0 B9R1.35 C=C(C)c1c[nH]c(n1)C 271570a_100000694244_100009814057 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 C=C(C)c1cc([nH]n1)C 271570a_100000694244_100015199547 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 C=C(C)c1cc(ns1)C 271570a_100000694244_100009815735 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 C=C(C)c1ccc(s1)Br 271570a_100000694244_100010197418 [0,0,0,0,0,0|2,1,0]=3 5 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [0,0,0,0,0,0|1,1,0]=2 6 B9R1.35 C=C(C)c1ccn(n1)C 271570a_100000694244_100000752436 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.35 C=C(C)c1cn(cn1)C 271570a_100000694244_100000040308 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 C=C(C)c1cnc(s1)C 271570a_100000694244_100000764884 [0,0,0,0,0,0|2,1,0]=3 9 B9R1.35 C=C(C)c1cnn(c1)C 271570a_100000694244_100000748075 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.35 C=C(C)c1cnn(n1)C 271570a_100000694244_100000733932 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 C=C(C)c1csc(n1)C 271570a_100000694244_100011934587 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 C=C(C)c1csc(n1)N 271570a_100000694244_100011998049 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.35 C=C(C)c1n[nH]c(n1)C 271570a_100000694244_100000732540 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 C=C(C)c1nc(c[nH]1)C 271570a_100000694244_100161115468 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 C=C(C)c1nc(cs1)Br 271570a_100000694244_200016082925 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.35 C=C(C)c1nc(cs1)C 271570a_100000694244_100011291629 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.35 C=C(C)c1nc(cs1)N 271570a_100000694244_200015188442 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.35 C=C(C)c1nc(ns1)C 271570a_100000694244_100000709739 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [0,0,0,0,0,0|2,1,0]=3 21 B9R1.35 C=C(C)c1ncn(n1)C 271570a_100000694244_100009819955 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 C=C(C)c1nnc(o1)C 271570a_100000694244_100000708914 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.35 C=C(C)c1nnc(s1)C 271570a_100000694244_100000686958 [0,0,0,0,0,0|3,1,0]=4 24 B9R1.35 C=C(C)c1noc(n1)C 271570a_100000694244_100012003639 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 CC(=O)C1CC(=NO1)C 1458a_100000763720_200000210301 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [0,0,0,0,0,0|1,0,3]=4 27 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [0,0,0,0,0,0|1,1,0]=2 31 B9R1.35 CC(=O)c1cn(nn1)C 274090a_200000210301_100000690481 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.35 CC(=O)c1cn(nn1)[13CH3] 274090a_200025704644_100000690481 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [0,0,0,0,0,0|2,1,0]=3 34 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.35 CC(=O)c1nc(cs1)O 271570a_203496583355_100010231720 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.35 CC(=O)c1ncc(s1)O 271570a_203496583355_100000693680 [0,0,0,0,0,0|2,1,0]=3 37 B9R1.35 CC(=O)n1cc(cn1)O 271570a_203496583355_100010205889 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.35 CC(N)c1ccc(s1)O 271570a_203496583355_100102723530 [0,0,0,0,0,0|2,1,1]=4 39 B9R1.35 CC1=NOC(C1)C(=O)[13CH3] 1458a_100000763720_200025704644 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.35 Cc1nnc(o1)N(C)C 27a_100102631434_100000708914 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.35 Cc1noc(n1)C(=O)N 270196a_100000212224_100011215815 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [0,0,0,0,0,0|2,1,0]=3 46 B9R1.35 NC(=O)c1cnc(s1)O 271570a_203496583355_100010220624 [0,0,0,0,0,0|3,1,0]=4 47 B9R1.35 NC(=O)c1coc(n1)O 271570a_203496583355_100009981048 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.35 NC(=O)c1csc(n1)O 271570a_203496583355_100010247141 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.35 Oc1ccc(o1)C(F)F 271570a_203496583355_100010688628 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [0,0,0,0,0,0|1,0,3]=4 52 B8R1.1 C=Cc1c[nH]c(n1)C 271570a_100011290941_100009814057 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.1 C=Cc1ccc(s1)Br 271570a_100011290941_100010197418 [1,0,0,0,0,0|1,1,1]=4 55 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,0,0,0,0,0|0,1,1]=3 56 B8R1.1 C=Cc1ccn(n1)C 271570a_100011290941_100000752436 [1,0,0,0,0,0|2,0,1]=4 57 B8R1.1 C=Cc1cnc(s1)C 271570a_100011290941_100000764884 [1,0,0,0,0,0|1,1,1]=4 58 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,0,0,0,0,0|2,0,1]=4 59 B8R1.1 C=Cc1csc(n1)C 271570a_100011290941_100011934587 [1,0,0,0,0,0|2,0,1]=4 60 B8R1.1 C=Cc1nc(c[nH]1)C 271570a_100011290941_100161115468 [1,0,0,0,0,0|2,0,1]=4 61 B8R1.1 C=Cc1nc(cs1)C 271570a_100011290941_100011291629 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.1 C=Cc1ncc(s1)C 271570a_100011290941_100000690809 [1,0,0,0,0,0|1,1,1]=4 63 B8R1.1 C=Cc1nnc(o1)C 271570a_100011290941_100000708914 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,0,0,0,0,0|1,1,1]=4 65 B8R1.1 CNc1nnc(o1)C 27a_100102657272_100000708914 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.1 COc1ccn(n1)C 34a_100012642153_200000210301 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.1 CSc1c[nH]c(n1)C 62a_100009814057_200000210301 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.1 CSc1c[nH]c(n1)C 62a_200000210301_100009814057 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.1 CSc1cc(cs1)C 62a_100009876951_200000210301 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.1 CSc1cc(cs1)C 62a_200000210301_100009876951 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.1 CSc1ccc(s1)Br 62a_100010197418_200000210301 [1,0,0,0,0,0|2,1,0]=4 72 B8R1.1 CSc1ccc(s1)Br 62a_200000210301_100010197418 [1,0,0,0,0,0|2,1,0]=4 73 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,0,0,0,0,0|1,1,0]=3 74 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,0,0,0,0,0|1,1,0]=3 75 B8R1.1 CSc1ccn(n1)C 62a_100000752436_200000210301 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.1 CSc1ccn(n1)C 62a_200000210301_100000752436 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.1 CSc1cnc(s1)C 62a_100000764884_200000210301 [1,0,0,0,0,0|2,1,0]=4 78 B8R1.1 CSc1cnc(s1)C 62a_200000210301_100000764884 [1,0,0,0,0,0|2,1,0]=4 79 B8R1.1 CSc1csc(c1)C 62a_100000759034_200000210301 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.1 CSc1csc(c1)C 62a_200000210301_100000759034 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.1 CSc1csc(n1)C 62a_100011934587_200000210301 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.1 CSc1csc(n1)C 62a_200000210301_100011934587 [1,0,0,0,0,0|3,0,0]=4 83 B8R1.1 CSc1nc(c[nH]1)C 62a_100161115468_200000210301 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.1 CSc1nc(c[nH]1)C 62a_200000210301_100161115468 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.1 CSc1nc(cs1)C 62a_100011291629_200000210301 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.1 CSc1nc(cs1)C 62a_200000210301_100011291629 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.1 CSc1ncc(s1)C 62a_100000690809_200000210301 [1,0,0,0,0,0|2,1,0]=4 88 B8R1.1 CSc1ncc(s1)C 62a_200000210301_100000690809 [1,0,0,0,0,0|2,1,0]=4 89 B8R1.1 CSc1nnc(o1)C 62a_200000210301_100000708914 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_100161115468_200025704644 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_200025704644_100161115468 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_100000759034_200025704644 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_200025704644_100000759034 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,0,0,0,0,0|1,1,0]=3 95 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,0,0,0,0,0|1,1,0]=3 96 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_100000690809_200025704644 [1,0,0,0,0,0|2,1,0]=4 97 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_200025704644_100000690809 [1,0,0,0,0,0|2,1,0]=4 98 B8R1.1 Cc1csc(c1)S[13CH3] 62a_100009876951_200025704644 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.1 Cc1csc(c1)S[13CH3] 62a_200025704644_100009876951 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.1 Cc1csc(n1)S[13CH3] 62a_100011291629_200025704644 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.1 Cc1csc(n1)S[13CH3] 62a_200025704644_100011291629 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.1 Cc1nc(c[nH]1)S[13CH3] 62a_100009814057_200025704644 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.1 Cc1nc(c[nH]1)S[13CH3] 62a_200025704644_100009814057 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_100011934587_200025704644 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_200025704644_100011934587 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_100000764884_200025704644 [1,0,0,0,0,0|2,1,0]=4 107 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_200025704644_100000764884 [1,0,0,0,0,0|2,1,0]=4 108 B8R1.1 Cc1nnc(o1)S[13CH3] 62a_200025704644_100000708914 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.1 Cn1ccc(n1)O[13CH3] 34a_100012642153_200025704644 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.1 Cn1ccc(n1)S[13CH3] 62a_100000752436_200025704644 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.1 Cn1ccc(n1)S[13CH3] 62a_200025704644_100000752436 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.1 N#Cc1ccc(o1)O 271570a_203496583355_100000764468 [1,0,0,0,0,0|2,0,1]=4 113 B8R1.1 NCc1ccc(o1)O 271570a_203496583355_100000708654 [1,0,0,0,0,0|2,0,1]=4 114 B8R1.1 O=Cc1c[nH]c(c1)O 271570a_203496583355_100009882863 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.1 O=Cc1cc(co1)O 271570a_203496583355_100000747035 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.1 O=Cc1cc(cs1)O 271570a_203496583355_100000211722 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.1 O=Cc1ccc(o1)O 271570a_203496583355_100000185145 [1,0,0,0,0,0|1,0,0]=2 118 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,0,0,0,0,0|1,1,0]=3 119 B8R1.1 O=Cc1cnc(s1)O 271570a_203496583355_100009814069 [1,0,0,0,0,0|2,1,0]=4 120 B8R1.1 O=Cc1csc(c1)O 271570a_203496583355_100000737087 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.1 O=Cc1csc(n1)O 271570a_203496583355_100009816748 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.1 O=Cc1nc(cs1)O 271570a_203496583355_100009816814 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.1 O=Cc1ncc(s1)O 271570a_203496583355_100000699580 [1,0,0,0,0,0|2,1,0]=4 124 B8R1.1 OCc1ccc(o1)O 271570a_203496583355_100000246276 [1,0,0,0,0,0|1,0,2]=4 125 B8R1.1 [13CH3]Sc1ccc(s1)Br 62a_100010197418_200025704644 [1,0,0,0,0,0|2,1,0]=4 126 B8R1.1 [13CH3]Sc1ccc(s1)Br 62a_200025704644_100010197418 [1,0,0,0,0,0|2,1,0]=4 127 B8R1.7 C=C(C)c1c[nH]cn1 271570a_100000694244_100000756875 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.7 C=C(C)c1cc[nH]n1 271570a_100000694244_100000062575 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [1,0,0,0,0,0|1,0,0]=2 130 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,0,0,0,0,0|1,1,0]=3 131 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.7 C=C(C)c1ccsn1 271570a_100000694244_100009818082 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.7 C=C(C)c1cnco1 271570a_100000694244_100020591547 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.7 C=C(C)c1cncs1 271570a_100000694244_100011934649 [1,0,0,0,0,0|2,1,0]=4 136 B8R1.7 C=C(C)c1cscn1 271570a_100000694244_100000751502 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.7 C=C(C)c1ncc[nH]1 271570a_100000694244_100025796157 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.7 C=C(C)c1ncco1 271570a_100000694244_100011787736 [1,0,0,0,0,0|2,0,0]=3 139 B8R1.7 C=C(C)c1nccs1 271570a_100000694244_100000211983 [1,0,0,0,0,0|2,1,0]=4 140 B8R1.7 CC(=O)C1=CCCC1 1458a_100000038896_200000210301 [1,0,0,0,0,0|1,0,2]=4 141 B8R1.7 CC(=O)C1=CCOC1 1458a_100000139269_200000210301 [1,0,0,0,0,0|2,0,1]=4 142 B8R1.7 CC(=O)C1=COCC1 1458a_100000750620_200000210301 [1,0,0,0,0,0|2,0,1]=4 143 B8R1.7 CC(=O)C1CC=CC1 1458a_100000759439_200000210301 [1,0,0,0,0,0|1,0,2]=4 144 B8R1.7 CC(=O)N1CC=CC1 1626a_100015195280_100015343762 [1,0,0,0,0,0|2,0,1]=4 145 B8R1.7 CC(=O)N1CC=CC1 240690a_100015195280_100015343762 [1,0,0,0,0,0|2,0,1]=4 146 B8R1.7 [13CH3]C(=O)C1=CCCC1 1458a_100000038896_200025704644 [1,0,0,0,0,0|1,0,2]=4 147 B8R1.7 [13CH3]C(=O)C1=CCOC1 1458a_100000139269_200025704644 [1,0,0,0,0,0|2,0,1]=4 148 B8R1.7 [13CH3]C(=O)C1=COCC1 1458a_100000750620_200025704644 [1,0,0,0,0,0|2,0,1]=4 149 B8R1.7 [13CH3]C(=O)C1CC=CC1 1458a_100000759439_200025704644 [1,0,0,0,0,0|1,0,2]=4 150 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,1,0,0,0,0|1,1,0]=3 151 B10R1.14 CNC(=O)c1ccc(o1)O 271570a_203496583355_100000159859 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.14 CNC(=O)c1ccc(s1)O 271570a_203496583355_200000155069 [0,1,0,0,0,0|1,1,0]=3 153 B10R1.14 CNC(=O)c1csc(n1)O 271570a_203496583355_100010260535 [0,1,0,0,0,0|3,0,0]=4 154 B10R1.14 CNC(C)c1ccc(o1)C 269862a_106832991636_100000204583 [0,1,0,0,0,0|1,0,1]=3 155 B10R1.14 CNC(C)c1ccc(s1)C 269862a_106832991636_100000195387 [0,1,0,0,0,0|1,1,1]=4 156 B10R1.14 COC(=O)c1c[nH]c(c1)O 271570a_203496583355_100009840242 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.14 COC(=O)c1cc(co1)O 271570a_203496583355_100009992624 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.14 COC(=O)c1cc(cs1)O 271570a_203496583355_100009815473 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.14 COC(=O)c1ccc([nH]1)O 271570a_203496583355_100000687774 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.14 COC(=O)c1ccc(o1)O 271570a_203496583355_100000148852 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.14 COC(=O)c1ccc(s1)O 271570a_203496583355_100000148107 [0,1,0,0,0,0|1,1,0]=3 162 B10R1.14 COC(=O)c1cnc([nH]1)O 271570a_203496583355_106744473586 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.14 COC(=O)c1cnc(s1)O 271570a_203496583355_100000738003 [0,1,0,0,0,0|2,1,0]=4 164 B10R1.14 COC(=O)c1coc(n1)O 271570a_203496583355_100010235569 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.14 COC(=O)c1csc(c1)O 271570a_203496583355_100000692058 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.14 COC(=O)c1csc(n1)O 271570a_203496583355_100009816811 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.14 COC(=O)c1nc(cs1)O 271570a_203496583355_100012360158 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.14 COC(=O)c1ncc(s1)O 271570a_203496583355_100010191244 [0,1,0,0,0,0|2,1,0]=4 169 B10R1.14 NNC(=O)c1ccc(o1)O 271570a_203496583355_100000186364 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.14 NNC(=O)c1ccc(s1)O 271570a_203496583355_100000180196 [0,1,0,0,0,0|2,1,0]=4 171 B10R1.31 C=C(C)c1ccc(o1)C#N 271570a_100000694244_100000764468 [0,1,0,0,0,0|1,0,1]=3 172 B10R1.31 C=C(C)c1ccc(o1)C=O 271570a_100000694244_100000185145 [0,1,0,0,0,0|1,0,1]=3 173 B10R1.31 C=C(C)c1ccc(o1)CN 271570a_100000694244_100000708654 [0,1,0,0,0,0|1,0,0]=2 174 B10R1.31 C=C(C)c1ccc(o1)CO 271570a_100000694244_100000246276 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.31 C=C(C)c1ccc(s1)C#N 271570a_100000694244_100000737243 [0,1,0,0,0,0|1,1,1]=4 176 B10R1.31 C=C(C)c1ccc(s1)C=O 271570a_100000694244_100000179771 [0,1,0,0,0,0|1,1,1]=4 177 B10R1.31 C=C(C)c1ccc(s1)CC 271570a_100000694244_100009844052 [0,1,0,0,0,0|1,1,0]=3 178 B10R1.31 C=C(C)c1ccc(s1)CN 271570a_100000694244_100000737305 [0,1,0,0,0,0|1,1,0]=3 179 B10R1.31 C=C(C)c1ccc(s1)CO 271570a_100000694244_100000246291 [0,1,0,0,0,0|1,1,0]=3 180 B10R1.31 C=C(C)c1ccn(n1)CC 271570a_100000694244_100012350556 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.31 C=C(C)c1cnc(s1)CN 271570a_100000694244_100016991807 [0,1,0,0,0,0|2,1,0]=4 182 B10R1.31 C=C(C)c1cnc(s1)CO 271570a_100000694244_100000696694 [0,1,0,0,0,0|2,1,0]=4 183 B10R1.31 C=C(C)c1cnc(s1)OC 271570a_100000694244_100000729428 [0,1,0,0,0,0|2,1,0]=4 184 B10R1.31 C=C(C)c1csc(c1)CC 271570a_100000694244_100009846239 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.31 C=C(C)c1csc(c1)CO 271570a_100000694244_100000238369 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.31 C=C(C)c1csc(c1)SC 271570a_100000694244_200010256830 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.31 C=C(C)c1csc(n1)CO 271570a_100000694244_100012000107 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.31 C=C(C)c1csc(n1)OC 271570a_100000694244_100000727839 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.31 C=C(C)c1csc(n1)SC 271570a_100000694244_100000732701 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.31 C=C(C)c1nc(cs1)CO 271570a_100000694244_100009816749 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.31 C=C(C)c1ncc(s1)CN 271570a_100000694244_100000726991 [0,1,0,0,0,0|2,1,0]=4 192 B10R1.31 C=C(C)c1ncc(s1)CO 271570a_100000694244_100009816753 [0,1,0,0,0,0|2,1,0]=4 193 B10R1.31 C=Cc1cc(cs1)C(=O)C 271570a_100011290941_200012344231 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.31 C=Cc1ccc([nH]1)C(=O)C 271570a_100011290941_200010494458 [0,1,0,0,0,0|1,0,1]=3 195 B10R1.31 C=Cc1ccc(o1)C(=O)C 271570a_100011290941_100000229899 [0,1,0,0,0,0|0,0,1]=2 196 B10R1.31 C=Cc1ccc(s1)C(=O)C 271570a_100011290941_100000183331 [0,1,0,0,0,0|0,1,1]=3 197 B10R1.31 C=Cc1ccc(s1)C(=O)N 271570a_100011290941_100000162267 [0,1,0,0,0,0|1,1,1]=4 198 B10R1.31 C=Cc1cnc(s1)C(=O)C 271570a_100011290941_100000693680 [0,1,0,0,0,0|1,1,1]=4 199 B10R1.31 C=Cc1csc(c1)C(=O)C 271570a_100011290941_100000718618 [0,1,0,0,0,0|2,0,1]=4 200 B10R1.31 C=Cc1csc(n1)C(=O)C 271570a_100011290941_100010231720 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.31 C=Cc1ncc(s1)C(=O)C 271570a_100011290941_200010173910 [0,1,0,0,0,0|1,1,1]=4 202 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_100000718618_200025704644 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100000718618 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.31 CC(=O)c1ccc([nH]1)S[13CH3] 62a_200010494458_200025704644 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.31 CC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000229899 [0,1,0,0,0,0|0,0,0]=1 206 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_100000183331_200025704644 [0,1,0,0,0,0|0,1,0]=2 207 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000034408 [0,1,0,0,0,0|0,1,0]=2 208 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200010173910_200025704644 [0,1,0,0,0,0|1,1,0]=3 209 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200025704644_200010173910 [0,1,0,0,0,0|1,1,0]=3 210 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200012344231_200025704644 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200025704644_200012344231 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_100010231720_200025704644 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_200025704644_100010231720 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_100000693680_200025704644 [0,1,0,0,0,0|1,1,0]=3 215 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_200025704644_100000693680 [0,1,0,0,0,0|1,1,0]=3 216 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_100010205889_200025704644 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_200025704644_100010205889 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.31 CC(N)c1ccc(s1)S[13CH3] 62a_100102723530_200025704644 [0,1,0,0,0,0|1,1,1]=4 219 B10R1.31 CC(N)c1ccc(s1)S[13CH3] 62a_200025704644_100102723530 [0,1,0,0,0,0|1,1,1]=4 220 B10R1.31 CNc1nc(co1)C(=O)N 27a_100102657272_100009981048 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.31 CNc1nc(cs1)C(=O)N 27a_100102657272_100010247141 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.31 CNc1ncc(s1)C(=O)C 27a_100102657272_200010173910 [0,1,0,0,0,0|1,1,0]=3 223 B10R1.31 CNc1ncc(s1)C(=O)N 27a_100102657272_100010220624 [0,1,0,0,0,0|2,1,0]=4 224 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_100000229580_200000210301 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_200000210301_100000229580 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200000210301_200012344231 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200012344231_200000210301 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.31 CSc1cc(cs1)C(=O)N 62a_100000747962_200000210301 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.31 CSc1cc(cs1)C(=O)N 62a_200000210301_100000747962 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.31 CSc1ccc([nH]1)C(=O)C 62a_200010494458_200000210301 [0,1,0,0,0,0|1,0,0]=2 231 B10R1.31 CSc1ccc(o1)C(=O)C 62a_200000210301_100000229899 [0,1,0,0,0,0|0,0,0]=1 232 B10R1.31 CSc1ccc(o1)C(F)F 62a_200000210301_100010688628 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.31 CSc1ccc(s1)C(=O)C 62a_100000183331_200000210301 [0,1,0,0,0,0|0,1,0]=2 234 B10R1.31 CSc1ccc(s1)C(=O)C 62a_200000210301_200000034408 [0,1,0,0,0,0|0,1,0]=2 235 B10R1.31 CSc1ccc(s1)C(=O)N 62a_100000162267_200000210301 [0,1,0,0,0,0|1,1,0]=3 236 B10R1.31 CSc1ccc(s1)C(C)N 62a_100102723530_200000210301 [0,1,0,0,0,0|1,1,1]=4 237 B10R1.31 CSc1ccc(s1)C(C)N 62a_200000210301_100102723530 [0,1,0,0,0,0|1,1,1]=4 238 B10R1.31 CSc1cnc(s1)C(=O)C 62a_100000693680_200000210301 [0,1,0,0,0,0|1,1,0]=3 239 B10R1.31 CSc1cnc(s1)C(=O)C 62a_200000210301_100000693680 [0,1,0,0,0,0|1,1,0]=3 240 B10R1.31 CSc1cnn(c1)C(=O)C 62a_100010205889_200000210301 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.31 CSc1cnn(c1)C(=O)C 62a_200000210301_100010205889 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.31 CSc1coc(c1)C(=O)N 62a_200000210301_200009817131 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.31 CSc1coc(c1)C(=O)N 62a_200009817131_200000210301 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.31 CSc1csc(c1)C(=O)C 62a_100000718618_200000210301 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.31 CSc1csc(c1)C(=O)C 62a_200000210301_100000718618 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.31 CSc1csc(c1)C(=O)N 62a_100009812991_200000210301 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.31 CSc1csc(c1)C(=O)N 62a_200000210301_100009812991 [0,1,0,0,0,0|3,0,0]=4 248 B10R1.31 CSc1csc(n1)C(=O)C 62a_100010231720_200000210301 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.31 CSc1csc(n1)C(=O)C 62a_200000210301_100010231720 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.31 CSc1nc(co1)C(=O)N 62a_100009981048_200000210301 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.31 CSc1nc(co1)C(=O)N 62a_200000210301_100009981048 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.31 CSc1nc(cs1)C(=O)N 62a_100010247141_200000210301 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.31 CSc1nc(cs1)C(=O)N 62a_200000210301_100010247141 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200000210301_200010173910 [0,1,0,0,0,0|1,1,0]=3 255 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200010173910_200000210301 [0,1,0,0,0,0|1,1,0]=3 256 B10R1.31 CSc1ncc(s1)C(=O)N 62a_100010220624_200000210301 [0,1,0,0,0,0|2,1,0]=4 257 B10R1.31 CSc1ncc(s1)C(=O)N 62a_200000210301_100010220624 [0,1,0,0,0,0|2,1,0]=4 258 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_100000229580_200025704644 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_200025704644_100000229580 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_100000747962_200025704644 