0 B9R1.23 C=Cc1cc(c(s1)C)C 271570a_100011290941_100009850898 [0,0,0,0,0,0|1,1,2]=4 1 B9R1.23 C=Cc1cc(n(n1)C)C 271570a_100011290941_100012001299 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.23 C=Cc1cn(c(n1)C)C 271570a_100011290941_100000684932 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.23 C=Cc1nc(c(s1)C)C 271570a_100011290941_100000765934 [0,0,0,0,0,0|0,1,2]=3 4 B9R1.23 CC1=CC(OC1=O)S[13CH3] 62a_200009893386_200025704644 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.23 CC1=CC(OC1=O)S[13CH3] 62a_200025704644_200009893386 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.23 CCc1nc(c(s1)O)C 271570a_203496583355_100010138847 [0,0,0,0,0,0|1,1,0]=2 7 B9R1.23 CNC1C=C(C(=O)O1)C 2230a_106832991635_200009893386 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.23 CNc1nc(c(s1)C)C 27a_100102657272_100000765934 [0,0,0,0,0,0|1,1,0]=2 9 B9R1.23 CSC1C=C(C(=O)O1)C 62a_200000210301_200009893386 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.23 CSC1C=C(C(=O)O1)C 62a_200009893386_200000210301 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.23 CSc1cc(c(s1)C)C 62a_100009850898_200000210301 [0,0,0,0,0,0|2,1,0]=3 12 B9R1.23 CSc1cc(c(s1)C)C 62a_200000210301_100009850898 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.23 CSc1cc(n(n1)C)C 62a_100012001299_200000210301 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.23 CSc1cc(n(n1)C)C 62a_200000210301_100012001299 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.23 CSc1cc(n(n1)C)N 62a_100000734454_200000210301 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.23 CSc1cc(n(n1)C)N 62a_200000210301_100000734454 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.23 CSc1cn(c(n1)C)C 62a_100000684932_200000210301 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.23 CSc1cn(c(n1)C)C 62a_200000210301_100000684932 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.23 CSc1cn(c(n1)N)C 62a_100025756272_200000210301 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.23 CSc1cn(c(n1)N)C 62a_200000210301_100025756272 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.23 CSc1nc(c(s1)C)C 62a_100000765934_200000210301 [0,0,0,0,0,0|1,1,0]=2 22 B9R1.23 CSc1nc(c(s1)C)C 62a_200000210301_100000765934 [0,0,0,0,0,0|1,1,0]=2 23 B9R1.23 CSc1nc(n(n1)C)N 62a_200000210301_200010296169 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.23 CSc1nc(n(n1)C)N 62a_200010296169_200000210301 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.23 Cc1cc(nn1C)S[13CH3] 62a_100012001299_200025704644 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.23 Cc1cc(nn1C)S[13CH3] 62a_200025704644_100012001299 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.23 Cc1cc(sc1C)S[13CH3] 62a_100009850898_200025704644 [0,0,0,0,0,0|2,1,0]=3 28 B9R1.23 Cc1cc(sc1C)S[13CH3] 62a_200025704644_100009850898 [0,0,0,0,0,0|2,1,0]=3 29 B9R1.23 Cc1nc(cn1C)S[13CH3] 62a_100000684932_200025704644 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.23 Cc1nc(cn1C)S[13CH3] 62a_200025704644_100000684932 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.23 Cc1nc(sc1C)S[13CH3] 62a_100000765934_200025704644 [0,0,0,0,0,0|1,1,0]=2 32 B9R1.23 Cc1nc(sc1C)S[13CH3] 62a_200025704644_100000765934 [0,0,0,0,0,0|1,1,0]=2 33 B9R1.23 Cc1sc(cc1O)CO 271570a_203496583355_100013897464 [0,0,0,0,0,0|3,1,0]=4 34 B9R1.23 Cn1cc(nc1N)S[13CH3] 62a_100025756272_200025704644 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.23 Cn1cc(nc1N)S[13CH3] 62a_200025704644_100025756272 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.23 Cn1nc(cc1N)S[13CH3] 62a_100000734454_200025704644 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.23 Cn1nc(cc1N)S[13CH3] 62a_200025704644_100000734454 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.23 Cn1nc(nc1N)S[13CH3] 62a_200010296169_200025704644 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.23 Cn1nc(nc1N)S[13CH3] 62a_200025704644_200010296169 [0,0,0,0,0,0|4,0,0]=4 40 B8R1.1 C=Cc1nc(c[nH]1)C 271570a_100011290941_100161115468 [1,0,0,0,0,0|1,0,2]=4 41 B8R1.1 C=Cc1nc(cs1)C 271570a_100011290941_100011291629 [1,0,0,0,0,0|0,1,2]=4 42 B8R1.1 C=Cc1ncc(s1)C 271570a_100011290941_100000690809 [1,0,0,0,0,0|0,1,2]=4 43 B8R1.1 C=Cc1nnc(o1)C 271570a_100011290941_100000708914 [1,0,0,0,0,0|1,0,2]=4 44 B8R1.1 CCc1cc(cs1)O 271570a_203496583355_100009846239 [1,0,0,0,0,0|2,1,0]=4 45 B8R1.1 CCc1ccc(s1)O 271570a_203496583355_100009844052 [1,0,0,0,0,0|2,1,0]=4 46 B8R1.1 CCc1nc(no1)C 270196a_100000212224_100000210414 [1,0,0,0,0,0|1,0,0]=2 47 B8R1.1 CCc1nc(no1)O 271570a_203496583355_100012003642 [1,0,0,0,0,0|2,0,0]=3 48 B8R1.1 CCc1noc(n1)C 270196a_200000212204_100000070787 [1,0,0,0,0,0|2,0,0]=3 49 B8R1.1 CCc1noc(n1)O 270196a_200000212204_100015183105 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.1 CCn1cc(cn1)O 271570a_203496583355_100011400201 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.1 CCn1cc(nn1)C 274090a_100000204670_200000242740 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.1 CCn1ccc(n1)O 271570a_203496583355_100012350556 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.1 CNc1nc(ns1)C 27a_100102657272_100000709739 [1,0,0,0,0,0|2,1,0]=4 54 B8R1.1 CNc1nnc(o1)C 27a_100102657272_100000708914 [1,0,0,0,0,0|2,0,0]=3 55 B8R1.1 CNc1nnc(s1)C 27a_100102657272_100000686958 [1,0,0,0,0,0|2,1,0]=4 56 B8R1.1 CNc1noc(n1)C 27a_100102657272_100012003639 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.1 COc1ccn(n1)C 34a_100012642153_200000210301 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.1 COc1nc(cs1)O 271570a_203496583355_100000727839 [1,0,0,0,0,0|2,1,0]=4 59 B8R1.1 COc1ncc(s1)O 271570a_203496583355_100000729428 [1,0,0,0,0,0|2,1,0]=4 60 B8R1.1 CSc1c[nH]c(n1)C 62a_100009814057_200000210301 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.1 CSc1c[nH]c(n1)C 62a_200000210301_100009814057 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.1 CSc1cc([nH]n1)C 62a_100009819999_200000210301 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.1 CSc1cc([nH]n1)C 62a_200000210301_100009819999 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.1 CSc1cc(cs1)C 62a_100009876951_200000210301 [1,0,0,0,0,0|2,1,0]=4 65 B8R1.1 CSc1cc(cs1)C 62a_200000210301_100009876951 [1,0,0,0,0,0|2,1,0]=4 66 B8R1.1 CSc1cc(on1)C 62a_100000716708_200000210301 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.1 CSc1cc(on1)C 62a_200000210301_100000716708 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,0,0,0,0,0|2,1,0]=4 69 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,0,0,0,0,0|2,1,0]=4 70 B8R1.1 CSc1ccn(n1)C 62a_100000752436_200000210301 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.1 CSc1ccn(n1)C 62a_200000210301_100000752436 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.1 CSc1cn(cn1)C 62a_100000040308_200000210301 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.1 CSc1cn(cn1)C 62a_200000210301_100000040308 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.1 CSc1csc(n1)C 62a_100011934587_200000210301 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.1 CSc1csc(n1)C 62a_200000210301_100011934587 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.1 CSc1n[nH]c(n1)C 62a_100000732540_200000210301 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.1 CSc1n[nH]c(n1)C 62a_200000210301_100000732540 [1,0,0,0,0,0|3,0,0]=4 78 B8R1.1 CSc1nc(c[nH]1)C 62a_100161115468_200000210301 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.1 CSc1nc(c[nH]1)C 62a_200000210301_100161115468 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.1 CSc1nc(cs1)Br 62a_200000210301_200016082925 [1,0,0,0,0,0|2,1,0]=4 81 B8R1.1 CSc1nc(cs1)Br 62a_200016082925_200000210301 [1,0,0,0,0,0|2,1,0]=4 82 B8R1.1 CSc1nc(cs1)C 62a_100011291629_200000210301 [1,0,0,0,0,0|1,1,0]=3 83 B8R1.1 CSc1nc(cs1)C 62a_200000210301_100011291629 [1,0,0,0,0,0|1,1,0]=3 84 B8R1.1 CSc1nc(cs1)N 62a_200000210301_200015188442 [1,0,0,0,0,0|2,1,0]=4 85 B8R1.1 CSc1nc(cs1)N 62a_200015188442_200000210301 [1,0,0,0,0,0|2,1,0]=4 86 B8R1.1 CSc1nc(cs1)O 271570a_203496583355_100000732701 [1,0,0,0,0,0|2,1,0]=4 87 B8R1.1 CSc1nc(ns1)C 62a_100000709739_200000210301 [1,0,0,0,0,0|2,1,0]=4 88 B8R1.1 CSc1nc(ns1)C 62a_200000210301_100000709739 [1,0,0,0,0,0|2,1,0]=4 89 B8R1.1 CSc1ncc(s1)C 62a_100000690809_200000210301 [1,0,0,0,0,0|1,1,0]=3 90 B8R1.1 CSc1ncc(s1)C 62a_200000210301_100000690809 [1,0,0,0,0,0|1,1,0]=3 91 B8R1.1 CSc1ncn(n1)C 62a_100009819955_200000210301 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.1 CSc1ncn(n1)C 62a_200000210301_100009819955 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.1 CSc1nnc(o1)C 62a_200000210301_100000708914 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.1 CSc1nnc(s1)C 62a_100000686958_200000210301 [1,0,0,0,0,0|2,1,0]=4 95 B8R1.1 CSc1nnc(s1)C 62a_200000210301_100000686958 [1,0,0,0,0,0|2,1,0]=4 96 B8R1.1 CSc1noc(n1)C 62a_100012003639_200000210301 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.1 CSc1noc(n1)C 62a_200000210301_100012003639 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_100161115468_200025704644 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.1 Cc1c[nH]c(n1)S[13CH3] 62a_200025704644_100161115468 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.1 Cc1cc(n[nH]1)S[13CH3] 62a_100009819999_200025704644 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.1 Cc1cc(n[nH]1)S[13CH3] 62a_200025704644_100009819999 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.1 Cc1cc(no1)S[13CH3] 62a_100000716708_200025704644 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.1 Cc1cc(no1)S[13CH3] 62a_200025704644_100000716708 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,0,0,0,0,0|2,1,0]=4 105 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,0,0,0,0,0|2,1,0]=4 106 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_100000690809_200025704644 [1,0,0,0,0,0|1,1,0]=3 107 B8R1.1 Cc1cnc(s1)S[13CH3] 62a_200025704644_100000690809 [1,0,0,0,0,0|1,1,0]=3 108 B8R1.1 Cc1csc(c1)S[13CH3] 62a_100009876951_200025704644 [1,0,0,0,0,0|2,1,0]=4 109 B8R1.1 Cc1csc(c1)S[13CH3] 62a_200025704644_100009876951 [1,0,0,0,0,0|2,1,0]=4 110 B8R1.1 Cc1csc(n1)S[13CH3] 62a_100011291629_200025704644 [1,0,0,0,0,0|1,1,0]=3 111 B8R1.1 Cc1csc(n1)S[13CH3] 62a_200025704644_100011291629 [1,0,0,0,0,0|1,1,0]=3 112 B8R1.1 Cc1nc(c[nH]1)S[13CH3] 62a_100009814057_200025704644 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.1 Cc1nc(c[nH]1)S[13CH3] 62a_200025704644_100009814057 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_100011934587_200025704644 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.1 Cc1nc(cs1)S[13CH3] 62a_200025704644_100011934587 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.1 Cc1nc(n[nH]1)S[13CH3] 62a_100000732540_200025704644 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.1 Cc1nc(n[nH]1)S[13CH3] 62a_200025704644_100000732540 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.1 Cc1nc(no1)CF 270196a_200000032654_100000070787 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.1 Cc1nc(no1)S[13CH3] 62a_100012003639_200025704644 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.1 Cc1nc(no1)S[13CH3] 62a_200025704644_100012003639 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.1 Cc1nnc(o1)S[13CH3] 62a_200025704644_100000708914 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_100000686958_200025704644 [1,0,0,0,0,0|2,1,0]=4 123 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_200025704644_100000686958 [1,0,0,0,0,0|2,1,0]=4 124 B8R1.1 Cc1noc(n1)CO 270196a_100000212224_100000210174 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.1 Cc1nsc(n1)S[13CH3] 62a_100000709739_200025704644 [1,0,0,0,0,0|2,1,0]=4 126 B8R1.1 Cc1nsc(n1)S[13CH3] 62a_200025704644_100000709739 [1,0,0,0,0,0|2,1,0]=4 127 B8R1.1 Cn1ccc(n1)O[13CH3] 34a_100012642153_200025704644 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.1 Cn1ccc(n1)S[13CH3] 62a_100000752436_200025704644 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.1 Cn1ccc(n1)S[13CH3] 62a_200025704644_100000752436 [1,0,0,0,0,0|3,0,0]=4 130 B8R1.1 Cn1cnc(c1)S[13CH3] 62a_100000040308_200025704644 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.1 Cn1cnc(c1)S[13CH3] 62a_200025704644_100000040308 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.1 Cn1cnc(n1)S[13CH3] 62a_100009819955_200025704644 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.1 Cn1cnc(n1)S[13CH3] 62a_200025704644_100009819955 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.1 NCc1ccc(o1)O 271570a_203496583355_100000708654 [1,0,0,0,0,0|3,0,0]=4 135 B8R1.1 NCc1ncc(s1)O 271570a_203496583355_100016991807 [1,0,0,0,0,0|2,1,0]=4 136 B8R1.1 OCc1ccc(o1)O 271570a_203496583355_100000246276 [1,0,0,0,0,0|3,0,0]=4 137 B8R1.1 OCc1nc(cs1)O 271570a_203496583355_100012000107 [1,0,0,0,0,0|2,1,0]=4 138 B8R1.1 OCc1ncc(s1)O 271570a_203496583355_100000696694 [1,0,0,0,0,0|2,1,0]=4 139 B8R1.1 [13CH3]Sc1nc(cs1)Br 62a_200016082925_200025704644 [1,0,0,0,0,0|2,1,0]=4 140 B8R1.1 [13CH3]Sc1nc(cs1)Br 62a_200025704644_200016082925 [1,0,0,0,0,0|2,1,0]=4 141 B8R1.1 [13CH3]Sc1nc(cs1)N 62a_200015188442_200025704644 [1,0,0,0,0,0|2,1,0]=4 142 B8R1.1 [13CH3]Sc1nc(cs1)N 62a_200025704644_200015188442 [1,0,0,0,0,0|2,1,0]=4 143 B8R1.18 Cc1cc(c(s1)C)O 271570a_203496583355_100000688054 [1,0,0,0,0,0|2,1,0]=4 144 B8R1.18 Cc1cc(c(s1)O)C 271570a_203496583355_100000689295 [1,0,0,0,0,0|2,1,0]=4 145 B8R1.18 Cc1cc(n(n1)C)O 271570a_203496583355_100009818511 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.18 Cc1cc(nn1C)O 271570a_203496583355_100012001299 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.18 Cc1cc(sc1C)O 271570a_203496583355_100009850898 [1,0,0,0,0,0|2,1,0]=4 148 B8R1.18 Cc1cn(c(n1)O)C 271570a_203496583355_100009816808 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.18 Cc1cn(nc1O)C 271570a_203496583355_100012644376 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.18 Cc1nc(c(s1)C)O 271570a_203496583355_100010270876 [1,0,0,0,0,0|1,1,0]=3 151 B8R1.18 Cc1nc(c(s1)O)C 271570a_203496583355_100009814099 [1,0,0,0,0,0|1,1,0]=3 152 B8R1.18 Cc1nc(cn1C)O 271570a_203496583355_100000684932 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.18 Cc1nc(sc1C)O 271570a_203496583355_100000765934 [1,0,0,0,0,0|1,1,0]=3 154 B8R1.18 Cc1nn(cc1O)C 271570a_203496583355_100011996311 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.18 Cc1nn(nc1O)C 271570a_203496583355_200009884731 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.18 Cc1sc(nc1O)N 271570a_203496583355_100009817509 [1,0,0,0,0,0|2,1,0]=4 157 B10R1.34 CCn1nc(c(c1C)O)C 271570a_203496583355_100000755104 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.35 C=Cc1nc(c(o1)C)C=O 271570a_100011290941_200010262729 [0,1,0,0,0,0|0,0,3]=4 159 B10R1.35 C=Cc1nc(c(s1)C)CO 271570a_100011290941_100010127906 [0,1,0,0,0,0|0,1,2]=4 160 B10R1.35 C=Cc1nc(c(s1)CO)C 271570a_100011290941_100010264302 [0,1,0,0,0,0|0,1,2]=4 161 B10R1.35 C=Cc1sc(nc1C)CC 271570a_100011290941_100010138847 [0,1,0,0,0,0|0,1,1]=3 162 B10R1.35 CCc1nc(c(s1)SC)C 62a_100010138847_200000210301 [0,1,0,0,0,0|0,1,0]=2 163 B10R1.35 CCc1nc(c(s1)SC)C 62a_200000210301_100010138847 [0,1,0,0,0,0|0,1,0]=2 164 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_100010138847_200025704644 [0,1,0,0,0,0|0,1,0]=2 165 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_200025704644_100010138847 [0,1,0,0,0,0|0,1,0]=2 166 B10R1.35 CCn1nc(cc1C)SC 62a_100010781242_200000210301 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.35 CCn1nc(cc1C)SC 62a_200000210301_100010781242 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.35 CCn1nc(cc1C)S[13CH3] 62a_100010781242_200025704644 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.35 CCn1nc(cc1C)S[13CH3] 62a_200025704644_100010781242 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.35 CNc1nc(c(s1)C=O)C 27a_100102657272_100010339034 [0,1,0,0,0,0|1,1,1]=4 171 B10R1.35 CSc1cc(sc1C)CO 62a_100013897464_200000210301 [0,1,0,0,0,0|2,1,0]=4 172 B10R1.35 CSc1cc(sc1C)CO 62a_200000210301_100013897464 [0,1,0,0,0,0|2,1,0]=4 173 B10R1.35 CSc1nc(c(o1)C)C=O 62a_200000210301_200010262729 [0,1,0,0,0,0|1,0,1]=3 174 B10R1.35 CSc1nc(c(o1)C)C=O 62a_200010262729_200000210301 [0,1,0,0,0,0|1,0,1]=3 175 B10R1.35 CSc1nc(c(s1)C)CO 62a_100010127906_200000210301 [0,1,0,0,0,0|1,1,0]=3 176 B10R1.35 CSc1nc(c(s1)C)CO 62a_200000210301_100010127906 [0,1,0,0,0,0|1,1,0]=3 177 B10R1.35 CSc1nc(c(s1)C=O)C 62a_100010339034_200000210301 [0,1,0,0,0,0|1,1,1]=4 178 B10R1.35 CSc1nc(c(s1)C=O)C 62a_200000210301_100010339034 [0,1,0,0,0,0|1,1,1]=4 179 B10R1.35 CSc1nc(c(s1)CO)C 62a_100010264302_200000210301 [0,1,0,0,0,0|1,1,0]=3 180 B10R1.35 CSc1nc(c(s1)CO)C 62a_200000210301_100010264302 [0,1,0,0,0,0|1,1,0]=3 181 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_100010339034_200025704644 [0,1,0,0,0,0|1,1,1]=4 182 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_200025704644_100010339034 [0,1,0,0,0,0|1,1,1]=4 183 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_100010264302_200025704644 [0,1,0,0,0,0|1,1,0]=3 184 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_200025704644_100010264302 [0,1,0,0,0,0|1,1,0]=3 185 B10R1.35 Cc1oc(nc1C=O)S[13CH3] 62a_200010262729_200025704644 [0,1,0,0,0,0|1,0,1]=3 186 B10R1.35 Cc1oc(nc1C=O)S[13CH3] 62a_200025704644_200010262729 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.35 Cc1sc(cc1S[13CH3])CO 62a_100013897464_200025704644 [0,1,0,0,0,0|2,1,0]=4 188 B10R1.35 Cc1sc(cc1S[13CH3])CO 62a_200025704644_100013897464 [0,1,0,0,0,0|2,1,0]=4 189 B10R1.35 Cc1sc(nc1CO)S[13CH3] 62a_100010127906_200025704644 [0,1,0,0,0,0|1,1,0]=3 190 B10R1.35 Cc1sc(nc1CO)S[13CH3] 62a_200025704644_100010127906 [0,1,0,0,0,0|1,1,0]=3 191 B10R1.58 C=C(C)c1cc(c(s1)C)C 271570a_100000694244_100009850898 [0,1,0,0,0,0|1,1,1]=4 192 B10R1.58 C=C(C)c1cc(n(n1)C)C 271570a_100000694244_100012001299 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.58 C=C(C)c1cn(c(n1)C)C 271570a_100000694244_100000684932 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.58 C=C(C)c1nc(c(s1)C)C 271570a_100000694244_100000765934 [0,1,0,0,0,0|0,1,1]=3 195 B10R1.58 Cc1nc(sc1C)N(C)C 27a_100102631434_100000765934 [0,1,0,0,0,0|1,1,0]=3 196 B10R1.58 Cc1nn(cc1O)C(C)C 271570a_203496583355_100012354293 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.131 C=C=Cc1nc(c(s1)C)C 271570a_100015277604_100000765934 [0,1,0,0,0,0|0,1,2]=4 198 B10R1.131 CC=Cc1cc(c(s1)C)C 271570a_100016259895_100009850898 [0,1,0,0,0,0|1,1,1]=4 199 B10R1.131 CC=Cc1cc(n(n1)C)C 271570a_100016259895_100012001299 [0,1,0,0,0,0|2,0,1]=4 200 B10R1.131 CC=Cc1cn(c(n1)C)C 271570a_100016259895_100000684932 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.131 CC=Cc1nc(c(s1)C)C 271570a_100016259895_100000765934 [0,1,0,0,0,0|0,1,1]=3 202 B10R1.131 CCNC1C=C(C(=O)O1)C 2230a_100015525214_200009893386 [0,1,0,0,0,0|2,0,1]=4 203 B10R1.131 CCNc1nc(c(s1)C)C 27a_100015525214_100000765934 [0,1,0,0,0,0|0,1,0]=2 204 B10R1.131 CCSC1C=C(C(=O)O1)C 62a_100000210202_200009893386 [0,1,0,0,0,0|2,0,1]=4 205 B10R1.131 CCSC1C=C(C(=O)O1)C 