]=4 8447 B14R1.717 CC(C)Cc1ccc(cc1)C(C)O[13CH3] 34a_100000246501_200025704644 [0,2,0,0,0,0|1,0,1]=4 8448 B14R1.717 CC(C)Cc1ccc(cc1)C(C)O[13CH3] 7a_100000246501_200025704644 [0,2,0,0,0,0|1,0,1]=4 8449 B14R1.717 CCC(=O)c1ccc(cc1)NC(=O)C 1458a_100000185149_100000210202 [0,2,0,0,0,0|2,0,0]=4 8450 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 11a_100000211316_100015343762 [0,2,0,0,0,0|2,0,0]=4 8451 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 1626a_100000211316_100015343762 [0,2,0,0,0,0|2,0,0]=4 8452 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 22a_100000211316_100000070787 [0,2,0,0,0,0|2,0,0]=4 8453 B14R1.717 CCC(C)c1ccc(cc1)NC(=O)C 527a_100000211316_100103153847 [0,2,0,0,0,0|2,0,0]=4 8454 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 2230a_100000219403_100000210202 [0,2,0,0,0,0|2,0,0]=4 8455 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 269982a_100000219403_100000204670 [0,2,0,0,0,0|2,0,0]=4 8456 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 34a_100000219403_100000210202 [0,2,0,0,0,0|2,0,0]=4 8457 B14R1.717 CCN(C)c1ccc(cc1)NC(=O)C 38a_100000219403_100000204670 [0,2,0,0,0,0|2,0,0]=4 8458 B14R1.717 CNC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000753832 [0,2,0,0,0,0|1,0,0]=3 8459 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 11a_100000184841_100015343762 [0,2,0,0,0,0|2,0,0]=4 8460 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 11a_106832991635_100000185149 [0,2,0,0,0,0|2,0,0]=4 8461 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 1626a_100000184841_100015343762 [0,2,0,0,0,0|2,0,0]=4 8462 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 1626a_100102657272_100000185149 [0,2,0,0,0,0|2,0,0]=4 8463 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 22a_100000184841_100000070787 [0,2,0,0,0,0|2,0,0]=4 8464 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 240690a_100102657272_100000185149 [0,2,0,0,0,0|2,0,0]=4 8465 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 527a_100000184841_100103153847 [0,2,0,0,0,0|2,0,0]=4 8466 B14R1.717 CNC(=O)c1ccc(cc1)NC(=O)C 527a_100102657272_100000185149 [0,2,0,0,0,0|2,0,0]=4 8467 B14R1.717 CNC(=O)c1ccc(cc1)OC(=O)C 11a_106832991635_100000188978 [0,2,0,0,0,0|2,0,0]=4 8468 B14R1.717 CNC(=O)c1ccc(cc1)OC(=O)C 1626a_100102657272_100000188978 [0,2,0,0,0,0|2,0,0]=4 8469 B14R1.717 CNC(=O)c1ccc(cc1)OC(=O)C 240690a_100102657272_100000188978 [0,2,0,0,0,0|2,0,0]=4 8470 B14R1.717 CNC(C)c1ccc(cc1)NC(=O)C 269862a_106832991636_100000152756 [0,2,0,0,0,0|2,0,0]=4 8471 B14R1.717 CNC(C)c1ccc(cc1)OC(=O)C 269862a_106832991636_100000001828 [0,2,0,0,0,0|2,0,0]=4 8472 B14R1.717 COC(=O)c1ccc(cc1)C=C(C)C 271570a_100102525489_100000150774 [0,2,0,0,0,0|1,0,1]=4 8473 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000735637 [0,2,0,0,0,0|0,0,0]=2 8474 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100012277402_200000210301 [0,2,0,0,0,0|0,0,0]=2 8475 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100012277402_200025704644 [0,2,0,0,0,0|0,0,0]=2 8476 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100000737656_200000210301 [0,2,0,0,0,0|2,0,0]=4 8477 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000735637 [0,2,0,0,0,0|2,0,0]=4 8478 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100000737656_200000210301 [0,2,0,0,0,0|2,0,0]=4 8479 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000735637 [0,2,0,0,0,0|2,0,0]=4 8480 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 270004a_100102631434_100000148700 [0,2,0,0,0,0|2,0,0]=4 8481 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 2230a_100000737656_200025704644 [0,2,0,0,0,0|2,0,0]=4 8482 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 269982a_100000737656_200025704644 [0,2,0,0,0,0|2,0,0]=4 8483 B14R1.717 COC(=O)c1ccc(cc1)NC(=O)C 188690a_100016994500_100015343762 [0,2,0,0,0,0|1,0,0]=3 8484 B14R1.717 COC(=O)c1ccc(cn1)CC(=O)C 1458a_100000070787_100010177729 [0,2,0,0,0,0|1,0,0]=3 8485 B14R1.717 COC(=O)c1ccc(nc1)CC(=O)C 1458a_100000070787_100010230174 [0,2,0,0,0,0|1,0,0]=3 8486 B14R1.717 COC(=O)c1cnc(cn1)CC(=O)C 1458a_100000070787_200010203303 [0,2,0,0,0,0|2,0,0]=4 8487 B14R1.717 COC(C)c1ccc(cc1)C=C(C)C 271570a_100102525489_100010254937 [0,2,0,0,0,0|1,0,1]=4 8488 B14R1.717 COC(C)c1ccc(cc1)CC(C)C 34a_100000246501_200000210301 [0,2,0,0,0,0|1,0,1]=4 8489 B14R1.717 COC(C)c1ccc(cc1)CC(C)C 7a_100000246501_200000210301 [0,2,0,0,0,0|1,0,1]=4 8490 B14R1.805 CC(=Cc1ccc(cc1)CC(=O)N)C 271570a_100102525489_100000162331 [0,2,0,0,0,0|2,0,0]=4 8491 B14R1.805 CC(=Cc1ccc(cc1)OC(C)C)C 271570a_100102525489_100000169947 [0,2,0,0,0,0|1,0,1]=4 8492 B14R1.805 CC(=Cc1ccc(cc1)OC(F)F)C 271570a_100102525489_100000179047 [0,2,0,0,0,0|1,0,1]=4 8493 B14R1.805 CC(=O)Cc1ccc(cc1)C=C(C)C 271570a_100102525489_100000691760 [0,2,0,0,0,0|1,0,0]=3 8494 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000070787_100011982790 [0,2,0,0,0,0|1,0,0]=3 8495 B14R1.805 CC(=O)Cc1ccc(cc1)CC(C)C 1458a_100000204619_200000210301 [0,2,0,0,0,0|1,0,0]=3 8496 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000070787_100000731167 [0,2,0,0,0,0|1,0,0]=3 8497 B14R1.805 CC(=O)Cc1ccc(cc1)NC(=O)C 1458a_100000199044_200000210301 [0,2,0,0,0,0|1,0,0]=3 8498 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 1458a_100000244678_200000210301 [0,2,0,0,0,0|0,0,0]=2 8499 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 34a_100011218180_100000210206 [0,2,0,0,0,0|0,0,0]=2 8500 B14R1.805 CC(=O)Cc1ccc(cc1)OC(C)C 7a_100011218180_100000210206 [0,2,0,0,0,0|0,0,0]=2 8501 B14R1.805 CC(=O)Cc1ccc(cc1)OC(F)F 1458a_100000070787_100011217905 [0,2,0,0,0,0|0,0,0]=2 8502 B14R1.805 CC(=O)Cc1ccc(cc1)OC(F)F 1458a_100000199076_200000210301 [0,2,0,0,0,0|0,0,0]=2 8503 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000210206_100000691760 [0,2,0,0,0,0|0,1,0]=3 8504 B14R1.805 CC(=O)Cc1ccc(cc1)SC(C)C 62a_100000691760_100000210206 [0,2,0,0,0,0|0,1,0]=3 8505 B14R1.805 CC(=O)Cc1ccc(nc1)OC(F)F 1458a_100000070787_100009887947 [0,2,0,0,0,0|1,0,0]=3 8506 B14R1.805 CC(=O)Nc1ccc(cc1)C=C(C)C 271570a_100102525489_100000155215 [0,2,0,0,0,0|2,0,0]=4 8507 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 11a_100000738315_100015343762 [0,2,0,0,0,0|2,0,0]=4 8508 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 1626a_100000738315_100015343762 [0,2,0,0,0,0|2,0,0]=4 8509 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 22a_100000738315_100000070787 [0,2,0,0,0,0|2,0,0]=4 8510 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)N 527a_100000738315_100103153847 [0,2,0,0,0,0|2,0,0]=4 8511 B14R1.805 CC(=O)Nc1ccc(cc1)CC(=O)[13CH3] 1458a_100000199044_200025704644 [0,2,0,0,0,0|1,0,0]=3 8512 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 11a_100000687309_100015343762 [0,2,0,0,0,0|2,0,0]=4 8513 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 1626a_100000687309_100015343762 [0,2,0,0,0,0|2,0,0]=4 8514 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 22a_100000687309_100000070787 [0,2,0,0,0,0|2,0,0]=4 8515 B14R1.805 CC(=O)Nc1ccc(cc1)CC(C)C 527a_100000687309_100103153847 [0,2,0,0,0,0|2,0,0]=4 8516 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 11a_100000246131_100015343762 [0,2,0,0,0,0|2,0,0]=4 8517 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 2230a_100102631434_100000731167 [0,2,0,0,0,0|2,0,0]=4 8518 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 22a_100000246131_100000070787 [0,2,0,0,0,0|2,0,0]=4 8519 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 269982a_100102631434_100000731167 [0,2,0,0,0,0|2,0,0]=4 8520 B14R1.805 CC(=O)Nc1ccc(cc1)CN(C)C 527a_100000246131_100103153847 [0,2,0,0,0,0|2,0,0]=4 8521 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 11a_100000184111_100015343762 [0,2,0,0,0,0|2,0,0]=4 8522 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 1626a_100000184111_100015343762 [0,2,0,0,0,0|2,0,0]=4 8523 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 22a_100000184111_100000070787 [0,2,0,0,0,0|2,0,0]=4 8524 B14R1.805 CC(=O)Nc1ccc(cc1)NC(=O)C 527a_100000184111_100103153847 [0,2,0,0,0,0|2,0,0]=4 8525 B14R1.805 CC(=O)Nc1ccc(cc1)NC(C)C 34a_100000184111_100000210206 [0,2,0,0,0,0|2,0,0]=4 8526 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 11a_100009829859_100015343762 [0,2,0,0,0,0|1,0,0]=3 8527 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 1626a_100009829859_100015343762 [0,2,0,0,0,0|1,0,0]=3 8528 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 22a_100009829859_100000070787 [0,2,0,0,0,0|1,0,0]=3 8529 B14R1.805 CC(=O)Nc1ccc(cc1)OC(=O)C 527a_100009829859_100103153847 [0,2,0,0,0,0|1,0,0]=3 8530 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 11a_100011194259_100015343762 [0,2,0,0,0,0|1,0,0]=3 8531 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 1626a_100011194259_100015343762 [0,2,0,0,0,0|1,0,0]=3 8532 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 22a_100011194259_100000070787 [0,2,0,0,0,0|1,0,0]=3 8533 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 34a_100000184395_100000210206 [0,2,0,0,0,0|1,0,0]=3 8534 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 527a_100011194259_100103153847 [0,2,0,0,0,0|1,0,0]=3 8535 B14R1.805 CC(=O)Nc1ccc(cc1)OC(C)C 7a_100000184395_100000210206 [0,2,0,0,0,0|1,0,0]=3 8536 B14R1.805 CC(=O)Nc1ccc(cc1)OC(F)F 11a_100000183591_100015343762 [0,2,0,0,0,0|1,0,0]=3 8537 B14R1.805 CC(=O)Nc1ccc(cc1)OC(F)F 1626a_100000183591_100015343762 [0,2,0,0,0,0|1,0,0]=3 8538 B14R1.805 CC(=O)Nc1ccc(cc1)OC(F)F 22a_100000183591_100000070787 [0,2,0,0,0,0|1,0,0]=3 8539 B14R1.805 CC(=O)Nc1ccc(cc1)OC(F)F 527a_100000183591_100103153847 [0,2,0,0,0,0|1,0,0]=3 8540 B14R1.805 CC(=O)Nc1ccc(cc1)SC(C)C 62a_100000210206_100000155215 [0,2,0,0,0,0|1,1,0]=4 8541 B14R1.805 CC(=O)Nc1ccc(cc1)SC(F)F 11a_100000189473_100015343762 [0,2,0,0,0,0|1,1,0]=4 8542 B14R1.805 CC(=O)Nc1ccc(cc1)SC(F)F 1626a_100000189473_100015343762 [0,2,0,0,0,0|1,1,0]=4 8543 B14R1.805 CC(=O)Nc1ccc(cc1)SC(F)F 22a_100000189473_100000070787 [0,2,0,0,0,0|1,1,0]=4 8544 B14R1.805 CC(=O)Nc1ccc(cn1)OC(C)C 34a_200000094647_100000210206 [0,2,0,0,0,0|2,0,0]=4 8545 B14R1.805 CC(=O)Nc1ccc(cn1)OC(C)C 7a_200000094647_100000210206 [0,2,0,0,0,0|2,0,0]=4 8546 B14R1.805 CC(=O)Oc1ccc(cc1)C=C(C)C 271570a_100102525489_100000002173 [0,2,0,0,0,0|1,0,1]=4 8547 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 2230a_100102631434_100000033664 [0,2,0,0,0,0|2,0,0]=4 8548 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 269982a_100102631434_100000033664 [0,2,0,0,0,0|2,0,0]=4 8549 B14R1.805 CC(=O)Oc1ccc(cc1)CN(C)C 270004a_100102631434_100000014718 [0,2,0,0,0,0|2,0,0]=4 8550 B14R1.805 CC(=O)Oc1ccc(cc1)SC(C)C 62a_100000210206_100000002173 [0,2,0,0,0,0|1,1,0]=4 8551 B14R1.805 CC(=O)Sc1ccc(cc1)C=C(C)C 271570a_100102525489_200009995050 [0,2,0,0,0,0|2,0,0]=4 8552 B14R1.805 CC(=O)Sc1ccc(cc1)SC(C)C 62a_200009995050_100000210206 [0,2,0,0,0,0|1,1,0]=4 8553 B14R1.805 CC(=S)Oc1ccc(cc1)C=C(C)C 271570a_100102525489_200009816735 [0,2,0,0,0,0|1,0,1]=4 8554 B14R1.805 CC(C)Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000204619_200025704644 [0,2,0,0,0,0|1,0,0]=3 8555 B14R1.805 CC(C)Nc1ccc(cc1)CC(=O)N 2230a_100000738315_100000210206 [0,2,0,0,0,0|2,0,0]=4 8556 B14R1.805 CC(C)Nc1ccc(cc1)CC(=O)N 34a_100000738315_100000210206 [0,2,0,0,0,0|2,0,0]=4 8557 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)N 34a_100000020825_100000210206 [0,2,0,0,0,0|1,0,0]=3 8558 B14R1.805 CC(C)Oc1ccc(cc1)CC(=O)[13CH3] 1458a_100000244678_200025704644 [0,2,0,0,0,0|0,0,0]=2 8559 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)C 2230a_100000713913_200000210301 [0,2,0,0,0,0|2,0,0]=4 8560 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)C 269982a_100000713913_200000210301 [0,2,0,0,0,0|2,0,0]=4 8561 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)C 270004a_100102631434_100000169837 [0,2,0,0,0,0|2,0,0]=4 8562 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)C 34a_100000713913_200000210301 [0,2,0,0,0,0|2,0,0]=4 8563 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)[13CH3] 2230a_100000713913_200025704644 [0,2,0,0,0,0|2,0,0]=4 8564 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)[13CH3] 269982a_100000713913_200025704644 [0,2,0,0,0,0|2,0,0]=4 8565 B14R1.805 CC(C)Oc1ccc(cc1)CN(C)[13CH3] 34a_100000713913_200025704644 [0,2,0,0,0,0|2,0,0]=4 8566 B14R1.805 CC(C)Sc1ccc(cc1)CC(=O)N 62a_100000162331_100000210206 [0,2,0,0,0,0|1,1,0]=4 8567 B14R1.805 CC(C)Sc1ccc(cc1)CC(=O)N 62a_100000210206_100000162331 [0,2,0,0,0,0|1,1,0]=4 8568 B14R1.805 CC(N)Cc1ccc(cc1)OC(C)C 34a_100102634573_100000210206 [0,2,0,0,0,0|1,0,1]=4 8569 B14R1.805 CN(C)Cc1ccc(cc1)OC(F)F 2230a_100102631434_100011217905 [0,2,0,0,0,0|2,0,0]=4 8570 B14R1.805 CN(C)Cc1ccc(cc1)OC(F)F 269982a_100102631434_100011217905 [0,2,0,0,0,0|2,0,0]=4 8571 B14R1.805 CN(C)Cc1ccc(cc1)OC(F)F 270004a_100102631434_100000179041 [0,2,0,0,0,0|2,0,0]=4 8572 B14R1.805 [13CH3]C(=O)Cc1ccc(cc1)OC(F)F 1458a_100000199076_200025704644 [0,2,0,0,0,0|0,0,0]=2 8573 B14R1.124 C=C(C)c1ccc(c(c1)C)NC(=O)C 271570a_100000694244_100000152120 [0,2,0,0,0,0|2,0,0]=4 8574 B14R1.124 C=C(C)c1ccc(c(c1)Cl)NC(=O)C 271570a_100000694244_100011273303 [0,2,0,0,0,0|2,0,0]=4 8575 B14R1.124 C=C(C)c1ccc(c(c1)F)NC(=O)C 271570a_100000694244_100000155584 [0,2,0,0,0,0|2,0,0]=4 8576 B14R1.124 C=C(C)c1ccc(c(c1)F)OC(=O)C 271570a_100000694244_100009811628 [0,2,0,0,0,0|2,0,0]=4 8577 B14R1.124 C=C(C)c1ccc(c(c1)N)NC(=O)C 271570a_100000694244_100000749274 [0,2,0,0,0,0|2,0,0]=4 8578 B14R1.124 CC(=O)Cc1ccc(cc1Br)C(=O)C 1458a_100000070787_100010884425 [0,2,0,0,0,0|1,0,0]=3 8579 B14R1.124 CC(=O)Cc1ccc(cc1Br)[N+](=O)[O-] 1458a_100000070787_100000741879 [0,2,0,0,0,0|2,0,0]=4 8580 B14R1.124 CC(=O)Cc1ccc(cc1C)[N+](=O)[O-] 1458a_100000070787_100010218038 [0,2,0,0,0,0|2,0,0]=4 8581 B14R1.124 CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000070787_100000747184 [0,2,0,0,0,0|2,0,0]=4 8582 B14R1.124 CC(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_200000210301 [0,2,0,0,0,0|2,0,0]=4 8583 B14R1.124 CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000070787_100000759423 [0,2,0,0,0,0|2,0,0]=4 8584 B14R1.124 CC(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_200000210301 [0,2,0,0,0,0|2,0,0]=4 8585 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 11a_100011218581_100015343762 [0,2,0,0,0,0|2,0,0]=4 8586 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 1626a_100011218581_100015343762 [0,2,0,0,0,0|2,0,0]=4 8587 B14R1.124 CC(=O)Nc1ccc(cc1Br)C(C)C 527a_100011218581_100103153847 [0,2,0,0,0,0|2,0,0]=4 8588 B14R1.124 CC(=O)Nc1ccc(cc1Br)N(C)C 11a_200013039233_100015343762 [0,2,0,0,0,0|2,0,0]=4 8589 B14R1.124 CC(=O)Nc1ccc(cc1Br)N(C)C 1626a_200013039233_100015343762 [0,2,0,0,0,0|2,0,0]=4 8590 B14R1.124 CC(=O)Nc1ccc(cc1C)C(=O)C 1458a_200000244242_200000210301 [0,2,0,0,0,0|2,0,0]=4 8591 B14R1.124 CC(=O)Nc1ccc(cc1C)C(=O)[13CH3] 1458a_200000244242_200025704644 [0,2,0,0,0,0|2,0,0]=4 8592 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 11a_100000246174_100015343762 [0,2,0,0,0,0|2,0,0]=4 8593 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 1626a_100000246174_100015343762 [0,2,0,0,0,0|2,0,0]=4 8594 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 22a_100000246174_100000070787 [0,2,0,0,0,0|2,0,0]=4 8595 B14R1.124 CC(=O)Nc1ccc(cc1C)N(C)C 527a_100000246174_100103153847 [0,2,0,0,0,0|2,0,0]=4 8596 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 11a_100012355998_100015343762 [0,2,0,0,0,0|2,0,0]=4 8597 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 1626a_100012355998_100015343762 [0,2,0,0,0,0|2,0,0]=4 8598 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 22a_100012355998_100000070787 [0,2,0,0,0,0|2,0,0]=4 8599 B14R1.124 CC(=O)Nc1ccc(cc1I)C(C)C 527a_100012355998_100103153847 [0,2,0,0,0,0|2,0,0]=4 8600 B14R1.124 CC(=O)Nc1ccc(cc1O)C(=O)C 271570a_203496583355_100009813952 [0,2,0,0,0,0|2,0,0]=4 8601 B14R1.124 CC(=O)Nc1ccc(cc1O)C(C)C 271570a_203496583355_200009992923 [0,2,0,0,0,0|2,0,0]=4 8602 B14R1.124 [13CH3]C(=O)Cc1ccc(cc1Cl)[N+](=O)[O-] 1458a_100000757483_200025704644 [0,2,0,0,0,0|2,0,0]=4 8603 B14R1.124 [13CH3]C(=O)Cc1ccc(cc1F)[N+](=O)[O-] 1458a_100000688093_200025704644 [0,2,0,0,0,0|2,0,0]=4 8604 B14R1.806 CC(=O)Cc1ccc(cc1)C(C)(C)C 1458a_100000070787_100000212263 [0,2,0,0,0,0|1,0,0]=3 8605 B14R1.806 CC(=O)Cc1ccc(cc1)C(C)(C)C 1458a_100000186723_200000210301 [0,2,0,0,0,0|1,0,0]=3 8606 B14R1.806 CC(=O)Cc1ccc(cc1)C(F)(F)F 1458a_100000070787_100000217503 [0,2,0,0,0,0|2,0,0]=4 8607 B14R1.806 CC(=O)Cc1ccc(cc1)C(F)(F)F 1458a_100000233766_200000210301 [0,2,0,0,0,0|2,0,0]=4 8608 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)C 1458a_100000070787_100000717844 [0,2,0,0,0,0|0,1,0]=3 8609 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)C 1458a_100011219842_200000210301 [0,2,0,0,0,0|0,1,0]=3 8610 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000070787_200012292325 [0,2,0,0,0,0|1,1,0]=4 8611 B14R1.806 CC(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000751520_200000210301 [0,2,0,0,0,0|1,1,0]=4 8612 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 11a_100000210346_100015343762 [0,2,0,0,0,0|2,0,0]=4 8613 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 1626a_100000210346_100015343762 [0,2,0,0,0,0|2,0,0]=4 8614 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 22a_100000210346_100000070787 [0,2,0,0,0,0|2,0,0]=4 8615 B14R1.806 CC(=O)Nc1ccc(cc1)C(C)(C)C 527a_100000210346_100103153847 [0,2,0,0,0,0|2,0,0]=4 8616 B14R1.806 CC(=O)Nc1ccc(cc1)S(=O)(=O)C 11a_100000195502_100015343762 [0,2,0,0,0,0|1,1,0]=4 8617 B14R1.806 CC(=O)Nc1ccc(cc1)S(=O)(=O)C 1626a_100000195502_100015343762 [0,2,0,0,0,0|1,1,0]=4 8618 B14R1.806 CC(=O)Nc1ccc(cc1)S(=O)(=O)C 22a_100000195502_100000070787 [0,2,0,0,0,0|1,1,0]=4 8619 