0 B13R1.50 C=Cc1cc(ccc1C)S(=O)(=O)C 271570a_100011290941_100010175561 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.50 C=Cc1cc(ccc1C)S(=O)(=O)N 271570a_100011290941_100011847911 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.50 C=Cc1cc(ccc1F)S(=O)(=O)C 271570a_100011290941_200000048130 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.50 C=Cc1cc(ccc1F)S(=O)(=O)N 271570a_100011290941_100000164542 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.50 C=Cc1cc(ccc1N)S(=O)(=O)C 271570a_100011290941_100000743533 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.50 C=Cc1cc(ccc1N)S(=O)(=O)N 271570a_100011290941_100000736770 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.50 CNc1cc(ccc1Br)S(=O)(=O)C 34a_200015322649_200000210301 [0,0,0,0,0,0|3,0,0]=3 7 B13R1.50 CNc1cc(ccc1Br)S(=O)(=O)C 7a_200015322649_200000210301 [0,0,0,0,0,0|3,0,0]=3 8 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)C 34a_100000230108_200000210301 [0,0,0,0,0,0|3,0,0]=3 9 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)C 7a_100000230108_200000210301 [0,0,0,0,0,0|3,0,0]=3 10 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)N 2230a_100000740146_200000210301 [0,0,0,0,0,0|3,0,0]=3 11 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)N 34a_100000740146_200000210301 [0,0,0,0,0,0|3,0,0]=3 12 B13R1.50 CNc1cc(ccc1Cl)S(=O)(=O)N 34a_100000186249_200000210301 [0,0,0,0,0,0|3,0,0]=3 13 B13R1.50 CNc1cc(ccc1F)S(=O)(=O)C 34a_100000217634_200000210301 [0,0,0,0,0,0|3,0,0]=3 14 B13R1.50 CNc1cc(ccc1F)S(=O)(=O)C 7a_100000217634_200000210301 [0,0,0,0,0,0|3,0,0]=3 15 B13R1.50 CNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_200000210301 [0,0,0,0,0,0|2,0,0]=2 16 B13R1.50 CNc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_200000210301 [0,0,0,0,0,0|2,0,0]=2 17 B13R1.50 COc1cc(ccc1O)C(F)(F)F 271570a_203496583355_100010150383 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])Br 34a_200015322649_200025704644 [0,0,0,0,0,0|3,0,0]=3 19 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])Br 7a_200015322649_200025704644 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])F 34a_100000217634_200025704644 [0,0,0,0,0,0|3,0,0]=3 21 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])F 7a_100000217634_200025704644 [0,0,0,0,0,0|3,0,0]=3 22 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])O 34a_100000186253_200025704644 [0,0,0,0,0,0|2,0,0]=2 23 B13R1.50 CS(=O)(=O)c1ccc(c(c1)N[13CH3])O 7a_100000186253_200025704644 [0,0,0,0,0,0|2,0,0]=2 24 B13R1.50 CS(=O)(=O)c1ccc(c(c1)S[13CH3])F 62a_200000048130_200025704644 [0,0,0,0,0,0|2,1,0]=3 25 B13R1.50 CS(=O)(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_200000048130 [0,0,0,0,0,0|2,1,0]=3 26 B13R1.50 CS(=O)(=O)c1ccc(c(c1)S[13CH3])N 62a_100000743533_200025704644 [0,0,0,0,0,0|2,1,0]=3 27 B13R1.50 CS(=O)(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100000743533 [0,0,0,0,0,0|2,1,0]=3 28 B13R1.50 CSc1cc(ccc1C)S(=O)(=O)C 62a_100010175561_200000210301 [0,0,0,0,0,0|2,1,0]=3 29 B13R1.50 CSc1cc(ccc1C)S(=O)(=O)C 62a_200000210301_100010175561 [0,0,0,0,0,0|2,1,0]=3 30 B13R1.50 CSc1cc(ccc1C)S(=O)(=O)N 62a_100011847911_200000210301 [0,0,0,0,0,0|2,1,0]=3 31 B13R1.50 CSc1cc(ccc1C)S(=O)(=O)N 62a_200000210301_100011847911 [0,0,0,0,0,0|2,1,0]=3 32 B13R1.50 CSc1cc(ccc1F)S(=O)(=O)C 62a_200000048130_200000210301 [0,0,0,0,0,0|2,1,0]=3 33 B13R1.50 CSc1cc(ccc1F)S(=O)(=O)C 62a_200000210301_200000048130 [0,0,0,0,0,0|2,1,0]=3 34 B13R1.50 CSc1cc(ccc1F)S(=O)(=O)N 62a_100000164542_200000210301 [0,0,0,0,0,0|2,1,0]=3 35 B13R1.50 CSc1cc(ccc1F)S(=O)(=O)N 62a_200000210301_100000164542 [0,0,0,0,0,0|2,1,0]=3 36 B13R1.50 CSc1cc(ccc1N)S(=O)(=O)C 62a_100000743533_200000210301 [0,0,0,0,0,0|2,1,0]=3 37 B13R1.50 CSc1cc(ccc1N)S(=O)(=O)C 62a_200000210301_100000743533 [0,0,0,0,0,0|2,1,0]=3 38 B13R1.50 CSc1cc(ccc1N)S(=O)(=O)N 62a_100000736770_200000210301 [0,0,0,0,0,0|2,1,0]=3 39 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)C 34a_100000230108_200025704644 [0,0,0,0,0,0|3,0,0]=3 40 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)C 7a_100000230108_200025704644 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)N 2230a_100000740146_200025704644 [0,0,0,0,0,0|3,0,0]=3 42 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)N 34a_100000740146_200025704644 [0,0,0,0,0,0|3,0,0]=3 43 B13R1.50 Cc1ccc(cc1S[13CH3])S(=O)(=O)C 62a_100010175561_200025704644 [0,0,0,0,0,0|2,1,0]=3 44 B13R1.50 Cc1ccc(cc1S[13CH3])S(=O)(=O)C 62a_200025704644_100010175561 [0,0,0,0,0,0|2,1,0]=3 45 B13R1.50 Cc1ccc(cc1S[13CH3])S(=O)(=O)N 62a_100011847911_200025704644 [0,0,0,0,0,0|2,1,0]=3 46 B13R1.50 Cc1ccc(cc1S[13CH3])S(=O)(=O)N 62a_200025704644_100011847911 [0,0,0,0,0,0|2,1,0]=3 47 B13R1.50 [13CH3]Nc1cc(ccc1Cl)S(=O)(=O)N 34a_100000186249_200025704644 [0,0,0,0,0,0|3,0,0]=3 48 B13R1.50 [13CH3]Sc1cc(ccc1F)S(=O)(=O)N 62a_100000164542_200025704644 [0,0,0,0,0,0|2,1,0]=3 49 B13R1.50 [13CH3]Sc1cc(ccc1F)S(=O)(=O)N 62a_200025704644_100000164542 [0,0,0,0,0,0|2,1,0]=3 50 B13R1.50 [13CH3]Sc1cc(ccc1N)S(=O)(=O)N 62a_100000736770_200025704644 [0,0,0,0,0,0|2,1,0]=3 51 B12R1.23 CS(=O)(=O)c1ccc(c(c1)F)O 271570a_203496583355_100010234714 [1,0,0,0,0,0|2,0,0]=3 52 B12R1.23 CS(=O)(=O)c1ccc(c(c1)N)O 271570a_203496583355_200015322649 [1,0,0,0,0,0|2,0,0]=3 53 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)F 271570a_203496583355_200000048130 [1,0,0,0,0,0|2,0,0]=3 54 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000743533 [1,0,0,0,0,0|2,0,0]=3 55 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)C 271570a_203496583355_200010713620 [1,0,0,0,0,0|1,0,0]=2 56 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)N 271570a_203496583355_100000164573 [1,0,0,0,0,0|1,0,0]=2 57 B12R1.23 Cc1cc(ncc1O)S(=O)(=O)C 271570a_203496583355_100015714225 [1,0,0,0,0,0|2,0,0]=3 58 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)C 271570a_203496583355_100010175561 [1,0,0,0,0,0|2,0,0]=3 59 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)N 271570a_203496583355_100011847911 [1,0,0,0,0,0|2,0,0]=3 60 B12R1.23 NS(=O)(=O)c1ccc(c(c1)F)O 271570a_203496583355_100011217219 [1,0,0,0,0,0|2,0,0]=3 61 B12R1.23 NS(=O)(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000164542 [1,0,0,0,0,0|2,0,0]=3 62 B12R1.23 Nc1cc(ccc1O)S(=O)(=O)N 271570a_203496583355_100011222944 [1,0,0,0,0,0|2,0,0]=3 63 B12R1.23 Nc1ccc(cc1O)S(=O)(=O)N 271570a_203496583355_100000736770 [1,0,0,0,0,0|2,0,0]=3 64 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [1,0,0,0,0,0|3,0,0]=4 66 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [1,0,0,0,0,0|3,0,0]=4 67 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [1,0,0,0,0,0|3,0,0]=4 68 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [1,0,0,0,0,0|3,0,0]=4 69 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [1,0,0,0,0,0|2,1,0]=4 70 B12R1.56 CNc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200000210301 [1,0,0,0,0,0|2,0,1]=4 71 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [1,0,0,0,0,0|3,0,0]=4 72 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [1,0,0,0,0,0|3,0,0]=4 74 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [1,0,0,0,0,0|3,0,0]=4 75 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200000210301 [1,0,0,0,0,0|2,0,1]=4 76 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200000210301 [1,0,0,0,0,0|2,0,1]=4 77 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 34a_100000740739_200000210301 [1,0,0,0,0,0|2,0,1]=4 82 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 7a_100000740739_200000210301 [1,0,0,0,0,0|2,0,1]=4 83 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [1,0,0,0,0,0|3,0,0]=4 84 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [1,0,0,0,0,0|3,0,0]=4 85 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200000210301 [1,0,0,0,0,0|2,0,1]=4 86 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200000210301 [1,0,0,0,0,0|2,0,1]=4 87 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200000210301 [1,0,0,0,0,0|2,0,1]=4 92 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200000210301 [1,0,0,0,0,0|2,0,1]=4 93 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [1,0,0,0,0,0|3,0,0]=4 94 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [1,0,0,0,0,0|3,0,0]=4 95 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200000210301 [1,0,0,0,0,0|2,0,1]=4 96 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200000210301 [1,0,0,0,0,0|2,0,1]=4 97 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200000210301 [1,0,0,0,0,0|2,0,1]=4 100 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200000210301 [1,0,0,0,0,0|2,0,1]=4 101 B12R1.56 COc1cc(ccc1O)B(O)O 271570a_203496583355_100012355544 [1,0,0,0,0,0|1,0,1]=3 102 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [1,0,0,0,0,0|2,0,0]=3 103 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [1,0,0,0,0,0|2,0,0]=3 104 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [1,0,0,0,0,0|2,0,0]=3 105 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [1,0,0,0,0,0|2,0,0]=3 106 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.56 COc1cc(cnc1O)B(O)O 271570a_203496583355_100009846025 [1,0,0,0,0,0|2,0,1]=4 108 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [1,0,0,0,0,0|2,1,0]=4 109 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000740739_200025704644 [1,0,0,0,0,0|2,0,1]=4 110 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000740739_200025704644 [1,0,0,0,0,0|2,0,1]=4 111 B12R1.56 [13CH3]Nc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200025704644 [1,0,0,0,0,0|2,0,1]=4 112 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [1,0,0,0,0,0|3,0,0]=4 113 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200025704644 [1,0,0,0,0,0|2,0,1]=4 115 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200025704644 [1,0,0,0,0,0|2,0,1]=4 116 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200025704644 [1,0,0,0,0,0|2,0,1]=4 117 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200025704644 [1,0,0,0,0,0|2,0,1]=4 118 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200025704644 [1,0,0,0,0,0|2,0,1]=4 119 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200025704644 [1,0,0,0,0,0|2,0,1]=4 120 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200025704644 [1,0,0,0,0,0|2,0,1]=4 121 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200025704644 [1,0,0,0,0,0|2,0,1]=4 122 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [1,0,0,0,0,0|3,0,0]=4 123 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [1,0,0,0,0,0|3,0,0]=4 124 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200025704644 [1,0,0,0,0,0|2,0,1]=4 125 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200025704644 [1,0,0,0,0,0|2,0,1]=4 126 B12R1.436 C=Cc1cccc(c1)S(=O)(=O)C 271570a_100011290941_100009815773 [1,0,0,0,0,0|2,0,1]=4 127 B12R1.436 C=Cc1cccc(c1)S(=O)(=O)N 271570a_100011290941_100000164563 [1,0,0,0,0,0|2,0,1]=4 128 B12R1.436 CC(C)(O)c1cccc(c1)O[13CH3] 34a_200000085863_200025704644 [1,0,0,0,0,0|3,0,0]=4 129 B12R1.436 CC(C)(O)c1cccc(c1)O[13CH3] 7a_200000085863_200025704644 [1,0,0,0,0,0|3,0,0]=4 130 B12R1.436 CNc1cccc(c1)S(=O)(=O)C 34a_100000209861_200000210301 [1,0,0,0,0,0|2,0,0]=3 131 B12R1.436 CNc1cccc(c1)S(=O)(=O)C 7a_100000209861_200000210301 [1,0,0,0,0,0|2,0,0]=3 132 B12R1.436 CNc1cccc(c1)S(=O)(=O)N 34a_100000182236_200000210301 [1,0,0,0,0,0|2,0,0]=3 133 B12R1.436 CNc1cccc(n1)S(=O)(=O)C 27a_100102657272_100010191205 [1,0,0,0,0,0|3,0,0]=4 134 B12R1.436 CNc1cncc(c1)S(=O)(=O)C 27a_100102657272_100000702611 [1,0,0,0,0,0|3,0,0]=4 135 B12R1.436 COc1cccc(c1)C(C)(C)O 34a_200000085863_200000210301 [1,0,0,0,0,0|3,0,0]=4 136 B12R1.436 COc1cccc(c1)C(C)(C)O 7a_200000085863_200000210301 [1,0,0,0,0,0|3,0,0]=4 137 B12R1.436 COc1cccc(c1)S(=O)(=O)[O-] 7a_100000116945_200000210301 [1,0,0,0,0,0|0,0,1]=2 138 B12R1.436 CS(=O)(=O)c1cccc(c1)N[13CH3] 34a_100000209861_200025704644 [1,0,0,0,0,0|2,0,0]=3 139 B12R1.436 CS(=O)(=O)c1cccc(c1)N[13CH3] 7a_100000209861_200025704644 [1,0,0,0,0,0|2,0,0]=3 140 B12R1.436 CS(=O)(=O)c1cccc(c1)S[13CH3] 62a_100009815773_200025704644 [1,0,0,0,0,0|1,1,0]=3 141 B12R1.436 CS(=O)(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009815773 [1,0,0,0,0,0|1,1,0]=3 142 B12R1.436 CS(=O)(=O)c1cccc(n1)S[13CH3] 62a_100010191205_200025704644 [1,0,0,0,0,0|2,1,0]=4 143 B12R1.436 CS(=O)(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100010191205 [1,0,0,0,0,0|2,1,0]=4 144 B12R1.436 CS(=O)(=O)c1ccnc(c1)S[13CH3] 62a_100016215246_200025704644 [1,0,0,0,0,0|2,1,0]=4 145 B12R1.436 CS(=O)(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100016215246 [1,0,0,0,0,0|2,1,0]=4 146 B12R1.436 CS(=O)(=O)c1cncc(c1)S[13CH3] 62a_100000702611_200025704644 [1,0,0,0,0,0|2,1,0]=4 147 B12R1.436 CS(=O)(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100000702611 [1,0,0,0,0,0|2,1,0]=4 148 B12R1.436 CSc1cc(ccn1)S(=O)(=O)C 62a_100016215246_200000210301 [1,0,0,0,0,0|2,1,0]=4 149 B12R1.436 CSc1cc(ccn1)S(=O)(=O)C 62a_200000210301_100016215246 [1,0,0,0,0,0|2,1,0]=4 150 B12R1.436 CSc1cccc(c1)S(=O)(=O)C 62a_100009815773_200000210301 [1,0,0,0,0,0|1,1,0]=3 151 B12R1.436 CSc1cccc(c1)S(=O)(=O)C 62a_200000210301_100009815773 [1,0,0,0,0,0|1,1,0]=3 152 B12R1.436 CSc1cccc(c1)S(=O)(=O)N 62a_100000164563_200000210301 [1,0,0,0,0,0|1,1,0]=3 153 B12R1.436 CSc1cccc(c1)S(=O)(=O)N 62a_200000210301_100000164563 [1,0,0,0,0,0|1,1,0]=3 154 B12R1.436 CSc1cccc(n1)S(=O)(=O)C 62a_100010191205_200000210301 [1,0,0,0,0,0|2,1,0]=4 155 B12R1.436 CSc1cccc(n1)S(=O)(=O)C 62a_200000210301_100010191205 [1,0,0,0,0,0|2,1,0]=4 156 B12R1.436 CSc1cccc(n1)S(=O)(=O)N 62a_100010191238_200000210301 [1,0,0,0,0,0|2,1,0]=4 157 B12R1.436 CSc1cccc(n1)S(=O)(=O)N 62a_200000210301_100010191238 [1,0,0,0,0,0|2,1,0]=4 158 B12R1.436 CSc1cncc(c1)S(=O)(=O)C 62a_100000702611_200000210301 [1,0,0,0,0,0|2,1,0]=4 159 B12R1.436 CSc1cncc(c1)S(=O)(=O)C 62a_200000210301_100000702611 [1,0,0,0,0,0|2,1,0]=4 160 B12R1.436 CSc1cncc(c1)S(=O)(=O)N 62a_100000745556_200000210301 [1,0,0,0,0,0|2,1,0]=4 161 B12R1.436 CSc1cncc(c1)S(=O)(=O)N 62a_200000210301_100000745556 [1,0,0,0,0,0|2,1,0]=4 162 B12R1.436 [13CH3]Nc1cccc(c1)S(=O)(=O)N 34a_100000182236_200025704644 [1,0,0,0,0,0|2,0,0]=3 163 B12R1.436 [13CH3]Oc1cccc(c1)S(=O)(=O)[O-] 7a_100000116945_200025704644 [1,0,0,0,0,0|0,0,1]=2 164 B12R1.436 [13CH3]Sc1cccc(c1)S(=O)(=O)N 62a_100000164563_200025704644 [1,0,0,0,0,0|1,1,0]=3 165 B12R1.436 [13CH3]Sc1cccc(c1)S(=O)(=O)N 62a_200025704644_100000164563 [1,0,0,0,0,0|1,1,0]=3 166 B12R1.436 [13CH3]Sc1cccc(n1)S(=O)(=O)N 62a_100010191238_200025704644 [1,0,0,0,0,0|2,1,0]=4 167 B12R1.436 [13CH3]Sc1cccc(n1)S(=O)(=O)N 62a_200025704644_100010191238 [1,0,0,0,0,0|2,1,0]=4 168 B12R1.436 [13CH3]Sc1cncc(c1)S(=O)(=O)N 62a_100000745556_200025704644 [1,0,0,0,0,0|2,1,0]=4 169 B12R1.436 [13CH3]Sc1cncc(c1)S(=O)(=O)N 62a_200025704644_100000745556 [1,0,0,0,0,0|2,1,0]=4 170 B14R1.437 CC=Cc1cc(ccc1C)S(=O)(=O)C 271570a_100016259895_100010175561 [0,1,0,0,0,0|3,0,0]=4 171 B14R1.437 CC=Cc1cc(ccc1C)S(=O)(=O)N 271570a_100016259895_100011847911 [0,1,0,0,0,0|3,0,0]=4 172 B14R1.437 CC=Cc1cc(ccc1F)S(=O)(=O)C 271570a_100016259895_200000048130 [0,1,0,0,0,0|3,0,0]=4 173 B14R1.437 CC=Cc1cc(ccc1F)S(=O)(=O)N 271570a_100016259895_100000164542 [0,1,0,0,0,0|3,0,0]=4 174 B14R1.437 CC=Cc1cc(ccc1N)S(=O)(=O)C 271570a_100016259895_100000743533 [0,1,0,0,0,0|3,0,0]=4 175 B14R1.437 CC=Cc1cc(ccc1N)S(=O)(=O)N 271570a_100016259895_100000736770 [0,1,0,0,0,0|3,0,0]=4 176 B14R1.437 CCNc1cc(ccc1Br)S(=O)(=O)C 34a_200015322649_100000210202 [0,1,0,0,0,0|3,0,0]=4 177 B14R1.437 