62a_200009893386_100000210202 [0,1,0,0,0,0|2,0,1]=4 206 B10R1.131 CCSc1cc(c(s1)C)C 62a_100000210202_100009850898 [0,1,0,0,0,0|1,1,0]=3 207 B10R1.131 CCSc1cc(c(s1)C)C 62a_100009850898_100000210202 [0,1,0,0,0,0|1,1,0]=3 208 B10R1.131 CCSc1cc(n(n1)C)C 62a_100000210202_100012001299 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.131 CCSc1cc(n(n1)C)C 62a_100012001299_100000210202 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.131 CCSc1cc(n(n1)C)N 62a_100000210202_100000734454 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.131 CCSc1cc(n(n1)C)N 62a_100000734454_100000210202 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.131 CCSc1cn(c(n1)C)C 62a_100000210202_100000684932 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.131 CCSc1cn(c(n1)C)C 62a_100000684932_100000210202 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.131 CCSc1cn(c(n1)N)C 62a_100000210202_100025756272 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.131 CCSc1cn(c(n1)N)C 62a_100025756272_100000210202 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.131 CCSc1nc(c(s1)C)C 62a_100000210202_100000765934 [0,1,0,0,0,0|0,1,0]=2 217 B10R1.131 CCSc1nc(c(s1)C)C 62a_100000765934_100000210202 [0,1,0,0,0,0|0,1,0]=2 218 B10R1.131 CCSc1nc(n(n1)C)N 62a_100000210202_200010296169 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.131 CCSc1nc(n(n1)C)N 62a_200010296169_100000210202 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.131 CNCc1cc(c(o1)Br)Br 207a_100102657272_100000188521 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.131 CNCc1cc(c(o1)Br)Br 270004a_106832991635_100000188521 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.131 CNCc1cc(c(s1)Br)C 207a_100102657272_100000761930 [0,1,0,0,0,0|2,1,0]=4 223 B10R1.131 CNCc1cc(c(s1)Br)C 270004a_106832991635_100000761930 [0,1,0,0,0,0|2,1,0]=4 224 B10R1.131 CNCc1cc(c(s1)C)Br 207a_100102657272_100000708457 [0,1,0,0,0,0|2,1,0]=4 225 B10R1.131 CNCc1cc(c(s1)C)Br 270004a_106832991635_100000708457 [0,1,0,0,0,0|2,1,0]=4 226 B10R1.131 CNCc1cc(c(s1)C)C 207a_100102657272_100011830369 [0,1,0,0,0,0|1,1,0]=3 227 B10R1.131 CNCc1cc(c(s1)C)C 270004a_106832991635_100011830369 [0,1,0,0,0,0|1,1,0]=3 228 B10R1.131 CNCc1cc(n(n1)C)C 207a_100102657272_100000763638 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.131 CNCc1cc(n(n1)C)C 2230a_100025705265_200000210301 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.131 CNCc1cc(n(n1)C)C 2230a_106832991635_100000761402 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.131 CNCc1cc(n(n1)C)C 270004a_106832991635_100000763638 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.131 CNCc1cc(n(n1)C)C 34a_100025705265_200000210301 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.131 CNCc1cc(n(n1)C)C 34a_100102657272_100000761402 [0,1,0,0,0,0|2,0,0]=3 234 B10R1.131 CNCc1cc(n(n1)C)C 7a_106832991635_100000761402 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.131 CNCc1nc(c(s1)C)C 207a_100102657272_100011775437 [0,1,0,0,0,0|0,1,0]=2 236 B10R1.131 CNCc1nc(c(s1)C)C 2230a_106832991635_100012347604 [0,1,0,0,0,0|0,1,0]=2 237 B10R1.131 CNCc1nc(c(s1)C)C 270004a_106832991635_100011775437 [0,1,0,0,0,0|0,1,0]=2 238 B10R1.131 CNCc1nc(c(s1)C)C 34a_100102657272_100012347604 [0,1,0,0,0,0|0,1,0]=2 239 B10R1.131 CNCc1nc(c(s1)C)C 7a_106832991635_100012347604 [0,1,0,0,0,0|0,1,0]=2 240 B10R1.131 COCc1cc(n(n1)C)C 34a_100011219459_200000210301 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.131 COCc1cc(n(n1)C)C 34a_100138415774_100000761402 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.131 COCc1nc(c(s1)C)C 34a_100138415774_100012347604 [0,1,0,0,0,0|0,1,0]=2 243 B10R1.131 COCc1nc(c(s1)C)C 7a_100000760949_200000210301 [0,1,0,0,0,0|0,1,0]=2 244 B10R1.131 CSCc1cc(n(n1)C)C 62a_100000761402_200000210301 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.131 CSCc1cc(n(n1)C)C 62a_200000210301_100000761402 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.131 CSCc1nc(c(s1)C)C 62a_100000763442_200000210301 [0,1,0,0,0,0|0,1,0]=2 247 B10R1.131 CSCc1nc(c(s1)C)C 62a_200000210301_100012347604 [0,1,0,0,0,0|0,1,0]=2 248 B10R1.131 Cc1cc(nn1C)CN[13CH3] 2230a_100025705265_200025704644 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.131 Cc1cc(nn1C)CN[13CH3] 34a_100025705265_200025704644 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.131 Cc1cc(nn1C)CO[13CH3] 34a_100011219459_200025704644 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.131 Cc1cc(nn1C)CS[13CH3] 62a_100000761402_200025704644 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.131 Cc1cc(nn1C)CS[13CH3] 62a_200025704644_100000761402 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.131 Cc1cc(nn1C)SCF 62a_100012001299_100015361967 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.131 Cc1cc(nn1C)SCF 62a_100015361967_100012001299 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.131 Cc1cc(sc1C)SCF 62a_100009850898_100015361967 [0,1,0,0,0,0|2,1,0]=4 256 B10R1.131 Cc1cc(sc1C)SCF 62a_100015361967_100009850898 [0,1,0,0,0,0|2,1,0]=4 257 B10R1.131 Cc1nc(cn1C)SCF 62a_100000684932_100015361967 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.131 Cc1nc(cn1C)SCF 62a_100015361967_100000684932 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.131 Cc1nc(sc1C)CO[13CH3] 7a_100000760949_200025704644 [0,1,0,0,0,0|0,1,0]=2 260 B10R1.131 Cc1nc(sc1C)CS[13CH3] 62a_100000763442_200025704644 [0,1,0,0,0,0|0,1,0]=2 261 B10R1.131 Cc1nc(sc1C)CS[13CH3] 62a_200025704644_100012347604 [0,1,0,0,0,0|0,1,0]=2 262 B10R1.131 Cc1nc(sc1C)SCF 62a_100000765934_100015361967 [0,1,0,0,0,0|1,1,0]=3 263 B10R1.131 Cc1nc(sc1C)SCF 62a_100015361967_100000765934 [0,1,0,0,0,0|1,1,0]=3 264 B10R1.131 Cc1nn(cc1O)CCF 271570a_203496583355_100010872355 [0,1,0,0,0,0|3,0,0]=4 265 B8R0.8 C=C(C)C(=NNCC)C 4a_100000756455_100011216138 [0,0,1,0,0,0|2,0,0]=3 266 B8R0.8 CCC/C=C(\C)/C(=O)C 1458a_200020648666_200000210301 [0,0,1,0,0,0|1,0,2]=4 267 B8R0.8 CCC/C=C(\C)/C(=O)[13CH3] 1458a_200020648666_200025704644 [0,0,1,0,0,0|1,0,2]=4 268 B8R0.8 CCCOC(C)C(=O)C 34a_100000212229_100000210303 [0,0,1,0,0,0|1,0,2]=4 269 B8R0.8 CCNN=C(C)C(C)C 4a_100000756455_100000211110 [0,0,1,0,0,0|2,0,1]=4 270 B8R0.8 CCNN=C(C)C(C)O 4a_100000756455_100000212229 [0,0,1,0,0,0|1,0,1]=3 271 B8R0.19 CCC(=O)C=C(C)CC 1458a_100020758463_100000210202 [0,0,1,0,0,0|1,0,2]=4 272 B10R1.8 C=Cc1cc(cc(n1)C)C 271570a_100011290941_100000069240 [0,0,0,0,0,1|1,0,2]=4 273 B10R1.8 C=Cc1cc(nc(n1)C)C 271570a_100011290941_100000736142 [0,0,0,0,0,1|1,0,2]=4 274 B10R1.8 C=Cc1nc(cc(n1)C)C 271570a_100011290941_100000736147 [0,0,0,0,0,1|1,0,2]=4 275 B10R1.8 C=Cc1nc(nc(n1)C)C 271570a_100011290941_100015468570 [0,0,0,0,0,1|1,0,2]=4 276 B10R1.8 CCc1cc(nc(n1)C)O 271570a_203496583355_100000761995 [0,0,0,0,0,1|2,0,0]=3 277 B10R1.8 CCc1cc(nc(n1)N)O 271570a_203496583355_100000069509 [0,0,0,0,0,1|3,0,0]=4 278 B10R1.8 CCc1nc(cc(n1)O)C 271570a_203496583355_100000687827 [0,0,0,0,0,1|2,0,0]=3 279 B10R1.8 CNc1cc(cc(c1)C)C 2230a_100000210930_200000210301 [0,0,0,0,0,1|3,0,0]=4 280 B10R1.8 CNc1cc(cc(c1)C)C 34a_100000210930_200000210301 [0,0,0,0,0,1|3,0,0]=4 281 B10R1.8 CNc1cc(cc(c1)C)C 7a_100000210930_200000210301 [0,0,0,0,0,1|3,0,0]=4 282 B10R1.8 CNc1cc(cc(n1)C)C 27a_100102657272_100000069240 [0,0,0,0,0,1|2,0,0]=3 283 B10R1.8 CNc1cc(cc(n1)F)C 27a_100102657272_100009819601 [0,0,0,0,0,1|3,0,0]=4 284 B10R1.8 CNc1cc(nc(c1)C)C 27a_100102657272_100000066820 [0,0,0,0,0,1|3,0,0]=4 285 B10R1.8 CNc1cc(nc(n1)C)C 27a_100102657272_100000736142 [0,0,0,0,0,1|2,0,0]=3 286 B10R1.8 CNc1cc(nc(n1)C)N 27a_100102657272_100000761517 [0,0,0,0,0,1|3,0,0]=4 287 B10R1.8 CNc1cc(nc(n1)C)O 271570a_203496583355_100000758931 [0,0,0,0,0,1|3,0,0]=4 288 B10R1.8 CNc1cc(nc(n1)C)O 27a_100102657272_106741647437 [0,0,0,0,0,1|3,0,0]=4 289 B10R1.8 CNc1cc(nc(n1)N)C 27a_100102657272_100000183061 [0,0,0,0,0,1|3,0,0]=4 290 B10R1.8 CNc1cc(nc(n1)O)C 271570a_203496583355_100011684537 [0,0,0,0,0,1|3,0,0]=4 291 B10R1.8 CNc1nc(cc(n1)C)C 27a_100102657272_100000736147 [0,0,0,0,0,1|2,0,0]=3 292 B10R1.8 CNc1nc(cc(n1)N)C 27a_100102657272_100000687285 [0,0,0,0,0,1|3,0,0]=4 293 B10R1.8 CNc1nc(cc(n1)O)C 271570a_203496583355_100011202761 [0,0,0,0,0,1|3,0,0]=4 294 B10R1.8 CNc1nc(nc(n1)C)C 27a_100102657272_100015468570 [0,0,0,0,0,1|2,0,0]=3 295 B10R1.8 CNc1nc(nc(n1)N)C 27a_100102657272_200012022553 [0,0,0,0,0,1|3,0,0]=4 296 B10R1.8 COc1cc(=O)cc(o1)C 34a_100016989201_200000210301 [0,0,0,0,0,1|3,0,0]=4 297 B10R1.8 COc1cc(cc(c1)C)C 34a_100000210933_200000210301 [0,0,0,0,0,1|3,0,0]=4 298 B10R1.8 COc1cc(cc(c1)C)C 7a_100000210933_200000210301 [0,0,0,0,0,1|3,0,0]=4 299 B10R1.8 COc1cc(cc(n1)C)O 271570a_203496583355_100010067692 [0,0,0,0,0,1|3,0,0]=4 300 B10R1.8 COc1cc(cc(n1)O)C 271570a_203496583355_100009856763 [0,0,0,0,0,1|3,0,0]=4 301 B10R1.8 COc1cc(nc(n1)C)O 271570a_203496583355_100011686313 [0,0,0,0,0,1|3,0,0]=4 302 B10R1.8 COc1cc(nc(n1)O)C 271570a_203496583355_100000755725 [0,0,0,0,0,1|3,0,0]=4 303 B10R1.8 CSc1cc(cc(c1)C)C 62a_100011215608_200000210301 [0,0,0,0,0,1|3,0,0]=4 304 B10R1.8 CSc1cc(cc(c1)C)C 62a_200000210301_100011215608 [0,0,0,0,0,1|3,0,0]=4 305 B10R1.8 CSc1cc(cc(n1)C)C 62a_100000069240_200000210301 [0,0,0,0,0,1|2,0,0]=3 306 B10R1.8 CSc1cc(cc(n1)C)C 62a_200000210301_100000069240 [0,0,0,0,0,1|2,0,0]=3 307 B10R1.8 CSc1cc(cc(n1)C)N 62a_100000071261_200000210301 [0,0,0,0,0,1|3,0,0]=4 308 B10R1.8 CSc1cc(cc(n1)C)N 62a_200000210301_100000071261 [0,0,0,0,0,1|3,0,0]=4 309 B10R1.8 CSc1cc(cc(n1)F)C 62a_100009819601_200000210301 [0,0,0,0,0,1|3,0,0]=4 310 B10R1.8 CSc1cc(cc(n1)F)C 62a_200000210301_100009819601 [0,0,0,0,0,1|3,0,0]=4 311 B10R1.8 CSc1cc(cc(n1)N)C 62a_100009819863_200000210301 [0,0,0,0,0,1|3,0,0]=4 312 B10R1.8 CSc1cc(cc(n1)N)C 62a_200000210301_100009819863 [0,0,0,0,0,1|3,0,0]=4 313 B10R1.8 CSc1cc(nc(c1)C)C 62a_100000066820_200000210301 [0,0,0,0,0,1|3,0,0]=4 314 B10R1.8 CSc1cc(nc(c1)C)C 62a_200000210301_100000066820 [0,0,0,0,0,1|3,0,0]=4 315 B10R1.8 CSc1cc(nc(n1)C)C 62a_100000736142_200000210301 [0,0,0,0,0,1|2,0,0]=3 316 B10R1.8 CSc1cc(nc(n1)C)C 62a_200000210301_100000736142 [0,0,0,0,0,1|2,0,0]=3 317 B10R1.8 CSc1cc(nc(n1)C)N 62a_100000761517_200000210301 [0,0,0,0,0,1|3,0,0]=4 318 B10R1.8 CSc1cc(nc(n1)C)N 62a_200000210301_100000761517 [0,0,0,0,0,1|3,0,0]=4 319 B10R1.8 CSc1cc(nc(n1)C)O 271570a_203496583355_100011686690 [0,0,0,0,0,1|3,0,0]=4 320 B10R1.8 CSc1cc(nc(n1)C)O 62a_200000210301_106741647437 [0,0,0,0,0,1|3,0,0]=4 321 B10R1.8 CSc1cc(nc(n1)N)C 62a_100000183061_200000210301 [0,0,0,0,0,1|3,0,0]=4 322 B10R1.8 CSc1cc(nc(n1)N)C 62a_200000210301_100000183061 [0,0,0,0,0,1|3,0,0]=4 323 B10R1.8 CSc1cc(nc(n1)O)C 271570a_203496583355_200011684794 [0,0,0,0,0,1|3,0,0]=4 324 B10R1.8 CSc1nc(cc(n1)C)C 62a_100000736147_200000210301 [0,0,0,0,0,1|2,0,0]=3 325 B10R1.8 CSc1nc(cc(n1)C)C 62a_200000210301_100000736147 [0,0,0,0,0,1|2,0,0]=3 326 B10R1.8 CSc1nc(cc(n1)N)C 62a_100000687285_200000210301 [0,0,0,0,0,1|3,0,0]=4 327 B10R1.8 CSc1nc(cc(n1)N)C 62a_200000210301_100000687285 [0,0,0,0,0,1|3,0,0]=4 328 B10R1.8 CSc1nc(cc(n1)O)C 271570a_203496583355_100000073727 [0,0,0,0,0,1|3,0,0]=4 329 B10R1.8 CSc1nc(nc(n1)C)C 62a_100015468570_200000210301 [0,0,0,0,0,1|2,0,0]=3 330 B10R1.8 CSc1nc(nc(n1)C)C 62a_200000210301_100015468570 [0,0,0,0,0,1|2,0,0]=3 331 B10R1.8 CSc1nc(nc(n1)N)C 62a_200000210301_200012022553 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.8 CSc1nc(nc(n1)N)C 62a_200012022553_200000210301 [0,0,0,0,0,1|3,0,0]=4 333 B10R1.8 Cc1cc(=O)cc(o1)O[13CH3] 34a_100016989201_200025704644 [0,0,0,0,0,1|3,0,0]=4 334 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 2230a_100000210930_200025704644 [0,0,0,0,0,1|3,0,0]=4 335 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 34a_100000210930_200025704644 [0,0,0,0,0,1|3,0,0]=4 336 B10R1.8 Cc1cc(cc(c1)N[13CH3])C 7a_100000210930_200025704644 [0,0,0,0,0,1|3,0,0]=4 337 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 34a_100000210933_200025704644 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.8 Cc1cc(cc(c1)O[13CH3])C 7a_100000210933_200025704644 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_100011215608_200025704644 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.8 Cc1cc(cc(c1)S[13CH3])C 62a_200025704644_100011215608 [0,0,0,0,0,1|3,0,0]=4 341 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_100000066820_200025704644 [0,0,0,0,0,1|3,0,0]=4 342 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100000066820 [0,0,0,0,0,1|3,0,0]=4 343 B10R1.8 Cc1cc(cc(n1)CN)O 271570a_203496583355_100010178683 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.8 Cc1cc(cc(n1)CO)O 271570a_203496583355_100010178681 [0,0,0,0,0,1|3,0,0]=4 345 B10R1.8 Cc1cc(cc(n1)S[13CH3])N 62a_100000071261_200025704644 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.8 Cc1cc(cc(n1)S[13CH3])N 62a_200025704644_100000071261 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.8 Cc1cc(nc(c1)CO)O 271570a_203496583355_100000725198 [0,0,0,0,0,1|3,0,0]=4 348 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_100000069240_200025704644 [0,0,0,0,0,1|2,0,0]=3 349 B10R1.8 Cc1cc(nc(c1)S[13CH3])C 62a_200025704644_100000069240 [0,0,0,0,0,1|2,0,0]=3 350 B10R1.8 Cc1cc(nc(c1)S[13CH3])F 62a_100009819601_200025704644 [0,0,0,0,0,1|3,0,0]=4 351 B10R1.8 Cc1cc(nc(c1)S[13CH3])F 62a_200025704644_100009819601 [0,0,0,0,0,1|3,0,0]=4 352 B10R1.8 Cc1cc(nc(c1)S[13CH3])N 62a_100009819863_200025704644 [0,0,0,0,0,1|3,0,0]=4 353 B10R1.8 Cc1cc(nc(c1)S[13CH3])N 62a_200025704644_100009819863 [0,0,0,0,0,1|3,0,0]=4 354 B10R1.8 Cc1cc(nc(n1)C)S[13CH3] 62a_100000736142_200025704644 [0,0,0,0,0,1|2,0,0]=3 355 B10R1.8 Cc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100000736142 [0,0,0,0,0,1|2,0,0]=3 356 B10R1.8 Cc1cc(nc(n1)N)S[13CH3] 62a_100000183061_200025704644 [0,0,0,0,0,1|3,0,0]=4 357 B10R1.8 Cc1cc(nc(n1)N)S[13CH3] 62a_200025704644_100000183061 [0,0,0,0,0,1|3,0,0]=4 358 B10R1.8 Cc1cc(nc(n1)S[13CH3])C 62a_100000736147_200025704644 [0,0,0,0,0,1|2,0,0]=3 359 B10R1.8 Cc1cc(nc(n1)S[13CH3])C 62a_200025704644_100000736147 [0,0,0,0,0,1|2,0,0]=3 360 B10R1.8 Cc1cc(nc(n1)S[13CH3])N 62a_100000687285_200025704644 [0,0,0,0,0,1|3,0,0]=4 361 B10R1.8 Cc1cc(nc(n1)S[13CH3])N 62a_200025704644_100000687285 [0,0,0,0,0,1|3,0,0]=4 362 B10R1.8 Cc1nc(cc(n1)S[13CH3])N 62a_100000761517_200025704644 [0,0,0,0,0,1|3,0,0]=4 363 B10R1.8 Cc1nc(cc(n1)S[13CH3])N 62a_200025704644_100000761517 [0,0,0,0,0,1|3,0,0]=4 364 B10R1.8 Cc1nc(cc(n1)S[13CH3])O 62a_200025704644_106741647437 [0,0,0,0,0,1|3,0,0]=4 365 B10R1.8 Cc1nc(nc(n1)S[13CH3])C 62a_100015468570_200025704644 [0,0,0,0,0,1|2,0,0]=3 366 B10R1.8 Cc1nc(nc(n1)S[13CH3])C 62a_200025704644_100015468570 [0,0,0,0,0,1|2,0,0]=3 367 B10R1.8 Cc1nc(nc(n1)S[13CH3])N 62a_200012022553_200025704644 [0,0,0,0,0,1|3,0,0]=4 368 B10R1.8 Cc1nc(nc(n1)S[13CH3])N 62a_200025704644_200012022553 [0,0,0,0,0,1|3,0,0]=4 369 B10R1.176 C=Cc1cc(c(cn1)C)C 271570a_100011290941_100009850809 [0,0,0,0,0,1|1,0,2]=4 370 B10R1.176 C=Cc1ccc(c(n1)C)C 271570a_100011290941_100000103781 [0,0,0,0,0,1|1,0,2]=4 371 B10R1.176 C=Cc1cnc(c(c1)C)C 271570a_100011290941_100000697892 [0,0,0,0,0,1|1,0,2]=4 372 B10R1.176 C=Cc1cnc(c(n1)C)C 271570a_100011290941_100009878948 [0,0,0,0,0,1|1,0,2]=4 373 B10R1.176 CNc1cc(c(cn1)C)F 27a_100102657272_100009841206 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [0,0,0,0,0,1|3,0,0]=4 375 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [0,0,0,0,0,1|3,0,0]=4 376 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.176 CNc1cnc(c(n1)C)C 27a_100102657272_100009878948 [0,0,0,0,0,1|2,0,0]=3 379 B10R1.176 CNc1ncc(c(n1)C)Cl 27a_100102657272_100010174973 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.176 CNc1ncc(c(n1)C)F 27a_100102657272_100015641512 [0,0,0,0,0,1|3,0,0]=4 381 B10R1.176 CNc1ncc(c(n1)C)N 27a_100102657272_100000123670 [0,0,0,0,0,1|3,0,0]=4 382 B10R1.176 CNc1ncc(c(n1)N)C 27a_100102657272_100011996698 [0,0,0,0,0,1|3,0,0]=4 383 B10R1.176 COc1cc(c(cn1)Br)C 34a_100000766222_200000210301 [0,0,0,0,0,1|3,0,0]=4 384 B10R1.176 COc1cc(c(cn1)C)Br 34a_100009831917_200000210301 [0,0,0,0,0,1|3,0,0]=4 385 B10R1.176 COc1cc(c(cn1)C)O 271570a_203496583355_100010068546 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.176 COc1cc(c(cn1)Cl)C 34a_200000085746_200000210301 [0,0,0,0,0,1|3,0,0]=4 387 B10R1.176 COc1cc(c(cn1)O)C 271570a_203496583355_100011934368 [0,0,0,0,0,1|3,0,0]=4 388 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [0,0,0,0,0,1|3,0,0]=4 389 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [0,0,0,0,0,1|3,0,0]=4 390 B10R1.176 COc1ccc(c(n1)C)Br 34a_100000691680_200000210301 [0,0,0,0,0,1|3,0,0]=4 391 B10R1.176 COc1ccc(c(n1)C)Cl 34a_200009863735_200000210301 [0,0,0,0,0,1|3,0,0]=4 392 B10R1.176 COc1ccc(c(n1)C)O 271570a_203496583355_100000766551 [0,0,0,0,0,1|3,0,0]=4 393 B10R1.176 COc1cnc(c(c1)Br)C 34a_100009819603_200000210301 [0,0,0,0,0,1|3,0,0]=4 394 B10R1.176 COc1cnc(c(c1)Br)C 7a_100009819603_200000210301 [0,0,0,0,0,1|3,0,0]=4 395 B10R1.176 COc1cnc(c(c1)C)Br 34a_100012000486_200000210301 [0,0,0,0,0,1|3,0,0]=4 396 B10R1.176 COc1cnc(c(c1)C)Br 7a_100012000486_200000210301 [0,0,0,0,0,1|3,0,0]=4 397 B10R1.176 COc1cnc(c(c1)C)C 34a_100009854398_200000210301 [0,0,0,0,0,1|2,0,0]=3 398 B10R1.176 COc1cnc(c(c1)C)C 7a_100009854398_200000210301 [0,0,0,0,0,1|2,0,0]=3 399 B10R1.176 COc1cnc(c(c1)C)Cl 34a_100012002680_200000210301 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.176 COc1cnc(c(c1)C)Cl 7a_100012002680_200000210301 [0,0,0,0,0,1|3,0,0]=4 401 B10R1.176 COc1cnc(c(c1)C)F 34a_100000094615_200000210301 [0,0,0,0,0,1|3,0,0]=4 402 B10R1.176 COc1cnc(c(c1)C)F 7a_100000094615_200000210301 [0,0,0,0,0,1|3,0,0]=4 403 B10R1.176 COc1cnc(c(c1)C)O 271570a_203496583355_200009851512 [0,0,0,0,0,1|3,0,0]=4 404 B10R1.176 COc1cnc(c(n1)C)C 34a_200000700380_200000210301 [0,0,0,0,0,1|2,0,0]=3 405 B10R1.176 COc1cnc(c(n1)C)O 271570a_203496583355_200010730098 [0,0,0,0,0,1|3,0,0]=4 406 B10R1.176 COc1ncc(c(n1)C)O 271570a_203496583355_100010152497 [0,0,0,0,0,1|3,0,0]=4 407 B10R1.176 CSc1c[nH]c(=O)c(n1)C 62a_100010363809_200000210301 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.176 CSc1c[nH]c(=O)c(n1)C 62a_200000210301_100010363809 [0,0,0,0,0,1|3,0,0]=4 409 B10R1.176 CSc1cc(c(=O)[nH]n1)C 62a_200000210301_100012187101 [0,0,0,0,0,1|3,0,0]=4 410 B10R1.176 CSc1cc(c(cn1)Br)C 62a_100012356354_200000210301 [0,0,0,0,0,1|3,0,0]=4 411 B10R1.176 CSc1cc(c(cn1)Br)C 62a_200000210301_100012356354 [0,0,0,0,0,1|3,0,0]=4 412 B10R1.176 CSc1cc(c(cn1)C)C 62a_100009850809_200000210301 [0,0,0,0,0,1|2,0,0]=3 413 B10R1.176 CSc1cc(c(cn1)C)C 62a_200000210301_100009850809 [0,0,0,0,0,1|2,0,0]=3 414 B10R1.176 CSc1cc(c(cn1)C)F 62a_100009841206_200000210301 [0,0,0,0,0,1|3,0,0]=4 415 B10R1.176 CSc1cc(c(cn1)C)F 62a_200000210301_100009841206 [0,0,0,0,0,1|3,0,0]=4 416 B10R1.176 CSc1cc(c(cn1)C)N 62a_100000126663_200000210301 [0,0,0,0,0,1|3,0,0]=4 417 B10R1.176 CSc1cc(c(cn1)C)N 62a_200000210301_100000126663 [0,0,0,0,0,1|3,0,0]=4 418 B10R1.176 CSc1cc(c(cn1)C)O 62a_100000704368_200000210301 [0,0,0,0,0,1|3,0,0]=4 419 B10R1.176 CSc1cc(c(cn1)C)O 