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 11a_100009954384_100015343762 [0,2,0,0,0,0|2,0,0]=4 8620 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 1626a_100009954384_100015343762 [0,2,0,0,0,0|2,0,0]=4 8621 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 22a_100009954384_100000070787 [0,2,0,0,0,0|2,0,0]=4 8622 B14R1.806 CC(=O)Nc1ccc(cc1)[Si](C)(C)C 527a_100009954384_100103153847 [0,2,0,0,0,0|2,0,0]=4 8623 B14R1.806 CC(C)(C)c1ccc(cc1)CC(=O)[13CH3] 1458a_100000186723_200025704644 [0,2,0,0,0,0|1,0,0]=3 8624 B14R1.806 CS(=O)(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100011219842_200025704644 [0,2,0,0,0,0|0,1,0]=3 8625 B14R1.806 [13CH3]C(=O)Cc1ccc(cc1)C(F)(F)F 1458a_100000233766_200025704644 [0,2,0,0,0,0|2,0,0]=4 8626 B14R1.806 [13CH3]C(=O)Cc1ccc(cc1)S(=O)(=O)N 1458a_100000751520_200025704644 [0,2,0,0,0,0|1,1,0]=4 8627 B14R1.101 CCc1cc(ccc1C=C(C)C)OC 271570a_100102525489_100000720562 [0,2,0,0,0,0|1,0,1]=4 8628 B14R1.101 CNc1cc(ccc1NC(=O)C)OC 2230a_100000744381_200000210301 [0,2,0,0,0,0|1,0,0]=3 8629 B14R1.101 CNc1cc(ccc1NC(=O)C)OC 34a_100000744381_200000210301 [0,2,0,0,0,0|1,0,0]=3 8630 B14R1.101 CNc1ccc(c(c1)OC)NC(=O)C 34a_100015186897_200000210301 [0,2,0,0,0,0|2,0,0]=4 8631 B14R1.101 CNc1ccc(c(c1)OC)NC(=O)C 7a_100015186897_200000210301 [0,2,0,0,0,0|2,0,0]=4 8632 B14R1.101 COc1cc(ccc1NC(=O)C)N[13CH3] 34a_100015186897_200025704644 [0,2,0,0,0,0|2,0,0]=4 8633 B14R1.101 COc1cc(ccc1NC(=O)C)N[13CH3] 7a_100015186897_200025704644 [0,2,0,0,0,0|2,0,0]=4 8634 B14R1.101 COc1cc(ccc1NC(=O)C)SC 11a_100000766855_100015343762 [0,2,0,0,0,0|1,1,0]=4 8635 B14R1.101 COc1cc(ccc1NC(=O)C)SC 22a_100000766855_100000070787 [0,2,0,0,0,0|1,1,0]=4 8636 B14R1.101 COc1cc(ccc1NC(=O)C)SC 527a_100000766855_100103153847 [0,2,0,0,0,0|1,1,0]=4 8637 B14R1.101 COc1ccc(c(c1)C#N)C=C(C)C 271570a_100102525489_100000748272 [0,2,0,0,0,0|1,0,1]=4 8638 B14R1.101 COc1ccc(c(c1)C#N)CC(=O)C 1458a_100009888289_200000210301 [0,2,0,0,0,0|0,0,0]=2 8639 B14R1.101 COc1ccc(c(c1)C#N)CC(=O)[13CH3] 1458a_100009888289_200025704644 [0,2,0,0,0,0|0,0,0]=2 8640 B14R1.101 COc1ccc(c(c1)C#N)NC(=O)C 11a_100011997231_100015343762 [0,2,0,0,0,0|1,0,0]=3 8641 B14R1.101 COc1ccc(c(c1)C#N)NC(=O)C 1626a_100011997231_100015343762 [0,2,0,0,0,0|1,0,0]=3 8642 B14R1.101 COc1ccc(c(c1)C=O)C=C(C)C 271570a_100102525489_100000691568 [0,2,0,0,0,0|1,0,1]=4 8643 B14R1.101 COc1ccc(c(c1)CN)C=C(C)C 271570a_100102525489_100000741592 [0,2,0,0,0,0|1,0,1]=4 8644 B14R1.101 COc1ccc(c(c1)CO)C=C(C)C 271570a_100102525489_200011273942 [0,2,0,0,0,0|1,0,1]=4 8645 B14R1.101 COc1ccc(c(c1)CO)NC(=O)C 22a_100012001277_100000070787 [0,2,0,0,0,0|1,0,0]=3 8646 B14R1.101 COc1ccc(c(c1)CO)NC(=O)C 527a_100012001277_100103153847 [0,2,0,0,0,0|1,0,0]=3 8647 B14R1.101 COc1ccc(c(c1)N[13CH3])NC(=O)C 2230a_100000744381_200025704644 [0,2,0,0,0,0|1,0,0]=3 8648 B14R1.101 COc1ccc(c(c1)N[13CH3])NC(=O)C 34a_100000744381_200025704644 [0,2,0,0,0,0|1,0,0]=3 8649 B14R1.101 COc1ccc(c(c1)OC)C=C(C)C 271570a_100102525489_100000750026 [0,2,0,0,0,0|1,0,1]=4 8650 B14R1.101 COc1ccc(c(c1)OC)CC(=O)C 1458a_100000195418_200000210301 [0,2,0,0,0,0|0,0,0]=2 8651 B14R1.101 COc1ccc(c(c1)OC)CC(=O)[13CH3] 1458a_100000195418_200025704644 [0,2,0,0,0,0|0,0,0]=2 8652 B14R1.101 COc1ccc(c(c1)OC)CN(C)C 2230a_100000184527_200000210301 [0,2,0,0,0,0|2,0,0]=4 8653 B14R1.101 COc1ccc(c(c1)OC)CN(C)C 269982a_100000184527_200000210301 [0,2,0,0,0,0|2,0,0]=4 8654 B14R1.101 COc1ccc(c(c1)OC)CN(C)C 270004a_100102631434_100000188320 [0,2,0,0,0,0|2,0,0]=4 8655 B14R1.101 COc1ccc(c(c1)OC)CN(C)[13CH3] 2230a_100000184527_200025704644 [0,2,0,0,0,0|2,0,0]=4 8656 B14R1.101 COc1ccc(c(c1)OC)CN(C)[13CH3] 269982a_100000184527_200025704644 [0,2,0,0,0,0|2,0,0]=4 8657 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 11a_100000211191_100015343762 [0,2,0,0,0,0|1,0,0]=3 8658 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 1626a_100000211191_100015343762 [0,2,0,0,0,0|1,0,0]=3 8659 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 22a_100000211191_100000070787 [0,2,0,0,0,0|1,0,0]=3 8660 B14R1.101 COc1ccc(c(c1)OC)NC(=O)C 527a_100000211191_100103153847 [0,2,0,0,0,0|1,0,0]=3 8661 B14R1.560 CC(=O)Cc1c(cc(cc1F)C#N)F 1458a_100000070787_200012663091 [0,2,0,0,0,0|2,0,0]=4 8662 B14R1.560 CC(=O)Nc1c(cc(cc1Br)N[13CH3])Br 34a_200011216352_200025704644 [0,2,0,0,0,0|2,0,0]=4 8663 B14R1.560 CC(=O)Nc1c(cc(cc1Br)N[13CH3])Br 7a_200011216352_200025704644 [0,2,0,0,0,0|2,0,0]=4 8664 B14R1.560 CC(=O)Oc1c(cc(cc1C)S[13CH3])C 62a_200009816532_200025704644 [0,2,0,0,0,0|1,1,0]=4 8665 B14R1.560 CC(=O)Oc1c(cc(cc1C)S[13CH3])C 62a_200025704644_200009816532 [0,2,0,0,0,0|1,1,0]=4 8666 B14R1.560 CNc1cc(c(c(c1)Br)NC(=O)C)Br 34a_200011216352_200000210301 [0,2,0,0,0,0|2,0,0]=4 8667 B14R1.560 CNc1cc(c(c(c1)Br)NC(=O)C)Br 7a_200011216352_200000210301 [0,2,0,0,0,0|2,0,0]=4 8668 B14R1.560 COc1cc(c(c(c1)Br)CN(C)C)F 270004a_100102631434_200021118581 [0,2,0,0,0,0|2,0,0]=4 8669 B14R1.560 COc1cc(c(c(c1)Br)NC(=O)C)Br 11a_100009997310_100015343762 [0,2,0,0,0,0|1,0,0]=3 8670 B14R1.560 COc1cc(c(c(c1)Br)NC(=O)C)C 11a_200011010636_100015343762 [0,2,0,0,0,0|1,0,0]=3 8671 B14R1.560 COc1cc(c(c(c1)Br)NC(=O)C)C 1626a_200011010636_100015343762 [0,2,0,0,0,0|1,0,0]=3 8672 B14R1.560 COc1cc(c(c(c1)C)C=C(C)C)C 271570a_100102525489_100012160682 [0,2,0,0,0,0|1,0,1]=4 8673 B14R1.560 COc1cc(c(c(c1)C)CN(C)C)C 270004a_100102631434_100000081723 [0,2,0,0,0,0|2,0,0]=4 8674 B14R1.560 COc1cc(c(c(c1)C)NC(=O)C)C 11a_100009848961_100015343762 [0,2,0,0,0,0|1,0,0]=3 8675 B14R1.560 COc1cc(c(c(c1)C)NC(=O)C)C 1626a_100009848961_100015343762 [0,2,0,0,0,0|1,0,0]=3 8676 B14R1.560 COc1cc(c(c(c1)C)NC(=O)C)C 22a_100009848961_100000070787 [0,2,0,0,0,0|1,0,0]=3 8677 B14R1.560 COc1cc(c(c(c1)Cl)CN(C)C)Cl 270004a_100102631434_100010254371 [0,2,0,0,0,0|2,0,0]=4 8678 B14R1.560 COc1cc(c(c(c1)Cl)NC(=O)C)Cl 11a_100000074854_100015343762 [0,2,0,0,0,0|1,0,0]=3 8679 B14R1.560 COc1cc(c(c(c1)Cl)NC(=O)C)Cl 1626a_100000074854_100015343762 [0,2,0,0,0,0|1,0,0]=3 8680 B14R1.560 COc1cc(c(c(c1)Cl)NC(=O)C)Cl 22a_100000074854_100000070787 [0,2,0,0,0,0|1,0,0]=3 8681 B14R1.560 COc1cc(c(c(c1)F)C=C(C)C)F 271570a_100102525489_100011218311 [0,2,0,0,0,0|1,0,1]=4 8682 B14R1.560 COc1cc(c(c(c1)F)CC(=O)C)F 1458a_100000062061_200000210301 [0,2,0,0,0,0|0,0,0]=2 8683 B14R1.560 COc1cc(c(c(c1)F)CC(=O)C)F 1458a_100000070787_100011260758 [0,2,0,0,0,0|0,0,0]=2 8684 B14R1.560 COc1cc(c(c(c1)F)CC(=O)[13CH3])F 1458a_100000062061_200025704644 [0,2,0,0,0,0|0,0,0]=2 8685 B14R1.560 COc1cc(c(c(c1)F)CN(C)C)F 2230a_100102631434_100011260758 [0,2,0,0,0,0|2,0,0]=4 8686 B14R1.560 COc1cc(c(c(c1)F)CN(C)C)F 269982a_100102631434_100011260758 [0,2,0,0,0,0|2,0,0]=4 8687 B14R1.560 COc1cc(c(c(c1)F)CN(C)C)F 270004a_100102631434_100011830392 [0,2,0,0,0,0|2,0,0]=4 8688 B14R1.560 COc1cc(c(c(c1)F)NC(=O)C)F 11a_100011383474_100015343762 [0,2,0,0,0,0|1,0,0]=3 8689 B14R1.560 COc1cc(c(c(c1)F)NC(=O)C)F 1626a_100011383474_100015343762 [0,2,0,0,0,0|1,0,0]=3 8690 B14R1.560 COc1cc(c(c(c1)F)NC(=O)C)F 22a_100011383474_100000070787 [0,2,0,0,0,0|1,0,0]=3 8691 B14R1.560 COc1cc(c(c(c1)F)NC(=O)C)F 527a_100011383474_100103153847 [0,2,0,0,0,0|1,0,0]=3 8692 B14R1.560 CSc1cc(c(c(c1)C)OC(=O)C)C 62a_200000210301_200009816532 [0,2,0,0,0,0|1,1,0]=4 8693 B14R1.560 CSc1cc(c(c(c1)C)OC(=O)C)C 62a_200009816532_200000210301 [0,2,0,0,0,0|1,1,0]=4 8694 B12R1.440 C=Cc1cccc(c1C)C(=O)C 271570a_100011290941_100012706834 [0,0,1,1,0,0|1,0,1]=4 8695 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 34a_200009877264_200025704644 [0,0,1,1,0,0|0,0,2]=4 8696 B12R1.440 CC(=O)c1cccc(c1C)O[13CH3] 7a_200009877264_200025704644 [0,0,1,1,0,0|0,0,2]=4 8697 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 34a_100009856408_200025704644 [0,0,1,1,0,0|1,0,1]=4 8698 B12R1.440 CC(=O)c1cccc(c1F)O[13CH3] 7a_100009856408_200025704644 [0,0,1,1,0,0|1,0,1]=4 8699 B12R1.440 CC(=O)c1cccc(c1N)O[13CH3] 7a_100000036053_200025704644 [0,0,1,1,0,0|1,0,1]=4 8700 B12R1.440 COc1cccc(c1Br)C(=O)C 1458a_100010245468_200000210301 [0,0,1,1,0,0|1,0,1]=4 8701 B12R1.440 COc1cccc(c1Br)C(=O)[13CH3] 1458a_100010245468_200025704644 [0,0,1,1,0,0|1,0,1]=4 8702 B12R1.440 COc1cccc(c1C)C(=O)C 1458a_100011217801_200000210301 [0,0,1,1,0,0|0,0,2]=4 8703 B12R1.440 COc1cccc(c1C)C(=O)C 34a_200009877264_200000210301 [0,0,1,1,0,0|0,0,2]=4 8704 B12R1.440 COc1cccc(c1C)C(=O)C 7a_200009877264_200000210301 [0,0,1,1,0,0|0,0,2]=4 8705 B12R1.440 COc1cccc(c1C)C(=O)[13CH3] 1458a_100011217801_200025704644 [0,0,1,1,0,0|0,0,2]=4 8706 B12R1.440 COc1cccc(c1Cl)C(=O)C 1458a_100000068443_200000210301 [0,0,1,1,0,0|1,0,1]=4 8707 B12R1.440 COc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000068443_200025704644 [0,0,1,1,0,0|1,0,1]=4 8708 B12R1.440 COc1cccc(c1F)C(=O)C 1458a_100000766180_200000210301 [0,0,1,1,0,0|1,0,1]=4 8709 B12R1.440 COc1cccc(c1F)C(=O)C 34a_100009856408_200000210301 [0,0,1,1,0,0|1,0,1]=4 8710 B12R1.440 COc1cccc(c1F)C(=O)C 7a_100009856408_200000210301 [0,0,1,1,0,0|1,0,1]=4 8711 B12R1.440 COc1cccc(c1F)C(=O)[13CH3] 1458a_100000766180_200025704644 [0,0,1,1,0,0|1,0,1]=4 8712 B12R1.440 COc1cccc(c1I)C(=O)C 1458a_100010075502_200000210301 [0,0,1,1,0,0|1,0,1]=4 8713 B12R1.440 COc1cccc(c1I)C(=O)[13CH3] 1458a_100010075502_200025704644 [0,0,1,1,0,0|1,0,1]=4 8714 B12R1.440 COc1cccc(c1N)C(=O)C 7a_100000036053_200000210301 [0,0,1,1,0,0|1,0,1]=4 8715 B12R1.440 COc1cccc(c1O)C(=O)C 1458a_100000212136_200000210301 [0,0,1,1,0,0|1,0,1]=4 8716 B12R1.440 COc1cccc(c1O)C(=O)[13CH3] 1458a_100000212136_200025704644 [0,0,1,1,0,0|1,0,1]=4 8717 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,0,1,1,0,0|2,0,0]=4 8718 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,0,1,1,0,0|2,0,0]=4 8719 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,0,1,1,0,0|1,0,1]=4 8720 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,0,1,1,0,0|1,0,1]=4 8721 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,0,1,1,0,0|2,0,0]=4 8722 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,0,1,1,0,0|2,0,0]=4 8723 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,0,1,1,0,0|1,0,1]=4 8724 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100009867868_200025704644 [0,0,1,1,0,0|1,0,1]=4 8725 B12R1.453 CC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100009867868_200025704644 [0,0,1,1,0,0|1,0,1]=4 8726 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 34a_100000091700_200025704644 [0,0,1,1,0,0|1,0,1]=4 8727 B12R1.453 CC(=O)c1cc(ccc1F)O[13CH3] 7a_100000091700_200025704644 [0,0,1,1,0,0|1,0,1]=4 8728 B12R1.453 COc1ccc(c(c1)C(=O)C)Br 1458a_100000211723_200000210301 [0,0,1,1,0,0|1,0,1]=4 8729 B12R1.453 COc1ccc(c(c1)C(=O)C)C 1458a_100011399813_200000210301 [0,0,1,1,0,0|0,0,2]=4 8730 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 1458a_100000763818_200000210301 [0,0,1,1,0,0|1,0,1]=4 8731 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_200000210301 [0,0,1,1,0,0|1,0,1]=4 8732 B12R1.453 COc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_200000210301 [0,0,1,1,0,0|1,0,1]=4 8733 B12R1.453 COc1ccc(c(c1)C(=O)C)F 1458a_100011217016_200000210301 [0,0,1,1,0,0|1,0,1]=4 8734 B12R1.453 COc1ccc(c(c1)C(=O)C)F 34a_100000091700_200000210301 [0,0,1,1,0,0|1,0,1]=4 8735 B12R1.453 COc1ccc(c(c1)C(=O)C)F 7a_100000091700_200000210301 [0,0,1,1,0,0|1,0,1]=4 8736 B12R1.453 COc1ccc(c(c1)C(=O)C)I 1458a_100012339533_200000210301 [0,0,1,1,0,0|1,0,1]=4 8737 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [0,0,1,1,0,0|1,0,1]=4 8738 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [0,0,1,1,0,0|1,0,1]=4 8739 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000211723_200025704644 [0,0,1,1,0,0|1,0,1]=4 8740 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])C 1458a_100011399813_200025704644 [0,0,1,1,0,0|0,0,2]=4 8741 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000763818_200025704644 [0,0,1,1,0,0|1,0,1]=4 8742 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])F 1458a_100011217016_200025704644 [0,0,1,1,0,0|1,0,1]=4 8743 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])I 1458a_100012339533_200025704644 [0,0,1,1,0,0|1,0,1]=4 8744 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [0,0,1,1,0,0|1,0,1]=4 8745 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [1,0,0,1,0,0|1,0,1]=4 8746 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 8747 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 8748 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [1,0,0,1,0,0|2,0,0]=4 8749 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [1,0,0,1,0,0|2,0,0]=4 8750 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [1,0,0,1,0,0|2,0,0]=4 8751 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [1,0,0,1,0,0|1,0,1]=4 8752 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [1,0,0,1,0,0|2,0,0]=4 8753 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [1,0,0,1,0,0|2,0,0]=4 8754 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [1,0,0,1,0,0|2,0,0]=4 8755 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [1,0,0,1,0,0|1,0,1]=4 8756 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [1,0,0,1,0,0|1,1,0]=4 8757 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [1,0,0,1,0,0|1,0,1]=4 8758 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [1,0,0,1,0,0|1,0,0]=3 8759 B12R2.606 O=C1Cc2cc(cnc2N1)O 271570a_203496583355_100010177629 [1,0,0,1,0,0|2,0,0]=4 8760 B12R2.606 O=C1Cc2cc(ncc2N1)O 271570a_203496583355_100000104063 [1,0,0,1,0,0|2,0,0]=4 8761 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [1,0,0,1,0,0|0,0,0]=2 8762 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [1,0,0,1,0,0|1,0,0]=3 8763 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [1,0,0,1,0,0|2,0,0]=4 8764 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [1,0,0,1,0,0|2,0,0]=4 8765 B12R2.606 O=C1Cc2nc(ccc2N1)O 271570a_203496583355_100000087150 [1,0,0,1,0,0|2,0,0]=4 8766 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [1,0,0,1,0,0|2,0,0]=4 8767 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [1,0,0,1,0,0|2,0,0]=4 8768 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [1,0,0,1,0,0|2,0,0]=4 8769 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [1,0,0,1,0,0|2,0,0]=4 8770 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [1,0,0,1,0,0|2,0,0]=4 8771 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [1,0,0,1,0,0|2,0,0]=4 8772 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [1,0,0,1,0,0|0,0,2]=4 8773 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 8774 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 8775 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [1,0,0,1,0,0|2,0,0]=4 8776 B12R2.9 CCc1ccc(cc1)C2CC2 271570a_100011220607_100011215824 [1,0,0,1,0,0|1,0,1]=4 8777 B12R2.9 CNc1ccc(cc1)C2CC2 271570a_100011220607_100000219623 [1,0,0,1,0,0|1,0,1]=4 8778 B12R2.9 CNc1ccc(cc1)C2CC2 34a_100016991203_200000210301 [1,0,0,1,0,0|1,0,1]=4 8779 B12R2.9 COc1ccc(cc1)C2CC2 271570a_100011220607_100000171711 [1,0,0,1,0,0|0,0,1]=3 8780 B12R2.9 COc1ccc(cc1)C2CC2 34a_100011997980_200000210301 [1,0,0,1,0,0|0,0,1]=3 8781 B12R2.9 COc1ccc(cc1)C2CC2 7a_100011997980_200000210301 [1,0,0,1,0,0|0,0,1]=3 8782 B12R2.9 COc1ccc(cn1)C2CC2 271570a_100011220607_100000047065 [1,0,0,1,0,0|1,0,1]=4 8783 B12R2.9 COc1ccc(nc1)C2CC2 271570a_100011220607_100000755202 [1,0,0,1,0,0|1,0,1]=4 8784 B12R2.9 CSc1ccc(cc1)C2CC2 271570a_100011220607_100011263217 [1,0,0,1,0,0|0,1,1]=4 8785 B12R2.9 CSc1ccc(cc1)C2CC2 62a_200000210301_100009820665 [1,0,0,1,0,0|0,1,1]=4 8786 B12R2.9 [13CH3]Nc1ccc(cc1)C2CC2 34a_100016991203_200025704644 [1,0,0,1,0,0|1,0,1]=4 8787 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 34a_100011997980_200025704644 [1,0,0,1,0,0|0,0,1]=3 8788 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 7a_100011997980_200025704644 [1,0,0,1,0,0|0,0,1]=3 8789 B12R2.9 [13CH3]Sc1ccc(cc1)C2CC2 62a_200025704644_100009820665 [1,0,0,1,0,0|0,1,1]=4 8790 B12R2.44 CNc1ccc2c(c1)CCC2 2230a_100000211504_200000210301 [1,0,0,1,0,0|1,0,1]=4 8791 B12R2.44 CNc1ccc2c(c1)CCC2 34a_100000211504_200000210301 [1,0,0,1,0,0|1,0,1]=4 8792 B12R2.44 CNc1ccc2c(c1)COC2 2230a_100011728444_200000210301 [1,0,0,1,0,0|2,0,0]=4 8793 B12R2.44 CNc1ccc2c(c1)COC2 34a_100011728444_200000210301 [1,0,0,1,0,0|2,0,0]=4 8794 B12R2.44 COc1ccc2[nH]ccc2c1 34a_100000756620_200000210301 [1,0,0,1,0,0|1,0,1]=4 8795 B12R2.44 COc1ccc2c(c1)CCC2 34a_100000209987_200000210301 [1,0,0,1,0,0|0,0,1]=3 8796 B12R2.44 COc1ccc2c(c1)CCC2 7a_100000209987_200000210301 [1,0,0,1,0,0|0,0,1]=3 8797 B12R2.44 COc1ccc2c(c1)CCN2 34a_100020636429_200000210301 [1,0,0,1,0,0|1,0,1]=4 8798 B12R2.44 COc1ccc2c(c1)CNC2 34a_100015195982_200000210301 [1,0,0,1,0,0|1,0,0]=3 8799 B12R2.44 COc1ccc2c(c1)NCC2 34a_100020636427_200000210301 [1,0,0,1,0,0|1,0,1]=4 8800 B12R2.44 COc1ccc2cc[nH]c2c1 34a_100000036713_200000210301 [1,0,0,1,0,0|1,0,1]=4 8801 B12R2.44 COc1ccc2ccoc2c1 34a_100000089557_200000210301 [1,0,0,1,0,0|0,0,2]=4 8802 B12R2.44 COc1ccc2ccoc2c1 7a_100000089557_200000210301 [1,0,0,1,0,0|0,0,2]=4 8803 B12R2.44 COc1ccc2ncsc2c1 34a_100011995850_200000210301 [1,0,0,1,0,0|1,1,0]=4 8804 B12R2.44 COc1ccc2ncsc2c1 7a_100011995850_200000210301 [1,0,0,1,0,0|1,1,0]=4 8805 B12R2.44 COc1ccc2occc2c1 34a_100000070125_200000210301 [1,0,0,1,0,0|1,0,1]=4 8806 B12R2.44 COc1ccc2occc2c1 7a_100000070125_200000210301 [1,0,0,1,0,0|1,0,1]=4 8807 B12R2.44 COc1ccc2sccc2c1 34a_100012180905_200000210301 [1,0,0,1,0,0|1,0,1]=4 8808 B12R2.44 COc1ccc2sccc2c1 7a_100012180905_200000210301 [1,0,0,1,0,0|1,0,1]=4 8809 B12R2.44 COc1ccc2scnc2c1 34a_200009850626_200000210301 [1,0,0,1,0,0|2,0,0]=4 8810 B12R2.44 COc1ccc2scnc2c1 7a_200009850626_200000210301 [1,0,0,1,0,0|2,0,0]=4 8811 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_100009814306_200000210301 [1,0,0,1,0,0|0,1,1]=4 8812 B12R2.44 