CCNc1cc(ccc1Br)S(=O)(=O)C 7a_200015322649_100000210202 [0,1,0,0,0,0|3,0,0]=4 178 B14R1.437 CCNc1cc(ccc1C)S(=O)(=O)C 34a_100000230108_100000210202 [0,1,0,0,0,0|3,0,0]=4 179 B14R1.437 CCNc1cc(ccc1C)S(=O)(=O)C 7a_100000230108_100000210202 [0,1,0,0,0,0|3,0,0]=4 180 B14R1.437 CCNc1cc(ccc1C)S(=O)(=O)N 2230a_100000740146_100000210202 [0,1,0,0,0,0|3,0,0]=4 181 B14R1.437 CCNc1cc(ccc1C)S(=O)(=O)N 34a_100000740146_100000210202 [0,1,0,0,0,0|3,0,0]=4 182 B14R1.437 CCNc1cc(ccc1Cl)S(=O)(=O)N 34a_100000186249_100000210202 [0,1,0,0,0,0|3,0,0]=4 183 B14R1.437 CCNc1cc(ccc1F)S(=O)(=O)C 34a_100000217634_100000210202 [0,1,0,0,0,0|3,0,0]=4 184 B14R1.437 CCNc1cc(ccc1F)S(=O)(=O)C 7a_100000217634_100000210202 [0,1,0,0,0,0|3,0,0]=4 185 B14R1.437 CCNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100000210202 [0,1,0,0,0,0|2,0,0]=3 186 B14R1.437 CCNc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_100000210202 [0,1,0,0,0,0|2,0,0]=3 187 B14R1.437 CCSc1cc(ccc1C)S(=O)(=O)C 62a_100000210202_100010175561 [0,1,0,0,0,0|2,1,0]=4 188 B14R1.437 CCSc1cc(ccc1C)S(=O)(=O)C 62a_100010175561_100000210202 [0,1,0,0,0,0|2,1,0]=4 189 B14R1.437 CCSc1cc(ccc1C)S(=O)(=O)N 62a_100000210202_100011847911 [0,1,0,0,0,0|2,1,0]=4 190 B14R1.437 CCSc1cc(ccc1C)S(=O)(=O)N 62a_100011847911_100000210202 [0,1,0,0,0,0|2,1,0]=4 191 B14R1.437 CCSc1cc(ccc1F)S(=O)(=O)C 62a_100000210202_200000048130 [0,1,0,0,0,0|2,1,0]=4 192 B14R1.437 CCSc1cc(ccc1F)S(=O)(=O)C 62a_200000048130_100000210202 [0,1,0,0,0,0|2,1,0]=4 193 B14R1.437 CCSc1cc(ccc1F)S(=O)(=O)N 62a_100000164542_100000210202 [0,1,0,0,0,0|2,1,0]=4 194 B14R1.437 CCSc1cc(ccc1F)S(=O)(=O)N 62a_100000210202_100000164542 [0,1,0,0,0,0|2,1,0]=4 195 B14R1.437 CCSc1cc(ccc1N)S(=O)(=O)C 62a_100000210202_100000743533 [0,1,0,0,0,0|2,1,0]=4 196 B14R1.437 CCSc1cc(ccc1N)S(=O)(=O)C 62a_100000743533_100000210202 [0,1,0,0,0,0|2,1,0]=4 197 B14R1.437 CCSc1cc(ccc1N)S(=O)(=O)N 62a_100000736770_100000210202 [0,1,0,0,0,0|2,1,0]=4 198 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)Br 34a_200015322649_100015361967 [0,1,0,0,0,0|3,0,0]=4 199 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)Br 7a_200015322649_100015361967 [0,1,0,0,0,0|3,0,0]=4 200 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)F 34a_100000217634_100015361967 [0,1,0,0,0,0|3,0,0]=4 201 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)F 7a_100000217634_100015361967 [0,1,0,0,0,0|3,0,0]=4 202 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)O 34a_100000186253_100015361967 [0,1,0,0,0,0|2,0,0]=3 203 B14R1.437 CS(=O)(=O)c1ccc(c(c1)NCF)O 7a_100000186253_100015361967 [0,1,0,0,0,0|2,0,0]=3 204 B14R1.437 CS(=O)(=O)c1ccc(c(c1)SCF)F 62a_100015361967_200000048130 [0,1,0,0,0,0|2,1,0]=4 205 B14R1.437 CS(=O)(=O)c1ccc(c(c1)SCF)F 62a_200000048130_100015361967 [0,1,0,0,0,0|2,1,0]=4 206 B14R1.437 CS(=O)(=O)c1ccc(c(c1)SCF)N 62a_100000743533_100015361967 [0,1,0,0,0,0|2,1,0]=4 207 B14R1.437 CS(=O)(=O)c1ccc(c(c1)SCF)N 62a_100015361967_100000743533 [0,1,0,0,0,0|2,1,0]=4 208 B14R1.437 Cc1ccc(cc1NCF)S(=O)(=O)C 34a_100000230108_100015361967 [0,1,0,0,0,0|3,0,0]=4 209 B14R1.437 Cc1ccc(cc1NCF)S(=O)(=O)C 7a_100000230108_100015361967 [0,1,0,0,0,0|3,0,0]=4 210 B14R1.437 Cc1ccc(cc1NCF)S(=O)(=O)N 34a_100000740146_100015361967 [0,1,0,0,0,0|3,0,0]=4 211 B14R1.437 Cc1ccc(cc1SCF)S(=O)(=O)C 62a_100010175561_100015361967 [0,1,0,0,0,0|2,1,0]=4 212 B14R1.437 Cc1ccc(cc1SCF)S(=O)(=O)C 62a_100015361967_100010175561 [0,1,0,0,0,0|2,1,0]=4 213 B14R1.437 Cc1ccc(cc1SCF)S(=O)(=O)N 62a_100011847911_100015361967 [0,1,0,0,0,0|2,1,0]=4 214 B14R1.437 Cc1ccc(cc1SCF)S(=O)(=O)N 62a_100015361967_100011847911 [0,1,0,0,0,0|2,1,0]=4 215 B14R1.437 NS(=O)(=O)c1ccc(c(c1)NCF)Cl 34a_100000186249_100015361967 [0,1,0,0,0,0|3,0,0]=4 216 B14R1.437 NS(=O)(=O)c1ccc(c(c1)SCF)F 62a_100000164542_100015361967 [0,1,0,0,0,0|2,1,0]=4 217 B14R1.437 NS(=O)(=O)c1ccc(c(c1)SCF)F 62a_100015361967_100000164542 [0,1,0,0,0,0|2,1,0]=4 218 B14R1.437 Nc1ccc(cc1SCF)S(=O)(=O)N 62a_100000736770_100015361967 [0,1,0,0,0,0|2,1,0]=4 219 B14R1.680 C=C(C)c1cc(ccc1C)S(=O)(=O)C 271570a_100000694244_100010175561 [0,1,0,0,0,0|3,0,0]=4 220 B14R1.680 C=C(C)c1cc(ccc1C)S(=O)(=O)N 271570a_100000694244_100011847911 [0,1,0,0,0,0|3,0,0]=4 221 B14R1.680 C=C(C)c1cc(ccc1F)S(=O)(=O)C 271570a_100000694244_200000048130 [0,1,0,0,0,0|3,0,0]=4 222 B14R1.680 C=C(C)c1cc(ccc1F)S(=O)(=O)N 271570a_100000694244_100000164542 [0,1,0,0,0,0|3,0,0]=4 223 B14R1.680 C=C(C)c1cc(ccc1N)S(=O)(=O)C 271570a_100000694244_100000743533 [0,1,0,0,0,0|3,0,0]=4 224 B14R1.680 C=C(C)c1cc(ccc1N)S(=O)(=O)N 271570a_100000694244_100000736770 [0,1,0,0,0,0|3,0,0]=4 225 B14R1.680 CC(=O)c1cc(ccc1C)S(=O)(=O)N 1458a_100000176667_200000210301 [0,1,0,0,0,0|3,0,0]=4 226 B14R1.680 CC(=O)c1cc(ccc1Cl)S(=O)(=O)C 1458a_100000181289_200000210301 [0,1,0,0,0,0|3,0,0]=4 227 B14R1.680 CC(=O)c1cc(ccc1Cl)S(=O)(=O)N 1458a_100000171173_200000210301 [0,1,0,0,0,0|3,0,0]=4 228 B14R1.680 CC(=O)c1cc(ccc1F)S(=O)(=O)C 1458a_100000743400_200000210301 [0,1,0,0,0,0|3,0,0]=4 229 B14R1.680 CC(=O)c1cc(ccc1F)S(=O)(=O)N 1458a_100000176669_200000210301 [0,1,0,0,0,0|3,0,0]=4 230 B14R1.680 CS(=O)(=O)c1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100000181289_200025704644 [0,1,0,0,0,0|3,0,0]=4 231 B14R1.680 CS(=O)(=O)c1ccc(c(c1)C(=O)[13CH3])F 1458a_100000743400_200025704644 [0,1,0,0,0,0|3,0,0]=4 232 B14R1.680 Cc1ccc(cc1C(=O)[13CH3])S(=O)(=O)N 1458a_100000176667_200025704644 [0,1,0,0,0,0|3,0,0]=4 233 B14R1.680 [13CH3]C(=O)c1cc(ccc1Cl)S(=O)(=O)N 1458a_100000171173_200025704644 [0,1,0,0,0,0|3,0,0]=4 234 B14R1.680 [13CH3]C(=O)c1cc(ccc1F)S(=O)(=O)N 1458a_100000176669_200025704644 [0,1,0,0,0,0|3,0,0]=4 235 B14R1.2279 CNc1cc(c(cc1C)C)S(=O)(=O)C 34a_100000067527_200000210301 [0,1,0,0,0,0|3,0,0]=4 236 B14R1.2279 CNc1cc(c(cc1C)C)S(=O)(=O)C 7a_100000067527_200000210301 [0,1,0,0,0,0|3,0,0]=4 237 B14R1.2279 CNc1cc(c(cc1F)F)S(=O)(=O)N 27a_100102657272_200011219831 [0,1,0,0,0,0|3,0,0]=4 238 B14R1.2279 COc1cc(c(cc1N)Cl)S(=O)(=O)N 34a_200010005463_200000210301 [0,1,0,0,0,0|2,0,0]=3 239 B14R1.2279 COc1cc(c(cc1N)Cl)S(=O)(=O)N 7a_200010005463_200000210301 [0,1,0,0,0,0|2,0,0]=3 240 B14R1.2279 CSc1cc(c(cc1F)F)S(=O)(=O)N 62a_200000210301_200011219831 [0,1,0,0,0,0|2,1,0]=4 241 B14R1.2279 CSc1cc(c(cc1F)F)S(=O)(=O)N 62a_200011219831_200000210301 [0,1,0,0,0,0|2,1,0]=4 242 B14R1.2279 Cc1cc(c(cc1N[13CH3])S(=O)(=O)C)C 34a_100000067527_200025704644 [0,1,0,0,0,0|3,0,0]=4 243 B14R1.2279 Cc1cc(c(cc1N[13CH3])S(=O)(=O)C)C 7a_100000067527_200025704644 [0,1,0,0,0,0|3,0,0]=4 244 B14R1.2279 [13CH3]Oc1cc(c(cc1N)Cl)S(=O)(=O)N 34a_200010005463_200025704644 [0,1,0,0,0,0|2,0,0]=3 245 B14R1.2279 [13CH3]Oc1cc(c(cc1N)Cl)S(=O)(=O)N 7a_200010005463_200025704644 [0,1,0,0,0,0|2,0,0]=3 246 B14R1.2279 [13CH3]Sc1cc(c(cc1F)F)S(=O)(=O)N 62a_200011219831_200025704644 [0,1,0,0,0,0|2,1,0]=4 247 B14R1.2279 [13CH3]Sc1cc(c(cc1F)F)S(=O)(=O)N 62a_200025704644_200011219831 [0,1,0,0,0,0|2,1,0]=4 248 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)NC)O 34a_100000210498_200000210301 [0,1,0,0,0,0|2,0,0]=3 249 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)NC)O 7a_100000210498_200000210301 [0,1,0,0,0,0|2,0,0]=3 250 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])O 34a_100000210498_200025704644 [0,1,0,0,0,0|2,0,0]=3 251 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])O 7a_100000210498_200025704644 [0,1,0,0,0,0|2,0,0]=3 252 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)C=O)O 270084a_100102657272_102495703266 [0,1,0,0,0,0|3,0,0]=4 253 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)C=O)O 274078a_100102657272_102495703266 [0,1,0,0,0,0|3,0,0]=4 254 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)N[13CH3])C 34a_100000740302_200025704644 [0,1,0,0,0,0|3,0,0]=4 255 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)N[13CH3])C 