62a_200000210301_100000704368 [0,0,0,0,0,1|3,0,0]=4 420 B10R1.176 CSc1cc(c(cn1)F)C 62a_100009818257_200000210301 [0,0,0,0,0,1|3,0,0]=4 421 B10R1.176 CSc1cc(c(cn1)F)C 62a_200000210301_100009818257 [0,0,0,0,0,1|3,0,0]=4 422 B10R1.176 CSc1cc(c(cn1)N)C 62a_100000067204_200000210301 [0,0,0,0,0,1|3,0,0]=4 423 B10R1.176 CSc1cc(c(cn1)N)C 62a_200000210301_100000067204 [0,0,0,0,0,1|3,0,0]=4 424 B10R1.176 CSc1cc(c(cn1)O)C 62a_200000210301_100000692680 [0,0,0,0,0,1|3,0,0]=4 425 B10R1.176 CSc1cc(c(nn1)N)C 62a_100153394926_200000210301 [0,0,0,0,0,1|3,0,0]=4 426 B10R1.176 CSc1cc(c(nn1)N)C 62a_200000210301_100153394926 [0,0,0,0,0,1|3,0,0]=4 427 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [0,0,0,0,0,1|3,0,0]=4 428 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [0,0,0,0,0,1|3,0,0]=4 429 B10R1.176 CSc1ccc(c(n1)C)Br 62a_100012360386_200000210301 [0,0,0,0,0,1|3,0,0]=4 430 B10R1.176 CSc1ccc(c(n1)C)Br 62a_200000210301_100012360386 [0,0,0,0,0,1|3,0,0]=4 431 B10R1.176 CSc1ccc(c(n1)C)C 62a_100000103781_200000210301 [0,0,0,0,0,1|2,0,0]=3 432 B10R1.176 CSc1ccc(c(n1)C)C 62a_200000210301_100000103781 [0,0,0,0,0,1|2,0,0]=3 433 B10R1.176 CSc1ccc(c(n1)C)F 62a_100009814307_200000210301 [0,0,0,0,0,1|3,0,0]=4 434 B10R1.176 CSc1ccc(c(n1)C)F 62a_200000210301_100009814307 [0,0,0,0,0,1|3,0,0]=4 435 B10R1.176 CSc1ccc(c(n1)C)N 62a_100000720120_200000210301 [0,0,0,0,0,1|3,0,0]=4 436 B10R1.176 CSc1ccc(c(n1)C)N 62a_200000210301_100000720120 [0,0,0,0,0,1|3,0,0]=4 437 B10R1.176 CSc1ccc(c(n1)C)O 62a_100010233687_200000210301 [0,0,0,0,0,1|3,0,0]=4 438 B10R1.176 CSc1ccc(c(n1)C)O 62a_200000210301_100010233687 [0,0,0,0,0,1|3,0,0]=4 439 B10R1.176 CSc1ccc(c(n1)N)C 62a_100009857032_200000210301 [0,0,0,0,0,1|3,0,0]=4 440 B10R1.176 CSc1ccc(c(n1)N)C 62a_200000210301_100009857032 [0,0,0,0,0,1|3,0,0]=4 441 B10R1.176 CSc1cnc(c(c1)C)Br 62a_100009816107_200000210301 [0,0,0,0,0,1|3,0,0]=4 442 B10R1.176 CSc1cnc(c(c1)C)Br 62a_200000210301_100009816107 [0,0,0,0,0,1|3,0,0]=4 443 B10R1.176 CSc1cnc(c(c1)C)C 62a_100000697892_200000210301 [0,0,0,0,0,1|2,0,0]=3 444 B10R1.176 CSc1cnc(c(c1)C)C 62a_200000210301_100000697892 [0,0,0,0,0,1|2,0,0]=3 445 B10R1.176 CSc1cnc(c(c1)C)Cl 62a_100009922867_200000210301 [0,0,0,0,0,1|3,0,0]=4 446 B10R1.176 CSc1cnc(c(c1)C)Cl 62a_200000210301_100009922867 [0,0,0,0,0,1|3,0,0]=4 447 B10R1.176 CSc1cnc(c(c1)C)F 62a_100000709442_200000210301 [0,0,0,0,0,1|3,0,0]=4 448 B10R1.176 CSc1cnc(c(c1)C)F 62a_200000210301_100000709442 [0,0,0,0,0,1|3,0,0]=4 449 B10R1.176 CSc1cnc(c(c1)C)N 62a_100000684428_200000210301 [0,0,0,0,0,1|3,0,0]=4 450 B10R1.176 CSc1cnc(c(c1)C)N 62a_200000210301_100000684428 [0,0,0,0,0,1|3,0,0]=4 451 B10R1.176 CSc1cnc(c(c1)C)O 271570a_203496583355_203440288091 [0,0,0,0,0,1|3,0,0]=4 452 B10R1.176 CSc1cnc(c(c1)C)O 62a_100000685391_200000210301 [0,0,0,0,0,1|3,0,0]=4 453 B10R1.176 CSc1cnc(c(c1)C)O 62a_200000210301_100000685391 [0,0,0,0,0,1|3,0,0]=4 454 B10R1.176 CSc1cnc(c(c1)F)C 62a_100009845756_200000210301 [0,0,0,0,0,1|3,0,0]=4 455 B10R1.176 CSc1cnc(c(c1)F)C 62a_200000210301_100009845756 [0,0,0,0,0,1|3,0,0]=4 456 B10R1.176 CSc1cnc(c(c1)N)C 62a_100011999542_200000210301 [0,0,0,0,0,1|3,0,0]=4 457 B10R1.176 CSc1cnc(c(c1)N)C 62a_200000210301_100011999542 [0,0,0,0,0,1|3,0,0]=4 458 B10R1.176 CSc1cnc(c(c1)O)C 62a_100009864810_200000210301 [0,0,0,0,0,1|3,0,0]=4 459 B10R1.176 CSc1cnc(c(c1)O)C 62a_200000210301_100009864810 [0,0,0,0,0,1|3,0,0]=4 460 B10R1.176 CSc1cnc(c(n1)C)C 62a_100009878948_200000210301 [0,0,0,0,0,1|2,0,0]=3 461 B10R1.176 CSc1cnc(c(n1)C)C 62a_200000210301_100009878948 [0,0,0,0,0,1|2,0,0]=3 462 B10R1.176 CSc1cnc(c(n1)C)N 62a_100009818571_200000210301 [0,0,0,0,0,1|3,0,0]=4 463 B10R1.176 CSc1cnc(c(n1)C)N 62a_200000210301_100009818571 [0,0,0,0,0,1|3,0,0]=4 464 B10R1.176 CSc1ncc(c(n1)C)Cl 62a_100010174973_200000210301 [0,0,0,0,0,1|3,0,0]=4 465 B10R1.176 CSc1ncc(c(n1)C)Cl 62a_200000210301_100010174973 [0,0,0,0,0,1|3,0,0]=4 466 B10R1.176 CSc1ncc(c(n1)C)F 62a_100015641512_200000210301 [0,0,0,0,0,1|3,0,0]=4 467 B10R1.176 CSc1ncc(c(n1)C)F 62a_200000210301_100015641512 [0,0,0,0,0,1|3,0,0]=4 468 B10R1.176 CSc1ncc(c(n1)C)N 62a_100000123670_200000210301 [0,0,0,0,0,1|3,0,0]=4 469 B10R1.176 CSc1ncc(c(n1)C)N 62a_200000210301_100000123670 [0,0,0,0,0,1|3,0,0]=4 470 B10R1.176 CSc1ncc(c(n1)C)O 271570a_203496583355_100015672207 [0,0,0,0,0,1|3,0,0]=4 471 B10R1.176 CSc1ncc(c(n1)N)C 62a_100011996698_200000210301 [0,0,0,0,0,1|3,0,0]=4 472 B10R1.176 CSc1ncc(c(n1)N)C 62a_200000210301_100011996698 [0,0,0,0,0,1|3,0,0]=4 473 B10R1.176 CSc1ncc(c(n1)O)C 271570a_203496583355_100000097195 [0,0,0,0,0,1|3,0,0]=4 474 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 34a_100012000486_200025704644 [0,0,0,0,0,1|3,0,0]=4 475 B10R1.176 Cc1cc(cnc1Br)O[13CH3] 7a_100012000486_200025704644 [0,0,0,0,0,1|3,0,0]=4 476 B10R1.176 Cc1cc(cnc1Br)S[13CH3] 62a_100009816107_200025704644 [0,0,0,0,0,1|3,0,0]=4 477 B10R1.176 Cc1cc(cnc1Br)S[13CH3] 62a_200025704644_100009816107 [0,0,0,0,0,1|3,0,0]=4 478 B10R1.176 Cc1cc(cnc1C)O[13CH3] 34a_100009854398_200025704644 [0,0,0,0,0,1|2,0,0]=3 479 B10R1.176 Cc1cc(cnc1C)O[13CH3] 7a_100009854398_200025704644 [0,0,0,0,0,1|2,0,0]=3 480 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_100000697892_200025704644 [0,0,0,0,0,1|2,0,0]=3 481 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_200025704644_100000697892 [0,0,0,0,0,1|2,0,0]=3 482 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 34a_100012002680_200025704644 [0,0,0,0,0,1|3,0,0]=4 483 B10R1.176 Cc1cc(cnc1Cl)O[13CH3] 7a_100012002680_200025704644 [0,0,0,0,0,1|3,0,0]=4 484 B10R1.176 Cc1cc(cnc1Cl)S[13CH3] 62a_100009922867_200025704644 [0,0,0,0,0,1|3,0,0]=4 485 B10R1.176 Cc1cc(cnc1Cl)S[13CH3] 62a_200025704644_100009922867 [0,0,0,0,0,1|3,0,0]=4 486 B10R1.176 Cc1cc(cnc1F)O[13CH3] 34a_100000094615_200025704644 [0,0,0,0,0,1|3,0,0]=4 487 B10R1.176 Cc1cc(cnc1F)O[13CH3] 7a_100000094615_200025704644 [0,0,0,0,0,1|3,0,0]=4 488 B10R1.176 Cc1cc(cnc1F)S[13CH3] 62a_100000709442_200025704644 [0,0,0,0,0,1|3,0,0]=4 489 B10R1.176 Cc1cc(cnc1F)S[13CH3] 62a_200025704644_100000709442 [0,0,0,0,0,1|3,0,0]=4 490 B10R1.176 Cc1cc(cnc1N)S[13CH3] 62a_100000684428_200025704644 [0,0,0,0,0,1|3,0,0]=4 491 B10R1.176 Cc1cc(cnc1N)S[13CH3] 62a_200025704644_100000684428 [0,0,0,0,0,1|3,0,0]=4 492 B10R1.176 Cc1cc(cnc1O)CO 271570a_203496583355_200000092119 [0,0,0,0,0,1|3,0,0]=4 493 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_100000685391_200025704644 [0,0,0,0,0,1|3,0,0]=4 494 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_200025704644_100000685391 [0,0,0,0,0,1|3,0,0]=4 495 B10R1.176 Cc1cc(n[nH]c1=O)S[13CH3] 62a_200025704644_100012187101 [0,0,0,0,0,1|3,0,0]=4 496 B10R1.176 Cc1cc(ncc1Br)O[13CH3] 34a_100000766222_200025704644 [0,0,0,0,0,1|3,0,0]=4 497 B10R1.176 Cc1cc(ncc1Br)S[13CH3] 62a_100012356354_200025704644 [0,0,0,0,0,1|3,0,0]=4 498 B10R1.176 Cc1cc(ncc1Br)S[13CH3] 62a_200025704644_100012356354 [0,0,0,0,0,1|3,0,0]=4 499 B10R1.176 Cc1cc(ncc1Cl)O[13CH3] 34a_200000085746_200025704644 [0,0,0,0,0,1|3,0,0]=4 500 B10R1.176 Cc1cc(ncc1F)S[13CH3] 62a_100009818257_200025704644 [0,0,0,0,0,1|3,0,0]=4 501 B10R1.176 Cc1cc(ncc1F)S[13CH3] 62a_200025704644_100009818257 [0,0,0,0,0,1|3,0,0]=4 502 B10R1.176 Cc1cc(ncc1N)S[13CH3] 62a_100000067204_200025704644 [0,0,0,0,0,1|3,0,0]=4 503 B10R1.176 Cc1cc(ncc1N)S[13CH3] 62a_200025704644_100000067204 [0,0,0,0,0,1|3,0,0]=4 504 B10R1.176 Cc1cc(ncc1O)CO 271570a_203496583355_200010713146 [0,0,0,0,0,1|3,0,0]=4 505 B10R1.176 Cc1cc(ncc1O)S[13CH3] 62a_200025704644_100000692680 [0,0,0,0,0,1|3,0,0]=4 506 B10R1.176 Cc1cc(nnc1N)S[13CH3] 62a_100153394926_200025704644 [0,0,0,0,0,1|3,0,0]=4 507 B10R1.176 Cc1cc(nnc1N)S[13CH3] 62a_200025704644_100153394926 [0,0,0,0,0,1|3,0,0]=4 508 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [0,0,0,0,0,1|3,0,0]=4 509 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [0,0,0,0,0,1|3,0,0]=4 510 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [0,0,0,0,0,1|3,0,0]=4 511 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [0,0,0,0,0,1|3,0,0]=4 512 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [0,0,0,0,0,1|3,0,0]=4 513 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [0,0,0,0,0,1|3,0,0]=4 514 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [0,0,0,0,0,1|3,0,0]=4 515 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_100000103781_200025704644 [0,0,0,0,0,1|2,0,0]=3 516 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_200025704644_100000103781 [0,0,0,0,0,1|2,0,0]=3 517 B10R1.176 Cc1ccc(nc1N)S[13CH3] 62a_100009857032_200025704644 [0,0,0,0,0,1|3,0,0]=4 518 B10R1.176 Cc1ccc(nc1N)S[13CH3] 62a_200025704644_100009857032 [0,0,0,0,0,1|3,0,0]=4 519 B10R1.176 Cc1cnc(cc1Br)O[13CH3] 34a_100009831917_200025704644 [0,0,0,0,0,1|3,0,0]=4 520 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_100009850809_200025704644 [0,0,0,0,0,1|2,0,0]=3 521 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_200025704644_100009850809 [0,0,0,0,0,1|2,0,0]=3 522 B10R1.176 Cc1cnc(cc1F)S[13CH3] 62a_100009841206_200025704644 [0,0,0,0,0,1|3,0,0]=4 523 B10R1.176 Cc1cnc(cc1F)S[13CH3] 62a_200025704644_100009841206 [0,0,0,0,0,1|3,0,0]=4 524 B10R1.176 Cc1cnc(cc1N)S[13CH3] 62a_100000126663_200025704644 [0,0,0,0,0,1|3,0,0]=4 525 B10R1.176 Cc1cnc(cc1N)S[13CH3] 62a_200025704644_100000126663 [0,0,0,0,0,1|3,0,0]=4 526 B10R1.176 Cc1cnc(cc1O)CO 271570a_203496583355_100010113723 [0,0,0,0,0,1|3,0,0]=4 527 B10R1.176 Cc1cnc(cc1O)S[13CH3] 62a_100000704368_200025704644 [0,0,0,0,0,1|3,0,0]=4 528 B10R1.176 Cc1cnc(cc1O)S[13CH3] 62a_200025704644_100000704368 [0,0,0,0,0,1|3,0,0]=4 529 B10R1.176 Cc1cnc(nc1N)S[13CH3] 62a_100011996698_200025704644 [0,0,0,0,0,1|3,0,0]=4 530 B10R1.176 Cc1cnc(nc1N)S[13CH3] 62a_200025704644_100011996698 [0,0,0,0,0,1|3,0,0]=4 531 B10R1.176 Cc1nc(c[nH]c1=O)S[13CH3] 62a_100010363809_200025704644 [0,0,0,0,0,1|3,0,0]=4 532 B10R1.176 Cc1nc(c[nH]c1=O)S[13CH3] 62a_200025704644_100010363809 [0,0,0,0,0,1|3,0,0]=4 533 B10R1.176 Cc1nc(ccc1Br)O[13CH3] 34a_100000691680_200025704644 [0,0,0,0,0,1|3,0,0]=4 534 B10R1.176 Cc1nc(ccc1Br)S[13CH3] 62a_100012360386_200025704644 [0,0,0,0,0,1|3,0,0]=4 535 B10R1.176 Cc1nc(ccc1Br)S[13CH3] 62a_200025704644_100012360386 [0,0,0,0,0,1|3,0,0]=4 536 B10R1.176 Cc1nc(ccc1Cl)O[13CH3] 34a_200009863735_200025704644 [0,0,0,0,0,1|3,0,0]=4 537 B10R1.176 Cc1nc(ccc1F)S[13CH3] 62a_100009814307_200025704644 [0,0,0,0,0,1|3,0,0]=4 538 B10R1.176 Cc1nc(ccc1F)S[13CH3] 62a_200025704644_100009814307 [0,0,0,0,0,1|3,0,0]=4 539 B10R1.176 Cc1nc(ccc1N)S[13CH3] 62a_100000720120_200025704644 [0,0,0,0,0,1|3,0,0]=4 540 B10R1.176 Cc1nc(ccc1N)S[13CH3] 62a_200025704644_100000720120 [0,0,0,0,0,1|3,0,0]=4 541 B10R1.176 Cc1nc(ccc1O)CO 271570a_203496583355_100010114280 [0,0,0,0,0,1|3,0,0]=4 542 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_100010233687_200025704644 [0,0,0,0,0,1|3,0,0]=4 543 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_200025704644_100010233687 [0,0,0,0,0,1|3,0,0]=4 544 B10R1.176 Cc1nc(cnc1N)S[13CH3] 62a_100009818571_200025704644 [0,0,0,0,0,1|3,0,0]=4 545 B10R1.176 Cc1nc(cnc1N)S[13CH3] 62a_200025704644_100009818571 [0,0,0,0,0,1|3,0,0]=4 546 B10R1.176 Cc1nc(ncc1Cl)S[13CH3] 62a_100010174973_200025704644 [0,0,0,0,0,1|3,0,0]=4 547 B10R1.176 Cc1nc(ncc1Cl)S[13CH3] 62a_200025704644_100010174973 [0,0,0,0,0,1|3,0,0]=4 548 B10R1.176 Cc1nc(ncc1F)S[13CH3] 62a_100015641512_200025704644 [0,0,0,0,0,1|3,0,0]=4 549 B10R1.176 Cc1nc(ncc1F)S[13CH3] 62a_200025704644_100015641512 [0,0,0,0,0,1|3,0,0]=4 550 B10R1.176 Cc1nc(ncc1N)S[13CH3] 62a_100000123670_200025704644 [0,0,0,0,0,1|3,0,0]=4 551 B10R1.176 Cc1nc(ncc1N)S[13CH3] 62a_200025704644_100000123670 [0,0,0,0,0,1|3,0,0]=4 552 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 34a_100009819603_200025704644 [0,0,0,0,0,1|3,0,0]=4 553 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 7a_100009819603_200025704644 [0,0,0,0,0,1|3,0,0]=4 554 B10R1.176 Cc1ncc(cc1F)S[13CH3] 62a_100009845756_200025704644 [0,0,0,0,0,1|3,0,0]=4 555 B10R1.176 Cc1ncc(cc1F)S[13CH3] 62a_200025704644_100009845756 [0,0,0,0,0,1|3,0,0]=4 556 B10R1.176 Cc1ncc(cc1N)S[13CH3] 62a_100011999542_200025704644 [0,0,0,0,0,1|3,0,0]=4 557 B10R1.176 Cc1ncc(cc1N)S[13CH3] 62a_200025704644_100011999542 [0,0,0,0,0,1|3,0,0]=4 558 B10R1.176 Cc1ncc(cc1O)S[13CH3] 62a_100009864810_200025704644 [0,0,0,0,0,1|3,0,0]=4 559 B10R1.176 Cc1ncc(cc1O)S[13CH3] 62a_200025704644_100009864810 [0,0,0,0,0,1|3,0,0]=4 560 B10R1.176 Cc1ncc(nc1C)O[13CH3] 34a_200000700380_200025704644 [0,0,0,0,0,1|2,0,0]=3 561 B10R1.176 Cc1ncc(nc1C)S[13CH3] 62a_100009878948_200025704644 [0,0,0,0,0,1|2,0,0]=3 562 B10R1.176 Cc1ncc(nc1C)S[13CH3] 62a_200025704644_100009878948 [0,0,0,0,0,1|2,0,0]=3 563 B7R0.3 C/C=C/CC(=O)CC 1458a_100000210414_100102629194 [1,0,1,0,0,0|1,0,1]=4 564 B7R0.3 C=CC(=NNCC)C 4a_100000756455_200015361842 [1,0,1,0,0,0|1,0,1]=4 565 B7R0.3 CC=CCC(=O)CC 1458a_100000210414_100000070051 [1,0,1,0,0,0|1,0,1]=4 566 B7R0.3 CC=CCC(=O)CC 1458a_100121576822_100000210202 [1,0,1,0,0,0|1,0,1]=4 567 B7R0.3 CCNN=C(C)CO 4a_100000756455_100000211253 [1,0,1,0,0,0|1,0,1]=4 568 B7R0.4 C=C(C)C=NNCC 4a_100000756455_100000210575 [1,0,1,0,0,0|2,0,0]=4 569 B7R0.4 CCC=NNC(=O)C 4a_100000189765_100000210100 [1,0,1,0,0,0|1,0,1]=4 570 B7R0.5 CC/C=C(\C)/C(=O)C 1458a_100016988807_200000210301 [1,0,1,0,0,0|0,0,1]=3 571 B7R0.5 CC/C=C(\C)/C(=O)[13CH3] 1458a_100016988807_200025704644 [1,0,1,0,0,0|0,0,1]=3 572 B7R0.5 CCOC(C)C(=O)C 1458a_100000739345_200000210301 [1,0,1,0,0,0|1,0,1]=4 573 B7R0.5 CCOC(C)C(=O)C 34a_100000212229_100000210202 [1,0,1,0,0,0|1,0,1]=4 574 B7R0.5 CCOC(C)C(=O)[13CH3] 1458a_100000739345_200025704644 [1,0,1,0,0,0|1,0,1]=4 575 B7R0.5 CO/N=C(\C)/C(=O)C 1458a_100160996864_200000210301 [1,0,1,0,0,0|1,0,1]=4 576 B7R0.5 CO/N=C(\C)/C(=O)[13CH3] 1458a_100160996864_200025704644 [1,0,1,0,0,0|1,0,1]=4 577 B7R0.2 C=C(C)CC(=O)CC 1458a_100000210414_100000748629 [1,0,1,0,0,0|1,0,1]=4 578 B7R0.2 CCC(=O)C=C(C)C 1458a_100000211388_100000210202 [1,0,1,0,0,0|1,0,1]=4 579 B7R1.1 C=Cc1ncco1 271570a_100011290941_100011787736 [2,0,0,0,0,0|0,0,2]=4 580 B7R1.1 CSc1ccco1 62a_100009814098_200000210301 [2,0,0,0,0,0|2,0,0]=4 581 B7R1.1 CSc1ccco1 62a_200000210301_100009814098 [2,0,0,0,0,0|2,0,0]=4 582 B7R1.1 CSc1ncc[nH]1 62a_100025796157_200000210301 [2,0,0,0,0,0|2,0,0]=4 583 B7R1.1 CSc1ncc[nH]1 62a_200000210301_100025796157 [2,0,0,0,0,0|2,0,0]=4 584 B7R1.1 CSc1ncco1 62a_100011787736_200000210301 [2,0,0,0,0,0|1,0,0]=3 585 B7R1.1 CSc1ncco1 62a_200000210301_100011787736 [2,0,0,0,0,0|1,0,0]=3 586 B7R1.1 CSc1nccs1 62a_100000211983_200000210301 [2,0,0,0,0,0|1,1,0]=4 587 B7R1.1 CSc1nccs1 62a_200000210301_100000211983 [2,0,0,0,0,0|1,1,0]=4 588 B7R1.1 [13CH3]Sc1ccco1 62a_100009814098_200025704644 [2,0,0,0,0,0|2,0,0]=4 589 B7R1.1 [13CH3]Sc1ccco1 62a_200025704644_100009814098 [2,0,0,0,0,0|2,0,0]=4 590 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_100025796157_200025704644 [2,0,0,0,0,0|2,0,0]=4 591 B7R1.1 [13CH3]Sc1ncc[nH]1 62a_200025704644_100025796157 [2,0,0,0,0,0|2,0,0]=4 592 B7R1.1 [13CH3]Sc1ncco1 62a_100011787736_200025704644 [2,0,0,0,0,0|1,0,0]=3 593 B7R1.1 [13CH3]Sc1ncco1 62a_200025704644_100011787736 [2,0,0,0,0,0|1,0,0]=3 594 B7R1.1 [13CH3]Sc1nccs1 62a_100000211983_200025704644 [2,0,0,0,0,0|1,1,0]=4 595 B7R1.1 [13CH3]Sc1nccs1 62a_200025704644_100000211983 [2,0,0,0,0,0|1,1,0]=4 596 B7R1.2 Cc1c[nH]c(n1)O 271570a_203496583355_100161115468 [2,0,0,0,0,0|2,0,0]=4 597 B7R1.2 Cc1cnc(s1)O 271570a_203496583355_100000690809 [2,0,0,0,0,0|1,1,0]=4 598 B7R1.2 Cc1csc(n1)O 271570a_203496583355_100011291629 [2,0,0,0,0,0|1,1,0]=4 599 B7R1.2 Cc1nc(c[nH]1)O 271570a_203496583355_100009814057 [2,0,0,0,0,0|2,0,0]=4 600 B7R1.2 Cc1nc(cs1)O 271570a_203496583355_100011934587 [2,0,0,0,0,0|1,1,0]=4 601 B7R1.2 Cc1nc(no1)O 271570a_203496583355_100012003639 [2,0,0,0,0,0|2,0,0]=4 602 B7R1.2 Cc1ncc(s1)O 271570a_203496583355_100000764884 [2,0,0,0,0,0|1,1,0]=4 603 B7R1.2 Cc1nnc(o1)O 271570a_203496583355_100000708914 [2,0,0,0,0,0|2,0,0]=4 604 B7R1.2 Cc1noc(n1)C 270196a_100000212224_100000070787 [2,0,0,0,0,0|1,0,0]=3 605 B7R1.2 Cc1noc(n1)O 270196a_100000212224_100015183105 [2,0,0,0,0,0|2,0,0]=4 606 B7R1.4 Cc1[nH]cnc1O 271570a_203496583355_100009816806 [2,0,0,0,0,0|2,0,0]=4 607 B7R1.4 Cc1ncsc1O 271570a_203496583355_100009817116 [2,0,0,0,0,0|1,1,0]=4 608 B7R1.4 Cc1scnc1O 271570a_203496583355_100000732656 [2,0,0,0,0,0|1,1,0]=4 609 B9R0.3 CCNN=C(C)C(C)(C)O 4a_100000756455_100000747739 [0,1,1,0,0,0|1,0,1]=4 610 B9R0.7 C=C(C)C(=NNC(C)C)C 4a_100000741168_100011216138 [0,1,1,0,0,0|2,0,0]=4 611 B9R0.7 CC(=NNC(C)C)C(C)O 4a_100000741168_100000212229 [0,1,1,0,0,0|1,0,1]=4 612 B9R0.8 C/C=C(\C)/C(=NNCC)C 4a_100000756455_100020675665 [0,1,1,0,0,0|2,0,0]=4 613 B9R0.8 CCNN=C(C)C(=NO)C 4a_100000756455_100000066335 [0,1,1,0,0,0|1,0,0]=3 614 B9R0.8 CCNN=C(C)C(=O)OC 4a_100000756455_100000211753 [0,1,1,0,0,0|1,0,1]=4 615 B9R0.8 CCNN=C(C)C(C)CO 4a_100000756455_100000032740 [0,1,1,0,0,0|1,0,1]=4 616 B9R0.47 C=C(C)C(=NNCCC)C 4a_100000740057_100011216138 [0,1,1,0,0,0|1,0,1]=4 617 B9R0.47 C=C(C)C(=NNCCO)C 4a_100000210001_100011216138 [0,1,1,0,0,0|2,0,0]=4 618 B9R0.47 CC(=NNCCO)C(C)O 4a_100000210001_100000212229 [0,1,1,0,0,0|1,0,1]=4 619 B9R0.47 CCCNN=C(C)C(C)O 4a_100000740057_100000212229 [0,1,1,0,0,0|0,0,2]=4 620 B9R0.40 CC=CC(=NNCC)CC 4a_100000756455_100102568992 [0,1,1,0,0,0|1,0,1]=4 621 B9R1.7 C#CCc1nc(no1)C 270196a_100000212224_100011220946 [1,1,0,0,0,0|1,0,1]=4 622 B9R1.7 CC=Cc1nc(c[nH]1)C 271570a_100016259895_100161115468 [1,1,0,0,0,0|1,0,1]=4 623 B9R1.7 CC=Cc1nc(cs1)C 271570a_100016259895_100011291629 [1,1,0,0,0,0|0,1,1]=4 624 B9R1.7 CC=Cc1nc(no1)C 270196a_100000212224_100000210699 [1,1,0,0,0,0|1,0,1]=4 625 B9R1.7 CC=Cc1ncc(s1)C 271570a_100016259895_100000690809 [1,1,0,0,0,0|0,1,1]=4 626 B9R1.7 CC=Cc1nnc(o1)C 271570a_100016259895_100000708914 [1,1,0,0,0,0|1,0,1]=4 627 B9R1.7 CCCc1nc(no1)C 270196a_100000212224_100000211992 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.7 CCCc1ncc([nH]1)O 271570a_203496583355_200009820212 [1,1,0,0,0,0|2,0,0]=4 629 B9R1.7 CCCc1noc(n1)C 270196a_100011193412_100000070787 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.7 CCNc1nc(ns1)C 27a_100015525214_100000709739 [1,1,0,0,0,0|1,1,0]=4 631 B9R1.7 CCNc1nnc(o1)C 27a_100015525214_100000708914 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.7 CCNc1nnc(s1)C 27a_100015525214_100000686958 [1,1,0,0,0,0|1,1,0]=4 633 B9R1.7 CCNc1noc(n1)C 27a_100015525214_100012003639 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.7 CCOc1ccn(n1)C 34a_100012642153_100000210202 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.7 CCOc1nc(cs1)O 271570a_203496583355_100011934640 [1,1,0,0,0,0|1,1,0]=4 636 B9R1.7 CCSc1c[nH]c(n1)C 62a_100000210202_100009814057 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.7 CCSc1c[nH]c(n1)C 62a_100009814057_100000210202 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.7 CCSc1cc([nH]n1)C 62a_100000210202_100009819999 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.7 CCSc1cc([nH]n1)C 62a_100009819999_100000210202 