CSc1ccc2c(c1)C=CC2 62a_200000210301_100009814306 [1,0,0,1,0,0|0,1,1]=4 8813 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200000210301_200009818231 [1,0,0,1,0,0|0,1,1]=4 8814 B12R2.44 CSc1ccc2c(c1)CC=C2 62a_200009818231_200000210301 [1,0,0,1,0,0|0,1,1]=4 8815 B12R2.44 CSc1ccc2c(c1)CCC2 62a_100000745594_200000210301 [1,0,0,1,0,0|0,1,1]=4 8816 B12R2.44 CSc1ccc2c(c1)CCC2 62a_200000210301_100000745594 [1,0,0,1,0,0|0,1,1]=4 8817 B12R2.44 CSc1ccc2c(c1)CNC2 62a_100000702344_200000210301 [1,0,0,1,0,0|1,1,0]=4 8818 B12R2.44 CSc1ccc2c(c1)CNC2 62a_200000210301_100000702344 [1,0,0,1,0,0|1,1,0]=4 8819 B12R2.44 CSc1ccc2c(c1)COC2 62a_100000698232_200000210301 [1,0,0,1,0,0|1,1,0]=4 8820 B12R2.44 CSc1ccc2c(c1)COC2 62a_200000210301_100000698232 [1,0,0,1,0,0|1,1,0]=4 8821 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 2230a_100000211504_200025704644 [1,0,0,1,0,0|1,0,1]=4 8822 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 34a_100000211504_200025704644 [1,0,0,1,0,0|1,0,1]=4 8823 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 2230a_100011728444_200025704644 [1,0,0,1,0,0|2,0,0]=4 8824 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 34a_100011728444_200025704644 [1,0,0,1,0,0|2,0,0]=4 8825 B12R2.44 [13CH3]Oc1ccc2[nH]ccc2c1 34a_100000756620_200025704644 [1,0,0,1,0,0|1,0,1]=4 8826 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 34a_100000209987_200025704644 [1,0,0,1,0,0|0,0,1]=3 8827 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 7a_100000209987_200025704644 [1,0,0,1,0,0|0,0,1]=3 8828 B12R2.44 [13CH3]Oc1ccc2c(c1)CCN2 34a_100020636429_200025704644 [1,0,0,1,0,0|1,0,1]=4 8829 B12R2.44 [13CH3]Oc1ccc2c(c1)CNC2 34a_100015195982_200025704644 [1,0,0,1,0,0|1,0,0]=3 8830 B12R2.44 [13CH3]Oc1ccc2c(c1)NCC2 34a_100020636427_200025704644 [1,0,0,1,0,0|1,0,1]=4 8831 B12R2.44 [13CH3]Oc1ccc2cc[nH]c2c1 34a_100000036713_200025704644 [1,0,0,1,0,0|1,0,1]=4 8832 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 34a_100000089557_200025704644 [1,0,0,1,0,0|0,0,2]=4 8833 B12R2.44 [13CH3]Oc1ccc2ccoc2c1 7a_100000089557_200025704644 [1,0,0,1,0,0|0,0,2]=4 8834 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 34a_100011995850_200025704644 [1,0,0,1,0,0|1,1,0]=4 8835 B12R2.44 [13CH3]Oc1ccc2ncsc2c1 7a_100011995850_200025704644 [1,0,0,1,0,0|1,1,0]=4 8836 B12R2.44 [13CH3]Oc1ccc2occc2c1 34a_100000070125_200025704644 [1,0,0,1,0,0|1,0,1]=4 8837 B12R2.44 [13CH3]Oc1ccc2occc2c1 7a_100000070125_200025704644 [1,0,0,1,0,0|1,0,1]=4 8838 B12R2.44 [13CH3]Oc1ccc2sccc2c1 34a_100012180905_200025704644 [1,0,0,1,0,0|1,0,1]=4 8839 B12R2.44 [13CH3]Oc1ccc2sccc2c1 7a_100012180905_200025704644 [1,0,0,1,0,0|1,0,1]=4 8840 B12R2.44 [13CH3]Oc1ccc2scnc2c1 34a_200009850626_200025704644 [1,0,0,1,0,0|2,0,0]=4 8841 B12R2.44 [13CH3]Oc1ccc2scnc2c1 7a_200009850626_200025704644 [1,0,0,1,0,0|2,0,0]=4 8842 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_100009814306_200025704644 [1,0,0,1,0,0|0,1,1]=4 8843 B12R2.44 [13CH3]Sc1ccc2c(c1)C=CC2 62a_200025704644_100009814306 [1,0,0,1,0,0|0,1,1]=4 8844 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200009818231_200025704644 [1,0,0,1,0,0|0,1,1]=4 8845 B12R2.44 [13CH3]Sc1ccc2c(c1)CC=C2 62a_200025704644_200009818231 [1,0,0,1,0,0|0,1,1]=4 8846 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_100000745594_200025704644 [1,0,0,1,0,0|0,1,1]=4 8847 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_200025704644_100000745594 [1,0,0,1,0,0|0,1,1]=4 8848 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_100000702344_200025704644 [1,0,0,1,0,0|1,1,0]=4 8849 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_200025704644_100000702344 [1,0,0,1,0,0|1,1,0]=4 8850 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_100000698232_200025704644 [1,0,0,1,0,0|1,1,0]=4 8851 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_200025704644_100000698232 [1,0,0,1,0,0|1,1,0]=4 8852 B12R2.143 CC=Cc1ccc2c(c1)CC2 271570a_100016259895_100009818592 [1,0,0,1,0,0|1,0,1]=4 8853 B12R2.143 CNCc1ccc2c(c1)CC2 207a_100102657272_100010273998 [1,0,0,1,0,0|2,0,0]=4 8854 B12R2.143 CNCc1ccc2c(c1)CC2 270004a_106832991635_100010273998 [1,0,0,1,0,0|2,0,0]=4 8855 B12R2.143 COCc1ccc2c(c1)CC2 34a_100010733339_200000210301 [1,0,0,1,0,0|2,0,0]=4 8856 B12R2.143 COCc1ccc2c(c1)CC2 7a_100010733339_200000210301 [1,0,0,1,0,0|2,0,0]=4 8857 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 34a_100010733339_200025704644 [1,0,0,1,0,0|2,0,0]=4 8858 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 7a_100010733339_200025704644 [1,0,0,1,0,0|2,0,0]=4 8859 B12R2.1384 C=C(C)c1ccc2c(c1)CC2 271570a_100000694244_100009818592 [0,0,0,1,1,0|2,0,0]=4 8860 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [0,0,0,1,1,0|1,0,0]=3 8861 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [0,0,0,1,1,0|1,0,0]=3 8862 B14R2.27 C=Cc1ccc(cc1)C2CC(=O)C2 271570a_100011290941_100000741321 [0,0,0,1,0,1|1,0,1]=4 8863 B14R2.27 CSc1ccc(cc1)C2CC(=O)C2 62a_100000741321_200000210301 [0,0,0,1,0,1|0,1,0]=3 8864 B14R2.27 CSc1ccc(cc1)C2CC(=O)C2 62a_200000210301_100000741321 [0,0,0,1,0,1|0,1,0]=3 8865 B14R2.27 [13CH3]Sc1ccc(cc1)C2CC(=O)C2 62a_100000741321_200025704644 [0,0,0,1,0,1|0,1,0]=3 8866 B14R2.27 [13CH3]Sc1ccc(cc1)C2CC(=O)C2 62a_200025704644_100000741321 [0,0,0,1,0,1|0,1,0]=3 8867 B14R2.134 C=Cc1ccc2c(c1)CC(=O)CC2 271570a_100011290941_100010138410 [0,0,0,1,0,1|1,0,1]=4 8868 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200000210301 [0,0,0,1,0,1|2,0,0]=4 8869 B14R2.134 CNc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200000210301 [0,0,0,1,0,1|2,0,0]=4 8870 B14R2.134 CNc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200000210301 [0,0,0,1,0,1|2,0,0]=4 8871 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200000210301 [0,0,0,1,0,1|0,0,0]=2 8872 B14R2.134 COc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200000210301 [0,0,0,1,0,1|0,0,0]=2 8873 B14R2.134 COc1ccc2c(c1)CN(CC2)C 2230a_100015207042_200000210301 [0,0,0,1,0,1|2,0,0]=4 8874 B14R2.134 COc1ccc2c(c1)CN(CC2)C 269982a_100015207042_200000210301 [0,0,0,1,0,1|2,0,0]=4 8875 B14R2.134 COc1ccc2c(c1)CN(CC2)C 34a_100015207042_200000210301 [0,0,0,1,0,1|2,0,0]=4 8876 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 2230a_100015207042_200025704644 [0,0,0,1,0,1|2,0,0]=4 8877 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 269982a_100015207042_200025704644 [0,0,0,1,0,1|2,0,0]=4 8878 B14R2.134 COc1ccc2c(c1)CN(CC2)[13CH3] 34a_100015207042_200025704644 [0,0,0,1,0,1|2,0,0]=4 8879 B14R2.134 COc1ccc2c(c1)C[C@@H](CC2)N 34a_100015730448_200000210301 [0,0,0,1,0,1|1,0,1]=4 8880 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200000210301 [0,0,0,1,0,1|1,0,0]=3 8881 B14R2.134 COc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200000210301 [0,0,0,1,0,1|1,0,0]=3 8882 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200000210301 [0,0,0,1,0,1|1,0,0]=3 8883 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [0,0,0,1,0,1|1,0,1]=4 8884 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [0,0,0,1,0,1|1,0,1]=4 8885 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [0,0,0,1,0,1|1,0,1]=4 8886 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [0,0,0,1,0,1|1,0,1]=4 8887 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [0,0,0,1,0,1|1,0,1]=4 8888 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [0,0,0,1,0,1|1,0,1]=4 8889 B14R2.134 CSc1ccc2c(c1)CC(=O)CC2 62a_100010138410_200000210301 [0,0,0,1,0,1|0,1,0]=3 8890 B14R2.134 CSc1ccc2c(c1)CC(=O)CC2 62a_200000210301_100010138410 [0,0,0,1,0,1|0,1,0]=3 8891 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200000210301 [0,0,0,1,0,1|1,1,0]=4 8892 B14R2.134 CSc1ccc2c(c1)NC(=O)CC2 62a_200000210301_100000763451 [0,0,0,1,0,1|1,1,0]=4 8893 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200000210301 [0,0,0,1,0,1|1,1,0]=4 8894 B14R2.134 CSc1ccc2c(c1)NC(=O)NC2 62a_200000210301_100010161048 [0,0,0,1,0,1|1,1,0]=4 8895 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [0,0,0,1,0,1|1,0,1]=4 8896 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [0,0,0,1,0,1|1,0,1]=4 8897 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [0,0,0,1,0,1|1,0,1]=4 8898 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [0,0,0,1,0,1|1,0,1]=4 8899 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 2230a_100000055022_200025704644 [0,0,0,1,0,1|2,0,0]=4 8900 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CC2 34a_100000055022_200025704644 [0,0,0,1,0,1|2,0,0]=4 8901 B14R2.134 [13CH3]Nc1ccc2c(c1)NC(=O)CO2 2230a_100000230169_200025704644 [0,0,0,1,0,1|2,0,0]=4 8902 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 34a_200000081095_200025704644 [0,0,0,1,0,1|0,0,0]=2 8903 B14R2.134 [13CH3]Oc1ccc2c(c1)CC(=O)CC2 7a_200000081095_200025704644 [0,0,0,1,0,1|0,0,0]=2 8904 B14R2.134 [13CH3]Oc1ccc2c(c1)C[C@@H](CC2)N 34a_100015730448_200025704644 [0,0,0,1,0,1|1,0,1]=4 8905 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CC2 34a_100000708604_200025704644 [0,0,0,1,0,1|1,0,0]=3 8906 B14R2.134 [13CH3]Oc1ccc2c(c1)NC(=O)CO2 34a_100009876821_200025704644 [0,0,0,1,0,1|1,0,0]=3 8907 B14R2.134 [13CH3]Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200025704644 [0,0,0,1,0,1|1,0,0]=3 8908 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [0,0,0,1,0,1|1,0,1]=4 8909 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [0,0,0,1,0,1|1,0,1]=4 8910 B14R2.134 [13CH3]Sc1ccc2c(c1)CC(=O)CC2 62a_100010138410_200025704644 [0,0,0,1,0,1|0,1,0]=3 8911 B14R2.134 [13CH3]Sc1ccc2c(c1)CC(=O)CC2 62a_200025704644_100010138410 [0,0,0,1,0,1|0,1,0]=3 8912 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_100000763451_200025704644 [0,0,0,1,0,1|1,1,0]=4 8913 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)CC2 62a_200025704644_100000763451 [0,0,0,1,0,1|1,1,0]=4 8914 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_100010161048_200025704644 [0,0,0,1,0,1|1,1,0]=4 8915 B14R2.134 [13CH3]Sc1ccc2c(c1)NC(=O)NC2 62a_200025704644_100010161048 [0,0,0,1,0,1|1,1,0]=4 8916 B14R2.328 COc1ccc(cc1)CNC2CC2 34a_100000185587_100000211595 [0,0,0,1,0,1|1,0,1]=4 8917 B14R2.328 COc1ccc(cc1)CNC2CC2 34a_100000212008_100000742318 [0,0,0,1,0,1|1,0,1]=4 8918 B14R2.328 COc1ccc(cc1)COC2CC2 34a_100000173359_100000211595 [0,0,0,1,0,1|1,0,1]=4 8919 B14R2.328 COc1ccc(cc1)NCC2CC2 34a_100000184247_100000742324 [0,0,0,1,0,1|1,0,1]=4 8920 B14R2.328 COc1ccc(cc1)NCC2CO2 34a_100000184247_102125554688 [0,0,0,1,0,1|0,0,2]=4 8921 B14R2.328 COc1ccc(cc1)OCC2CC2 34a_100000210503_100000742324 [0,0,0,1,0,1|1,0,1]=4 8922 B14R2.328 COc1ccc(cc1)OCC2CO2 34a_100000210503_102125554688 [0,0,0,1,0,1|0,0,2]=4 8923 B14R2.328 COc1ccc(cc1)SCC2CC2 62a_100000756562_100000171711 [0,0,0,1,0,1|1,0,1]=4 8924 B14R2.328 COc1ccc(cc1)SCC2CO2 62a_102125554688_100000171711 [0,0,0,1,0,1|0,0,2]=4 8925 B14R2.328 COc1ccc(cc1)SCC2CS2 62a_100000031435_100000171711 [0,0,0,1,0,1|0,1,1]=4 8926 B14R2.328 COc1ccc(cc1)SC[C@@H]2CO2 62a_100000745022_100000171711 [0,0,0,1,0,1|0,0,2]=4 8927 B14R2.1264 C=C(C)CSc1ccc2c(c1)CC2 62a_100000748629_100009818592 [0,0,0,1,0,1|2,0,0]=4 8928 B14R2.1264 C=C(C)CSc1ccc2c(c1)CC2 62a_100009818592_100000211660 [0,0,0,1,0,1|2,0,0]=4 8929 B14R2.1264 NC(=O)CSc1ccc2c(c1)CC2 62a_100000747473_100009818592 [0,0,0,1,0,1|2,0,0]=4 8930 B14R2.1264 NC(=O)CSc1ccc2c(c1)CC2 62a_100009818592_100000747473 [0,0,0,1,0,1|2,0,0]=4 8931 B14R2.1264 O=C([O-])CSc1ccc2c(c1)CC2 62a_100009818592_100020667443 [0,0,0,1,0,1|2,0,0]=4 8932 B14R2.1264 O=C([O-])CSc1ccc2c(c1)CC2 62a_100020667443_100009818592 [0,0,0,1,0,1|2,0,0]=4 8933 B14R2.26 CN[C@@H]1C[C@H]1c2ccc(cc2)OC 2230a_100102558531_200000210301 [0,1,0,1,0,0|1,0,1]=4 8934 B14R2.26 CN[C@@H]1C[C@H]1c2ccc(cc2)OC 34a_100102558531_200000210301 [0,1,0,1,0,0|1,0,1]=4 8935 B14R2.26 COc1ccc(cc1)[C@@H]2C[C@H]2N[13CH3] 2230a_100102558531_200025704644 [0,1,0,1,0,0|1,0,1]=4 8936 B14R2.26 COc1ccc(cc1)[C@@H]2C[C@H]2N[13CH3] 34a_100102558531_200025704644 [0,1,0,1,0,0|1,0,1]=4 8937 B14R2.331 COc1ccc(cc1)CN2CCC2 269982a_100000754969_100000742318 [0,1,0,1,0,0|2,0,0]=4 8938 B14R2.331 COc1ccc(cc1)CN2CCC2 26a_100000754969_100000210503 [0,1,0,1,0,0|2,0,0]=4 8939 B14R2.2332 C=Cc1ccc2c(c1)CCC(=O)C2 271570a_100011290941_100000753102 [0,1,0,1,0,0|1,0,1]=4 8940 B14R2.2332 C=Cc1ccc2c(c1)CNC(=O)C2 271570a_100011290941_100010174877 [0,1,0,1,0,0|1,0,1]=4 8941 B14R2.2332 CN1CCc2cc(ccc2C1)O[13CH3] 34a_200009882110_200025704644 [0,1,0,1,0,0|2,0,0]=4 8942 B14R2.2332 CNc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200000210301 [0,1,0,1,0,0|2,0,0]=4 8943 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200000210301 [0,1,0,1,0,0|0,0,0]=2 8944 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200000210301 [0,1,0,1,0,0|0,0,0]=2 8945 B14R2.2332 COc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200000210301 [0,1,0,1,0,0|1,0,0]=3 8946 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 2230a_100015189960_200000210301 [0,1,0,1,0,0|2,0,0]=4 8947 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 269982a_100015189960_200000210301 [0,1,0,1,0,0|2,0,0]=4 8948 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_100015189960_200000210301 [0,1,0,1,0,0|2,0,0]=4 8949 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_200009882110_200000210301 [0,1,0,1,0,0|2,0,0]=4 8950 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 2230a_100015189960_200025704644 [0,1,0,1,0,0|2,0,0]=4 8951 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 269982a_100015189960_200025704644 [0,1,0,1,0,0|2,0,0]=4 8952 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 34a_100015189960_200025704644 [0,1,0,1,0,0|2,0,0]=4 8953 B14R2.2332 COc1ccc2cc(ccc2c1)C 34a_100000074090_200000210301 [0,1,0,1,0,0|1,0,1]=4 8954 B14R2.2332 COc1ccc2cc(ccc2c1)C 7a_100000074090_200000210301 [0,1,0,1,0,0|1,0,1]=4 8955 B14R2.2332 COc1ccc2nc(ccc2c1)C 34a_100000037634_200000210301 [0,1,0,1,0,0|2,0,0]=4 8956 B14R2.2332 COc1ccc2nc(ccc2c1)C 7a_100000037634_200000210301 [0,1,0,1,0,0|2,0,0]=4 8957 B14R2.2332 COc1ccc2oc(=O)ccc2c1 34a_100000066265_200000210301 [0,1,0,1,0,0|1,0,1]=4 8958 B14R2.2332 COc1ccc2oc(=O)ccc2c1 7a_100000066265_200000210301 [0,1,0,1,0,0|1,0,1]=4 8959 B14R2.2332 CSc1ccc2c(c1)CCC(=O)C2 62a_100000753102_200000210301 [0,1,0,1,0,0|0,1,0]=3 8960 B14R2.2332 CSc1ccc2c(c1)CCC(=O)C2 62a_200000210301_100000753102 [0,1,0,1,0,0|0,1,0]=3 8961 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200000210301 [0,1,0,1,0,0|1,1,0]=4 8962 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_200000210301_100000754843 [0,1,0,1,0,0|1,1,0]=4 8963 B14R2.2332 CSc1ccc2c(c1)CCC(=O)O2 62a_100010179853_200000210301 [0,1,0,1,0,0|1,1,0]=4 8964 B14R2.2332 CSc1ccc2c(c1)CCC(=O)O2 62a_200000210301_100010179853 [0,1,0,1,0,0|1,1,0]=4 8965 B14R2.2332 CSc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200000210301 [0,1,0,1,0,0|0,1,0]=3 8966 B14R2.2332 CSc1ccc2c(c1)CNC(=O)N2 62a_200000210301_100010171468 [0,1,0,1,0,0|1,1,0]=4 8967 B14R2.2332 CSc1ccc2c(c1)NCC(=O)N2 62a_200000210301_100000693460 [0,1,0,1,0,0|1,1,0]=4 8968 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 34a_100000074090_200025704644 [0,1,0,1,0,0|1,0,1]=4 8969 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 7a_100000074090_200025704644 [0,1,0,1,0,0|1,0,1]=4 8970 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 34a_100000037634_200025704644 [0,1,0,1,0,0|2,0,0]=4 8971 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 7a_100000037634_200025704644 [0,1,0,1,0,0|2,0,0]=4 8972 B14R2.2332 [13CH3]Nc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200025704644 [0,1,0,1,0,0|2,0,0]=4 8973 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200025704644 [0,1,0,1,0,0|0,0,0]=2 8974 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200025704644 [0,1,0,1,0,0|0,0,0]=2 8975 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200025704644 [0,1,0,1,0,0|1,0,0]=3 8976 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 34a_100000066265_200025704644 [0,1,0,1,0,0|1,0,1]=4 8977 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 7a_100000066265_200025704644 [0,1,0,1,0,0|1,0,1]=4 8978 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)C2 62a_100000753102_200025704644 [0,1,0,1,0,0|0,1,0]=3 8979 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)C2 62a_200025704644_100000753102 [0,1,0,1,0,0|0,1,0]=3 8980 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200025704644 [0,1,0,1,0,0|1,1,0]=4 8981 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_200025704644_100000754843 [0,1,0,1,0,0|1,1,0]=4 8982 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)O2 62a_100010179853_200025704644 [0,1,0,1,0,0|1,1,0]=4 8983 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)O2 62a_200025704644_100010179853 [0,1,0,1,0,0|1,1,0]=4 8984 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200025704644 [0,1,0,1,0,0|0,1,0]=3 8985 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)N2 62a_200025704644_100010171468 [0,1,0,1,0,0|1,1,0]=4 8986 B14R2.2332 [13CH3]Sc1ccc2c(c1)NCC(=O)N2 62a_200025704644_100000693460 [0,1,0,1,0,0|1,1,0]=4 8987 B14R2.3274 C=Cc1ccc2c(c1)N(C(=O)C2)C 271570a_100011290941_100010285470 [0,1,0,1,0,0|1,0,1]=4 8988 B14R2.3274 CC1C(=O)Nc2c1cc(cc2)S[13CH3] 62a_200025704644_100010251565 [0,1,0,1,0,0|1,1,0]=4 8989 B14R2.3274 CC1Cc2ccc(cc2C1=O)S[13CH3] 62a_100000694082_200025704644 [0,1,0,1,0,0|0,1,1]=4 8990 B14R2.3274 CC1Cc2ccc(cc2C1=O)S[13CH3] 62a_200025704644_100000694082 [0,1,0,1,0,0|0,1,1]=4 8991 B14R2.3274 CN1C(=O)Cc2c1cc(cc2)S[13CH3] 62a_200025704644_100010285470 [0,1,0,1,0,0|0,1,0]=3 8992 B14R2.3274 CN1Cc2ccc(cc2C1=O)N[13CH3] 34a_100012186466_200025704644 [0,1,0,1,0,0|2,0,0]=4 8993 B14R2.3274 CN1Cc2ccc(cc2C1=O)O[13CH3] 34a_100010264224_200025704644 [0,1,0,1,0,0|1,0,0]=3 8994 B14R2.3274 CN1Cc2ccc(cc2C1=O)O[13CH3] 7a_100010264224_200025704644 [0,1,0,1,0,0|1,0,0]=3 8995 B14R2.3274 CN1Cc2ccc(cc2C1=O)S[13CH3] 62a_100010125600_200025704644 [0,1,0,1,0,0|1,1,0]=4 8996 B14R2.3274 CNc1ccc2c(c1)C(=O)N(C2)C 34a_100012186466_200000210301 [0,1,0,1,0,0|2,0,0]=4 8997 B14R2.3274 COc1ccc2c(c1)C(=O)N(C2)C 34a_100010264224_200000210301 [0,1,0,1,0,0|1,0,0]=3 8998 B14R2.3274 COc1ccc2c(c1)C(=O)N(C2)C 7a_100010264224_200000210301 [0,1,0,1,0,0|1,0,0]=3 8999 B14R2.3274 CSc1ccc2c(c1)C(=O)C(C2)C 62a_100000694082_200000210301 [0,1,0,1,0,0|0,1,1]=4 9000 B14R2.3274 CSc1ccc2c(c1)C(=O)C(C2)C 62a_200000210301_100000694082 [0,1,0,1,0,0|0,1,1]=4 9001 B14R2.3274 CSc1ccc2c(c1)C(=O)N(C2)C 62a_100010125600_200000210301 [0,1,0,1,0,0|1,1,0]=4 9002 B14R2.3274 CSc1ccc2c(c1)C(C(=O)N2)C 62a_200000210301_100010251565 [0,1,0,1,0,0|1,1,0]=4 9003 B14R2.3274 CSc1ccc2c(c1)N(C(=O)C2)C 62a_200000210301_100010285470 [0,1,0,1,0,0|0,1,0]=3 9004 B14R2.3304 CCN1Cc2ccc(cc2C1)OC 269982a_100000051402_100000204670 [0,1,0,1,0,0|2,0,0]=4 9005 B14R2.3304 CCN1Cc2ccc(cc2C1)OC 34a_100000051402_100000210202 [0,1,0,1,0,0|2,0,0]=4 9006 B14R2.3304 CNc1nc2ccc(cc2s1)OC 27a_100102657272_100010195960 [0,1,0,1,0,0|1,1,0]=4 9007 B14R2.3304 COc1ccc2c(c1)CN(C2)CF 269982a_100000051402_100015361967 [0,1,0,1,0,0|2,0,0]=4 9008 B14R2.3304 COc1ccc2c(c1)CN(C2)CF 34a_100000051402_100015361967 [0,1,0,1,0,0|2,0,0]=4 9009 B14R2.3304 COc1ccc2nc(sc2c1)SC 62a_200000210301_100010195960 [0,1,0,1,0,0|1,1,0]=4 9010 B14R2.3304 COc1ccc2nc(sc2c1)SC 7a_100009853011_200000210301 [0,1,0,1,0,0|1,1,0]=4 9011 B14R2.3304 COc1ccc2nc(sc2c1)S[13CH3] 62a_200025704644_100010195960 [0,1,0,1,0,0|1,1,0]=4 9012 B14R2.3304 CSc1nc2ccc(cc2s1)O[13CH3] 7a_100009853011_200025704644 [0,1,0,1,0,0|1,1,0]=4 9013 B14R2.1008 CC(=Cc1ccc2c(c1)CCO2)C 271570a_100102525489_100000729065 [0,1,0,1,0,0|1,0,1]=4 9014 B14R2.1008 CC(=Cc1ccc2c(c1)COC2)C 271570a_100102525489_100000698232 [0,1,0,1,0,0|1,0,1]=4 9015 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,1,0,1,0,0|1,0,1]=4 9016 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,1,0,1,0,0|0,0,0]=2 9017 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,1,0,1,0,0|0,0,0]=2 9018 B14R2.1008 CC(=O)Cc1ccc2cc[nH]c2c1 1458a_100000094508_200000210301 [0,1,0,1,0,0|1,0,1]=4 9019 B14R2.1008 CC(=O)Cc1ccc2cn[nH]c2c1 1458a_100000070787_100020605281 [0,1,0,1,0,0|2,0,0]=4 9020 B14R2.1008 CC(=O)Cc1ccc2nc[nH]c2c1 1458a_100000055147_200000210301 [0,1,0,1,0,0|1,0,1]=4 9021 B14R2.1008 CC(=O)Cc1ccc2ncoc2c1 1458a_100000070787_106359897996 [0,1,0,1,0,0|1,0,1]=4 9022 B14R2.1008 CC(=O)Cc1ccc2ncsc2c1 1458a_100000070787_100009847474 [0,1,0,1,0,0|1,0,1]=4 9023 B14R2.1008 CC(=O)Cc1ccc2nonc2c1 1458a_100000070787_100000733437 [0,1,0,1,0,0|1,0,0]=3 9024 B14R2.1008 CC(=O)Cc1ccc2nsnc2c1 1458a_100000070787_100000187484 [0,1,0,1,0,0|1,1,0]=4 9025 B14R2.1008 CC(=O)Cc1ccc2occc2c1 1458a_100000096804_200000210301 [0,1,0,1,0,0|0,0,1]=3 9026 B14R2.1008 CC(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200000210301 [0,1,0,1,0,0|0,0,1]=3 9027 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100015343762 [0,1,0,1,0,0|2,0,0]=4 9028 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100015343762 [0,1,0,1,0,0|2,0,0]=4 9029 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000070787 [0,1,0,1,0,0|2,0,0]=4 9030 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100103153847 [0,1,0,1,0,0|2,0,0]=4 9031 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [0,1,0,1,0,0|1,0,0]=3 9032 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [0,1,0,1,0,0|1,0,0]=3 9033 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [0,1,0,1,0,0|1,0,0]=3 9034 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [0,1,0,1,0,0|1,0,0]=3 9035 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 11a_100011728444_100015343762 [0,1,0,1,0,0|1,0,0]=3 9036 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 1626a_100011728444_100015343762 [0,1,0,1,0,0|1,0,0]=3 9037 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 22a_100011728444_100000070787 [0,1,0,1,0,0|1,0,0]=3 9038 B14R2.1008 CC(=O)Nc1ccc2c(c1)COC2 527a_100011728444_100103153847 [0,1,0,1,0,0|1,0,0]=3 9039 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,1,0,1,0,0|1,0,0]=3 9040 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,1,0,1,0,0|1,0,0]=3 9041 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,1,0,1,0,0|1,0,0]=3 9042 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,1,0,1,0,0|1,0,0]=3 9043 B14R2.1008 CC(=O)Nc1ccc2occc2c1 11a_106430523501_100015343762 [0,1,0,1,0,0|1,0,1]=4 9044 B14R2.1008 CC(=O)Nc1ccc2occc2c1 1626a_106430523501_100015343762 [0,1,0,1,0,0|1,0,1]=4 9045 B14R2.1008 CC(=O)Nc1ccc2occc2c1 22a_106430523501_100000070787 [0,1,0,1,0,0|1,0,1]=4 9046 B14R2.1008 CC(=O)Nc1ccc2occc2c1 527a_106430523501_100103153847 [0,1,0,1,0,0|1,0,1]=4 9047 B14R2.1008 CC(=O)Nc1ccc2ocnc2c1 11a_100011219863_100015343762 [0,1,0,1,0,0|1,0,1]=4 9048 B14R2.1008 CC(=O)Nc1ccc2ocnc2c1 1626a_100011219863_100015343762 [0,1,0,1,0,0|1,0,1]=4 9049 B14R2.1008 CC(=O)Nc1ccc2ocnc2c1 527a_100011219863_100103153847 [0,1,0,1,0,0|1,0,1]=4 9050 B14R2.1008 CC(=O)Nc1ccc2oncc2c1 11a_100000037595_100015343762 [0,1,0,1,0,0|1,0,1]=4 9051 B14R2.1008 CC(=O)Nc1ccc2oncc2c1 1626a_100000037595_100015343762 [0,1,0,1,0,0|1,0,1]=4 9052 B14R2.1008 CN(C)Cc1ccc2c(c1)CCO2 270004a_100102631434_100011218456 [0,1,0,1,0,0|2,0,0]=4 9053 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [0,1,0,1,0,0|2,0,0]=4 9054 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [0,1,0,1,0,0|2,0,0]=4 9055 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [0,1,0,1,0,0|2,0,0]=4 9056 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [0,1,0,1,0,0|2,0,0]=4 9057 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [0,1,0,1,0,0|2,0,0]=4 9058 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,1,0,1,0,0|0,0,0]=2 9059 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,1,0,1,0,0|0,0,0]=2 9060 B14R2.1008 [13CH3]C(=O)Cc1ccc2cc[nH]c2c1 1458a_100000094508_200025704644 [0,1,0,1,0,0|1,0,1]=4 9061 B14R2.1008 [13CH3]C(=O)Cc1ccc2nc[nH]c2c1 1458a_100000055147_200025704644 [0,1,0,1,0,0|1,0,1]=4 9062 B14R2.1008 [13CH3]C(=O)Cc1ccc2occc2c1 1458a_100000096804_200025704644 [0,1,0,1,0,0|0,0,1]=3 9063 B14R2.1008 [13CH3]C(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200025704644 [0,1,0,1,0,0|0,0,1]=3 9064 B14R2.1197 CSc1cc2c(cc1C)NC(=O)C2 62a_200000210301_100010201617 [0,1,0,1,0,0|1,1,0]=4 9065 B14R2.1197 CSc1cc2c(cc1Cl)NC(=O)C2 62a_200000210301_100012929135 [0,1,0,1,0,0|1,1,0]=4 9066 B14R2.1197 CSc1cc2c(cc1F)CC(=O)N2 62a_200000210301_200010218348 [0,1,0,1,0,0|1,1,0]=4 9067 B14R2.1197 CSc1cc2c(cc1F)NC(=O)C2 62a_200000210301_100000727509 [0,1,0,1,0,0|1,1,0]=4 9068 B14R2.1197 Cc1cc2c(cc1S[13CH3])CC(=O)N2 62a_200025704644_100010201617 [0,1,0,1,0,0|1,1,0]=4 9069 B14R2.1197 [13CH3]Sc1cc2c(cc1Cl)NC(=O)C2 62a_200025704644_100012929135 [0,1,0,1,0,0|1,1,0]=4 9070 B14R2.1197 [13CH3]Sc1cc2c(cc1F)CC(=O)N2 62a_200025704644_200010218348 [0,1,0,1,0,0|1,1,0]=4 9071 B14R2.1197 [13CH3]Sc1cc2c(cc1F)NC(=O)C2 62a_200025704644_100000727509 [0,1,0,1,0,0|1,1,0]=4 9072 B14R2.3302 COc1ccc2[nH]c(cc2c1F)C 34a_100000085321_200000210301 [0,1,0,1,0,0|2,0,0]=4 9073 B14R2.3302 COc1ccc2[nH]c(cc2c1F)C 7a_100000085321_200000210301 [0,1,0,1,0,0|2,0,0]=4 9074 B14R2.3302 COc1ccc2c(c1F)CN(C2)C 2230a_200025707880_200000210301 [0,1,0,1,0,0|2,0,0]=4 9075 B14R2.3302 COc1ccc2c(c1F)CN(C2)C 269982a_200025707880_200000210301 [0,1,0,1,0,0|2,0,0]=4 9076 B14R2.3302 COc1ccc2c(c1F)CN(C2)C 34a_200025707880_200000210301 [0,1,0,1,0,0|2,0,0]=4 9077 B14R2.3302 COc1ccc2c(c1F)CN(C2)[13CH3] 2230a_200025707880_200025704644 [0,1,0,1,0,0|2,0,0]=4 9078 B14R2.3302 COc1ccc2c(c1F)CN(C2)[13CH3] 269982a_200025707880_200025704644 [0,1,0,1,0,0|2,0,0]=4 9079 B14R2.3302 COc1ccc2c(c1F)CN(C2)[13CH3] 34a_200025707880_200025704644 [0,1,0,1,0,0|2,0,0]=4 9080 B14R2.3302 Cc1cc2c(c(ccc2[nH]1)O[13CH3])F 34a_100000085321_200025704644 [0,1,0,1,0,0|2,0,0]=4 9081 B14R2.3302 Cc1cc2c(c(ccc2[nH]1)O[13CH3])F 7a_100000085321_200025704644 [0,1,0,1,0,0|2,0,0]=4 9082 B14R2.1815 CC1C(=O)Nc2c1ccc(c2)S[13CH3] 62a_200025704644_100010201481 [0,1,0,1,0,0|1,1,0]=4 9083 B14R2.1815 CN1C(=O)Cc2c1ccc(c2)S[13CH3] 62a_200025704644_100000183948 [0,1,0,1,0,0|1,1,0]=4 9084 B14R2.1815 COc1ccc2c(c1)cc(n2C)C 34a_100000079728_200000210301 [0,1,0,1,0,0|2,0,0]=4 9085 B14R2.1815 COc1ccc2c(c1)cc(n2C)C 7a_100000079728_200000210301 [0,1,0,1,0,0|2,0,0]=4 9086 B14R2.1815 CSc1ccc2c(c1)CC(=O)N2C 62a_200000210301_100000183948 [0,1,0,1,0,0|1,1,0]=4 9087 B14R2.1815 CSc1ccc2c(c1)NC(=O)C2C 62a_200000210301_100010201481 [0,1,0,1,0,0|1,1,0]=4 9088 B14R2.1815 Cc1cc2cc(ccc2n1C)O[13CH3] 34a_100000079728_200025704644 [0,1,0,1,0,0|2,0,0]=4 9089 B14R2.1815 Cc1cc2cc(ccc2n1C)O[13CH3] 7a_100000079728_200025704644 [0,1,0,1,0,0|2,0,0]=4 9090 B14R2.1006 CC(=O)Cc1ccc(cc1)C2CC2 271570a_100011220607_100000691760 [0,1,0,1,0,0|1,0,0]=3 9091 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 11a_100016991203_100015343762 [0,1,0,1,0,0|2,0,0]=4 9092 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 1626a_100016991203_100015343762 [0,1,0,1,0,0|2,0,0]=4 9093 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 22a_100016991203_100000070787 [0,1,0,1,0,0|2,0,0]=4 9094 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 271570a_100011220607_100000155215 [0,1,0,1,0,0|2,0,0]=4 9095 B14R2.1006 CC(=O)Nc1ccc(cc1)C2CC2 527a_100016991203_100103153847 [0,1,0,1,0,0|2,0,0]=4 9096 B14R2.1006 CC(=O)Oc1ccc(cc1)C2CC2 271570a_100011220607_100000002173 [0,1,0,1,0,0|2,0,0]=4 9097 B14R2.1006 CC(=O)Sc1ccc(cc1)C2CC2 271570a_100011220607_200009995050 [0,1,0,1,0,0|2,0,0]=4 9098 B14R2.1006 NC(=O)Cc1ccc(cc1)C2CC2 271570a_100011220607_100000162331 [0,1,0,1,0,0|2,0,0]=4 9099 B14R2.6400 C=C=Cc1ccc2c(c1)CC(=O)C2 271570a_100015277604_100010185598 [0,1,0,1,0,0|1,0,1]=4 9100 B14R2.6400 CC=Cc1ccc2c(c1)CC(=O)C2 271570a_100016259895_100010185598 [0,1,0,1,0,0|1,0,0]=3 9101 B14R2.6400 CC=Cc1ccc2c(c1)CC(=O)N2 271570a_100016259895_100000754858 [0,1,0,1,0,0|2,0,0]=4 9102 B14R2.6400 CC=Cc1ccc2c(c1)NC(=O)C2 271570a_100016259895_100000760487 [0,1,0,1,0,0|2,0,0]=4 9103 B14R2.6400 CCOc1ccc2[nH]c(=O)oc2c1 7a_200000068749_100000210202 [0,1,0,1,0,0|2,0,0]=4 9104 B14R2.6400 CCOc1ccc2[nH]c(cc2c1)C 34a_100000073708_100000210202 [0,1,0,1,0,0|2,0,0]=4 9105 B14R2.6400 CCOc1ccc2[nH]c(cc2c1)C 7a_100000073708_100000210202 [0,1,0,1,0,0|2,0,0]=4 9106 B14R2.6400 CCOc1ccc2c(c1)CC(=O)O2 34a_100000035078_100000210202 [0,1,0,1,0,0|1,0,0]=3 9107 B14R2.6400 CCOc1ccc2c(c1)CC(=O)O2 7a_100000035078_100000210202 [0,1,0,1,0,0|1,0,0]=3 9108 B14R2.6400 CCOc1ccc2cc([nH]c2c1)C 34a_100000058111_100000210202 [0,1,0,1,0,0|1,0,1]=4 9109 B14R2.6400 CCOc1ccc2cc(oc2c1)C 34a_100000095638_100000210202 [0,1,0,1,0,0|0,0,2]=4 9110 B14R2.6400 CCOc1ccc2cc(oc2c1)C 7a_100000095638_100000210202 [0,1,0,1,0,0|0,0,2]=4 9111 B14R2.6400 CCOc1ccc2nc(oc2c1)C 34a_100000116946_100000210202 [0,1,0,1,0,0|1,0,1]=4 9112 B14R2.6400 CCOc1ccc2nc(oc2c1)C 7a_100000116946_100000210202 [0,1,0,1,0,0|1,0,1]=4 9113 B14R2.6400 CCOc1ccc2nc(sc2c1)C 34a_100000008955_100000210202 [0,1,0,1,0,0|1,1,0]=4 9114 B14R2.6400 CCOc1ccc2nc(sc2c1)C 7a_100000008955_100000210202 [0,1,0,1,0,0|1,1,0]=4 9115 B14R2.6400 CCOc1ccc2oc(nc2c1)C 34a_100000102623_100000210202 [0,1,0,1,0,0|2,0,0]=4 9116 B14R2.6400 CCOc1ccc2oc(nc2c1)C 7a_100000102623_100000210202 [0,1,0,1,0,0|2,0,0]=4 9117 B14R2.6400 CCOc1ccc2sc(nc2c1)C 34a_100000031546_100000210202 [0,1,0,1,0,0|2,0,0]=4 9118 B14R2.6400 CCOc1ccc2sc(nc2c1)C 7a_100000031546_100000210202 [0,1,0,1,0,0|2,0,0]=4 9119 B14R2.6400 CCSc1ccc2c(c1)CC(=O)C2 62a_100010185598_100000210202 [0,1,0,1,0,0|0,1,0]=3 9120 B14R2.6400 CCSc1ccc2c(c1)CC(=O)N2 62a_100000210202_100000754858 [0,1,0,1,0,0|1,1,0]=4 9121 B14R2.6400 CCSc1ccc2c(c1)NC(=O)C2 62a_100000210202_100000760487 [0,1,0,1,0,0|1,1,0]=4 9122 B14R2.6400 CNCc1ccc2c(c1)CC(=O)O2 26a_100102657272_100000035078 [0,1,0,1,0,0|2,0,0]=4 9123 B14R2.6400 COCc1ccc2nc(oc2c1)C 34a_100010326561_200000210301 [0,1,0,1,0,0|1,0,1]=4 9124 B14R2.6400 COCc1ccc2nc(oc2c1)C 7a_100010326561_200000210301 [0,1,0,1,0,0|1,0,1]=4 9125 B14R2.6400 COCc1ccc2oc(nc2c1)C 34a_200009878806_200000210301 [0,1,0,1,0,0|2,0,0]=4 9126 B14R2.6400 COCc1ccc2oc(nc2c1)C 7a_200009878806_200000210301 [0,1,0,1,0,0|2,0,0]=4 9127 B14R2.6400 Cc1cc2cc(ccc2[nH]1)OCF 34a_100000073708_100015361967 [0,1,0,1,0,0|2,0,0]=4 9128 B14R2.6400 Cc1cc2cc(ccc2[nH]1)OCF 7a_100000073708_100015361967 [0,1,0,1,0,0|2,0,0]=4 9129 B14R2.6400 Cc1cc2ccc(cc2[nH]1)OCF 34a_100000058111_100015361967 [0,1,0,1,0,0|1,0,1]=4 9130 B14R2.6400 Cc1cc2ccc(cc2o1)OCF 34a_100000095638_100015361967 [0,1,0,1,0,0|0,0,2]=4 9131 B14R2.6400 Cc1cc2ccc(cc2o1)OCF 7a_100000095638_100015361967 [0,1,0,1,0,0|0,0,2]=4 9132 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 34a_200009878806_200025704644 [0,1,0,1,0,0|2,0,0]=4 9133 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 7a_200009878806_200025704644 [0,1,0,1,0,0|2,0,0]=4 9134 B14R2.6400 Cc1nc2cc(ccc2o1)OCF 34a_100000102623_100015361967 [0,1,0,1,0,0|2,0,0]=4 9135 B14R2.6400 Cc1nc2cc(ccc2o1)OCF 7a_100000102623_100015361967 [0,1,0,1,0,0|2,0,0]=4 9136 B14R2.6400 Cc1nc2cc(ccc2s1)OCF 34a_100000031546_100015361967 [0,1,0,1,0,0|2,0,0]=4 9137 B14R2.6400 Cc1nc2cc(ccc2s1)OCF 7a_100000031546_100015361967 [0,1,0,1,0,0|2,0,0]=4 9138 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 34a_100010326561_200025704644 [0,1,0,1,0,0|1,0,1]=4 9139 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 7a_100010326561_200025704644 [0,1,0,1,0,0|1,0,1]=4 9140 B14R2.6400 Cc1nc2ccc(cc2o1)OCF 34a_100000116946_100015361967 [0,1,0,1,0,0|1,0,1]=4 9141 B14R2.6400 Cc1nc2ccc(cc2o1)OCF 7a_100000116946_100015361967 [0,1,0,1,0,0|1,0,1]=4 9142 B14R2.6400 Cc1nc2ccc(cc2s1)OCF 34a_100000008955_100015361967 [0,1,0,1,0,0|1,1,0]=4 9143 B14R2.6400 Cc1nc2ccc(cc2s1)OCF 7a_100000008955_100015361967 [0,1,0,1,0,0|1,1,0]=4 9144 B14R2.6400 O=C1Cc2cc(ccc2N1)SCF 62a_100015361967_100000754858 [0,1,0,1,0,0|1,1,0]=4 9145 B14R2.6400 O=C1Cc2cc(ccc2O1)OCF 34a_100000035078_100015361967 [0,1,0,1,0,0|1,0,0]=3 9146 B14R2.6400 O=C1Cc2cc(ccc2O1)OCF 7a_100000035078_100015361967 [0,1,0,1,0,0|1,0,0]=3 9147 B14R2.6400 O=C1Cc2ccc(cc2C1)SCF 62a_100010185598_100015361967 [0,1,0,1,0,0|0,1,0]=3 9148 B14R2.6400 O=C1Cc2ccc(cc2N1)SCF 62a_100015361967_100000760487 [0,1,0,1,0,0|1,1,0]=4 9149 B14R2.6400 O=c1[nH]c2ccc(cc2o1)OCF 7a_200000068749_100015361967 [0,1,0,1,0,0|2,0,0]=4 9150 B14R2.601 C=C(C)c1ccc2c(c1)CC(=O)C2 271570a_100000694244_100010185598 [0,1,0,1,0,0|1,0,0]=3 9151 B14R2.601 C=C(C)c1ccc2c(c1)CC(=O)N2 271570a_100000694244_100000754858 [0,1,0,1,0,0|2,0,0]=4 9152 B14R2.601 C=C(C)c1ccc2c(c1)NC(=O)C2 271570a_100000694244_100000760487 [0,1,0,1,0,0|2,0,0]=4 9153 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [1,0,0,0,1,0|2,0,0]=4 9154 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [1,0,0,0,1,0|1,0,0]=3 9155 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [1,0,0,0,1,0|2,0,0]=4 9156 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [1,0,0,0,1,0|2,0,0]=4 9157 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [1,0,0,0,1,0|2,0,0]=4 9158 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [1,0,0,0,1,0|1,0,0]=3 9159 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [1,0,0,0,1,0|1,0,0]=3 9160 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [1,0,0,0,1,0|2,0,0]=4 9161 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [1,0,0,0,1,0|2,0,0]=4 9162 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [1,0,0,0,1,0|2,0,0]=4 9163 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [1,0,0,0,1,0|1,0,0]=3 9164 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [1,0,0,0,1,0|0,0,0]=2 9165 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [1,0,0,0,1,0|1,0,0]=3 9166 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [1,0,0,0,1,0|1,0,0]=3 9167 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [1,0,0,0,1,0|1,0,0]=3 9168 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [1,0,0,0,1,0|0,0,0]=2 9169 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [1,0,0,0,1,0|0,0,0]=2 9170 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [1,0,0,0,1,0|1,0,0]=3 9171 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [1,0,0,0,1,0|1,0,0]=3 9172 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [1,0,0,0,1,0|2,0,0]=4 9173 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [1,0,0,0,1,0|2,0,0]=4 9174 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [1,0,0,0,1,0|2,0,0]=4 9175 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [1,0,0,0,1,0|1,0,1]=4 9176 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [1,0,0,0,1,0|0,0,2]=4 9177 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [1,0,0,0,1,0|2,0,0]=4 9178 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [1,0,0,0,1,0|2,0,0]=4 9179 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [1,0,0,0,1,0|2,0,0]=4 9180 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [1,0,0,0,1,0|2,0,0]=4 9181 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [1,0,0,0,1,0|2,0,0]=4 9182 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [1,0,0,0,1,0|1,0,0]=3 9183 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [1,0,0,0,1,0|1,0,1]=4 9184 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [1,0,0,0,1,0|1,0,1]=4 9185 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [1,0,0,0,1,0|0,0,0]=2 9186 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [1,0,0,0,1,0|2,0,0]=4 9187 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [1,0,0,0,1,0|2,0,0]=4 9188 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [1,0,0,0,1,0|2,0,0]=4 9189 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [1,0,0,0,1,0|2,0,0]=4 9190 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [1,0,0,0,1,0|2,0,0]=4 