7a_100000740302_200025704644 [0,1,0,0,0,0|3,0,0]=4 256 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)N[13CH3])O 34a_100000732981_200025704644 [0,1,0,0,0,0|2,0,0]=3 257 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)OC)Br 270084a_100102657272_100000765252 [0,1,0,0,0,0|2,0,0]=3 258 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)OC)Br 274078a_100102657272_100000765252 [0,1,0,0,0,0|2,0,0]=3 259 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)OC)F 270084a_100102657272_100000717096 [0,1,0,0,0,0|2,0,0]=3 260 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)OC)F 274078a_100102657272_100000717096 [0,1,0,0,0,0|2,0,0]=3 261 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)SC)Br 270084a_100102657272_114948214829 [0,1,0,0,0,0|2,1,0]=4 262 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)SC)Br 274078a_100102657272_114948214829 [0,1,0,0,0,0|2,1,0]=4 263 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)SC)C 62a_200000210301_200012355755 [0,1,0,0,0,0|2,1,0]=4 264 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)SC)C 62a_200012355755_200000210301 [0,1,0,0,0,0|2,1,0]=4 265 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)S[13CH3])C 62a_200012355755_200025704644 [0,1,0,0,0,0|2,1,0]=4 266 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_200012355755 [0,1,0,0,0,0|2,1,0]=4 267 B14R1.3413 CNc1cc(ccc1C)S(=O)(=O)NC 34a_100000740302_200000210301 [0,1,0,0,0,0|3,0,0]=4 268 B14R1.3413 CNc1cc(ccc1C)S(=O)(=O)NC 7a_100000740302_200000210301 [0,1,0,0,0,0|3,0,0]=4 269 B14R1.3413 CNc1cc(ccc1O)S(=O)(=O)NC 34a_100000732981_200000210301 [0,1,0,0,0,0|2,0,0]=3 270 B14R1.3654 CNc1cc(ccc1OC)S(=O)(=O)C 34a_100011298280_200000210301 [0,1,0,0,0,0|2,0,0]=3 271 B14R1.3654 CNc1cc(ccc1OC)S(=O)(=O)C 7a_100011298280_200000210301 [0,1,0,0,0,0|2,0,0]=3 272 B14R1.3654 CNc1ccc(cc1OC)S(=O)(=O)C 34a_100011900471_200000210301 [0,1,0,0,0,0|2,0,0]=3 273 B14R1.3654 COc1cc(ccc1N[13CH3])S(=O)(=O)C 34a_100011900471_200025704644 [0,1,0,0,0,0|2,0,0]=3 274 B14R1.3654 COc1ccc(cc1N[13CH3])S(=O)(=O)C 34a_100011298280_200025704644 [0,1,0,0,0,0|2,0,0]=3 275 B14R1.3654 COc1ccc(cc1N[13CH3])S(=O)(=O)C 7a_100011298280_200025704644 [0,1,0,0,0,0|2,0,0]=3 276 B14R1.3654 CS(=O)(=O)c1ccc(c(c1)S[13CH3])C=O 62a_200000036326_200025704644 [0,1,0,0,0,0|1,1,1]=4 277 B14R1.3654 CS(=O)(=O)c1ccc(c(c1)S[13CH3])C=O 62a_200025704644_200000036326 [0,1,0,0,0,0|1,1,1]=4 278 B14R1.3654 CS(=O)(=O)c1ccc(c(c1)S[13CH3])NN 62a_100009814396_200025704644 [0,1,0,0,0,0|2,1,0]=4 279 B14R1.3654 CS(=O)(=O)c1ccc(c(c1)S[13CH3])NN 62a_200025704644_100009814396 [0,1,0,0,0,0|2,1,0]=4 280 B14R1.3654 CSc1cc(ccc1C=O)S(=O)(=O)C 62a_200000036326_200000210301 [0,1,0,0,0,0|1,1,1]=4 281 B14R1.3654 CSc1cc(ccc1C=O)S(=O)(=O)C 62a_200000210301_200000036326 [0,1,0,0,0,0|1,1,1]=4 282 B14R1.3654 CSc1cc(ccc1NN)S(=O)(=O)C 62a_100009814396_200000210301 [0,1,0,0,0,0|2,1,0]=4 283 B14R1.3654 CSc1cc(ccc1NN)S(=O)(=O)C 62a_200000210301_100009814396 [0,1,0,0,0,0|2,1,0]=4 284 B14R1.4107 CNc1c(ccc(c1C)S(=O)(=O)C)C 34a_200000036878_200000210301 [0,1,0,0,0,0|3,0,0]=4 285 B14R1.4107 CNc1c(ccc(c1C)S(=O)(=O)C)C 7a_200000036878_200000210301 [0,1,0,0,0,0|3,0,0]=4 286 B14R1.4107 Cc1ccc(c(c1N[13CH3])C)S(=O)(=O)C 34a_200000036878_200025704644 [0,1,0,0,0,0|3,0,0]=4 287 B14R1.4107 Cc1ccc(c(c1N[13CH3])C)S(=O)(=O)C 7a_200000036878_200025704644 [0,1,0,0,0,0|3,0,0]=4 288 B14R1.3412 CCc1cc(ccc1Br)NS(=O)(=O)C 40a_100010109747_100000738038 [0,0,0,0,0,1|3,0,0]=4 289 B14R1.3412 CNc1cc(ccc1F)NS(=O)(=O)C 34a_200011193678_200000210301 [0,0,0,0,0,1|3,0,0]=4 290 B14R1.3412 CNc1cc(ccc1O)CS(=O)(=O)N 2230a_200010686696_200000210301 [0,0,0,0,0,1|2,0,0]=3 291 B14R1.3412 CNc1cc(ccc1O)CS(=O)(=O)N 34a_200010686696_200000210301 [0,0,0,0,0,1|2,0,0]=3 292 B14R1.3412 COc1cc(ccc1Br)NS(=O)(=O)C 40a_100000765947_100000738038 [0,0,0,0,0,1|2,0,0]=3 293 B14R1.3412 COc1cc(ccc1C)NS(=O)(=O)C 40a_100011279678_100000738038 [0,0,0,0,0,1|2,0,0]=3 294 B14R1.3412 COc1cc(ccc1Cl)NS(=O)(=O)C 40a_100000742311_100000738038 [0,0,0,0,0,1|2,0,0]=3 295 B14R1.3412 COc1cc(ccc1F)NS(=O)(=O)C 40a_100000701188_100000738038 [0,0,0,0,0,1|2,0,0]=3 296 B14R1.3412 COc1cc(ccc1I)NS(=O)(=O)C 40a_100000746945_100000738038 [0,0,0,0,0,1|2,0,0]=3 297 B14R1.3412 COc1cc(ccc1O)NS(=O)(=O)C 40a_100000726020_100000738038 [0,0,0,0,0,1|1,0,0]=2 298 B14R1.3412 CS(=O)(=O)Nc1ccc(c(c1)N[13CH3])F 34a_200011193678_200025704644 [0,0,0,0,0,1|3,0,0]=4 299 B14R1.3412 CS(=O)(=O)Nc1ccc(c(c1)S[13CH3])F 62a_100012348136_200025704644 [0,0,0,0,0,1|2,1,0]=4 300 B14R1.3412 CS(=O)(=O)Nc1ccc(c(c1)S[13CH3])F 62a_200025704644_100012348136 [0,0,0,0,0,1|2,1,0]=4 301 B14R1.3412 CSc1cc(ccc1F)CS(=O)(=O)N 62a_100011405576_200000210301 [0,0,0,0,0,1|2,1,0]=4 302 B14R1.3412 CSc1cc(ccc1F)CS(=O)(=O)N 62a_200000210301_100011405576 [0,0,0,0,0,1|2,1,0]=4 303 B14R1.3412 CSc1cc(ccc1F)NS(=O)(=O)C 62a_100012348136_200000210301 [0,0,0,0,0,1|2,1,0]=4 304 B14R1.3412 CSc1cc(ccc1F)NS(=O)(=O)C 62a_200000210301_100012348136 [0,0,0,0,0,1|2,1,0]=4 305 B14R1.3412 [13CH3]Nc1cc(ccc1O)CS(=O)(=O)N 2230a_200010686696_200025704644 [0,0,0,0,0,1|2,0,0]=3 306 B14R1.3412 [13CH3]Nc1cc(ccc1O)CS(=O)(=O)N 34a_200010686696_200025704644 [0,0,0,0,0,1|2,0,0]=3 307 B14R1.3412 [13CH3]Sc1cc(ccc1F)CS(=O)(=O)N 62a_100011405576_200025704644 [0,0,0,0,0,1|2,1,0]=4 308 B14R1.3412 [13CH3]Sc1cc(ccc1F)CS(=O)(=O)N 62a_200025704644_100011405576 [0,0,0,0,0,1|2,1,0]=4 309 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [2,0,0,0,0,0|1,0,0]=3 310 B11R1.19 CS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814649 [2,0,0,0,0,0|2,0,0]=4 311 B11R1.19 CS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100009816761 [2,0,0,0,0,0|2,0,0]=4 312 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [2,0,0,0,0,0|1,0,0]=3 313 B11R1.19 NS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_200000753255 [2,0,0,0,0,0|2,0,0]=4 314 B11R1.19 NS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100000164566 [2,0,0,0,0,0|2,0,0]=4 315 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [2,0,0,0,0,0|2,0,0]=4 316 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [2,0,0,0,0,0|2,0,0]=4 317 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [2,0,0,0,0,0|2,0,0]=4 318 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [2,0,0,0,0,0|2,0,0]=4 319 B11R1.21 Cc1cc(ccc1O)B(O)O 271570a_203496583355_100010089846 [2,0,0,0,0,0|1,0,1]=4 320 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [2,0,0,0,0,0|2,0,0]=4 321 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [2,0,0,0,0,0|2,0,0]=4 322 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [2,0,0,0,0,0|2,0,0]=4 323 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [2,0,0,0,0,0|2,0,0]=4 324 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [2,0,0,0,0,0|1,0,0]=3 325 B11R1.155 CS(=O)(=O)c1cccc(n1)O 271570a_203496583355_100010191205 [2,0,0,0,0,0|2,0,0]=4 326 B11R1.155 CS(=O)(=O)c1ccnc(c1)O 271570a_203496583355_100016215246 [2,0,0,0,0,0|2,0,0]=4 327 B11R1.155 CS(=O)(=O)c1cncc(c1)O 271570a_203496583355_100000702611 [2,0,0,0,0,0|2,0,0]=4 328 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [2,0,0,0,0,0|1,0,0]=3 329 B11R1.155 NS(=O)(=O)c1cccc(n1)O 271570a_203496583355_100010191238 [2,0,0,0,0,0|2,0,0]=4 330 B11R1.155 NS(=O)(=O)c1cncc(c1)O 271570a_203496583355_100000745556 [2,0,0,0,0,0|2,0,0]=4 331 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [2,0,0,0,0,0|2,0,0]=4 332 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [2,0,0,0,0,0|2,0,0]=4 333 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [2,0,0,0,0,0|2,0,0]=4 334 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [2,0,0,0,0,0|2,0,0]=4 335 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [2,0,0,0,0,0|2,0,0]=4 336 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [2,0,0,0,0,0|2,0,0]=4 