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_200025704644_100000747962 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.31 [13CH3]Sc1ccc(o1)C(F)F 62a_200025704644_100010688628 [0,1,0,0,0,0|2,0,1]=4 263 B10R1.31 [13CH3]Sc1ccc(s1)C(=O)N 62a_100000162267_200025704644 [0,1,0,0,0,0|1,1,0]=3 264 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200009817131_200025704644 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200025704644_200009817131 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_100009812991_200025704644 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_200025704644_100009812991 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.31 [13CH3]Sc1nc(co1)C(=O)N 62a_100009981048_200025704644 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.31 [13CH3]Sc1nc(co1)C(=O)N 62a_200025704644_100009981048 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.31 [13CH3]Sc1nc(cs1)C(=O)N 62a_100010247141_200025704644 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.31 [13CH3]Sc1nc(cs1)C(=O)N 62a_200025704644_100010247141 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.31 [13CH3]Sc1ncc(s1)C(=O)N 62a_100010220624_200025704644 [0,1,0,0,0,0|2,1,0]=4 273 B10R1.31 [13CH3]Sc1ncc(s1)C(=O)N 62a_200025704644_100010220624 [0,1,0,0,0,0|2,1,0]=4 274 B10R1.58 C=C(C)c1cc(c(s1)C)C 271570a_100000694244_100009850898 [0,1,0,0,0,0|1,1,0]=3 275 B10R1.58 C=C(C)c1cc(n(n1)C)C 271570a_100000694244_100012001299 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.58 C=C(C)c1cc(n(n1)C)N 271570a_100000694244_100000734454 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.58 C=C(C)c1cn(c(n1)C)C 271570a_100000694244_100000684932 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.58 C=C(C)c1nc(c(s1)C)C 271570a_100000694244_100000765934 [0,1,0,0,0,0|2,1,0]=4 279 B10R1.58 CC(=O)c1cc(c(s1)O)C 271570a_203496583355_100000729792 [0,1,0,0,0,0|1,1,0]=3 280 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.59 C=C(C)c1nc(cn1C)C 271570a_100000694244_100009816808 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.59 C=C(C)c1nc(sc1C)C 271570a_100000694244_100010270876 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.59 C=C(C)c1nn(cc1C)C 271570a_100000694244_100012644376 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,1,0,0,0,0|1,1,0]=3 285 B10R1.59 C=C(C)c1sc(nc1C)C 271570a_100000694244_100009814099 [0,1,0,0,0,0|2,1,0]=4 286 B10R1.59 CC(=O)c1sc(nc1C)O 271570a_203496583355_100010106820 [0,1,0,0,0,0|2,1,0]=4 287 B10R1.194 C=C(C)c1cnc(n1C)C 271570a_100000694244_100000762843 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.194 C=C(C)c1csc(c1C)C 271570a_100000694244_100009820295 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.194 C=C(C)c1ncc(n1C)C 271570a_100000694244_100009816807 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.194 CC(=O)c1c[nH]c(c1C)O 271570a_203496583355_200010235672 [0,1,0,0,0,0|3,0,0]=4 291 B8R0.8 C=C(C)C(=O)C/C=C/C 1458a_100000185857_100102629194 [0,0,1,0,0,0|1,0,2]=4 292 B8R0.8 C=C(C)C(=O)CC=CC 1458a_100000185857_100000070051 [0,0,1,0,0,0|1,0,2]=4 293 B8R0.8 CCC/C=C(\C)/C(=O)C 1458a_200020648666_200000210301 [0,0,1,0,0,0|1,0,2]=4 294 B8R0.8 CCC/C=C(\C)/C(=O)[13CH3] 1458a_200020648666_200025704644 [0,0,1,0,0,0|1,0,2]=4 295 B8R0.9 C=CC(=NNC(=O)C)C 4a_100000189765_200015361842 [0,0,1,0,0,0|2,0,0]=3 296 B8R0.9 C=CC(=O)CC=C(C)C 1458a_100000185746_100000761012 [0,0,1,0,0,0|3,0,0]=4 297 B8R0.9 C=CC(=O)NCC(=O)C 1458a_200011222540_200000210301 [0,0,1,0,0,0|2,0,1]=4 298 B8R0.9 C=CC(=O)NCC(=O)[13CH3] 1458a_200011222540_200025704644 [0,0,1,0,0,0|2,0,1]=4 299 B8R0.9 C=CC(=O)NNC(=O)C 22a_100000189765_100000185746 [0,0,1,0,0,0|3,0,0]=4 300 B8R0.9 C=CC(C)OCC(=C)C 34a_100000695699_100000748629 [0,0,1,0,0,0|1,0,2]=4 301 B8R0.9 C=CC(C)OCC(=O)N 34a_100000695699_100000187820 [0,0,1,0,0,0|1,0,2]=4 302 B8R0.9 C=CC(C)OCC(=O)[O-] 34a_100000695699_100020667443 [0,0,1,0,0,0|1,0,2]=4 303 B8R0.9 CC=C(C)C=CC(=O)C 1458a_100000692105_200000210301 [0,0,1,0,0,0|1,0,1]=3 304 B8R0.9 CC=C(C)C=CC(=O)[13CH3] 1458a_100000692105_200025704644 [0,0,1,0,0,0|1,0,1]=3 305 B8R0.23 C=C(C)CC(=O)C(=C)C 1458a_100000185857_100000748629 [0,0,1,0,0,0|3,0,0]=4 306 B8R0.23 C=C(C)CN(C)C(=O)C 11a_100000225649_100015343762 [0,0,1,0,0,0|2,0,1]=4 307 B8R0.23 C=C(C)CN(C)C(=O)C 1626a_100000225649_100015343762 [0,0,1,0,0,0|2,0,1]=4 308 B8R0.23 C=C(C)CN(C)C(=O)C 527a_100000225649_100103153847 [0,0,1,0,0,0|2,0,1]=4 309 B8R0.23 CC(=O)CC(=O)C(=O)C 1458a_100000070787_100011261029 [0,0,1,0,0,0|3,0,0]=4 310 B8R0.23 CC(=O)OC(C)C(=O)C 1458a_100000070787_100009818208 [0,0,1,0,0,0|1,0,2]=4 311 B8R0.23 CC(=O)O[C@@H](C)C(=O)C 1458a_100009816467_200000210301 [0,0,1,0,0,0|1,0,2]=4 312 B8R0.23 CC(=O)O[C@@H](C)C(=O)[13CH3] 1458a_100009816467_200025704644 [0,0,1,0,0,0|1,0,2]=4 313 B8R0.28 C=C(C)C=NNC(=O)C 4a_100000189765_100000210575 [0,0,1,0,0,0|3,0,0]=4 314 B8R0.28 CC(=O)C/C=C/B(O)O 1458a_100000070787_100016262062 [0,0,1,0,0,0|2,0,1]=4 315 B8R0.28 CC(=O)C/C=C/C(C)C 1458a_100016292215_200000210301 [0,0,1,0,0,0|1,0,2]=4 316 B8R0.28 CC(=O)C=CCN(C)C 1458a_100000754359_200000210301 [0,0,1,0,0,0|2,0,1]=4 317 B8R0.28 CC(=O)CCC=C(C)C 1458a_100000070787_100011217483 [0,0,1,0,0,0|1,0,2]=4 318 B8R0.28 CC(=O)NCC=C(C)C 11a_100000718196_100015343762 [0,0,1,0,0,0|2,0,1]=4 319 B8R0.28 CC(=O)NCC=C(C)C 1626a_100000718196_100015343762 [0,0,1,0,0,0|2,0,1]=4 320 B8R0.28 CC(=O)NCC=C(C)C 527a_100000718196_100103153847 [0,0,1,0,0,0|2,0,1]=4 321 B8R0.28 CC(C)/C=C/CC(=O)[13CH3] 1458a_100016292215_200025704644 [0,0,1,0,0,0|1,0,2]=4 322 B8R0.28 CN(C)CC=CC(=O)[13CH3] 1458a_100000754359_200025704644 [0,0,1,0,0,0|2,0,1]=4 323 B10R2.14 Cc1ccc(s1)C2CC2 271570a_100011220607_100000761539 [0,0,0,1,0,0|1,1,1]=4 324 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [0,0,0,0,0,1|3,0,0]=4 325 B10R1.13 C=C(C)c1ccc(=O)[nH]n1 271570a_100000694244_100009820020 [0,0,0,0,0,1|3,0,0]=4 326 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [0,0,0,0,0,1|3,0,0]=4 327 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [0,0,0,0,0,1|2,0,0]=3 328 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [0,0,0,0,0,1|3,0,0]=4 329 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [0,0,0,0,0,1|3,0,0]=4 330 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [0,0,0,0,0,1|3,0,0]=4 331 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [0,0,0,0,0,1|3,0,0]=4 333 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [0,0,0,0,0,1|3,0,0]=4 334 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [0,0,0,0,0,1|2,0,0]=3 335 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [0,0,0,0,0,1|3,0,0]=4 336 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [0,0,0,0,0,1|3,0,0]=4 337 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [0,0,0,0,0,1|2,0,0]=3 341 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [0,0,0,0,0,1|3,0,0]=4 342 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [0,0,0,0,0,1|3,0,0]=4 343 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.13 C=C(C)c1ccc(nn1)C 271570a_100000694244_100011450037 [0,0,0,0,0,1|2,0,0]=3 345 B10R1.13 C=C(C)c1ccc(nn1)N 271570a_100000694244_100009816609 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.13 C=C(C)c1cnc(cn1)C 271570a_100000694244_100011999403 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.13 C=C(C)c1cnc(nc1)C 271570a_100000694244_100000686985 [0,0,0,0,0,1|3,0,0]=4 348 B10R1.13 C=C(C)c1ncc(cn1)C 271570a_100000694244_100011825175 [0,0,0,0,0,1|3,0,0]=4 349 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [0,0,0,0,0,1|1,0,2]=4 350 B10R1.13 CC(=O)N1CC=C(CC1)C 11a_100000693516_100015343762 [0,0,0,0,0,1|2,0,1]=4 351 B10R1.13 CC(=O)N1CC=C(CC1)C 1626a_100000693516_100015343762 [0,0,0,0,0,1|2,0,1]=4 352 B10R1.13 CC(=O)N1CC=C(CC1)C 240690a_100000693516_100015343762 [0,0,0,0,0,1|2,0,1]=4 353 B10R1.13 CC(=O)N1CC=C(CC1)C 527a_100000693516_100103153847 [0,0,0,0,0,1|2,0,1]=4 354 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [0,0,0,0,0,1|2,0,0]=3 355 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [0,0,0,0,0,1|1,0,0]=2 356 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [0,0,0,0,0,1|2,0,0]=3 357 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [0,0,0,0,0,1|2,0,0]=3 358 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [0,0,0,0,0,1|2,0,0]=3 359 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [0,0,0,0,0,1|2,0,0]=3 360 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [0,0,0,0,0,1|2,0,0]=3 361 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [0,0,0,0,0,1|2,0,0]=3 362 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [0,0,0,0,0,1|2,0,0]=3 363 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [0,0,0,0,0,1|3,0,0]=4 364 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [0,0,0,0,0,1|3,0,0]=4 365 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [0,0,0,0,0,1|3,0,0]=4 366 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [0,0,0,0,0,1|1,0,2]=4 367 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [0,0,0,0,0,1|3,0,0]=4 368 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [0,0,0,0,0,1|1,0,0]=2 369 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [0,0,0,0,0,1|3,0,0]=4 370 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [0,0,0,0,0,1|3,0,0]=4 371 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [0,0,0,0,0,1|3,0,0]=4 372 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [0,0,0,0,0,1|3,0,0]=4 373 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [0,0,0,0,0,1|3,0,0]=4 375 B10R1.13 Cc1ccc(nn1)N(C)C 27a_100102631434_100000744512 [0,0,0,0,0,1|3,0,0]=4 376 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [0,0,0,0,0,1|3,0,0]=4 379 B10R1.13 NC(=O)c1ccc(nn1)O 271570a_203496583355_100000761398 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [0,0,0,0,0,1|2,0,0]=3 381 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [0,0,0,0,0,1|2,0,0]=3 382 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [0,0,0,0,0,1|2,0,0]=3 383 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [0,0,0,0,0,1|2,0,0]=3 384 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [0,0,0,0,0,1|2,0,0]=3 385 B10R1.54 CC(=Cc1c[nH]c(n1)C)C 271570a_100102525489_100009814057 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.54 CC(=Cc1cc(cs1)C)C 271570a_100102525489_100009876951 [0,0,0,0,0,1|3,0,0]=4 387 B10R1.54 CC(=Cc1ccc(s1)Br)C 271570a_100102525489_100010197418 [0,0,0,0,0,1|2,1,0]=4 388 B10R1.54 CC(=Cc1ccc(s1)C)C 271570a_100102525489_100000761539 [0,0,0,0,0,1|1,1,0]=3 389 B10R1.54 CC(=Cc1ccn(n1)C)C 271570a_100102525489_100000752436 [0,0,0,0,0,1|3,0,0]=4 390 B10R1.54 CC(=Cc1cnc(s1)C)C 271570a_100102525489_100000764884 [0,0,0,0,0,1|2,1,0]=4 391 B10R1.54 CC(=Cc1csc(c1)C)C 271570a_100102525489_100000759034 [0,0,0,0,0,1|3,0,0]=4 392 B10R1.54 CC(=Cc1csc(n1)C)C 271570a_100102525489_100011934587 [0,0,0,0,0,1|3,0,0]=4 393 B10R1.54 CC(=Cc1nc(c[nH]1)C)C 271570a_100102525489_100161115468 [0,0,0,0,0,1|3,0,0]=4 394 B10R1.54 CC(=Cc1nc(cs1)C)C 271570a_100102525489_100011291629 [0,0,0,0,0,1|3,0,0]=4 395 B10R1.54 CC(=Cc1ncc(s1)C)C 271570a_100102525489_100000690809 [0,0,0,0,0,1|2,1,0]=4 396 B10R1.54 CC(=Cc1nnc(o1)C)C 271570a_100102525489_100000708914 [0,0,0,0,0,1|3,0,0]=4 397 B10R1.54 CC(=O)C[NH+]1C=CN(C1)C 1458a_100121571517_200000210301 [0,0,0,0,0,1|3,0,0]=4 398 B10R1.54 CC(=O)C[n+]1ccn(c1)C 1458a_100000765871_200000210301 [0,0,0,0,0,1|3,0,0]=4 399 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100000070787_100000746031 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100011542370_200000210301 [0,0,0,0,0,1|3,0,0]=4 401 B10R1.54 CC(=O)Cc1cc(no1)C 1458a_100000037866_200000210301 [0,0,0,0,0,1|3,0,0]=4 402 B10R1.54 CC(=O)Cc1cc(no1)C 1458a_100000070787_100000707947 [0,0,0,0,0,1|3,0,0]=4 403 B10R1.54 CC(=O)Cc1cc(on1)C 1458a_100000070787_100000199038 [0,0,0,0,0,1|3,0,0]=4 404 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000070787_100000708592 [0,0,0,0,0,1|1,1,0]=3 405 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000238643_200000210301 [0,0,0,0,0,1|1,1,0]=3 406 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000070787_100000185097 [0,0,0,0,0,1|1,1,0]=3 407 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000238644_200000210301 [0,0,0,0,0,1|1,1,0]=3 408 B10R1.54 CC(=O)Cc1ccn(n1)C 1458a_100000070787_100000726502 [0,0,0,0,0,1|2,0,0]=3 409 B10R1.54 CC(=O)Cc1cn(cn1)C 1458a_100000070787_100000717665 [0,0,0,0,0,1|3,0,0]=4 410 B10R1.54 CC(=O)Cc1cn(cn1)C 1458a_100011512828_200000210301 [0,0,0,0,0,1|3,0,0]=4 411 B10R1.54 CC(=O)Cc1cnc(s1)Br 1458a_100000070787_100000717027 [0,0,0,0,0,1|2,1,0]=4 412 B10R1.54 CC(=O)Cc1cnc(s1)C 1458a_100000070787_100020635045 [0,0,0,0,0,1|1,1,0]=3 413 B10R1.54 CC(=O)Cc1cnc(s1)Cl 1458a_100000070787_100000058068 [0,0,0,0,0,1|2,1,0]=4 414 B10R1.54 CC(=O)Cc1cnn(c1)C 1458a_100000070787_100000744441 [0,0,0,0,0,1|3,0,0]=4 415 B10R1.54 CC(=O)Cc1csc(n1)C 1458a_100000070787_100015186478 [0,0,0,0,0,1|2,0,0]=3 416 B10R1.54 CC(=O)Cc1csc(n1)C 1458a_100000184407_200000210301 [0,0,0,0,0,1|2,0,0]=3 417 B10R1.54 CC(=O)Cc1csc(n1)Cl 1458a_100000070787_100000024076 [0,0,0,0,0,1|3,0,0]=4 418 B10R1.54 CC(=O)Cc1n[nH]c(n1)C 1458a_100011457670_200000210301 [0,0,0,0,0,1|3,0,0]=4 419 B10R1.54 CC(=O)Cc1nc(no1)C 1458a_100000070787_100000735555 [0,0,0,0,0,1|3,0,0]=4 420 B10R1.54 CC(=O)Cc1nc(no1)C 1458a_100011441805_200000210301 [0,0,0,0,0,1|3,0,0]=4 421 B10R1.54 CC(=O)Cc1ncn(n1)C 1458a_100000070787_100016995526 [0,0,0,0,0,1|3,0,0]=4 422 B10R1.54 CC(=O)Cc1nnc(o1)C 1458a_100000070787_100000181450 [0,0,0,0,0,1|2,0,0]=3 423 B10R1.54 CC(=O)Cc1nnc(s1)C 1458a_100000070787_100000688753 [0,0,0,0,0,1|2,1,0]=4 424 B10R1.54 CC(=O)Cc1noc(n1)C 1458a_100000070787_100000231061 [0,0,0,0,0,1|3,0,0]=4 425 B10R1.54 CC(=O)Cc1noc(n1)C 1458a_100000105485_200000210301 [0,0,0,0,0,1|3,0,0]=4 426 B10R1.54 CC(=O)Cc1noc(n1)C 270196a_100011229364_100000070787 [0,0,0,0,0,1|3,0,0]=4 427 B10R1.54 CC(=O)Cn1cc(cn1)C 1458a_100000743463_200000210301 [0,0,0,0,0,1|3,0,0]=4 428 B10R1.54 CC(=O)Cn1ccc(n1)C 1458a_100000238720_200000210301 [0,0,0,0,0,1|2,0,0]=3 429 B10R1.54 CC(=O)Nc1ccc(s1)O 271570a_203496583355_100010002808 [0,0,0,0,0,1|1,1,0]=3 430 B10R1.54 CC(=O)Nc1ncc(s1)O 271570a_203496583355_100000050200 [0,0,0,0,0,1|2,1,0]=4 431 B10R1.54 CN(C)Cc1ccc(o1)Br 2230a_100000207588_200000210301 [0,0,0,0,0,1|3,0,0]=4 432 B10R1.54 CN(C)Cc1ccc(o1)Br 269982a_100000207588_200000210301 [0,0,0,0,0,1|3,0,0]=4 433 B10R1.54 CN(C)Cc1ccc(o1)Br 270004a_100102631434_100000185145 [0,0,0,0,0,1|3,0,0]=4 434 B10R1.54 CN(C)Cc1ccc(o1)Cl 270004a_100102631434_100000188459 [0,0,0,0,0,1|3,0,0]=4 435 B10R1.54 CN([13CH3])Cc1ccc(o1)Br 2230a_100000207588_200025704644 [0,0,0,0,0,1|3,0,0]=4 436 B10R1.54 CN([13CH3])Cc1ccc(o1)Br 269982a_100000207588_200025704644 [0,0,0,0,0,1|3,0,0]=4 437 B10R1.54 CN1C=C[NH+](C1)CC(=O)[13CH3] 1458a_100121571517_200025704644 [0,0,0,0,0,1|3,0,0]=4 438 B10R1.54 Cc1cc(on1)CC(=O)[13CH3] 1458a_100000037866_200025704644 [0,0,0,0,0,1|3,0,0]=4 439 B10R1.54 Cc1ccc(o1)CN(C)C 2230a_100000184526_200000210301 [0,0,0,0,0,1|2,0,0]=3 440 B10R1.54 Cc1ccc(o1)CN(C)C 269982a_100000184526_200000210301 [0,0,0,0,0,1|2,0,0]=3 441 B10R1.54 Cc1ccc(o1)CN(C)C 270004a_100102631434_100000183696 [0,0,0,0,0,1|2,0,0]=3 442 B10R1.54 Cc1ccc(o1)CN(C)C 34a_100000184526_200000210301 [0,0,0,0,0,1|2,0,0]=3 443 B10R1.54 Cc1ccc(o1)CN(C)[13CH3] 2230a_100000184526_200025704644 [0,0,0,0,0,1|2,0,0]=3 444 B10R1.54 Cc1ccc(o1)CN(C)[13CH3] 269982a_100000184526_200025704644 [0,0,0,0,0,1|2,0,0]=3 445 B10R1.54 Cc1ccc(o1)CN(C)[13CH3] 34a_100000184526_200025704644 [0,0,0,0,0,1|2,0,0]=3 446 B10R1.54 Cc1ccc(s1)CN(C)C 2230a_100000751125_200000210301 [0,0,0,0,0,1|2,1,0]=4 447 B10R1.54 Cc1ccc(s1)CN(C)C 269982a_100000751125_200000210301 [0,0,0,0,0,1|2,1,0]=4 448 B10R1.54 Cc1ccc(s1)CN(C)C 270004a_100102631434_100000211121 [0,0,0,0,0,1|2,1,0]=4 449 B10R1.54 Cc1ccc(s1)CN(C)[13CH3] 2230a_100000751125_200025704644 [0,0,0,0,0,1|2,1,0]=4 450 B10R1.54 Cc1ccc(s1)CN(C)[13CH3] 269982a_100000751125_200025704644 [0,0,0,0,0,1|2,1,0]=4 451 B10R1.54 Cc1ccc(s1)SC(C)C 62a_100000031368_100000210206 [0,0,0,0,0,1|1,1,1]=4 452 B10R1.54 Cc1ccc(s1)SC(C)C 62a_100000210206_100000031368 [0,0,0,0,0,1|1,1,1]=4 453 B10R1.54 Cc1ccn(n1)CC(=O)[13CH3] 1458a_100000238720_200025704644 [0,0,0,0,0,1|2,0,0]=3 454 B10R1.54 Cc1cnn(c1)CC(=O)[13CH3] 1458a_100000743463_200025704644 [0,0,0,0,0,1|3,0,0]=4 455 B10R1.54 Cc1nc(cs1)CC(=O)[13CH3] 1458a_100000184407_200025704644 [0,0,0,0,0,1|2,0,0]=3 456 B10R1.54 Cc1nc(n[nH]1)CC(=O)[13CH3] 1458a_100011457670_200025704644 [0,0,0,0,0,1|3,0,0]=4 457 B10R1.54 Cc1nc(no1)CC(=O)[13CH3] 1458a_100000105485_200025704644 [0,0,0,0,0,1|3,0,0]=4 458 B10R1.54 Cc1ncc(o1)CN(C)C 270004a_100102631434_100000084308 [0,0,0,0,0,1|3,0,0]=4 459 B10R1.54 Cc1noc(n1)CC(=O)[13CH3] 1458a_100011441805_200025704644 [0,0,0,0,0,1|3,0,0]=4 460 B10R1.54 Cn1cc[n+](c1)CC(=O)[13CH3] 1458a_100000765871_200025704644 [0,0,0,0,0,1|3,0,0]=4 461 B10R1.54 Cn1cnc(c1)CC(=O)[13CH3] 1458a_100011512828_200025704644 [0,0,0,0,0,1|3,0,0]=4 462 B10R1.54 [13CH3]C(=O)Cc1cc(cs1)Br 1458a_100011542370_200025704644 [0,0,0,0,0,1|3,0,0]=4 463 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Br 1458a_100000238643_200025704644 [0,0,0,0,0,1|1,1,0]=3 464 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Cl 1458a_100000238644_200025704644 [0,0,0,0,0,1|1,1,0]=3 465 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [0,0,0,0,0,1|2,0,0]=3 466 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [0,0,0,0,0,1|3,0,0]=4 467 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [0,0,0,0,0,1|3,0,0]=4 468 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [0,0,0,0,0,1|3,0,0]=4 469 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [0,0,0,0,0,1|3,0,0]=4 470 B10R1.113 C=C(C)c1cc(cnn1)C 271570a_100000694244_100000070100 [0,0,0,0,0,1|3,0,0]=4 471 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [0,0,0,0,0,1|3,0,0]=4 472 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [0,0,0,0,0,1|3,0,0]=4 473 B10R1.113 C=C(C)c1cc[nH]c(=O)n1 271570a_100000694244_200000134032 [0,0,0,0,0,1|3,0,0]=4 474 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [0,0,0,0,0,1|3,0,0]=4 475 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [0,0,0,0,0,1|3,0,0]=4 476 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [0,0,0,0,0,1|3,0,0]=4 477 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [0,0,0,0,0,1|2,0,0]=3 478 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [0,0,0,0,0,1|3,0,0]=4 479 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [0,0,0,0,0,1|3,0,0]=4 480 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [0,0,0,0,0,1|3,0,0]=4 481 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [0,0,0,0,0,1|3,0,0]=4 482 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [0,0,0,0,0,1|3,0,0]=4 483 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [0,0,0,0,0,1|3,0,0]=4 484 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [0,0,0,0,0,1|3,0,0]=4 485 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [0,0,0,0,0,1|2,0,0]=3 486 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [0,0,0,0,0,1|3,0,0]=4 487 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [0,0,0,0,0,1|3,0,0]=4 488 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [0,0,0,0,0,1|3,0,0]=4 489 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [0,0,0,0,0,1|2,0,0]=3 490 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [0,0,0,0,0,1|3,0,0]=4 491 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [0,0,0,0,0,1|3,0,0]=4 492 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [0,0,0,0,0,1|3,0,0]=4 493 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [0,0,0,0,0,1|2,0,0]=3 494 B10R1.113 C=C(C)c1ccnc(n1)N 271570a_100000694244_100009820717 [0,0,0,0,0,1|3,0,0]=4 495 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [0,0,0,0,0,1|3,0,0]=4 496 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [0,0,0,0,0,1|2,0,0]=3 497 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [0,0,0,0,0,1|3,0,0]=4 498 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [0,0,0,0,0,1|3,0,0]=4 499 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [0,0,0,0,0,1|3,0,0]=4 500 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [0,0,0,0,0,1|3,0,0]=4 501 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [0,0,0,0,0,1|3,0,0]=4 502 B10R1.113 C=C(C)c1cncc(n1)C 271570a_100000694244_100009842155 [0,0,0,0,0,1|2,0,0]=3 503 B10R1.113 C=C(C)c1cncc(n1)F 271570a_100000694244_200009863489 [0,0,0,0,0,1|3,0,0]=4 504 B10R1.113 C=C(C)c1cncc(n1)N 271570a_100000694244_100009819714 [0,0,0,0,0,1|3,0,0]=4 505 B10R1.113 C=C(C)c1cncc(n1)O 271570a_100000694244_100011269956 [0,0,0,0,0,1|3,0,0]=4 506 B10R1.113 C=C(C)c1nccc(n1)C 271570a_100000694244_100011243806 [0,0,0,0,0,1|2,0,0]=3 507 B10R1.113 C=C(C)c1nccc(n1)N 271570a_100000694244_100000757536 [0,0,0,0,0,1|3,0,0]=4 508 B10R1.113 C=C(C)c1nccc(n1)O 271570a_100000694244_100011649813 [0,0,0,0,0,1|3,0,0]=4 509 B10R1.113 CC(=O)N1CCC=C(C1)C 11a_100000725631_100015343762 [0,0,0,0,0,1|2,0,1]=4 510 B10R1.113 CC(=O)N1CCC=C(C1)C 1626a_100000725631_100015343762 [0,0,0,0,0,1|2,0,1]=4 511 B10R1.113 CC(=O)N1CCC=C(C1)C 240690a_100000725631_100015343762 [0,0,0,0,0,1|2,0,1]=4 512 B10R1.113 CC(=O)N1CCC=C(C1)C 527a_100000725631_100103153847 [0,0,0,0,0,1|2,0,1]=4 513 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [0,0,0,0,0,1|2,0,0]=3 514 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [0,0,0,0,0,1|2,0,0]=3 515 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [0,0,0,0,0,1|1,0,0]=2 516 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [0,0,0,0,0,1|2,0,0]=3 517 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [0,0,0,0,0,1|2,0,0]=3 518 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [0,0,0,0,0,1|2,0,0]=3 519 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [0,0,0,0,0,1|2,0,0]=3 520 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [0,0,0,0,0,1|2,0,0]=3 521 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [0,0,0,0,0,1|2,0,0]=3 522 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [0,0,0,0,0,1|2,0,0]=3 523 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [0,0,0,0,0,1|2,0,0]=3 524 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [0,0,0,0,0,1|2,0,0]=3 525 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [0,0,0,0,0,1|3,0,0]=4 526 B10R1.113 Cc1cc(ccn1)N(C)C 27a_100102631434_100000758586 [0,0,0,0,0,1|3,0,0]=4 527 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [0,0,0,0,0,1|1,0,0]=2 528 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [0,0,0,0,0,1|3,0,0]=4 529 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [0,0,0,0,0,1|3,0,0]=4 530 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [0,0,0,0,0,1|3,0,0]=4 531 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [0,0,0,0,0,1|3,0,0]=4 532 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [0,0,0,0,0,1|3,0,0]=4 533 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [0,0,0,0,0,1|3,0,0]=4 534 B10R1.113 Cc1ccnc(n1)N(C)C 27a_100102631434_100000750684 [0,0,0,0,0,1|3,0,0]=4 535 B10R1.113 Cc1cncc(n1)N(C)C 27a_100102631434_100000754123 [0,0,0,0,0,1|3,0,0]=4 536 B10R1.113 Cc1nccc(n1)N(C)C 27a_100102631434_100000749937 [0,0,0,0,0,1|3,0,0]=4 537 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [0,0,0,0,0,1|3,0,0]=4 