9191 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [1,0,0,0,1,0|2,0,0]=4 9192 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [1,0,0,0,1,0|1,0,0]=3 9193 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [1,0,0,0,1,0|2,0,0]=4 9194 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [1,0,0,0,1,0|2,0,0]=4 9195 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [1,0,0,0,1,0|1,0,0]=3 9196 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [1,0,0,0,1,0|1,0,0]=3 9197 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [1,0,0,0,1,0|1,0,0]=3 9198 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [1,0,0,0,1,0|1,0,0]=3 9199 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [1,0,0,0,1,0|0,0,0]=2 9200 B10R1.54 CC(=O)C[n+]1ccn(c1)C 1458a_100000765871_200000210301 [1,0,0,0,1,0|2,0,0]=4 9201 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100000070787_100000746031 [1,0,0,0,1,0|2,0,0]=4 9202 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100011542370_200000210301 [1,0,0,0,1,0|2,0,0]=4 9203 B10R1.54 CC(=O)Cc1cc(no1)C 1458a_100000037866_200000210301 [1,0,0,0,1,0|2,0,0]=4 9204 B10R1.54 CC(=O)Cc1cc(no1)C 1458a_100000070787_100000707947 [1,0,0,0,1,0|2,0,0]=4 9205 B10R1.54 CC(=O)Cc1cc(on1)C 1458a_100000070787_100000199038 [1,0,0,0,1,0|2,0,0]=4 9206 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000070787_100000708592 [1,0,0,0,1,0|2,0,0]=4 9207 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000238643_200000210301 [1,0,0,0,1,0|2,0,0]=4 9208 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000070787_100000185097 [1,0,0,0,1,0|2,0,0]=4 9209 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000238644_200000210301 [1,0,0,0,1,0|2,0,0]=4 9210 B10R1.54 CC(=O)Cc1ccn(n1)C 1458a_100000070787_100000726502 [1,0,0,0,1,0|2,0,0]=4 9211 B10R1.54 CC(=O)Cc1cn(cn1)C 1458a_100000070787_100000717665 [1,0,0,0,1,0|2,0,0]=4 9212 B10R1.54 CC(=O)Cc1cn(cn1)C 1458a_100011512828_200000210301 [1,0,0,0,1,0|2,0,0]=4 9213 B10R1.54 CC(=O)Cc1cnc(s1)C 1458a_100000070787_100020635045 [1,0,0,0,1,0|2,0,0]=4 9214 B10R1.54 CC(=O)Cc1cnn(c1)C 1458a_100000070787_100000744441 [1,0,0,0,1,0|2,0,0]=4 9215 B10R1.54 CC(=O)Cc1csc(n1)C 1458a_100000070787_100015186478 [1,0,0,0,1,0|2,0,0]=4 9216 B10R1.54 CC(=O)Cc1csc(n1)C 1458a_100000184407_200000210301 [1,0,0,0,1,0|2,0,0]=4 9217 B10R1.54 CC(=O)Cn1cc(cn1)C 1458a_100000743463_200000210301 [1,0,0,0,1,0|2,0,0]=4 9218 B10R1.54 CC(=O)Cn1cc(cn1)O 271570a_203496583355_100000763327 [1,0,0,0,1,0|2,0,0]=4 9219 B10R1.54 CC(=O)Cn1ccc(n1)C 1458a_100000238720_200000210301 [1,0,0,0,1,0|2,0,0]=4 9220 B10R1.54 CC(=O)Nc1ccc(s1)O 271570a_203496583355_100010002808 [1,0,0,0,1,0|2,0,0]=4 9221 B10R1.54 Cc1cc(on1)CC(=O)[13CH3] 1458a_100000037866_200025704644 [1,0,0,0,1,0|2,0,0]=4 9222 B10R1.54 Cc1ccn(n1)CC(=O)[13CH3] 1458a_100000238720_200025704644 [1,0,0,0,1,0|2,0,0]=4 9223 B10R1.54 Cc1cnn(c1)CC(=O)[13CH3] 1458a_100000743463_200025704644 [1,0,0,0,1,0|2,0,0]=4 9224 B10R1.54 Cc1nc(cs1)CC(=O)[13CH3] 1458a_100000184407_200025704644 [1,0,0,0,1,0|2,0,0]=4 9225 B10R1.54 Cn1cc[n+](c1)CC(=O)[13CH3] 1458a_100000765871_200025704644 [1,0,0,0,1,0|2,0,0]=4 9226 B10R1.54 Cn1cnc(c1)CC(=O)[13CH3] 1458a_100011512828_200025704644 [1,0,0,0,1,0|2,0,0]=4 9227 B10R1.54 [13CH3]C(=O)Cc1cc(cs1)Br 1458a_100011542370_200025704644 [1,0,0,0,1,0|2,0,0]=4 9228 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Br 1458a_100000238643_200025704644 [1,0,0,0,1,0|2,0,0]=4 9229 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Cl 1458a_100000238644_200025704644 [1,0,0,0,1,0|2,0,0]=4 9230 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_100000718618_200025704644 [0,0,0,0,2,0|1,1,0]=4 9231 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100000718618 [0,0,0,0,2,0|1,1,0]=4 9232 B10R1.31 CC(=O)c1ccc([nH]1)S[13CH3] 62a_200010494458_200025704644 [0,0,0,0,2,0|1,1,0]=4 9233 B10R1.31 CC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000229899 [0,0,0,0,2,0|1,1,0]=4 9234 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_100000183331_200025704644 [0,0,0,0,2,0|1,1,0]=4 9235 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000034408 [0,0,0,0,2,0|1,1,0]=4 9236 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200012344231_200025704644 [0,0,0,0,2,0|1,1,0]=4 9237 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200025704644_200012344231 [0,0,0,0,2,0|1,1,0]=4 9238 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200000210301_200012344231 [0,0,0,0,2,0|1,1,0]=4 9239 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200012344231_200000210301 [0,0,0,0,2,0|1,1,0]=4 9240 B10R1.31 CSc1ccc([nH]1)C(=O)C 62a_200010494458_200000210301 [0,0,0,0,2,0|1,1,0]=4 9241 B10R1.31 CSc1ccc(o1)C(=O)C 62a_200000210301_100000229899 [0,0,0,0,2,0|1,1,0]=4 9242 B10R1.31 CSc1ccc(s1)C(=O)C 62a_100000183331_200000210301 [0,0,0,0,2,0|1,1,0]=4 9243 B10R1.31 CSc1ccc(s1)C(=O)C 62a_200000210301_200000034408 [0,0,0,0,2,0|1,1,0]=4 9244 B10R1.31 CSc1csc(c1)C(=O)C 62a_100000718618_200000210301 [0,0,0,0,2,0|1,1,0]=4 9245 B10R1.31 CSc1csc(c1)C(=O)C 62a_200000210301_100000718618 [0,0,0,0,2,0|1,1,0]=4 9246 B12R1.21 C=C(C)CNc1ccc(cc1)Br 2230a_100000210018_100000748629 [1,0,0,0,0,1|2,0,0]=4 9247 B12R1.21 C=C(C)CNc1ccc(cc1)Br 34a_100000210018_100000748629 [1,0,0,0,0,1|2,0,0]=4 9248 B12R1.21 C=C(C)CNc1ccc(cc1)C 34a_100000124888_100000748629 [1,0,0,0,0,1|1,0,0]=3 9249 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000748629 [1,0,0,0,0,1|2,0,0]=4 9250 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 34a_100000210052_100000748629 [1,0,0,0,0,1|2,0,0]=4 9251 B12R1.21 C=C(C)CNc1ccc(cc1)F 34a_100000185862_100000748629 [1,0,0,0,0,1|2,0,0]=4 9252 B12R1.21 C=C(C)CNc1ccc(cc1)I 34a_100000185761_100000748629 [1,0,0,0,0,1|2,0,0]=4 9253 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [1,0,0,0,0,1|1,0,0]=3 9254 B12R1.21 C=C(C)COc1ccc(cc1)Br 34a_100000185759_100000748629 [1,0,0,0,0,1|2,0,0]=4 9255 B12R1.21 C=C(C)COc1ccc(cc1)Br 7a_100000185759_100000748629 [1,0,0,0,0,1|2,0,0]=4 9256 B12R1.21 C=C(C)COc1ccc(cc1)C 34a_100000210336_100000748629 [1,0,0,0,0,1|1,0,0]=3 9257 B12R1.21 C=C(C)COc1ccc(cc1)C 7a_100000210336_100000748629 [1,0,0,0,0,1|1,0,0]=3 9258 B12R1.21 C=C(C)COc1ccc(cc1)Cl 34a_100000210216_100000748629 [1,0,0,0,0,1|2,0,0]=4 9259 B12R1.21 C=C(C)COc1ccc(cc1)Cl 7a_100000210216_100000748629 [1,0,0,0,0,1|2,0,0]=4 9260 B12R1.21 C=C(C)COc1ccc(cc1)F 34a_100000210339_100000748629 [1,0,0,0,0,1|2,0,0]=4 9261 B12R1.21 C=C(C)COc1ccc(cc1)I 34a_100000212066_100000748629 [1,0,0,0,0,1|2,0,0]=4 9262 B12R1.21 C=C(C)COc1ccc(cc1)I 7a_100000212066_100000748629 [1,0,0,0,0,1|2,0,0]=4 9263 B12R1.21 C=C(C)COc1ccc(cc1)N 34a_100000185829_100000748629 [1,0,0,0,0,1|2,0,0]=4 9264 B12R1.21 C=C(C)COc1ccc(cn1)C 34a_100000759353_100000748629 [1,0,0,0,0,1|2,0,0]=4 9265 B12R1.21 C=C(C)COc1ccc(nc1)C 34a_100000745506_100000748629 [1,0,0,0,0,1|2,0,0]=4 9266 B12R1.21 C=C(C)COc1ccc(nc1)C 7a_100000745506_100000748629 [1,0,0,0,0,1|2,0,0]=4 9267 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000748629_100000752885 [1,0,0,0,0,1|2,0,0]=4 9268 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000752885_100000211660 [1,0,0,0,0,1|2,0,0]=4 9269 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000186775_100000211660 [1,0,0,0,0,1|1,0,0]=3 9270 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000748629_100000186775 [1,0,0,0,0,1|1,0,0]=3 9271 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000748629_100000755918 [1,0,0,0,0,1|2,0,0]=4 9272 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000755918_100000211660 [1,0,0,0,0,1|2,0,0]=4 9273 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000211213_100000211660 [1,0,0,0,0,1|2,0,0]=4 9274 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000748629_100000211213 [1,0,0,0,0,1|2,0,0]=4 9275 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000185761_100000211660 [1,0,0,0,0,1|2,0,0]=4 9276 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000748629_100000185761 [1,0,0,0,0,1|2,0,0]=4 9277 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [1,0,0,0,0,1|1,0,0]=3 9278 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100000748629_100000754016 [1,0,0,0,0,1|2,0,0]=4 9279 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100011192072_100000211660 [1,0,0,0,0,1|2,0,0]=4 9280 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000685995_100000211660 [1,0,0,0,0,1|2,0,0]=4 9281 B12R1.21 C=C(C)CSc1ccc(cn1)O 62a_100000748629_100000744096 [1,0,0,0,0,1|2,0,0]=4 9282 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000748629_100000751577 [1,0,0,0,0,1|2,0,0]=4 9283 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000751577_100000211660 [1,0,0,0,0,1|2,0,0]=4 9284 B12R1.21 C=C(F)CNc1ccc(cc1)C 34a_100000124888_100009893438 [1,0,0,0,0,1|1,0,1]=4 9285 B12R1.21 C=C(F)CNc1ccc(cc1)O 34a_100000185829_100009893438 [1,0,0,0,0,1|1,0,1]=4 9286 B12R1.21 C=C(F)COc1ccc(cc1)C 34a_100000210336_100009893438 [1,0,0,0,0,1|1,0,1]=4 9287 B12R1.21 C=C(F)COc1ccc(cc1)C 7a_100000210336_100000042424 [1,0,0,0,0,1|1,0,1]=4 9288 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000042424_100000186775 [1,0,0,0,0,1|1,0,1]=4 9289 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000186775_100000042424 [1,0,0,0,0,1|1,0,1]=4 9290 B12R1.21 C=C(F)CSc1ccc(cc1)O 62a_100000042424_100000185759 [1,0,0,0,0,1|1,0,1]=4 9291 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [1,0,0,0,0,1|0,0,1]=3 9292 B12R1.21 CC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200000210301 [1,0,0,0,0,1|1,0,1]=4 9293 B12R1.21 CC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200000210301 [1,0,0,0,0,1|1,0,1]=4 9294 B12R1.21 CC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200000210301 [1,0,0,0,0,1|1,0,1]=4 9295 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [1,0,0,0,0,1|1,0,1]=4 9296 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [1,0,0,0,0,1|0,0,1]=3 9297 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [1,0,0,0,0,1|1,0,1]=4 9298 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [1,0,0,0,0,1|1,0,1]=4 9299 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [1,0,0,0,0,1|1,0,1]=4 9300 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [1,0,0,0,0,1|1,0,0]=3 9301 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [1,0,0,0,0,1|1,0,0]=3 9302 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [1,0,0,0,0,1|0,0,0]=2 9303 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [1,0,0,0,0,1|0,0,0]=2 9304 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [1,0,0,0,0,1|1,0,0]=3 9305 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [1,0,0,0,0,1|1,0,0]=3 9306 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [1,0,0,0,0,1|1,0,0]=3 9307 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [1,0,0,0,0,1|1,0,0]=3 9308 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [1,0,0,0,0,1|1,0,0]=3 9309 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [1,0,0,0,0,1|0,0,0]=2 9310 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [1,0,0,0,0,1|0,0,0]=2 9311 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [1,0,0,0,0,1|0,0,0]=2 9312 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [1,0,0,0,0,1|1,0,0]=3 9313 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [1,0,0,0,0,1|0,0,0]=2 9314 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [1,0,0,0,0,1|1,0,0]=3 9315 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [1,0,0,0,0,1|1,0,0]=3 9316 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [1,0,0,0,0,1|1,0,0]=3 9317 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [1,0,0,0,0,1|0,0,0]=2 9318 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [1,0,0,0,0,1|1,0,0]=3 9319 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [1,0,0,0,0,1|0,0,0]=2 9320 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [1,0,0,0,0,1|1,0,0]=3 9321 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [1,0,0,0,0,1|1,0,0]=3 9322 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [1,0,0,0,0,1|1,0,0]=3 9323 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [1,0,0,0,0,1|1,0,0]=3 9324 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [1,0,0,0,0,1|1,0,0]=3 9325 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [1,0,0,0,0,1|1,0,0]=3 9326 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [1,0,0,0,0,1|0,0,0]=2 9327 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [1,0,0,0,0,1|0,0,0]=2 9328 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [1,0,0,0,0,1|0,0,0]=2 9329 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [1,0,0,0,0,1|0,0,0]=2 9330 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [1,0,0,0,0,1|1,0,0]=3 9331 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [1,0,0,0,0,1|1,0,0]=3 9332 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [1,0,0,0,0,1|1,0,0]=3 9333 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [1,0,0,0,0,1|1,0,0]=3 9334 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [1,0,0,0,0,1|1,0,0]=3 9335 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [1,0,0,0,0,1|1,0,0]=3 9336 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [1,0,0,0,0,1|1,0,0]=3 9337 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [1,0,0,0,0,1|1,0,0]=3 9338 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [1,0,0,0,0,1|1,0,0]=3 9339 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [1,0,0,0,0,1|1,0,0]=3 9340 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [1,0,0,0,0,1|1,0,0]=3 9341 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [1,0,0,0,0,1|1,0,0]=3 9342 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [1,0,0,0,0,1|0,0,0]=2 9343 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [1,0,0,0,0,1|0,0,0]=2 9344 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [1,0,0,0,0,1|0,0,0]=2 9345 B12R1.21 CC(=O)NCc1ccc(cn1)Br 11a_100015188789_100015343762 [1,0,0,0,0,1|2,0,0]=4 9346 B12R1.21 CC(=O)NCc1ccc(cn1)Br 1626a_100015188789_100015343762 [1,0,0,0,0,1|2,0,0]=4 9347 B12R1.21 CC(=O)NCc1ccc(cn1)Br 240690a_100015188789_100015343762 [1,0,0,0,0,1|2,0,0]=4 9348 B12R1.21 CC(=O)NCc1ccc(cn1)Br 527a_100015188789_100103153847 [1,0,0,0,0,1|2,0,0]=4 9349 B12R1.21 CC(=O)NCc1ccc(cn1)C 11a_100015187455_100015343762 [1,0,0,0,0,1|1,0,0]=3 9350 B12R1.21 CC(=O)NCc1ccc(cn1)C 1626a_100015187455_100015343762 [1,0,0,0,0,1|1,0,0]=3 9351 B12R1.21 CC(=O)NCc1ccc(cn1)C 240690a_100015187455_100015343762 [1,0,0,0,0,1|1,0,0]=3 9352 B12R1.21 CC(=O)NCc1ccc(cn1)C 527a_100015187455_100103153847 [1,0,0,0,0,1|1,0,0]=3 9353 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 11a_100000697193_100015343762 [1,0,0,0,0,1|2,0,0]=4 9354 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 1626a_100000697193_100015343762 [1,0,0,0,0,1|2,0,0]=4 9355 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100015343762 [1,0,0,0,0,1|2,0,0]=4 9356 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 527a_100000697193_100103153847 [1,0,0,0,0,1|2,0,0]=4 9357 B12R1.21 CC(=O)NCc1ccc(cn1)F 11a_100020620131_100015343762 [1,0,0,0,0,1|2,0,0]=4 9358 B12R1.21 CC(=O)NCc1ccc(cn1)F 1626a_100020620131_100015343762 [1,0,0,0,0,1|2,0,0]=4 9359 B12R1.21 CC(=O)NCc1ccc(cn1)F 240690a_100020620131_100015343762 [1,0,0,0,0,1|2,0,0]=4 9360 B12R1.21 CC(=O)NCc1ccc(cn1)F 527a_100020620131_100103153847 [1,0,0,0,0,1|2,0,0]=4 9361 B12R1.21 CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100015343762 [1,0,0,0,0,1|1,0,0]=3 9362 B12R1.21 CC(=O)NCc1ccc(nc1)Br 11a_100009817727_100015343762 [1,0,0,0,0,1|2,0,0]=4 9363 B12R1.21 CC(=O)NCc1ccc(nc1)Br 240690a_100009817727_100015343762 [1,0,0,0,0,1|2,0,0]=4 9364 B12R1.21 CC(=O)NCc1ccc(nc1)Br 527a_100009817727_100103153847 [1,0,0,0,0,1|2,0,0]=4 9365 B12R1.21 CC(=O)NCc1ccc(nc1)C 11a_100000740942_100015343762 [1,0,0,0,0,1|1,0,0]=3 9366 B12R1.21 CC(=O)NCc1ccc(nc1)C 1626a_100000740942_100015343762 [1,0,0,0,0,1|1,0,0]=3 9367 B12R1.21 CC(=O)NCc1ccc(nc1)C 240690a_100000740942_100015343762 [1,0,0,0,0,1|1,0,0]=3 9368 B12R1.21 CC(=O)NCc1ccc(nc1)C 527a_100000740942_100103153847 [1,0,0,0,0,1|1,0,0]=3 9369 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 11a_100000735879_100015343762 [1,0,0,0,0,1|2,0,0]=4 9370 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 1626a_100000735879_100015343762 [1,0,0,0,0,1|2,0,0]=4 9371 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100015343762 [1,0,0,0,0,1|2,0,0]=4 9372 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 527a_100000735879_100103153847 [1,0,0,0,0,1|2,0,0]=4 9373 B12R1.21 CC(=O)NCc1ccc(nc1)F 11a_100000101913_100015343762 [1,0,0,0,0,1|2,0,0]=4 9374 B12R1.21 CC(=O)NCc1ccc(nc1)F 1626a_100000101913_100015343762 [1,0,0,0,0,1|2,0,0]=4 9375 B12R1.21 CC(=O)NCc1ccc(nc1)F 240690a_100000101913_100015343762 [1,0,0,0,0,1|2,0,0]=4 9376 B12R1.21 CC(=O)NCc1ccc(nc1)F 527a_100000101913_100103153847 [1,0,0,0,0,1|2,0,0]=4 9377 B12R1.21 CC(=O)NCc1ccc(nc1)O 11a_100000757128_100015343762 [1,0,0,0,0,1|1,0,0]=3 9378 B12R1.21 CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100015343762 [1,0,0,0,0,1|1,0,0]=3 9379 B12R1.21 CC(=O)NCc1cnc(cn1)C 11a_100132314150_100015343762 [1,0,0,0,0,1|2,0,0]=4 9380 B12R1.21 CC(=O)NCc1cnc(cn1)C 240690a_100132314150_100015343762 [1,0,0,0,0,1|2,0,0]=4 9381 B12R1.21 CC(=O)NCc1cnc(cn1)C 527a_100132314150_100103153847 [1,0,0,0,0,1|2,0,0]=4 9382 B12R1.21 CC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000070787 [1,0,0,0,0,1|2,0,0]=4 9383 B12R1.21 CC(=O)NNc1ccc(cc1)C 22a_100000683527_100000070787 [1,0,0,0,0,1|1,0,0]=3 9384 B12R1.21 CC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000070787 [1,0,0,0,0,1|2,0,0]=4 9385 B12R1.21 CC(=O)NNc1ccc(cc1)F 22a_100000728448_100000070787 [1,0,0,0,0,1|2,0,0]=4 9386 B12R1.21 CC(=O)NNc1ccc(cc1)I 22a_100016988836_100000070787 [1,0,0,0,0,1|2,0,0]=4 9387 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [1,0,0,0,0,1|1,0,0]=3 