337 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [2,0,0,0,0,0|2,0,0]=4 338 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [2,0,0,0,0,0|2,0,0]=4 339 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [2,0,0,0,0,0|2,0,0]=4 340 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [2,0,0,0,0,0|2,0,0]=4 341 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [2,0,0,0,0,0|2,0,0]=4 342 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [2,0,0,0,0,0|2,0,0]=4 343 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [2,0,0,0,0,0|1,0,1]=4 344 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [2,0,0,0,0,0|1,0,1]=4 345 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [2,0,0,0,0,0|1,0,1]=4 348 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [2,0,0,0,0,0|1,0,1]=4 349 B11R1.280 C=Cc1ccc(c(c1)OC)O 271570a_100011290941_100000694246 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.280 CCc1ccc(c(c1)OC)O 271570a_203496583355_200010710389 [2,0,0,0,0,0|2,0,0]=4 351 B11R1.280 CNc1cc(ccc1O)CO 34a_100000123545_200000210301 [2,0,0,0,0,0|2,0,0]=4 352 B11R1.280 CNc1ccc(c(c1)OC)O 34a_100000726020_200000210301 [2,0,0,0,0,0|2,0,0]=4 353 B11R1.280 COc1cc(ccc1Br)CO 34a_100010191536_200000210301 [2,0,0,0,0,0|2,0,0]=4 354 B11R1.280 COc1cc(ccc1Br)CO 7a_100010191536_200000210301 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.280 COc1cc(ccc1Cl)CO 34a_100009876509_200000210301 [2,0,0,0,0,0|2,0,0]=4 356 B11R1.280 COc1cc(ccc1Cl)CO 7a_100009876509_200000210301 [2,0,0,0,0,0|2,0,0]=4 357 B11R1.280 COc1cc(ccc1F)CO 34a_100009842347_200000210301 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.280 COc1cc(ccc1F)CO 7a_100009842347_200000210301 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.280 COc1cc(ccc1I)CO 34a_100000049605_200000210301 [2,0,0,0,0,0|2,0,0]=4 360 B11R1.280 COc1cc(ccc1I)CO 7a_100000049605_200000210301 [2,0,0,0,0,0|2,0,0]=4 361 B11R1.280 COc1cc(ccc1O)C#N 271570a_203496583355_100012356288 [2,0,0,0,0,0|2,0,0]=4 362 B11R1.280 COc1cc(ccc1O)C=O 271570a_203496583355_100010244714 [2,0,0,0,0,0|1,0,0]=3 363 B11R1.280 COc1cc(ccc1O)CO 271570a_203496583355_100010234685 [2,0,0,0,0,0|1,0,0]=3 364 B11R1.280 COc1cc(ccc1O)N[13CH3] 34a_100000726020_200025704644 [2,0,0,0,0,0|2,0,0]=4 365 B11R1.280 COc1cc(ccc1O)SC 62a_200000210301_100000694246 [2,0,0,0,0,0|1,0,1]=4 366 B11R1.280 COc1cc(ccc1O)S[13CH3] 62a_200025704644_100000694246 [2,0,0,0,0,0|1,0,1]=4 367 B11R1.280 COc1cc(ncc1O)CO 271570a_203496583355_100010999569 [2,0,0,0,0,0|2,0,0]=4 368 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [2,0,0,0,0,0|1,1,0]=4 369 B11R1.280 CSc1cc(ccc1O)C=O 62a_100000184552_200000210301 [2,0,0,0,0,0|1,1,0]=4 370 B11R1.280 CSc1cc(ccc1O)C=O 62a_200000210301_100000184552 [2,0,0,0,0,0|1,1,0]=4 371 B11R1.280 CSc1cc(ccc1O)CO 62a_100011191544_200000210301 [2,0,0,0,0,0|1,1,0]=4 372 B11R1.280 CSc1cc(ccc1O)CO 62a_200000210301_100011191544 [2,0,0,0,0,0|1,1,0]=4 373 B11R1.280 [13CH3]Nc1cc(ccc1O)CO 34a_100000123545_200025704644 [2,0,0,0,0,0|2,0,0]=4 374 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 34a_100010191536_200025704644 [2,0,0,0,0,0|2,0,0]=4 375 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 7a_100010191536_200025704644 [2,0,0,0,0,0|2,0,0]=4 376 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 34a_100009876509_200025704644 [2,0,0,0,0,0|2,0,0]=4 377 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 7a_100009876509_200025704644 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 34a_100009842347_200025704644 [2,0,0,0,0,0|2,0,0]=4 379 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 7a_100009842347_200025704644 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 34a_100000049605_200025704644 [2,0,0,0,0,0|2,0,0]=4 381 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 7a_100000049605_200025704644 [2,0,0,0,0,0|2,0,0]=4 382 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_100000184552_200025704644 [2,0,0,0,0,0|1,1,0]=4 383 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_200025704644_100000184552 [2,0,0,0,0,0|1,1,0]=4 384 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_100011191544_200025704644 [2,0,0,0,0,0|1,1,0]=4 385 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_200025704644_100011191544 [2,0,0,0,0,0|1,1,0]=4 386 B13R1.38 C=Cc1ccc(cc1C)S(=O)(=O)C 271570a_100011290941_200010713620 [1,1,0,0,0,0|2,0,0]=4 387 B13R1.38 C=Cc1ccc(cc1C)S(=O)(=O)N 271570a_100011290941_100000164573 [1,1,0,0,0,0|2,0,0]=4 388 B13R1.38 CNc1ccc(cc1C)S(=O)(=O)C 34a_100000755730_200000210301 [1,1,0,0,0,0|2,0,0]=4 389 B13R1.38 CNc1ccc(cc1C)S(=O)(=O)C 7a_100000755730_200000210301 [1,1,0,0,0,0|2,0,0]=4 390 B13R1.38 CNc1ccc(cc1C)S(=O)(=O)N 34a_100011352517_200000210301 [1,1,0,0,0,0|2,0,0]=4 391 B13R1.38 COc1ccc(cc1F)S(=O)(=O)C 34a_100000069939_200000210301 [1,1,0,0,0,0|2,0,0]=4 392 B13R1.38 COc1ccc(cc1F)S(=O)(=O)C 7a_100000069939_200000210301 [1,1,0,0,0,0|2,0,0]=4 393 B13R1.38 COc1ccc(cc1N)S(=O)(=O)C 34a_100000186253_200000210301 [1,1,0,0,0,0|2,0,0]=4 394 B13R1.38 COc1ccc(cc1N)S(=O)(=O)C 7a_100000186253_200000210301 [1,1,0,0,0,0|2,0,0]=4 395 B13R1.38 COc1ccc(cc1N)S(=O)(=O)N 34a_100000182321_200000210301 [1,1,0,0,0,0|2,0,0]=4 396 B13R1.38 COc1ccc(cc1N)S(=O)(=O)N 7a_100000182321_200000210301 [1,1,0,0,0,0|2,0,0]=4 397 B13R1.38 CS(=O)(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000069939_200025704644 [1,1,0,0,0,0|2,0,0]=4 398 B13R1.38 CS(=O)(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000069939_200025704644 [1,1,0,0,0,0|2,0,0]=4 399 B13R1.38 CS(=O)(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000186253_200025704644 [1,1,0,0,0,0|2,0,0]=4 400 B13R1.38 CS(=O)(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000186253_200025704644 [1,1,0,0,0,0|2,0,0]=4 401 B13R1.38 CS(=O)(=O)c1ccc(c(c1)O)C=O 271570a_203496583355_200000036326 [1,1,0,0,0,0|1,0,1]=4 402 B13R1.38 CS(=O)(=O)c1ccc(c(c1)O)NN 271570a_203496583355_100009814396 [1,1,0,0,0,0|2,0,0]=4 403 B13R1.38 CSc1ccc(cc1C)S(=O)(=O)C 62a_200000210301_200010713620 [1,1,0,0,0,0|1,1,0]=4 404 B13R1.38 CSc1ccc(cc1C)S(=O)(=O)C 62a_200010713620_200000210301 [1,1,0,0,0,0|1,1,0]=4 405 B13R1.38 CSc1ccc(cc1C)S(=O)(=O)N 62a_100000164573_200000210301 [1,1,0,0,0,0|1,1,0]=4 406 B13R1.38 CSc1ccc(cc1C)S(=O)(=O)N 62a_200000210301_100000164573 [1,1,0,0,0,0|1,1,0]=4 407 B13R1.38 Cc1cc(ccc1N[13CH3])S(=O)(=O)C 34a_100000755730_200025704644 [1,1,0,0,0,0|2,0,0]=4 408 B13R1.38 Cc1cc(ccc1N[13CH3])S(=O)(=O)C 7a_100000755730_200025704644 [1,1,0,0,0,0|2,0,0]=4 409 B13R1.38 Cc1cc(ccc1N[13CH3])S(=O)(=O)N 34a_100011352517_200025704644 [1,1,0,0,0,0|2,0,0]=4 410 B13R1.38 Cc1cc(ccc1S[13CH3])S(=O)(=O)C 62a_200010713620_200025704644 [1,1,0,0,0,0|1,1,0]=4 411 B13R1.38 Cc1cc(ccc1S[13CH3])S(=O)(=O)C 62a_200025704644_200010713620 [1,1,0,0,0,0|1,1,0]=4 412 B13R1.38 Cc1cc(ccc1S[13CH3])S(=O)(=O)N 62a_100000164573_200025704644 [1,1,0,0,0,0|1,1,0]=4 413 B13R1.38 Cc1cc(ccc1S[13CH3])S(=O)(=O)N 62a_200025704644_100000164573 [1,1,0,0,0,0|1,1,0]=4 414 B13R1.38 [13CH3]Oc1ccc(cc1N)S(=O)(=O)N 34a_100000182321_200025704644 [1,1,0,0,0,0|2,0,0]=4 415 B13R1.38 [13CH3]Oc1ccc(cc1N)S(=O)(=O)N 7a_100000182321_200025704644 [1,1,0,0,0,0|2,0,0]=4 416 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 270084a_100102657272_100000184575 [1,1,0,0,0,0|2,0,0]=4 417 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 274078a_100102657272_100000184575 [1,1,0,0,0,0|2,0,0]=4 418 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Br 40a_100102657272_200015196462 [1,1,0,0,0,0|2,0,0]=4 419 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)C 270084a_100102657272_200000182954 [1,1,0,0,0,0|2,0,0]=4 420 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)C 274078a_100102657272_200000182954 [1,1,0,0,0,0|2,0,0]=4 421 