538 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [0,0,0,0,0,1|3,0,0]=4 539 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [0,0,0,0,0,1|3,0,0]=4 540 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [0,0,0,0,0,1|3,0,0]=4 541 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [0,0,0,0,0,1|3,0,0]=4 542 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [0,0,0,0,0,1|3,0,0]=4 543 B10R1.113 NC(=O)c1cncc(n1)O 271570a_203496583355_100000764846 [0,0,0,0,0,1|3,0,0]=4 544 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [0,0,0,0,0,1|2,0,0]=3 545 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [0,0,0,0,0,1|2,0,0]=3 546 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [0,0,0,0,0,1|2,0,0]=3 547 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [0,0,0,0,0,1|2,0,0]=3 548 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [0,0,0,0,0,1|2,0,0]=3 549 B7R0.3 C=CC(=O)C/C=C/C 1458a_100000185746_100102629194 [1,0,1,0,0,0|2,0,0]=4 550 B7R0.3 C=CC(=O)CC=CC 1458a_100000185746_100000070051 [1,0,1,0,0,0|2,0,0]=4 551 B7R0.3 C=CC(C)OCC=O 34a_100000695699_200009817547 [1,0,1,0,0,0|0,0,2]=4 552 B7R0.4 C/C=C/C=CC(=O)C 1458a_100000185730_200000210301 [1,0,1,0,0,0|0,0,0]=2 553 B7R0.4 C/C=C/C=CC(=O)[13CH3] 1458a_100000185730_200025704644 [1,0,1,0,0,0|0,0,0]=2 554 B7R0.4 C=CCOCC(=O)C 34a_100000211253_100015514636 [1,0,1,0,0,0|0,0,2]=4 555 B7R0.4 CC/C=C/CC(=O)C 1458a_100016274230_200000210301 [1,0,1,0,0,0|0,0,2]=4 556 B7R0.4 CC/C=C/CC(=O)[13CH3] 1458a_100016274230_200025704644 [1,0,1,0,0,0|0,0,2]=4 557 B7R0.4 CC/C=C\CC(=O)C 1458a_100000070787_100103147603 [1,0,1,0,0,0|0,0,2]=4 558 B7R0.4 CCCC=CC(=O)C 1458a_100000212230_200000210301 [1,0,1,0,0,0|0,0,2]=4 559 B7R0.4 CCCC=CC(=O)[13CH3] 1458a_100000212230_200025704644 [1,0,1,0,0,0|0,0,2]=4 560 B7R0.4 CCOC=CC(=O)C 1458a_100016266692_200000210301 [1,0,1,0,0,0|1,0,1]=4 561 B7R0.4 CCOC=CC(=O)[13CH3] 1458a_100016266692_200025704644 [1,0,1,0,0,0|1,0,1]=4 562 B7R0.4 COCC=CC(=O)C 1458a_100016285016_200000210301 [1,0,1,0,0,0|1,0,1]=4 563 B7R0.4 COCC=CC(=O)[13CH3] 1458a_100016285016_200025704644 [1,0,1,0,0,0|1,0,1]=4 564 B7R0.5 CC/C=C(\C)/C(=O)C 1458a_100016988807_200000210301 [1,0,1,0,0,0|1,0,1]=4 565 B7R0.5 CC/C=C(\C)/C(=O)[13CH3] 1458a_100016988807_200025704644 [1,0,1,0,0,0|1,0,1]=4 566 B7R0.6 C=C(C)CCC(=O)C 1458a_100000070787_100000730704 [1,0,1,0,0,0|1,0,1]=4 567 B7R0.6 C=C(C)CCC(=O)C 1458a_200000688413_200000210301 [1,0,1,0,0,0|1,0,1]=4 568 B7R0.6 C=C(C)CCC(=O)[13CH3] 1458a_200000688413_200025704644 [1,0,1,0,0,0|1,0,1]=4 569 B7R0.6 C=C(C)CNC(=O)C 11a_100000765925_100015343762 [1,0,1,0,0,0|2,0,0]=4 570 B7R0.6 C=C(C)CNC(=O)C 1626a_100000765925_100015343762 [1,0,1,0,0,0|2,0,0]=4 571 B7R0.6 C=C(C)CNC(=O)C 240690a_100000765925_100015343762 [1,0,1,0,0,0|2,0,0]=4 572 B7R0.6 C=C(C)CNC(=O)C 527a_100000765925_100103153847 [1,0,1,0,0,0|2,0,0]=4 573 B7R0.6 CC(=O)COC(=O)C 1458a_100000183556_200000210301 [1,0,1,0,0,0|1,0,1]=4 574 B7R0.6 CC(=O)OCC(=O)[13CH3] 1458a_100000183556_200025704644 [1,0,1,0,0,0|1,0,1]=4 575 B7R1.1 C=Cc1ccco1 271570a_100011290941_100009814098 [2,0,0,0,0,0|0,0,1]=3 576 B7R1.1 C=Cc1cccs1 271570a_100011290941_100011215356 [2,0,0,0,0,0|0,1,1]=4 577 B7R1.1 C=Cc1cnco1 271570a_100011290941_100020591547 [2,0,0,0,0,0|1,0,1]=4 578 B7R1.1 C=Cc1ncco1 271570a_100011290941_100011787736 [2,0,0,0,0,0|1,0,1]=4 579 B7R1.1 CSc1ccco1 62a_100009814098_200000210301 [2,0,0,0,0,0|1,0,0]=3 580 B7R1.1 CSc1ccco1 62a_200000210301_100009814098 [2,0,0,0,0,0|1,0,0]=3 581 B7R1.1 CSc1cccs1 62a_100011215356_200000210301 [2,0,0,0,0,0|1,1,0]=4 582 B7R1.1 CSc1cccs1 62a_200000210301_100011215356 [2,0,0,0,0,0|1,1,0]=4 583 B7R1.1 CSc1cnco1 62a_100020591547_200000210301 [2,0,0,0,0,0|2,0,0]=4 584 B7R1.1 CSc1cnco1 62a_200000210301_100020591547 [2,0,0,0,0,0|2,0,0]=4 585 B7R1.1 CSc1ncco1 62a_100011787736_200000210301 [2,0,0,0,0,0|2,0,0]=4 586 B7R1.1 CSc1ncco1 62a_200000210301_100011787736 [2,0,0,0,0,0|2,0,0]=4 587 B7R1.1 [13CH3]Sc1ccco1 62a_100009814098_200025704644 [2,0,0,0,0,0|1,0,0]=3 588 B7R1.1 [13CH3]Sc1ccco1 62a_200025704644_100009814098 [2,0,0,0,0,0|1,0,0]=3 589 B7R1.1 [13CH3]Sc1cccs1 62a_100011215356_200025704644 [2,0,0,0,0,0|1,1,0]=4 590 B7R1.1 [13CH3]Sc1cccs1 62a_200025704644_100011215356 [2,0,0,0,0,0|1,1,0]=4 591 B7R1.1 [13CH3]Sc1cnco1 62a_100020591547_200025704644 [2,0,0,0,0,0|2,0,0]=4 592 B7R1.1 [13CH3]Sc1cnco1 62a_200025704644_100020591547 [2,0,0,0,0,0|2,0,0]=4 593 B7R1.1 [13CH3]Sc1ncco1 62a_100011787736_200025704644 [2,0,0,0,0,0|2,0,0]=4 594 B7R1.1 [13CH3]Sc1ncco1 62a_200025704644_100011787736 [2,0,0,0,0,0|2,0,0]=4 595 B7R1.2 Cc1ccc(s1)O 271570a_203496583355_100000761539 [2,0,0,0,0,0|0,1,1]=4 596 B9R0.6 CC=CC(=O)C(C)C(=O)C 1458a_100000210699_100000179758 [0,1,1,0,0,0|1,0,1]=4 597 B9R0.8 C/C=C/CC(=O)C(=O)NC 1458a_100011218921_100102629194 [0,1,1,0,0,0|0,0,2]=4 598 B9R0.8 CC=CCC(=O)C(=O)NC 1458a_100011218921_100000070051 [0,1,1,0,0,0|0,0,2]=4 599 B9R0.24 C=CC(=NNC(=O)CC)C 4a_100000183195_200015361842 [0,1,1,0,0,0|2,0,0]=4 600 B9R0.24 C=CC(C)OCC(=O)NC 34a_100000695699_100000183359 [0,1,1,0,0,0|0,0,2]=4 601 B9R0.24 C=CC(C)OCC(=O)OC 34a_100000695699_100000747449 [0,1,1,0,0,0|0,0,2]=4 602 B9R0.24 CC=C(C)C=CC(=O)CC 1458a_100000692105_100000210202 [0,1,1,0,0,0|1,0,1]=4 603 B9R0.24 CC=C(C)C=CC(=O)CF 1458a_100000692105_100015361967 [0,1,1,0,0,0|1,0,1]=4 604 B9R0.24 CC=C(C)C=CC(=O)NC 1626a_100102657272_100000692105 [0,1,1,0,0,0|1,0,1]=4 605 B9R0.43 C=CC(=NNC(=O)C)CC 4a_100000189765_100000747743 [0,1,1,0,0,0|2,0,0]=4 606 B9R0.48 CC=CC(=NNC(=O)C)C 4a_100000189765_100011218416 [0,1,1,0,0,0|2,0,0]=4 607 B9R1.7 C=C=Cc1ccc(s1)C 271570a_100015277604_100000761539 [1,1,0,0,0,0|0,1,1]=4 608 B9R1.7 CC=Cc1c[nH]c(n1)C 271570a_100016259895_100009814057 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.7 CC=Cc1cc(cs1)C 271570a_100016259895_100009876951 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.7 CC=Cc1ccc(s1)Br 271570a_100016259895_100010197418 [1,1,0,0,0,0|1,1,0]=4 611 B9R1.7 CC=Cc1ccc(s1)C 271570a_100016259895_100000761539 [1,1,0,0,0,0|0,1,0]=3 612 B9R1.7 CC=Cc1ccn(n1)C 271570a_100016259895_100000752436 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.7 CC=Cc1cnc(s1)C 271570a_100016259895_100000764884 [1,1,0,0,0,0|1,1,0]=4 614 B9R1.7 CC=Cc1csc(c1)C 271570a_100016259895_100000759034 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.7 CC=Cc1csc(n1)C 271570a_100016259895_100011934587 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.7 CC=Cc1nc(c[nH]1)C 271570a_100016259895_100161115468 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.7 CC=Cc1nc(cs1)C 271570a_100016259895_100011291629 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.7 CC=Cc1ncc(s1)C 271570a_100016259895_100000690809 [1,1,0,0,0,0|1,1,0]=4 619 B9R1.7 CC=Cc1nnc(o1)C 271570a_100016259895_100000708914 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.7 CCSc1ccc(s1)C 62a_100000031368_100000210202 [1,1,0,0,0,0|0,1,1]=4 621 B9R1.7 CCSc1ccc(s1)C 62a_100000210202_100000031368 [1,1,0,0,0,0|0,1,1]=4 622 B9R1.7 CNCc1ccc(o1)Br 207a_100102657272_100000185145 [1,1,0,0,0,0|1,0,1]=4 623 B9R1.7 CNCc1ccc(o1)Br 270004a_106832991635_100000185145 [1,1,0,0,0,0|1,0,1]=4 624 B9R1.7 CNCc1ccc(o1)Br 34a_100000708654_200000210301 [1,1,0,0,0,0|1,0,1]=4 625 B9R1.7 CNCc1ccc(o1)C 207a_100102657272_100000183696 [1,1,0,0,0,0|0,0,1]=3 626 B9R1.7 CNCc1ccc(o1)C 270004a_106832991635_100000183696 [1,1,0,0,0,0|0,0,1]=3 627 B9R1.7 CNCc1ccc(o1)C 34a_100011194323_200000210301 [1,1,0,0,0,0|0,0,1]=3 628 B9R1.7 CNCc1ccc(o1)Cl 207a_100102657272_100000188459 [1,1,0,0,0,0|1,0,1]=4 629 B9R1.7 CNCc1ccc(o1)Cl 270004a_106832991635_100000188459 [1,1,0,0,0,0|1,0,1]=4 630 B9R1.7 CNCc1ccc(o1)I 207a_100102657272_100000186757 [1,1,0,0,0,0|1,0,1]=4 631 B9R1.7 CNCc1ccc(o1)O 271570a_203496583355_100000207588 [1,1,0,0,0,0|1,0,1]=4 632 B9R1.7 CNCc1ccc(s1)C 207a_100102657272_100000211121 [1,1,0,0,0,0|0,1,1]=4 633 B9R1.7 CNCc1ccc(s1)C 2230a_100000238518_200000210301 [1,1,0,0,0,0|0,1,1]=4 634 B9R1.7 CNCc1ccc(s1)C 270004a_106832991635_100000211121 [1,1,0,0,0,0|0,1,1]=4 635 B9R1.7 CNCc1cnc(o1)C 207a_100102657272_100000084308 [1,1,0,0,0,0|1,0,1]=4 636 B9R1.7 CNCc1cnc(o1)C 270004a_106832991635_100000084308 [1,1,0,0,0,0|1,0,1]=4 637 B9R1.7 CNCc1ncc(o1)C 2230a_100138411809_200000210301 [1,1,0,0,0,0|1,0,1]=4 638 B9R1.7 CNCc1ncc(o1)C 34a_100138411809_200000210301 [1,1,0,0,0,0|1,0,1]=4 639 B9R1.7 COCc1ccc(o1)Br 34a_100000246276_200000210301 [1,1,0,0,0,0|1,0,1]=4 640 B9R1.7 COCc1ccc(o1)Br 7a_100000246276_200000210301 [1,1,0,0,0,0|1,0,1]=4 641 B9R1.7 COCc1ccc(o1)C 34a_100011232665_200000210301 [1,1,0,0,0,0|0,0,1]=3 642 B9R1.7 COCc1ccc(o1)C 7a_100011232665_200000210301 [1,1,0,0,0,0|0,0,1]=3 643 B9R1.7 COCc1ccc(s1)C 34a_100000238367_200000210301 [1,1,0,0,0,0|0,1,1]=4 644 B9R1.7 Cc1ccc(o1)CN[13CH3] 34a_100011194323_200025704644 [1,1,0,0,0,0|0,0,1]=3 645 B9R1.7 Cc1ccc(o1)CO[13CH3] 34a_100011232665_200025704644 [1,1,0,0,0,0|0,0,1]=3 646 B9R1.7 Cc1ccc(o1)CO[13CH3] 7a_100011232665_200025704644 [1,1,0,0,0,0|0,0,1]=3 647 B9R1.7 Cc1ccc(s1)CN[13CH3] 2230a_100000238518_200025704644 [1,1,0,0,0,0|0,1,1]=4 648 B9R1.7 Cc1ccc(s1)CO[13CH3] 34a_100000238367_200025704644 [1,1,0,0,0,0|0,1,1]=4 649 B9R1.7 Cc1ccc(s1)SCF 62a_100000031368_100015361967 [1,1,0,0,0,0|1,1,0]=4 650 B9R1.7 Cc1ccc(s1)SCF 62a_100015361967_100000031368 [1,1,0,0,0,0|1,1,0]=4 651 B9R1.7 Cc1cnc(o1)CN[13CH3] 2230a_100138411809_200025704644 [1,1,0,0,0,0|1,0,1]=4 652 B9R1.7 Cc1cnc(o1)CN[13CH3] 34a_100138411809_200025704644 [1,1,0,0,0,0|1,0,1]=4 653 B9R1.7 [13CH3]NCc1ccc(o1)Br 34a_100000708654_200025704644 [1,1,0,0,0,0|1,0,1]=4 654 B9R1.7 [13CH3]OCc1ccc(o1)Br 34a_100000246276_200025704644 [1,1,0,0,0,0|1,0,1]=4 655 B9R1.7 [13CH3]OCc1ccc(o1)Br 7a_100000246276_200025704644 [1,1,0,0,0,0|1,0,1]=4 656 B9R1.21 C=Cc1ccc(o1)C#N 271570a_100011290941_100000764468 [1,1,0,0,0,0|0,0,2]=4 657 B9R1.21 C=Cc1ccc(o1)C=O 271570a_100011290941_100000185145 [1,1,0,0,0,0|0,0,1]=3 658 B9R1.21 C=Cc1ccc(o1)CN 271570a_100011290941_100000708654 [1,1,0,0,0,0|0,0,1]=3 659 B9R1.21 C=Cc1ccc(o1)CO 271570a_100011290941_100000246276 [1,1,0,0,0,0|0,0,1]=3 660 B9R1.21 C=Cc1ccc(s1)C=O 271570a_100011290941_100000179771 [1,1,0,0,0,0|0,1,1]=4 661 B9R1.21 C=Cc1ccc(s1)CC 271570a_100011290941_100009844052 [1,1,0,0,0,0|0,1,1]=4 662 B9R1.21 C=Cc1ccc(s1)CN 271570a_100011290941_100000737305 [1,1,0,0,0,0|0,1,1]=4 663 B9R1.21 C=Cc1ccc(s1)CO 271570a_100011290941_100000246291 [1,1,0,0,0,0|0,1,1]=4 664 B9R1.21 CCc1ccc(s1)SC 62a_100009844052_200000210301 [1,1,0,0,0,0|0,1,1]=4 665 B9R1.21 CCc1ccc(s1)SC 62a_200000210301_100009844052 [1,1,0,0,0,0|0,1,1]=4 666 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_100009844052_200025704644 [1,1,0,0,0,0|0,1,1]=4 667 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_200025704644_100009844052 [1,1,0,0,0,0|0,1,1]=4 668 B9R1.21 CNc1ncc(s1)C=O 27a_100102657272_100009814069 [1,1,0,0,0,0|1,1,0]=4 669 B9R1.21 CSc1c[nH]c(c1)C=O 62a_100000720742_200000210301 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.21 CSc1c[nH]c(c1)C=O 62a_200000210301_100000720742 [1,1,0,0,0,0|2,0,0]=4 671 B9R1.21 CSc1cc(c[nH]1)C=O 62a_100009882863_200000210301 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.21 CSc1cc(c[nH]1)C=O 62a_200000210301_100009882863 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.21 CSc1cc(cs1)C=O 62a_100000737087_200000210301 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.21 CSc1cc(cs1)C=O 62a_200000210301_100000737087 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.21 CSc1ccc([nH]1)C=O 62a_200000210301_100009875417 [1,1,0,0,0,0|1,0,0]=3 676 B9R1.21 CSc1ccc(o1)C#N 62a_200000210301_100000764468 [1,1,0,0,0,0|1,0,1]=4 677 B9R1.21 CSc1ccc(o1)C=O 62a_200000210301_100000186757 [1,1,0,0,0,0|0,0,0]=2 678 B9R1.21 CSc1ccc(o1)CN 62a_200000210301_100000708654 [1,1,0,0,0,0|1,0,0]=3 679 B9R1.21 CSc1ccc(o1)CO 62a_100000246276_200000210301 [1,1,0,0,0,0|1,0,0]=3 680 B9R1.21 CSc1ccc(o1)CO 62a_200000210301_100000246276 [1,1,0,0,0,0|1,0,0]=3 681 B9R1.21 CSc1ccc(s1)C=O 62a_100000179771_200000210301 [1,1,0,0,0,0|0,1,0]=3 682 B9R1.21 CSc1ccc(s1)C=O 62a_200000210301_100000179771 [1,1,0,0,0,0|0,1,0]=3 683 B9R1.21 CSc1ccc(s1)CN 62a_100000737305_200000210301 [1,1,0,0,0,0|1,1,0]=4 684 B9R1.21 CSc1ccc(s1)CN 62a_200000210301_100000737305 [1,1,0,0,0,0|1,1,0]=4 685 B9R1.21 CSc1ccc(s1)CO 62a_100000246291_200000210301 [1,1,0,0,0,0|1,1,0]=4 686 B9R1.21 CSc1ccc(s1)CO 62a_200000210301_100000246291 [1,1,0,0,0,0|1,1,0]=4 687 B9R1.21 CSc1cnc(s1)C=O 62a_100000699580_200000210301 [1,1,0,0,0,0|1,1,0]=4 688 B9R1.21 CSc1cnc(s1)C=O 62a_200000210301_100000699580 [1,1,0,0,0,0|1,1,0]=4 689 B9R1.21 CSc1coc(c1)C=O 62a_100000747035_200000210301 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.21 CSc1coc(c1)C=O 62a_200000210301_100000747035 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.21 CSc1csc(c1)C=O 62a_100000211722_200000210301 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.21 CSc1csc(c1)C=O 62a_200000210301_100000211722 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.21 CSc1csc(n1)C=O 62a_100009816814_200000210301 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.21 CSc1csc(n1)C=O 62a_200000210301_100009816814 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.21 CSc1nc(cs1)C=O 62a_100009816748_200000210301 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.21 CSc1nc(cs1)C=O 62a_200000210301_100009816748 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.21 CSc1ncc(s1)C=O 62a_100009814069_200000210301 [1,1,0,0,0,0|1,1,0]=4 698 B9R1.21 CSc1ncc(s1)C=O 62a_200000210301_100009814069 [1,1,0,0,0,0|1,1,0]=4 699 B9R1.21 [13CH3]Sc1c[nH]c(c1)C=O 62a_100000720742_200025704644 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.21 [13CH3]Sc1c[nH]c(c1)C=O 62a_200025704644_100000720742 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.21 [13CH3]Sc1cc(c[nH]1)C=O 62a_100009882863_200025704644 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.21 [13CH3]Sc1cc(c[nH]1)C=O 62a_200025704644_100009882863 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.21 [13CH3]Sc1cc(cs1)C=O 62a_100000737087_200025704644 [1,1,0,0,0,0|2,0,0]=4 704 B9R1.21 [13CH3]Sc1cc(cs1)C=O 62a_200025704644_100000737087 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.21 [13CH3]Sc1ccc([nH]1)C=O 62a_200025704644_100009875417 [1,1,0,0,0,0|1,0,0]=3 706 B9R1.21 [13CH3]Sc1ccc(o1)C#N 62a_200025704644_100000764468 [1,1,0,0,0,0|1,0,1]=4 707 B9R1.21 [13CH3]Sc1ccc(o1)C=O 62a_200025704644_100000186757 [1,1,0,0,0,0|0,0,0]=2 708 B9R1.21 [13CH3]Sc1ccc(o1)CN 62a_200025704644_100000708654 [1,1,0,0,0,0|1,0,0]=3 709 B9R1.21 [13CH3]Sc1ccc(o1)CO 62a_100000246276_200025704644 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.21 [13CH3]Sc1ccc(o1)CO 62a_200025704644_100000246276 [1,1,0,0,0,0|1,0,0]=3 711 B9R1.21 [13CH3]Sc1ccc(s1)C=O 62a_100000179771_200025704644 [1,1,0,0,0,0|0,1,0]=3 712 B9R1.21 [13CH3]Sc1ccc(s1)C=O 62a_200025704644_100000179771 [1,1,0,0,0,0|0,1,0]=3 713 B9R1.21 [13CH3]Sc1ccc(s1)CN 62a_100000737305_200025704644 [1,1,0,0,0,0|1,1,0]=4 714 B9R1.21 [13CH3]Sc1ccc(s1)CN 62a_200025704644_100000737305 [1,1,0,0,0,0|1,1,0]=4 715 B9R1.21 [13CH3]Sc1ccc(s1)CO 62a_100000246291_200025704644 [1,1,0,0,0,0|1,1,0]=4 716 B9R1.21 [13CH3]Sc1ccc(s1)CO 62a_200025704644_100000246291 [1,1,0,0,0,0|1,1,0]=4 717 B9R1.21 [13CH3]Sc1cnc(s1)C=O 62a_100000699580_200025704644 [1,1,0,0,0,0|1,1,0]=4 718 B9R1.21 [13CH3]Sc1cnc(s1)C=O 62a_200025704644_100000699580 [1,1,0,0,0,0|1,1,0]=4 719 B9R1.21 [13CH3]Sc1coc(c1)C=O 62a_100000747035_200025704644 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.21 [13CH3]Sc1coc(c1)C=O 62a_200025704644_100000747035 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.21 [13CH3]Sc1csc(c1)C=O 62a_100000211722_200025704644 [1,1,0,0,0,0|2,0,0]=4 722 B9R1.21 [13CH3]Sc1csc(c1)C=O 62a_200025704644_100000211722 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.21 [13CH3]Sc1csc(n1)C=O 62a_100009816814_200025704644 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.21 [13CH3]Sc1csc(n1)C=O 62a_200025704644_100009816814 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.21 [13CH3]Sc1nc(cs1)C=O 62a_100009816748_200025704644 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.21 [13CH3]Sc1nc(cs1)C=O 62a_200025704644_100009816748 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.21 [13CH3]Sc1ncc(s1)C=O 62a_100009814069_200025704644 [1,1,0,0,0,0|1,1,0]=4 728 B9R1.21 [13CH3]Sc1ncc(s1)C=O 62a_200025704644_100009814069 [1,1,0,0,0,0|1,1,0]=4 729 B9R1.22 C=Cc1sc(cc1C)C 271570a_100011290941_100000689295 [1,1,0,0,0,0|0,1,1]=4 730 B9R1.22 CSc1sc(cc1C)C 62a_100000689295_200000210301 [1,1,0,0,0,0|1,1,0]=4 731 B9R1.22 CSc1sc(cc1C)C 62a_200000210301_100000689295 [1,1,0,0,0,0|1,1,0]=4 732 B9R1.22 Cc1cc(c(s1)C=O)O 271570a_203496583355_100011361552 [1,1,0,0,0,0|0,1,0]=3 733 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_100000689295_200025704644 [1,1,0,0,0,0|1,1,0]=4 734 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_200025704644_100000689295 [1,1,0,0,0,0|1,1,0]=4 735 B9R1.22 Cc1cc(sc1C=O)O 271570a_203496583355_100010221198 [1,1,0,0,0,0|1,1,0]=4 736 B9R1.23 C=Cc1cc(c(s1)C)C 271570a_100011290941_100009850898 [1,1,0,0,0,0|0,1,1]=4 737 B9R1.23 CSc1cc(c(s1)C)C 62a_100009850898_200000210301 [1,1,0,0,0,0|1,1,0]=4 738 B9R1.23 CSc1cc(c(s1)C)C 62a_200000210301_100009850898 [1,1,0,0,0,0|1,1,0]=4 739 B9R1.23 Cc1cc(sc1C)S[13CH3] 62a_100009850898_200025704644 [1,1,0,0,0,0|1,1,0]=4 740 B9R1.23 Cc1cc(sc1C)S[13CH3] 62a_200025704644_100009850898 [1,1,0,0,0,0|1,1,0]=4 741 B9R1.23 Cc1cc(sc1O)C=O 271570a_203496583355_100000761930 [1,1,0,0,0,0|1,1,0]=4 742 B9R1.23 Cc1sc(cc1O)C=O 271570a_203496583355_100000708457 [1,1,0,0,0,0|0,1,0]=3 743 B9R1.11 CN[C@H](C)c1ccco1 2230a_100160469435_200000210301 [1,1,0,0,0,0|1,0,1]=4 744 B9R1.11 CO[C@@H](C)c1ccco1 34a_100000755270_200000210301 [1,1,0,0,0,0|0,0,2]=4 745 B9R1.11 CO[C@@H](C)c1ccco1 7a_100000755270_200000210301 [1,1,0,0,0,0|0,0,2]=4 746 B9R1.11 C[C@@H](N[13CH3])c1ccco1 2230a_100160469435_200025704644 [1,1,0,0,0,0|1,0,1]=4 747 B9R1.11 C[C@H](O[13CH3])c1ccco1 34a_100000755270_200025704644 [1,1,0,0,0,0|0,0,2]=4 748 B9R1.11 C[C@H](O[13CH3])c1ccco1 7a_100000755270_200025704644 [1,1,0,0,0,0|0,0,2]=4 749 B9R1.41 C=C(C)c1sccc1Br 271570a_100000694244_100012361411 [1,1,0,0,0,0|1,1,0]=4 750 B9R1.41 C=C(C)c1sccc1C 271570a_100000694244_100000742657 [1,1,0,0,0,0|1,1,0]=4 751 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [1,1,0,0,0,0|0,1,0]=3 752 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [1,1,0,0,0,0|1,1,0]=4 753 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [0,1,0,0,0,1|1,0,1]=4 754 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [0,1,0,0,0,1|1,0,1]=4 755 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,1,0,0,0,1|2,0,0]=4 759 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [0,1,0,0,0,1|2,0,0]=4 766 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.3 C=C(C)c1ccc(cn1)CC 271570a_100000694244_100009843584 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.3 C=C(C)c1ccc(cn1)CN 271570a_100000694244_100009817727 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.3 C=C(C)c1ccc(cn1)NC 271570a_100000694244_100000764248 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.3 C=C(C)c1ccc(cn1)SC 271570a_100000694244_100009820866 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.3 C=C(C)c1ccc(nc1)CC 271570a_100000694244_100009820025 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.3 C=C(C)c1ccc(nc1)CN 271570a_100000694244_100015188789 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.3 C=C(C)c1ccc(nc1)NC 271570a_100000694244_100000741341 [0,1,0,0,0,1|2,0,0]=4 780 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [0,1,0,0,0,1|2,0,0]=4 781 B11R1.3 C=C(C)c1ccc(nc1)SC 271570a_100000694244_100011408404 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.3 C=C(C)c1ccc(nn1)NC 271570a_100000694244_100000215272 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.3 C=C(C)c1ccc(nn1)OC 271570a_100000694244_100009819040 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [0,1,0,0,0,1|1,0,1]=4 785 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [0,1,0,0,0,1|1,0,1]=4 786 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [0,1,0,0,0,1|1,0,1]=4 787 B11R1.3 C=Cc1ccc(cn1)C(=O)C 271570a_100011290941_100000684857 [0,1,0,0,0,1|1,0,1]=4 788 B11R1.3 C=Cc1ccc(nc1)C(=O)C 271570a_100011290941_100000686046 [0,1,0,0,0,1|1,0,1]=4 789 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [0,1,0,0,0,1|1,0,1]=4 790 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [0,1,0,0,0,1|1,0,0]=3 791 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [0,1,0,0,0,1|1,0,0]=3 792 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [0,1,0,0,0,1|1,0,0]=3 793 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [0,1,0,0,0,1|1,0,0]=3 794 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [0,1,0,0,0,1|1,0,0]=3 795 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [0,1,0,0,0,1|1,0,0]=3 796 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [0,1,0,0,0,1|1,0,0]=3 797 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [0,1,0,0,0,1|1,0,0]=3 798 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [0,1,0,0,0,1|1,0,0]=3 799 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [0,1,0,0,0,1|1,0,0]=3 800 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [0,1,0,0,0,1|1,0,0]=3 801 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_100009883172_200025704644 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_200025704644_100009883172 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_100000099681_200025704644 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_200025704644_100000099681 [0,1,0,0,0,1|2,0,0]=4 805 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_100010077182_200025704644 [0,1,0,0,0,1|2,0,0]=4 806 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100010077182 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,1,0,0,0,1|1,0,0]=3 808 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,1,0,0,0,1|1,0,0]=3 809 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [0,1,0,0,0,1|1,0,0]=3 812 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [0,1,0,0,0,1|2,0,0]=4 813 B11R1.3 CNc1ccc(nn1)C(=O)N 27a_100102657272_100000761398 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.3 CNc1cnc(cn1)C(=O)C 27a_100102657272_100009883172 [0,1,0,0,0,1|2,0,0]=4 815 B11R1.3 CNc1ncc(cn1)C(=O)C 27a_100102657272_100000099681 [0,1,0,0,0,1|2,0,0]=4 816 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [0,1,0,0,0,1|1,0,0]=3 817 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [0,1,0,0,0,1|1,0,0]=3 818 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [0,1,0,0,0,1|1,0,0]=3 819 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [0,1,0,0,0,1|2,0,0]=4 820 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [0,1,0,0,0,1|1,0,0]=3 822 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [0,1,0,0,0,1|2,0,0]=4 823 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [0,1,0,0,0,1|2,0,0]=4 824 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [0,1,0,0,0,1|1,0,0]=3 825 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [0,1,0,0,0,1|1,0,0]=3 826 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [0,1,0,0,0,1|1,0,0]=3 