9388 B12R1.21 CC(=O)NNc1ccc(cn1)C 22a_100000746693_100000070787 [1,0,0,0,0,1|2,0,0]=4 9389 B12R1.21 CC(=O)NNc1ccc(cn1)O 271570a_203496583355_200010175596 [1,0,0,0,0,1|2,0,0]=4 9390 B12R1.21 CC(=O)NNc1ccc(nc1)C 22a_100020639869_100000070787 [1,0,0,0,0,1|2,0,0]=4 9391 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [1,0,0,0,0,1|1,0,1]=4 9392 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [1,0,0,0,0,1|1,0,1]=4 9393 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [1,0,0,0,0,1|1,0,1]=4 9394 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [1,0,0,0,0,1|1,0,1]=4 9395 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [1,0,0,0,0,1|1,0,1]=4 9396 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [1,0,0,0,0,1|1,0,1]=4 9397 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [1,0,0,0,0,1|1,0,1]=4 9398 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [1,0,0,0,0,1|1,0,1]=4 9399 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [1,0,0,0,0,1|0,0,2]=4 9400 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [1,0,0,0,0,1|0,0,2]=4 9401 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 9402 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [1,0,0,0,0,1|2,0,0]=4 9403 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 9404 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [1,0,0,0,0,1|2,0,0]=4 9405 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [1,0,0,0,0,1|2,0,0]=4 9406 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 9407 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 9408 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [1,0,0,0,0,1|2,0,0]=4 9409 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [1,0,0,0,0,1|0,0,2]=4 9410 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [1,0,0,0,0,1|0,0,2]=4 9411 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [1,0,0,0,0,1|0,0,1]=3 9412 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [1,0,0,0,0,1|0,0,0]=2 9413 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [1,0,0,0,0,1|2,0,0]=4 9414 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [1,0,0,0,0,1|2,0,0]=4 9415 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [1,0,0,0,0,1|1,0,1]=4 9416 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [1,0,0,0,0,1|1,0,1]=4 9417 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [1,0,0,0,0,1|1,0,1]=4 9418 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [1,0,0,0,0,1|1,0,1]=4 9419 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [1,0,0,0,0,1|1,0,1]=4 9420 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [1,0,0,0,0,1|1,0,1]=4 9421 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [1,0,0,0,0,1|1,0,1]=4 9422 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [1,0,0,0,0,1|1,0,1]=4 9423 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [1,0,0,0,0,1|1,0,1]=4 9424 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [1,0,0,0,0,1|1,0,1]=4 9425 B12R1.21 Cc1ccc(cc1)NCC(=O)N 34a_100000124888_100000187820 [1,0,0,0,0,1|1,0,0]=3 9426 B12R1.21 Cc1ccc(cc1)NCC(=O)[O-] 34a_100000124888_100020667443 [1,0,0,0,0,1|1,0,0]=3 9427 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [1,0,0,0,0,1|1,0,1]=4 9428 B12R1.21 Cc1ccc(cc1)NCC(C)O 34a_100000124888_100011218427 [1,0,0,0,0,1|0,0,2]=4 9429 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O 34a_100000124888_100009817552 [1,0,0,0,0,1|0,0,2]=4 9430 B12R1.21 Cc1ccc(cc1)NC[N+](=O)[O-] 34a_100000124888_100000761209 [1,0,0,0,0,1|2,0,0]=4 9431 B12R1.21 Cc1ccc(cc1)OCC(=O)N 34a_100000210336_100000187820 [1,0,0,0,0,1|1,0,0]=3 9432 B12R1.21 Cc1ccc(cc1)OCC(=O)N 7a_100000210336_100000187820 [1,0,0,0,0,1|1,0,0]=3 9433 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [1,0,0,0,0,1|0,0,0]=2 9434 B12R1.21 Cc1ccc(cc1)OCC(=O)[O-] 34a_100000210336_100020667443 [1,0,0,0,0,1|1,0,0]=3 9435 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [1,0,0,0,0,1|1,0,1]=4 9436 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [1,0,0,0,0,1|1,0,1]=4 9437 B12R1.21 Cc1ccc(cc1)OCC(C)O 34a_100000210336_100011218427 [1,0,0,0,0,1|0,0,2]=4 9438 B12R1.21 Cc1ccc(cc1)OCC(C)O 7a_100000210336_100011218427 [1,0,0,0,0,1|0,0,2]=4 9439 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 34a_100000210336_100009817552 [1,0,0,0,0,1|0,0,2]=4 9440 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 7a_100000210336_100009817552 [1,0,0,0,0,1|0,0,2]=4 9441 B12R1.21 Cc1ccc(cc1)OC[N+](=O)[O-] 34a_100000210336_100000761209 [1,0,0,0,0,1|2,0,0]=4 9442 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000186775_100000747473 [1,0,0,0,0,1|1,0,0]=3 9443 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000186775 [1,0,0,0,0,1|1,0,0]=3 9444 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [1,0,0,0,0,1|0,0,0]=2 9445 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100000186775_100020667443 [1,0,0,0,0,1|1,0,0]=3 9446 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000186775 [1,0,0,0,0,1|1,0,0]=3 9447 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [1,0,0,0,0,1|1,0,1]=4 9448 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [1,0,0,0,0,1|1,0,1]=4 9449 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100000186775_100011218427 [1,0,0,0,0,1|0,0,2]=4 9450 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000186775 [1,0,0,0,0,1|0,0,2]=4 9451 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100000186775_100009817552 [1,0,0,0,0,1|0,0,2]=4 9452 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000186775 [1,0,0,0,0,1|0,0,2]=4 9453 B12R1.21 Cc1ccc(cc1)SC[N+](=O)[O-] 62a_100000186775_100000761209 [1,0,0,0,0,1|2,0,0]=4 9454 B12R1.21 Cc1ccc(cn1)OCC(=O)N 34a_100000745506_100000187820 [1,0,0,0,0,1|2,0,0]=4 9455 B12R1.21 Cc1ccc(cn1)OCC(=O)N 7a_100000745506_100000187820 [1,0,0,0,0,1|2,0,0]=4 9456 B12R1.21 Cc1ccc(cn1)OCC(=O)[O-] 34a_100000745506_100020667443 [1,0,0,0,0,1|2,0,0]=4 9457 B12R1.21 Cc1ccc(cn1)SCC(=O)N 62a_100000747473_100000751577 [1,0,0,0,0,1|2,0,0]=4 9458 B12R1.21 Cc1ccc(cn1)SCC(=O)N 62a_100000751577_100000747473 [1,0,0,0,0,1|2,0,0]=4 9459 B12R1.21 Cc1ccc(cn1)SCC(=O)[O-] 62a_100000751577_100020667443 [1,0,0,0,0,1|2,0,0]=4 9460 B12R1.21 Cc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000751577 [1,0,0,0,0,1|2,0,0]=4 9461 B12R1.21 Cc1ccc(nc1)OCC(=O)N 34a_100000759353_100000187820 [1,0,0,0,0,1|2,0,0]=4 9462 B12R1.21 Cc1ccc(nc1)OCC(=O)[O-] 34a_100000759353_100020667443 [1,0,0,0,0,1|2,0,0]=4 9463 B12R1.21 Cc1ccc(nc1)SCC(=O)N 62a_100000747473_100000754016 [1,0,0,0,0,1|2,0,0]=4 9464 B12R1.21 Cc1ccc(nc1)SCC(=O)N 62a_100011192072_100000747473 [1,0,0,0,0,1|2,0,0]=4 9465 B12R1.21 Cc1ccc(nc1)SCC(=O)[O-] 62a_100011192072_100020667443 [1,0,0,0,0,1|2,0,0]=4 9466 B12R1.21 Cc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000754016 [1,0,0,0,0,1|2,0,0]=4 9467 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [1,0,0,0,0,1|1,0,0]=3 9468 B12R1.21 NC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747473 [1,0,0,0,0,1|2,0,0]=4 9469 B12R1.21 NC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000187820 [1,0,0,0,0,1|2,0,0]=4 9470 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747473 [1,0,0,0,0,1|2,0,0]=4 9471 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000187820 [1,0,0,0,0,1|2,0,0]=4 9472 B12R1.21 NC(=O)CNc1ccc(cc1)F 34a_100000185862_100000187820 [1,0,0,0,0,1|2,0,0]=4 9473 B12R1.21 NC(=O)CNc1ccc(cc1)I 34a_100000185761_100000187820 [1,0,0,0,0,1|2,0,0]=4 9474 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [1,0,0,0,0,1|1,0,0]=3 9475 B12R1.21 NC(=O)COc1ccc(cc1)Br 34a_100000185759_100000187820 [1,0,0,0,0,1|2,0,0]=4 9476 B12R1.21 NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000187820 [1,0,0,0,0,1|2,0,0]=4 9477 B12R1.21 NC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000187820 [1,0,0,0,0,1|2,0,0]=4 9478 B12R1.21 NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000187820 [1,0,0,0,0,1|2,0,0]=4 9479 B12R1.21 NC(=O)COc1ccc(cc1)F 34a_100000210339_100000187820 [1,0,0,0,0,1|2,0,0]=4 9480 B12R1.21 NC(=O)COc1ccc(cc1)I 34a_100000212066_100000187820 [1,0,0,0,0,1|2,0,0]=4 9481 B12R1.21 NC(=O)COc1ccc(cc1)I 7a_100000212066_100000187820 [1,0,0,0,0,1|2,0,0]=4 9482 B12R1.21 NC(=O)COc1ccc(cc1)N 34a_100000185829_100000187820 [1,0,0,0,0,1|2,0,0]=4 9483 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000747473_100000752885 [1,0,0,0,0,1|2,0,0]=4 9484 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747473 [1,0,0,0,0,1|2,0,0]=4 9485 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000747473_100000755918 [1,0,0,0,0,1|2,0,0]=4 9486 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747473 [1,0,0,0,0,1|2,0,0]=4 9487 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747473 [1,0,0,0,0,1|2,0,0]=4 9488 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000747473_100000211213 [1,0,0,0,0,1|2,0,0]=4 9489 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747473 [1,0,0,0,0,1|2,0,0]=4 9490 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000747473_100000185761 [1,0,0,0,0,1|2,0,0]=4 9491 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [1,0,0,0,0,1|1,0,0]=3 9492 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [1,0,0,0,0,1|1,0,0]=3 9493 B12R1.21 NC(=O)CSc1ccc(cn1)O 62a_100000685995_100000747473 [1,0,0,0,0,1|2,0,0]=4 9494 B12R1.21 NC(=O)CSc1ccc(cn1)O 62a_100000747473_100000744096 [1,0,0,0,0,1|2,0,0]=4 9495 B12R1.21 Nc1ccc(cc1)OCC(=O)[O-] 34a_100000185829_100020667443 [1,0,0,0,0,1|2,0,0]=4 9496 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100000185761_100020667443 [1,0,0,0,0,1|2,0,0]=4 9497 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185761 [1,0,0,0,0,1|2,0,0]=4 9498 B12R1.21 O=C([O-])CNc1ccc(cc1)Br 34a_100000210018_100020667443 [1,0,0,0,0,1|2,0,0]=4 9499 B12R1.21 O=C([O-])CNc1ccc(cc1)Cl 34a_100000210052_100020667443 [1,0,0,0,0,1|2,0,0]=4 9500 B12R1.21 O=C([O-])CNc1ccc(cc1)F 34a_100000185862_100020667443 [1,0,0,0,0,1|2,0,0]=4 9501 B12R1.21 O=C([O-])CNc1ccc(cc1)I 34a_100000185761_100020667443 [1,0,0,0,0,1|2,0,0]=4 9502 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [1,0,0,0,0,1|1,0,0]=3 9503 B12R1.21 O=C([O-])COc1ccc(cc1)Br 34a_100000185759_100020667443 [1,0,0,0,0,1|2,0,0]=4 9504 B12R1.21 O=C([O-])COc1ccc(cc1)Cl 34a_100000210216_100020667443 [1,0,0,0,0,1|2,0,0]=4 9505 B12R1.21 O=C([O-])COc1ccc(cc1)F 34a_100000210339_100020667443 [1,0,0,0,0,1|2,0,0]=4 9506 B12R1.21 O=C([O-])COc1ccc(cc1)I 34a_100000212066_100020667443 [1,0,0,0,0,1|2,0,0]=4 9507 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100000752885_100020667443 [1,0,0,0,0,1|2,0,0]=4 9508 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100020667443_100000752885 [1,0,0,0,0,1|2,0,0]=4 9509 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100000755918_100020667443 [1,0,0,0,0,1|2,0,0]=4 9510 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100020667443_100000755918 [1,0,0,0,0,1|2,0,0]=4 9511 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100000211213_100020667443 [1,0,0,0,0,1|2,0,0]=4 9512 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100020667443_100000211213 [1,0,0,0,0,1|2,0,0]=4 9513 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [1,0,0,0,0,1|1,0,0]=3 9514 B12R1.21 O=C([O-])CSc1ccc(cn1)O 62a_100000685995_100020667443 [1,0,0,0,0,1|2,0,0]=4 9515 B12R1.21 O=C([O-])CSc1ccc(cn1)O 62a_100020667443_100000744096 [1,0,0,0,0,1|2,0,0]=4 9516 B12R1.21 O=[N+]([O-])CNc1ccc(cc1)O 34a_100000185829_100000761209 [1,0,0,0,0,1|2,0,0]=4 9517 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200025704644 [1,0,0,0,0,1|1,0,1]=4 9518 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200025704644 [1,0,0,0,0,1|1,0,1]=4 9519 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200025704644 [1,0,0,0,0,1|1,0,1]=4 9520 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [1,0,0,0,0,1|1,0,1]=4 9521 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [1,0,0,0,0,1|1,0,1]=4 9522 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [1,0,0,0,0,1|1,0,1]=4 9523 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [1,0,0,0,0,1|1,0,1]=4 9524 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [1,0,0,0,0,1|1,0,0]=3 9525 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [1,0,0,0,0,1|1,0,0]=3 9526 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [1,0,0,0,0,1|1,0,0]=3 9527 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [1,0,0,0,0,1|1,0,0]=3 9528 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [1,0,0,0,0,1|0,0,0]=2 9529 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [1,0,0,0,0,1|1,0,0]=3 9530 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [1,0,0,0,0,1|1,0,0]=3 9531 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [1,0,0,0,0,1|1,0,0]=3 9532 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [1,0,0,0,0,1|1,0,0]=3 9533 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [1,0,0,0,0,1|0,0,0]=2 9534 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [1,0,0,0,0,1|1,0,0]=3 9535 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [1,0,0,0,0,1|1,0,0]=3 9536 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [1,0,0,0,0,1|1,0,0]=3 9537 B12R1.438 C=Cc1cccc(c1)CC(=O)C 271570a_100011290941_100000689217 [0,0,0,0,1,1|1,0,1]=4 9538 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000070787_100000233786 [0,0,0,0,1,1|2,0,0]=4 9539 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000684415_200000210301 [0,0,0,0,1,1|2,0,0]=4 9540 B12R1.438 CC(=O)Cc1cccc(c1)C=O 1458a_100000070787_100009816774 [0,0,0,0,1,1|2,0,0]=4 9541 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [0,0,0,0,1,1|2,0,0]=4 9542 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [0,0,0,0,1,1|0,1,0]=3 9543 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [0,0,0,0,1,1|0,1,0]=3 9544 B12R1.438 CC(=O)Cc1cncc(c1)C#N 1458a_100000070787_200020634941 [0,0,0,0,1,1|2,0,0]=4 9545 B12R1.438 CC(=O)Nc1cc(ccn1)S[13CH3] 62a_200025704644_100012362434 [0,0,0,0,1,1|1,1,0]=4 9546 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [0,0,0,0,1,1|2,0,0]=4 9547 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [0,0,0,0,1,1|1,0,0]=3 9548 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [0,0,0,0,1,1|1,0,0]=3 9549 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [0,0,0,0,1,1|1,1,0]=4 9550 B12R1.438 CC(=O)Nc1ccnc(c1)S[13CH3] 62a_200025704644_100000238608 [0,0,0,0,1,1|1,1,0]=4 9551 B12R1.438 CC(=O)Nc1cncc(c1)S[13CH3] 62a_200025704644_100012351681 [0,0,0,0,1,1|1,1,0]=4 9552 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [0,0,0,0,1,1|1,0,0]=3 9553 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [0,0,0,0,1,1|1,1,0]=4 9554 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,0,0,0,1,1|2,0,0]=4 9555 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,0,0,0,1,1|2,0,0]=4 9556 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,0,0,0,1,1|2,0,0]=4 9557 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,0,0,0,1,1|2,0,0]=4 9558 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [0,0,0,0,1,1|2,0,0]=4 9559 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [0,0,0,0,1,1|2,0,0]=4 9560 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [0,0,0,0,1,1|2,0,0]=4 9561 B12R1.438 COc1cc(ccn1)C=C(C)C 271570a_100102525489_100000117307 [0,0,0,0,1,1|1,0,1]=4 9562 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [0,0,0,0,1,1|0,0,0]=2 9563 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [0,0,0,0,1,1|0,0,0]=2 9564 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [0,0,0,0,1,1|0,0,0]=2 9565 B12R1.438 COc1cc(ccn1)CN(C)C 2230a_100102631434_100103152439 [0,0,0,0,1,1|2,0,0]=4 9566 B12R1.438 COc1cc(ccn1)CN(C)C 269982a_100102631434_100103152439 [0,0,0,0,1,1|2,0,0]=4 9567 B12R1.438 COc1cc(ccn1)CN(C)C 270004a_100102631434_100000050969 [0,0,0,0,1,1|2,0,0]=4 9568 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [0,0,0,0,1,1|1,0,1]=4 9569 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [0,0,0,0,1,1|0,0,0]=2 9570 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [0,0,0,0,1,1|0,0,0]=2 9571 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,0,0,0,1,1|1,0,0]=3 9572 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,0,0,0,1,1|1,0,0]=3 9573 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [0,0,0,0,1,1|0,0,0]=2 9574 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [0,0,0,0,1,1|2,0,0]=4 9575 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [0,0,0,0,1,1|2,0,0]=4 9576 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [0,0,0,0,1,1|2,0,0]=4 9577 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [0,0,0,0,1,1|2,0,0]=4 9578 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [0,0,0,0,1,1|2,0,0]=4 9579 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [0,0,0,0,1,1|2,0,0]=4 9580 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [0,0,0,0,1,1|2,0,0]=4 9581 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [0,0,0,0,1,1|1,0,0]=3 9582 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [0,0,0,0,1,1|1,0,0]=3 9583 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [0,0,0,0,1,1|1,0,0]=3 9584 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [0,0,0,0,1,1|1,0,0]=3 9585 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [0,0,0,0,1,1|1,0,0]=3 9586 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [0,0,0,0,1,1|1,0,0]=3 9587 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [0,0,0,0,1,1|2,0,0]=4 9588 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [0,0,0,0,1,1|2,0,0]=4 9589 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [0,0,0,0,1,1|1,0,0]=3 9590 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [0,0,0,0,1,1|1,0,0]=3 9591 B12R1.438 COc1ccnc(c1)C=C(C)C 271570a_100102525489_100011216251 [0,0,0,0,1,1|1,0,1]=4 9592 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [0,0,0,0,1,1|0,0,0]=2 