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.7 CCSc1cc(cs1)C 62a_100000210202_100009876951 [1,1,0,0,0,0|1,1,0]=4 641 B9R1.7 CCSc1cc(cs1)C 62a_100009876951_100000210202 [1,1,0,0,0,0|1,1,0]=4 642 B9R1.7 CCSc1cc(on1)C 62a_100000210202_100000716708 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.7 CCSc1cc(on1)C 62a_100000716708_100000210202 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.7 CCSc1ccc(s1)C 62a_100000031368_100000210202 [1,1,0,0,0,0|1,1,0]=4 645 B9R1.7 CCSc1ccc(s1)C 62a_100000210202_100000031368 [1,1,0,0,0,0|1,1,0]=4 646 B9R1.7 CCSc1ccn(n1)C 62a_100000210202_100000752436 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.7 CCSc1ccn(n1)C 62a_100000752436_100000210202 [1,1,0,0,0,0|2,0,0]=4 648 B9R1.7 CCSc1cn(cn1)C 62a_100000040308_100000210202 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.7 CCSc1cn(cn1)C 62a_100000210202_100000040308 [1,1,0,0,0,0|2,0,0]=4 650 B9R1.7 CCSc1csc(n1)C 62a_100000210202_100011934587 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.7 CCSc1csc(n1)C 62a_100011934587_100000210202 [1,1,0,0,0,0|2,0,0]=4 652 B9R1.7 CCSc1n[nH]c(n1)C 62a_100000210202_100000732540 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.7 CCSc1n[nH]c(n1)C 62a_100000732540_100000210202 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.7 CCSc1nc(c[nH]1)C 62a_100000210202_100161115468 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.7 CCSc1nc(c[nH]1)C 62a_100161115468_100000210202 [1,1,0,0,0,0|1,0,0]=3 656 B9R1.7 CCSc1nc(cs1)Br 62a_100000210202_200016082925 [1,1,0,0,0,0|1,1,0]=4 657 B9R1.7 CCSc1nc(cs1)Br 62a_200016082925_100000210202 [1,1,0,0,0,0|1,1,0]=4 658 B9R1.7 CCSc1nc(cs1)C 62a_100000210202_100011291629 [1,1,0,0,0,0|0,1,0]=3 659 B9R1.7 CCSc1nc(cs1)C 62a_100011291629_100000210202 [1,1,0,0,0,0|0,1,0]=3 660 B9R1.7 CCSc1nc(cs1)N 62a_100000210202_200015188442 [1,1,0,0,0,0|1,1,0]=4 661 B9R1.7 CCSc1nc(cs1)N 62a_200015188442_100000210202 [1,1,0,0,0,0|1,1,0]=4 662 B9R1.7 CCSc1nc(ns1)C 62a_100000210202_100000709739 [1,1,0,0,0,0|1,1,0]=4 663 B9R1.7 CCSc1nc(ns1)C 62a_100000709739_100000210202 [1,1,0,0,0,0|1,1,0]=4 664 B9R1.7 CCSc1ncc(s1)C 62a_100000210202_100000690809 [1,1,0,0,0,0|0,1,0]=3 665 B9R1.7 CCSc1ncc(s1)C 62a_100000690809_100000210202 [1,1,0,0,0,0|0,1,0]=3 666 B9R1.7 CCSc1ncn(n1)C 62a_100000210202_100009819955 [1,1,0,0,0,0|2,0,0]=4 667 B9R1.7 CCSc1ncn(n1)C 62a_100009819955_100000210202 [1,1,0,0,0,0|2,0,0]=4 668 B9R1.7 CCSc1nnc(o1)C 62a_100000210202_100000708914 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.7 CCSc1nnc(s1)C 62a_100000210202_100000686958 [1,1,0,0,0,0|1,1,0]=4 670 B9R1.7 CCSc1nnc(s1)C 62a_100000686958_100000210202 [1,1,0,0,0,0|1,1,0]=4 671 B9R1.7 CCSc1noc(n1)C 62a_100000210202_100012003639 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.7 CCSc1noc(n1)C 62a_100012003639_100000210202 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.7 CNCc1c[nH]c(n1)C 207a_100102657272_100011219055 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.7 CNCc1cc(co1)Br 270004a_106832991635_100000747035 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.7 CNCc1cc(cs1)C 207a_100102657272_100102525248 [1,1,0,0,0,0|1,1,0]=4 676 B9R1.7 CNCc1cc(cs1)C 2230a_100015204214_200000210301 [1,1,0,0,0,0|1,1,0]=4 677 B9R1.7 CNCc1cc(cs1)C 270004a_106832991635_100102525248 [1,1,0,0,0,0|1,1,0]=4 678 B9R1.7 CNCc1cc(cs1)C 34a_100015204214_200000210301 [1,1,0,0,0,0|1,1,0]=4 679 B9R1.7 CNCc1cc(no1)C 207a_100102657272_100011794430 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.7 CNCc1cc(no1)C 2230a_100000745748_200000210301 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.7 CNCc1cc(no1)C 2230a_106832991635_100000707947 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.7 CNCc1cc(no1)C 270004a_106832991635_100011794430 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.7 CNCc1cc(no1)C 34a_100000745748_200000210301 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.7 CNCc1cc(no1)C 34a_100102657272_100000707947 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.7 CNCc1cc(no1)C 7a_106832991635_100000707947 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.7 CNCc1cc(on1)C 207a_100102657272_100011217994 [1,1,0,0,0,0|2,0,0]=4 687 B9R1.7 CNCc1cc(on1)C 2230a_100000745230_200000210301 [1,1,0,0,0,0|2,0,0]=4 688 B9R1.7 CNCc1cc(on1)C 2230a_106832991635_100000199038 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.7 CNCc1cc(on1)C 270004a_106832991635_100011217994 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.7 CNCc1cc(on1)C 34a_100000745230_200000210301 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.7 CNCc1cc(on1)C 34a_100102657272_100000199038 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.7 CNCc1cc(on1)C 7a_106832991635_100000199038 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.7 CNCc1cc(sn1)C 207a_100102657272_200000100279 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.7 CNCc1cc(sn1)C 270004a_106832991635_200000100279 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.7 CNCc1ccc(o1)Br 207a_100102657272_100000185145 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.7 CNCc1ccc(o1)Br 270004a_106832991635_100000185145 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.7 CNCc1ccc(o1)Br 34a_100000708654_200000210301 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.7 CNCc1ccc(o1)C 207a_100102657272_100000183696 [1,1,0,0,0,0|1,0,0]=3 699 B9R1.7 CNCc1ccc(o1)C 270004a_106832991635_100000183696 [1,1,0,0,0,0|1,0,0]=3 700 B9R1.7 CNCc1ccc(o1)C 34a_100011194323_200000210301 [1,1,0,0,0,0|1,0,0]=3 701 B9R1.7 CNCc1ccc(o1)Cl 207a_100102657272_100000188459 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.7 CNCc1ccc(o1)Cl 270004a_106832991635_100000188459 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.7 CNCc1ccc(o1)I 207a_100102657272_100000186757 [1,1,0,0,0,0|2,0,0]=4 704 B9R1.7 CNCc1ccc(o1)O 271570a_203496583355_100000207588 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.7 CNCc1ccc(s1)C 207a_100102657272_100000211121 [1,1,0,0,0,0|1,1,0]=4 706 B9R1.7 CNCc1ccc(s1)C 2230a_100000238518_200000210301 [1,1,0,0,0,0|1,1,0]=4 707 B9R1.7 CNCc1ccc(s1)C 270004a_106832991635_100000211121 [1,1,0,0,0,0|1,1,0]=4 708 B9R1.7 CNCc1ccn(n1)C 207a_100102657272_100000750880 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.7 CNCc1ccn(n1)C 2230a_100020636201_200000210301 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.7 CNCc1ccn(n1)C 2230a_106832991635_100000726502 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.7 CNCc1ccn(n1)C 270004a_106832991635_100000750880 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.7 CNCc1ccn(n1)C 34a_100020636201_200000210301 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.7 CNCc1ccn(n1)C 34a_100102657272_100000726502 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.7 CNCc1ccn(n1)C 7a_106832991635_100000726502 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.7 CNCc1cn(cn1)C 207a_100102657272_100000684808 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.7 CNCc1cn(cn1)C 2230a_106832991635_100000717665 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.7 CNCc1cn(cn1)C 270004a_106832991635_100000684808 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.7 CNCc1cn(cn1)C 34a_100102657272_100000717665 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.7 CNCc1cn(cn1)C 7a_106832991635_100000717665 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.7 CNCc1cnc(o1)C 207a_100102657272_100000084308 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.7 CNCc1cnc(o1)C 270004a_106832991635_100000084308 [1,1,0,0,0,0|2,0,0]=4 722 B9R1.7 CNCc1coc(n1)C 207a_100102657272_100011361629 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.7 CNCc1coc(n1)C 270004a_106832991635_100011361629 [1,1,0,0,0,0|2,0,0]=4 724 B9R1.7 CNCc1csc(n1)C 207a_100102657272_100000203724 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.7 CNCc1csc(n1)C 2230a_106832991635_100015186478 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.7 CNCc1csc(n1)C 270004a_106832991635_100000203724 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.7 CNCc1csc(n1)C 34a_100000707933_200000210301 [1,1,0,0,0,0|2,0,0]=4 728 B9R1.7 CNCc1csc(n1)C 34a_100102657272_100015186478 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.7 CNCc1csc(n1)C 7a_106832991635_100015186478 [1,1,0,0,0,0|2,0,0]=4 730 B9R1.7 CNCc1n[nH]c(n1)C 2230a_100000752542_200000210301 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.7 CNCc1nc(c[nH]1)C 207a_100102657272_100000082322 [1,1,0,0,0,0|1,0,0]=3 732 B9R1.7 CNCc1nc(c[nH]1)C 270004a_106832991635_100000082322 [1,1,0,0,0,0|1,0,0]=3 733 B9R1.7 CNCc1nc(cs1)Br 270004a_106832991635_100009816814 [1,1,0,0,0,0|1,1,0]=4 734 B9R1.7 CNCc1nc(cs1)C 207a_100102657272_100000756994 [1,1,0,0,0,0|0,1,0]=3 735 B9R1.7 CNCc1nc(cs1)C 2230a_100015183719_200000210301 [1,1,0,0,0,0|0,1,0]=3 736 B9R1.7 CNCc1nc(cs1)C 270004a_106832991635_100000756994 [1,1,0,0,0,0|0,1,0]=3 737 B9R1.7 CNCc1nc(no1)C 2230a_106832991635_100000735555 [1,1,0,0,0,0|1,0,0]=3 738 B9R1.7 CNCc1nc(no1)C 34a_100102657272_100000735555 [1,1,0,0,0,0|1,0,0]=3 739 B9R1.7 CNCc1nc(no1)C 7a_106832991635_100000735555 [1,1,0,0,0,0|1,0,0]=3 740 B9R1.7 CNCc1ncc(o1)C 2230a_100138411809_200000210301 [1,1,0,0,0,0|0,0,0]=2 741 B9R1.7 CNCc1ncc(o1)C 34a_100138411809_200000210301 [1,1,0,0,0,0|0,0,0]=2 742 B9R1.7 CNCc1ncc(s1)Br 270004a_106832991635_100000699580 [1,1,0,0,0,0|1,1,0]=4 743 B9R1.7 CNCc1ncc(s1)C 207a_100102657272_100011361622 [1,1,0,0,0,0|0,1,0]=3 744 B9R1.7 CNCc1ncc(s1)C 270004a_106832991635_100011361622 [1,1,0,0,0,0|0,1,0]=3 745 B9R1.7 CNCc1ncc(s1)Cl 270004a_106832991635_100000699884 [1,1,0,0,0,0|1,1,0]=4 746 B9R1.7 CNCc1ncn(n1)C 207a_100102657272_100010630104 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.7 CNCc1ncn(n1)C 2230a_100000695864_200000210301 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.7 CNCc1ncn(n1)C 2230a_106832991635_100016995526 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.7 CNCc1ncn(n1)C 270004a_106832991635_100010630104 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.7 CNCc1ncn(n1)C 34a_100102657272_100016995526 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.7 CNCc1ncn(n1)C 7a_106832991635_100016995526 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.7 CNCc1nnc(o1)C 2230a_106832991635_100000181450 [1,1,0,0,0,0|1,0,0]=3 753 B9R1.7 CNCc1nnc(o1)C 2230a_200000236979_200000210301 [1,1,0,0,0,0|1,0,0]=3 754 B9R1.7 CNCc1nnc(o1)C 34a_200000236979_200000210301 [1,1,0,0,0,0|1,0,0]=3 755 B9R1.7 CNCc1nnc(o1)C 7a_106832991635_100000181450 [1,1,0,0,0,0|1,0,0]=3 756 B9R1.7 CNCc1nnc(s1)C 2230a_106832991635_100000688753 [1,1,0,0,0,0|1,1,0]=4 757 B9R1.7 CNCc1nnc(s1)C 34a_100102657272_100000688753 [1,1,0,0,0,0|1,1,0]=4 758 B9R1.7 CNCc1nnc(s1)C 7a_106832991635_100000688753 [1,1,0,0,0,0|1,1,0]=4 759 B9R1.7 CNCc1noc(n1)C 2230a_106832991635_100000231061 [1,1,0,0,0,0|2,0,0]=4 760 B9R1.7 CNCc1noc(n1)C 34a_100102657272_100000231061 [1,1,0,0,0,0|2,0,0]=4 761 B9R1.7 CNCc1noc(n1)C 7a_106832991635_100000231061 [1,1,0,0,0,0|2,0,0]=4 762 B9R1.7 COCc1cc(cs1)C 34a_200000068372_200000210301 [1,1,0,0,0,0|1,1,0]=4 763 B9R1.7 COCc1cc(cs1)C 7a_200000068372_200000210301 [1,1,0,0,0,0|1,1,0]=4 764 B9R1.7 COCc1cc(no1)C 34a_100000684692_200000210301 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.7 COCc1cc(no1)C 34a_100138415774_100000707947 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.7 COCc1cc(on1)C 34a_100011216401_200000210301 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.7 COCc1cc(on1)C 34a_100138415774_100000199038 [1,1,0,0,0,0|2,0,0]=4 768 B9R1.7 COCc1ccc(o1)Br 34a_100000246276_200000210301 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.7 COCc1ccc(o1)Br 7a_100000246276_200000210301 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.7 COCc1ccc(o1)C 34a_100011232665_200000210301 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.7 COCc1ccc(o1)C 7a_100011232665_200000210301 [1,1,0,0,0,0|1,0,0]=3 772 B9R1.7 COCc1ccc(s1)C 34a_100000238367_200000210301 [1,1,0,0,0,0|1,1,0]=4 773 B9R1.7 COCc1ccn(n1)C 34a_100000744484_200000210301 [1,1,0,0,0,0|2,0,0]=4 774 B9R1.7 COCc1ccn(n1)C 34a_100138415774_100000726502 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.7 COCc1cn(cn1)C 34a_100000710007_200000210301 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.7 COCc1cn(cn1)C 34a_100138415774_100000717665 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.7 COCc1coc(n1)C 34a_100012017233_200000210301 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.7 COCc1csc(n1)C 34a_100000735831_200000210301 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.7 COCc1csc(n1)C 34a_100138415774_100015186478 [1,1,0,0,0,0|2,0,0]=4 780 B9R1.7 COCc1nc(cs1)Br 7a_100012000107_200000210301 [1,1,0,0,0,0|1,1,0]=4 781 B9R1.7 COCc1nc(no1)C 270196a_100000212224_100000210968 [1,1,0,0,0,0|1,0,0]=3 782 B9R1.7 COCc1nc(no1)C 34a_100000749583_200000210301 [1,1,0,0,0,0|1,0,0]=3 783 B9R1.7 COCc1nc(no1)C 34a_100138415774_100000735555 [1,1,0,0,0,0|1,0,0]=3 784 B9R1.7 COCc1ncn(n1)C 34a_100138415774_100016995526 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.7 COCc1nnc(o1)C 34a_100000749586_200000210301 [1,1,0,0,0,0|1,0,0]=3 786 B9R1.7 COCc1nnc(s1)C 34a_100138415774_100000688753 [1,1,0,0,0,0|1,1,0]=4 787 B9R1.7 COCc1noc(n1)C 270196a_100000195696_100000070787 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.7 COCc1noc(n1)C 34a_100138415774_100000231061 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.7 CSCc1cc(no1)C 62a_100000707947_200000210301 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.7 CSCc1cc(no1)C 62a_200000210301_100000707947 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.7 CSCc1cc(on1)C 62a_100000199038_200000210301 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.7 CSCc1cc(on1)C 62a_200000210301_100000199038 [1,1,0,0,0,0|2,0,0]=4 793 B9R1.7 CSCc1ccn(n1)C 62a_100000726502_200000210301 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.7 CSCc1ccn(n1)C 62a_200000210301_100000726502 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.7 CSCc1cn(cn1)C 62a_100000717665_200000210301 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.7 CSCc1cn(cn1)C 62a_200000210301_100000717665 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.7 CSCc1csc(n1)C 62a_100015186478_200000210301 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.7 CSCc1csc(n1)C 62a_200000210301_100015186478 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.7 CSCc1nc(no1)C 270196a_100000212224_100000184570 [1,1,0,0,0,0|1,0,0]=3 800 B9R1.7 CSCc1nc(no1)C 62a_100000735555_200000210301 [1,1,0,0,0,0|1,0,0]=3 801 B9R1.7 CSCc1nc(no1)C 62a_200000210301_100000735555 [1,1,0,0,0,0|1,0,0]=3 802 B9R1.7 CSCc1ncn(n1)C 62a_100016995526_200000210301 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.7 CSCc1ncn(n1)C 62a_200000210301_100016995526 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.7 CSCc1nnc(o1)C 62a_100000181450_200000210301 [1,1,0,0,0,0|1,0,0]=3 805 B9R1.7 CSCc1nnc(o1)C 62a_200000210301_100000181450 [1,1,0,0,0,0|1,0,0]=3 806 B9R1.7 CSCc1nnc(s1)C 62a_100000688753_200000210301 [1,1,0,0,0,0|1,1,0]=4 807 B9R1.7 CSCc1nnc(s1)C 62a_200000210301_100000688753 [1,1,0,0,0,0|1,1,0]=4 808 B9R1.7 CSCc1noc(n1)C 270196a_100000749773_100000070787 [1,1,0,0,0,0|2,0,0]=4 809 B9R1.7 CSCc1noc(n1)C 62a_100000231061_200000210301 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.7 CSCc1noc(n1)C 62a_200000210301_100000231061 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.7 Cc1c[nH]c(n1)SCF 62a_100015361967_100161115468 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.7 Cc1c[nH]c(n1)SCF 62a_100161115468_100015361967 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.7 Cc1cc(no1)CN[13CH3] 2230a_100000745230_200025704644 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.7 Cc1cc(no1)CN[13CH3] 34a_100000745230_200025704644 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.7 Cc1cc(no1)CO[13CH3] 34a_100011216401_200025704644 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.7 Cc1cc(no1)CS[13CH3] 62a_100000199038_200025704644 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.7 Cc1cc(no1)CS[13CH3] 62a_200025704644_100000199038 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.7 Cc1cc(on1)CN[13CH3] 2230a_100000745748_200025704644 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.7 Cc1cc(on1)CN[13CH3] 34a_100000745748_200025704644 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.7 Cc1cc(on1)CO[13CH3] 34a_100000684692_200025704644 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.7 Cc1cc(on1)CS[13CH3] 62a_100000707947_200025704644 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.7 Cc1cc(on1)CS[13CH3] 62a_200025704644_100000707947 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.7 Cc1ccc(o1)CN[13CH3] 34a_100011194323_200025704644 [1,1,0,0,0,0|1,0,0]=3 824 B9R1.7 Cc1ccc(o1)CO[13CH3] 34a_100011232665_200025704644 [1,1,0,0,0,0|1,0,0]=3 825 B9R1.7 Cc1ccc(o1)CO[13CH3] 7a_100011232665_200025704644 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.7 Cc1ccc(s1)CN[13CH3] 2230a_100000238518_200025704644 [1,1,0,0,0,0|1,1,0]=4 827 B9R1.7 Cc1ccc(s1)CO[13CH3] 34a_100000238367_200025704644 [1,1,0,0,0,0|1,1,0]=4 828 B9R1.7 Cc1cnc(o1)CN[13CH3] 2230a_100138411809_200025704644 [1,1,0,0,0,0|0,0,0]=2 829 B9R1.7 Cc1cnc(o1)CN[13CH3] 34a_100138411809_200025704644 [1,1,0,0,0,0|0,0,0]=2 830 B9R1.7 Cc1cnc(s1)SCF 62a_100000690809_100015361967 [1,1,0,0,0,0|1,1,0]=4 831 B9R1.7 Cc1cnc(s1)SCF 62a_100015361967_100000690809 [1,1,0,0,0,0|1,1,0]=4 832 B9R1.7 Cc1csc(c1)CN[13CH3] 2230a_100015204214_200025704644 [1,1,0,0,0,0|1,1,0]=4 833 B9R1.7 Cc1csc(c1)CN[13CH3] 34a_100015204214_200025704644 [1,1,0,0,0,0|1,1,0]=4 834 B9R1.7 Cc1csc(c1)CO[13CH3] 34a_200000068372_200025704644 [1,1,0,0,0,0|1,1,0]=4 835 B9R1.7 Cc1csc(c1)CO[13CH3] 7a_200000068372_200025704644 [1,1,0,0,0,0|1,1,0]=4 836 B9R1.7 Cc1csc(n1)CN[13CH3] 2230a_100015183719_200025704644 [1,1,0,0,0,0|0,1,0]=3 837 B9R1.7 Cc1csc(n1)SCF 62a_100011291629_100015361967 [1,1,0,0,0,0|1,1,0]=4 838 B9R1.7 Cc1csc(n1)SCF 62a_100015361967_100011291629 [1,1,0,0,0,0|1,1,0]=4 839 B9R1.7 Cc1nc(co1)CO[13CH3] 34a_100012017233_200025704644 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.7 Cc1nc(cs1)CN[13CH3] 34a_100000707933_200025704644 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.7 Cc1nc(cs1)CO[13CH3] 34a_100000735831_200025704644 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.7 Cc1nc(cs1)CS[13CH3] 62a_100015186478_200025704644 [1,1,0,0,0,0|2,0,0]=4 843 B9R1.7 Cc1nc(cs1)CS[13CH3] 62a_200025704644_100015186478 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.7 Cc1nc(n[nH]1)CN[13CH3] 2230a_100000752542_200025704644 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.7 Cc1nc(no1)CS[13CH3] 62a_100000231061_200025704644 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.7 Cc1nc(no1)CS[13CH3] 62a_200025704644_100000231061 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.7 Cc1nnc(o1)CN[13CH3] 2230a_200000236979_200025704644 [1,1,0,0,0,0|1,0,0]=3 848 B9R1.7 Cc1nnc(o1)CN[13CH3] 34a_200000236979_200025704644 [1,1,0,0,0,0|1,0,0]=3 849 B9R1.7 Cc1nnc(o1)CO[13CH3] 34a_100000749586_200025704644 [1,1,0,0,0,0|1,0,0]=3 850 B9R1.7 Cc1nnc(o1)CS[13CH3] 62a_100000181450_200025704644 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.7 Cc1nnc(o1)CS[13CH3] 62a_200025704644_100000181450 [1,1,0,0,0,0|1,0,0]=3 852 B9R1.7 Cc1nnc(o1)SCF 62a_100015361967_100000708914 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.7 Cc1nnc(s1)CS[13CH3] 62a_100000688753_200025704644 [1,1,0,0,0,0|1,1,0]=4 854 B9R1.7 Cc1nnc(s1)CS[13CH3] 62a_200025704644_100000688753 [1,1,0,0,0,0|1,1,0]=4 855 B9R1.7 Cc1noc(n1)CCO 270196a_100000212224_100011216618 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.7 Cc1noc(n1)CO[13CH3] 34a_100000749583_200025704644 [1,1,0,0,0,0|1,0,0]=3 857 B9R1.7 Cc1noc(n1)CS[13CH3] 62a_100000735555_200025704644 [1,1,0,0,0,0|1,0,0]=3 858 B9R1.7 Cc1noc(n1)CS[13CH3] 62a_200025704644_100000735555 [1,1,0,0,0,0|1,0,0]=3 859 B9R1.7 Cn1ccc(n1)CN[13CH3] 2230a_100020636201_200025704644 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.7 Cn1ccc(n1)CN[13CH3] 34a_100020636201_200025704644 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.7 Cn1ccc(n1)CO[13CH3] 34a_100000744484_200025704644 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.7 Cn1ccc(n1)CS[13CH3] 62a_100000726502_200025704644 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.7 Cn1ccc(n1)CS[13CH3] 62a_200025704644_100000726502 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.7 Cn1cnc(c1)CO[13CH3] 34a_100000710007_200025704644 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.7 Cn1cnc(c1)CS[13CH3] 62a_100000717665_200025704644 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.7 Cn1cnc(c1)CS[13CH3] 62a_200025704644_100000717665 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.7 Cn1cnc(n1)CN[13CH3] 2230a_100000695864_200025704644 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.7 Cn1cnc(n1)CS[13CH3] 62a_100016995526_200025704644 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.7 Cn1cnc(n1)CS[13CH3] 62a_200025704644_100016995526 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.7 [13CH3]NCc1ccc(o1)Br 34a_100000708654_200025704644 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.7 [13CH3]OCc1ccc(o1)Br 34a_100000246276_200025704644 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.7 [13CH3]OCc1ccc(o1)Br 7a_100000246276_200025704644 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.7 [13CH3]OCc1nc(cs1)Br 7a_100012000107_200025704644 [1,1,0,0,0,0|1,1,0]=4 874 B9R1.21 C=Cc1noc(n1)CC 271570a_100011290941_100012003642 [1,1,0,0,0,0|1,0,1]=4 875 B9R1.21 CCc1cc(cs1)SC 62a_100009846239_200000210301 [1,1,0,0,0,0|1,1,0]=4 876 B9R1.21 CCc1cc(cs1)SC 62a_200000210301_100009846239 [1,1,0,0,0,0|1,1,0]=4 877 B9R1.21 CCc1cc(cs1)S[13CH3] 62a_100009846239_200025704644 [1,1,0,0,0,0|1,1,0]=4 878 B9R1.21 CCc1cc(cs1)S[13CH3] 62a_200025704644_100009846239 [1,1,0,0,0,0|1,1,0]=4 879 B9R1.21 CCc1cc(no1)OC 34a_200009875660_200000210301 [1,1,0,0,0,0|2,0,0]=4 880 B9R1.21 CCc1cc(no1)O[13CH3] 34a_200009875660_200025704644 [1,1,0,0,0,0|2,0,0]=4 881 B9R1.21 CCc1ccc(s1)SC 62a_100009844052_200000210301 [1,1,0,0,0,0|1,1,0]=4 882 B9R1.21 CCc1ccc(s1)SC 62a_200000210301_100009844052 [1,1,0,0,0,0|1,1,0]=4 883 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_100009844052_200025704644 [1,1,0,0,0,0|1,1,0]=4 884 B9R1.21 CCc1ccc(s1)S[13CH3] 62a_200025704644_100009844052 [1,1,0,0,0,0|1,1,0]=4 885 B9R1.21 CCc1nc(no1)CF 270196a_200000032654_100000210414 [1,1,0,0,0,0|1,0,0]=3 886 B9R1.21 CCc1nc(no1)NC 27a_100102657272_100012003642 [1,1,0,0,0,0|1,0,0]=3 887 B9R1.21 CCc1nc(no1)SC 62a_100012003642_200000210301 [1,1,0,0,0,0|1,0,0]=3 888 B9R1.21 CCc1nc(no1)SC 62a_200000210301_100012003642 [1,1,0,0,0,0|1,0,0]=3 889 B9R1.21 CCc1nc(no1)S[13CH3] 62a_100012003642_200025704644 [1,1,0,0,0,0|1,0,0]=3 890 B9R1.21 CCc1nc(no1)S[13CH3] 62a_200025704644_100012003642 [1,1,0,0,0,0|1,0,0]=3 891 B9R1.21 CCc1noc(n1)CC 270196a_200000212204_100000210414 [1,1,0,0,0,0|1,0,0]=3 892 B9R1.21 CCc1noc(n1)CO 270196a_200000212204_100000210174 [1,1,0,0,0,0|2,0,0]=4 893 B9R1.21 CCn1cc(cn1)OC 34a_100000708037_200000210301 [1,1,0,0,0,0|2,0,0]=4 894 B9R1.21 CCn1cc(cn1)O[13CH3] 34a_100000708037_200025704644 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.21 CCn1cc(cn1)SC 62a_100011400201_200000210301 [1,1,0,0,0,0|2,0,0]=4 896 B9R1.21 CCn1cc(cn1)SC 62a_200000210301_100011400201 [1,1,0,0,0,0|2,0,0]=4 897 B9R1.21 CCn1cc(cn1)S[13CH3] 62a_100011400201_200025704644 [1,1,0,0,0,0|2,0,0]=4 898 B9R1.21 CCn1cc(cn1)S[13CH3] 62a_200025704644_100011400201 [1,1,0,0,0,0|2,0,0]=4 899 B9R1.21 CCn1ccc(n1)SC 62a_100012350556_200000210301 [1,1,0,0,0,0|2,0,0]=4 900 B9R1.21 CCn1ccc(n1)SC 62a_200000210301_100012350556 [1,1,0,0,0,0|2,0,0]=4 901 B9R1.21 CCn1ccc(n1)S[13CH3] 62a_100012350556_200025704644 [1,1,0,0,0,0|2,0,0]=4 902 B9R1.21 CCn1ccc(n1)S[13CH3] 62a_200025704644_100012350556 [1,1,0,0,0,0|2,0,0]=4 903 B9R1.21 COc1nc(cs1)SC 62a_100000727839_200000210301 [1,1,0,0,0,0|1,1,0]=4 904 B9R1.21 COc1nc(cs1)SC 62a_200000210301_100000727839 [1,1,0,0,0,0|1,1,0]=4 905 B9R1.21 COc1nc(cs1)S[13CH3] 62a_100000727839_200025704644 [1,1,0,0,0,0|1,1,0]=4 906 B9R1.21 COc1nc(cs1)S[13CH3] 62a_200025704644_100000727839 [1,1,0,0,0,0|1,1,0]=4 907 B9R1.21 COc1ncc(s1)SC 62a_100000729428_200000210301 [1,1,0,0,0,0|1,1,0]=4 908 B9R1.21 COc1ncc(s1)SC 62a_200000210301_100000729428 [1,1,0,0,0,0|1,1,0]=4 909 B9R1.21 COc1ncc(s1)S[13CH3] 62a_100000729428_200025704644 [1,1,0,0,0,0|1,1,0]=4 910 B9R1.21 COc1ncc(s1)S[13CH3] 62a_200025704644_100000729428 [1,1,0,0,0,0|1,1,0]=4 911 B9R1.21 CSc1ccc(o1)CN 62a_200000210301_100000708654 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.21 CSc1ccc(o1)CO 62a_100000246276_200000210301 [1,1,0,0,0,0|2,0,0]=4 913 B9R1.21 CSc1ccc(o1)CO 62a_200000210301_100000246276 [1,1,0,0,0,0|2,0,0]=4 914 B9R1.21 CSc1cnc(s1)CN 62a_100016991807_200000210301 [1,1,0,0,0,0|1,1,0]=4 915 B9R1.21 CSc1cnc(s1)CN 62a_200000210301_100016991807 [1,1,0,0,0,0|1,1,0]=4 916 B9R1.21 CSc1cnc(s1)CO 62a_100000696694_200000210301 [1,1,0,0,0,0|1,1,0]=4 917 B9R1.21 CSc1cnc(s1)CO 62a_200000210301_100000696694 [1,1,0,0,0,0|1,1,0]=4 918 B9R1.21 CSc1csc(n1)CO 62a_100012000107_200000210301 [1,1,0,0,0,0|1,1,0]=4 919 B9R1.21 CSc1csc(n1)CO 62a_200000210301_100012000107 [1,1,0,0,0,0|1,1,0]=4 920 B9R1.21 CSc1csc(n1)SC 62a_100000732701_200000210301 [1,1,0,0,0,0|1,1,0]=4 921 B9R1.21 CSc1csc(n1)SC 62a_200000210301_100000732701 [1,1,0,0,0,0|1,1,0]=4 922 B9R1.21 CSc1nc(cs1)CO 62a_100009816749_200000210301 [1,1,0,0,0,0|1,1,0]=4 923 B9R1.21 CSc1nc(cs1)CO 62a_200000210301_100009816749 [1,1,0,0,0,0|1,1,0]=4 924 B9R1.21 CSc1nc(cs1)S[13CH3] 62a_100000732701_200025704644 [1,1,0,0,0,0|1,1,0]=4 925 B9R1.21 CSc1nc(cs1)S[13CH3] 62a_200025704644_100000732701 [1,1,0,0,0,0|1,1,0]=4 926 B9R1.21 CSc1ncc(s1)CN 62a_100000726991_200000210301 [1,1,0,0,0,0|1,1,0]=4 927 B9R1.21 CSc1ncc(s1)CN 62a_200000210301_100000726991 [1,1,0,0,0,0|1,1,0]=4 928 B9R1.21 CSc1ncc(s1)CO 62a_100009816753_200000210301 [1,1,0,0,0,0|1,1,0]=4 929 B9R1.21 CSc1ncc(s1)CO 62a_200000210301_100009816753 [1,1,0,0,0,0|1,1,0]=4 930 B9R1.21 OCc1nc(no1)CF 270196a_200000032654_100000210174 [1,1,0,0,0,0|2,0,0]=4 931 B9R1.21 [13CH3]Sc1ccc(o1)CN 62a_200025704644_100000708654 [1,1,0,0,0,0|2,0,0]=4 932 B9R1.21 [13CH3]Sc1ccc(o1)CO 62a_100000246276_200025704644 [1,1,0,0,0,0|2,0,0]=4 933 B9R1.21 [13CH3]Sc1ccc(o1)CO 62a_200025704644_100000246276 [1,1,0,0,0,0|2,0,0]=4 934 B9R1.21 [13CH3]Sc1cnc(s1)CN 62a_100016991807_200025704644 [1,1,0,0,0,0|1,1,0]=4 935 B9R1.21 [13CH3]Sc1cnc(s1)CN 62a_200025704644_100016991807 [1,1,0,0,0,0|1,1,0]=4 936 B9R1.21 [13CH3]Sc1cnc(s1)CO 62a_100000696694_200025704644 [1,1,0,0,0,0|1,1,0]=4 937 B9R1.21 [13CH3]Sc1cnc(s1)CO 62a_200025704644_100000696694 [1,1,0,0,0,0|1,1,0]=4 938 B9R1.21 [13CH3]Sc1csc(n1)CO 62a_100012000107_200025704644 [1,1,0,0,0,0|1,1,0]=4 939 B9R1.21 [13CH3]Sc1csc(n1)CO 62a_200025704644_100012000107 [1,1,0,0,0,0|1,1,0]=4 940 B9R1.21 [13CH3]Sc1nc(cs1)CO 62a_100009816749_200025704644 [1,1,0,0,0,0|1,1,0]=4 941 B9R1.21 [13CH3]Sc1nc(cs1)CO 62a_200025704644_100009816749 [1,1,0,0,0,0|1,1,0]=4 942 B9R1.21 [13CH3]Sc1ncc(s1)CN 62a_100000726991_200025704644 [1,1,0,0,0,0|1,1,0]=4 943 B9R1.21 [13CH3]Sc1ncc(s1)CN 62a_200025704644_100000726991 [1,1,0,0,0,0|1,1,0]=4 944 B9R1.21 [13CH3]Sc1ncc(s1)CO 62a_100009816753_200025704644 [1,1,0,0,0,0|1,1,0]=4 945 B9R1.21 [13CH3]Sc1ncc(s1)CO 62a_200025704644_100009816753 [1,1,0,0,0,0|1,1,0]=4 946 B9R1.22 CCc1nn(cc1O)C 271570a_203496583355_100012396458 [1,1,0,0,0,0|2,0,0]=4 947 B9R1.22 CSc1nc(cn1C)C 62a_100009816808_200000210301 [1,1,0,0,0,0|2,0,0]=4 948 B9R1.22 CSc1nc(cn1C)C 62a_200000210301_100009816808 [1,1,0,0,0,0|2,0,0]=4 949 B9R1.22 Cc1cn(c(n1)S[13CH3])C 62a_100009816808_200025704644 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.22 Cc1cn(c(n1)S[13CH3])C 62a_200025704644_100009816808 [1,1,0,0,0,0|2,0,0]=4 951 B9R1.35 C=C(C)c1nc(c[nH]1)C 271570a_100000694244_100161115468 [1,1,0,0,0,0|1,0,1]=4 952 B9R1.35 C=C(C)c1nc(cs1)C 271570a_100000694244_100011291629 [1,1,0,0,0,0|0,1,1]=4 953 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [1,1,0,0,0,0|0,1,1]=4 954 B9R1.35 C=C(C)c1nnc(o1)C 271570a_100000694244_100000708914 [1,1,0,0,0,0|1,0,1]=4 955 B9R1.35 CC(C)c1nc(cs1)O 271570a_203496583355_200011934575 [1,1,0,0,0,0|1,1,0]=4 956 B9R1.35 Cc1nc(no1)C(C)C 270196a_100000210513_100000070787 [1,1,0,0,0,0|2,0,0]=4 957 B9R1.35 Cc1nnc(o1)N(C)C 27a_100102631434_100000708914 [1,1,0,0,0,0|2,0,0]=4 958 B9R1.35 Cc1noc(n1)C(C)C 270196a_100000212224_100000210198 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.35 Cc1noc(n1)C(C)F 270196a_100000212224_100000062450 [1,1,0,0,0,0|1,0,0]=3 960 B9R1.35 Cc1noc(n1)C(F)F 270196a_100000212224_100000210393 [1,1,0,0,0,0|2,0,0]=4 961 B9R1.35 Cc1noc(n1)C(O)O 270196a_100000212224_100000233687 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.35 Cc1noc(n1)[C@@H](C)O 270196a_100000212224_100000717761 [1,1,0,0,0,0|1,0,0]=3 963 B9R1.35 Cc1noc(n1)[C@H](C)O 270196a_100000212224_217856618621 [1,1,0,0,0,0|1,0,0]=3 964 B9R1.132 CSc1ncc(n1C)C 62a_100009816807_200000210301 [1,1,0,0,0,0|2,0,0]=4 965 B9R1.132 CSc1ncc(n1C)C 62a_200000210301_100009816807 [1,1,0,0,0,0|2,0,0]=4 966 B9R1.132 Cc1cnc(n1C)S[13CH3] 62a_100009816807_200025704644 [1,1,0,0,0,0|2,0,0]=4 967 B9R1.132 Cc1cnc(n1C)S[13CH3] 62a_200025704644_100009816807 [1,1,0,0,0,0|2,0,0]=4 968 B9R1.37 Cc1nn(c(c1O)C)C 271570a_203496583355_100000239273 [1,1,0,0,0,0|2,0,0]=4 969 B11R1.8 COc1nc(nc(c1C)C)C 34a_100000762955_200000210301 [0,1,0,0,0,1|2,0,0]=4 970 B11R1.8 CSc1nc(cc(c1N)C)C 62a_100009816701_200000210301 [0,1,0,0,0,1|2,0,0]=4 971 B11R1.8 CSc1nc(cc(c1N)C)C 62a_200000210301_100009816701 [0,1,0,0,0,1|2,0,0]=4 972 B11R1.8 Cc1cc(c(c(n1)S[13CH3])N)C 62a_100009816701_200025704644 [0,1,0,0,0,1|2,0,0]=4 973 B11R1.8 Cc1cc(c(c(n1)S[13CH3])N)C 62a_200025704644_100009816701 [0,1,0,0,0,1|2,0,0]=4 974 B11R1.8 Cc1nc(c(c(n1)O[13CH3])C)C 34a_100000762955_200025704644 [0,1,0,0,0,1|2,0,0]=4 975 B11R1.9 C=Cc1cc(nc(n1)C)CC 271570a_100011290941_100000761995 [0,1,0,0,0,1|1,0,1]=4 976 B11R1.9 C=Cc1cc(nc(n1)CC)C 271570a_100011290941_100000687827 [0,1,0,0,0,1|1,0,1]=4 977 B11R1.9 CCc1cc(cc(c1)NC)C 2230a_100012022893_200000210301 [0,1,0,0,0,1|2,0,0]=4 978 B11R1.9 CCc1cc(cc(c1)NC)C 34a_100012022893_200000210301 [0,1,0,0,0,1|2,0,0]=4 979 B11R1.9 CCc1cc(cc(c1)NC)C 7a_100012022893_200000210301 [0,1,0,0,0,1|2,0,0]=4 980 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 2230a_100012022893_200025704644 [0,1,0,0,0,1|2,0,0]=4 981 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 34a_100012022893_200025704644 [0,1,0,0,0,1|2,0,0]=4 982 B11R1.9 CCc1cc(cc(c1)N[13CH3])C 7a_100012022893_200025704644 [0,1,0,0,0,1|2,0,0]=4 983 B11R1.9 CCc1cc(cc(n1)CC)O 271570a_203496583355_100010074970 [0,1,0,0,0,1|2,0,0]=4 984 B11R1.9 CCc1cc(nc(n1)C)NC 27a_100102657272_100000761995 [0,1,0,0,0,1|1,0,0]=3 985 B11R1.9 CCc1cc(nc(n1)C)SC 62a_100000761995_200000210301 [0,1,0,0,0,1|1,0,0]=3 986 B11R1.9 CCc1cc(nc(n1)C)SC 62a_200000210301_100000761995 [0,1,0,0,0,1|1,0,0]=3 987 B11R1.9 CCc1cc(nc(n1)C)S[13CH3] 62a_100000761995_200025704644 [0,1,0,0,0,1|1,0,0]=3 988 B11R1.9 CCc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100000761995 [0,1,0,0,0,1|1,0,0]=3 989 B11R1.9 CCc1cc(nc(n1)N)NC 27a_100102657272_100000069509 [0,1,0,0,0,1|2,0,0]=4 990 B11R1.9 CCc1cc(nc(n1)N)SC 62a_100000069509_200000210301 [0,1,0,0,0,1|2,0,0]=4 991 B11R1.9 CCc1cc(nc(n1)N)SC 62a_200000210301_100000069509 [0,1,0,0,0,1|2,0,0]=4 992 B11R1.9 CCc1cc(nc(n1)N)S[13CH3] 62a_100000069509_200025704644 [0,1,0,0,0,1|2,0,0]=4 993 B11R1.9 CCc1cc(nc(n1)N)S[13CH3] 62a_200025704644_100000069509 [0,1,0,0,0,1|2,0,0]=4 994 B11R1.9 CCc1nc(cc(n1)NC)C 27a_100102657272_100000687827 [0,1,0,0,0,1|1,0,0]=3 995 B11R1.9 CCc1nc(cc(n1)SC)C 62a_100000687827_200000210301 [0,1,0,0,0,1|1,0,0]=3 996 B11R1.9 CCc1nc(cc(n1)SC)C 62a_200000210301_100000687827 [0,1,0,0,0,1|1,0,0]=3 997 B11R1.9 CCc1nc(cc(n1)S[13CH3])C 62a_100000687827_200025704644 [0,1,0,0,0,1|1,0,0]=3 998 B11R1.9 CCc1nc(cc(n1)S[13CH3])C 62a_200025704644_100000687827 [0,1,0,0,0,1|1,0,0]=3 999 B11R1.9 CNc1cc(cc(n1)CO)C 27a_100102657272_100000725198 [0,1,0,0,0,1|2,0,0]=4 1000 B11R1.9 CNc1cc(nc(c1)CN)C 27a_100102657272_100010178683 [0,1,0,0,0,1|2,0,0]=4 1001 B11R1.9 CNc1cc(nc(c1)CO)C 27a_100102657272_100010178681 [0,1,0,0,0,1|2,0,0]=4 1002 B11R1.9 CNc1cc(nc(n1)C)NC 27a_100102657272_100000758931 [0,1,0,0,0,1|2,0,0]=4 1003 B11R1.9 CNc1cc(nc(n1)C)OC 27a_100102657272_100011686313 [0,1,0,0,0,1|2,0,0]=4 1004 B11R1.9 CNc1cc(nc(n1)C)SC 27a_100102657272_100011686690 [0,1,0,0,0,1|2,0,0]=4 1005 B11R1.9 CNc1cc(nc(n1)C)SC 62a_100000758931_200000210301 [0,1,0,0,0,1|2,0,0]=4 1006 B11R1.9 CNc1cc(nc(n1)C)SC 62a_200000210301_100000758931 [0,1,0,0,0,1|2,0,0]=4 1007 B11R1.9 CNc1cc(nc(n1)C)S[13CH3] 62a_100000758931_200025704644 [0,1,0,0,0,1|2,0,0]=4 1008 B11R1.9 CNc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100000758931 [0,1,0,0,0,1|2,0,0]=4 1009 B11R1.9 CNc1cc(nc(n1)NC)C 27a_100102657272_100011202761 [0,1,0,0,0,1|2,0,0]=4 1010 B11R1.9 CNc1cc(nc(n1)NC)C 27a_100102657272_100011684537 [0,1,0,0,0,1|2,0,0]=4 1011 B11R1.9 CNc1cc(nc(n1)SC)C 27a_100102657272_100000073727 [0,1,0,0,0,1|2,0,0]=4 1012 B11R1.9 CNc1cc(nc(n1)SC)C 62a_100011684537_200000210301 [0,1,0,0,0,1|2,0,0]=4 1013 B11R1.9 CNc1cc(nc(n1)SC)C 62a_200000210301_100011684537 [0,1,0,0,0,1|2,0,0]=4 1014 B11R1.9 CNc1cc(nc(n1)S[13CH3])C 62a_100011684537_200025704644 [0,1,0,0,0,1|2,0,0]=4 1015 B11R1.9 CNc1cc(nc(n1)S[13CH3])C 62a_200025704644_100011684537 [0,1,0,0,0,1|2,0,0]=4 1016 B11R1.9 CNc1nc(cc(n1)OC)C 27a_100102657272_100000755725 [0,1,0,0,0,1|2,0,0]=4 1017 B11R1.9 CNc1nc(cc(n1)SC)C 27a_100102657272_200011684794 [0,1,0,0,0,1|2,0,0]=4 1018 B11R1.9 CNc1nc(cc(n1)SC)C 62a_100011202761_200000210301 [0,1,0,0,0,1|2,0,0]=4 1019 B11R1.9 CNc1nc(cc(n1)SC)C 62a_200000210301_100011202761 [0,1,0,0,0,1|2,0,0]=4 1020 B11R1.9 CNc1nc(cc(n1)S[13CH3])C 62a_100011202761_200025704644 [0,1,0,0,0,1|2,0,0]=4 1021 B11R1.9 CNc1nc(cc(n1)S[13CH3])C 62a_200025704644_100011202761 [0,1,0,0,0,1|2,0,0]=4 1022 B11R1.9 COc1cc(cc(n1)C)SC 62a_100010067692_200000210301 [0,1,0,0,0,1|2,0,0]=4 1023 B11R1.9 COc1cc(cc(n1)C)SC 62a_200000210301_100010067692 [0,1,0,0,0,1|2,0,0]=4 1024 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_100010067692_200025704644 [0,1,0,0,0,1|2,0,0]=4 1025 B11R1.9 COc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100010067692 [0,1,0,0,0,1|2,0,0]=4 1026 B11R1.9 COc1cc(cc(n1)SC)C 62a_100009856763_200000210301 [0,1,0,0,0,1|2,0,0]=4 1027 B11R1.9 COc1cc(cc(n1)SC)C 62a_200000210301_100009856763 [0,1,0,0,0,1|2,0,0]=4 1028 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_100009856763_200025704644 [0,1,0,0,0,1|2,0,0]=4 1029 B11R1.9 COc1cc(cc(n1)S[13CH3])C 62a_200025704644_100009856763 [0,1,0,0,0,1|2,0,0]=4 1030 B11R1.9 COc1cc(nc(c1)SC)C 62a_200000210301_200009849800 [0,1,0,0,0,1|2,0,0]=4 1031 B11R1.9 COc1cc(nc(c1)SC)C 62a_200009849800_200000210301 [0,1,0,0,0,1|2,0,0]=4 1032 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200009849800_200025704644 [0,1,0,0,0,1|2,0,0]=4 1033 B11R1.9 COc1cc(nc(c1)S[13CH3])C 62a_200025704644_200009849800 [0,1,0,0,0,1|2,0,0]=4 1034 B11R1.9 COc1cc(nc(n1)C)SC 62a_100011686313_200000210301 [0,1,0,0,0,1|2,0,0]=4 1035 B11R1.9 COc1cc(nc(n1)C)SC 62a_200000210301_100011686313 [0,1,0,0,0,1|2,0,0]=4 1036 B11R1.9 COc1cc(nc(n1)C)S[13CH3] 62a_100011686313_200025704644 [0,1,0,0,0,1|2,0,0]=4 1037 B11R1.9 COc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100011686313 [0,1,0,0,0,1|2,0,0]=4 1038 B11R1.9 COc1cc(nc(n1)SC)C 62a_100000755725_200000210301 [0,1,0,0,0,1|2,0,0]=4 1039 B11R1.9 COc1cc(nc(n1)SC)C 62a_200000210301_100000755725 [0,1,0,0,0,1|2,0,0]=4 1040 B11R1.9 COc1cc(nc(n1)S[13CH3])C 62a_100000755725_200025704644 [0,1,0,0,0,1|2,0,0]=4 1041 B11R1.9 COc1cc(nc(n1)S[13CH3])C 62a_200025704644_100000755725 [0,1,0,0,0,1|2,0,0]=4 1042 B11R1.9 CSc1cc(cc(n1)CO)C 62a_100000725198_200000210301 [0,1,0,0,0,1|2,0,0]=4 1043 B11R1.9 CSc1cc(cc(n1)CO)C 62a_200000210301_100000725198 [0,1,0,0,0,1|2,0,0]=4 1044 B11R1.9 CSc1cc(nc(c1)CN)C 62a_100010178683_200000210301 [0,1,0,0,0,1|2,0,0]=4 1045 B11R1.9 CSc1cc(nc(c1)CN)C 62a_200000210301_100010178683 [0,1,0,0,0,1|2,0,0]=4 1046 B11R1.9 CSc1cc(nc(c1)CO)C 62a_100010178681_200000210301 [0,1,0,0,0,1|2,0,0]=4 1047 B11R1.9 CSc1cc(nc(c1)CO)C 62a_200000210301_100010178681 [0,1,0,0,0,1|2,0,0]=4 1048 B11R1.9 CSc1cc(nc(n1)C)SC 62a_100011686690_200000210301 [0,1,0,0,0,1|2,0,0]=4 1049 B11R1.9 CSc1cc(nc(n1)C)SC 62a_200000210301_100011686690 [0,1,0,0,0,1|2,0,0]=4 1050 B11R1.9 CSc1cc(nc(n1)C)S[13CH3] 62a_100011686690_200025704644 [0,1,0,0,0,1|2,0,0]=4 1051 B11R1.9 CSc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100011686690 [0,1,0,0,0,1|2,0,0]=4 1052 B11R1.9 CSc1cc(nc(n1)SC)C 62a_100000073727_200000210301 [0,1,0,0,0,1|2,0,0]=4 1053 B11R1.9 CSc1cc(nc(n1)SC)C 62a_200000210301_100000073727 [0,1,0,0,0,1|2,0,0]=4 1054 B11R1.9 CSc1cc(nc(n1)SC)C 62a_200000210301_200011684794 [0,1,0,0,0,1|2,0,0]=4 1055 B11R1.9 CSc1cc(nc(n1)SC)C 62a_200011684794_200000210301 [0,1,0,0,0,1|2,0,0]=4 1056 B11R1.9 CSc1cc(nc(n1)S[13CH3])C 62a_200011684794_200025704644 [0,1,0,0,0,1|2,0,0]=4 1057 B11R1.9 CSc1cc(nc(n1)S[13CH3])C 62a_200025704644_200011684794 [0,1,0,0,0,1|2,0,0]=4 1058 B11R1.9 CSc1nc(cc(n1)S[13CH3])C 62a_100000073727_200025704644 [0,1,0,0,0,1|2,0,0]=4 1059 B11R1.9 CSc1nc(cc(n1)S[13CH3])C 62a_200025704644_100000073727 [0,1,0,0,0,1|2,0,0]=4 1060 B11R1.9 Cc1cc(cc(n1)CN)S[13CH3] 62a_100010178683_200025704644 [0,1,0,0,0,1|2,0,0]=4 1061 B11R1.9 Cc1cc(cc(n1)CN)S[13CH3] 62a_200025704644_100010178683 [0,1,0,0,0,1|2,0,0]=4 1062 B11R1.9 Cc1cc(cc(n1)CO)S[13CH3] 62a_100010178681_200025704644 [0,1,0,0,0,1|2,0,0]=4 1063 B11R1.9 Cc1cc(cc(n1)CO)S[13CH3] 62a_200025704644_100010178681 [0,1,0,0,0,1|2,0,0]=4 1064 B11R1.9 Cc1cc(nc(c1)S[13CH3])CO 62a_100000725198_200025704644 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.9 