830 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [0,1,0,0,0,1|1,0,0]=3 831 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [0,1,0,0,0,1|1,0,0]=3 832 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [0,1,0,0,0,1|2,0,0]=4 833 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [0,1,0,0,0,1|2,0,0]=4 834 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [0,1,0,0,0,1|1,0,0]=3 835 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [0,1,0,0,0,1|2,0,0]=4 836 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [0,1,0,0,0,1|1,0,0]=3 837 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [0,1,0,0,0,1|1,0,0]=3 838 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [0,1,0,0,0,1|2,0,0]=4 839 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [0,1,0,0,0,1|2,0,0]=4 840 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [0,1,0,0,0,1|1,0,0]=3 841 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [0,1,0,0,0,1|1,0,0]=3 842 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [0,1,0,0,0,1|2,0,0]=4 843 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [0,1,0,0,0,1|2,0,0]=4 844 B11R1.3 CSc1ccc(nn1)C(=O)N 62a_100000761398_200000210301 [0,1,0,0,0,1|2,0,0]=4 845 B11R1.3 CSc1ccc(nn1)C(=O)N 62a_200000210301_100000761398 [0,1,0,0,0,1|2,0,0]=4 846 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_100009883172_200000210301 [0,1,0,0,0,1|2,0,0]=4 847 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_200000210301_100009883172 [0,1,0,0,0,1|2,0,0]=4 848 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_100010077182_200000210301 [0,1,0,0,0,1|2,0,0]=4 849 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_200000210301_100010077182 [0,1,0,0,0,1|2,0,0]=4 850 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_100000099681_200000210301 [0,1,0,0,0,1|2,0,0]=4 851 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_200000210301_100000099681 [0,1,0,0,0,1|2,0,0]=4 852 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [0,1,0,0,0,1|1,0,1]=4 853 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [0,1,0,0,0,1|1,0,0]=3 854 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [0,1,0,0,0,1|2,0,0]=4 855 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [0,1,0,0,0,1|2,0,0]=4 856 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [0,1,0,0,0,1|2,0,0]=4 857 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [0,1,0,0,0,1|2,0,0]=4 858 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [0,1,0,0,0,1|2,0,0]=4 859 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [0,1,0,0,0,1|2,0,0]=4 860 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [0,1,0,0,0,1|2,0,0]=4 861 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [0,1,0,0,0,1|2,0,0]=4 862 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [0,1,0,0,0,1|2,0,0]=4 863 B11R1.3 [13CH3]Sc1ccc(nn1)C(=O)N 62a_100000761398_200025704644 [0,1,0,0,0,1|2,0,0]=4 864 B11R1.3 [13CH3]Sc1ccc(nn1)C(=O)N 62a_200025704644_100000761398 [0,1,0,0,0,1|2,0,0]=4 865 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [0,1,0,0,0,1|2,0,0]=4 866 B11R1.21 C=C(C)c1cc(c(cn1)C)F 271570a_100000694244_100009841206 [0,1,0,0,0,1|2,0,0]=4 867 B11R1.21 C=C(C)c1cc(c(cn1)C)N 271570a_100000694244_100000690170 [0,1,0,0,0,1|2,0,0]=4 868 B11R1.21 C=C(C)c1cc(c(cn1)C)O 271570a_100000694244_100000704368 [0,1,0,0,0,1|2,0,0]=4 869 B11R1.21 C=C(C)c1ccc([n+](c1)[O-])C 271570a_100000694244_100000703231 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,1,0,0,0,1|2,0,0]=4 872 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,1,0,0,0,1|2,0,0]=4 873 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,1,0,0,0,1|2,0,0]=4 874 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,1,0,0,0,1|2,0,0]=4 875 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,1,0,0,0,1|2,0,0]=4 876 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [0,1,0,0,0,1|2,0,0]=4 877 B11R1.21 C=C(C)c1ccc(c(n1)N)C 271570a_100000694244_100009857032 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.21 C=C(C)c1cnc(c(c1)F)C 271570a_100000694244_100009845756 [0,1,0,0,0,1|2,0,0]=4 880 B11R1.21 C=C(C)c1cnc(c(c1)N)C 271570a_100000694244_100011999542 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.21 C=C(C)c1cnc(c(c1)O)C 271570a_100000694244_100009864810 [0,1,0,0,0,1|2,0,0]=4 882 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,1,0,0,0,1|1,0,0]=3 885 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,1,0,0,0,1|1,0,0]=3 892 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,1,0,0,0,1|2,0,0]=4 896 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,1,0,0,0,1|1,0,0]=3 899 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,1,0,0,0,1|2,0,0]=4 900 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,1,0,0,0,1|2,0,0]=4 904 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,1,0,0,0,1|1,0,0]=3 905 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,1,0,0,0,1|2,0,0]=4 906 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,1,0,0,0,1|2,0,0]=4 908 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,1,0,0,0,1|1,0,0]=3 912 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,1,0,0,0,1|2,0,0]=4 917 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,1,0,0,0,1|1,0,0]=3 920 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,1,0,0,0,1|1,0,0]=3 921 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,1,0,0,0,1|2,0,0]=4 923 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,1,0,0,0,1|2,0,0]=4 925 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,1,0,0,0,1|2,0,0]=4 926 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,1,0,0,0,1|2,0,0]=4 932 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,1,0,0,0,1|2,0,0]=4 934 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,1,0,0,0,1|2,0,0]=4 935 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,1,0,0,0,1|1,0,0]=3 936 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,1,0,0,0,1|1,0,0]=3 937 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,1,0,0,0,1|1,0,0]=3 938 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,1,0,0,0,1|1,0,0]=3 939 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,1,0,0,0,1|1,0,0]=3 940 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [0,1,0,0,0,1|2,0,0]=4 941 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,1,0,0,0,1|1,0,0]=3 942 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,1,0,0,0,1|2,0,0]=4 943 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,1,0,0,0,1|2,0,0]=4 944 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,1,0,0,0,1|2,0,0]=4 945 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,1,0,0,0,1|2,0,0]=4 946 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,1,0,0,0,1|2,0,0]=4 947 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,1,0,0,0,1|2,0,0]=4 948 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,1,0,0,0,1|2,0,0]=4 949 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,1,0,0,0,1|2,0,0]=4 950 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,1,0,0,0,1|2,0,0]=4 951 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,1,0,0,0,1|2,0,0]=4 952 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,1,0,0,0,1|2,0,0]=4 953 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,1,0,0,0,1|2,0,0]=4 954 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,1,0,0,0,1|2,0,0]=4 955 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,1,0,0,0,1|2,0,0]=4 956 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,1,0,0,0,1|2,0,0]=4 957 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,1,0,0,0,1|2,0,0]=4 958 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,1,0,0,0,1|2,0,0]=4 959 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,1,0,0,0,1|2,0,0]=4 960 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,1,0,0,0,1|2,0,0]=4 961 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,1,0,0,0,1|2,0,0]=4 962 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,1,0,0,0,1|2,0,0]=4 963 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,1,0,0,0,1|2,0,0]=4 964 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,1,0,0,0,1|2,0,0]=4 965 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,1,0,0,0,1|2,0,0]=4 966 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,1,0,0,0,1|2,0,0]=4 967 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,0,0,0,1|2,0,0]=4 968 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,0,0,0,1|1,0,0]=3 969 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,0,0,0,1|2,0,0]=4 970 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,0,0,0,1|2,0,0]=4 971 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,0,0,0,1|2,0,0]=4 972 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,0,0,0,1|2,0,0]=4 973 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,0,0,0,1|2,0,0]=4 974 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,0,0,0,1|2,0,0]=4 975 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,0,0,0,1|2,0,0]=4 976 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,0,0,0,1|2,0,0]=4 977 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,0,0,0,1|2,0,0]=4 978 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,0,0,0,1|2,0,0]=4 979 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,0,0,0,1|1,0,0]=3 980 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,0,0,0,1|1,0,0]=3 981 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,0,0,0,1|1,0,0]=3 982 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,0,0,0,1|1,0,0]=3 983 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,0,0,0,1|2,0,0]=4 984 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,0,0,0,1|2,0,0]=4 985 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,0,0,0,1|2,0,0]=4 986 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,0,0,0,1|2,0,0]=4 987 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,0,0,0,1|2,0,0]=4 988 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,0,0,0,1|2,0,0]=4 989 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,0,0,0,1|2,0,0]=4 990 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,0,0,0,1|2,0,0]=4 991 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,0,0,0,1|2,0,0]=4 992 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,0,0,0,1|2,0,0]=4 993 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,0,0,0,1|2,0,0]=4 994 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,0,0,0,1|2,0,0]=4 995 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,0,0,0,1|2,0,0]=4 996 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,0,0,0,1|2,0,0]=4 997 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,0,0,0,1|2,0,0]=4 998 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,0,0,0,1|2,0,0]=4 999 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,0,0,0,1|2,0,0]=4 1000 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,0,0,0,1|2,0,0]=4 1001 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,0,0,0,1|2,0,0]=4 1002 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,0,0,0,1|2,0,0]=4 1003 B11R1.22 COC(=O)c1ccc(nn1)O 271570a_203496583355_100009816182 [0,1,0,0,0,1|2,0,0]=4 1004 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,0,0,0,1|1,0,0]=3 1005 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,0,0,0,1|2,0,0]=4 1006 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,0,0,0,1|2,0,0]=4 1007 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,0,0,0,1|2,0,0]=4 1008 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,0,0,0,1|2,0,0]=4 1009 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,0,0,0,1|2,0,0]=4 1010 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,0,0,0,1|2,0,0]=4 1011 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,0,0,0,1|2,0,0]=4 1012 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])C 271570a_100000694244_100009819918 [0,1,0,0,0,1|2,0,0]=4 1013 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [0,1,0,0,0,1|2,0,0]=4 1014 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,0,0,0,1|2,0,0]=4 1015 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [0,1,0,0,0,1|2,0,0]=4 1016 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [0,1,0,0,0,1|2,0,0]=4 1017 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [0,1,0,0,0,1|2,0,0]=4 1018 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,1,0,0,0,1|2,0,0]=4 1019 B11R1.166 C=C(C)c1ccc(nc1C)C 271570a_100000694244_100009813853 [0,1,0,0,0,1|2,0,0]=4 1020 B11R1.166 C=C(C)c1ccc(nc1F)C 271570a_100000694244_100010006597 [0,1,0,0,0,1|2,0,0]=4 1021 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,1,0,0,0,1|2,0,0]=4 1022 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [0,1,0,0,0,1|2,0,0]=4 1023 B11R1.166 C=C(C)c1cnc(cc1C)C 271570a_100000694244_100009819613 [0,1,0,0,0,1|2,0,0]=4 1024 B11R1.166 C=C(C)c1cnc(cc1N)C 271570a_100000694244_100009817891 [0,1,0,0,0,1|2,0,0]=4 1025 B11R1.166 C=C(C)c1cnc(cc1O)C 271570a_100000694244_100011016184 [0,1,0,0,0,1|2,0,0]=4 1026 B11R1.166 C=C(C)c1ncc(cc1C)C 271570a_100000694244_100009864548 [0,1,0,0,0,1|2,0,0]=4 1027 B11R1.166 C=C(C)c1ncc(cc1F)C 271570a_100000694244_100009819633 [0,1,0,0,0,1|2,0,0]=4 1028 B11R1.166 C=C(C)c1ncc(cc1N)C 271570a_100000694244_100000733613 [0,1,0,0,0,1|2,0,0]=4 1029 B11R1.166 C=C(C)c1ncc(cc1O)C 271570a_100000694244_100012000487 [0,1,0,0,0,1|2,0,0]=4 1030 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,1,0,0,0,1|2,0,0]=4 1031 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,1,0,0,0,1|1,0,0]=3 1032 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,1,0,0,0,1|2,0,0]=4 1033 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,1,0,0,0,1|2,0,0]=4 1034 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,1,0,0,0,1|2,0,0]=4 1035 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,1,0,0,0,1|2,0,0]=4 1036 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,1,0,0,0,1|2,0,0]=4 1037 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,1,0,0,0,1|1,0,0]=3 1038 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,1,0,0,0,1|2,0,0]=4 1039 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,1,0,0,0,1|2,0,0]=4 1040 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,1,0,0,0,1|2,0,0]=4 1041 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,1,0,0,0,1|2,0,0]=4 1042 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,1,0,0,0,1|2,0,0]=4 1043 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,1,0,0,0,1|2,0,0]=4 1044 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,1,0,0,0,1|1,0,0]=3 1045 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,1,0,0,0,1|2,0,0]=4 1046 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,1,0,0,0,1|2,0,0]=4 1047 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,1,0,0,0,1|2,0,0]=4 1048 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,1,0,0,0,1|2,0,0]=4 1049 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,1,0,0,0,1|2,0,0]=4 1050 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,1,0,0,0,1|1,0,0]=3 1051 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,1,0,0,0,1|2,0,0]=4 1052 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,1,0,0,0,1|2,0,0]=4 1053 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,1,0,0,0,1|2,0,0]=4 1054 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,1,0,0,0,1|2,0,0]=4 1055 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,1,0,0,0,1|2,0,0]=4 1056 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,1,0,0,0,1|2,0,0]=4 1057 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,1,0,0,0,1|1,0,0]=3 1058 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,1,0,0,0,1|2,0,0]=4 1059 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,1,0,0,0,1|2,0,0]=4 1060 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,1,0,0,0,1|2,0,0]=4 1061 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,0,0,0,1|2,0,0]=4 1062 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,0,0,0,1|1,0,0]=3 1063 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,0,0,0,1|1,0,0]=3 1064 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,0,0,0,1|2,0,0]=4 1066 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,0,0,0,1|2,0,0]=4 1067 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,0,0,0,1|2,0,0]=4 1068 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,0,0,0,1|2,0,0]=4 1069 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,0,0,0,1|2,0,0]=4 1070 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,0,0,0,1|2,0,0]=4 1071 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [0,1,0,0,0,1|2,0,0]=4 1072 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,1,0,0,0,1|2,0,0]=4 1073 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,1,0,0,0,1|2,0,0]=4 1074 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,1,0,0,0,1|2,0,0]=4 1075 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,1,0,0,0,1|2,0,0]=4 1076 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,1,0,0,0,1|2,0,0]=4 1077 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,1,0,0,0,1|1,0,0]=3 1078 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,1,0,0,0,1|1,0,0]=3 1079 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,1,0,0,0,1|1,0,0]=3 1080 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,1,0,0,0,1|1,0,0]=3 1081 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,1,0,0,0,1|1,0,0]=3 1082 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,0,0,0,1|1,0,0]=3 1083 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 271570a_203496583355_100000041523 [0,1,0,0,0,1|2,0,0]=4 1084 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,1,0,0,0,1|2,0,0]=4 1085 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,1,0,0,0,1|2,0,0]=4 1086 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,1,0,0,0,1|2,0,0]=4 1087 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,1,0,0,0,1|2,0,0]=4 1088 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,1,0,0,0,1|2,0,0]=4 1090 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,1,0,0,0,1|2,0,0]=4 1091 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,1,0,0,0,1|2,0,0]=4 1092 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,1,0,0,0,1|2,0,0]=4 1093 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,1,0,0,0,1|2,0,0]=4 1094 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,1,0,0,0,1|2,0,0]=4 1095 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,1,0,0,0,1|2,0,0]=4 1096 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,1,0,0,0,1|2,0,0]=4 1097 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,1,0,0,0,1|2,0,0]=4 1098 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,1,0,0,0,1|2,0,0]=4 1099 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,1,0,0,0,1|2,0,0]=4 1100 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,1,0,0,0,1|2,0,0]=4 1101 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,1,0,0,0,1|2,0,0]=4 1102 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,0,0,0,1|2,0,0]=4 1103 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,0,0,0,1|2,0,0]=4 1104 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,0,0,0,1|2,0,0]=4 1105 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,0,0,0,1|2,0,0]=4 1106 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,0,0,0,1|2,0,0]=4 1107 B11R1.39 CC(=Cc1ccc(o1)I)C#N 6a_100000186757_200000212204 [0,1,0,0,0,1|2,0,0]=4 1108 B11R1.39 CCC(=O)Cc1ccc(s1)Br 1458a_100000210414_100000708592 [0,1,0,0,0,1|1,1,0]=4 1109 B11R1.39 CCC(=O)Cc1ccc(s1)Br 1458a_100000238643_100000210202 [0,1,0,0,0,1|1,1,0]=4 1110 B11R1.39 CCC(=O)Cc1ccc(s1)Cl 1458a_100000210414_100000185097 [0,1,0,0,0,1|1,1,0]=4 1111 B11R1.39 CCC(=O)Cc1ccc(s1)Cl 1458a_100000238644_100000210202 [0,1,0,0,0,1|1,1,0]=4 1112 B11R1.39 CCC(=O)Cc1ccn(n1)C 1458a_100000210414_100000726502 [0,1,0,0,0,1|2,0,0]=4 1113 B11R1.39 CCC(=O)Cc1cnc(s1)C 1458a_100000210414_100020635045 [0,1,0,0,0,1|1,1,0]=4 1114 B11R1.39 CCC(=O)Cc1csc(n1)C 1458a_100000184407_100000210202 [0,1,0,0,0,1|2,0,0]=4 1115 B11R1.39 CCC(=O)Cc1csc(n1)C 1458a_100000210414_100015186478 [0,1,0,0,0,1|2,0,0]=4 1116 B11R1.39 CCC(=O)Cc1nnc(o1)C 1458a_100000210414_100000181450 [0,1,0,0,0,1|2,0,0]=4 1117 B11R1.39 CCC(=O)Cn1ccc(n1)C 1458a_100000238720_100000210202 [0,1,0,0,0,1|2,0,0]=4 1118 B11R1.39 CCN(C)Cc1ccc(o1)C 2230a_100000184526_100000210202 [0,1,0,0,0,1|2,0,0]=4 1119 B11R1.39 CCN(C)Cc1ccc(o1)C 2230a_200015183256_200000210301 [0,1,0,0,0,1|2,0,0]=4 1120 B11R1.39 CCN(C)Cc1ccc(o1)C 269982a_100000184526_100000204670 [0,1,0,0,0,1|2,0,0]=4 1121 B11R1.39 CCN(C)Cc1ccc(o1)C 269982a_200015183256_200000210301 [0,1,0,0,0,1|2,0,0]=4 1122 B11R1.39 CCN(C)Cc1ccc(o1)C 34a_100000184526_100000210202 [0,1,0,0,0,1|2,0,0]=4 1123 B11R1.39 CCN([13CH3])Cc1ccc(o1)C 2230a_200015183256_200025704644 [0,1,0,0,0,1|2,0,0]=4 1124 B11R1.39 CCN([13CH3])Cc1ccc(o1)C 269982a_200015183256_200025704644 [0,1,0,0,0,1|2,0,0]=4 1125 B11R1.39 CNC(=O)Cc1ccc(s1)Br 11a_106832991635_100000238643 [0,1,0,0,0,1|1,1,0]=4 1126 B11R1.39 CNC(=O)Cc1ccc(s1)Br 1626a_100102657272_100000238643 [0,1,0,0,0,1|1,1,0]=4 1127 B11R1.39 CNC(=O)Cc1ccc(s1)Cl 11a_106832991635_100000238644 [0,1,0,0,0,1|1,1,0]=4 1128 B11R1.39 CNC(=O)Cc1ccc(s1)Cl 1626a_100102657272_100000238644 [0,1,0,0,0,1|1,1,0]=4 1129 B11R1.39 CNC(=O)Cc1ccc(s1)Cl 240690a_100102657272_100000238644 [0,1,0,0,0,1|1,1,0]=4 1130 B11R1.39 CNC(=O)Cc1csc(n1)C 11a_106832991635_100000184407 [0,1,0,0,0,1|2,0,0]=4 1131 B11R1.39 CNC(=O)Cc1csc(n1)C 1626a_100102657272_100000184407 [0,1,0,0,0,1|2,0,0]=4 1132 B11R1.39 CNC(=O)Cc1csc(n1)C 240690a_100102657272_100000184407 [0,1,0,0,0,1|2,0,0]=4 1133 B11R1.39 CNC(=O)Cc1csc(n1)C 527a_100102657272_100000184407 [0,1,0,0,0,1|2,0,0]=4 1134 B11R1.39 CNC(=O)Cc1nc(cs1)C 1626a_100102657272_100000734950 [0,1,0,0,0,1|2,0,0]=4 1135 B11R1.39 CNC(=O)Cc1nc(cs1)C 240690a_100102657272_100000734950 [0,1,0,0,0,1|2,0,0]=4 1136 B11R1.39 CNC(=O)Cn1ccc(n1)C 11a_106832991635_100000238720 [0,1,0,0,0,1|2,0,0]=4 1137 B11R1.39 CNC(=O)Cn1ccc(n1)C 1626a_100102657272_100000238720 [0,1,0,0,0,1|2,0,0]=4 1138 B11R1.39 CNC(=O)Cn1ccc(n1)C 240690a_100102657272_100000238720 [0,1,0,0,0,1|2,0,0]=4 1139 B11R1.39 CNC(=O)Cn1ccc(n1)C 527a_100102657272_100000238720 [0,1,0,0,0,1|2,0,0]=4 1140 B11R1.39 COC(=O)Cc1ccc(s1)O 271570a_203496583355_100012028946 [0,1,0,0,0,1|1,1,0]=4 1141 B11R1.39 Cc1ccc(o1)CN(C)CF 269982a_100000184526_100015361967 [0,1,0,0,0,1|2,0,0]=4 1142 B11R1.39 Cc1ccc(o1)CN(C)CF 34a_100000184526_100015361967 [0,1,0,0,0,1|2,0,0]=4 1143 B11R1.39 Cc1ccn(n1)CC(=O)CF 1458a_100000238720_100015361967 [0,1,0,0,0,1|2,0,0]=4 1144 B11R1.39 Cc1nc(cs1)CC(=O)CF 1458a_100000184407_100015361967 [0,1,0,0,0,1|2,0,0]=4 1145 B11R1.39 Cc1nc(cs1)CC(=O)CO 1458a_100000210174_100015186478 [0,1,0,0,0,1|2,0,0]=4 1146 B11R1.39 Cc1ncc(s1)CC(=O)CO 1458a_100000210174_100020635045 [0,1,0,0,0,1|1,1,0]=4 1147 B11R1.39 Cc1nnc(o1)CC(=O)CO 1458a_100000210174_100000181450 [0,1,0,0,0,1|2,0,0]=4 1148 B11R1.39 Cn1ccc(n1)CC(=O)CO 1458a_100000210174_100000726502 [0,1,0,0,0,1|2,0,0]=4 1149 B11R1.39 O=C(CF)Cc1ccc(s1)Br 1458a_100000238643_100015361967 [0,1,0,0,0,1|1,1,0]=4 1150 B11R1.39 O=C(CF)Cc1ccc(s1)Cl 1458a_100000238644_100015361967 [0,1,0,0,0,1|1,1,0]=4 1151 B11R1.39 O=C(CO)Cc1ccc(s1)Br 1458a_100000210174_100000708592 [0,1,0,0,0,1|1,1,0]=4 1152 B11R1.39 O=C(CO)Cc1ccc(s1)Cl 1458a_100000210174_100000185097 [0,1,0,0,0,1|1,1,0]=4 1153 B11R1.43 