9593 B12R1.438 COc1ccnc(c1)CN(C)C 2230a_100102631434_100000752681 [0,0,0,0,1,1|2,0,0]=4 9594 B12R1.438 COc1ccnc(c1)CN(C)C 269982a_100102631434_100000752681 [0,0,0,0,1,1|2,0,0]=4 9595 B12R1.438 COc1ccnc(c1)CN(C)C 270004a_100102631434_100000087537 [0,0,0,0,1,1|2,0,0]=4 9596 B12R1.438 COc1cncc(c1)C=C(C)C 271570a_100102525489_100000684773 [0,0,0,0,1,1|1,0,1]=4 9597 B12R1.438 COc1cncc(c1)CN(C)C 270004a_100102631434_100011361638 [0,0,0,0,1,1|2,0,0]=4 9598 B12R1.438 CSc1cc(ccn1)NC(=O)C 62a_200000210301_100000238608 [0,0,0,0,1,1|1,1,0]=4 9599 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [0,0,0,0,1,1|0,1,0]=3 9600 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [0,0,0,0,1,1|0,1,0]=3 9601 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [0,0,0,0,1,1|0,1,0]=3 9602 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [0,0,0,0,1,1|1,1,0]=4 9603 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [0,0,0,0,1,1|1,1,0]=4 9604 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [0,0,0,0,1,1|0,1,0]=3 9605 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [0,0,0,0,1,1|1,1,0]=4 9606 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [0,0,0,0,1,1|1,1,0]=4 9607 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [0,0,0,0,1,1|1,1,0]=4 9608 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [0,0,0,0,1,1|1,1,0]=4 9609 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [0,0,0,0,1,1|1,1,0]=4 9610 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [0,0,0,0,1,1|1,1,0]=4 9611 B12R1.438 CSc1ccnc(c1)NC(=O)C 62a_200000210301_100012362434 [0,0,0,0,1,1|1,1,0]=4 9612 B12R1.438 CSc1cncc(c1)NC(=O)C 62a_200000210301_100012351681 [0,0,0,0,1,1|1,1,0]=4 9613 B12R1.438 [13CH3]C(=O)Cc1cccc(c1)C#N 1458a_100000684415_200025704644 [0,0,0,0,1,1|2,0,0]=4 9614 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [0,0,0,0,1,1|2,0,0]=4 9615 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [0,0,0,0,1,1|2,0,0]=4 9616 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,0,0,0,1,1|1,0,0]=3 9617 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,0,0,0,1,1|1,0,0]=3 9618 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [0,0,0,0,1,1|2,0,0]=4 9619 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [0,0,0,0,1,1|2,0,0]=4 9620 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [0,0,0,0,1,1|1,1,0]=4 9621 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [0,0,0,0,1,1|1,1,0]=4 9622 B14R1.4 C#Cc1ccc(cc1)COCC(=O)C 34a_100000211253_100000140223 [0,0,0,0,0,2|1,0,1]=4 9623 B14R1.4 C#Cc1ccc(cc1)NCOC(=O)C 34a_100011215031_100009813279 [0,0,0,0,0,2|1,0,1]=4 9624 B14R1.4 C=C(C)C=NNc1ccc(cc1)OC 4a_100000005221_100000210575 [0,0,0,0,0,2|1,0,1]=4 9625 B14R1.4 C=C(C)CCNc1ccc(cc1)CC 2230a_100000211069_100000730704 [0,0,0,0,0,2|2,0,0]=4 9626 B14R1.4 C=C(C)CCNc1ccc(cc1)CC 34a_100000211069_100000730704 [0,0,0,0,0,2|2,0,0]=4 9627 B14R1.4 C=C(C)CCNc1ccc(cc1)OC 34a_100000184247_100000730704 [0,0,0,0,0,2|1,0,0]=3 9628 B14R1.4 C=C(C)CCNc1ccc(cc1)SC 34a_100000212337_100000730704 [0,0,0,0,0,2|1,1,0]=4 9629 B14R1.4 C=C(C)CCOc1ccc(cc1)CC 34a_100000211359_100000730704 [0,0,0,0,0,2|2,0,0]=4 9630 B14R1.4 C=C(C)CCOc1ccc(cc1)CC 7a_100000211359_100000730704 [0,0,0,0,0,2|2,0,0]=4 9631 B14R1.4 C=C(C)CCOc1ccc(cc1)NC 34a_100000182112_100000730704 [0,0,0,0,0,2|2,0,0]=4 9632 B14R1.4 C=C(C)CCOc1ccc(cc1)OC 34a_100000210503_100000730704 [0,0,0,0,0,2|1,0,0]=3 9633 B14R1.4 C=C(C)CCOc1ccc(cc1)SC 34a_100000211864_100000730704 [0,0,0,0,0,2|1,1,0]=4 9634 B14R1.4 C=C(C)CCOc1ccc(cn1)OC 34a_100012002028_100000730704 [0,0,0,0,0,2|2,0,0]=4 9635 B14R1.4 C=C(C)CCOc1ccc(nc1)OC 34a_100011934560_100000730704 [0,0,0,0,0,2|2,0,0]=4 9636 B14R1.4 C=C(C)CCSc1ccc(cc1)CC 62a_100000730704_100011215824 [0,0,0,0,0,2|2,0,0]=4 9637 B14R1.4 C=C(C)CCSc1ccc(cc1)CC 62a_100011215824_100000730704 [0,0,0,0,0,2|2,0,0]=4 9638 B14R1.4 C=C(C)CCSc1ccc(cc1)NC 62a_100000730704_100000743151 [0,0,0,0,0,2|2,0,0]=4 9639 B14R1.4 C=C(C)CCSc1ccc(cc1)NC 62a_100000743151_100000730704 [0,0,0,0,0,2|2,0,0]=4 9640 B14R1.4 C=C(C)CCSc1ccc(cc1)OC 62a_100000730704_100000171711 [0,0,0,0,0,2|1,0,0]=3 9641 B14R1.4 C=C(C)CCSc1ccc(cc1)SC 62a_100000730704_100011263217 [0,0,0,0,0,2|1,1,0]=4 9642 B14R1.4 C=C(C)CCSc1ccc(cc1)SC 62a_100011263217_100000730704 [0,0,0,0,0,2|1,1,0]=4 9643 B14R1.4 C=C(C)CCSc1ccc(cn1)OC 62a_100000730704_100000744180 [0,0,0,0,0,2|2,0,0]=4 9644 B14R1.4 C=C(C)CCSc1ccc(cn1)OC 62a_100000755202_100000730704 [0,0,0,0,0,2|2,0,0]=4 9645 B14R1.4 C=C(C)CCSc1ccc(nc1)OC 62a_100000047065_100000730704 [0,0,0,0,0,2|2,0,0]=4 9646 B14R1.4 C=C(C)CCSc1ccc(nc1)OC 62a_100000730704_100000047065 [0,0,0,0,0,2|2,0,0]=4 9647 B14R1.4 C=C(C)CNCc1ccc(cc1)CC 2230a_100000721222_100000748629 [0,0,0,0,0,2|2,0,0]=4 9648 B14R1.4 C=C(C)CNCc1ccc(cc1)CC 34a_100000721222_100000748629 [0,0,0,0,0,2|2,0,0]=4 9649 B14R1.4 C=C(C)CNCc1ccc(cc1)OC 34a_100000185587_100000748629 [0,0,0,0,0,2|1,0,0]=3 9650 B14R1.4 C=C(C)CNCc1ccc(cc1)SC 2230a_100000174980_100000748629 [0,0,0,0,0,2|1,1,0]=4 9651 B14R1.4 C=C(C)CNCc1ccc(cc1)SC 34a_100000174980_100000748629 [0,0,0,0,0,2|1,1,0]=4 9652 B14R1.4 C=C(C)CNCc1ccc(cn1)OC 34a_100000703904_100000748629 [0,0,0,0,0,2|2,0,0]=4 9653 B14R1.4 C=C(C)CNCc1ccc(nc1)OC 2230a_100000241975_100000748629 [0,0,0,0,0,2|2,0,0]=4 9654 B14R1.4 C=C(C)COCc1ccc(cc1)CC 34a_100000210245_100000747183 [0,0,0,0,0,2|2,0,0]=4 9655 B14R1.4 C=C(C)COCc1ccc(cc1)CC 34a_100000702245_100000748629 [0,0,0,0,0,2|2,0,0]=4 9656 B14R1.4 C=C(C)COCc1ccc(cc1)CC 7a_100000702245_100000748629 [0,0,0,0,0,2|2,0,0]=4 9657 B14R1.4 C=C(C)COCc1ccc(cc1)OC 34a_100000173359_100000748629 [0,0,0,0,0,2|1,0,0]=3 9658 B14R1.4 C=C(C)COCc1ccc(cc1)OC 34a_100000210245_100000742318 [0,0,0,0,0,2|1,0,0]=3 9659 B14R1.4 C=C(C)COCc1ccc(cc1)SC 34a_100000210245_100000181263 [0,0,0,0,0,2|1,1,0]=4 9660 B14R1.4 C=C(C)COCc1ccc(cc1)SC 34a_100011215404_100000748629 [0,0,0,0,0,2|1,1,0]=4 9661 B14R1.4 C=C(C)COCc1ccc(cc1)SC 7a_100011215404_100000748629 [0,0,0,0,0,2|1,1,0]=4 9662 B14R1.4 C=C(C)COCc1ccc(cn1)OC 34a_100000210245_200000757186 [0,0,0,0,0,2|2,0,0]=4 9663 B14R1.4 C=C(C)COCc1ccc(cn1)OC 34a_100011998694_100000748629 [0,0,0,0,0,2|2,0,0]=4 9664 B14R1.4 C=C(C)COCc1ccc(nc1)OC 34a_100000210245_100020631284 [0,0,0,0,0,2|2,0,0]=4 9665 B14R1.4 C=C(C)COCc1ccc(nc1)OC 34a_100000763316_100000748629 [0,0,0,0,0,2|2,0,0]=4 9666 B14R1.4 C=C(C)CSCc1ccc(cc1)CC 62a_100000748629_100000747183 [0,0,0,0,0,2|2,0,0]=4 9667 B14R1.4 C=C(C)CSCc1ccc(cc1)CC 62a_100000757233_100000211660 [0,0,0,0,0,2|2,0,0]=4 9668 B14R1.4 C=C(C)CSCc1ccc(cc1)OC 62a_100000748629_100000742318 [0,0,0,0,0,2|1,0,0]=3 9669 B14R1.4 C=C(C)CSCc1ccc(cc1)SC 62a_100000181263_100000211660 [0,0,0,0,0,2|1,1,0]=4 9670 B14R1.4 C=C(C)CSCc1ccc(cc1)SC 62a_100000748629_100000181263 [0,0,0,0,0,2|1,1,0]=4 9671 B14R1.4 C=C(C)CSCc1ccc(cn1)OC 62a_100000748629_200000757186 [0,0,0,0,0,2|2,0,0]=4 9672 B14R1.4 C=C(C)CSCc1ccc(cn1)OC 62a_200000757186_100000211660 [0,0,0,0,0,2|2,0,0]=4 9673 B14R1.4 C=C(C)CSCc1ccc(nc1)OC 62a_100000748629_100020631284 [0,0,0,0,0,2|2,0,0]=4 9674 B14R1.4 C=C(C)CSCc1ccc(nc1)OC 62a_100020631284_100000211660 [0,0,0,0,0,2|2,0,0]=4 9675 B14R1.4 C=C(F)CNCc1ccc(cc1)OC 34a_100000185587_100009893438 [0,0,0,0,0,2|1,0,1]=4 9676 B14R1.4 C=C(F)COCc1ccc(cc1)OC 34a_100000173359_100009893438 [0,0,0,0,0,2|1,0,1]=4 9677 B14R1.4 C=C(F)COCc1ccc(cc1)OC 34a_200010262243_100000742318 [0,0,0,0,0,2|1,0,1]=4 9678 B14R1.4 C=C(F)CSCc1ccc(cc1)OC 62a_100000042424_100000742318 [0,0,0,0,0,2|1,0,1]=4 9679 B14R1.4 C=Cc1ccc(cc1)CCOC(=O)C 271570a_100011290941_200016374084 [0,0,0,0,0,2|1,0,1]=4 9680 B14R1.4 C=Cc1ccc(cc1)COCC(=O)C 34a_100000211253_100000034074 [0,0,0,0,0,2|1,0,1]=4 9681 B14R1.4 C=Cc1ccc(cc1)NCOC(=O)C 34a_100011218248_100009813279 [0,0,0,0,0,2|1,0,1]=4 9682 B14R1.4 C=Cc1ccc(cc1)OCCC(=O)C 7a_100000189437_100000053229 [0,0,0,0,0,2|1,0,1]=4 9683 B14R1.4 C=Cc1ccc(cc1)OCOC(=O)C 34a_100000189437_100009813279 [0,0,0,0,0,2|1,0,1]=4 9684 B14R1.4 C=Cc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000748128 [0,0,0,0,0,2|1,0,1]=4 9685 B14R1.4 C=Cc1ccc(cc1)SCCC(=O)C 62a_100000748128_100000053229 [0,0,0,0,0,2|1,0,1]=4 9686 B14R1.4 C=Cc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000748128 [0,0,0,0,0,2|1,0,1]=4 9687 B14R1.4 C=Cc1ccc(cc1)SCOC(=O)C 62a_100000748128_100000076356 [0,0,0,0,0,2|1,0,1]=4 9688 B14R1.4 CC(=O)CCOc1ccc(cc1)C#N 1458a_100000070787_100000184558 [0,0,0,0,0,2|2,0,0]=4 9689 B14R1.4 CC(=O)CCOc1ccc(cc1)C#N 1458a_100011194779_200000210301 [0,0,0,0,0,2|2,0,0]=4 9690 B14R1.4 CC(=O)CCOc1ccc(cc1)C#N 7a_100000210344_100000053229 [0,0,0,0,0,2|2,0,0]=4 9691 B14R1.4 CC(=O)CCOc1ccc(cc1)C=O 1458a_100000070787_100000040479 [0,0,0,0,0,2|2,0,0]=4 9692 B14R1.4 CC(=O)CCOc1ccc(cc1)CO 1458a_200011215777_200000210301 [0,0,0,0,0,2|2,0,0]=4 9693 B14R1.4 CC(=O)CCSc1ccc(cc1)C#N 62a_100000053229_100000184291 [0,0,0,0,0,2|2,0,0]=4 9694 B14R1.4 CC(=O)CCSc1ccc(cc1)C=O 62a_100000053229_100000188517 [0,0,0,0,0,2|2,0,0]=4 9695 B14R1.4 CC(=O)CCSc1ccc(cc1)C=O 62a_100000188517_100000053229 [0,0,0,0,0,2|2,0,0]=4 9696 B14R1.4 CC(=O)CCSc1ccc(cc1)CF 62a_100000053229_100010268989 [0,0,0,0,0,2|2,0,0]=4 9697 B14R1.4 CC(=O)CCSc1ccc(cc1)CF 62a_100010268989_100000053229 [0,0,0,0,0,2|2,0,0]=4 9698 B14R1.4 CC(=O)CCSc1ccc(cc1)CN 62a_100000053229_100016989417 [0,0,0,0,0,2|2,0,0]=4 9699 B14R1.4 CC(=O)CCSc1ccc(cc1)CN 62a_100016989417_100000053229 [0,0,0,0,0,2|2,0,0]=4 9700 B14R1.4 CC(=O)CCSc1ccc(cc1)CO 62a_100000053229_100000690907 [0,0,0,0,0,2|2,0,0]=4 9701 B14R1.4 CC(=O)CCSc1ccc(cc1)CO 62a_100000690907_100000053229 [0,0,0,0,0,2|2,0,0]=4 9702 B14R1.4 CC(=O)CCSc1ccc(cc1)NN 62a_100000053229_100016988836 [0,0,0,0,0,2|2,0,0]=4 9703 B14R1.4 CC(=O)CCSc1ccc(cc1)NN 62a_100016988836_100000053229 [0,0,0,0,0,2|2,0,0]=4 9704 B14R1.4 CC(=O)COCc1ccc(cc1)C#N 34a_100000211253_100000184898 [0,0,0,0,0,2|2,0,0]=4 9705 B14R1.4 CC(=O)COCc1ccc(cc1)C=O 34a_100000211253_100009816848 [0,0,0,0,0,2|2,0,0]=4 9706 B14R1.4 CC(=O)COCc1ccc(cc1)CO 34a_100000211253_100000067286 [0,0,0,0,0,2|2,0,0]=4 9707 B14R1.4 CC(=O)NCCc1ccc(cc1)C#N 11a_100015189369_100015343762 [0,0,0,0,0,2|2,0,0]=4 9708 B14R1.4 CC(=O)NCCc1ccc(cc1)C#N 1626a_100015189369_100015343762 [0,0,0,0,0,2|2,0,0]=4 9709 B14R1.4 CC(=O)NCCc1ccc(cc1)C#N 240690a_100015189369_100015343762 [0,0,0,0,0,2|2,0,0]=4 9710 B14R1.4 CC(=O)NCCc1ccc(cc1)C#N 527a_100015189369_100103153847 [0,0,0,0,0,2|2,0,0]=4 9711 B14R1.4 CC(=O)NCCc1ccc(cc1)O[13CH3] 34a_100011395907_200025704644 [0,0,0,0,0,2|0,0,0]=2 9712 B14R1.4 CC(=O)NCCc1ccc(cc1)O[13CH3] 7a_100011395907_200025704644 [0,0,0,0,0,2|0,0,0]=2 9713 B14R1.4 CC(=O)NNCc1ccc(cc1)CO 22a_202495334029_100000070787 [0,0,0,0,0,2|2,0,0]=4 9714 B14R1.4 CC(=O)OCCc1ccc(cc1)S[13CH3] 62a_200016374084_200025704644 [0,0,0,0,0,2|0,1,0]=3 9715 B14R1.4 CC(=O)OCCc1ccc(cc1)S[13CH3] 62a_200025704644_200016374084 [0,0,0,0,0,2|0,1,0]=3 9716 B14R1.4 CC(=O)OCNc1ccc(cc1)C#N 34a_100000185469_100009813279 [0,0,0,0,0,2|2,0,0]=4 9717 B14R1.4 CC(=O)OCNc1ccc(cc1)CO 34a_100011215238_100009813279 [0,0,0,0,0,2|2,0,0]=4 9718 B14R1.4 CC(=O)OCOc1ccc(cc1)C#N 34a_100000210344_100009813279 [0,0,0,0,0,2|2,0,0]=4 9719 B14R1.4 CC(=O)OCOc1ccc(cc1)CN 34a_100000185549_100009813279 [0,0,0,0,0,2|2,0,0]=4 9720 B14R1.4 CC(=O)OCOc1ccc(cc1)CO 34a_100000211755_100009813279 [0,0,0,0,0,2|2,0,0]=4 9721 B14R1.4 CC(=O)OCSc1ccc(cc1)C#N 62a_100000076356_100000184291 [0,0,0,0,0,2|2,0,0]=4 9722 B14R1.4 CC(=O)OCSc1ccc(cc1)C=O 62a_100000076356_100000188517 [0,0,0,0,0,2|2,0,0]=4 9723 B14R1.4 CC(=O)OCSc1ccc(cc1)C=O 62a_100000188517_100000076356 [0,0,0,0,0,2|2,0,0]=4 9724 B14R1.4 CC(=O)OCSc1ccc(cc1)CF 62a_100000076356_100010268989 [0,0,0,0,0,2|2,0,0]=4 9725 B14R1.4 CC(=O)OCSc1ccc(cc1)CF 62a_100010268989_100000076356 [0,0,0,0,0,2|2,0,0]=4 9726 B14R1.4 CC(=O)OCSc1ccc(cc1)CN 62a_100000076356_100016989417 [0,0,0,0,0,2|2,0,0]=4 9727 B14R1.4 CC(=O)OCSc1ccc(cc1)CN 62a_100016989417_100000076356 [0,0,0,0,0,2|2,0,0]=4 9728 B14R1.4 CC(=O)OCSc1ccc(cc1)CO 62a_100000076356_100000690907 [0,0,0,0,0,2|2,0,0]=4 9729 B14R1.4 CC(=O)OCSc1ccc(cc1)CO 62a_100000690907_100000076356 [0,0,0,0,0,2|2,0,0]=4 9730 B14R1.4 CC(=O)OCSc1ccc(cc1)NN 62a_100000076356_100016988836 [0,0,0,0,0,2|2,0,0]=4 9731 B14R1.4 CC(=O)OCSc1ccc(cc1)NN 62a_100016988836_100000076356 [0,0,0,0,0,2|2,0,0]=4 9732 B14R1.4 CCc1ccc(cc1)C=NNC(=O)C 4a_100000189765_100000211036 [0,0,0,0,0,2|1,0,1]=4 9733 B14R1.4 CCc1ccc(cc1)CCCC(=O)C 1458a_100011236546_200000210301 [0,0,0,0,0,2|1,0,0]=3 9734 B14R1.4 CCc1ccc(cc1)CCCC(=O)[13CH3] 1458a_100011236546_200025704644 [0,0,0,0,0,2|1,0,0]=3 9735 B14R1.4 CCc1ccc(cc1)CCNC(=O)C 11a_100025712186_100015343762 [0,0,0,0,0,2|1,0,0]=3 9736 B14R1.4 CCc1ccc(cc1)CCNC(=O)C 1626a_100025712186_100015343762 [0,0,0,0,0,2|1,0,0]=3 9737 B14R1.4 CCc1ccc(cc1)CCNC(=O)C 240690a_100025712186_100015343762 [0,0,0,0,0,2|1,0,0]=3 9738 B14R1.4 CCc1ccc(cc1)CCNC(=O)C 527a_100025712186_100103153847 [0,0,0,0,0,2|1,0,0]=3 9739 B14R1.4 CCc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000747183 [0,0,0,0,0,2|2,0,0]=4 9740 B14R1.4 CCc1ccc(cc1)CNCC(=O)N 2230a_100000721222_100000747473 [0,0,0,0,0,2|2,0,0]=4 9741 B14R1.4 CCc1ccc(cc1)CNCC(=O)N 34a_100000721222_100000187820 [0,0,0,0,0,2|2,0,0]=4 9742 B14R1.4 CCc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000757233 [0,0,0,0,0,2|2,0,0]=4 9743 B14R1.4 CCc1ccc(cc1)CNCC(=O)[O-] 34a_100000721222_100020667443 [0,0,0,0,0,2|2,0,0]=4 9744 B14R1.4 CCc1ccc(cc1)COCC(=O)C 34a_100000211253_100000747183 [0,0,0,0,0,2|1,0,0]=3 9745 B14R1.4 CCc1ccc(cc1)COCC(=O)N 34a_100000702245_100000187820 [0,0,0,0,0,2|2,0,0]=4 9746 B14R1.4 CCc1ccc(cc1)COCC(=O)N 7a_100000702245_100000187820 [0,0,0,0,0,2|2,0,0]=4 9747 B14R1.4 CCc1ccc(cc1)COCC(=O)[O-] 34a_100000702245_100020667443 [0,0,0,0,0,2|2,0,0]=4 9748 B14R1.4 CCc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000747183 [0,0,0,0,0,2|2,0,0]=4 9749 B14R1.4 CCc1ccc(cc1)CSCC(=O)N 62a_100000757233_100000747473 [0,0,0,0,0,2|2,0,0]=4 9750 B14R1.4 CCc1ccc(cc1)CSCC(=O)[O-] 62a_100000757233_100020667443 [0,0,0,0,0,2|2,0,0]=4 9751 B14R1.4 CCc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000747183 [0,0,0,0,0,2|2,0,0]=4 9752 B14R1.4 CCc1ccc(cc1)NCC=C(C)C 2230a_100000211069_100000761012 [0,0,0,0,0,2|2,0,0]=4 9753 B14R1.4 CCc1ccc(cc1)NCC=C(C)C 34a_100000211069_100000761012 [0,0,0,0,0,2|2,0,0]=4 9754 B14R1.4 CCc1ccc(cc1)NCCC(=O)N 2230a_100000211069_100000744528 [0,0,0,0,0,2|2,0,0]=4 9755 B14R1.4 CCc1ccc(cc1)NCCC(=O)N 34a_100000211069_100000731001 [0,0,0,0,0,2|2,0,0]=4 9756 B14R1.4 CCc1ccc(cc1)NCOC(=O)C 34a_100000211069_100009813279 [0,0,0,0,0,2|1,0,0]=3 9757 B14R1.4 CCc1ccc(cc1)OCC=C(C)C 34a_100000211359_100000761012 [0,0,0,0,0,2|2,0,0]=4 9758 B14R1.4 CCc1ccc(cc1)OCC=C(C)C 7a_100000211359_100000761012 [0,0,0,0,0,2|2,0,0]=4 9759 B14R1.4 CCc1ccc(cc1)OCCC(=O)C 7a_100000211359_100000053229 [0,0,0,0,0,2|1,0,0]=3 9760 B14R1.4 CCc1ccc(cc1)OCCC(=O)N 34a_100000211359_100000731001 [0,0,0,0,0,2|2,0,0]=4 9761 B14R1.4 CCc1ccc(cc1)OCCC(=O)N 7a_100000211359_100000744528 [0,0,0,0,0,2|2,0,0]=4 9762 B14R1.4 CCc1ccc(cc1)OCOC(=O)C 34a_100000211359_100009813279 [0,0,0,0,0,2|1,0,0]=3 9763 B14R1.4 CCc1ccc(cc1)SCC=C(C)C 62a_100000761012_100011215824 [0,0,0,0,0,2|2,0,0]=4 9764 B14R1.4 CCc1ccc(cc1)SCC=C(C)C 62a_100011215824_100000761012 [0,0,0,0,0,2|2,0,0]=4 9765 B14R1.4 CCc1ccc(cc1)SCCC(=O)C 62a_100000053229_100011215824 [0,0,0,0,0,2|1,0,0]=3 9766 B14R1.4 CCc1ccc(cc1)SCCC(=O)C 62a_100011215824_100000053229 [0,0,0,0,0,2|1,0,0]=3 9767 B14R1.4 CCc1ccc(cc1)SCCC(=O)N 62a_100000744528_100011215824 [0,0,0,0,0,2|2,0,0]=4 9768 B14R1.4 CCc1ccc(cc1)SCCC(=O)N 62a_100011215824_100000744528 [0,0,0,0,0,2|2,0,0]=4 9769 B14R1.4 CCc1ccc(cc1)SCOC(=O)C 62a_100000076356_100011215824 [0,0,0,0,0,2|1,0,0]=3 9770 B14R1.4 CCc1ccc(cc1)SCOC(=O)C 62a_100011215824_100000076356 [0,0,0,0,0,2|1,0,0]=3 9771 B14R1.4 CCc1ccc(cn1)SCCC(=O)C 62a_100000053229_100009820025 [0,0,0,0,0,2|2,0,0]=4 9772 B14R1.4 CCc1ccc(cn1)SCCC(=O)C 62a_100009820025_100000053229 [0,0,0,0,0,2|2,0,0]=4 9773 B14R1.4 CCc1ccc(cn1)SCOC(=O)C 62a_100000076356_100009820025 [0,0,0,0,0,2|2,0,0]=4 9774 B14R1.4 CCc1ccc(cn1)SCOC(=O)C 62a_100009820025_100000076356 [0,0,0,0,0,2|2,0,0]=4 9775 B14R1.4 CCc1ccc(nc1)SCCC(=O)C 62a_100000053229_100009843584 [0,0,0,0,0,2|2,0,0]=4 9776 B14R1.4 CCc1ccc(nc1)SCCC(=O)C 62a_100009843584_100000053229 [0,0,0,0,0,2|2,0,0]=4 9777 B14R1.4 CCc1ccc(nc1)SCOC(=O)C 62a_100000076356_100009843584 [0,0,0,0,0,2|2,0,0]=4 9778 B14R1.4 CCc1ccc(nc1)SCOC(=O)C 62a_100009843584_100000076356 [0,0,0,0,0,2|2,0,0]=4 9779 B14R1.4 CNc1ccc(cc1)OCC=C(C)C 34a_100000182112_100000761012 [0,0,0,0,0,2|2,0,0]=4 9780 B14R1.4 CNc1ccc(cc1)OCCC(=O)N 34a_100000182112_100000731001 [0,0,0,0,0,2|2,0,0]=4 9781 B14R1.4 CNc1ccc(cc1)OCOC(=O)C 34a_100000182112_100009813279 [0,0,0,0,0,2|1,0,0]=3 9782 B14R1.4 CNc1ccc(cc1)SCC=C(C)C 62a_100000743151_100000761012 [0,0,0,0,0,2|2,0,0]=4 9783 B14R1.4 CNc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000743151 [0,0,0,0,0,2|2,0,0]=4 9784 B14R1.4 CNc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000743151 [0,0,0,0,0,2|1,0,0]=3 9785 B14R1.4 CNc1ccc(cc1)SCCC(=O)C 62a_100000743151_100000053229 [0,0,0,0,0,2|1,0,0]=3 9786 B14R1.4 CNc1ccc(cc1)SCCC(=O)N 62a_100000743151_100000744528 [0,0,0,0,0,2|2,0,0]=4 9787 B14R1.4 CNc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000743151 [0,0,0,0,0,2|2,0,0]=4 9788 B14R1.4 CNc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000743151 [0,0,0,0,0,2|1,0,0]=3 9789 B14R1.4 CNc1ccc(cc1)SCOC(=O)C 62a_100000743151_100000076356 [0,0,0,0,0,2|1,0,0]=3 9790 B14R1.4 CNc1ccc(cn1)SCCC(=O)C 62a_100000053229_100000741341 [0,0,0,0,0,2|2,0,0]=4 9791 B14R1.4 CNc1ccc(cn1)SCCC(=O)C 62a_100000741341_100000053229 [0,0,0,0,0,2|2,0,0]=4 9792 B14R1.4 CNc1ccc(cn1)SCOC(=O)C 62a_100000076356_100000741341 [0,0,0,0,0,2|2,0,0]=4 9793 B14R1.4 