Cc1cc(nc(c1)S[13CH3])CO 62a_200025704644_100000725198 [0,1,0,0,0,1|2,0,0]=4 1066 B11R1.14 CSc1cc(c(c(n1)C)N)C 62a_100009817025_200000210301 [0,1,0,0,0,1|2,0,0]=4 1067 B11R1.14 CSc1cc(c(c(n1)C)N)C 62a_200000210301_100009817025 [0,1,0,0,0,1|2,0,0]=4 1068 B11R1.14 Cc1cc(nc(c1N)C)S[13CH3] 62a_100009817025_200025704644 [0,1,0,0,0,1|2,0,0]=4 1069 B11R1.14 Cc1cc(nc(c1N)C)S[13CH3] 62a_200025704644_100009817025 [0,1,0,0,0,1|2,0,0]=4 1070 B11R1.34 CC=Cc1cc(cc(n1)C)C 271570a_100016259895_100000069240 [0,1,0,0,0,1|1,0,1]=4 1071 B11R1.34 CC=Cc1cc(nc(n1)C)C 271570a_100016259895_100000736142 [0,1,0,0,0,1|1,0,1]=4 1072 B11R1.34 CC=Cc1nc(cc(n1)C)C 271570a_100016259895_100000736147 [0,1,0,0,0,1|1,0,1]=4 1073 B11R1.34 CC=Cc1nc(nc(n1)C)C 271570a_100016259895_100015468570 [0,1,0,0,0,1|1,0,1]=4 1074 B11R1.34 CCNc1cc(cc(c1)C)C 2230a_100000210930_100000210202 [0,1,0,0,0,1|2,0,0]=4 1075 B11R1.34 CCNc1cc(cc(c1)C)C 34a_100000210930_100000210202 [0,1,0,0,0,1|2,0,0]=4 1076 B11R1.34 CCNc1cc(cc(c1)C)C 7a_100000210930_100000210202 [0,1,0,0,0,1|2,0,0]=4 1077 B11R1.34 CCNc1cc(cc(n1)C)C 27a_100015525214_100000069240 [0,1,0,0,0,1|1,0,0]=3 1078 B11R1.34 CCNc1cc(cc(n1)F)C 27a_100015525214_100009819601 [0,1,0,0,0,1|2,0,0]=4 1079 B11R1.34 CCNc1cc(nc(c1)C)C 27a_100015525214_100000066820 [0,1,0,0,0,1|2,0,0]=4 1080 B11R1.34 CCNc1cc(nc(n1)C)C 27a_100015525214_100000736142 [0,1,0,0,0,1|1,0,0]=3 1081 B11R1.34 CCNc1cc(nc(n1)C)N 27a_100015525214_100000761517 [0,1,0,0,0,1|2,0,0]=4 1082 B11R1.34 CCNc1cc(nc(n1)C)O 27a_100015525214_106741647437 [0,1,0,0,0,1|2,0,0]=4 1083 B11R1.34 CCNc1cc(nc(n1)N)C 27a_100015525214_100000183061 [0,1,0,0,0,1|2,0,0]=4 1084 B11R1.34 CCNc1nc(cc(n1)C)C 27a_100015525214_100000736147 [0,1,0,0,0,1|1,0,0]=3 1085 B11R1.34 CCNc1nc(cc(n1)N)C 27a_100015525214_100000687285 [0,1,0,0,0,1|2,0,0]=4 1086 B11R1.34 CCNc1nc(nc(n1)C)C 27a_100015525214_100015468570 [0,1,0,0,0,1|1,0,0]=3 1087 B11R1.34 CCNc1nc(nc(n1)N)C 27a_100015525214_200012022553 [0,1,0,0,0,1|2,0,0]=4 1088 B11R1.34 CCOc1cc(=O)cc(o1)C 34a_100016989201_100000210202 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.34 CCOc1cc(cc(c1)C)C 34a_100000210933_100000210202 [0,1,0,0,0,1|2,0,0]=4 1090 B11R1.34 CCOc1cc(cc(c1)C)C 7a_100000210933_100000210202 [0,1,0,0,0,1|2,0,0]=4 1091 B11R1.34 CCOc1cc(nc(n1)O)C 271570a_203496583355_100011684413 [0,1,0,0,0,1|2,0,0]=4 1092 B11R1.34 CCSc1cc(cc(c1)C)C 62a_100000210202_100011215608 [0,1,0,0,0,1|2,0,0]=4 1093 B11R1.34 CCSc1cc(cc(c1)C)C 62a_100011215608_100000210202 [0,1,0,0,0,1|2,0,0]=4 1094 B11R1.34 CCSc1cc(cc(n1)C)C 62a_100000069240_100000210202 [0,1,0,0,0,1|1,0,0]=3 1095 B11R1.34 CCSc1cc(cc(n1)C)C 62a_100000210202_100000069240 [0,1,0,0,0,1|1,0,0]=3 1096 B11R1.34 CCSc1cc(cc(n1)C)N 62a_100000071261_100000210202 [0,1,0,0,0,1|2,0,0]=4 1097 B11R1.34 CCSc1cc(cc(n1)C)N 62a_100000210202_100000071261 [0,1,0,0,0,1|2,0,0]=4 1098 B11R1.34 CCSc1cc(cc(n1)F)C 62a_100000210202_100009819601 [0,1,0,0,0,1|2,0,0]=4 1099 B11R1.34 CCSc1cc(cc(n1)F)C 62a_100009819601_100000210202 [0,1,0,0,0,1|2,0,0]=4 1100 B11R1.34 CCSc1cc(cc(n1)N)C 62a_100000210202_100009819863 [0,1,0,0,0,1|2,0,0]=4 1101 B11R1.34 CCSc1cc(cc(n1)N)C 62a_100009819863_100000210202 [0,1,0,0,0,1|2,0,0]=4 1102 B11R1.34 CCSc1cc(nc(c1)C)C 62a_100000066820_100000210202 [0,1,0,0,0,1|2,0,0]=4 1103 B11R1.34 CCSc1cc(nc(c1)C)C 62a_100000210202_100000066820 [0,1,0,0,0,1|2,0,0]=4 1104 B11R1.34 CCSc1cc(nc(n1)C)C 62a_100000210202_100000736142 [0,1,0,0,0,1|1,0,0]=3 1105 B11R1.34 CCSc1cc(nc(n1)C)C 62a_100000736142_100000210202 [0,1,0,0,0,1|1,0,0]=3 1106 B11R1.34 CCSc1cc(nc(n1)C)N 62a_100000210202_100000761517 [0,1,0,0,0,1|2,0,0]=4 1107 B11R1.34 CCSc1cc(nc(n1)C)N 62a_100000761517_100000210202 [0,1,0,0,0,1|2,0,0]=4 1108 B11R1.34 CCSc1cc(nc(n1)C)O 62a_100000210202_106741647437 [0,1,0,0,0,1|2,0,0]=4 1109 B11R1.34 CCSc1cc(nc(n1)N)C 62a_100000183061_100000210202 [0,1,0,0,0,1|2,0,0]=4 1110 B11R1.34 CCSc1cc(nc(n1)N)C 62a_100000210202_100000183061 [0,1,0,0,0,1|2,0,0]=4 1111 B11R1.34 CCSc1nc(cc(n1)C)C 62a_100000210202_100000736147 [0,1,0,0,0,1|1,0,0]=3 1112 B11R1.34 CCSc1nc(cc(n1)C)C 62a_100000736147_100000210202 [0,1,0,0,0,1|1,0,0]=3 1113 B11R1.34 CCSc1nc(cc(n1)N)C 62a_100000210202_100000687285 [0,1,0,0,0,1|2,0,0]=4 1114 B11R1.34 CCSc1nc(cc(n1)N)C 62a_100000687285_100000210202 [0,1,0,0,0,1|2,0,0]=4 1115 B11R1.34 CCSc1nc(cc(n1)O)C 271570a_203496583355_200000116819 [0,1,0,0,0,1|2,0,0]=4 1116 B11R1.34 CCSc1nc(nc(n1)C)C 62a_100000210202_100015468570 [0,1,0,0,0,1|1,0,0]=3 1117 B11R1.34 CCSc1nc(nc(n1)C)C 62a_100015468570_100000210202 [0,1,0,0,0,1|1,0,0]=3 1118 B11R1.34 CCSc1nc(nc(n1)N)C 62a_100000210202_200012022553 [0,1,0,0,0,1|2,0,0]=4 1119 B11R1.34 CCSc1nc(nc(n1)N)C 62a_200012022553_100000210202 [0,1,0,0,0,1|2,0,0]=4 1120 B11R1.34 CNCc1cc(cc(c1)C)C 207a_100102657272_100000745632 [0,1,0,0,0,1|2,0,0]=4 1121 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_100020591340_200000210301 [0,1,0,0,0,1|2,0,0]=4 1122 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_106832991635_100000181317 [0,1,0,0,0,1|2,0,0]=4 1123 B11R1.34 CNCc1cc(cc(c1)C)C 270004a_106832991635_100000745632 [0,1,0,0,0,1|2,0,0]=4 1124 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100020591340_200000210301 [0,1,0,0,0,1|2,0,0]=4 1125 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100102657272_100000181317 [0,1,0,0,0,1|2,0,0]=4 1126 B11R1.34 CNCc1cc(cc(c1)C)C 7a_106832991635_100000181317 [0,1,0,0,0,1|2,0,0]=4 1127 B11R1.34 CNCc1cc(cc(n1)C)Br 270004a_106832991635_100009814795 [0,1,0,0,0,1|2,0,0]=4 1128 B11R1.34 CNCc1cc(cc(n1)C)C 2230a_106832991635_100012357514 [0,1,0,0,0,1|1,0,0]=3 1129 B11R1.34 CNCc1cc(cc(n1)C)C 34a_100102657272_100012357514 [0,1,0,0,0,1|1,0,0]=3 1130 B11R1.34 CNCc1cc(cc(n1)C)C 7a_106832991635_100012357514 [0,1,0,0,0,1|1,0,0]=3 1131 B11R1.34 CNCc1cc(nc(c1)C)C 207a_100102657272_100011997668 [0,1,0,0,0,1|2,0,0]=4 1132 B11R1.34 CNCc1cc(nc(c1)C)C 2230a_106832991635_200000139866 [0,1,0,0,0,1|2,0,0]=4 1133 B11R1.34 CNCc1cc(nc(c1)C)C 270004a_106832991635_100011997668 [0,1,0,0,0,1|2,0,0]=4 1134 B11R1.34 CNCc1cc(nc(c1)C)C 34a_100102657272_200000139866 [0,1,0,0,0,1|2,0,0]=4 1135 B11R1.34 CNCc1cc(nc(c1)C)C 7a_106832991635_200000139866 [0,1,0,0,0,1|2,0,0]=4 1136 B11R1.34 CNCc1nc(cc(n1)C)C 2230a_106832991635_100011935097 [0,1,0,0,0,1|1,0,0]=3 1137 B11R1.34 CNCc1nc(cc(n1)C)C 34a_100102657272_100011935097 [0,1,0,0,0,1|1,0,0]=3 1138 B11R1.34 CNCc1nc(cc(n1)C)C 7a_106832991635_100011935097 [0,1,0,0,0,1|1,0,0]=3 1139 B11R1.34 COCc1cc(cc(c1)C)C 34a_100011216556_200000210301 [0,1,0,0,0,1|2,0,0]=4 1140 B11R1.34 COCc1cc(cc(c1)C)C 34a_100138415774_100000181317 [0,1,0,0,0,1|2,0,0]=4 1141 B11R1.34 COCc1cc(cc(c1)C)C 7a_100011216556_200000210301 [0,1,0,0,0,1|2,0,0]=4 1142 B11R1.34 COCc1cc(cc(n1)C)Br 34a_100010178681_200000210301 [0,1,0,0,0,1|2,0,0]=4 1143 B11R1.34 COCc1cc(cc(n1)C)C 34a_100012182918_200000210301 [0,1,0,0,0,1|1,0,0]=3 1144 B11R1.34 COCc1cc(cc(n1)C)C 34a_100138415774_100012357514 [0,1,0,0,0,1|1,0,0]=3 1145 B11R1.34 COCc1cc(nc(c1)C)C 34a_100012017140_200000210301 [0,1,0,0,0,1|2,0,0]=4 1146 B11R1.34 COCc1cc(nc(c1)C)C 34a_100138415774_200000139866 [0,1,0,0,0,1|2,0,0]=4 1147 B11R1.34 COCc1nc(cc(n1)C)C 34a_100138415774_100011935097 [0,1,0,0,0,1|1,0,0]=3 1148 B11R1.34 CSCc1cc(cc(c1)C)C 62a_100000181317_200000210301 [0,1,0,0,0,1|2,0,0]=4 1149 B11R1.34 CSCc1cc(cc(c1)C)C 62a_200000210301_100000181317 [0,1,0,0,0,1|2,0,0]=4 1150 B11R1.34 CSCc1cc(cc(n1)C)C 62a_100012357514_200000210301 [0,1,0,0,0,1|1,0,0]=3 1151 B11R1.34 CSCc1cc(cc(n1)C)C 62a_200000210301_100012357514 [0,1,0,0,0,1|1,0,0]=3 1152 B11R1.34 CSCc1cc(nc(c1)C)C 62a_200000139866_200000210301 [0,1,0,0,0,1|2,0,0]=4 1153 B11R1.34 CSCc1cc(nc(c1)C)C 62a_200000210301_200000139866 [0,1,0,0,0,1|2,0,0]=4 1154 B11R1.34 CSCc1nc(cc(n1)C)C 62a_100011935097_200000210301 [0,1,0,0,0,1|1,0,0]=3 1155 B11R1.34 CSCc1nc(cc(n1)C)C 62a_200000210301_100011935097 [0,1,0,0,0,1|1,0,0]=3 1156 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 2230a_100020591340_200025704644 [0,1,0,0,0,1|2,0,0]=4 1157 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 34a_100020591340_200025704644 [0,1,0,0,0,1|2,0,0]=4 1158 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 34a_100011216556_200025704644 [0,1,0,0,0,1|2,0,0]=4 1159 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 7a_100011216556_200025704644 [0,1,0,0,0,1|2,0,0]=4 1160 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_100000181317_200025704644 [0,1,0,0,0,1|2,0,0]=4 1161 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_200025704644_100000181317 [0,1,0,0,0,1|2,0,0]=4 1162 B11R1.34 Cc1cc(cc(n1)C)CO[13CH3] 34a_100012017140_200025704644 [0,1,0,0,0,1|2,0,0]=4 1163 B11R1.34 Cc1cc(cc(n1)C)CS[13CH3] 62a_200000139866_200025704644 [0,1,0,0,0,1|2,0,0]=4 1164 B11R1.34 Cc1cc(cc(n1)C)CS[13CH3] 62a_200025704644_200000139866 [0,1,0,0,0,1|2,0,0]=4 1165 B11R1.34 Cc1cc(cc(n1)CO[13CH3])Br 34a_100010178681_200025704644 [0,1,0,0,0,1|2,0,0]=4 1166 B11R1.34 Cc1cc(nc(c1)CO[13CH3])C 34a_100012182918_200025704644 [0,1,0,0,0,1|1,0,0]=3 1167 B11R1.34 Cc1cc(nc(c1)CS[13CH3])C 62a_100012357514_200025704644 [0,1,0,0,0,1|1,0,0]=3 1168 B11R1.34 Cc1cc(nc(c1)CS[13CH3])C 62a_200025704644_100012357514 [0,1,0,0,0,1|1,0,0]=3 1169 B11R1.34 Cc1cc(nc(c1)SCF)C 62a_100000069240_100015361967 [0,1,0,0,0,1|2,0,0]=4 1170 B11R1.34 Cc1cc(nc(c1)SCF)C 62a_100015361967_100000069240 [0,1,0,0,0,1|2,0,0]=4 1171 B11R1.34 Cc1cc(nc(n1)C)SCF 62a_100000736142_100015361967 [0,1,0,0,0,1|2,0,0]=4 1172 B11R1.34 Cc1cc(nc(n1)C)SCF 62a_100015361967_100000736142 [0,1,0,0,0,1|2,0,0]=4 1173 B11R1.34 Cc1cc(nc(n1)CS[13CH3])C 62a_100011935097_200025704644 [0,1,0,0,0,1|1,0,0]=3 1174 B11R1.34 Cc1cc(nc(n1)CS[13CH3])C 62a_200025704644_100011935097 [0,1,0,0,0,1|1,0,0]=3 1175 B11R1.34 Cc1cc(nc(n1)SCF)C 62a_100000736147_100015361967 [0,1,0,0,0,1|2,0,0]=4 1176 B11R1.34 Cc1cc(nc(n1)SCF)C 62a_100015361967_100000736147 [0,1,0,0,0,1|2,0,0]=4 1177 B11R1.34 Cc1nc(nc(n1)SCF)C 62a_100015361967_100015468570 [0,1,0,0,0,1|2,0,0]=4 1178 B11R1.34 Cc1nc(nc(n1)SCF)C 62a_100015468570_100015361967 [0,1,0,0,0,1|2,0,0]=4 1179 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [0,1,0,0,0,1|1,0,1]=4 1180 B11R1.74 C=C(C)c1cc(nc(n1)C)C 271570a_100000694244_100000736142 [0,1,0,0,0,1|1,0,1]=4 1181 B11R1.74 C=C(C)c1nc(cc(n1)C)C 271570a_100000694244_100000736147 [0,1,0,0,0,1|1,0,1]=4 1182 B11R1.74 C=C(C)c1nc(nc(n1)C)C 271570a_100000694244_100015468570 [0,1,0,0,0,1|1,0,1]=4 1183 B11R1.74 Cc1cc(nc(c1)N(C)C)C 27a_100102631434_100000069240 [0,1,0,0,0,1|2,0,0]=4 1184 B11R1.74 Cc1cc(nc(n1)C(C)C)O 271570a_203496583355_100000217492 [0,1,0,0,0,1|2,0,0]=4 1185 B11R1.74 Cc1cc(nc(n1)C)N(C)C 27a_100102631434_100000736142 [0,1,0,0,0,1|2,0,0]=4 1186 B11R1.74 Cc1cc(nc(n1)N(C)C)C 27a_100102631434_100000736147 [0,1,0,0,0,1|2,0,0]=4 1187 B11R1.74 Cc1nc(cc(n1)C(C)C)O 271570a_203496583355_100011315409 [0,1,0,0,0,1|2,0,0]=4 1188 B11R1.74 Cc1nc(nc(n1)N(C)C)C 27a_100102631434_100015468570 [0,1,0,0,0,1|2,0,0]=4 1189 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [0,1,0,0,0,1|1,0,1]=4 1190 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [0,1,0,0,0,1|1,0,1]=4 1191 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [0,1,0,0,0,1|1,0,1]=4 1192 B11R1.21 C=C(C)c1cnc(c(n1)C)C 271570a_100000694244_100009878948 [0,1,0,0,0,1|1,0,1]=4 1193 B11R1.21 Cc1cc(ncc1O)C(C)C 271570a_203496583355_100021475462 [0,1,0,0,0,1|2,0,0]=4 1194 B11R1.21 Cc1ncc(nc1C)N(C)C 27a_100102631434_100009878948 [0,1,0,0,0,1|2,0,0]=4 1195 B11R1.192 CC=Cc1cc(c(cn1)C)C 271570a_100016259895_100009850809 [0,1,0,0,0,1|1,0,1]=4 1196 B11R1.192 CC=Cc1ccc(c(n1)C)C 271570a_100016259895_100000103781 [0,1,0,0,0,1|1,0,1]=4 1197 B11R1.192 CC=Cc1cnc(c(c1)C)C 271570a_100016259895_100000697892 [0,1,0,0,0,1|1,0,1]=4 1198 B11R1.192 CC=Cc1cnc(c(n1)C)C 271570a_100016259895_100009878948 [0,1,0,0,0,1|1,0,1]=4 1199 B11R1.192 CCNc1cc(c(cn1)C)F 27a_100015525214_100009841206 [0,1,0,0,0,1|2,0,0]=4 1200 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [0,1,0,0,0,1|2,0,0]=4 1201 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [0,1,0,0,0,1|2,0,0]=4 1202 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [0,1,0,0,0,1|2,0,0]=4 1203 B11R1.192 CCNc1cnc(c(n1)C)C 27a_100015525214_100009878948 [0,1,0,0,0,1|1,0,0]=3 1204 B11R1.192 CCNc1ncc(c(n1)C)Cl 27a_100015525214_100010174973 [0,1,0,0,0,1|2,0,0]=4 1205 B11R1.192 CCNc1ncc(c(n1)C)F 27a_100015525214_100015641512 [0,1,0,0,0,1|2,0,0]=4 1206 B11R1.192 CCNc1ncc(c(n1)C)N 27a_100015525214_100000123670 [0,1,0,0,0,1|2,0,0]=4 1207 B11R1.192 CCNc1ncc(c(n1)N)C 27a_100015525214_100011996698 [0,1,0,0,0,1|2,0,0]=4 1208 B11R1.192 CCOc1cc(c(cn1)Br)C 34a_100000766222_100000210202 [0,1,0,0,0,1|2,0,0]=4 1209 B11R1.192 CCOc1cc(c(cn1)C)Br 34a_100009831917_100000210202 [0,1,0,0,0,1|2,0,0]=4 1210 B11R1.192 CCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210202 [0,1,0,0,0,1|2,0,0]=4 1211 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [0,1,0,0,0,1|2,0,0]=4 1212 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [0,1,0,0,0,1|2,0,0]=4 1213 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [0,1,0,0,0,1|2,0,0]=4 1214 B11R1.192 CCOc1ccc(c(n1)C)Br 34a_100000691680_100000210202 [0,1,0,0,0,1|2,0,0]=4 1215 B11R1.192 CCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210202 [0,1,0,0,0,1|2,0,0]=4 1216 B11R1.192 CCOc1cnc(c(c1)Br)C 34a_100009819603_100000210202 [0,1,0,0,0,1|2,0,0]=4 1217 B11R1.192 CCOc1cnc(c(c1)Br)C 7a_100009819603_100000210202 [0,1,0,0,0,1|2,0,0]=4 1218 B11R1.192 CCOc1cnc(c(c1)C)Br 34a_100012000486_100000210202 [0,1,0,0,0,1|2,0,0]=4 1219 B11R1.192 CCOc1cnc(c(c1)C)Br 7a_100012000486_100000210202 [0,1,0,0,0,1|2,0,0]=4 1220 B11R1.192 CCOc1cnc(c(c1)C)C 34a_100009854398_100000210202 [0,1,0,0,0,1|1,0,0]=3 1221 B11R1.192 CCOc1cnc(c(c1)C)C 7a_100009854398_100000210202 [0,1,0,0,0,1|1,0,0]=3 1222 B11R1.192 CCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210202 [0,1,0,0,0,1|2,0,0]=4 1223 B11R1.192 CCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210202 [0,1,0,0,0,1|2,0,0]=4 1224 B11R1.192 CCOc1cnc(c(c1)C)F 34a_100000094615_100000210202 [0,1,0,0,0,1|2,0,0]=4 1225 B11R1.192 CCOc1cnc(c(c1)C)F 7a_100000094615_100000210202 [0,1,0,0,0,1|2,0,0]=4 1226 B11R1.192 CCOc1cnc(c(n1)C)C 34a_200000700380_100000210202 [0,1,0,0,0,1|1,0,0]=3 1227 B11R1.192 CCSc1c[nH]c(=O)c(n1)C 62a_100000210202_100010363809 [0,1,0,0,0,1|2,0,0]=4 1228 B11R1.192 CCSc1c[nH]c(=O)c(n1)C 62a_100010363809_100000210202 [0,1,0,0,0,1|2,0,0]=4 1229 B11R1.192 CCSc1cc(c(=O)[nH]n1)C 62a_100000210202_100012187101 [0,1,0,0,0,1|2,0,0]=4 1230 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100000210202_100012356354 [0,1,0,0,0,1|2,0,0]=4 1231 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100012356354_100000210202 [0,1,0,0,0,1|2,0,0]=4 1232 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100000210202_100009850809 [0,1,0,0,0,1|1,0,0]=3 1233 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100009850809_100000210202 [0,1,0,0,0,1|1,0,0]=3 1234 B11R1.192 CCSc1cc(c(cn1)C)F 62a_100000210202_100009841206 [0,1,0,0,0,1|2,0,0]=4 1235 B11R1.192 CCSc1cc(c(cn1)C)F 62a_100009841206_100000210202 [0,1,0,0,0,1|2,0,0]=4 1236 B11R1.192 CCSc1cc(c(cn1)C)N 62a_100000126663_100000210202 [0,1,0,0,0,1|2,0,0]=4 1237 B11R1.192 CCSc1cc(c(cn1)C)N 62a_100000210202_100000126663 [0,1,0,0,0,1|2,0,0]=4 1238 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000210202_100000704368 [0,1,0,0,0,1|2,0,0]=4 1239 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000704368_100000210202 [0,1,0,0,0,1|2,0,0]=4 1240 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100000210202_100009818257 [0,1,0,0,0,1|2,0,0]=4 1241 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100009818257_100000210202 [0,1,0,0,0,1|2,0,0]=4 1242 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000067204_100000210202 [0,1,0,0,0,1|2,0,0]=4 1243 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000210202_100000067204 [0,1,0,0,0,1|2,0,0]=4 1244 B11R1.192 CCSc1cc(c(cn1)O)C 62a_100000210202_100000692680 [0,1,0,0,0,1|2,0,0]=4 1245 B11R1.192 CCSc1cc(c(nn1)N)C 62a_100000210202_100153394926 [0,1,0,0,0,1|2,0,0]=4 1246 B11R1.192 CCSc1cc(c(nn1)N)C 62a_100153394926_100000210202 [0,1,0,0,0,1|2,0,0]=4 1247 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [0,1,0,0,0,1|2,0,0]=4 1248 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [0,1,0,0,0,1|2,0,0]=4 1249 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100000210202_100012360386 [0,1,0,0,0,1|2,0,0]=4 1250 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100012360386_100000210202 [0,1,0,0,0,1|2,0,0]=4 1251 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000103781_100000210202 [0,1,0,0,0,1|1,0,0]=3 1252 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000210202_100000103781 [0,1,0,0,0,1|1,0,0]=3 1253 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100000210202_100009814307 [0,1,0,0,0,1|2,0,0]=4 1254 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100009814307_100000210202 [0,1,0,0,0,1|2,0,0]=4 1255 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000210202_100000720120 [0,1,0,0,0,1|2,0,0]=4 1256 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000720120_100000210202 [0,1,0,0,0,1|2,0,0]=4 1257 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [0,1,0,0,0,1|2,0,0]=4 1258 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [0,1,0,0,0,1|2,0,0]=4 1259 B11R1.192 CCSc1ccc(c(n1)N)C 62a_100000210202_100009857032 [0,1,0,0,0,1|2,0,0]=4 1260 B11R1.192 CCSc1ccc(c(n1)N)C 62a_100009857032_100000210202 [0,1,0,0,0,1|2,0,0]=4 1261 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100000210202_100009816107 [0,1,0,0,0,1|2,0,0]=4 1262 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100009816107_100000210202 [0,1,0,0,0,1|2,0,0]=4 1263 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000210202_100000697892 [0,1,0,0,0,1|1,0,0]=3 1264 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000697892_100000210202 [0,1,0,0,0,1|1,0,0]=3 1265 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100000210202_100009922867 [0,1,0,0,0,1|2,0,0]=4 1266 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100009922867_100000210202 [0,1,0,0,0,1|2,0,0]=4 1267 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000210202_100000709442 [0,1,0,0,0,1|2,0,0]=4 1268 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000709442_100000210202 [0,1,0,0,0,1|2,0,0]=4 1269 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000210202_100000684428 [0,1,0,0,0,1|2,0,0]=4 1270 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000684428_100000210202 [0,1,0,0,0,1|2,0,0]=4 1271 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000210202_100000685391 [0,1,0,0,0,1|2,0,0]=4 1272 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000685391_100000210202 [0,1,0,0,0,1|2,0,0]=4 1273 B11R1.192 CCSc1cnc(c(c1)F)C 62a_100000210202_100009845756 [0,1,0,0,0,1|2,0,0]=4 1274 B11R1.192 CCSc1cnc(c(c1)F)C 62a_100009845756_100000210202 [0,1,0,0,0,1|2,0,0]=4 1275 B11R1.192 CCSc1cnc(c(c1)N)C 62a_100000210202_100011999542 [0,1,0,0,0,1|2,0,0]=4 1276 B11R1.192 CCSc1cnc(c(c1)N)C 62a_100011999542_100000210202 [0,1,0,0,0,1|2,0,0]=4 1277 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100000210202_100009864810 [0,1,0,0,0,1|2,0,0]=4 1278 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100009864810_100000210202 [0,1,0,0,0,1|2,0,0]=4 1279 B11R1.192 CCSc1cnc(c(n1)C)C 62a_100000210202_100009878948 [0,1,0,0,0,1|1,0,0]=3 1280 B11R1.192 CCSc1cnc(c(n1)C)C 62a_100009878948_100000210202 [0,1,0,0,0,1|1,0,0]=3 1281 B11R1.192 CCSc1cnc(c(n1)C)N 62a_100000210202_100009818571 [0,1,0,0,0,1|2,0,0]=4 1282 B11R1.192 CCSc1cnc(c(n1)C)N 62a_100009818571_100000210202 [0,1,0,0,0,1|2,0,0]=4 1283 B11R1.192 CCSc1ncc(c(n1)C)Cl 62a_100000210202_100010174973 [0,1,0,0,0,1|2,0,0]=4 1284 B11R1.192 CCSc1ncc(c(n1)C)Cl 62a_100010174973_100000210202 [0,1,0,0,0,1|2,0,0]=4 1285 B11R1.192 CCSc1ncc(c(n1)C)F 62a_100000210202_100015641512 [0,1,0,0,0,1|2,0,0]=4 1286 B11R1.192 CCSc1ncc(c(n1)C)F 62a_100015641512_100000210202 [0,1,0,0,0,1|2,0,0]=4 1287 B11R1.192 CCSc1ncc(c(n1)C)N 62a_100000123670_100000210202 [0,1,0,0,0,1|2,0,0]=4 1288 B11R1.192 CCSc1ncc(c(n1)C)N 62a_100000210202_100000123670 [0,1,0,0,0,1|2,0,0]=4 1289 B11R1.192 CCSc1ncc(c(n1)N)C 62a_100000210202_100011996698 [0,1,0,0,0,1|2,0,0]=4 1290 B11R1.192 CCSc1ncc(c(n1)N)C 62a_100011996698_100000210202 [0,1,0,0,0,1|2,0,0]=4 1291 B11R1.192 CNCc1cc(c(cn1)Br)C 207a_100102657272_100009814806 [0,1,0,0,0,1|2,0,0]=4 1292 B11R1.192 CNCc1cc(c(cn1)Br)C 270004a_106832991635_100009814806 [0,1,0,0,0,1|2,0,0]=4 1293 B11R1.192 CNCc1cc(c(cn1)C)Br 207a_100102657272_100010174032 [0,1,0,0,0,1|2,0,0]=4 1294 B11R1.192 CNCc1cc(c(cn1)C)Br 270004a_106832991635_100010174032 [0,1,0,0,0,1|2,0,0]=4 1295 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [0,1,0,0,0,1|2,0,0]=4 1296 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [0,1,0,0,0,1|2,0,0]=4 1297 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [0,1,0,0,0,1|2,0,0]=4 1298 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [0,1,0,0,0,1|2,0,0]=4 1299 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [0,1,0,0,0,1|2,0,0]=4 1300 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [0,1,0,0,0,1|2,0,0]=4 1301 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [0,1,0,0,0,1|2,0,0]=4 1302 B11R1.192 CNCc1ccc(c(n1)C)Br 207a_100102657272_100010238520 [0,1,0,0,0,1|2,0,0]=4 1303 B11R1.192 CNCc1ccc(c(n1)C)Br 270004a_106832991635_100010238520 [0,1,0,0,0,1|2,0,0]=4 1304 B11R1.192 CNCc1ccc(c(n1)C)C 2230a_202515432893_200000210301 [0,1,0,0,0,1|1,0,0]=3 1305 B11R1.192 CNCc1ccc(c(n1)C)C 34a_202515432893_200000210301 [0,1,0,0,0,1|1,0,0]=3 1306 B11R1.192 CNCc1cnc(c(c1)C)Br 270004a_106832991635_100009814818 [0,1,0,0,0,1|2,0,0]=4 1307 B11R1.192 CNCc1cnc(c(c1)C)Cl 207a_100102657272_100000070293 [0,1,0,0,0,1|2,0,0]=4 1308 B11R1.192 CNCc1cnc(c(c1)C)Cl 270004a_106832991635_100000070293 [0,1,0,0,0,1|2,0,0]=4 1309 B11R1.192 CNCc1cnc(c(c1)C)F 270004a_106832991635_100000050577 [0,1,0,0,0,1|2,0,0]=4 1310 B11R1.192 COCc1cc(c(cn1)Br)C 34a_200010713146_200000210301 [0,1,0,0,0,1|2,0,0]=4 1311 B11R1.192 COCc1cc(c(cn1)C)Br 34a_100010113723_200000210301 [0,1,0,0,0,1|2,0,0]=4 1312 B11R1.192 COCc1cc(c(cn1)C)Br 7a_100010113723_200000210301 [0,1,0,0,0,1|2,0,0]=4 1313 B11R1.192 COCc1cc(c(cn1)C)Cl 34a_200000144627_200000210301 [0,1,0,0,0,1|2,0,0]=4 1314 B11R1.192 COCc1cc(c(cn1)C)Cl 7a_200000144627_200000210301 [0,1,0,0,0,1|2,0,0]=4 1315 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [0,1,0,0,0,1|2,0,0]=4 1316 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [0,1,0,0,0,1|2,0,0]=4 1317 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [0,1,0,0,0,1|2,0,0]=4 1318 B11R1.192 COCc1ccc(c(n1)C)Br 34a_100010114280_200000210301 [0,1,0,0,0,1|2,0,0]=4 1319 B11R1.192 COCc1ccc(c(n1)C)F 34a_200009884719_200000210301 [0,1,0,0,0,1|2,0,0]=4 1320 B11R1.192 COCc1cnc(c(c1)C)Cl 34a_200000092119_200000210301 [0,1,0,0,0,1|2,0,0]=4 1321 B11R1.192 COCc1cnc(c(c1)C)Cl 7a_200000092119_200000210301 [0,1,0,0,0,1|2,0,0]=4 1322 B11R1.192 COCc1cnc(c(c1)F)C 34a_100009839834_200000210301 [0,1,0,0,0,1|2,0,0]=4 1323 B11R1.192 COCc1cnc(c(c1)F)C 7a_100009839834_200000210301 [0,1,0,0,0,1|2,0,0]=4 1324 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [0,1,0,0,0,1|2,0,0]=4 1325 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [0,1,0,0,0,1|2,0,0]=4 1326 B11R1.192 Cc1cc(cnc1C)OCF 34a_100009854398_100015361967 [0,1,0,0,0,1|2,0,0]=4 1327 B11R1.192 Cc1cc(cnc1C)OCF 7a_100009854398_100015361967 [0,1,0,0,0,1|2,0,0]=4 1328 B11R1.192 Cc1cc(cnc1C)SCF 62a_100000697892_100015361967 [0,1,0,0,0,1|2,0,0]=4 1329 B11R1.192 Cc1cc(cnc1C)SCF 62a_100015361967_100000697892 [0,1,0,0,0,1|2,0,0]=4 1330 B11R1.192 Cc1cc(cnc1Cl)CO[13CH3] 34a_200000092119_200025704644 [0,1,0,0,0,1|2,0,0]=4 1331 B11R1.192 Cc1cc(cnc1Cl)CO[13CH3] 7a_200000092119_200025704644 [0,1,0,0,0,1|2,0,0]=4 1332 B11R1.192 Cc1cc(ncc1Br)CO[13CH3] 34a_200010713146_200025704644 [0,1,0,0,0,1|2,0,0]=4 1333 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [0,1,0,0,0,1|2,0,0]=4 1334 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [0,1,0,0,0,1|2,0,0]=4 1335 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [0,1,0,0,0,1|2,0,0]=4 1336 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [0,1,0,0,0,1|2,0,0]=4 1337 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [0,1,0,0,0,1|2,0,0]=4 1338 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [0,1,0,0,0,1|2,0,0]=4 1339 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 2230a_202515432893_200025704644 [0,1,0,0,0,1|1,0,0]=3 1340 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 34a_202515432893_200025704644 [0,1,0,0,0,1|1,0,0]=3 1341 B11R1.192 Cc1ccc(nc1C)SCF 62a_100000103781_100015361967 [0,1,0,0,0,1|2,0,0]=4 1342 B11R1.192 Cc1ccc(nc1C)SCF 62a_100015361967_100000103781 [0,1,0,0,0,1|2,0,0]=4 1343 B11R1.192 Cc1cnc(cc1Br)CO[13CH3] 34a_100010113723_200025704644 [0,1,0,0,0,1|2,0,0]=4 1344 B11R1.192 Cc1cnc(cc1Br)CO[13CH3] 7a_100010113723_200025704644 [0,1,0,0,0,1|2,0,0]=4 1345 B11R1.192 Cc1cnc(cc1C)SCF 62a_100009850809_100015361967 [0,1,0,0,0,1|2,0,0]=4 1346 B11R1.192 Cc1cnc(cc1C)SCF 62a_100015361967_100009850809 [0,1,0,0,0,1|2,0,0]=4 1347 B11R1.192 Cc1cnc(cc1Cl)CO[13CH3] 34a_200000144627_200025704644 [0,1,0,0,0,1|2,0,0]=4 1348 B11R1.192 Cc1cnc(cc1Cl)CO[13CH3] 7a_200000144627_200025704644 [0,1,0,0,0,1|2,0,0]=4 1349 B11R1.192 Cc1nc(ccc1Br)CO[13CH3] 34a_100010114280_200025704644 [0,1,0,0,0,1|2,0,0]=4 1350 B11R1.192 Cc1nc(ccc1F)CO[13CH3] 34a_200009884719_200025704644 [0,1,0,0,0,1|2,0,0]=4 1351 B11R1.192 Cc1ncc(cc1F)CO[13CH3] 34a_100009839834_200025704644 [0,1,0,0,0,1|2,0,0]=4 1352 B11R1.192 Cc1ncc(cc1F)CO[13CH3] 7a_100009839834_200025704644 [0,1,0,0,0,1|2,0,0]=4 1353 B11R1.192 Cc1ncc(nc1C)OCF 34a_200000700380_100015361967 [0,1,0,0,0,1|2,0,0]=4 1354 B11R1.192 Cc1ncc(nc1C)SCF 62a_100009878948_100015361967 [0,1,0,0,0,1|2,0,0]=4 1355 B11R1.192 Cc1ncc(nc1C)SCF 62a_100015361967_100009878948 [0,1,0,0,0,1|2,0,0]=4 1356 B11R1.277 COc1nc(c(nc1Cl)C)C 34a_100000717854_200000210301 [0,1,0,0,0,1|2,0,0]=4 1357 B11R1.277 CSc1cc(c(nc1N)C)C 62a_100009990238_200000210301 [0,1,0,0,0,1|2,0,0]=4 1358 B11R1.277 CSc1cc(c(nc1N)C)C 62a_200000210301_100009990238 [0,1,0,0,0,1|2,0,0]=4 1359 B11R1.277 CSc1nc(c(nc1N)C)C 62a_100012282008_200000210301 [0,1,0,0,0,1|2,0,0]=4 1360 B11R1.277 CSc1nc(c(nc1N)C)C 62a_200000210301_100012282008 [0,1,0,0,0,1|2,0,0]=4 1361 B11R1.277 CSc1nc(c(nc1O)C)C 62a_200000210301_100000717854 [0,1,0,0,0,1|2,0,0]=4 1362 B11R1.277 Cc1cc(c(nc1C)N)S[13CH3] 62a_100009990238_200025704644 [0,1,0,0,0,1|2,0,0]=4 1363 B11R1.277 Cc1cc(c(nc1C)N)S[13CH3] 62a_200025704644_100009990238 [0,1,0,0,0,1|2,0,0]=4 1364 B11R1.277 Cc1nc(c(nc1C)O[13CH3])Cl 34a_100000717854_200025704644 [0,1,0,0,0,1|2,0,0]=4 1365 B11R1.277 Cc1nc(c(nc1C)S[13CH3])N 62a_100012282008_200025704644 [0,1,0,0,0,1|2,0,0]=4 1366 B11R1.277 Cc1nc(c(nc1C)S[13CH3])N 62a_200025704644_100012282008 [0,1,0,0,0,1|2,0,0]=4 1367 B11R1.277 Cc1nc(c(nc1C)S[13CH3])O 62a_200025704644_100000717854 [0,1,0,0,0,1|2,0,0]=4 1368 B11R1.279 CCc1ccc(c(c1)C)NC 2230a_100011226020_200000210301 [0,1,0,0,0,1|2,0,0]=4 1369 B11R1.279 CCc1ccc(c(c1)C)NC 34a_100011226020_200000210301 [0,1,0,0,0,1|2,0,0]=4 1370 B11R1.279 CCc1ccc(c(c1)C)NC 7a_100011226020_200000210301 [0,1,0,0,0,1|2,0,0]=4 1371 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 2230a_100011226020_200025704644 [0,1,0,0,0,1|2,0,0]=4 1372 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 34a_100011226020_200025704644 [0,1,0,0,0,1|2,0,0]=4 1373 B11R1.279 CCc1ccc(c(c1)C)N[13CH3] 7a_100011226020_200025704644 [0,1,0,0,0,1|2,0,0]=4 1374 B11R1.279 CNc1cc(c(cn1)SC)C 62a_100012352278_200000210301 [0,1,0,0,0,1|2,0,0]=4 1375 B11R1.279 CNc1cc(c(cn1)SC)C 62a_200000210301_100012352278 [0,1,0,0,0,1|2,0,0]=4 1376 B11R1.279 CNc1cc(c(cn1)S[13CH3])C 62a_100012352278_200025704644 [0,1,0,0,0,1|2,0,0]=4 1377 B11R1.279 CNc1cc(c(cn1)S[13CH3])C 62a_200025704644_100012352278 [0,1,0,0,0,1|2,0,0]=4 1378 B11R1.279 CNc1ncc(c(n1)C)OC 27a_100102657272_100010382893 [0,1,0,0,0,1|2,0,0]=4 1379 B11R1.279 CNc1ncc(cc1C)SC 27a_100102657272_203440288091 [0,1,0,0,0,1|2,0,0]=4 1380 B11R1.279 CNc1ncc(cc1C)SC 62a_100012357622_200000210301 [0,1,0,0,0,1|2,0,0]=4 1381 B11R1.279 CNc1ncc(cc1C)SC 62a_200000210301_100012357622 [0,1,0,0,0,1|2,0,0]=4 1382 B11R1.279 CNc1ncc(cc1C)S[13CH3] 62a_100012357622_200025704644 [0,1,0,0,0,1|2,0,0]=4 1383 B11R1.279 CNc1ncc(cc1C)S[13CH3] 62a_200025704644_100012357622 [0,1,0,0,0,1|2,0,0]=4 1384 B11R1.279 COc1cc(c(cn1)SC)C 62a_100011934368_200000210301 [0,1,0,0,0,1|2,0,0]=4 1385 B11R1.279 COc1cc(c(cn1)SC)C 62a_200000210301_100011934368 [0,1,0,0,0,1|2,0,0]=4 1386 B11R1.279 COc1cc(c(cn1)S[13CH3])C 62a_100011934368_200025704644 [0,1,0,0,0,1|2,0,0]=4 1387 B11R1.279 COc1cc(c(cn1)S[13CH3])C 62a_200025704644_100011934368 [0,1,0,0,0,1|2,0,0]=4 1388 B11R1.279 COc1ccc(c(n1)C)OC 34a_200009873766_200000210301 [0,1,0,0,0,1|2,0,0]=4 1389 B11R1.279 COc1ccc(c(n1)C)O[13CH3] 34a_200009873766_200025704644 [0,1,0,0,0,1|2,0,0]=4 1390 B11R1.279 COc1ccc(c(n1)C)SC 62a_100000766551_200000210301 [0,1,0,0,0,1|2,0,0]=4 1391 B11R1.279 COc1ccc(c(n1)C)SC 62a_200000210301_100000766551 [0,1,0,0,0,1|2,0,0]=4 1392 B11R1.279 COc1ccc(c(n1)C)S[13CH3] 62a_100000766551_200025704644 [0,1,0,0,0,1|2,0,0]=4 1393 B11R1.279 COc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100000766551 [0,1,0,0,0,1|2,0,0]=4 1394 B11R1.279 COc1ccc(nc1C)SC 62a_100010244750_200000210301 [0,1,0,0,0,1|2,0,0]=4 1395 B11R1.279 COc1ccc(nc1C)SC 62a_200000210301_100010244750 [0,1,0,0,0,1|2,0,0]=4 1396 B11R1.279 COc1ccc(nc1C)S[13CH3] 62a_100010244750_200025704644 [0,1,0,0,0,1|2,0,0]=4 1397 B11R1.279 COc1ccc(nc1C)S[13CH3] 62a_200025704644_100010244750 [0,1,0,0,0,1|2,0,0]=4 1398 B11R1.279 COc1cnc(c(c1)C)SC 62a_200000210301_200009851512 [0,1,0,0,0,1|2,0,0]=4 1399 B11R1.279 COc1cnc(c(c1)C)S[13CH3] 62a_200025704644_200009851512 [0,1,0,0,0,1|2,0,0]=4 1400 B11R1.279 COc1cnc(c(n1)C)SC 62a_200000210301_200010730098 [0,1,0,0,0,1|2,0,0]=4 1401 B11R1.279 COc1cnc(c(n1)C)SC 62a_200010730098_200000210301 [0,1,0,0,0,1|2,0,0]=4 1402 B11R1.279 COc1cnc(c(n1)C)S[13CH3] 62a_200010730098_200025704644 [0,1,0,0,0,1|2,0,0]=4 1403 B11R1.279 COc1cnc(c(n1)C)S[13CH3] 62a_200025704644_200010730098 [0,1,0,0,0,1|2,0,0]=4 1404 B11R1.279 COc1cnc(nc1C)SC 62a_100010382893_200000210301 [0,1,0,0,0,1|2,0,0]=4 1405 B11R1.279 COc1cnc(nc1C)SC 62a_200000210301_100010382893 [0,1,0,0,0,1|2,0,0]=4 1406 B11R1.279 COc1cnc(nc1C)S[13CH3] 62a_100010382893_200025704644 [0,1,0,0,0,1|2,0,0]=4 1407 B11R1.279 COc1cnc(nc1C)S[13CH3] 62a_200025704644_100010382893 [0,1,0,0,0,1|2,0,0]=4 1408 B11R1.279 COc1ncc(c(n1)C)SC 62a_100010152497_200000210301 [0,1,0,0,0,1|2,0,0]=4 1409 B11R1.279 COc1ncc(c(n1)C)SC 62a_200000210301_100010152497 [0,1,0,0,0,1|2,0,0]=4 1410 B11R1.279 COc1ncc(c(n1)C)S[13CH3] 62a_100010152497_200025704644 [0,1,0,0,0,1|2,0,0]=4 1411 B11R1.279 COc1ncc(c(n1)C)S[13CH3] 62a_200025704644_100010152497 [0,1,0,0,0,1|2,0,0]=4 1412 B11R1.279 COc1ncc(cc1C)SC 62a_100011290809_200000210301 [0,1,0,0,0,1|2,0,0]=4 1413 B11R1.279 COc1ncc(cc1C)SC 62a_200000210301_100011290809 [0,1,0,0,0,1|2,0,0]=4 1414 B11R1.279 COc1ncc(cc1C)S[13CH3] 62a_100011290809_200025704644 [0,1,0,0,0,1|2,0,0]=4 1415 B11R1.279 COc1ncc(cc1C)S[13CH3] 62a_200025704644_100011290809 [0,1,0,0,0,1|2,0,0]=4 1416 B11R1.279 COc1nnc(cc1C)SC 62a_100010272851_200000210301 [0,1,0,0,0,1|2,0,0]=4 1417 B11R1.279 COc1nnc(cc1C)SC 62a_200000210301_100010272851 [0,1,0,0,0,1|2,0,0]=4 1418 B11R1.279 COc1nnc(cc1C)S[13CH3] 62a_100010272851_200025704644 [0,1,0,0,0,1|2,0,0]=4 1419 B11R1.279 COc1nnc(cc1C)S[13CH3] 62a_200025704644_100010272851 [0,1,0,0,0,1|2,0,0]=4 1420 B11R1.279 CSc1cc(c(cn1)CO)C 62a_100010277336_200000210301 [0,1,0,0,0,1|2,0,0]=4 1421 B11R1.279 CSc1cc(c(cn1)CO)C 62a_200000210301_100010277336 [0,1,0,0,0,1|2,0,0]=4 1422 B11R1.279 CSc1ccc(nc1C)CO 62a_100010114280_200000210301 [0,1,0,0,0,1|2,0,0]=4 1423 B11R1.279 CSc1ccc(nc1C)CO 62a_200000210301_100010114280 [0,1,0,0,0,1|2,0,0]=4 1424 B11R1.279 CSc1cnc(c(c1)C)CO 62a_100010116297_200000210301 [0,1,0,0,0,1|2,0,0]=4 1425 B11R1.279 CSc1cnc(c(c1)C)CO 62a_200000210301_100010116297 [0,1,0,0,0,1|2,0,0]=4 1426 B11R1.279 CSc1cnc(c(c1)C)SC 62a_200000210301_203440288091 [0,1,0,0,0,1|2,0,0]=4 1427 B11R1.279 CSc1cnc(c(c1)C)SC 62a_203440288091_200000210301 [0,1,0,0,0,1|2,0,0]=4 1428 B11R1.279 CSc1cnc(c(c1)C)S[13CH3] 62a_200025704644_203440288091 [0,1,0,0,0,1|2,0,0]=4 1429 B11R1.279 CSc1cnc(c(c1)C)S[13CH3] 62a_203440288091_200025704644 [0,1,0,0,0,1|2,0,0]=4 1430 B11R1.279 CSc1cnc(cc1C)CO 62a_200000210301_200010713146 [0,1,0,0,0,1|2,0,0]=4 1431 B11R1.279 CSc1cnc(cc1C)CO 62a_200010713146_200000210301 [0,1,0,0,0,1|2,0,0]=4 1432 B11R1.279 CSc1ncc(c(n1)C)SC 62a_100015672207_200000210301 [0,1,0,0,0,1|2,0,0]=4 1433 B11R1.279 CSc1ncc(c(n1)C)SC 62a_200000210301_100015672207 [0,1,0,0,0,1|2,0,0]=4 1434 B11R1.279 CSc1ncc(c(n1)C)S[13CH3] 62a_100015672207_200025704644 [0,1,0,0,0,1|2,0,0]=4 1435 B11R1.279 CSc1ncc(c(n1)C)S[13CH3] 62a_200025704644_100015672207 [0,1,0,0,0,1|2,0,0]=4 1436 B11R1.279 CSc1ncc(cc1C)CO 62a_200000092119_200000210301 [0,1,0,0,0,1|2,0,0]=4 1437 B11R1.279 CSc1ncc(cc1C)CO 62a_200000210301_200000092119 [0,1,0,0,0,1|2,0,0]=4 1438 B11R1.279 Cc1cc(cnc1CO)S[13CH3] 62a_100010116297_200025704644 [0,1,0,0,0,1|2,0,0]=4 1439 B11R1.279 Cc1cc(cnc1CO)S[13CH3] 62a_200025704644_100010116297 [0,1,0,0,0,1|2,0,0]=4 1440 B11R1.279 Cc1cc(cnc1S[13CH3])CO 62a_200000092119_200025704644 [0,1,0,0,0,1|2,0,0]=4 1441 B11R1.279 Cc1cc(cnc1S[13CH3])CO 62a_200025704644_200000092119 [0,1,0,0,0,1|2,0,0]=4 1442 B11R1.279 Cc1cc(ncc1CO)S[13CH3] 62a_100010277336_200025704644 [0,1,0,0,0,1|2,0,0]=4 1443 B11R1.279 Cc1cc(ncc1CO)S[13CH3] 62a_200025704644_100010277336 [0,1,0,0,0,1|2,0,0]=4 1444 B11R1.279 Cc1cc(ncc1S[13CH3])CO 62a_200010713146_200025704644 [0,1,0,0,0,1|2,0,0]=4 1445 B11R1.279 Cc1cc(ncc1S[13CH3])CO 62a_200025704644_200010713146 [0,1,0,0,0,1|2,0,0]=4 1446 B11R1.279 Cc1nc(ccc1S[13CH3])CO 62a_100010114280_200025704644 [0,1,0,0,0,1|2,0,0]=4 1447 B11R1.279 Cc1nc(ccc1S[13CH3])CO 62a_200025704644_100010114280 [0,1,0,0,0,1|2,0,0]=4 1448 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [0,1,0,0,0,1|2,0,0]=4 1449 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [0,1,0,0,0,1|2,0,0]=4 1450 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [0,1,0,0,0,1|2,0,0]=4 1451 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [0,1,0,0,0,1|2,0,0]=4 1452 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [0,1,0,0,0,1|2,0,0]=4 1453 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [0,1,0,0,0,1|2,0,0]=4 1454 B11R1.280 CNc1nc(ncc1C)SC 27a_100102657272_100000097195 [0,1,0,0,0,1|2,0,0]=4 1455 B11R1.280 CNc1ncc(c(n1)OC)C 27a_100102657272_100012500371 [0,1,0,0,0,1|2,0,0]=4 1456 B11R1.280 CNc1ncc(c(n1)SC)C 27a_100102657272_100012501347 [0,1,0,0,0,1|2,0,0]=4 1457 B11R1.280 COc1cc(c(cn1)C)SC 62a_100010068546_200000210301 [0,1,0,0,0,1|2,0,0]=4 1458 B11R1.280 COc1cc(c(cn1)C)SC 62a_200000210301_100010068546 [0,1,0,0,0,1|2,0,0]=4 1459 B11R1.280 COc1cc(c(cn1)C)S[13CH3] 62a_100010068546_200025704644 [0,1,0,0,0,1|2,0,0]=4 1460 B11R1.280 COc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100010068546 [0,1,0,0,0,1|2,0,0]=4 1461 B11R1.280 COc1cc(cnc1C)SC 62a_100010254219_200000210301 [0,1,0,0,0,1|2,0,0]=4 1462 B11R1.280 COc1cc(cnc1C)SC 62a_200000210301_100010254219 [0,1,0,0,0,1|2,0,0]=4 1463 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_100010254219_200025704644 [0,1,0,0,0,1|2,0,0]=4 1464 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_200025704644_100010254219 [0,1,0,0,0,1|2,0,0]=4 1465 B11R1.280 COc1cc(ncc1C)SC 62a_100010067687_200000210301 [0,1,0,0,0,1|2,0,0]=4 1466 B11R1.280 COc1cc(ncc1C)SC 62a_200000210301_100010067687 [0,1,0,0,0,1|2,0,0]=4 1467 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_100010067687_200025704644 [0,1,0,0,0,1|2,0,0]=4 1468 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_200025704644_100010067687 [0,1,0,0,0,1|2,0,0]=4 1469 B11R1.280 COc1nc(ncc1C)SC 62a_100012500371_200000210301 [0,1,0,0,0,1|2,0,0]=4 1470 B11R1.280 COc1nc(ncc1C)SC 62a_200000210301_100012500371 [0,1,0,0,0,1|2,0,0]=4 1471 B11R1.280 COc1nc(ncc1C)S[13CH3] 62a_100012500371_200025704644 [0,1,0,0,0,1|2,0,0]=4 1472 B11R1.280 COc1nc(ncc1C)S[13CH3] 62a_200025704644_100012500371 [0,1,0,0,0,1|2,0,0]=4 1473 B11R1.280 CSc1cc(ncc1C)CO 62a_100010113723_200000210301 [0,1,0,0,0,1|2,0,0]=4 1474 B11R1.280 CSc1cc(ncc1C)CO 62a_200000210301_100010113723 [0,1,0,0,0,1|2,0,0]=4 1475 B11R1.280 CSc1cnc(c(c1)CO)C 62a_100010894652_200000210301 [0,1,0,0,0,1|2,0,0]=4 1476 B11R1.280 CSc1cnc(c(c1)CO)C 62a_200000210301_100010894652 [0,1,0,0,0,1|2,0,0]=4 1477 B11R1.280 CSc1nc(ncc1C)S[13CH3] 62a_100012501347_200025704644 [0,1,0,0,0,1|2,0,0]=4 1478 B11R1.280 CSc1nc(ncc1C)S[13CH3] 62a_200025704644_100012501347 [0,1,0,0,0,1|2,0,0]=4 1479 B11R1.280 CSc1ncc(c(n1)SC)C 62a_100000097195_200000210301 [0,1,0,0,0,1|2,0,0]=4 1480 B11R1.280 CSc1ncc(c(n1)SC)C 62a_100012501347_200000210301 [0,1,0,0,0,1|2,0,0]=4 1481 B11R1.280 CSc1ncc(c(n1)SC)C 62a_200000210301_100000097195 [0,1,0,0,0,1|2,0,0]=4 1482 B11R1.280 CSc1ncc(c(n1)SC)C 62a_200000210301_100012501347 [0,1,0,0,0,1|2,0,0]=4 1483 B11R1.280 CSc1ncc(c(n1)S[13CH3])C 62a_100000097195_200025704644 [0,1,0,0,0,1|2,0,0]=4 1484 B11R1.280 CSc1ncc(c(n1)S[13CH3])C 62a_200025704644_100000097195 [0,1,0,0,0,1|2,0,0]=4 1485 B11R1.280 Cc1cnc(cc1S[13CH3])CO 62a_100010113723_200025704644 [0,1,0,0,0,1|2,0,0]=4 1486 B11R1.280 Cc1cnc(cc1S[13CH3])CO 62a_200025704644_100010113723 [0,1,0,0,0,1|2,0,0]=4 1487 B11R1.280 Cc1ncc(cc1CO)S[13CH3] 62a_100010894652_200025704644 [0,1,0,0,0,1|2,0,0]=4 1488 B11R1.280 Cc1ncc(cc1CO)S[13CH3] 62a_200025704644_100010894652 [0,1,0,0,0,1|2,0,0]=4 1489 B11R1.186 CNCc1nc(c(n1C)C)C 207a_100102657272_100000087074 [0,2,0,0,0,0|1,0,0]=3 1490 B11R1.186 CNCc1nc(c(n1C)C)C 270004a_106832991635_100000087074 [0,2,0,0,0,0|1,0,0]=3 1491 B11R1.978 CCn1nc(c(c1C)SC)C 62a_100000755104_200000210301 [0,2,0,0,0,0|2,0,0]=4 