C=Cc1ccc(s1)NC(=O)C 271570a_100011290941_100010002808 [0,1,0,0,0,1|0,1,1]=4 1154 B11R1.43 CC(=Cc1ccc(o1)C#N)C 271570a_100102525489_100000764468 [0,1,0,0,0,1|1,0,1]=4 1155 B11R1.43 CC(=Cc1ccc(o1)C=O)C 271570a_100102525489_100000185145 [0,1,0,0,0,1|1,0,1]=4 1156 B11R1.43 CC(=Cc1ccc(o1)CN)C 271570a_100102525489_100000708654 [0,1,0,0,0,1|1,0,0]=3 1157 B11R1.43 CC(=Cc1ccc(o1)CO)C 271570a_100102525489_100000246276 [0,1,0,0,0,1|1,0,0]=3 1158 B11R1.43 CC(=Cc1ccc(s1)CN)C 271570a_100102525489_100000737305 [0,1,0,0,0,1|1,1,0]=4 1159 B11R1.43 CC(=Cc1ccc(s1)CO)C 271570a_100102525489_100000246291 [0,1,0,0,0,1|1,1,0]=4 1160 B11R1.43 CC(=O)Cc1ccc(o1)C#N 1458a_100000070787_100009822536 [0,1,0,0,0,1|0,0,1]=3 1161 B11R1.43 CC(=O)Cc1ccc(o1)C=O 1458a_100000070787_200000079136 [0,1,0,0,0,1|0,0,1]=3 1162 B11R1.43 CC(=O)Cc1ccc(s1)C#N 1458a_100000070787_100010188212 [0,1,0,0,0,1|0,1,1]=4 1163 B11R1.43 CC(=O)Nc1ccc(s1)S[13CH3] 62a_200025704644_100010002808 [0,1,0,0,0,1|0,1,0]=3 1164 B11R1.43 CC(=O)Nc1ncc(s1)S[13CH3] 62a_200025704644_100000050200 [0,1,0,0,0,1|1,1,0]=4 1165 B11R1.43 CC(C)Sc1ccc(o1)CN 62a_100000210206_100000708654 [0,1,0,0,0,1|1,0,1]=4 1166 B11R1.43 CC(C)Sc1ccc(o1)CO 62a_100000210206_100000246276 [0,1,0,0,0,1|1,0,1]=4 1167 B11R1.43 CC(C)Sc1ccc(o1)CO 62a_100000246276_100000210206 [0,1,0,0,0,1|1,0,1]=4 1168 B11R1.43 CCc1ccc(o1)CN(C)C 270004a_100102631434_100000743199 [0,1,0,0,0,1|2,0,0]=4 1169 B11R1.43 CCc1ccc(s1)C=C(C)C 271570a_100102525489_100009844052 [0,1,0,0,0,1|1,1,0]=4 1170 B11R1.43 CCc1nc(cs1)CC(=O)C 1458a_100000070787_100020603300 [0,1,0,0,0,1|2,0,0]=4 1171 B11R1.43 CCn1ccc(n1)CC(=O)C 1458a_100000070787_100000094151 [0,1,0,0,0,1|2,0,0]=4 1172 B11R1.43 CN(C)Cc1ccc(o1)CO 270004a_100102631434_100000758743 [0,1,0,0,0,1|2,0,0]=4 1173 B11R1.43 CSc1ccc(s1)NC(=O)C 62a_200000210301_100010002808 [0,1,0,0,0,1|0,1,0]=3 1174 B11R1.43 CSc1cnc(s1)NC(=O)C 62a_200000210301_100000050200 [0,1,0,0,0,1|1,1,0]=4 1175 B11R1.80 CC(=Cc1cc(c(s1)C)C)C 271570a_100102525489_100009850898 [0,1,0,0,0,1|1,1,0]=4 1176 B11R1.80 CC(=O)Cc1cc(n(n1)C)C 1458a_100000070787_100000761402 [0,1,0,0,0,1|2,0,0]=4 1177 B11R1.80 CC(=O)Cc1nc(c(s1)C)C 1458a_100000070787_100000763442 [0,1,0,0,0,1|1,1,0]=4 1178 B11R1.80 CC(=O)Cn1cc(c(n1)C)Br 1458a_100000759134_200000210301 [0,1,0,0,0,1|2,0,0]=4 1179 B11R1.80 CC(=O)Nc1nc(c(s1)O)C 271570a_203496583355_200010003082 [0,1,0,0,0,1|2,0,0]=4 1180 B11R1.80 Cc1nn(cc1Br)CC(=O)[13CH3] 1458a_100000759134_200025704644 [0,1,0,0,0,1|2,0,0]=4 1181 B11R1.314 CC(=C(C)c1ccc(s1)C)C 271570a_200000049429_100000761539 [0,1,0,0,0,1|1,1,0]=4 1182 B11R1.645 CC(=Cc1sc(cc1C)C)C 271570a_100102525489_100000689295 [0,1,0,0,0,1|1,1,0]=4 1183 B11R1.645 CC(=O)Cc1nc(sc1C)C 1458a_100000040699_200000210301 [0,1,0,0,0,1|2,0,0]=4 1184 B11R1.645 CC(=O)Cc1nn(cc1Br)C 1458a_100000070787_100009817083 [0,1,0,0,0,1|2,0,0]=4 1185 B11R1.645 CC(=O)Cc1oc(=O)oc1C 1458a_100000070787_100000068490 [0,1,0,0,0,1|2,0,0]=4 1186 B11R1.645 CC(=O)Cc1sc(nc1Br)C 1458a_100000070787_100015664652 [0,1,0,0,0,1|1,1,0]=4 1187 B11R1.645 CC(=O)Cc1sc(nc1C)C 1458a_100000070787_100000760948 [0,1,0,0,0,1|1,1,0]=4 1188 B11R1.645 CC(=O)Cc1sc(nc1C)C 1458a_100025788167_200000210301 [0,1,0,0,0,1|1,1,0]=4 1189 B11R1.645 CC(=O)Cn1nc(cc1C)C 1458a_100000230924_200000210301 [0,1,0,0,0,1|2,0,0]=4 1190 B11R1.645 Cc1cc(n(n1)CC(=O)[13CH3])C 1458a_100000230924_200025704644 [0,1,0,0,0,1|2,0,0]=4 1191 B11R1.645 Cc1nc(c(s1)C)CC(=O)[13CH3] 1458a_100000040699_200025704644 [0,1,0,0,0,1|2,0,0]=4 1192 B11R1.645 Cc1nc(c(s1)CC(=O)[13CH3])C 1458a_100025788167_200025704644 [0,1,0,0,0,1|1,1,0]=4 1193 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [0,1,0,0,0,1|2,0,0]=4 1194 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [0,1,0,0,0,1|2,0,0]=4 1195 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,1,0,0,0,1|1,0,0]=3 1196 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [0,1,0,0,0,1|2,0,0]=4 1197 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [0,1,0,0,0,1|2,0,0]=4 1198 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [0,1,0,0,0,1|2,0,0]=4 1199 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [0,1,0,0,0,1|2,0,0]=4 1200 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [0,1,0,0,0,1|2,0,0]=4 1201 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [0,1,0,0,0,1|2,0,0]=4 1202 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [0,1,0,0,0,1|2,0,0]=4 1203 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [0,1,0,0,0,1|2,0,0]=4 1204 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [0,1,0,0,0,1|2,0,0]=4 1205 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [0,1,0,0,0,1|2,0,0]=4 1206 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [0,1,0,0,0,1|2,0,0]=4 1207 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [0,1,0,0,0,1|1,0,0]=3 1208 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [0,1,0,0,0,1|1,0,0]=3 1209 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [0,1,0,0,0,1|1,0,0]=3 1210 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [0,1,0,0,0,1|1,0,0]=3 1211 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [0,1,0,0,0,1|2,0,0]=4 1212 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [0,1,0,0,0,1|2,0,0]=4 1213 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [0,1,0,0,0,1|2,0,0]=4 1214 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [0,1,0,0,0,1|2,0,0]=4 1215 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [0,1,0,0,0,1|2,0,0]=4 1216 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [0,1,0,0,0,1|2,0,0]=4 1217 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [0,1,0,0,0,1|2,0,0]=4 1218 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [0,1,0,0,0,1|2,0,0]=4 1219 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [0,1,0,0,0,1|2,0,0]=4 1220 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [0,1,0,0,0,1|2,0,0]=4 1221 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [0,1,0,0,0,1|2,0,0]=4 1222 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [0,1,0,0,0,1|2,0,0]=4 1223 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [0,1,0,0,0,1|2,0,0]=4 1224 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [0,1,0,0,0,1|2,0,0]=4 1225 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [0,1,0,0,0,1|2,0,0]=4 1226 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [0,1,0,0,0,1|2,0,0]=4 1227 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [0,1,0,0,0,1|2,0,0]=4 1228 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [0,1,0,0,0,1|2,0,0]=4 1229 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [0,1,0,0,0,1|2,0,0]=4 1230 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [0,1,0,0,0,1|2,0,0]=4 1231 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [0,1,0,0,0,1|2,0,0]=4 1232 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [0,1,0,0,0,1|2,0,0]=4 1233 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [0,1,0,0,0,1|2,0,0]=4 1234 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [0,1,0,0,0,1|2,0,0]=4 1235 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [0,1,0,0,0,1|2,0,0]=4 1236 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [0,1,0,0,0,1|1,0,0]=3 1237 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [0,1,0,0,0,1|2,0,0]=4 1238 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [0,1,0,0,0,1|2,0,0]=4 1239 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [0,1,0,0,0,1|2,0,0]=4 1240 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [0,1,0,0,0,1|2,0,0]=4 1241 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [0,1,0,0,0,1|2,0,0]=4 1242 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [0,1,0,0,0,1|2,0,0]=4 1243 B11R1.74 C=C(C)c1cc([nH]c(=O)c1)C 271570a_100000694244_100009861981 [0,1,0,0,0,1|2,0,0]=4 1244 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [0,1,0,0,0,1|2,0,0]=4 1245 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [0,1,0,0,0,1|2,0,0]=4 1246 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [0,1,0,0,0,1|2,0,0]=4 1247 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [0,1,0,0,0,1|2,0,0]=4 1248 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [0,1,0,0,0,1|2,0,0]=4 1249 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [0,1,0,0,0,1|2,0,0]=4 1250 B11R1.74 C=C(C)c1cc(cc(n1)F)C 271570a_100000694244_100009819601 [0,1,0,0,0,1|2,0,0]=4 1251 B11R1.74 C=C(C)c1cc(cc(n1)N)C 271570a_100000694244_100009819863 [0,1,0,0,0,1|2,0,0]=4 1252 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [0,1,0,0,0,1|2,0,0]=4 1253 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [0,1,0,0,0,1|2,0,0]=4 1254 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [0,1,0,0,0,1|2,0,0]=4 1255 B11R1.74 C=C(C)c1cc(nc(n1)C)C 271570a_100000694244_100000736142 [0,1,0,0,0,1|2,0,0]=4 1256 B11R1.74 C=C(C)c1cc(nc(n1)C)N 271570a_100000694244_100012178882 [0,1,0,0,0,1|2,0,0]=4 1257 B11R1.74 C=C(C)c1cc(nc(n1)C)O 271570a_100000694244_106741647437 [0,1,0,0,0,1|2,0,0]=4 1258 B11R1.74 C=C(C)c1nc(cc(n1)C)C 271570a_100000694244_100000736147 [0,1,0,0,0,1|2,0,0]=4 1259 B11R1.74 C=C(C)c1nc(cc(n1)N)C 271570a_100000694244_100000687285 [0,1,0,0,0,1|2,0,0]=4 1260 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [0,1,0,0,0,1|2,0,0]=4 1261 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [0,1,0,0,0,1|1,0,0]=3 1262 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [0,1,0,0,0,1|2,0,0]=4 1263 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [0,1,0,0,0,1|2,0,0]=4 1264 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [0,1,0,0,0,1|2,0,0]=4 1265 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [0,1,0,0,0,1|2,0,0]=4 1266 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [0,1,0,0,0,1|1,0,0]=3 1267 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [0,1,0,0,0,1|1,0,0]=3 1268 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [0,1,0,0,0,1|2,0,0]=4 1269 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [0,1,0,0,0,1|2,0,0]=4 1270 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [0,1,0,0,0,1|2,0,0]=4 1271 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [0,1,0,0,0,1|1,0,0]=3 1272 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [0,1,0,0,0,1|2,0,0]=4 1273 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [0,1,0,0,0,1|2,0,0]=4 1274 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [0,1,0,0,0,1|2,0,0]=4 1275 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [0,1,0,0,0,1|2,0,0]=4 1276 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [0,1,0,0,0,1|1,0,0]=3 1277 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [0,1,0,0,0,1|2,0,0]=4 1278 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [0,1,0,0,0,1|2,0,0]=4 1279 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [0,1,0,0,0,1|2,0,0]=4 1280 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [0,1,0,0,0,1|1,0,0]=3 1281 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [0,1,0,0,0,1|1,0,0]=3 1282 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [0,1,0,0,0,1|1,0,0]=3 1283 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [0,1,0,0,0,1|2,0,0]=4 1284 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [0,1,0,0,0,1|1,0,0]=3 1285 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [0,1,0,0,0,1|1,0,0]=3 1286 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [0,1,0,0,0,1|1,0,0]=3 1287 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [0,1,0,0,0,1|1,0,0]=3 1288 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [0,1,0,0,0,1|1,0,0]=3 1289 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [0,1,0,0,0,1|1,0,0]=3 1290 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [0,1,0,0,0,1|2,0,0]=4 1291 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [0,1,0,0,0,1|2,0,0]=4 1292 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [0,1,0,0,0,1|2,0,0]=4 1293 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [0,1,0,0,0,1|2,0,0]=4 1294 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [0,1,0,0,0,1|2,0,0]=4 1295 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [0,1,0,0,0,1|2,0,0]=4 1296 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [0,1,0,0,0,1|2,0,0]=4 1297 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [0,1,0,0,0,1|2,0,0]=4 1298 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [0,1,0,0,0,1|2,0,0]=4 1299 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [0,1,0,0,0,1|2,0,0]=4 1300 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [0,1,0,0,0,1|2,0,0]=4 1301 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [0,1,0,0,0,1|2,0,0]=4 1302 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [0,1,0,0,0,1|2,0,0]=4 1303 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,1,0,0,0,1|2,0,0]=4 1304 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [0,1,0,0,0,1|2,0,0]=4 1305 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [0,1,0,0,0,1|2,0,0]=4 1306 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [0,1,0,0,0,1|2,0,0]=4 1307 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,1,0,0,0,1|2,0,0]=4 1308 B11R1.159 C=C(C)c1ccnc(c1C)C 271570a_100000694244_100009846815 [0,1,0,0,0,1|2,0,0]=4 1309 B11R1.159 C=C(C)c1ccnc(c1Cl)C 271570a_100000694244_100000698670 [0,1,0,0,0,1|2,0,0]=4 1310 B11R1.159 C=C(C)c1ccnc(c1F)C 271570a_100000694244_100009849794 [0,1,0,0,0,1|2,0,0]=4 1311 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [0,1,0,0,0,1|2,0,0]=4 1312 B11R1.159 C=C(C)c1cncc(c1C)C 271570a_100000694244_100009864703 [0,1,0,0,0,1|2,0,0]=4 1313 B11R1.159 C=C(C)c1cncc(c1N)C 271570a_100000694244_100009818025 [0,1,0,0,0,1|2,0,0]=4 1314 B11R1.159 C=C(C)c1nccc(c1C)C 271570a_100000694244_100009847204 [0,1,0,0,0,1|2,0,0]=4 1315 B11R1.159 C=C(C)c1nccc(c1F)C 271570a_100000694244_100009817629 [0,1,0,0,0,1|2,0,0]=4 1316 B11R1.159 C=C(C)c1nccc(c1N)C 271570a_100000694244_100000763560 [0,1,0,0,0,1|2,0,0]=4 1317 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [0,1,0,0,0,1|2,0,0]=4 1318 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,1,0,0,0,1|2,0,0]=4 1319 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,1,0,0,0,1|1,0,0]=3 1320 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,1,0,0,0,1|2,0,0]=4 1321 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,1,0,0,0,1|2,0,0]=4 1322 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,1,0,0,0,1|2,0,0]=4 1323 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,1,0,0,0,1|2,0,0]=4 1324 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,1,0,0,0,1|2,0,0]=4 1325 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,1,0,0,0,1|1,0,0]=3 1326 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,1,0,0,0,1|2,0,0]=4 1327 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,1,0,0,0,1|2,0,0]=4 1328 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,1,0,0,0,1|2,0,0]=4 1329 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,1,0,0,0,1|2,0,0]=4 1330 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,1,0,0,0,1|2,0,0]=4 1331 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,1,0,0,0,1|2,0,0]=4 1332 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,1,0,0,0,1|1,0,0]=3 1333 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,1,0,0,0,1|2,0,0]=4 1334 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,1,0,0,0,1|2,0,0]=4 1335 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,1,0,0,0,1|2,0,0]=4 1336 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,1,0,0,0,1|2,0,0]=4 1337 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,1,0,0,0,1|2,0,0]=4 1338 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,1,0,0,0,1|1,0,0]=3 1339 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,1,0,0,0,1|2,0,0]=4 1340 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,1,0,0,0,1|2,0,0]=4 1341 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,1,0,0,0,1|2,0,0]=4 1342 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,1,0,0,0,1|2,0,0]=4 1343 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,1,0,0,0,1|2,0,0]=4 1344 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,1,0,0,0,1|2,0,0]=4 1345 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,1,0,0,0,1|1,0,0]=3 1346 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,1,0,0,0,1|2,0,0]=4 1347 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,1,0,0,0,1|2,0,0]=4 1348 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,1,0,0,0,1|2,0,0]=4 1349 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,1,0,0,0,1|2,0,0]=4 1350 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,1,0,0,0,1|1,0,0]=3 1351 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,1,0,0,0,1|2,0,0]=4 1352 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,1,0,0,0,1|2,0,0]=4 1353 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,1,0,0,0,1|2,0,0]=4 1354 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,1,0,0,0,1|2,0,0]=4 1355 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,1,0,0,0,1|2,0,0]=4 1356 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [0,1,0,0,0,1|2,0,0]=4 1357 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [0,1,0,0,0,1|2,0,0]=4 1358 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,1,0,0,0,1|2,0,0]=4 1359 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,1,0,0,0,1|2,0,0]=4 1360 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,1,0,0,0,1|2,0,0]=4 1361 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,1,0,0,0,1|2,0,0]=4 1362 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,1,0,0,0,1|2,0,0]=4 1363 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,1,0,0,0,1|1,0,0]=3 1364 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,1,0,0,0,1|1,0,0]=3 1365 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,1,0,0,0,1|1,0,0]=3 1366 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,1,0,0,0,1|1,0,0]=3 1367 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,1,0,0,0,1|1,0,0]=3 1368 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,1,0,0,0,1|2,0,0]=4 1369 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,1,0,0,0,1|1,0,0]=3 1370 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,1,0,0,0,1|2,0,0]=4 1371 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,1,0,0,0,1|2,0,0]=4 1372 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,1,0,0,0,1|2,0,0]=4 1373 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,1,0,0,0,1|2,0,0]=4 1374 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,1,0,0,0,1|2,0,0]=4 1375 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,1,0,0,0,1|2,0,0]=4 1376 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,1,0,0,0,1|2,0,0]=4 1377 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,1,0,0,0,1|2,0,0]=4 1378 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,1,0,0,0,1|2,0,0]=4 1379 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,1,0,0,0,1|2,0,0]=4 1380 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,1,0,0,0,1|2,0,0]=4 1381 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,1,0,0,0,1|2,0,0]=4 1382 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,1,0,0,0,1|2,0,0]=4 1383 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,1,0,0,0,1|2,0,0]=4 1384 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,1,0,0,0,1|2,0,0]=4 1385 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,1,0,0,0,1|2,0,0]=4 1386 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,1,0,0,0,1|2,0,0]=4 1387 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,1,0,0,0,1|2,0,0]=4 1388 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,1,0,0,0,1|2,0,0]=4 1389 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,1,0,0,0,1|2,0,0]=4 1390 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,1,0,0,0,1|2,0,0]=4 1391 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,1,0,0,0,1|2,0,0]=4 1392 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,1,0,0,0,1|2,0,0]=4 1393 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [0,1,0,0,0,1|2,0,0]=4 1394 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,1,0,0,0,1|2,0,0]=4 1395 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [0,1,0,0,0,1|2,0,0]=4 1396 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [0,1,0,0,0,1|2,0,0]=4 1397 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [0,1,0,0,0,1|2,0,0]=4 1398 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,1,0,0,0,1|2,0,0]=4 1399 B11R1.167 C=C(C)c1cc(cnc1C)C 271570a_100000694244_100009817436 [0,1,0,0,0,1|2,0,0]=4 1400 B11R1.167 C=C(C)c1cc(cnc1Cl)C 271570a_100000694244_100010210167 [0,1,0,0,0,1|2,0,0]=4 1401 B11R1.167 C=C(C)c1cc(cnc1F)C 271570a_100000694244_100000049784 [0,1,0,0,0,1|2,0,0]=4 1402 B11R1.167 C=C(C)c1cc(cnc1N)C 271570a_100000694244_100000049664 [0,1,0,0,0,1|2,0,0]=4 1403 B11R1.167 C=C(C)c1cc(cnc1O)C 271570a_100000694244_100000049931 [0,1,0,0,0,1|2,0,0]=4 1404 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [0,1,0,0,0,1|2,0,0]=4 1405 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [0,1,0,0,0,1|2,0,0]=4 1406 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [0,1,0,0,0,1|2,0,0]=4 1407 B11R1.167 C=C(C)c1nc(c[nH]c1=O)C 271570a_100000694244_100009858157 [0,1,0,0,0,1|2,0,0]=4 1408 B11R1.167 C=C(C)c1nc(ccc1C)C 271570a_100000694244_100009854376 [0,1,0,0,0,1|2,0,0]=4 1409 B11R1.167 C=C(C)c1nc(ccc1F)C 271570a_100000694244_100009817602 [0,1,0,0,0,1|2,0,0]=4 1410 B11R1.167 C=C(C)c1nc(ccc1N)C 271570a_100000694244_100000685570 [0,1,0,0,0,1|2,0,0]=4 1411 B11R1.167 C=C(C)c1nc(ccc1O)C 271570a_100000694244_100000702858 [0,1,0,0,0,1|2,0,0]=4 1412 B11R1.167 C=C(C)c1nc(cnc1C)C 271570a_100000694244_100000211308 [0,1,0,0,0,1|2,0,0]=4 1413 B11R1.167 C=C(C)c1nc(cnc1N)C 271570a_100000694244_100009819049 [0,1,0,0,0,1|2,0,0]=4 1414 B11R1.167 C=C(C)c1nc(ncc1F)C 271570a_100000694244_100000059819 [0,1,0,0,0,1|2,0,0]=4 1415 B11R1.167 C=C(C)c1nc(ncc1N)C 271570a_100000694244_100009873743 [0,1,0,0,0,1|2,0,0]=4 1416 B11R1.167 CC(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200000210301 [0,1,0,0,0,1|2,0,0]=4 1417 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,1,0,0,0,1|2,0,0]=4 1418 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,1,0,0,0,1|1,0,0]=3 1419 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,1,0,0,0,1|2,0,0]=4 1420 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,1,0,0,0,1|2,0,0]=4 1421 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,1,0,0,0,1|2,0,0]=4 1422 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,1,0,0,0,1|2,0,0]=4 1423 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,1,0,0,0,1|2,0,0]=4 1424 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,1,0,0,0,1|1,0,0]=3 1425 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,1,0,0,0,1|2,0,0]=4 1426 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,1,0,0,0,1|2,0,0]=4 1427 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,1,0,0,0,1|2,0,0]=4 1428 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,1,0,0,0,1|2,0,0]=4 1429 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,1,0,0,0,1|2,0,0]=4 1430 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,1,0,0,0,1|2,0,0]=4 1431 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,1,0,0,0,1|1,0,0]=3 1432 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,1,0,0,0,1|2,0,0]=4 1433 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,1,0,0,0,1|2,0,0]=4 1434 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,1,0,0,0,1|2,0,0]=4 