CNc1ccc(cn1)SCOC(=O)C 62a_100000741341_100000076356 [0,0,0,0,0,2|2,0,0]=4 9794 B14R1.4 CNc1ccc(nc1)SCCC(=O)C 62a_100000053229_100000764248 [0,0,0,0,0,2|2,0,0]=4 9795 B14R1.4 CNc1ccc(nc1)SCCC(=O)C 62a_100000764248_100000053229 [0,0,0,0,0,2|2,0,0]=4 9796 B14R1.4 CNc1ccc(nc1)SCOC(=O)C 62a_100000076356_100000764248 [0,0,0,0,0,2|2,0,0]=4 9797 B14R1.4 CNc1ccc(nc1)SCOC(=O)C 62a_100000764248_100000076356 [0,0,0,0,0,2|2,0,0]=4 9798 B14R1.4 COc1ccc(cc1)C=CCC(C)C 271570a_100016259101_100000171711 [0,0,0,0,0,2|1,0,1]=4 9799 B14R1.4 COc1ccc(cc1)C=CCN(C)C 270004a_100102631434_100016259823 [0,0,0,0,0,2|2,0,0]=4 9800 B14R1.4 COc1ccc(cc1)C=NNC(=O)C 4a_100000189765_100000169835 [0,0,0,0,0,2|0,0,1]=3 9801 B14R1.4 COc1ccc(cc1)CCCC(=O)C 1458a_100000070787_100011740616 [0,0,0,0,0,2|0,0,0]=2 9802 B14R1.4 COc1ccc(cc1)CCCC(=O)C 1458a_100000186216_200000210301 [0,0,0,0,0,2|0,0,0]=2 9803 B14R1.4 COc1ccc(cc1)CCCC(=O)[13CH3] 1458a_100000186216_200025704644 [0,0,0,0,0,2|0,0,0]=2 9804 B14R1.4 COc1ccc(cc1)CCCN(C)C 2230a_100102631434_100011740616 [0,0,0,0,0,2|2,0,0]=4 9805 B14R1.4 COc1ccc(cc1)CCCN(C)C 269982a_100102631434_100011740616 [0,0,0,0,0,2|2,0,0]=4 9806 B14R1.4 COc1ccc(cc1)CCCN(C)C 270004a_100102631434_100011361577 [0,0,0,0,0,2|2,0,0]=4 9807 B14R1.4 COc1ccc(cc1)CCNC(=O)C 11a_100000210796_100015343762 [0,0,0,0,0,2|0,0,0]=2 9808 B14R1.4 COc1ccc(cc1)CCNC(=O)C 1626a_100000210796_100015343762 [0,0,0,0,0,2|0,0,0]=2 9809 B14R1.4 COc1ccc(cc1)CCNC(=O)C 240690a_100000210796_100015343762 [0,0,0,0,0,2|0,0,0]=2 9810 B14R1.4 COc1ccc(cc1)CCNC(=O)C 34a_100011395907_200000210301 [0,0,0,0,0,2|0,0,0]=2 9811 B14R1.4 COc1ccc(cc1)CCNC(=O)C 527a_100000210796_100103153847 [0,0,0,0,0,2|0,0,0]=2 9812 B14R1.4 COc1ccc(cc1)CCNC(=O)C 7a_100011395907_200000210301 [0,0,0,0,0,2|0,0,0]=2 9813 B14R1.4 COc1ccc(cc1)CCNC(C)C 2230a_100000210796_100000210206 [0,0,0,0,0,2|1,0,1]=4 9814 B14R1.4 COc1ccc(cc1)CCNC(C)C 2230a_100138425928_100011713689 [0,0,0,0,0,2|1,0,1]=4 9815 B14R1.4 COc1ccc(cc1)CCNC(C)C 34a_100000210796_100000210206 [0,0,0,0,0,2|1,0,1]=4 9816 B14R1.4 COc1ccc(cc1)CCNC(C)C 34a_100138425928_100000184700 [0,0,0,0,0,2|1,0,1]=4 9817 B14R1.4 COc1ccc(cc1)CCOC(C)C 34a_100000212225_100000184700 [0,0,0,0,0,2|1,0,1]=4 9818 B14R1.4 COc1ccc(cc1)CCOC(C)C 34a_100011219623_100000210206 [0,0,0,0,0,2|1,0,1]=4 9819 B14R1.4 COc1ccc(cc1)CCOC(C)C 7a_100011219623_100000210206 [0,0,0,0,0,2|1,0,1]=4 9820 B14R1.4 COc1ccc(cc1)CCSC(C)C 62a_100000210206_100011713689 [0,0,0,0,0,2|1,0,1]=4 9821 B14R1.4 COc1ccc(cc1)CCSC(C)C 62a_100011713689_100000210206 [0,0,0,0,0,2|1,0,1]=4 9822 B14R1.4 COc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000742318 [0,0,0,0,0,2|1,0,0]=3 9823 B14R1.4 COc1ccc(cc1)CNCC(=O)N 34a_100000185587_100000187820 [0,0,0,0,0,2|1,0,0]=3 9824 B14R1.4 COc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000742318 [0,0,0,0,0,2|1,0,0]=3 9825 B14R1.4 COc1ccc(cc1)CNCC(=O)[O-] 34a_100000185587_100020667443 [0,0,0,0,0,2|1,0,0]=3 9826 B14R1.4 COc1ccc(cc1)CNCC(C)C 207a_100000210953_100000169835 [0,0,0,0,0,2|1,0,1]=4 9827 B14R1.4 COc1ccc(cc1)CNCC(C)C 2230a_100000210953_100000742318 [0,0,0,0,0,2|1,0,1]=4 9828 B14R1.4 COc1ccc(cc1)CNCC(C)C 26a_100000210953_100000210503 [0,0,0,0,0,2|1,0,1]=4 9829 B14R1.4 COc1ccc(cc1)CNCC(C)C 270004a_100000185587_100000210432 [0,0,0,0,0,2|1,0,1]=4 9830 B14R1.4 COc1ccc(cc1)CNCC(C)C 270004a_100000210953_100000169835 [0,0,0,0,0,2|1,0,1]=4 9831 B14R1.4 COc1ccc(cc1)CNCC(C)C 34a_100000185587_100000210624 [0,0,0,0,0,2|1,0,1]=4 9832 B14R1.4 COc1ccc(cc1)CNCC(C)C 34a_100000210953_100000742318 [0,0,0,0,0,2|1,0,1]=4 9833 B14R1.4 COc1ccc(cc1)CNCC(C)O 207a_100000210904_100000169835 [0,0,0,0,0,2|0,0,2]=4 9834 B14R1.4 COc1ccc(cc1)CNCC(C)O 2230a_100000210904_100000742318 [0,0,0,0,0,2|0,0,2]=4 9835 B14R1.4 COc1ccc(cc1)CNCC(C)O 270004a_100000210904_100000169835 [0,0,0,0,0,2|0,0,2]=4 9836 B14R1.4 COc1ccc(cc1)CNCC(C)O 34a_100000185587_100011218427 [0,0,0,0,0,2|0,0,2]=4 9837 B14R1.4 COc1ccc(cc1)CNCC(C)O 34a_100000210904_100000742318 [0,0,0,0,0,2|0,0,2]=4 9838 B14R1.4 COc1ccc(cc1)CNC[C@@H](C)O 34a_100000185587_100009817552 [0,0,0,0,0,2|0,0,2]=4 9839 B14R1.4 COc1ccc(cc1)CNC[N+](=O)[O-] 34a_100000185587_100000761209 [0,0,0,0,0,2|2,0,0]=4 9840 B14R1.4 COc1ccc(cc1)CNNC(=O)C 22a_100000741578_100000070787 [0,0,0,0,0,2|0,0,0]=2 9841 B14R1.4 COc1ccc(cc1)COCC(=O)C 1458a_100000741626_200000210301 [0,0,0,0,0,2|0,0,0]=2 9842 B14R1.4 COc1ccc(cc1)COCC(=O)C 34a_100000211253_100000742318 [0,0,0,0,0,2|0,0,0]=2 9843 B14R1.4 COc1ccc(cc1)COCC(=O)N 34a_100000173359_100000187820 [0,0,0,0,0,2|1,0,0]=3 9844 B14R1.4 COc1ccc(cc1)COCC(=O)[13CH3] 1458a_100000741626_200025704644 [0,0,0,0,0,2|0,0,0]=2 9845 B14R1.4 COc1ccc(cc1)COCC(=O)[O-] 34a_100000173359_100020667443 [0,0,0,0,0,2|1,0,0]=3 9846 B14R1.4 COc1ccc(cc1)COCC(C)Br 34a_100012180447_100000742318 [0,0,0,0,0,2|1,0,1]=4 9847 B14R1.4 COc1ccc(cc1)COCC(C)C 34a_100000173359_100000210624 [0,0,0,0,0,2|1,0,1]=4 9848 B14R1.4 COc1ccc(cc1)COCC(C)C 34a_100000210257_100000742318 [0,0,0,0,0,2|1,0,1]=4 9849 B14R1.4 COc1ccc(cc1)COCC(C)F 34a_100015925927_100000742318 [0,0,0,0,0,2|1,0,1]=4 9850 B14R1.4 COc1ccc(cc1)COCC(C)O 34a_100000173359_100011218427 [0,0,0,0,0,2|0,0,2]=4 9851 B14R1.4 COc1ccc(cc1)COC[C@@H](C)Cl 34a_100016084084_100000742318 [0,0,0,0,0,2|1,0,1]=4 9852 B14R1.4 COc1ccc(cc1)COC[C@@H](C)N 34a_100000737577_100000742318 [0,0,0,0,0,2|1,0,1]=4 9853 B14R1.4 COc1ccc(cc1)COC[C@@H](C)O 34a_100000173359_100009817552 [0,0,0,0,0,2|0,0,2]=4 9854 B14R1.4 COc1ccc(cc1)COC[N+](=O)[O-] 34a_100000173359_100000761209 [0,0,0,0,0,2|2,0,0]=4 9855 B14R1.4 COc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000742318 [0,0,0,0,0,2|1,0,0]=3 9856 B14R1.4 COc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000742318 [0,0,0,0,0,2|1,0,0]=3 9857 B14R1.4 COc1ccc(cc1)CSCC(C)C 62a_100000210624_100000742318 [0,0,0,0,0,2|1,0,1]=4 9858 B14R1.4 COc1ccc(cc1)CSCC(C)O 62a_100011218427_100000742318 [0,0,0,0,0,2|0,0,2]=4 9859 B14R1.4 COc1ccc(cc1)CSC[C@@H](C)O 62a_100009817552_100000742318 [0,0,0,0,0,2|0,0,2]=4 9860 B14R1.4 COc1ccc(cc1)NCC=C(C)C 34a_100000184247_100000761012 [0,0,0,0,0,2|1,0,0]=3 9861 B14R1.4 COc1ccc(cc1)NCCC(=O)N 34a_100000184247_100000731001 [0,0,0,0,0,2|1,0,0]=3 9862 B14R1.4 COc1ccc(cc1)NCCC(C)C 34a_100000184247_100000210312 [0,0,0,0,0,2|1,0,1]=4 9863 B14R1.4 COc1ccc(cc1)NCCC(C)O 34a_100000184247_100012276601 [0,0,0,0,0,2|0,0,2]=4 9864 B14R1.4 COc1ccc(cc1)NCOC(=O)C 34a_100000184247_100009813279 [0,0,0,0,0,2|0,0,0]=2 9865 B14R1.4 COc1ccc(cc1)NCOC(C)C 34a_100000184247_100000709892 [0,0,0,0,0,2|1,0,1]=4 9866 B14R1.4 COc1ccc(cc1)OCC=C(C)C 34a_100000210503_100000761012 [0,0,0,0,0,2|1,0,0]=3 9867 B14R1.4 COc1ccc(cc1)OCCC(=O)C 1458a_100000070787_100000183225 [0,0,0,0,0,2|0,0,0]=2 9868 B14R1.4 COc1ccc(cc1)OCCC(=O)C 1458a_100000182993_200000210301 [0,0,0,0,0,2|0,0,0]=2 9869 B14R1.4 COc1ccc(cc1)OCCC(=O)N 34a_100000210503_100000731001 [0,0,0,0,0,2|1,0,0]=3 9870 B14R1.4 COc1ccc(cc1)OCCC(=O)[13CH3] 1458a_100000182993_200025704644 [0,0,0,0,0,2|0,0,0]=2 9871 B14R1.4 COc1ccc(cc1)OCCC(C)C 34a_100000210503_100000210312 [0,0,0,0,0,2|1,0,1]=4 9872 B14R1.4 COc1ccc(cc1)OCCC(C)O 34a_100000210503_100012276601 [0,0,0,0,0,2|0,0,2]=4 9873 B14R1.4 COc1ccc(cc1)OCCN(C)C 2230a_100102631434_100000183225 [0,0,0,0,0,2|2,0,0]=4 9874 B14R1.4 COc1ccc(cc1)OCCN(C)C 269982a_100102631434_100000183225 [0,0,0,0,0,2|2,0,0]=4 9875 B14R1.4 COc1ccc(cc1)OCOC(=O)C 34a_100000210503_100009813279 [0,0,0,0,0,2|0,0,0]=2 9876 B14R1.4 COc1ccc(cc1)OCOC(C)C 34a_100000210503_100000709892 [0,0,0,0,0,2|1,0,1]=4 9877 B14R1.4 COc1ccc(cc1)SCC=C(C)C 62a_100000761012_100000171711 [0,0,0,0,0,2|1,0,0]=3 9878 B14R1.4 COc1ccc(cc1)SCCC(=O)C 62a_100000053229_100000171711 [0,0,0,0,0,2|0,0,0]=2 9879 B14R1.4 COc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000171711 [0,0,0,0,0,2|1,0,0]=3 9880 B14R1.4 COc1ccc(cc1)SCCC(C)C 62a_100000210312_100000171711 [0,0,0,0,0,2|1,0,1]=4 9881 B14R1.4 COc1ccc(cc1)SCCC(C)O 62a_100012276601_100000171711 [0,0,0,0,0,2|0,0,2]=4 9882 B14R1.4 COc1ccc(cc1)SCOC(=O)C 62a_100000076356_100000171711 [0,0,0,0,0,2|0,0,0]=2 9883 B14R1.4 COc1ccc(cc1)SCOC(C)C 62a_100000709892_100000171711 [0,0,0,0,0,2|1,0,1]=4 9884 B14R1.4 COc1ccc(cn1)C=NNC(=O)C 4a_100000189765_100000761633 [0,0,0,0,0,2|1,0,1]=4 9885 B14R1.4 COc1ccc(cn1)CCNC(=O)C 11a_100011998949_100015343762 [0,0,0,0,0,2|1,0,0]=3 9886 B14R1.4 COc1ccc(cn1)CCNC(=O)C 1626a_100011998949_100015343762 [0,0,0,0,0,2|1,0,0]=3 9887 B14R1.4 COc1ccc(cn1)CCNC(=O)C 240690a_100011998949_100015343762 [0,0,0,0,0,2|1,0,0]=3 9888 B14R1.4 COc1ccc(cn1)CCNC(=O)C 527a_100011998949_100103153847 [0,0,0,0,0,2|1,0,0]=3 9889 B14R1.4 COc1ccc(cn1)CNCC(=O)N 2230a_100000241975_100000747473 [0,0,0,0,0,2|2,0,0]=4 9890 B14R1.4 COc1ccc(cn1)CNCC(=O)N 2230a_100000711301_100020631284 [0,0,0,0,0,2|2,0,0]=4 9891 B14R1.4 COc1ccc(cn1)CNCC(=O)O 269956a_100016091260_100020631284 [0,0,0,0,0,2|2,0,0]=4 9892 B14R1.4 COc1ccc(cn1)COCC(=O)C 34a_100000211253_100020631284 [0,0,0,0,0,2|1,0,0]=3 9893 B14R1.4 COc1ccc(cn1)COCC(=O)N 34a_100000763316_100000187820 [0,0,0,0,0,2|2,0,0]=4 9894 B14R1.4 COc1ccc(cn1)COCC(=O)[O-] 34a_100000763316_100020667443 [0,0,0,0,0,2|2,0,0]=4 9895 B14R1.4 COc1ccc(cn1)CSCC(=O)N 62a_100000747473_100020631284 [0,0,0,0,0,2|2,0,0]=4 9896 B14R1.4 COc1ccc(cn1)CSCC(=O)N 62a_100020631284_100000747473 [0,0,0,0,0,2|2,0,0]=4 9897 B14R1.4 COc1ccc(cn1)CSCC(=O)[O-] 62a_100020631284_100020667443 [0,0,0,0,0,2|2,0,0]=4 9898 B14R1.4 COc1ccc(cn1)CSCC(=O)[O-] 62a_100020667443_100020631284 [0,0,0,0,0,2|2,0,0]=4 9899 B14R1.4 COc1ccc(cn1)OCC=C(C)C 34a_100011934560_100000761012 [0,0,0,0,0,2|2,0,0]=4 9900 B14R1.4 COc1ccc(cn1)OCCC(=O)N 34a_100011934560_100000731001 [0,0,0,0,0,2|2,0,0]=4 9901 B14R1.4 COc1ccc(cn1)OCOC(=O)C 34a_100011934560_100009813279 [0,0,0,0,0,2|1,0,0]=3 9902 B14R1.4 COc1ccc(cn1)SCC=C(C)C 62a_100000047065_100000761012 [0,0,0,0,0,2|2,0,0]=4 9903 B14R1.4 COc1ccc(cn1)SCC=C(C)C 62a_100000761012_100000047065 [0,0,0,0,0,2|2,0,0]=4 9904 B14R1.4 COc1ccc(cn1)SCCC(=O)C 62a_100000047065_100000053229 [0,0,0,0,0,2|1,0,0]=3 9905 B14R1.4 COc1ccc(cn1)SCCC(=O)C 62a_100000053229_100000047065 [0,0,0,0,0,2|1,0,0]=3 9906 B14R1.4 COc1ccc(cn1)SCCC(=O)N 62a_100000047065_100000744528 [0,0,0,0,0,2|2,0,0]=4 9907 B14R1.4 COc1ccc(cn1)SCCC(=O)N 62a_100000744528_100000047065 [0,0,0,0,0,2|2,0,0]=4 9908 B14R1.4 COc1ccc(cn1)SCOC(=O)C 62a_100000047065_100000076356 [0,0,0,0,0,2|1,0,0]=3 9909 B14R1.4 COc1ccc(cn1)SCOC(=O)C 62a_100000076356_100000047065 [0,0,0,0,0,2|1,0,0]=3 9910 B14R1.4 COc1ccc(nc1)C=NNC(=O)C 4a_100000189765_100000701244 [0,0,0,0,0,2|1,0,1]=4 9911 B14R1.4 COc1ccc(nc1)CNCC(=O)N 2230a_100000711301_200000757186 [0,0,0,0,0,2|2,0,0]=4 9912 B14R1.4 COc1ccc(nc1)CNCC(=O)N 34a_100000703904_100000187820 [0,0,0,0,0,2|2,0,0]=4 9913 B14R1.4 COc1ccc(nc1)CNCC(=O)O 269956a_100016091260_200000757186 [0,0,0,0,0,2|2,0,0]=4 9914 B14R1.4 COc1ccc(nc1)CNCC(=O)[O-] 34a_100000703904_100020667443 [0,0,0,0,0,2|2,0,0]=4 9915 B14R1.4 COc1ccc(nc1)COCC(=O)C 34a_100000211253_200000757186 [0,0,0,0,0,2|1,0,0]=3 9916 B14R1.4 COc1ccc(nc1)COCC(=O)N 34a_100011998694_100000187820 [0,0,0,0,0,2|2,0,0]=4 9917 B14R1.4 COc1ccc(nc1)COCC(=O)[O-] 34a_100011998694_100020667443 [0,0,0,0,0,2|2,0,0]=4 9918 B14R1.4 COc1ccc(nc1)CSCC(=O)N 62a_100000747473_200000757186 [0,0,0,0,0,2|2,0,0]=4 9919 B14R1.4 COc1ccc(nc1)CSCC(=O)N 62a_200000757186_100000747473 [0,0,0,0,0,2|2,0,0]=4 9920 B14R1.4 COc1ccc(nc1)CSCC(=O)[O-] 62a_100020667443_200000757186 [0,0,0,0,0,2|2,0,0]=4 9921 B14R1.4 COc1ccc(nc1)CSCC(=O)[O-] 62a_200000757186_100020667443 [0,0,0,0,0,2|2,0,0]=4 9922 B14R1.4 COc1ccc(nc1)OCC=C(C)C 34a_100012002028_100000761012 [0,0,0,0,0,2|2,0,0]=4 9923 B14R1.4 COc1ccc(nc1)OCCC(=O)N 34a_100012002028_100000731001 [0,0,0,0,0,2|2,0,0]=4 9924 B14R1.4 COc1ccc(nc1)OCOC(=O)C 34a_100012002028_100009813279 [0,0,0,0,0,2|1,0,0]=3 9925 B14R1.4 COc1ccc(nc1)SCC=C(C)C 62a_100000755202_100000761012 [0,0,0,0,0,2|2,0,0]=4 9926 B14R1.4 COc1ccc(nc1)SCC=C(C)C 62a_100000761012_100000744180 [0,0,0,0,0,2|2,0,0]=4 9927 B14R1.4 COc1ccc(nc1)SCCC(=O)C 62a_100000053229_100000744180 [0,0,0,0,0,2|1,0,0]=3 9928 B14R1.4 COc1ccc(nc1)SCCC(=O)C 62a_100000755202_100000053229 [0,0,0,0,0,2|1,0,0]=3 9929 B14R1.4 COc1ccc(nc1)SCCC(=O)N 62a_100000744528_100000744180 [0,0,0,0,0,2|2,0,0]=4 9930 B14R1.4 COc1ccc(nc1)SCCC(=O)N 62a_100000755202_100000744528 [0,0,0,0,0,2|2,0,0]=4 9931 B14R1.4 COc1ccc(nc1)SCOC(=O)C 62a_100000076356_100000744180 [0,0,0,0,0,2|1,0,0]=3 9932 B14R1.4 COc1ccc(nc1)SCOC(=O)C 62a_100000755202_100000076356 [0,0,0,0,0,2|1,0,0]=3 9933 B14R1.4 COc1ccc(nn1)SCCC(=O)C 62a_100000053229_100009819040 [0,0,0,0,0,2|2,0,0]=4 9934 B14R1.4 COc1ccc(nn1)SCCC(=O)C 62a_100009819040_100000053229 [0,0,0,0,0,2|2,0,0]=4 9935 B14R1.4 COc1ccc(nn1)SCOC(=O)C 62a_100000076356_100009819040 [0,0,0,0,0,2|2,0,0]=4 9936 B14R1.4 COc1ccc(nn1)SCOC(=O)C 62a_100009819040_100000076356 [0,0,0,0,0,2|2,0,0]=4 9937 B14R1.4 COc1cnc(cn1)SCCC(=O)C 62a_100000053229_100011998698 [0,0,0,0,0,2|2,0,0]=4 9938 B14R1.4 COc1cnc(cn1)SCCC(=O)C 62a_100011998698_100000053229 [0,0,0,0,0,2|2,0,0]=4 9939 B14R1.4 COc1cnc(cn1)SCOC(=O)C 62a_100000076356_100011998698 [0,0,0,0,0,2|2,0,0]=4 9940 B14R1.4 COc1cnc(cn1)SCOC(=O)C 62a_100011998698_100000076356 [0,0,0,0,0,2|2,0,0]=4 9941 B14R1.4 COc1cnc(nc1)SCCC(=O)C 62a_100000053229_100000069167 [0,0,0,0,0,2|2,0,0]=4 9942 B14R1.4 COc1cnc(nc1)SCCC(=O)C 62a_100000069167_100000053229 [0,0,0,0,0,2|2,0,0]=4 9943 B14R1.4 COc1cnc(nc1)SCOC(=O)C 62a_100000069167_100000076356 [0,0,0,0,0,2|2,0,0]=4 9944 B14R1.4 COc1cnc(nc1)SCOC(=O)C 62a_100000076356_100000069167 [0,0,0,0,0,2|2,0,0]=4 9945 B14R1.4 COc1ncc(cn1)OCCC(=O)C 7a_100000099601_100000053229 [0,0,0,0,0,2|2,0,0]=4 9946 B14R1.4 COc1ncc(cn1)OCOC(=O)C 34a_100000099601_100009813279 [0,0,0,0,0,2|2,0,0]=4 9947 B14R1.4 COc1ncc(cn1)SCCC(=O)C 62a_100000053229_100000686852 [0,0,0,0,0,2|2,0,0]=4 9948 B14R1.4 COc1ncc(cn1)SCCC(=O)C 62a_100000686852_100000053229 [0,0,0,0,0,2|2,0,0]=4 9949 B14R1.4 COc1ncc(cn1)SCOC(=O)C 62a_100000076356_100000686852 [0,0,0,0,0,2|2,0,0]=4 9950 B14R1.4 COc1ncc(cn1)SCOC(=O)C 62a_100000686852_100000076356 [0,0,0,0,0,2|2,0,0]=4 9951 B14R1.4 CSc1ccc(cc1)C=NNC(=O)C 4a_100000189765_100000211154 [0,0,0,0,0,2|0,1,1]=4 9952 B14R1.4 CSc1ccc(cc1)CCOC(=O)C 62a_200000210301_200016374084 [0,0,0,0,0,2|0,1,0]=3 9953 B14R1.4 CSc1ccc(cc1)CCOC(=O)C 62a_200016374084_200000210301 [0,0,0,0,0,2|0,1,0]=3 9954 B14R1.4 CSc1ccc(cc1)CNCC(=O)N 2230a_100000174980_100000747473 [0,0,0,0,0,2|1,1,0]=4 9955 B14R1.4 CSc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000181263 [0,0,0,0,0,2|1,1,0]=4 9956 B14R1.4 CSc1ccc(cc1)CNCC(=O)N 34a_100000174980_100000187820 [0,0,0,0,0,2|1,1,0]=4 9957 B14R1.4 CSc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000181263 [0,0,0,0,0,2|1,1,0]=4 9958 B14R1.4 CSc1ccc(cc1)CNCC(=O)[O-] 34a_100000174980_100020667443 [0,0,0,0,0,2|1,1,0]=4 9959 B14R1.4 CSc1ccc(cc1)CNNC(=O)C 22a_102495366275_100000070787 [0,0,0,0,0,2|0,1,0]=3 9960 B14R1.4 CSc1ccc(cc1)COCC(=O)C 34a_100000211253_100000181263 [0,0,0,0,0,2|0,1,0]=3 9961 B14R1.4 CSc1ccc(cc1)COCC(=O)N 34a_100011215404_100000187820 [0,0,0,0,0,2|1,1,0]=4 9962 B14R1.4 CSc1ccc(cc1)COCC(=O)N 7a_100011215404_100000187820 [0,0,0,0,0,2|1,1,0]=4 9963 B14R1.4 CSc1ccc(cc1)COCC(=O)[O-] 34a_100011215404_100020667443 [0,0,0,0,0,2|1,1,0]=4 9964 B14R1.4 CSc1ccc(cc1)CSCC(=O)N 62a_100000181263_100000747473 [0,0,0,0,0,2|1,1,0]=4 9965 B14R1.4 CSc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000181263 [0,0,0,0,0,2|1,1,0]=4 9966 B14R1.4 CSc1ccc(cc1)CSCC(=O)[O-] 62a_100000181263_100020667443 [0,0,0,0,0,2|1,1,0]=4 9967 B14R1.4 CSc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000181263 [0,0,0,0,0,2|1,1,0]=4 9968 B14R1.4 CSc1ccc(cc1)NCC=C(C)C 34a_100000212337_100000761012 [0,0,0,0,0,2|1,1,0]=4 9969 B14R1.4 CSc1ccc(cc1)NCCC(=O)N 34a_100000212337_100000731001 [0,0,0,0,0,2|1,1,0]=4 9970 B14R1.4 CSc1ccc(cc1)NCOC(=O)C 34a_100000212337_100009813279 [0,0,0,0,0,2|0,1,0]=3 9971 B14R1.4 CSc1ccc(cc1)OCC=C(C)C 34a_100000211864_100000761012 [0,0,0,0,0,2|1,1,0]=4 9972 B14R1.4 CSc1ccc(cc1)OCCC(=O)N 34a_100000211864_100000731001 [0,0,0,0,0,2|1,1,0]=4 9973 B14R1.4 CSc1ccc(cc1)OCOC(=O)C 34a_100000211864_100009813279 [0,0,0,0,0,2|0,1,0]=3 9974 B14R1.4 CSc1ccc(cc1)SCC=C(C)C 62a_100000761012_100011263217 [0,0,0,0,0,2|1,1,0]=4 9975 B14R1.4 CSc1ccc(cc1)SCC=C(C)C 62a_100011263217_100000761012 [0,0,0,0,0,2|1,1,0]=4 9976 B14R1.4 CSc1ccc(cc1)SCCC(=O)C 62a_100000053229_100011263217 [0,0,0,0,0,2|0,1,0]=3 9977 B14R1.4 CSc1ccc(cc1)SCCC(=O)C 62a_100011263217_100000053229 [0,0,0,0,0,2|0,1,0]=3 9978 B14R1.4 CSc1ccc(cc1)SCCC(=O)N 62a_100000744528_100011263217 [0,0,0,0,0,2|1,1,0]=4 9979 B14R1.4 CSc1ccc(cc1)SCCC(=O)N 62a_100011263217_100000744528 [0,0,0,0,0,2|1,1,0]=4 9980 B14R1.4 CSc1ccc(cc1)SCOC(=O)C 62a_100000076356_100011263217 [0,0,0,0,0,2|0,1,0]=3 9981 B14R1.4 CSc1ccc(cc1)SCOC(=O)C 62a_100011263217_100000076356 [0,0,0,0,0,2|0,1,0]=3 9982 B14R1.4 CSc1ccc(cn1)SCCC(=O)C 62a_100000053229_100011408404 [0,0,0,0,0,2|1,1,0]=4 9983 B14R1.4 CSc1ccc(cn1)SCCC(=O)C 62a_100011408404_100000053229 [0,0,0,0,0,2|1,1,0]=4 9984 B14R1.4 CSc1ccc(cn1)SCOC(=O)C 62a_100000076356_100011408404 [0,0,0,0,0,2|1,1,0]=4 9985 B14R1.4 CSc1ccc(cn1)SCOC(=O)C 62a_100011408404_100000076356 [0,0,0,0,0,2|1,1,0]=4 9986 B14R1.4 CSc1ccc(nc1)SCCC(=O)C 62a_100000053229_100009820866 [0,0,0,0,0,2|1,1,0]=4 9987 B14R1.4 CSc1ccc(nc1)SCCC(=O)C 62a_100009820866_100000053229 [0,0,0,0,0,2|1,1,0]=4 9988 B14R1.4 CSc1ccc(nc1)SCOC(=O)C 62a_100000076356_100009820866 [0,0,0,0,0,2|1,1,0]=4 9989 B14R1.4 CSc1ccc(nc1)SCOC(=O)C 62a_100009820866_100000076356 [0,0,0,0,0,2|1,1,0]=4 9990 B14R1.4 [13CH3]C(=O)CCOc1ccc(cc1)C#N 1458a_100011194779_200025704644 [0,0,0,0,0,2|2,0,0]=4 9991 B14R1.4 [13CH3]C(=O)CCOc1ccc(cc1)CO 1458a_200011215777_200025704644 [0,0,0,0,0,2|2,0,0]=4