1492 B11R1.978 CCn1nc(c(c1C)SC)C 62a_200000210301_100000755104 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.978 CCn1nc(c(c1C)S[13CH3])C 62a_100000755104_200025704644 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.978 CCn1nc(c(c1C)S[13CH3])C 62a_200025704644_100000755104 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.48 C=C(C)c1nc(c(o1)C)C=O 271570a_100000694244_200010262729 [0,2,0,0,0,0|0,0,2]=4 1496 B11R1.48 C=C(C)c1nc(c(s1)C)CO 271570a_100000694244_100010127906 [0,2,0,0,0,0|0,1,1]=4 1497 B11R1.48 C=C(C)c1nc(c(s1)CO)C 271570a_100000694244_100010264302 [0,2,0,0,0,0|0,1,1]=4 1498 B11R1.48 CSc1cn(nc1C)C(C)C 62a_100012354293_200000210301 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.48 CSc1cn(nc1C)C(C)C 62a_200000210301_100012354293 [0,2,0,0,0,0|2,0,0]=4 1500 B11R1.48 Cc1nn(cc1S[13CH3])C(C)C 62a_100012354293_200025704644 [0,2,0,0,0,0|2,0,0]=4 1501 B11R1.48 Cc1nn(cc1S[13CH3])C(C)C 62a_200025704644_100012354293 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.50 C=C(C)c1sc(nc1C)CC 271570a_100000694244_100010138847 [0,2,0,0,0,0|0,1,0]=3 1503 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_100010106820_200025704644 [0,2,0,0,0,0|1,1,0]=4 1504 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_200025704644_100010106820 [0,2,0,0,0,0|1,1,0]=4 1505 B11R1.50 CNc1nc(c(s1)C(=O)C)C 27a_100102657272_100010106820 [0,2,0,0,0,0|1,1,0]=4 1506 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_100010106820_200000210301 [0,2,0,0,0,0|1,1,0]=4 1507 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_200000210301_100010106820 [0,2,0,0,0,0|1,1,0]=4 1508 B11R1.185 C=C=Cc1sc(nc1C)CC 271570a_100015277604_100010138847 [0,2,0,0,0,0|0,1,1]=4 1509 B11R1.185 CC=Cc1sc(nc1C)CC 271570a_100016259895_100010138847 [0,2,0,0,0,0|0,1,0]=3 1510 B11R1.185 CCSc1sc(nc1C)CC 62a_100000210202_100010138847 [0,2,0,0,0,0|0,1,0]=3 1511 B11R1.185 CCSc1sc(nc1C)CC 62a_100010138847_100000210202 [0,2,0,0,0,0|0,1,0]=3 1512 B11R1.185 CCc1nc(c([nH]1)C)CNC 207a_100102657272_100000041053 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.185 CCc1nc(c(s1)CNC)C 2230a_100015186448_200000210301 [0,2,0,0,0,0|0,1,0]=3 1514 B11R1.185 CCc1nc(c(s1)CN[13CH3])C 2230a_100015186448_200025704644 [0,2,0,0,0,0|0,1,0]=3 1515 B11R1.185 CCc1nc(c(s1)SCF)C 62a_100010138847_100015361967 [0,2,0,0,0,0|0,1,0]=3 1516 B11R1.185 CCc1nc(c(s1)SCF)C 62a_100015361967_100010138847 [0,2,0,0,0,0|0,1,0]=3 1517 B11R1.185 CCn1cc(c(n1)C)CNC 207a_100102657272_100000763669 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.185 CCn1cc(c(n1)C)CNC 270004a_106832991635_100000763669 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.185 CCn1cc(c(n1)C)CNC 34a_100011996558_200000210301 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.185 CCn1cc(c(n1)C)CN[13CH3] 34a_100011996558_200025704644 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.185 CNc1nc(c(s1)C)CCO 27a_100102657272_100010201174 [0,2,0,0,0,0|1,1,0]=4 1522 B11R1.185 CSc1nc(c(s1)C)CCO 62a_100010201174_200000210301 [0,2,0,0,0,0|1,1,0]=4 1523 B11R1.185 CSc1nc(c(s1)C)CCO 62a_200000210301_100010201174 [0,2,0,0,0,0|1,1,0]=4 1524 B11R1.185 Cc1sc(nc1CCO)S[13CH3] 62a_100010201174_200025704644 [0,2,0,0,0,0|1,1,0]=4 1525 B11R1.185 Cc1sc(nc1CCO)S[13CH3] 62a_200025704644_100010201174 [0,2,0,0,0,0|1,1,0]=4 1526 B11R1.187 CC=Cc1nc(c(o1)C)C=O 271570a_100016259895_200010262729 [0,2,0,0,0,0|0,0,2]=4 1527 B11R1.187 CC=Cc1nc(c(s1)C)CO 271570a_100016259895_100010127906 [0,2,0,0,0,0|0,1,1]=4 1528 B11R1.187 CC=Cc1nc(c(s1)CO)C 271570a_100016259895_100010264302 [0,2,0,0,0,0|0,1,1]=4 1529 B11R1.187 CCCc1cc(n(n1)C)OC 34a_200012396517_200000210301 [0,2,0,0,0,0|2,0,0]=4 1530 B11R1.187 CCCc1cc(n(n1)C)O[13CH3] 34a_200012396517_200025704644 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.187 CCNc1nc(c(s1)C=O)C 27a_100015525214_100010339034 [0,2,0,0,0,0|0,1,1]=4 1532 B11R1.187 CCSc1cc(n(n1)CC)C 62a_100000210202_100010781242 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.187 CCSc1cc(n(n1)CC)C 62a_100010781242_100000210202 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.187 CCSc1nc(c(o1)C)C=O 62a_100000210202_200010262729 [0,2,0,0,0,0|0,0,1]=3 1535 B11R1.187 CCSc1nc(c(o1)C)C=O 62a_200010262729_100000210202 [0,2,0,0,0,0|0,0,1]=3 1536 B11R1.187 CCSc1nc(c(s1)C)CO 62a_100000210202_100010127906 [0,2,0,0,0,0|0,1,0]=3 1537 B11R1.187 CCSc1nc(c(s1)C)CO 62a_100010127906_100000210202 [0,2,0,0,0,0|0,1,0]=3 1538 B11R1.187 CCSc1nc(c(s1)C=O)C 62a_100000210202_100010339034 [0,2,0,0,0,0|0,1,1]=4 1539 B11R1.187 CCSc1nc(c(s1)C=O)C 62a_100010339034_100000210202 [0,2,0,0,0,0|0,1,1]=4 1540 B11R1.187 CCSc1nc(c(s1)CO)C 62a_100000210202_100010264302 [0,2,0,0,0,0|0,1,0]=3 1541 B11R1.187 CCSc1nc(c(s1)CO)C 62a_100010264302_100000210202 [0,2,0,0,0,0|0,1,0]=3 1542 B11R1.187 CSc1cn(nc1C)CCF 62a_100010872355_200000210301 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.187 CSc1cn(nc1C)CCF 62a_200000210301_100010872355 [0,2,0,0,0,0|2,0,0]=4 1544 B11R1.187 Cc1nc(sc1CO)SCF 62a_100010264302_100015361967 [0,2,0,0,0,0|1,1,0]=4 1545 B11R1.187 Cc1nc(sc1CO)SCF 62a_100015361967_100010264302 [0,2,0,0,0,0|1,1,0]=4 1546 B11R1.187 Cc1nn(cc1S[13CH3])CCF 62a_100010872355_200025704644 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.187 Cc1nn(cc1S[13CH3])CCF 62a_200025704644_100010872355 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.187 Cc1oc(nc1C=O)SCF 62a_100015361967_200010262729 [0,2,0,0,0,0|1,0,1]=4 1549 B11R1.187 Cc1oc(nc1C=O)SCF 62a_200010262729_100015361967 [0,2,0,0,0,0|1,0,1]=4 1550 B11R1.187 Cc1sc(nc1CO)SCF 62a_100010127906_100015361967 [0,2,0,0,0,0|1,1,0]=4 1551 B11R1.187 Cc1sc(nc1CO)SCF 62a_100015361967_100010127906 [0,2,0,0,0,0|1,1,0]=4 1552 B11R1.80 CC(=Cc1nc(c(s1)C)C)C 271570a_100102525489_100000765934 [0,2,0,0,0,0|0,1,1]=4 1553 B11R1.80 CC(=O)Cc1cc(n(n1)C)C 1458a_100000070787_100000761402 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.80 CC(=O)Cc1nc(c(s1)C)C 1458a_100000070787_100000763442 [0,2,0,0,0,0|0,1,0]=3 1555 B11R1.80 Cc1cc(nn1C)CN(C)C 2230a_100102631434_100000761402 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.80 Cc1cc(nn1C)CN(C)C 269982a_100102631434_100000761402 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.80 Cc1cc(nn1C)CN(C)C 270004a_100102631434_100000763638 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.80 Cc1cc(nn1C)SC(C)C 62a_100000210206_100012001299 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.80 Cc1cc(nn1C)SC(C)C 62a_100012001299_100000210206 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.80 Cc1cc(sc1C)CN(C)C 270004a_100102631434_100011830369 [0,2,0,0,0,0|1,1,0]=4 1561 B11R1.80 Cc1cc(sc1C)SC(C)C 62a_100000210206_100009850898 [0,2,0,0,0,0|1,1,0]=4 1562 B11R1.80 Cc1cc(sc1C)SC(C)C 62a_100009850898_100000210206 [0,2,0,0,0,0|1,1,0]=4 1563 B11R1.80 Cc1nc(cn1C)SC(C)C 62a_100000210206_100000684932 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.80 Cc1nc(cn1C)SC(C)C 62a_100000684932_100000210206 [0,2,0,0,0,0|2,0,0]=4 1565 B11R1.80 Cc1nc(sc1C)CN(C)C 2230a_100102631434_100012347604 [0,2,0,0,0,0|0,1,0]=3 1566 B11R1.80 Cc1nc(sc1C)CN(C)C 269982a_100102631434_100012347604 [0,2,0,0,0,0|0,1,0]=3 1567 B11R1.80 Cc1nc(sc1C)CN(C)C 270004a_100102631434_100011775437 [0,2,0,0,0,0|0,1,0]=3 1568 B11R1.80 Cc1nc(sc1C)NC(C)C 27a_100138425928_100000765934 [0,2,0,0,0,0|0,1,0]=3 1569 B11R1.80 Cc1nc(sc1C)SC(C)C 62a_100000210206_100000765934 [0,2,0,0,0,0|0,1,0]=3 1570 B11R1.80 Cc1nc(sc1C)SC(C)C 62a_100000765934_100000210206 [0,2,0,0,0,0|0,1,0]=3 1571 B11R1.231 C#CCNc1nc(c(s1)C)C 27a_100000212058_100000765934 [0,2,0,0,0,0|0,1,1]=4 1572 B11R1.231 C#CCSc1nc(c(s1)C)C 62a_100000038162_100000765934 [0,2,0,0,0,0|0,1,1]=4 1573 B11R1.231 C=CCNc1nc(c(s1)C)C 27a_100020586998_100000765934 [0,2,0,0,0,0|0,1,1]=4 1574 B11R1.231 C=CCSc1nc(c(s1)C)C 62a_100000210623_100000765934 [0,2,0,0,0,0|0,1,1]=4 1575 B11R1.231 C=CCSc1nc(c(s1)C)C 62a_100000765934_100000210623 [0,2,0,0,0,0|0,1,1]=4 1576 B11R1.231 CC=NNc1nc(c(s1)C)C 4a_100015184946_200000210099 [0,2,0,0,0,0|0,1,1]=4 1577 B11R1.231 CCCCc1cc(c(s1)C)C 271570a_100020621405_100009850898 [0,2,0,0,0,0|1,1,0]=4 1578 B11R1.231 CCCCc1cc(n(n1)C)C 271570a_100020621405_100012001299 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.231 CCCCc1cn(c(n1)C)C 271570a_100020621405_100000684932 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.231 CCCCc1nc(c(s1)C)C 271570a_100020621405_100000765934 [0,2,0,0,0,0|0,1,0]=3 1581 B11R1.231 CCCSc1cc(c(s1)C)C 62a_100000210303_100009850898 [0,2,0,0,0,0|1,1,0]=4 1582 B11R1.231 CCCSc1cc(c(s1)C)C 62a_100009850898_100000210303 [0,2,0,0,0,0|1,1,0]=4 1583 B11R1.231 CCCSc1cc(n(n1)C)C 62a_100000210303_100012001299 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.231 CCCSc1cc(n(n1)C)C 62a_100012001299_100000210303 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.231 CCCSc1cn(c(n1)C)C 62a_100000210303_100000684932 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.231 CCCSc1cn(c(n1)C)C 62a_100000684932_100000210303 [0,2,0,0,0,0|2,0,0]=4 1587 B11R1.231 CCCSc1nc(c(s1)C)C 62a_100000210303_100000765934 [0,2,0,0,0,0|0,1,0]=3 1588 B11R1.231 CCCSc1nc(c(s1)C)C 62a_100000765934_100000210303 [0,2,0,0,0,0|0,1,0]=3 1589 B11R1.231 CCNCc1cc(c(s1)C)C 207a_100015525214_100011830369 [0,2,0,0,0,0|1,1,0]=4 1590 B11R1.231 CCNCc1cc(c(s1)C)C 270004a_100015525214_100011830369 [0,2,0,0,0,0|1,1,0]=4 1591 B11R1.231 CCNCc1cc(n(n1)C)C 207a_100015525214_100000763638 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.231 CCNCc1cc(n(n1)C)C 2230a_100015525214_100000761402 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.231 CCNCc1cc(n(n1)C)C 2230a_100025705265_100000210202 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.231 CCNCc1cc(n(n1)C)C 270004a_100015525214_100000763638 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.231 CCNCc1cc(n(n1)C)C 34a_100025705265_100000210202 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.231 CCNCc1nc(c(s1)C)C 207a_100015525214_100011775437 [0,2,0,0,0,0|0,1,0]=3 1597 B11R1.231 CCNCc1nc(c(s1)C)C 2230a_100015525214_100012347604 [0,2,0,0,0,0|0,1,0]=3 1598 B11R1.231 CCNCc1nc(c(s1)C)C 270004a_100015525214_100011775437 [0,2,0,0,0,0|0,1,0]=3 1599 B11R1.231 CCOCc1cc(n(n1)C)C 34a_100011219459_100000210202 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.231 CCOCc1cc(n(n1)C)C 34a_100121572206_100000761402 [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.231 CCOCc1nc(c(s1)C)C 34a_100121572206_100012347604 [0,2,0,0,0,0|0,1,0]=3 1602 B11R1.231 CCOCc1nc(c(s1)C)C 7a_100000760949_100000210202 [0,2,0,0,0,0|0,1,0]=3 1603 B11R1.231 CCSCc1cc(n(n1)C)C 62a_100000210202_100000761402 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.231 CCSCc1cc(n(n1)C)C 62a_100000761402_100000210202 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.231 CCSCc1nc(c(s1)C)C 62a_100000210202_100012347604 [0,2,0,0,0,0|0,1,0]=3 1606 B11R1.231 CCSCc1nc(c(s1)C)C 62a_100000763442_100000210202 [0,2,0,0,0,0|0,1,0]=3 1607 B11R1.231 CNCCc1nc(c(s1)C)C 2230a_100000759773_200000210301 [0,2,0,0,0,0|0,1,0]=3 1608 B11R1.231 COCSc1cc(c(s1)C)C 62a_100000766300_100009850898 [0,2,0,0,0,0|1,1,0]=4 1609 B11R1.231 COCSc1cc(c(s1)C)C 62a_100009850898_100000766300 [0,2,0,0,0,0|1,1,0]=4 1610 B11R1.231 COCSc1cc(n(n1)C)C 62a_100000766300_100012001299 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.231 COCSc1cc(n(n1)C)C 62a_100012001299_100000766300 [0,2,0,0,0,0|2,0,0]=4 1612 B11R1.231 COCSc1cn(c(n1)C)C 62a_100000684932_100000766300 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.231 COCSc1cn(c(n1)C)C 62a_100000766300_100000684932 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.231 COCSc1nc(c(s1)C)C 62a_100000765934_100000766300 [0,2,0,0,0,0|0,1,0]=3 1615 B11R1.231 COCSc1nc(c(s1)C)C 62a_100000766300_100000765934 [0,2,0,0,0,0|0,1,0]=3 1616 B11R1.231 CSCSc1cc(c(s1)C)C 62a_100009850898_100011218213 [0,2,0,0,0,0|1,1,0]=4 1617 B11R1.231 CSCSc1cc(c(s1)C)C 62a_100011218213_100009850898 [0,2,0,0,0,0|1,1,0]=4 1618 B11R1.231 CSCSc1cc(n(n1)C)C 62a_100011218213_100012001299 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.231 CSCSc1cc(n(n1)C)C 62a_100012001299_100011218213 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.231 CSCSc1cn(c(n1)C)C 62a_100000684932_100011218213 [0,2,0,0,0,0|2,0,0]=4 1621 B11R1.231 CSCSc1cn(c(n1)C)C 62a_100011218213_100000684932 [0,2,0,0,0,0|2,0,0]=4 1622 B11R1.231 CSCSc1nc(c(s1)C)C 62a_100000765934_100011218213 [0,2,0,0,0,0|0,1,0]=3 1623 B11R1.231 CSCSc1nc(c(s1)C)C 62a_100011218213_100000765934 [0,2,0,0,0,0|0,1,0]=3 1624 B11R1.231 Cc1cc(nn1C)CNCF 34a_100025705265_100015361967 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.231 Cc1cc(nn1C)COCF 34a_100011219459_100015361967 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.231 Cc1cc(nn1C)CSCF 62a_100000761402_100015361967 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.231 Cc1cc(nn1C)CSCF 62a_100015361967_100000761402 [0,2,0,0,0,0|2,0,0]=4 1628 B11R1.231 Cc1cc(nn1C)SCCF 62a_100011217306_100012001299 [0,2,0,0,0,0|2,0,0]=4 1629 B11R1.231 Cc1cc(nn1C)SCCF 62a_100012001299_100011217306 [0,2,0,0,0,0|2,0,0]=4 1630 B11R1.231 Cc1cc(nn1C)SCCO 62a_100000211926_100012001299 [0,2,0,0,0,0|2,0,0]=4 1631 B11R1.231 Cc1cc(nn1C)SCCO 62a_100012001299_100000211926 [0,2,0,0,0,0|2,0,0]=4 1632 B11R1.231 Cc1cc(sc1C)SCCF 62a_100009850898_100011217306 [0,2,0,0,0,0|1,1,0]=4 1633 B11R1.231 Cc1cc(sc1C)SCCF 62a_100011217306_100009850898 [0,2,0,0,0,0|1,1,0]=4 1634 B11R1.231 Cc1cc(sc1C)SCCO 62a_100000211926_100009850898 [0,2,0,0,0,0|1,1,0]=4 1635 B11R1.231 Cc1cc(sc1C)SCCO 62a_100009850898_100000211926 [0,2,0,0,0,0|1,1,0]=4 1636 B11R1.231 Cc1nc(cn1C)SCCF 62a_100000684932_100011217306 [0,2,0,0,0,0|2,0,0]=4 1637 B11R1.231 Cc1nc(cn1C)SCCF 62a_100011217306_100000684932 [0,2,0,0,0,0|2,0,0]=4 1638 B11R1.231 Cc1nc(cn1C)SCCO 62a_100000211926_100000684932 [0,2,0,0,0,0|2,0,0]=4 1639 B11R1.231 Cc1nc(cn1C)SCCO 62a_100000684932_100000211926 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.231 Cc1nc(sc1C)CCN[13CH3] 2230a_100000759773_200025704644 [0,2,0,0,0,0|0,1,0]=3 1641 B11R1.231 Cc1nc(sc1C)COCF 7a_100000760949_100015361967 [0,2,0,0,0,0|0,1,0]=3 1642 B11R1.231 Cc1nc(sc1C)CSCF 62a_100000763442_100015361967 [0,2,0,0,0,0|0,1,0]=3 1643 B11R1.231 Cc1nc(sc1C)CSCF 62a_100015361967_100012347604 [0,2,0,0,0,0|0,1,0]=3 1644 B11R1.231 Cc1nc(sc1C)NCCO 27a_100000210304_100000765934 [0,2,0,0,0,0|0,1,0]=3 1645 B11R1.231 Cc1nc(sc1C)SCC#N 62a_100000765934_100011215382 [0,2,0,0,0,0|0,1,1]=4 1646 B11R1.231 Cc1nc(sc1C)SCC#N 62a_100011215382_100000765934 [0,2,0,0,0,0|0,1,1]=4 1647 B11R1.231 Cc1nc(sc1C)SCC=O 62a_100000765934_200015260668 [0,2,0,0,0,0|0,1,1]=4 1648 B11R1.231 Cc1nc(sc1C)SCC=O 62a_200015260668_100000765934 [0,2,0,0,0,0|0,1,1]=4 1649 B11R1.231 Cc1nc(sc1C)SCCF 62a_100000765934_100011217306 [0,2,0,0,0,0|0,1,0]=3 1650 B11R1.231 Cc1nc(sc1C)SCCF 62a_100011217306_100000765934 [0,2,0,0,0,0|0,1,0]=3 1651 B11R1.231 Cc1nc(sc1C)SCCO 62a_100000211926_100000765934 [0,2,0,0,0,0|0,1,0]=3 1652 B11R1.231 Cc1nc(sc1C)SCCO 62a_100000765934_100000211926 [0,2,0,0,0,0|0,1,0]=3 1653 B9R1.69 Cc1cnc(c(c1)O)C 271570a_203496583355_100009817436 [0,0,1,1,0,0|0,0,2]=4 1654 B9R1.69 Cc1cnc(c(n1)O)C 271570a_203496583355_100000211308 [0,0,1,1,0,0|1,0,1]=4 1655 B9R1.100 CCNN=C(C)C1CO1 4a_100000756455_100000031964 [0,0,1,1,0,0|1,0,1]=4 1656 B11R2.355 Cc1cc(nn1C)C2CC2 271570a_100011220607_100012001299 [0,1,0,1,0,0|2,0,0]=4 1657 B11R2.355 Cc1cc(sc1C)C2CC2 271570a_100011220607_100009850898 [0,1,0,1,0,0|1,1,0]=4 1658 B11R2.355 Cc1nc(cn1C)C2CC2 271570a_100011220607_100000684932 [0,1,0,1,0,0|2,0,0]=4 1659 B11R2.355 Cc1nc(sc1C)C2CC2 271570a_100011220607_100000765934 [0,1,0,1,0,0|0,1,0]=3 1660 B7R0.10 C/C=C(\C)/C(=O)CC 1458a_100020587367_100000210202 [0,0,1,0,1,0|0,0,1]=3 1661 B7R0.10 C/C=C(\C)/C(=O)CF 1458a_100020587367_100015361967 [0,0,1,0,1,0|1,0,1]=4 1662 B7R0.10 C/C=C(\C)/C(=O)NC 11a_106832991635_100020587367 [0,0,1,0,1,0|1,0,1]=4 1663 B7R0.10 C/C=C(\C)/C(=O)NC 1626a_100102657272_100020587367 [0,0,1,0,1,0|1,0,1]=4 1664 B9R0.24 C=CC(=NNC(=O)CC)C 4a_100000183195_200015361842 [0,0,1,0,0,1|0,0,2]=4 1665 B9R0.24 CC=C(C)C=CC(=O)CC 1458a_100000692105_100000210202 [0,0,1,0,0,1|1,0,1]=4 1666 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [1,0,0,0,0,1|2,0,0]=4 1667 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,0,0,0,0,1|2,0,0]=4 1668 B9R1.1 CNc1ccc(nn1)C 27a_100102657272_100000744512 [1,0,0,0,0,1|2,0,0]=4 1669 B9R1.1 CNc1cnc(cn1)C 27a_100102657272_100000074397 [1,0,0,0,0,1|2,0,0]=4 1670 B9R1.1 CNc1ncc(cn1)C 27a_100102657272_100000061069 [1,0,0,0,0,1|2,0,0]=4 1671 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,0,0,0,0,1|2,0,0]=4 1672 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,1|2,0,0]=4 1673 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,1|2,0,0]=4 1674 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,0,0,0,0,1|2,0,0]=4 1675 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,0,0,0,0,1|2,0,0]=4 1676 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,1|2,0,0]=4 1677 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,1|2,0,0]=4 1678 B9R1.1 CSc1ccc(nn1)C 62a_100000744512_200000210301 [1,0,0,0,0,1|2,0,0]=4 1679 B9R1.1 CSc1ccc(nn1)C 62a_200000210301_100000744512 [1,0,0,0,0,1|2,0,0]=4 1680 B9R1.1 CSc1cnc(cn1)C 62a_100011999403_200000210301 [1,0,0,0,0,1|2,0,0]=4 1681 B9R1.1 CSc1cnc(cn1)C 62a_200000210301_100011999403 [1,0,0,0,0,1|2,0,0]=4 1682 B9R1.1 CSc1ncc(cn1)C 62a_100000061069_200000210301 [1,0,0,0,0,1|2,0,0]=4 1683 B9R1.1 CSc1ncc(cn1)C 62a_200000210301_100000061069 [1,0,0,0,0,1|2,0,0]=4 1684 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,1|2,0,0]=4 1685 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,1|2,0,0]=4 1686 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,1|2,0,0]=4 1687 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,1|2,0,0]=4 1688 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,0,0,0,0,1|2,0,0]=4 1689 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,0,0,0,0,1|2,0,0]=4 1690 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,0,0,0,0,1|2,0,0]=4 1691 B9R1.1 Cc1ccc(nn1)S[13CH3] 62a_100000744512_200025704644 [1,0,0,0,0,1|2,0,0]=4 1692 B9R1.1 Cc1ccc(nn1)S[13CH3] 62a_200025704644_100000744512 [1,0,0,0,0,1|2,0,0]=4 1693 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_100011999403_200025704644 [1,0,0,0,0,1|2,0,0]=4 1694 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_200025704644_100011999403 [1,0,0,0,0,1|2,0,0]=4 1695 B9R1.1 Cc1cnc(nc1)S[13CH3] 62a_100000061069_200025704644 [1,0,0,0,0,1|2,0,0]=4 1696 B9R1.1 Cc1cnc(nc1)S[13CH3] 62a_200025704644_100000061069 [1,0,0,0,0,1|2,0,0]=4 1697 B9R1.34 Cc1cc(cc(n1)C)O 271570a_203496583355_100009816552 [1,0,0,0,0,1|2,0,0]=4 1698 B9R1.34 Cc1cc(nc(c1)O)C 271570a_203496583355_100000069240 [1,0,0,0,0,1|2,0,0]=4 1699 B9R1.34 Cc1cc(nc(n1)C)O 271570a_203496583355_100000736142 [1,0,0,0,0,1|2,0,0]=4 1700 B9R1.34 Cc1cc(nc(n1)O)C 271570a_203496583355_100000736147 [1,0,0,0,0,1|2,0,0]=4 1701 B9R1.34 Cc1nc(nc(n1)O)C 271570a_203496583355_100015468570 [1,0,0,0,0,1|2,0,0]=4