1435 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,1,0,0,0,1|2,0,0]=4 1436 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,1,0,0,0,1|2,0,0]=4 1437 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,1,0,0,0,1|2,0,0]=4 1438 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,1,0,0,0,1|1,0,0]=3 1439 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,1,0,0,0,1|2,0,0]=4 1440 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,1,0,0,0,1|2,0,0]=4 1441 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,1,0,0,0,1|2,0,0]=4 1442 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,1,0,0,0,1|2,0,0]=4 1443 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,1,0,0,0,1|2,0,0]=4 1444 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,1,0,0,0,1|2,0,0]=4 1445 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,1,0,0,0,1|1,0,0]=3 1446 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,1,0,0,0,1|2,0,0]=4 1447 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,1,0,0,0,1|2,0,0]=4 1448 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,1,0,0,0,1|2,0,0]=4 1449 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,1,0,0,0,1|2,0,0]=4 1450 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,1,0,0,0,1|2,0,0]=4 1451 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,1,0,0,0,1|2,0,0]=4 1452 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,1,0,0,0,1|2,0,0]=4 1453 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,1,0,0,0,1|1,0,0]=3 1454 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,1,0,0,0,1|1,0,0]=3 1455 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,1,0,0,0,1|2,0,0]=4 1456 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,1,0,0,0,1|2,0,0]=4 1457 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,1,0,0,0,1|2,0,0]=4 1458 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,1,0,0,0,1|2,0,0]=4 1459 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,1,0,0,0,1|2,0,0]=4 1460 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,1,0,0,0,1|2,0,0]=4 1461 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,1,0,0,0,1|2,0,0]=4 1462 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [0,1,0,0,0,1|2,0,0]=4 1463 B11R1.167 CC(=O)c1cc(cnc1F)O 271570a_203496583355_100010254234 [0,1,0,0,0,1|2,0,0]=4 1464 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [0,1,0,0,0,1|2,0,0]=4 1465 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [0,1,0,0,0,1|2,0,0]=4 1466 B11R1.167 CC(=O)c1cc(ncc1F)O 271570a_203496583355_100000697832 [0,1,0,0,0,1|2,0,0]=4 1467 B11R1.167 CC(=O)c1nc(ccc1F)O 271570a_203496583355_100009887703 [0,1,0,0,0,1|2,0,0]=4 1468 B11R1.167 CC(=O)c1nc(ncc1C)O 271570a_203496583355_100010687370 [0,1,0,0,0,1|2,0,0]=4 1469 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,1,0,0,0,1|2,0,0]=4 1470 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,1,0,0,0,1|1,0,0]=3 1471 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,1,0,0,0,1|1,0,0]=3 1472 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,1,0,0,0,1|1,0,0]=3 1473 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,1,0,0,0,1|1,0,0]=3 1474 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,1,0,0,0,1|1,0,0]=3 1475 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,1,0,0,0,1|1,0,0]=3 1476 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,1,0,0,0,1|2,0,0]=4 1477 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,1,0,0,0,1|2,0,0]=4 1478 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,1,0,0,0,1|2,0,0]=4 1479 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,1,0,0,0,1|2,0,0]=4 1480 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,1,0,0,0,1|2,0,0]=4 1481 B11R1.167 [13CH3]C(=O)C1=NC(=O)CC=C1Cl 1458a_100009855368_200025704644 [0,1,0,0,0,1|2,0,0]=4 1482 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,1,0,0,0,1|2,0,0]=4 1483 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,1,0,0,0,1|2,0,0]=4 1484 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,1,0,0,0,1|2,0,0]=4 1485 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,1,0,0,0,1|2,0,0]=4 1486 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,1,0,0,0,1|2,0,0]=4 1487 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,1,0,0,0,1|2,0,0]=4 1488 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,1,0,0,0,1|2,0,0]=4 1489 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,1,0,0,0,1|2,0,0]=4 1490 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,1,0,0,0,1|2,0,0]=4 1491 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,1,0,0,0,1|2,0,0]=4 1492 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,1,0,0,0,1|2,0,0]=4 1493 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,1,0,0,0,1|2,0,0]=4 1494 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,1,0,0,0,1|2,0,0]=4 1495 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,1,0,0,0,1|2,0,0]=4 1496 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,1,0,0,0,1|2,0,0]=4 1497 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,1,0,0,0,1|2,0,0]=4 1498 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,1,0,0,0,1|2,0,0]=4 1499 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,1,0,0,0,1|2,0,0]=4 1500 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,1,0,0,0,1|2,0,0]=4 1501 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,1,0,0,0,1|2,0,0]=4 1502 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,1,0,0,0,1|2,0,0]=4 1503 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,1,0,0,0,1|2,0,0]=4 1504 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,1,0,0,0,1|2,0,0]=4 1505 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,1,0,0,0,1|2,0,0]=4 1506 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,1,0,0,0,1|2,0,0]=4 1507 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [0,1,0,0,0,1|1,0,1]=4 1508 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [0,1,0,0,0,1|1,0,1]=4 1509 B11R1.266 C=C(C)c1cc(ccn1)CC 271570a_100000694244_100009817561 [0,1,0,0,0,1|2,0,0]=4 1510 B11R1.266 C=C(C)c1cc(ccn1)CO 271570a_100000694244_100009814636 [0,1,0,0,0,1|2,0,0]=4 1511 B11R1.266 C=C(C)c1cc(ccn1)NC 271570a_100000694244_100009869472 [0,1,0,0,0,1|2,0,0]=4 1512 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [0,1,0,0,0,1|2,0,0]=4 1513 B11R1.266 C=C(C)c1cc(ccn1)SC 271570a_100000694244_100010883326 [0,1,0,0,0,1|2,0,0]=4 1514 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [0,1,0,0,0,1|2,0,0]=4 1515 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [0,1,0,0,0,1|2,0,0]=4 1516 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [0,1,0,0,0,1|2,0,0]=4 1517 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [0,1,0,0,0,1|2,0,0]=4 1518 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [0,1,0,0,0,1|2,0,0]=4 1519 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [0,1,0,0,0,1|2,0,0]=4 1520 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [0,1,0,0,0,1|2,0,0]=4 1521 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [0,1,0,0,0,1|2,0,0]=4 1522 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [0,1,0,0,0,1|2,0,0]=4 1523 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [0,1,0,0,0,1|2,0,0]=4 1524 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [0,1,0,0,0,1|2,0,0]=4 1525 B11R1.266 C=C(C)c1cccc(n1)CC 271570a_100000694244_100009856026 [0,1,0,0,0,1|2,0,0]=4 1526 B11R1.266 C=C(C)c1cccc(n1)CN 271570a_100000694244_100016990191 [0,1,0,0,0,1|2,0,0]=4 1527 B11R1.266 C=C(C)c1cccc(n1)CO 271570a_100000694244_100000694195 [0,1,0,0,0,1|2,0,0]=4 1528 B11R1.266 C=C(C)c1cccc(n1)NC 271570a_100000694244_100000703281 [0,1,0,0,0,1|2,0,0]=4 1529 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [0,1,0,0,0,1|2,0,0]=4 1530 B11R1.266 C=C(C)c1cccc(n1)SC 271570a_100000694244_100011960944 [0,1,0,0,0,1|2,0,0]=4 1531 B11R1.266 C=C(C)c1ccnc(c1)CC 271570a_100000694244_100009820011 [0,1,0,0,0,1|2,0,0]=4 1532 B11R1.266 C=C(C)c1ccnc(c1)CN 271570a_100000694244_100000085674 [0,1,0,0,0,1|2,0,0]=4 1533 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [0,1,0,0,0,1|2,0,0]=4 1534 B11R1.266 C=C(C)c1ccnc(c1)NC 271570a_100000694244_100009819592 [0,1,0,0,0,1|2,0,0]=4 1535 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [0,1,0,0,0,1|2,0,0]=4 1536 B11R1.266 C=C(C)c1ccnc(n1)NC 271570a_100000694244_100012000420 [0,1,0,0,0,1|2,0,0]=4 1537 B11R1.266 C=C(C)c1ccnc(n1)OC 271570a_100000694244_100000069072 [0,1,0,0,0,1|2,0,0]=4 1538 B11R1.266 C=C(C)c1ccnc(n1)SC 271570a_100000694244_100000032126 [0,1,0,0,0,1|2,0,0]=4 1539 B11R1.266 C=C(C)c1cncc(c1)CC 271570a_100000694244_200009819073 [0,1,0,0,0,1|2,0,0]=4 1540 B11R1.266 C=C(C)c1cncc(c1)CN 271570a_100000694244_100011249555 [0,1,0,0,0,1|2,0,0]=4 1541 B11R1.266 C=C(C)c1cncc(c1)CO 271570a_100000694244_100011259137 [0,1,0,0,0,1|2,0,0]=4 1542 B11R1.266 C=C(C)c1cncc(c1)NC 271570a_100000694244_100012184536 [0,1,0,0,0,1|2,0,0]=4 1543 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [0,1,0,0,0,1|2,0,0]=4 1544 B11R1.266 C=C(C)c1cncc(c1)SC 271570a_100000694244_100009816972 [0,1,0,0,0,1|2,0,0]=4 1545 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200000210301_200009889500 [0,1,0,0,0,1|2,0,0]=4 1546 B11R1.266 C=C(C)c1cncc(c1)SC 62a_200009889500_200000210301 [0,1,0,0,0,1|2,0,0]=4 1547 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200009889500_200025704644 [0,1,0,0,0,1|2,0,0]=4 1548 B11R1.266 C=C(C)c1cncc(c1)S[13CH3] 62a_200025704644_200009889500 [0,1,0,0,0,1|2,0,0]=4 1549 B11R1.266 C=C(C)c1cncc(n1)CO 271570a_100000694244_100009853123 [0,1,0,0,0,1|2,0,0]=4 1550 B11R1.266 C=C(C)c1cncc(n1)NC 271570a_100000694244_100011529438 [0,1,0,0,0,1|2,0,0]=4 1551 B11R1.266 C=C(C)c1cncc(n1)OC 271570a_100000694244_100000756030 [0,1,0,0,0,1|2,0,0]=4 1552 B11R1.266 C=C(C)c1nccc(n1)CC 271570a_100000694244_100000100215 [0,1,0,0,0,1|2,0,0]=4 1553 B11R1.266 C=C(C)c1nccc(n1)NC 271570a_100000694244_100011649947 [0,1,0,0,0,1|2,0,0]=4 1554 B11R1.266 C=C(C)c1nccc(n1)OC 271570a_100000694244_100000182009 [0,1,0,0,0,1|2,0,0]=4 1555 B11R1.266 C=C(C)c1nccc(n1)SC 271570a_100000694244_100011650323 [0,1,0,0,0,1|2,0,0]=4 1556 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [0,1,0,0,0,1|1,0,1]=4 1557 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [0,1,0,0,0,1|1,0,1]=4 1558 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [0,1,0,0,0,1|1,0,1]=4 1559 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [0,1,0,0,0,1|1,0,1]=4 1560 B11R1.266 C=Cc1cccc(n1)C(=O)C 271570a_100011290941_100009816502 [0,1,0,0,0,1|1,0,1]=4 1561 B11R1.266 C=Cc1ccnc(c1)C(=O)C 271570a_100011290941_100000709912 [0,1,0,0,0,1|1,0,1]=4 1562 B11R1.266 C=Cc1cncc(c1)C(=O)C 271570a_100011290941_100011216243 [0,1,0,0,0,1|1,0,1]=4 1563 B11R1.266 C=Cc1nccc(n1)C(=O)C 271570a_100011290941_100010643186 [0,1,0,0,0,1|1,0,1]=4 1564 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_100000709912_200025704644 [0,1,0,0,0,1|1,0,0]=3 1565 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000709912 [0,1,0,0,0,1|1,0,0]=3 1566 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [0,1,0,0,0,1|1,0,1]=4 1567 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [0,1,0,0,0,1|1,0,0]=3 1568 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [0,1,0,0,0,1|1,0,0]=3 1569 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [0,1,0,0,0,1|1,0,0]=3 1570 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [0,1,0,0,0,1|1,0,0]=3 1571 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [0,1,0,0,0,1|1,0,0]=3 1572 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_100009816502_200025704644 [0,1,0,0,0,1|1,0,0]=3 1573 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100009816502 [0,1,0,0,0,1|1,0,0]=3 1574 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [0,1,0,0,0,1|1,0,0]=3 1575 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [0,1,0,0,0,1|1,0,0]=3 1576 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_100010643186_200025704644 [0,1,0,0,0,1|1,0,0]=3 1577 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_200025704644_100010643186 [0,1,0,0,0,1|1,0,0]=3 1578 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_100011216243_200025704644 [0,1,0,0,0,1|1,0,0]=3 1579 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100011216243 [0,1,0,0,0,1|1,0,0]=3 1580 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [0,1,0,0,0,1|1,0,0]=3 1581 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [0,1,0,0,0,1|1,0,0]=3 1582 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [0,1,0,0,0,1|2,0,0]=4 1583 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [0,1,0,0,0,1|1,0,0]=3 1584 B11R1.266 CNc1cccc(n1)C(=O)N 27a_100102657272_100011834053 [0,1,0,0,0,1|2,0,0]=4 1585 B11R1.266 CNc1ccnc(c1)C(=O)N 27a_100102657272_100000229564 [0,1,0,0,0,1|2,0,0]=4 1586 B11R1.266 CNc1cncc(n1)C(=O)N 27a_100102657272_100000764846 [0,1,0,0,0,1|2,0,0]=4 1587 B11R1.266 CNc1nccc(n1)C(=O)C 27a_100102657272_100010643186 [0,1,0,0,0,1|1,0,0]=3 1588 B11R1.266 CNc1nccc(n1)C(=O)N 27a_100102657272_100000066158 [0,1,0,0,0,1|2,0,0]=4 1589 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [0,1,0,0,0,1|1,0,0]=3 1590 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [0,1,0,0,0,1|1,0,0]=3 1591 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [0,1,0,0,0,1|1,0,0]=3 1592 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [0,1,0,0,0,1|2,0,0]=4 1593 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [0,1,0,0,0,1|2,0,0]=4 1594 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [0,1,0,0,0,1|1,0,0]=3 1595 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [0,1,0,0,0,1|2,0,0]=4 1596 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [0,1,0,0,0,1|2,0,0]=4 1597 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [0,1,0,0,0,1|2,0,0]=4 1598 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [0,1,0,0,0,1|1,0,0]=3 1599 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [0,1,0,0,0,1|1,0,0]=3 1600 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_100000229836_200000210301 [0,1,0,0,0,1|2,0,0]=4 1601 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_200000210301_100000229836 [0,1,0,0,0,1|2,0,0]=4 1602 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [0,1,0,0,0,1|1,0,0]=3 1603 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [0,1,0,0,0,1|1,0,0]=3 1604 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [0,1,0,0,0,1|1,0,0]=3 1605 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [0,1,0,0,0,1|2,0,0]=4 1606 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [0,1,0,0,0,1|2,0,0]=4 1607 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [0,1,0,0,0,1|1,0,0]=3 1608 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [0,1,0,0,0,1|2,0,0]=4 1609 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [0,1,0,0,0,1|2,0,0]=4 1610 B11R1.266 CSc1cccc(n1)C(=O)C 62a_100009816502_200000210301 [0,1,0,0,0,1|1,0,0]=3 1611 B11R1.266 CSc1cccc(n1)C(=O)C 62a_200000210301_100009816502 [0,1,0,0,0,1|1,0,0]=3 1612 B11R1.266 CSc1cccc(n1)C(=O)N 62a_100011834053_200000210301 [0,1,0,0,0,1|2,0,0]=4 1613 B11R1.266 CSc1cccc(n1)C(=O)N 62a_200000210301_100011834053 [0,1,0,0,0,1|2,0,0]=4 1614 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_100000709912_200000210301 [0,1,0,0,0,1|1,0,0]=3 1615 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_200000210301_100000709912 [0,1,0,0,0,1|1,0,0]=3 1616 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_100000229564_200000210301 [0,1,0,0,0,1|2,0,0]=4 1617 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_200000210301_100000229564 [0,1,0,0,0,1|2,0,0]=4 1618 B11R1.266 CSc1cncc(c1)C(=O)C 62a_100011216243_200000210301 [0,1,0,0,0,1|1,0,0]=3 1619 B11R1.266 CSc1cncc(c1)C(=O)C 62a_200000210301_100011216243 [0,1,0,0,0,1|1,0,0]=3 1620 B11R1.266 CSc1cncc(c1)C(=O)N 62a_100000162242_200000210301 [0,1,0,0,0,1|2,0,0]=4 1621 B11R1.266 CSc1cncc(c1)C(=O)N 62a_200000210301_100000162242 [0,1,0,0,0,1|2,0,0]=4 1622 B11R1.266 CSc1cncc(n1)C(=O)N 62a_100000764846_200000210301 [0,1,0,0,0,1|2,0,0]=4 1623 B11R1.266 CSc1cncc(n1)C(=O)N 62a_200000210301_100000764846 [0,1,0,0,0,1|2,0,0]=4 1624 B11R1.266 CSc1nccc(n1)C(=O)C 62a_100010643186_200000210301 [0,1,0,0,0,1|1,0,0]=3 1625 B11R1.266 CSc1nccc(n1)C(=O)C 62a_200000210301_100010643186 [0,1,0,0,0,1|1,0,0]=3 1626 B11R1.266 CSc1nccc(n1)C(=O)N 62a_100000066158_200000210301 [0,1,0,0,0,1|2,0,0]=4 1627 B11R1.266 CSc1nccc(n1)C(=O)N 62a_200000210301_100000066158 [0,1,0,0,0,1|2,0,0]=4 1628 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [0,1,0,0,0,1|1,0,1]=4 1629 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [0,1,0,0,0,1|1,0,0]=3 1630 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [0,1,0,0,0,1|2,0,0]=4 1631 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [0,1,0,0,0,1|2,0,0]=4 1632 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [0,1,0,0,0,1|2,0,0]=4 1633 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [0,1,0,0,0,1|2,0,0]=4 1634 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_100000229836_200025704644 [0,1,0,0,0,1|2,0,0]=4 1635 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_200025704644_100000229836 [0,1,0,0,0,1|2,0,0]=4 1636 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [0,1,0,0,0,1|2,0,0]=4 1637 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [0,1,0,0,0,1|2,0,0]=4 1638 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_100011834053_200025704644 [0,1,0,0,0,1|2,0,0]=4 1639 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_200025704644_100011834053 [0,1,0,0,0,1|2,0,0]=4 1640 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_100000229564_200025704644 [0,1,0,0,0,1|2,0,0]=4 1641 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_200025704644_100000229564 [0,1,0,0,0,1|2,0,0]=4 1642 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_100000162242_200025704644 [0,1,0,0,0,1|2,0,0]=4 1643 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_200025704644_100000162242 [0,1,0,0,0,1|2,0,0]=4 1644 B11R1.266 [13CH3]Sc1cncc(n1)C(=O)N 62a_100000764846_200025704644 [0,1,0,0,0,1|2,0,0]=4 1645 B11R1.266 [13CH3]Sc1cncc(n1)C(=O)N 62a_200025704644_100000764846 [0,1,0,0,0,1|2,0,0]=4 1646 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_100000066158_200025704644 [0,1,0,0,0,1|2,0,0]=4 1647 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_200025704644_100000066158 [0,1,0,0,0,1|2,0,0]=4 1648 B11R1.6 CNS(=O)(=O)c1ccc(s1)C 270084a_100102657272_100000229961 [0,2,0,0,0,0|1,1,0]=4 1649 B11R1.6 CNS(=O)(=O)c1ccc(s1)C 274078a_100102657272_100000229961 [0,2,0,0,0,0|1,1,0]=4 1650 B11R1.11 CCC(NC)c1ccc(o1)C 269862a_106832991636_100011218535 [0,2,0,0,0,0|1,0,1]=4 1651 B11R1.11 CC[C@H](NC)c1ccc(o1)C 2230a_100012022952_200000210301 [0,2,0,0,0,0|1,0,1]=4 1652 B11R1.11 CC[C@H](NC)c1ccc(o1)C 34a_100012022952_200000210301 [0,2,0,0,0,0|1,0,1]=4 1653 B11R1.11 CC[C@H](N[13CH3])c1ccc(o1)C 2230a_100012022952_200025704644 [0,2,0,0,0,0|1,0,1]=4 1654 B11R1.11 CC[C@H](N[13CH3])c1ccc(o1)C 34a_100012022952_200025704644 [0,2,0,0,0,0|1,0,1]=4 1655 B11R1.15 CCNC(=O)c1ccc(s1)O 271570a_203496583355_200000155171 [0,2,0,0,0,0|1,1,0]=4 1656 B11R1.15 CCNC(C)c1ccc(o1)C 269862a_100015525214_100000204583 [0,2,0,0,0,0|1,0,1]=4 1657 B11R1.15 CCOC(=O)c1ccc([nH]1)O 271570a_203496583355_200000687776 [0,2,0,0,0,0|2,0,0]=4 1658 B11R1.15 CCOC(=O)c1ccc(o1)O 271570a_203496583355_200000170220 [0,2,0,0,0,0|1,0,0]=3 1659 B11R1.15 CCOC(=O)c1ccc(s1)O 271570a_203496583355_100000172375 [0,2,0,0,0,0|1,1,0]=4 1660 B11R1.15 CCOC(=O)c1cnc(o1)O 271570a_203496583355_100010205802 [0,2,0,0,0,0|2,0,0]=4 1661 B11R1.15 CNCC(=O)c1ccc(s1)Br 2230a_106832991635_100000185163 [0,2,0,0,0,0|1,1,0]=4 1662 B11R1.15 CNCC(=O)c1ccc(s1)Br 7a_106832991635_100000185163 [0,2,0,0,0,0|1,1,0]=4 1663 B11R1.15 CNCC(=O)c1ccc(s1)C 2230a_106832991635_100011262362 [0,2,0,0,0,0|0,1,0]=3 1664 B11R1.15 CNCC(=O)c1ccc(s1)C 34a_100102657272_100011262362 [0,2,0,0,0,0|0,1,0]=3 1665 B11R1.15 CNCC(=O)c1ccc(s1)C 7a_106832991635_100011262362 [0,2,0,0,0,0|0,1,0]=3 1666 B11R1.15 CNCC(=O)c1ccc(s1)Cl 2230a_106832991635_100000185135 [0,2,0,0,0,0|1,1,0]=4 1667 B11R1.15 CNCC(=O)c1ccc(s1)Cl 7a_106832991635_100000185135 [0,2,0,0,0,0|1,1,0]=4 1668 B11R1.15 COCC(=O)c1ccc(s1)C 34a_100138415774_100011262362 [0,2,0,0,0,0|0,1,0]=3 1669 B11R1.15 CSCC(=O)c1ccc(s1)Br 62a_100000185163_200000210301 [0,2,0,0,0,0|1,1,0]=4 1670 B11R1.15 CSCC(=O)c1ccc(s1)C 62a_100011262362_200000210301 [0,2,0,0,0,0|0,1,0]=3 1671 B11R1.15 CSCC(=O)c1ccc(s1)C 62a_200000210301_100011262362 [0,2,0,0,0,0|0,1,0]=3 1672 B11R1.15 CSCC(=O)c1ccc(s1)Cl 62a_100000185135_200000210301 [0,2,0,0,0,0|1,1,0]=4 1673 B11R1.15 CSCC(=O)c1ccc(s1)Cl 62a_200000210301_100000185135 [0,2,0,0,0,0|1,1,0]=4 1674 B11R1.15 Cc1ccc(s1)C(=O)CS[13CH3] 62a_100011262362_200025704644 [0,2,0,0,0,0|0,1,0]=3 1675 B11R1.15 Cc1ccc(s1)C(=O)CS[13CH3] 62a_200025704644_100011262362 [0,2,0,0,0,0|0,1,0]=3 1676 B11R1.15 [13CH3]SCC(=O)c1ccc(s1)Br 62a_100000185163_200025704644 [0,2,0,0,0,0|1,1,0]=4 1677 B11R1.15 [13CH3]SCC(=O)c1ccc(s1)Cl 62a_100000185135_200025704644 [0,2,0,0,0,0|1,1,0]=4 1678 B11R1.15 [13CH3]SCC(=O)c1ccc(s1)Cl 62a_200025704644_100000185135 [0,2,0,0,0,0|1,1,0]=4 1679 B11R1.44 C=Cc1ccc([nH]1)C(=O)OC 271570a_100011290941_100000687774 [0,2,0,0,0,0|1,0,1]=4 1680 B11R1.44 C=Cc1ccc(o1)C(=O)NC 271570a_100011290941_100000159859 [0,2,0,0,0,0|0,0,1]=3 1681 B11R1.44 C=Cc1ccc(o1)C(=O)NN 271570a_100011290941_100000186364 [0,2,0,0,0,0|1,0,1]=4 1682 B11R1.44 C=Cc1ccc(o1)C(=O)OC 271570a_100011290941_100000148852 [0,2,0,0,0,0|0,0,1]=3 1683 B11R1.44 C=Cc1ccc(s1)C(=O)CC 271570a_100011290941_200011203577 [0,2,0,0,0,0|0,1,1]=4 1684 B11R1.44 C=Cc1ccc(s1)C(=O)NC 271570a_100011290941_200000155069 [0,2,0,0,0,0|0,1,1]=4 1685 B11R1.44 C=Cc1ccc(s1)C(=O)OC 271570a_100011290941_100000148107 [0,2,0,0,0,0|0,1,1]=4 1686 B11R1.44 CCC(=O)c1ccc(s1)SC 62a_200000210301_200011203577 [0,2,0,0,0,0|0,1,0]=3 1687 B11R1.44 CCC(=O)c1ccc(s1)SC 62a_200011203577_200000210301 [0,2,0,0,0,0|0,1,0]=3 1688 B11R1.44 CCC(=O)c1ccc(s1)S[13CH3] 62a_200011203577_200025704644 [0,2,0,0,0,0|0,1,0]=3 1689 B11R1.44 CCC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200011203577 [0,2,0,0,0,0|0,1,0]=3 1690 B11R1.44 CNC(=O)c1ccc(o1)SC 62a_200000210301_100000159859 [0,2,0,0,0,0|0,0,0]=2 1691 B11R1.44 CNC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000159859 [0,2,0,0,0,0|0,0,0]=2 1692 B11R1.44 CNC(=O)c1ccc(s1)SC 62a_200000155069_200000210301 [0,2,0,0,0,0|0,1,0]=3 1693 B11R1.44 CNC(=O)c1ccc(s1)SC 62a_200000210301_200000155069 [0,2,0,0,0,0|0,1,0]=3 1694 B11R1.44 CNC(=O)c1ccc(s1)S[13CH3] 62a_200000155069_200025704644 [0,2,0,0,0,0|0,1,0]=3 1695 B11R1.44 CNC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000155069 [0,2,0,0,0,0|0,1,0]=3 1696 B11R1.44 CNC(=O)c1csc(n1)NC 27a_100102657272_100010260535 [0,2,0,0,0,0|2,0,0]=4 1697 B11R1.44 CNC(=O)c1csc(n1)SC 62a_100010260535_200000210301 [0,2,0,0,0,0|2,0,0]=4 1698 B11R1.44 CNC(=O)c1csc(n1)SC 62a_200000210301_100010260535 [0,2,0,0,0,0|2,0,0]=4 1699 B11R1.44 CNC(=O)c1csc(n1)S[13CH3] 62a_100010260535_200025704644 [0,2,0,0,0,0|2,0,0]=4 1700 B11R1.44 CNC(=O)c1csc(n1)S[13CH3] 62a_200025704644_100010260535 [0,2,0,0,0,0|2,0,0]=4 1701 B11R1.44 CNc1nc(co1)C(=O)OC 27a_100102657272_100010235569 [0,2,0,0,0,0|2,0,0]=4 1702 B11R1.44 CNc1ncc(s1)C(=O)OC 27a_100102657272_100000738003 [0,2,0,0,0,0|1,1,0]=4 1703 B11R1.44 COC(=O)c1c[nH]c(c1)SC 62a_100009840242_200000210301 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.44 COC(=O)c1c[nH]c(c1)SC 62a_200000210301_100009840242 [0,2,0,0,0,0|2,0,0]=4 1705 B11R1.44 COC(=O)c1c[nH]c(c1)S[13CH3] 62a_100009840242_200025704644 [0,2,0,0,0,0|2,0,0]=4 1706 B11R1.44 COC(=O)c1c[nH]c(c1)S[13CH3] 62a_200025704644_100009840242 [0,2,0,0,0,0|2,0,0]=4 1707 B11R1.44 COC(=O)c1cc(c[nH]1)SC 62a_200000210301_100000205823 [0,2,0,0,0,0|2,0,0]=4 1708 B11R1.44 COC(=O)c1cc(c[nH]1)S[13CH3] 62a_200025704644_100000205823 [0,2,0,0,0,0|2,0,0]=4 1709 B11R1.44 COC(=O)c1cc(co1)SC 62a_200000210301_100009992624 [0,2,0,0,0,0|2,0,0]=4 1710 B11R1.44 COC(=O)c1cc(co1)S[13CH3] 62a_200025704644_100009992624 [0,2,0,0,0,0|2,0,0]=4 1711 B11R1.44 COC(=O)c1cc(cs1)SC 62a_100009815473_200000210301 [0,2,0,0,0,0|2,0,0]=4 1712 B11R1.44 COC(=O)c1cc(cs1)SC 62a_200000210301_100009815473 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.44 COC(=O)c1cc(cs1)S[13CH3] 62a_100009815473_200025704644 [0,2,0,0,0,0|2,0,0]=4 1714 B11R1.44 COC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100009815473 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.44 COC(=O)c1ccc([nH]1)SC 62a_200000210301_100000687774 [0,2,0,0,0,0|1,0,0]=3 1716 B11R1.44 COC(=O)c1ccc([nH]1)S[13CH3] 62a_200025704644_100000687774 [0,2,0,0,0,0|1,0,0]=3 1717 B11R1.44 COC(=O)c1ccc(o1)SC 62a_200000210301_100000148852 [0,2,0,0,0,0|0,0,0]=2 1718 B11R1.44 COC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000148852 [0,2,0,0,0,0|0,0,0]=2 1719 B11R1.44 COC(=O)c1ccc(s1)SC 62a_100000148107_200000210301 [0,2,0,0,0,0|0,1,0]=3 1720 B11R1.44 COC(=O)c1ccc(s1)SC 62a_200000210301_100000148107 [0,2,0,0,0,0|0,1,0]=3 1721 B11R1.44 COC(=O)c1ccc(s1)S[13CH3] 62a_100000148107_200025704644 [0,2,0,0,0,0|0,1,0]=3 1722 B11R1.44 COC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_100000148107 [0,2,0,0,0,0|0,1,0]=3 1723 B11R1.44 COC(=O)c1cnc([nH]1)SC 62a_106744473586_200000210301 [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.44 COC(=O)c1cnc([nH]1)SC 62a_200000210301_106744473586 [0,2,0,0,0,0|2,0,0]=4 1725 B11R1.44 COC(=O)c1cnc([nH]1)S[13CH3] 62a_106744473586_200025704644 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.44 COC(=O)c1cnc([nH]1)S[13CH3] 62a_200025704644_106744473586 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.44 COC(=O)c1cnc(s1)SC 62a_100000738003_200000210301 [0,2,0,0,0,0|1,1,0]=4 1728 B11R1.44 COC(=O)c1cnc(s1)SC 62a_200000210301_100000738003 [0,2,0,0,0,0|1,1,0]=4 1729 B11R1.44 COC(=O)c1cnc(s1)S[13CH3] 62a_100000738003_200025704644 [0,2,0,0,0,0|1,1,0]=4 1730 B11R1.44 COC(=O)c1cnc(s1)S[13CH3] 62a_200025704644_100000738003 [0,2,0,0,0,0|1,1,0]=4 1731 B11R1.44 COC(=O)c1coc(n1)SC 62a_100010235569_200000210301 [0,2,0,0,0,0|2,0,0]=4 1732 B11R1.44 COC(=O)c1coc(n1)SC 62a_200000210301_100010235569 [0,2,0,0,0,0|2,0,0]=4 1733 B11R1.44 COC(=O)c1coc(n1)S[13CH3] 62a_100010235569_200025704644 [0,2,0,0,0,0|2,0,0]=4 1734 B11R1.44 COC(=O)c1coc(n1)S[13CH3] 62a_200025704644_100010235569 [0,2,0,0,0,0|2,0,0]=4 1735 B11R1.44 COC(=O)c1csc(c1)SC 62a_100000692058_200000210301 [0,2,0,0,0,0|2,0,0]=4 1736 B11R1.44 COC(=O)c1csc(c1)SC 62a_200000210301_100000692058 [0,2,0,0,0,0|2,0,0]=4 1737 B11R1.44 COC(=O)c1csc(c1)S[13CH3] 62a_100000692058_200025704644 [0,2,0,0,0,0|2,0,0]=4 1738 B11R1.44 COC(=O)c1csc(c1)S[13CH3] 62a_200025704644_100000692058 [0,2,0,0,0,0|2,0,0]=4 1739 B11R1.44 COC(=O)c1csc(n1)SC 62a_100009816811_200000210301 [0,2,0,0,0,0|2,0,0]=4 1740 B11R1.44 COC(=O)c1csc(n1)SC 62a_200000210301_100009816811 [0,2,0,0,0,0|2,0,0]=4 1741 B11R1.44 COC(=O)c1csc(n1)S[13CH3] 62a_100009816811_200025704644 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.44 COC(=O)c1csc(n1)S[13CH3] 62a_200025704644_100009816811 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.44 COC(=O)c1nc(cs1)SC 62a_100012360158_200000210301 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.44 COC(=O)c1nc(cs1)SC 62a_200000210301_100012360158 [0,2,0,0,0,0|2,0,0]=4 1745 B11R1.44 COC(=O)c1nc(cs1)S[13CH3] 62a_100012360158_200025704644 [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.44 COC(=O)c1nc(cs1)S[13CH3] 62a_200025704644_100012360158 [0,2,0,0,0,0|2,0,0]=4 1747 B11R1.44 COC(=O)c1ncc(s1)SC 62a_100010191244_200000210301 [0,2,0,0,0,0|1,1,0]=4 1748 B11R1.44 COC(=O)c1ncc(s1)SC 62a_200000210301_100010191244 [0,2,0,0,0,0|1,1,0]=4 1749 B11R1.44 COC(=O)c1ncc(s1)S[13CH3] 62a_100010191244_200025704644 [0,2,0,0,0,0|1,1,0]=4 1750 B11R1.44 COC(=O)c1ncc(s1)S[13CH3] 62a_200025704644_100010191244 [0,2,0,0,0,0|1,1,0]=4 1751 B11R1.44 CSc1ccc(o1)C(=O)NN 62a_200000210301_100000186364 [0,2,0,0,0,0|1,0,0]=3 1752 B11R1.44 CSc1ccc(s1)C(=O)NN 62a_100000180196_200000210301 [0,2,0,0,0,0|1,1,0]=4 1753 B11R1.44 CSc1ccc(s1)C(=O)NN 62a_200000210301_100000180196 [0,2,0,0,0,0|1,1,0]=4 1754 B11R1.44 [13CH3]Sc1ccc(o1)C(=O)NN 62a_200025704644_100000186364 [0,2,0,0,0,0|1,0,0]=3 1755 B11R1.44 [13CH3]Sc1ccc(s1)C(=O)NN 62a_100000180196_200025704644 [0,2,0,0,0,0|1,1,0]=4 1756 B11R1.44 [13CH3]Sc1ccc(s1)C(=O)NN 62a_200025704644_100000180196 [0,2,0,0,0,0|1,1,0]=4 1757 B11R1.225 COC(=O)c1cc(sc1O)C 271570a_203496583355_100009817063 [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.225 COC(=O)c1nc(sc1O)C 271570a_203496583355_100000730370 [0,2,0,0,0,0|2,0,0]=4 1759 B11R1.225 COC(=O)c1nn(cc1O)C 271570a_203496583355_100010124786 [0,2,0,0,0,0|2,0,0]=4 1760 B11R1.225 COC(=O)c1oc(cc1C)O 271570a_203496583355_100000737583 [0,2,0,0,0,0|1,0,0]=3 1761 B11R1.225 COC(=O)c1sc(cc1F)O 271570a_203496583355_100010734428 [0,2,0,0,0,0|1,1,0]=4 1762 B11R1.225 COC(=O)c1sc(cc1N)O 271570a_203496583355_100010255210 [0,2,0,0,0,0|1,1,0]=4 1763 B11R1.225 COC(=O)c1sc(cc1O)C 271570a_203496583355_100009817204 [0,2,0,0,0,0|0,1,0]=3 1764 B11R1.226 COC(=O)c1cc(c(s1)O)C 271570a_203496583355_100011219469 [0,2,0,0,0,0|1,1,0]=4 1765 B11R1.226 COC(=O)c1cc(c(s1)O)N 271570a_203496583355_200010749435 [0,2,0,0,0,0|1,1,0]=4 1766 B11R1.226 COC(=O)c1cc(n(n1)C)O 271570a_203496583355_100010367948 [0,2,0,0,0,0|2,0,0]=4 1767 B11R1.865 COC(=O)c1ccc(n1C)O 271570a_203496583355_100010124797 [0,2,0,0,0,0|2,0,0]=4 1768 B11R1.865 COC(=O)c1scc(c1O)C 271570a_203496583355_100000716566 [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.48 C=C(C)c1nc(c(o1)C)C=O 271570a_100000694244_200010262729 [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.48 C=Cc1sc(cc1C)C(=O)C 271570a_100011290941_100000729792 [0,2,0,0,0,0|0,1,1]=4 1771 B11R1.48 CC(=O)c1cc(c(s1)S[13CH3])C 62a_100000729792_200025704644 [0,2,0,0,0,0|0,1,0]=3 1772 B11R1.48 CC(=O)c1cc(c(s1)S[13CH3])C 62a_200025704644_100000729792 [0,2,0,0,0,0|0,1,0]=3 1773 B11R1.48 CSc1sc(cc1C)C(=O)C 62a_100000729792_200000210301 [0,2,0,0,0,0|0,1,0]=3 1774 B11R1.48 CSc1sc(cc1C)C(=O)C 62a_200000210301_100000729792 [0,2,0,0,0,0|0,1,0]=3 1775 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_100010106820_200025704644 [0,2,0,0,0,0|1,1,0]=4 1776 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_200025704644_100010106820 [0,2,0,0,0,0|1,1,0]=4 1777 B11R1.50 CNc1nc(c(s1)C(=O)C)C 27a_100102657272_100010106820 [0,2,0,0,0,0|1,1,0]=4 1778 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_100010106820_200000210301 [0,2,0,0,0,0|1,1,0]=4 1779 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_200000210301_100010106820 [0,2,0,0,0,0|1,1,0]=4 1780 B11R1.124 C=C(C)c1ccc(o1)CNC 271570a_100000694244_100000207588 [0,2,0,0,0,0|1,0,0]=3 1781 B11R1.124 C=C(C)c1ccc(s1)CC#N 271570a_100000694244_100000740997 [0,2,0,0,0,0|1,1,0]=4 1782 B11R1.124 C=C(C)c1ccc(s1)CCC 271570a_100000694244_100010157708 [0,2,0,0,0,0|1,1,0]=4 1783 B11R1.124 C=C=Cc1ccc([nH]1)C(=O)C 271570a_100015277604_200010494458 [0,2,0,0,0,0|1,0,1]=4 1784 B11R1.124 C=C=Cc1ccc(o1)C(=O)C 271570a_100015277604_100000229899 [0,2,0,0,0,0|0,0,1]=3 1785 B11R1.124 C=C=Cc1ccc(s1)C(=O)C 271570a_100015277604_100000183331 [0,2,0,0,0,0|0,1,1]=4 1786 B11R1.124 CC(=O)c1cc(cs1)CS[13CH3] 62a_200000067479_200025704644 [0,2,0,0,0,0|2,0,0]=4 1787 B11R1.124 CC(=O)c1cc(cs1)CS[13CH3] 62a_200025704644_200000067479 [0,2,0,0,0,0|2,0,0]=4 1788 B11R1.124 CC(=O)c1cc(cs1)SCF 62a_100000718618_100015361967 [0,2,0,0,0,0|2,0,0]=4 1789 B11R1.124 CC(=O)c1cc(cs1)SCF 62a_100015361967_100000718618 [0,2,0,0,0,0|2,0,0]=4 1790 B11R1.124 CC(=O)c1ccc([nH]1)SCF 62a_200010494458_100015361967 [0,2,0,0,0,0|1,0,0]=3 1791 B11R1.124 CC(=O)c1ccc(o1)SCF 62a_100015361967_100000229899 [0,2,0,0,0,0|0,0,0]=2 1792 B11R1.124 CC(=O)c1ccc(s1)SCF 62a_100000183331_100015361967 [0,2,0,0,0,0|0,1,0]=3 1793 B11R1.124 CC(=O)c1ccc(s1)SCF 62a_100015361967_200000034408 [0,2,0,0,0,0|0,1,0]=3 1794 B11R1.124 CC(=O)c1cnc(s1)SCF 62a_100015361967_200010173910 [0,2,0,0,0,0|1,1,0]=4 1795 B11R1.124 CC(=O)c1cnc(s1)SCF 62a_200010173910_100015361967 [0,2,0,0,0,0|1,1,0]=4 1796 B11R1.124 CC(=O)c1csc(c1)SCF 62a_100015361967_200012344231 [0,2,0,0,0,0|2,0,0]=4 1797 B11R1.124 CC(=O)c1csc(c1)SCF 62a_200012344231_100015361967 [0,2,0,0,0,0|2,0,0]=4 1798 B11R1.124 CC(=O)c1nc(cs1)SCF 62a_100010231720_100015361967 [0,2,0,0,0,0|2,0,0]=4 1799 B11R1.124 CC(=O)c1nc(cs1)SCF 62a_100015361967_100010231720 [0,2,0,0,0,0|2,0,0]=4 1800 B11R1.124 CC(=O)c1ncc(s1)SCF 62a_100000693680_100015361967 [0,2,0,0,0,0|1,1,0]=4 1801 B11R1.124 CC(=O)c1ncc(s1)SCF 62a_100015361967_100000693680 [0,2,0,0,0,0|1,1,0]=4 1802 B11R1.124 CC=Cc1cc(cs1)C(=O)C 271570a_100016259895_200012344231 [0,2,0,0,0,0|2,0,0]=4 1803 B11R1.124 CC=Cc1ccc([nH]1)C(=O)C 271570a_100016259895_200010494458 [0,2,0,0,0,0|1,0,0]=3 1804 B11R1.124 CC=Cc1ccc(o1)C(=O)C 271570a_100016259895_100000229899 [0,2,0,0,0,0|0,0,0]=2 1805 B11R1.124 CC=Cc1ccc(s1)C(=O)C 271570a_100016259895_100000183331 [0,2,0,0,0,0|0,1,0]=3 1806 B11R1.124 CC=Cc1ccc(s1)C(=O)N 271570a_100016259895_100000162267 [0,2,0,0,0,0|1,1,0]=4 1807 B11R1.124 CC=Cc1cnc(s1)C(=O)C 271570a_100016259895_100000693680 [0,2,0,0,0,0|1,1,0]=4 1808 B11R1.124 CC=Cc1csc(c1)C(=O)C 271570a_100016259895_100000718618 [0,2,0,0,0,0|2,0,0]=4 1809 B11R1.124 CC=Cc1csc(n1)C(=O)C 271570a_100016259895_100010231720 [0,2,0,0,0,0|2,0,0]=4 1810 B11R1.124 CC=Cc1ncc(s1)C(=O)C 271570a_100016259895_200010173910 [0,2,0,0,0,0|1,1,0]=4 1811 B11R1.124 CCNc1ncc(s1)C(=O)C 27a_100015525214_200010173910 [0,2,0,0,0,0|1,1,0]=4 1812 B11R1.124 CCSc1cc(cs1)C(=O)C 62a_100000210202_200012344231 [0,2,0,0,0,0|2,0,0]=4 1813 B11R1.124 CCSc1cc(cs1)C(=O)C 62a_200012344231_100000210202 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.124 CCSc1ccc([nH]1)C(=O)C 62a_200010494458_100000210202 [0,2,0,0,0,0|1,0,0]=3 1815 B11R1.124 CCSc1ccc(o1)C(=O)C 62a_100000210202_100000229899 [0,2,0,0,0,0|0,0,0]=2 1816 B11R1.124 CCSc1ccc(s1)C(=O)C 62a_100000183331_100000210202 [0,2,0,0,0,0|0,1,0]=3 1817 B11R1.124 CCSc1ccc(s1)C(=O)C 62a_100000210202_200000034408 [0,2,0,0,0,0|0,1,0]=3 1818 B11R1.124 CCSc1ccc(s1)C(=O)N 62a_100000162267_100000210202 [0,2,0,0,0,0|1,1,0]=4 1819 B11R1.124 CCSc1cnc(s1)C(=O)C 62a_100000210202_100000693680 [0,2,0,0,0,0|1,1,0]=4 1820 B11R1.124 CCSc1cnc(s1)C(=O)C 62a_100000693680_100000210202 [0,2,0,0,0,0|1,1,0]=4 1821 B11R1.124 CCSc1csc(c1)C(=O)C 62a_100000210202_100000718618 [0,2,0,0,0,0|2,0,0]=4 1822 B11R1.124 CCSc1csc(c1)C(=O)C 62a_100000718618_100000210202 [0,2,0,0,0,0|2,0,0]=4 1823 B11R1.124 CCSc1csc(n1)C(=O)C 62a_100000210202_100010231720 [0,2,0,0,0,0|2,0,0]=4 1824 B11R1.124 CCSc1csc(n1)C(=O)C 62a_100010231720_100000210202 [0,2,0,0,0,0|2,0,0]=4 1825 B11R1.124 CCSc1ncc(s1)C(=O)C 62a_100000210202_200010173910 [0,2,0,0,0,0|1,1,0]=4 1826 B11R1.124 CCSc1ncc(s1)C(=O)C 62a_200010173910_100000210202 [0,2,0,0,0,0|1,1,0]=4 1827 B11R1.124 CNCc1ccc(o1)[N+](=O)[O-] 34a_100102657272_200011215689 [0,2,0,0,0,0|2,0,0]=4 1828 B11R1.124 CNCc1ccc(o1)[N+](=O)[O-] 7a_106832991635_200011215689 [0,2,0,0,0,0|2,0,0]=4 1829 B11R1.124 CNCc1csc(c1)C(=O)C 2230a_106832991635_200000067479 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.124 CNCc1csc(c1)C(=O)C 34a_100102657272_200000067479 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.124 CNCc1csc(c1)C(=O)C 7a_106832991635_200000067479 [0,2,0,0,0,0|2,0,0]=4 1832 B11R1.124 COCc1ccc(o1)[N+](=O)[O-] 34a_100138415774_200011215689 [0,2,0,0,0,0|2,0,0]=4 1833 B11R1.124 COCc1ccc(o1)[N+](=O)[O-] 7a_100000238365_200000210301 [0,2,0,0,0,0|2,0,0]=4 1834 B11R1.124 COCc1csc(c1)C(=O)C 34a_100138415774_200000067479 [0,2,0,0,0,0|2,0,0]=4 1835 B11R1.124 CSCc1csc(c1)C(=O)C 62a_200000067479_200000210301 [0,2,0,0,0,0|2,0,0]=4 1836 B11R1.124 CSCc1csc(c1)C(=O)C 62a_200000210301_200000067479 [0,2,0,0,0,0|2,0,0]=4 1837 B11R1.124 NC(=O)c1ccc(s1)SCF 62a_100000162267_100015361967 [0,2,0,0,0,0|1,1,0]=4 1838 B11R1.124 [13CH3]OCc1ccc(o1)[N+](=O)[O-] 7a_100000238365_200025704644 [0,2,0,0,0,0|2,0,0]=4 1839 B11R1.175 C=C(C)c1cc(cs1)C(=O)C 271570a_100000694244_200012344231 [0,2,0,0,0,0|2,0,0]=4 1840 B11R1.175 C=C(C)c1ccc([nH]1)C(=O)C 271570a_100000694244_200010494458 [0,2,0,0,0,0|1,0,0]=3 1841 B11R1.175 C=C(C)c1ccc(o1)C(=O)C 271570a_100000694244_100000229899 [0,2,0,0,0,0|0,0,0]=2 1842 B11R1.175 C=C(C)c1ccc(o1)C(F)F 271570a_100000694244_100010688628 [0,2,0,0,0,0|1,0,0]=3 1843 B11R1.175 C=C(C)c1ccc(s1)C(=O)C 271570a_100000694244_100000183331 [0,2,0,0,0,0|0,1,0]=3 1844 B11R1.175 C=C(C)c1ccc(s1)C(=O)N 271570a_100000694244_100000162267 [0,2,0,0,0,0|1,1,0]=4 1845 B11R1.175 C=C(C)c1ccc(s1)C(C)N 271570a_100000694244_100102723530 [0,2,0,0,0,0|1,1,0]=4 1846 B11R1.175 C=C(C)c1ccc(s1)C(F)F 271570a_100000694244_100000733805 [0,2,0,0,0,0|1,1,0]=4 1847 B11R1.175 C=C(C)c1cnc(s1)C(=O)C 271570a_100000694244_100000693680 [0,2,0,0,0,0|1,1,0]=4 1848 B11R1.175 C=C(C)c1csc(c1)C(=O)C 271570a_100000694244_100000718618 [0,2,0,0,0,0|2,0,0]=4 1849 B11R1.175 C=C(C)c1csc(n1)C(=O)C 271570a_100000694244_100010231720 [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.175 C=C(C)c1ncc(s1)C(=O)C 271570a_100000694244_200010173910 [0,2,0,0,0,0|1,1,0]=4 1851 B11R1.175 CC(=O)c1ccc(s1)C(F)F 1458a_100009925260_200000210301 [0,2,0,0,0,0|0,1,0]=3 1852 B11R1.175 CC(=O)c1ccn(n1)C(F)F 1458a_100000238454_200000210301 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.175 CC(=O)c1cnc(s1)N(C)C 27a_100102631434_200010173910 [0,2,0,0,0,0|1,1,0]=4 1854 B11R1.175 [13CH3]C(=O)c1ccc(s1)C(F)F 1458a_100009925260_200025704644 [0,2,0,0,0,0|0,1,0]=3 1855 B11R1.175 [13CH3]C(=O)c1ccn(n1)C(F)F 1458a_100000238454_200025704644 [0,2,0,0,0,0|2,0,0]=4 1856 B11R1.473 CC(=O)c1c[nH]c(c1C)S[13CH3] 62a_200010235672_200025704644 [0,2,0,0,0,0|2,0,0]=4 1857 B11R1.473 CC(=O)c1c[nH]c(c1C)S[13CH3] 62a_200025704644_200010235672 [0,2,0,0,0,0|2,0,0]=4 1858 B11R1.473 CSc1[nH]cc(c1C)C(=O)C 62a_200000210301_200010235672 [0,2,0,0,0,0|2,0,0]=4 1859 B11R1.473 CSc1[nH]cc(c1C)C(=O)C 62a_200010235672_200000210301 [0,2,0,0,0,0|2,0,0]=4 1860 B9R1.6 CC(=O)C1=CCCCO1 1458a_100000764163_200000210301 [0,0,1,1,0,0|0,0,2]=4 1861 B9R1.6 CC(=O)C1=COCCO1 1458a_100000008702_200000210301 [0,0,1,1,0,0|1,0,1]=4 1862 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [0,0,1,1,0,0|1,0,1]=4 1863 B9R1.6 [13CH3]C(=O)C1=CCCCO1 1458a_100000764163_200025704644 [0,0,1,1,0,0|0,0,2]=4 1864 B9R1.6 [13CH3]C(=O)C1=COCCO1 1458a_100000008702_200025704644 [0,0,1,1,0,0|1,0,1]=4 1865 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [0,0,1,1,0,0|1,0,1]=4 1866 B9R1.69 Cc1cc(c(cn1)O)C 271570a_203496583355_100009819613 [0,0,1,1,0,0|2,0,0]=4 1867 B9R1.69 Cc1cc(ccc1O)Br 271570a_203496583355_100000701812 [0,0,1,1,0,0|2,0,0]=4 1868 B9R1.69 Cc1cc(ccc1O)Cl 271570a_203496583355_100011219607 [0,0,1,1,0,0|2,0,0]=4 1869 B9R1.69 Cc1cc(ccc1O)F 271570a_203496583355_100011205405 [0,0,1,1,0,0|2,0,0]=4 1870 B9R1.69 Cc1cc(ccc1O)N 271570a_203496583355_100000210723 [0,0,1,1,0,0|2,0,0]=4 1871 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000186361 [0,0,1,1,0,0|2,0,0]=4 1872 B9R1.69 Cc1cc(ccc1O)O 271570a_203496583355_100000729255 [0,0,1,1,0,0|2,0,0]=4 1873 B9R1.69 Cc1ccc(c(c1)Br)O 271570a_203496583355_100009813563 [0,0,1,1,0,0|1,0,1]=4 1874 B9R1.69 Cc1ccc(c(c1)C)O 271570a_203496583355_100011217332 [0,0,1,1,0,0|1,0,0]=3 1875 B9R1.69 Cc1ccc(c(c1)Cl)O 271570a_203496583355_100011263221 [0,0,1,1,0,0|1,0,1]=4 1876 B9R1.69 Cc1ccc(c(c1)F)O 271570a_203496583355_100011216119 [0,0,1,1,0,0|1,0,1]=4 1877 B9R1.69 Cc1ccc(c(c1)N)O 271570a_203496583355_100011216686 [0,0,1,1,0,0|1,0,1]=4 1878 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100000765521 [0,0,1,1,0,0|0,0,2]=4 1879 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100012002257 [0,0,1,1,0,0|0,0,2]=4 1880 B9R1.69 Cc1ccc(c(n1)C)O 271570a_203496583355_100009813853 [0,0,1,1,0,0|1,0,0]=3 1881 B9R1.69 Cc1ccc(c(n1)F)O 271570a_203496583355_100010006597 [0,0,1,1,0,0|2,0,0]=4 1882 B9R1.69 Cc1ccc(c(n1)N)O 271570a_203496583355_100009816662 [0,0,1,1,0,0|2,0,0]=4 1883 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100000702858 [0,0,1,1,0,0|1,0,1]=4 1884 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100009817604 [0,0,1,1,0,0|1,0,1]=4 1885 B9R1.69 Cc1cnc(c(c1)C)O 271570a_203496583355_100009864548 [0,0,1,1,0,0|2,0,0]=4 1886 B9R1.69 Cc1cnc(c(n1)C)O 271570a_203496583355_100000065684 [0,0,1,1,0,0|2,0,0]=4 1887 B9R1.69 Cc1nc(ccc1O)Cl 271570a_203496583355_100000062408 [0,0,1,1,0,0|2,0,0]=4 1888 B9R1.69 Cc1nc(ccc1O)F 271570a_203496583355_100000688911 [0,0,1,1,0,0|2,0,0]=4 1889 B9R1.69 Cc1nc(ccc1O)N 271570a_203496583355_100000013003 [0,0,1,1,0,0|2,0,0]=4 1890 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100000691680 [0,0,1,1,0,0|2,0,0]=4 1891 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100010233687 [0,0,1,1,0,0|2,0,0]=4 1892 B9R1.69 Cc1ncc(c(=O)[nH]1)O 271570a_203496583355_100011999157 [0,0,1,1,0,0|2,0,0]=4 1893 B9R1.33 CC=Cc1ccsc1C 271570a_100016259895_100000684487 [0,0,1,1,0,0|1,1,0]=4 1894 B9R2.2 c1coc(c1)C2CC2 271570a_100011220607_100009814098 [1,0,0,1,0,0|1,0,1]=4 1895 B11R2.21 NCc1ccc(o1)C2CC2 271570a_100011220607_100000708654 [0,1,0,1,0,0|1,0,1]=4 1896 B11R2.21 OCc1ccc(o1)C2CC2 271570a_100011220607_100000246276 [0,1,0,1,0,0|1,0,1]=4 1897 B9R0.55 CC(=O)NN=CC=C(C)C 4a_100000189765_100011215525 [0,0,1,0,0,1|2,0,0]=4 1898 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [1,0,0,0,0,1|1,0,1]=4 1899 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [1,0,0,0,0,1|1,0,1]=4 1900 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [1,0,0,0,0,1|1,0,1]=4 1901 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [1,0,0,0,0,1|1,0,1]=4 1902 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [1,0,0,0,0,1|1,0,1]=4 1903 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [1,0,0,0,0,1|1,0,1]=4 1904 B9R1.2 C=Cc1cncc(n1)C 271570a_100011290941_100009842155 [1,0,0,0,0,1|1,0,1]=4 1905 B9R1.2 C=Cc1nccc(n1)C 271570a_100011290941_100011243806 [1,0,0,0,0,1|1,0,1]=4 1906 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [1,0,0,0,0,1|2,0,0]=4 1907 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [1,0,0,0,0,1|2,0,0]=4 1908 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [1,0,0,0,0,1|2,0,0]=4 1909 B9R1.2 CNc1ccnc(n1)C 27a_100102657272_100000749937 [1,0,0,0,0,1|2,0,0]=4 1910 B9R1.2 CNc1cncc(n1)C 27a_100102657272_100000754123 [1,0,0,0,0,1|2,0,0]=4 1911 B9R1.2 CNc1nccc(n1)C 27a_100102657272_100000750684 [1,0,0,0,0,1|2,0,0]=4 1912 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [1,0,0,0,0,1|2,0,0]=4 1913 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [1,0,0,0,0,1|2,0,0]=4 1914 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [1,0,0,0,0,1|2,0,0]=4 1915 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [1,0,0,0,0,1|2,0,0]=4 1916 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [1,0,0,0,0,1|2,0,0]=4 1917 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [1,0,0,0,0,1|2,0,0]=4 1918 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [1,0,0,0,0,1|2,0,0]=4 1919 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [1,0,0,0,0,1|2,0,0]=4 1920 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [1,0,0,0,0,1|2,0,0]=4 1921 B9R1.2 CSc1cccc(n1)C 62a_100000742759_200000210301 [1,0,0,0,0,1|2,0,0]=4 1922 B9R1.2 CSc1cccc(n1)C 62a_200000210301_100000742759 [1,0,0,0,0,1|2,0,0]=4 1923 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [1,0,0,0,0,1|2,0,0]=4 1924 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [1,0,0,0,0,1|2,0,0]=4 1925 B9R1.2 CSc1ccnc(n1)C 62a_100000749937_200000210301 [1,0,0,0,0,1|2,0,0]=4 1926 B9R1.2 CSc1ccnc(n1)C 62a_200000210301_100000749937 [1,0,0,0,0,1|2,0,0]=4 1927 B9R1.2 CSc1cncc(c1)C 62a_100000760492_200000210301 [1,0,0,0,0,1|2,0,0]=4 1928 B9R1.2 CSc1cncc(c1)C 62a_200000210301_100000760492 [1,0,0,0,0,1|2,0,0]=4 1929 B9R1.2 CSc1cncc(n1)C 62a_100000754123_200000210301 [1,0,0,0,0,1|2,0,0]=4 1930 B9R1.2 CSc1cncc(n1)C 62a_200000210301_100000754123 [1,0,0,0,0,1|2,0,0]=4 1931 B9R1.2 CSc1nccc(n1)C 62a_100011243806_200000210301 [1,0,0,0,0,1|2,0,0]=4 1932 B9R1.2 CSc1nccc(n1)C 62a_200000210301_100011243806 [1,0,0,0,0,1|2,0,0]=4 1933 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [1,0,0,0,0,1|2,0,0]=4 1934 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [1,0,0,0,0,1|2,0,0]=4 1935 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [1,0,0,0,0,1|2,0,0]=4 1936 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [1,0,0,0,0,1|2,0,0]=4 1937 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [1,0,0,0,0,1|2,0,0]=4 1938 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [1,0,0,0,0,1|2,0,0]=4 1939 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [1,0,0,0,0,1|2,0,0]=4 1940 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [1,0,0,0,0,1|2,0,0]=4 1941 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [1,0,0,0,0,1|2,0,0]=4 1942 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_100000742759_200025704644 [1,0,0,0,0,1|2,0,0]=4 1943 B9R1.2 Cc1cccc(n1)S[13CH3] 62a_200025704644_100000742759 [1,0,0,0,0,1|2,0,0]=4 1944 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [1,0,0,0,0,1|2,0,0]=4 1945 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [1,0,0,0,0,1|2,0,0]=4 1946 B9R1.2 Cc1ccnc(n1)S[13CH3] 62a_100011243806_200025704644 [1,0,0,0,0,1|2,0,0]=4 1947 B9R1.2 Cc1ccnc(n1)S[13CH3] 62a_200025704644_100011243806 [1,0,0,0,0,1|2,0,0]=4 1948 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [1,0,0,0,0,1|2,0,0]=4 1949 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [1,0,0,0,0,1|2,0,0]=4 1950 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_100000760492_200025704644 [1,0,0,0,0,1|2,0,0]=4 1951 B9R1.2 Cc1cncc(c1)S[13CH3] 62a_200025704644_100000760492 [1,0,0,0,0,1|2,0,0]=4 1952 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_100000754123_200025704644 [1,0,0,0,0,1|2,0,0]=4 1953 B9R1.2 Cc1cncc(n1)S[13CH3] 62a_200025704644_100000754123 [1,0,0,0,0,1|2,0,0]=4 1954 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_100000749937_200025704644 [1,0,0,0,0,1|2,0,0]=4 1955 B9R1.2 Cc1nccc(n1)S[13CH3] 62a_200025704644_100000749937 [1,0,0,0,0,1|2,0,0]=4 1956 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [1,0,0,0,0,1|2,0,0]=4 1957 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [1,0,0,0,0,1|2,0,0]=4 1958 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [1,0,0,0,0,1|2,0,0]=4 1959 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [1,0,0,0,0,1|2,0,0]=4 1960 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [1,0,0,0,0,1|2,0,0]=4 1961 B9R1.13 CC(=Cc1ccco1)C 271570a_100102525489_100009814098 [1,0,0,0,0,1|1,0,0]=3 1962 B9R1.13 CC(=Cc1cccs1)C 271570a_100102525489_100011215356 [1,0,0,0,0,1|1,1,0]=4 1963 B9R1.13 CC(=Cc1cnco1)C 271570a_100102525489_100020591547 [1,0,0,0,0,1|2,0,0]=4 1964 B9R1.13 CC(=Cc1ncco1)C 271570a_100102525489_100011787736 [1,0,0,0,0,1|2,0,0]=4 1965 B9R1.13 CC(=O)Cc1c[nH]cn1 1458a_100000070787_100000707719 [1,0,0,0,0,1|2,0,0]=4 1966 B9R1.13 CC(=O)Cc1c[nH]cn1 1458a_100015291406_200000210301 [1,0,0,0,0,1|2,0,0]=4 1967 B9R1.13 CC(=O)Cc1ccc[nH]1 1458a_100000238377_200000210301 [1,0,0,0,0,1|1,0,0]=3 1968 B9R1.13 CC(=O)Cc1ccco1 1458a_100011217309_200000210301 [1,0,0,0,0,1|0,0,0]=2 1969 B9R1.13 CC(=O)Cc1cccs1 1458a_100000210189_200000210301 [1,0,0,0,0,1|0,1,0]=3 1970 B9R1.13 CC(=O)Cc1ccn[nH]1 1458a_100000070787_100000728653 [1,0,0,0,0,1|2,0,0]=4 1971 B9R1.13 CC(=O)Cc1ccn[nH]1 1458a_100000752941_200000210301 [1,0,0,0,0,1|2,0,0]=4 1972 B9R1.13 CC(=O)Cc1ccoc1 1458a_100000684892_200000210301 [1,0,0,0,0,1|2,0,0]=4 1973 B9R1.13 CC(=O)Cc1ccon1 1458a_100000070787_100000234950 [1,0,0,0,0,1|2,0,0]=4 1974 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000070787_100011233845 [1,0,0,0,0,1|2,0,0]=4 1975 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000184062_200000210301 [1,0,0,0,0,1|2,0,0]=4 1976 B9R1.13 CC(=O)Cc1cncs1 1458a_100000070787_100015185245 [1,0,0,0,0,1|1,1,0]=4 1977 B9R1.13 CC(=O)Cc1cscn1 1458a_100000070787_100000205941 [1,0,0,0,0,1|2,0,0]=4 1978 B9R1.13 CC(=O)Cc1cscn1 1458a_100011438297_200000210301 [1,0,0,0,0,1|2,0,0]=4 1979 B9R1.13 CC(=O)Cc1ncco1 1458a_100000070787_103436540062 [1,0,0,0,0,1|1,0,0]=3 1980 B9R1.13 CC(=O)Cc1nccs1 1458a_100000070787_100015184050 [1,0,0,0,0,1|1,1,0]=4 1981 B9R1.13 CC(=O)Cn1cccc1 1458a_100011196272_200000210301 [1,0,0,0,0,1|2,0,0]=4 1982 B9R1.13 CC(=O)Cn1cccn1 1458a_100000233772_200000210301 [1,0,0,0,0,1|2,0,0]=4 1983 B9R1.13 CC(C)Sc1ccco1 62a_100000210206_100009814098 [1,0,0,0,0,1|1,0,1]=4 1984 B9R1.13 CC(C)Sc1ccco1 62a_100009814098_100000210206 [1,0,0,0,0,1|1,0,1]=4 1985 B9R1.13 CN(C)Cc1ccco1 2230a_100000185268_200000210301 [1,0,0,0,0,1|2,0,0]=4 1986 B9R1.13 CN(C)Cc1ccco1 269982a_100000185268_200000210301 [1,0,0,0,0,1|2,0,0]=4 1987 B9R1.13 CN(C)Cc1ccco1 270004a_100102631434_100000186105 [1,0,0,0,0,1|2,0,0]=4 1988 B9R1.13 CN([13CH3])Cc1ccco1 2230a_100000185268_200025704644 [1,0,0,0,0,1|2,0,0]=4 1989 B9R1.13 CN([13CH3])Cc1ccco1 269982a_100000185268_200025704644 [1,0,0,0,0,1|2,0,0]=4 1990 B9R1.13 [13CH3]C(=O)Cc1c[nH]cn1 1458a_100015291406_200025704644 [1,0,0,0,0,1|2,0,0]=4 1991 B9R1.13 [13CH3]C(=O)Cc1ccc[nH]1 1458a_100000238377_200025704644 [1,0,0,0,0,1|1,0,0]=3 1992 B9R1.13 [13CH3]C(=O)Cc1ccco1 1458a_100011217309_200025704644 [1,0,0,0,0,1|0,0,0]=2 1993 B9R1.13 [13CH3]C(=O)Cc1cccs1 1458a_100000210189_200025704644 [1,0,0,0,0,1|0,1,0]=3 1994 B9R1.13 [13CH3]C(=O)Cc1ccn[nH]1 1458a_100000752941_200025704644 [1,0,0,0,0,1|2,0,0]=4 1995 B9R1.13 [13CH3]C(=O)Cc1ccoc1 1458a_100000684892_200025704644 [1,0,0,0,0,1|2,0,0]=4 1996 B9R1.13 [13CH3]C(=O)Cc1ccsc1 1458a_100000184062_200025704644 [1,0,0,0,0,1|2,0,0]=4 1997 B9R1.13 [13CH3]C(=O)Cc1cscn1 1458a_100011438297_200025704644 [1,0,0,0,0,1|2,0,0]=4 1998 B9R1.13 [13CH3]C(=O)Cn1cccc1 1458a_100011196272_200025704644 [1,0,0,0,0,1|2,0,0]=4 1999 B9R1.13 [13CH3]C(=O)Cn1cccn1 1458a_100000233772_200025704644 [1,0,0,0,0,1|2,0,0]=4 2000 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,0,0,0,0,2|2,0,0]=4 2001 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,0,0,0,0,2|2,0,0]=4 2002 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [0,0,0,0,0,2|2,0,0]=4 2003 B11R1.20 CC(=Cc1ccc(nn1)C)C 271570a_100102525489_100011450037 [0,0,0,0,0,2|2,0,0]=4 2004 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,0,0,0,0,2|2,0,0]=4 2005 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,0,0,0,0,2|2,0,0]=4 2006 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,0,0,0,0,2|1,0,0]=3 2007 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,0,0,0,0,2|1,0,0]=3 2008 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,0,0,0,0,2|2,0,0]=4 2009 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,0,0,0,0,2|2,0,0]=4 2010 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,0,0,0,0,2|2,0,0]=4 2011 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,0,0,0,0,2|2,0,0]=4 2012 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,0,0,0,0,2|2,0,0]=4 2013 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,0,0,0,0,2|2,0,0]=4 2014 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,0,0,0,0,2|2,0,0]=4 2015 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,0,0,0,0,2|2,0,0]=4 2016 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100000070787_100000702658 [0,0,0,0,0,2|2,0,0]=4 2017 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000210301 [0,0,0,0,0,2|2,0,0]=4 2018 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [0,0,0,0,0,2|1,0,0]=3 2019 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [0,0,0,0,0,2|1,0,0]=3 2020 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000070787_100012066911 [0,0,0,0,0,2|2,0,0]=4 2021 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000210301 [0,0,0,0,0,2|2,0,0]=4 2022 B11R1.20 CC(=O)Cc1ccc(cn1)F 1458a_100000070787_100000703193 [0,0,0,0,0,2|2,0,0]=4 2023 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100000070787_100009831999 [0,0,0,0,0,2|2,0,0]=4 2024 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000210301 [0,0,0,0,0,2|2,0,0]=4 2025 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000070787_100016987292 [0,0,0,0,0,2|1,0,0]=3 2026 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000740413_200000210301 [0,0,0,0,0,2|1,0,0]=3 2027 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000210301 [0,0,0,0,0,2|2,0,0]=4 2028 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000070787_100000735431 [0,0,0,0,0,2|2,0,0]=4 2029 B11R1.20 CC(=O)Cc1ccc(nc1)F 1458a_100000070787_100009820150 [0,0,0,0,0,2|2,0,0]=4 2030 B11R1.20 CC(=O)Cc1ccc(nn1)Cl 1458a_100000070787_100016992710 [0,0,0,0,0,2|2,0,0]=4 2031 B11R1.20 CC(=O)Cc1cnc(cn1)C 1458a_100000070787_100000752025 [0,0,0,0,0,2|2,0,0]=4 2032 B11R1.20 CC(=O)Cc1ncc(cn1)C 1458a_100000070787_100000685645 [0,0,0,0,0,2|2,0,0]=4 2033 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,0,0,0,0,2|2,0,0]=4 2034 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,0,0,0,0,2|2,0,0]=4 2035 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,0,0,0,0,2|2,0,0]=4 2036 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,0,0,0,0,2|2,0,0]=4 2037 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,0,0,0,0,2|1,0,0]=3 2038 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,0,0,0,0,2|1,0,0]=3 2039 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,0,0,0,0,2|1,0,0]=3 2040 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,0,0,0,0,2|1,0,0]=3 2041 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,0,0,0,0,2|2,0,0]=4 2042 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,0,0,0,0,2|2,0,0]=4 2043 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,0,0,0,0,2|2,0,0]=4 2044 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,0,0,0,0,2|2,0,0]=4 2045 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,0,0,0,0,2|2,0,0]=4 2046 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,0,0,0,0,2|2,0,0]=4 2047 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,0,0,0,0,2|2,0,0]=4 2048 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,0,0,0,0,2|2,0,0]=4 2049 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,0,0,0,0,2|2,0,0]=4 2050 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,0,0,0,0,2|2,0,0]=4 2051 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,0,0,0,0,2|2,0,0]=4 2052 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,0,0,0,0,2|2,0,0]=4 2053 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,0,0,0,0,2|2,0,0]=4 2054 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,0,0,0,0,2|2,0,0]=4 2055 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [0,0,0,0,0,2|2,0,0]=4 2056 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [0,0,0,0,0,2|2,0,0]=4 2057 B11R1.20 CC(=O)Nc1ccc(nn1)O 271570a_203496583355_100011804224 [0,0,0,0,0,2|2,0,0]=4 2058 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,0,0,0,0,2|2,0,0]=4 2059 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,0,0,0,0,2|2,0,0]=4 2060 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,0,0,0,0,2|1,0,0]=3 2061 B11R1.20 Cc1ccc(cn1)CC(=O)[13CH3] 1458a_100000740413_200025704644 [0,0,0,0,0,2|1,0,0]=3 2062 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [0,0,0,0,0,2|1,0,0]=3 2063 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,0,0,0,0,2|2,0,0]=4 2064 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,0,0,0,0,2|2,0,0]=4 2065 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,0,0,0,0,2|2,0,0]=4 2066 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,0,0,0,0,2|2,0,0]=4 2067 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,0,0,0,0,2|2,0,0]=4 2068 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200025704644 [0,0,0,0,0,2|2,0,0]=4 2069 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200025704644 [0,0,0,0,0,2|2,0,0]=4 2070 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200025704644 [0,0,0,0,0,2|2,0,0]=4 2071 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200025704644 [0,0,0,0,0,2|2,0,0]=4 2072 B11R1.75 C=C(C)CSc1ccc(s1)C 62a_100000031368_100000211660 [0,0,0,0,0,2|1,1,0]=4 2073 B11R1.75 C=C(C)CSc1ccc(s1)C 62a_100000748629_100000031368 [0,0,0,0,0,2|1,1,0]=4 2074 B11R1.75 CC(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200000210301 [0,0,0,0,0,2|1,0,0]=3 2075 B11R1.75 CC(=O)C=Cc1ccc(o1)C 1458a_100000183563_200000210301 [0,0,0,0,0,2|0,0,0]=2 2076 B11R1.75 CC(=O)C=Cc1ccc(o1)I 1458a_100000679848_200000210301 [0,0,0,0,0,2|1,0,0]=3 2077 B11R1.75 CC(=O)C=Cc1ccc(s1)Br 1458a_100102558031_200000210301 [0,0,0,0,0,2|1,1,0]=4 2078 B11R1.75 CC(=O)C=Cc1ccc(s1)C 1458a_100102558089_200000210301 [0,0,0,0,0,2|0,1,0]=3 2079 B11R1.75 CC(=O)C=Cc1ccc(s1)Cl 1458a_100102558157_200000210301 [0,0,0,0,0,2|1,1,0]=4 2080 B11R1.75 CC(=O)CCc1csc(n1)C 1458a_100000070787_100000695623 [0,0,0,0,0,2|2,0,0]=4 2081 B11R1.75 CC(=O)CCn1ccc(n1)C 1458a_100000070787_200011934056 [0,0,0,0,0,2|2,0,0]=4 2082 B11R1.75 CC(=O)CCn1ccc(n1)C 1458a_100000759146_200000210301 [0,0,0,0,0,2|2,0,0]=4 2083 B11R1.75 CC(=O)CSc1nnc(o1)C 1458a_200000179512_200000210301 [0,0,0,0,0,2|2,0,0]=4 2084 B11R1.75 CC(=O)NCc1cc(cs1)C 11a_100015204214_100015343762 [0,0,0,0,0,2|2,0,0]=4 2085 B11R1.75 CC(=O)NCc1cc(cs1)C 1626a_100015204214_100015343762 [0,0,0,0,0,2|2,0,0]=4 2086 B11R1.75 CC(=O)NCc1cc(cs1)C 240690a_100015204214_100015343762 [0,0,0,0,0,2|2,0,0]=4 2087 B11R1.75 CC(=O)NCc1cc(cs1)C 527a_100015204214_100103153847 [0,0,0,0,0,2|2,0,0]=4 2088 B11R1.75 CC(=O)NCc1ccc(o1)Br 11a_100000708654_100015343762 [0,0,0,0,0,2|1,0,0]=3 2089 B11R1.75 CC(=O)NCc1ccc(o1)Br 1626a_100000708654_100015343762 [0,0,0,0,0,2|1,0,0]=3 2090 B11R1.75 CC(=O)NCc1ccc(o1)Br 240690a_100000708654_100015343762 [0,0,0,0,0,2|1,0,0]=3 2091 B11R1.75 CC(=O)NCc1ccc(o1)Br 527a_100000708654_100103153847 [0,0,0,0,0,2|1,0,0]=3 2092 B11R1.75 CC(=O)NCc1ccc(o1)C 11a_100011194323_100015343762 [0,0,0,0,0,2|0,0,0]=2 2093 B11R1.75 CC(=O)NCc1ccc(o1)C 1626a_100011194323_100015343762 [0,0,0,0,0,2|0,0,0]=2 2094 B11R1.75 CC(=O)NCc1ccc(o1)C 240690a_100011194323_100015343762 [0,0,0,0,0,2|0,0,0]=2 2095 B11R1.75 CC(=O)NCc1ccc(o1)C 527a_100011194323_100103153847 [0,0,0,0,0,2|0,0,0]=2 2096 B11R1.75 CC(=O)NCc1ccc(s1)Br 11a_100000737305_100015343762 [0,0,0,0,0,2|1,1,0]=4 2097 B11R1.75 CC(=O)NCc1ccc(s1)Br 1626a_100000737305_100015343762 [0,0,0,0,0,2|1,1,0]=4 2098 B11R1.75 CC(=O)NCc1ccc(s1)Br 240690a_100000737305_100015343762 [0,0,0,0,0,2|1,1,0]=4 2099 B11R1.75 CC(=O)NCc1ccc(s1)Br 527a_100000737305_100103153847 [0,0,0,0,0,2|1,1,0]=4 2100 B11R1.75 CC(=O)NCc1ccc(s1)C 11a_100000238518_100015343762 [0,0,0,0,0,2|0,1,0]=3 2101 B11R1.75 CC(=O)NCc1ccc(s1)C 1626a_100000238518_100015343762 [0,0,0,0,0,2|0,1,0]=3 2102 B11R1.75 CC(=O)NCc1ccc(s1)C 240690a_100000238518_100015343762 [0,0,0,0,0,2|0,1,0]=3 2103 B11R1.75 CC(=O)NCc1ccc(s1)C 527a_100000238518_100103153847 [0,0,0,0,0,2|0,1,0]=3 2104 B11R1.75 CC(=O)NCc1ccc(s1)Cl 11a_100000737310_100015343762 [0,0,0,0,0,2|1,1,0]=4 2105 B11R1.75 CC(=O)NCc1ccc(s1)Cl 1626a_100000737310_100015343762 [0,0,0,0,0,2|1,1,0]=4 2106 B11R1.75 CC(=O)NCc1ccc(s1)Cl 240690a_100000737310_100015343762 [0,0,0,0,0,2|1,1,0]=4 2107 B11R1.75 CC(=O)NCc1ccc(s1)Cl 527a_100000737310_100103153847 [0,0,0,0,0,2|1,1,0]=4 2108 B11R1.75 CC(=O)NCc1ccn(n1)C 11a_100020636201_100015343762 [0,0,0,0,0,2|2,0,0]=4 2109 B11R1.75 CC(=O)NCc1ccn(n1)C 240690a_100020636201_100015343762 [0,0,0,0,0,2|2,0,0]=4 2110 B11R1.75 CC(=O)NCc1ccn(n1)C 527a_100020636201_100103153847 [0,0,0,0,0,2|2,0,0]=4 2111 B11R1.75 CC(=O)NCc1cnc(s1)C 11a_200000743601_100015343762 [0,0,0,0,0,2|1,1,0]=4 2112 B11R1.75 CC(=O)NCc1cnc(s1)C 1626a_200000743601_100015343762 [0,0,0,0,0,2|1,1,0]=4 2113 B11R1.75 CC(=O)NCc1cnc(s1)C 240690a_200000743601_100015343762 [0,0,0,0,0,2|1,1,0]=4 2114 B11R1.75 CC(=O)NCc1cnc(s1)C 527a_200000743601_100103153847 [0,0,0,0,0,2|1,1,0]=4 2115 B11R1.75 CC(=O)NCc1csc(n1)C 11a_100000707933_100015343762 [0,0,0,0,0,2|2,0,0]=4 2116 B11R1.75 CC(=O)NCc1csc(n1)C 1626a_100000707933_100015343762 [0,0,0,0,0,2|2,0,0]=4 2117 B11R1.75 CC(=O)NCc1csc(n1)C 240690a_100000707933_100015343762 [0,0,0,0,0,2|2,0,0]=4 2118 B11R1.75 CC(=O)NCc1csc(n1)C 527a_100000707933_100103153847 [0,0,0,0,0,2|2,0,0]=4 2119 B11R1.75 CC(=O)NCc1nc(cs1)C 11a_100015183719_100015343762 [0,0,0,0,0,2|2,0,0]=4 2120 B11R1.75 CC(=O)NCc1nc(cs1)C 1626a_100015183719_100015343762 [0,0,0,0,0,2|2,0,0]=4 2121 B11R1.75 CC(=O)NCc1nc(cs1)C 240690a_100015183719_100015343762 [0,0,0,0,0,2|2,0,0]=4 2122 B11R1.75 CC(=O)NCc1nc(cs1)C 527a_100015183719_100103153847 [0,0,0,0,0,2|2,0,0]=4 2123 B11R1.75 CC(=O)NCc1ncc(o1)C 11a_100138411809_100015343762 [0,0,0,0,0,2|1,0,0]=3 2124 B11R1.75 CC(=O)NCc1ncc(o1)C 1626a_100138411809_100015343762 [0,0,0,0,0,2|1,0,0]=3 2125 B11R1.75 CC(=O)NCc1ncc(o1)C 240690a_100138411809_100015343762 [0,0,0,0,0,2|1,0,0]=3 2126 B11R1.75 CC(=O)NCc1ncc(o1)C 527a_100138411809_100103153847 [0,0,0,0,0,2|1,0,0]=3 2127 B11R1.75 CC(=O)NCc1nnc(o1)C 11a_200000236979_100015343762 [0,0,0,0,0,2|2,0,0]=4 2128 B11R1.75 CC(=O)NCc1nnc(o1)C 240690a_200000236979_100015343762 [0,0,0,0,0,2|2,0,0]=4 2129 B11R1.75 CC(=O)NCc1nnc(o1)C 527a_200000236979_100103153847 [0,0,0,0,0,2|2,0,0]=4 2130 B11R1.75 CC(=O)NNc1nc(cs1)C 22a_100000692962_100000070787 [0,0,0,0,0,2|2,0,0]=4 2131 B11R1.75 Cc1ccc(o1)C=CC(=O)[13CH3] 1458a_100000183563_200025704644 [0,0,0,0,0,2|0,0,0]=2 2132 B11R1.75 Cc1ccc(o1)CNC(C)C 207a_100138425928_100000183696 [0,0,0,0,0,2|1,0,1]=4 2133 B11R1.75 Cc1ccc(o1)CNC(C)C 34a_100011194323_100000210206 [0,0,0,0,0,2|1,0,1]=4 2134 B11R1.75 Cc1ccc(o1)COC(C)C 34a_100011232665_100000210206 [0,0,0,0,0,2|1,0,1]=4 2135 B11R1.75 Cc1ccc(o1)COC(C)C 7a_100011232665_100000210206 [0,0,0,0,0,2|1,0,1]=4 2136 B11R1.75 Cc1ccc(s1)C=CC(=O)[13CH3] 1458a_100102558089_200025704644 [0,0,0,0,0,2|0,1,0]=3 2137 B11R1.75 Cc1ccc(s1)SCC(=O)N 62a_100000031368_100000747473 [0,0,0,0,0,2|1,1,0]=4 2138 B11R1.75 Cc1ccc(s1)SCC(=O)N 62a_100000747473_100000031368 [0,0,0,0,0,2|1,1,0]=4 2139 B11R1.75 Cc1ccc(s1)SCC(=O)[O-] 62a_100000031368_100020667443 [0,0,0,0,0,2|1,1,0]=4 2140 B11R1.75 Cc1ccc(s1)SCC(=O)[O-] 62a_100020667443_100000031368 [0,0,0,0,0,2|1,1,0]=4 2141 B11R1.75 Cc1ccn(n1)CCC(=O)[13CH3] 1458a_100000759146_200025704644 [0,0,0,0,0,2|2,0,0]=4 2142 B11R1.75 Cc1nnc(o1)SCC(=O)[13CH3] 1458a_200000179512_200025704644 [0,0,0,0,0,2|2,0,0]=4 2143 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200025704644 [0,0,0,0,0,2|1,0,0]=3 2144 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)I 1458a_100000679848_200025704644 [0,0,0,0,0,2|1,0,0]=3 2145 B11R1.75 [13CH3]C(=O)C=Cc1ccc(s1)Br 1458a_100102558031_200025704644 [0,0,0,0,0,2|1,1,0]=4 2146 B11R1.75 [13CH3]C(=O)C=Cc1ccc(s1)Cl 1458a_100102558157_200025704644 [0,0,0,0,0,2|1,1,0]=4 2147 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [0,0,0,0,0,2|2,0,0]=4 2148 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [0,0,0,0,0,2|2,0,0]=4 2149 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [0,0,0,0,0,2|2,0,0]=4 2150 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [0,0,0,0,0,2|2,0,0]=4 2151 B11R1.157 CC(=Cc1ccnc(n1)C)C 271570a_100102525489_100000749937 [0,0,0,0,0,2|2,0,0]=4 2152 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [0,0,0,0,0,2|2,0,0]=4 2153 B11R1.157 CC(=Cc1cncc(n1)C)C 271570a_100102525489_100009842155 [0,0,0,0,0,2|2,0,0]=4 2154 B11R1.157 CC(=Cc1nccc(n1)C)C 271570a_100102525489_100011243806 [0,0,0,0,0,2|2,0,0]=4 2155 B11R1.157 CC(=O)Cc1cc(ccn1)Br 1458a_100000070787_100010173614 [0,0,0,0,0,2|2,0,0]=4 2156 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [0,0,0,0,0,2|1,0,0]=3 2157 B11R1.157 CC(=O)Cc1cc(ccn1)Cl 1458a_100000070787_100016988179 [0,0,0,0,0,2|2,0,0]=4 2158 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [0,0,0,0,0,2|2,0,0]=4 2159 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [0,0,0,0,0,2|2,0,0]=4 2160 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [0,0,0,0,0,2|1,0,0]=3 2161 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [0,0,0,0,0,2|1,0,0]=3 2162 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [0,0,0,0,0,2|2,0,0]=4 2163 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [0,0,0,0,0,2|2,0,0]=4 2164 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [0,0,0,0,0,2|2,0,0]=4 2165 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [0,0,0,0,0,2|2,0,0]=4 2166 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [0,0,0,0,0,2|2,0,0]=4 2167 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [0,0,0,0,0,2|2,0,0]=4 2168 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [0,0,0,0,0,2|2,0,0]=4 2169 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [0,0,0,0,0,2|2,0,0]=4 2170 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [0,0,0,0,0,2|2,0,0]=4 2171 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100000070787_100009889011 [0,0,0,0,0,2|2,0,0]=4 2172 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000210301 [0,0,0,0,0,2|2,0,0]=4 2173 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [0,0,0,0,0,2|1,0,0]=3 2174 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [0,0,0,0,0,2|1,0,0]=3 2175 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000070787_100000086093 [0,0,0,0,0,2|2,0,0]=4 2176 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000210301 [0,0,0,0,0,2|2,0,0]=4 2177 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000070787_100009819644 [0,0,0,0,0,2|2,0,0]=4 2178 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000096803_200000210301 [0,0,0,0,0,2|2,0,0]=4 2179 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100000070787_100010243470 [0,0,0,0,0,2|2,0,0]=4 2180 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000210301 [0,0,0,0,0,2|2,0,0]=4 2181 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [0,0,0,0,0,2|1,0,0]=3 2182 B11R1.157 CC(=O)Cc1ccnc(c1)Cl 1458a_100000070787_100000764220 [0,0,0,0,0,2|2,0,0]=4 2183 B11R1.157 CC(=O)Cc1ccnc(n1)Cl 1458a_100000070787_100000099655 [0,0,0,0,0,2|2,0,0]=4 2184 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000070787_100011740620 [0,0,0,0,0,2|2,0,0]=4 2185 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000210301 [0,0,0,0,0,2|2,0,0]=4 2186 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [0,0,0,0,0,2|1,0,0]=3 2187 B11R1.157 CC(=O)Cc1cncc(c1)Cl 1458a_100000070787_100016992070 [0,0,0,0,0,2|2,0,0]=4 2188 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100000070787_100000725299 [0,0,0,0,0,2|2,0,0]=4 2189 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100011667516_200000210301 [0,0,0,0,0,2|2,0,0]=4 2190 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [0,0,0,0,0,2|2,0,0]=4 2191 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,0,0,0,0,2|2,0,0]=4 2192 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,0,0,0,0,2|2,0,0]=4 2193 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,0,0,0,0,2|2,0,0]=4 2194 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,0,0,0,0,2|2,0,0]=4 2195 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,0,0,0,0,2|1,0,0]=3 2196 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,0,0,0,0,2|1,0,0]=3 2197 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,0,0,0,0,2|1,0,0]=3 2198 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,0,0,0,0,2|1,0,0]=3 2199 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,0,0,0,0,2|2,0,0]=4 2200 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,0,0,0,0,2|2,0,0]=4 2201 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,0,0,0,0,2|2,0,0]=4 2202 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,0,0,0,0,2|2,0,0]=4 2203 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,0,0,0,0,2|2,0,0]=4 2204 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,0,0,0,0,2|2,0,0]=4 2205 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,0,0,0,0,2|2,0,0]=4 2206 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,0,0,0,0,2|2,0,0]=4 2207 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,0,0,0,0,2|2,0,0]=4 2208 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,0,0,0,0,2|2,0,0]=4 2209 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,0,0,0,0,2|2,0,0]=4 2210 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,0,0,0,0,2|2,0,0]=4 2211 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,0,0,0,0,2|2,0,0]=4 2212 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,0,0,0,0,2|2,0,0]=4 2213 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,0,0,0,0,2|2,0,0]=4 2214 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [0,0,0,0,0,2|2,0,0]=4 2215 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [0,0,0,0,0,2|2,0,0]=4 2216 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [0,0,0,0,0,2|2,0,0]=4 2217 B11R1.157 CC(=O)Nc1cncc(n1)O 271570a_203496583355_100000703374 [0,0,0,0,0,2|2,0,0]=4 2218 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [0,0,0,0,0,2|2,0,0]=4 2219 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [0,0,0,0,0,2|1,0,0]=3 2220 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [0,0,0,0,0,2|1,0,0]=3 2221 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [0,0,0,0,0,2|2,0,0]=4 2222 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [0,0,0,0,0,2|2,0,0]=4 2223 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [0,0,0,0,0,2|2,0,0]=4 2224 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [0,0,0,0,0,2|2,0,0]=4 2225 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [0,0,0,0,0,2|2,0,0]=4 2226 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Br 1458a_100010201708_200025704644 [0,0,0,0,0,2|2,0,0]=4 2227 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200025704644 [0,0,0,0,0,2|2,0,0]=4 2228 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)F 1458a_100000096803_200025704644 [0,0,0,0,0,2|2,0,0]=4 2229 B11R1.157 [13CH3]C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200025704644 [0,0,0,0,0,2|2,0,0]=4 2230 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)Br 1458a_100000239331_200025704644 [0,0,0,0,0,2|2,0,0]=4 2231 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)F 1458a_100011667516_200025704644 [0,0,0,0,0,2|2,0,0]=4