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Cl 270084a_100102657272_100000051332 [1,1,0,0,0,0|2,0,0]=4 422 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)Cl 274078a_100102657272_100000051332 [1,1,0,0,0,0|2,0,0]=4 423 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)F 270084a_100102657272_100000742315 [1,1,0,0,0,0|2,0,0]=4 424 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)F 274078a_100102657272_100000742315 [1,1,0,0,0,0|2,0,0]=4 425 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000165156 [1,1,0,0,0,0|1,0,0]=3 426 B13R1.272 CNS(=O)(=O)c1ccc(c(c1)O)C 271570a_203496583355_200012355755 [1,1,0,0,0,0|2,0,0]=4 427 B13R1.877 Cc1cc(c(cc1O)C)S(=O)(=O)N 271570a_203496583355_100011219846 [1,1,0,0,0,0|1,0,0]=3 428 B13R1.877 NS(=O)(=O)c1cc(c(cc1F)F)O 271570a_203496583355_200011219831 [1,1,0,0,0,0|2,0,0]=4 429 B13R1.877 NS(=O)(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100000036728 [1,1,0,0,0,0|2,0,0]=4 430 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [1,1,0,0,0,0|2,0,0]=4 431 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [1,1,0,0,0,0|2,0,0]=4 432 B13R1.49 COC(=O)c1cc(c(cn1)O)OC 271570a_203496583355_100010136178 [1,1,0,0,0,0|2,0,0]=4 433 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [1,1,0,0,0,0|2,0,0]=4 434 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [1,1,0,0,0,0|2,0,0]=4 435 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [1,1,0,0,0,0|2,0,0]=4 436 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [1,1,0,0,0,0|2,0,0]=4 437 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [1,1,0,0,0,0|2,0,0]=4 438 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [1,1,0,0,0,0|2,0,0]=4 439 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [1,1,0,0,0,0|2,0,0]=4 440 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [1,1,0,0,0,0|2,0,0]=4 441 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [1,1,0,0,0,0|2,0,0]=4 442 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [1,1,0,0,0,0|2,0,0]=4 443 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [1,1,0,0,0,0|2,0,0]=4 444 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [1,1,0,0,0,0|2,0,0]=4 445 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [1,1,0,0,0,0|1,0,0]=3 446 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [1,1,0,0,0,0|2,0,0]=4 447 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [1,1,0,0,0,0|2,0,0]=4 448 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [1,1,0,0,0,0|2,0,0]=4 449 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [1,1,0,0,0,0|2,0,0]=4 450 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [1,1,0,0,0,0|2,0,0]=4 451 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [1,1,0,0,0,0|2,0,0]=4 452 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [1,1,0,0,0,0|2,0,0]=4 453 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [1,1,0,0,0,0|2,0,0]=4 454 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [1,1,0,0,0,0|2,0,0]=4 455 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [1,1,0,0,0,0|2,0,0]=4 456 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [1,1,0,0,0,0|2,0,0]=4 457 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [1,1,0,0,0,0|2,0,0]=4 458 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [1,1,0,0,0,0|1,1,0]=4 459 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [1,1,0,0,0,0|1,1,0]=4 460 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [1,1,0,0,0,0|1,1,0]=4 461 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [1,1,0,0,0,0|1,1,0]=4 462 B13R1.49 COC(=O)c1ccc(c(n1)OC)O 271570a_203496583355_100010189641 [1,1,0,0,0,0|2,0,0]=4 463 B13R1.49 COC(=O)c1cnc(c(c1)OC)O 271570a_203496583355_100010074909 [1,1,0,0,0,0|2,0,0]=4 464 B13R1.49 COc1cc(ccc1O)C(=O)CF 1458a_100000687070_100015361967 [1,1,0,0,0,0|2,0,0]=4 465 B13R1.298 COc1cc(cc(c1O)Cl)C(=O)C 1458a_100000209947_200000210301 [1,1,0,0,0,0|2,0,0]=4 466 B13R1.298 COc1cc(cc(c1O)Cl)C(=O)[13CH3] 1458a_100000209947_200025704644 [1,1,0,0,0,0|2,0,0]=4 467 B13R1.298 COc1cc(cc(c1O)O)C(=O)C 1458a_100000061230_200000210301 [1,1,0,0,0,0|2,0,0]=4 468 B13R1.298 COc1cc(cc(c1O)O)C(=O)[13CH3] 1458a_100000061230_200025704644 [1,1,0,0,0,0|2,0,0]=4 469 B13R1.354 CCOc1cc(ccc1O)C(=O)C 1458a_100011260950_200000210301 [1,1,0,0,0,0|2,0,0]=4 470 B13R1.354 CCOc1cc(ccc1O)C(=O)[13CH3] 1458a_100011260950_200025704644 [1,1,0,0,0,0|2,0,0]=4 471 B13R1.354 COCc1cc(ccc1O)C(=O)C 34a_100138415774_100000010293 [1,1,0,0,0,0|2,0,0]=4 472 B13R1.354 COCc1cc(ccc1O)[N+](=O)[O-] 34a_100138415774_200009813932 [1,1,0,0,0,0|1,0,1]=4 473 B13R1.3091 COc1cc(ccc1CO)[N+](=O)[O-] 34a_100000089567_200000210301 [1,1,0,0,0,0|1,0,1]=4 474 B13R1.3091 COc1cc(ccc1CO)[N+](=O)[O-] 7a_100000089567_200000210301 [1,1,0,0,0,0|1,0,1]=4 475 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 34a_100000186468_200025704644 [1,1,0,0,0,0|2,0,0]=4 476 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 7a_100000186468_200025704644 [1,1,0,0,0,0|2,0,0]=4 477 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 34a_100000246512_200025704644 [1,1,0,0,0,0|2,0,0]=4 478 B13R1.3091 COc1cc(ccc1O[13CH3])C(C)O 7a_100000246512_200025704644 [1,1,0,0,0,0|2,0,0]=4 479 B13R1.3091 COc1cc(ccc1O[13CH3])[N+](=O)[O-] 34a_100000742293_200025704644 [1,1,0,0,0,0|1,0,1]=4 480 B13R1.3091 COc1cc(ccc1O[13CH3])[N+](=O)[O-] 7a_100000742293_200025704644 [1,1,0,0,0,0|1,0,1]=4 481 B13R1.3091 COc1ccc(cc1OC)C(=O)C 1458a_100000211223_200000210301 [1,1,0,0,0,0|2,0,0]=4 482 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000186468_200000210301 [1,1,0,0,0,0|2,0,0]=4 483 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000732934_200000210301 [1,1,0,0,0,0|2,0,0]=4 484 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000186468_200000210301 [1,1,0,0,0,0|2,0,0]=4 485 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000732934_200000210301 [1,1,0,0,0,0|2,0,0]=4 486 B13R1.3091 COc1ccc(cc1OC)C(=O)[13CH3] 1458a_100000211223_200025704644 [1,1,0,0,0,0|2,0,0]=4 487 B13R1.3091 COc1ccc(cc1OC)C(C)O 34a_100000246512_200000210301 [1,1,0,0,0,0|2,0,0]=4 488 B13R1.3091 COc1ccc(cc1OC)C(C)O 7a_100000246512_200000210301 [1,1,0,0,0,0|2,0,0]=4 489 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 34a_100000211812_200000210301 [1,1,0,0,0,0|1,0,1]=4 490 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 34a_100000742293_200000210301 [1,1,0,0,0,0|1,0,1]=4 491 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 7a_100000211812_200000210301 [1,1,0,0,0,0|1,0,1]=4 492 B13R1.3091 COc1ccc(cc1OC)[N+](=O)[O-] 7a_100000742293_200000210301 [1,1,0,0,0,0|1,0,1]=4 493 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 34a_100000732934_200025704644 [1,1,0,0,0,0|2,0,0]=4 494 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 7a_100000732934_200025704644 [1,1,0,0,0,0|2,0,0]=4 495 B13R1.3091 COc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000211812_200025704644 [1,1,0,0,0,0|1,0,1]=4 496 B13R1.3091 COc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000211812_200025704644 [1,1,0,0,0,0|1,0,1]=4 497 B13R1.3091 [13CH3]Oc1cc(ccc1CO)[N+](=O)[O-] 34a_100000089567_200025704644 [1,1,0,0,0,0|1,0,1]=4 498 B13R1.3091 [13CH3]Oc1cc(ccc1CO)[N+](=O)[O-] 7a_100000089567_200025704644 [1,1,0,0,0,0|1,0,1]=4 499 B13R1.3230 COc1c(ccc(c1F)B(O)O)O 271570a_203496583355_200009815746 [1,1,0,0,0,0|1,0,1]=4 500 B13R1.57 CNc1cc(cc(c1)S(=O)(=O)C)Br 34a_200010115582_200000210301 [1,1,0,0,0,0|2,0,0]=4 501 B13R1.57 CNc1cc(cc(c1)S(=O)(=O)C)Br 7a_200010115582_200000210301 [1,1,0,0,0,0|2,0,0]=4 502 B13R1.57 CS(=O)(=O)c1cc(cc(c1)N[13CH3])Br 34a_200010115582_200025704644 [1,1,0,0,0,0|2,0,0]=4 503 B13R1.57 CS(=O)(=O)c1cc(cc(c1)N[13CH3])Br 7a_200010115582_200025704644 [1,1,0,0,0,0|2,0,0]=4 504 B13R1.57 CS(=O)(=O)c1cc(cc(c1)S[13CH3])F 62a_200010884439_200025704644 [1,1,0,0,0,0|1,1,0]=4 505 B13R1.57 CS(=O)(=O)c1cc(cc(c1)S[13CH3])F 62a_200025704644_200010884439 [1,1,0,0,0,0|1,1,0]=4 506 B13R1.57 CS(=O)(=O)c1cc(cc(c1)S[13CH3])N 62a_200010115582_200025704644 [1,1,0,0,0,0|1,1,0]=4 507 B13R1.57 CS(=O)(=O)c1cc(cc(c1)S[13CH3])N 62a_200025704644_200010115582 [1,1,0,0,0,0|1,1,0]=4 508 B13R1.57 CSc1cc(cc(c1)S(=O)(=O)C)F 62a_200000210301_200010884439 [1,1,0,0,0,0|1,1,0]=4 509 B13R1.57 CSc1cc(cc(c1)S(=O)(=O)C)F 62a_200010884439_200000210301 [1,1,0,0,0,0|1,1,0]=4 510 B13R1.57 CSc1cc(cc(c1)S(=O)(=O)C)N 62a_200000210301_200010115582 [1,1,0,0,0,0|1,1,0]=4 511 B13R1.57 CSc1cc(cc(c1)S(=O)(=O)C)N 62a_200010115582_200000210301 [1,1,0,0,0,0|1,1,0]=4 512 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)C)F 34a_100015204152_200000210301 [1,1,0,0,0,0|2,0,0]=4 513 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)C)F 7a_100015204152_200000210301 [1,1,0,0,0,0|2,0,0]=4 514 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)N)C 2230a_100000198553_200000210301 [1,1,0,0,0,0|2,0,0]=4 515 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)N)C 34a_100000198553_200000210301 [1,1,0,0,0,0|2,0,0]=4 516 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)N)Cl 2230a_200000747092_200000210301 [1,1,0,0,0,0|2,0,0]=4 517 B13R1.98 CNc1ccc(c(c1)S(=O)(=O)N)Cl 34a_200000747092_200000210301 [1,1,0,0,0,0|2,0,0]=4 518 B13R1.98 CS(=O)(=O)c1cc(ccc1Br)S[13CH3] 62a_100011102953_200025704644 [1,1,0,0,0,0|1,1,0]=4 519 B13R1.98 CS(=O)(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_100011102953 [1,1,0,0,0,0|1,1,0]=4 520 B13R1.98 CS(=O)(=O)c1cc(ccc1F)N[13CH3] 34a_100015204152_200025704644 [1,1,0,0,0,0|2,0,0]=4 521 B13R1.98 CS(=O)(=O)c1cc(ccc1F)N[13CH3] 7a_100015204152_200025704644 [1,1,0,0,0,0|2,0,0]=4 522 B13R1.98 CS(=O)(=O)c1cc(ccc1F)S[13CH3] 62a_100010195686_200025704644 [1,1,0,0,0,0|1,1,0]=4 523 B13R1.98 CS(=O)(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100010195686 [1,1,0,0,0,0|1,1,0]=4 524 B13R1.98 CS(=O)(=O)c1cc(ccc1N)S[13CH3] 62a_100000692581_200025704644 [1,1,0,0,0,0|1,1,0]=4 525 B13R1.98 CS(=O)(=O)c1cc(ccc1O)S[13CH3] 62a_200015712519_200025704644 [1,1,0,0,0,0|1,1,0]=4 526 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)Br 62a_100011102953_200000210301 [1,1,0,0,0,0|1,1,0]=4 527 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)Br 62a_200000210301_100011102953 [1,1,0,0,0,0|1,1,0]=4 528 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)C 62a_100009814363_200000210301 [1,1,0,0,0,0|1,1,0]=4 529 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)C 62a_200000210301_100009814363 [1,1,0,0,0,0|1,1,0]=4 530 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)F 62a_100010195686_200000210301 [1,1,0,0,0,0|1,1,0]=4 531 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)F 62a_200000210301_100010195686 [1,1,0,0,0,0|1,1,0]=4 532 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)N 62a_100000692581_200000210301 [1,1,0,0,0,0|1,1,0]=4 533 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)C)O 62a_200015712519_200000210301 [1,1,0,0,0,0|1,1,0]=4 534 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)N)F 62a_100000729927_200000210301 [1,1,0,0,0,0|1,1,0]=4 535 B13R1.98 CSc1ccc(c(c1)S(=O)(=O)N)N 62a_100011388931_200000210301 [1,1,0,0,0,0|1,1,0]=4 536 B13R1.98 Cc1ccc(cc1S(=O)(=O)C)S[13CH3] 62a_100009814363_200025704644 [1,1,0,0,0,0|1,1,0]=4 537 B13R1.98 Cc1ccc(cc1S(=O)(=O)C)S[13CH3] 62a_200025704644_100009814363 [1,1,0,0,0,0|1,1,0]=4 538 B13R1.98 Cc1ccc(cc1S(=O)(=O)N)N[13CH3] 2230a_100000198553_200025704644 [1,1,0,0,0,0|2,0,0]=4 539 B13R1.98 Cc1ccc(cc1S(=O)(=O)N)N[13CH3] 34a_100000198553_200025704644 [1,1,0,0,0,0|2,0,0]=4 540 B13R1.98 [13CH3]Nc1ccc(c(c1)S(=O)(=O)N)Cl 2230a_200000747092_200025704644 [1,1,0,0,0,0|2,0,0]=4 541 B13R1.98 [13CH3]Nc1ccc(c(c1)S(=O)(=O)N)Cl 34a_200000747092_200025704644 [1,1,0,0,0,0|2,0,0]=4 542 B13R1.98 [13CH3]Sc1ccc(c(c1)S(=O)(=O)N)F 62a_100000729927_200025704644 [1,1,0,0,0,0|1,1,0]=4 543 B13R1.98 [13CH3]Sc1ccc(c(c1)S(=O)(=O)N)N 62a_100011388931_200025704644 [1,1,0,0,0,0|1,1,0]=4 544 B13R1.345 C=C(C)c1cccc(c1)S(=O)(=O)C 271570a_100000694244_100009815773 [1,1,0,0,0,0|2,0,0]=4 545 B13R1.345 C=C(C)c1cccc(c1)S(=O)(=O)N 271570a_100000694244_100000164563 [1,1,0,0,0,0|2,0,0]=4 546 B13R1.345 CC(=O)c1cccc(c1)S(=O)(=O)C 1458a_100000184887_200000210301 [1,1,0,0,0,0|2,0,0]=4 547 B13R1.345 CC(=O)c1cccc(c1)S(=O)(=O)N 1458a_100000171177_200000210301 [1,1,0,0,0,0|2,0,0]=4 548 B13R1.345 CS(=O)(=O)c1cccc(c1)C(=O)[13CH3] 1458a_100000184887_200025704644 [1,1,0,0,0,0|2,0,0]=4 549 B13R1.345 [13CH3]C(=O)c1cccc(c1)S(=O)(=O)N 1458a_100000171177_200025704644 [1,1,0,0,0,0|2,0,0]=4 550 B13R1.375 CC=Cc1cccc(c1)S(=O)(=O)C 271570a_100016259895_100009815773 [1,1,0,0,0,0|2,0,0]=4 551 B13R1.375 CC=Cc1cccc(c1)S(=O)(=O)N 271570a_100016259895_100000164563 [1,1,0,0,0,0|2,0,0]=4 552 B13R1.375 CCNc1cccc(c1)S(=O)(=O)C 34a_100000209861_100000210202 [1,1,0,0,0,0|2,0,0]=4 553 B13R1.375 CCNc1cccc(c1)S(=O)(=O)C 7a_100000209861_100000210202 [1,1,0,0,0,0|2,0,0]=4 554 B13R1.375 CCNc1cccc(c1)S(=O)(=O)N 34a_100000182236_100000210202 [1,1,0,0,0,0|2,0,0]=4 555 B13R1.375 CCOc1cccc(c1)S(=O)(=O)[O-] 7a_100000116945_100000210202 [1,1,0,0,0,0|0,0,1]=3 556 B13R1.375 CCSc1cccc(c1)S(=O)(=O)C 62a_100000210202_100009815773 [1,1,0,0,0,0|1,1,0]=4 557 B13R1.375 CCSc1cccc(c1)S(=O)(=O)C 62a_100009815773_100000210202 [1,1,0,0,0,0|1,1,0]=4 558 B13R1.375 CCSc1cccc(c1)S(=O)(=O)N 62a_100000164563_100000210202 [1,1,0,0,0,0|1,1,0]=4 559 B13R1.375 CCSc1cccc(c1)S(=O)(=O)N 62a_100000210202_100000164563 [1,1,0,0,0,0|1,1,0]=4 560 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 207a_100102657272_100000101570 [1,1,0,0,0,0|2,0,0]=4 561 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 2230a_106832991635_100009817112 [1,1,0,0,0,0|2,0,0]=4 562 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 270004a_106832991635_100000101570 [1,1,0,0,0,0|2,0,0]=4 563 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 34a_100015204004_200000210301 [1,1,0,0,0,0|2,0,0]=4 564 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 34a_100102657272_100009817112 [1,1,0,0,0,0|2,0,0]=4 565 B13R1.375 CNCc1cccc(c1)S(=O)(=O)C 7a_106832991635_100009817112 [1,1,0,0,0,0|2,0,0]=4 566 B13R1.375 CNCc1cccc(c1)S(=O)(=O)N 2230a_106832991635_100010205824 [1,1,0,0,0,0|2,0,0]=4 567 B13R1.375 CNCc1cccc(c1)S(=O)(=O)N 34a_100102657272_100010205824 [1,1,0,0,0,0|2,0,0]=4 568 B13R1.375 CNCc1cccc(c1)S(=O)(=O)N 7a_106832991635_100010205824 [1,1,0,0,0,0|2,0,0]=4 569 B13R1.375 CNCc1cccc(c1)S(=O)(=O)[O-] 207a_100102657272_100010211312 [1,1,0,0,0,0|1,0,1]=4 570 B13R1.375 CNCc1cccc(c1)S(=O)(=O)[O-] 26a_100102657272_100000116945 [1,1,0,0,0,0|1,0,1]=4 571 B13R1.375 COCc1cccc(c1)S(=O)(=O)C 34a_100012180062_200000210301 [1,1,0,0,0,0|1,0,0]=3 572 B13R1.375 COCc1cccc(c1)S(=O)(=O)C 34a_100138415774_100009817112 [1,1,0,0,0,0|1,0,0]=3 573 B13R1.375 COCc1cccc(c1)S(=O)(=O)C 7a_100012180062_200000210301 [1,1,0,0,0,0|1,0,0]=3 574 B13R1.375 COCc1cccc(c1)S(=O)(=O)N 34a_100138415774_100010205824 [1,1,0,0,0,0|1,0,0]=3 575 B13R1.375 CS(=O)(=O)c1cccc(c1)CN[13CH3] 34a_100015204004_200025704644 [1,1,0,0,0,0|2,0,0]=4 576 B13R1.375 CS(=O)(=O)c1cccc(c1)CO[13CH3] 34a_100012180062_200025704644 [1,1,0,0,0,0|1,0,0]=3 577 B13R1.375 CS(=O)(=O)c1cccc(c1)CO[13CH3] 7a_100012180062_200025704644 [1,1,0,0,0,0|1,0,0]=3 578 B13R1.375 CS(=O)(=O)c1cccc(c1)CS[13CH3] 62a_100009817112_200025704644 [1,1,0,0,0,0|1,1,0]=4 579 B13R1.375 CS(=O)(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100009817112 [1,1,0,0,0,0|1,1,0]=4 580 B13R1.375 CS(=O)(=O)c1cccc(c1)NCF 34a_100000209861_100015361967 [1,1,0,0,0,0|2,0,0]=4 581 B13R1.375 CS(=O)(=O)c1cccc(c1)NCF 7a_100000209861_100015361967 [1,1,0,0,0,0|2,0,0]=4 582 B13R1.375 CS(=O)(=O)c1cccc(c1)SCF 62a_100009815773_100015361967 [1,1,0,0,0,0|1,1,0]=4 583 B13R1.375 CS(=O)(=O)c1cccc(c1)SCF 62a_100015361967_100009815773 [1,1,0,0,0,0|1,1,0]=4 584 B13R1.375 CSCc1cccc(c1)S(=O)(=O)C 62a_100009817112_200000210301 [1,1,0,0,0,0|1,1,0]=4 585 B13R1.375 CSCc1cccc(c1)S(=O)(=O)C 62a_200000210301_100009817112 [1,1,0,0,0,0|1,1,0]=4 586 B13R1.375 CSCc1cccc(c1)S(=O)(=O)N 62a_100010205824_200000210301 [1,1,0,0,0,0|1,1,0]=4 587 B13R1.375 CSCc1cccc(c1)S(=O)(=O)N 62a_200000210301_100010205824 [1,1,0,0,0,0|1,1,0]=4 588 B13R1.375 NS(=O)(=O)c1cccc(c1)NCF 34a_100000182236_100015361967 [1,1,0,0,0,0|2,0,0]=4 589 B13R1.375 NS(=O)(=O)c1cccc(c1)SCF 62a_100000164563_100015361967 [1,1,0,0,0,0|1,1,0]=4 590 B13R1.375 NS(=O)(=O)c1cccc(c1)SCF 62a_100015361967_100000164563 [1,1,0,0,0,0|1,1,0]=4 591 B13R1.375 O=S(=O)([O-])c1cccc(c1)OCF 7a_100000116945_100015361967 [1,1,0,0,0,0|0,0,1]=3 592 B13R1.375 [13CH3]SCc1cccc(c1)S(=O)(=O)N 62a_100010205824_200025704644 [1,1,0,0,0,0|1,1,0]=4 593 B13R1.375 [13CH3]SCc1cccc(c1)S(=O)(=O)N 62a_200025704644_100010205824 [1,1,0,0,0,0|1,1,0]=4 594 B13R1.645 CSc1cccc(c1F)S(=O)(=O)N 62a_100011217397_200000210301 [1,1,0,0,0,0|1,1,0]=4 595 B13R1.645 CSc1cccc(c1F)S(=O)(=O)N 62a_200000210301_100011217397 [1,1,0,0,0,0|1,1,0]=4 596 B13R1.645 [13CH3]Sc1cccc(c1F)S(=O)(=O)N 62a_100011217397_200025704644 [1,1,0,0,0,0|1,1,0]=4 597 B13R1.645 [13CH3]Sc1cccc(c1F)S(=O)(=O)N 62a_200025704644_100011217397 [1,1,0,0,0,0|1,1,0]=4 598 B13R1.3040 CCS(=O)(=O)c1cccc(c1)SC 62a_100009815775_200000210301 [1,1,0,0,0,0|1,1,0]=4 599 B13R1.3040 CCS(=O)(=O)c1cccc(c1)SC 62a_200000210301_100009815775 [1,1,0,0,0,0|1,1,0]=4 600 B13R1.3040 CCS(=O)(=O)c1cccc(c1)S[13CH3] 62a_100009815775_200025704644 [1,1,0,0,0,0|1,1,0]=4 601 B13R1.3040 CCS(=O)(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009815775 [1,1,0,0,0,0|1,1,0]=4 602 B13R1.3040 CNS(=O)(=O)c1cccc(c1)N[13CH3] 34a_100000738320_200025704644 [1,1,0,0,0,0|2,0,0]=4 603 B13R1.3040 CNS(=O)(=O)c1cccc(c1)N[13CH3] 7a_100000738320_200025704644 [1,1,0,0,0,0|2,0,0]=4 604 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 270084a_100102657272_100000750905 [1,1,0,0,0,0|1,0,0]=3 605 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 274078a_100102657272_100000750905 [1,1,0,0,0,0|1,0,0]=3 606 B13R1.3040 CNS(=O)(=O)c1cccc(c1)OC 40a_100102657272_200010300420 [1,1,0,0,0,0|1,0,0]=3 607 B13R1.3040 CNS(=O)(=O)c1cccc(c1)SC 62a_100000165148_200000210301 [1,1,0,0,0,0|1,1,0]=4 608 B13R1.3040 CNS(=O)(=O)c1cccc(c1)SC 62a_200000210301_100000165148 [1,1,0,0,0,0|1,1,0]=4 609 B13R1.3040 CNS(=O)(=O)c1cccc(c1)S[13CH3] 62a_100000165148_200025704644 [1,1,0,0,0,0|1,1,0]=4 610 B13R1.3040 CNS(=O)(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000165148 [1,1,0,0,0,0|1,1,0]=4 611 B13R1.3040 CNS(=O)(=O)c1ccnc(c1)OC 270084a_100102657272_200000120522 [1,1,0,0,0,0|2,0,0]=4 612 B13R1.3040 CNS(=O)(=O)c1ccnc(c1)OC 274078a_100102657272_200000120522 [1,1,0,0,0,0|2,0,0]=4 613 B13R1.3040 CNc1cccc(c1)S(=O)(=O)NC 34a_100000738320_200000210301 [1,1,0,0,0,0|2,0,0]=4 614 B13R1.3040 CNc1cccc(c1)S(=O)(=O)NC 7a_100000738320_200000210301 [1,1,0,0,0,0|2,0,0]=4 615 B15R1.370 COc1cc(cc(c1Cl)Br)NS(=O)(=O)C 40a_100010131419_100000738038 [0,1,0,0,0,1|2,0,0]=4 616 B15R1.906 CC(=O)c1cc(ccc1O)NS(=O)(=O)C 1458a_100000744780_200000210301 [0,1,0,0,0,1|2,0,0]=4 617 B15R1.906 CS(=O)(=O)Nc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000744780_200025704644 [0,1,0,0,0,1|2,0,0]=4 618 B15R1.1793 COc1cc(c(cc1Br)C)NS(=O)(=O)C 40a_100010232211_100000738038 [0,1,0,0,0,1|2,0,0]=4 619 B15R1.1793 COc1cc(c(cc1C)Br)NS(=O)(=O)C 40a_100010244135_100000738038 [0,1,0,0,0,1|2,0,0]=4 620 B15R1.1793 COc1cc(c(cc1Cl)C)NS(=O)(=O)C 40a_100009858536_100000738038 [0,1,0,0,0,1|2,0,0]=4 621 B15R1.1793 COc1cc(c(cc1Cl)Cl)NS(=O)(=O)C 40a_100011830341_100000738038 [0,1,0,0,0,1|2,0,0]=4 622 B15R1.1793 COc1cc(c(cc1Cl)F)NS(=O)(=O)C 40a_100009872666_100000738038 [0,1,0,0,0,1|2,0,0]=4 623 B15R1.1793 COc1cc(c(cc1F)Cl)NS(=O)(=O)C 40a_100009958774_100000738038 [0,1,0,0,0,1|2,0,0]=4 624 B15R1.3768 CNc1ccc(cc1OC)NS(=O)(=O)C 34a_100000690464_200000210301 [0,1,0,0,0,1|2,0,0]=4 625 B15R1.3768 COc1cc(ccc1C#N)NS(=O)(=O)C 40a_100011999456_100000738038 [0,1,0,0,0,1|2,0,0]=4 626 B15R1.3768 COc1cc(ccc1CO)NS(=O)(=O)C 40a_100012183141_100000738038 [0,1,0,0,0,1|1,0,0]=3 627 B15R1.3768 COc1cc(ccc1N[13CH3])NS(=O)(=O)C 34a_100000690464_200025704644 [0,1,0,0,0,1|2,0,0]=4 628 B15R1.3768 COc1ccc(cc1OC)NS(=O)(=O)C 40a_100000187404_100000738038 [0,1,0,0,0,1|1,0,0]=3 629 B15R1.3768 COc1ccc(cc1SC)OS(=O)(=O)C 62a_200000210301_200010208287 [0,1,0,0,0,1|1,1,0]=4 630 B15R1.3768 COc1ccc(cc1SC)OS(=O)(=O)C 62a_200010208287_200000210301 [0,1,0,0,0,1|1,1,0]=4 631 B15R1.3768 COc1ccc(cc1S[13CH3])OS(=O)(=O)C 62a_200010208287_200025704644 [0,1,0,0,0,1|1,1,0]=4 632 B15R1.3768 COc1ccc(cc1S[13CH3])OS(=O)(=O)C 62a_200025704644_200010208287 [0,1,0,0,0,1|1,1,0]=4 633 B15R1.5195 COc1c(ccc(c1F)NS(=O)(=O)C)F 40a_100137314619_100000738038 [0,1,0,0,0,1|2,0,0]=4 634 B15R1.9229 CCNc1cc(ccc1O)CS(=O)(=O)N 2230a_200010686696_100000210202 [0,1,0,0,0,1|2,0,0]=4 635 B15R1.9229 CCNc1cc(ccc1O)CS(=O)(=O)N 34a_200010686696_100000210202 [0,1,0,0,0,1|2,0,0]=4 636 B15R1.9229 CCOc1cc(ccc1Br)NS(=O)(=O)C 40a_200016990551_100000738038 [0,1,0,0,0,1|2,0,0]=4 637 B15R1.9229 CCOc1cc(ccc1Cl)NS(=O)(=O)C 40a_100011964961_100000738038 [0,1,0,0,0,1|2,0,0]=4 638 B15R1.9229 NS(=O)(=O)Cc1ccc(c(c1)NCF)O 34a_200010686696_100015361967 [0,1,0,0,0,1|2,0,0]=4 639 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)Br 232682a_100000765947_100000211323 [0,1,0,0,0,1|2,0,0]=4 640 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)Br 40a_100000765947_100000053943 [0,1,0,0,0,1|2,0,0]=4 641 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)C 232682a_100011279678_100000211323 [0,1,0,0,0,1|2,0,0]=4 642 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)C 40a_100011279678_100000053943 [0,1,0,0,0,1|2,0,0]=4 643 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)Cl 232682a_100000742311_100000211323 [0,1,0,0,0,1|2,0,0]=4 644 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)Cl 40a_100000742311_100000053943 [0,1,0,0,0,1|2,0,0]=4 645 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)F 232682a_100000701188_100000211323 [0,1,0,0,0,1|2,0,0]=4 646 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)F 40a_100000701188_100000053943 [0,1,0,0,0,1|2,0,0]=4 647 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)I 232682a_100000746945_100000211323 [0,1,0,0,0,1|2,0,0]=4 648 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)I 40a_100000746945_100000053943 [0,1,0,0,0,1|2,0,0]=4 649 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)O 232682a_100000726020_100000211323 [0,1,0,0,0,1|1,0,0]=3 650 B15R1.17595 CCS(=O)(=O)Nc1ccc(c(c1)OC)O 40a_100000726020_100000053943 [0,1,0,0,0,1|1,0,0]=3 651 B15R1.533 CCNc1cc(ccc1OC)S(=O)(=O)C 34a_100011298280_100000210202 [0,2,0,0,0,0|2,0,0]=4 652 B15R1.533 CCNc1cc(ccc1OC)S(=O)(=O)C 7a_100011298280_100000210202 [0,2,0,0,0,0|2,0,0]=4 653 B15R1.533 COc1ccc(cc1NCF)S(=O)(=O)C 34a_100011298280_100015361967 [0,2,0,0,0,0|2,0,0]=4 654 B15R1.533 COc1ccc(cc1NCF)S(=O)(=O)C 7a_100011298280_100015361967 [0,2,0,0,0,0|2,0,0]=4 655 B15R1.900 CC(=O)Nc1cc(ccc1O)S(=O)(=O)C 22a_100000186253_100000070787 [0,2,0,0,0,0|2,0,0]=4 656 B15R1.900 CC(=O)Nc1cc(ccc1O)S(=O)(=O)C 527a_100000186253_100103153847 [0,2,0,0,0,0|2,0,0]=4 657 B15R1.900 CC(=O)Nc1cc(ccc1O)S(=O)(=O)N 22a_100000182321_100000070787 [0,2,0,0,0,0|2,0,0]=4 658 B15R1.900 CC(C)Nc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100000210206 [0,2,0,0,0,0|2,0,0]=4 659 B15R1.900 CC(C)Nc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_100000210206 [0,2,0,0,0,0|2,0,0]=4 660 B15R1.1004 C#CCNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100000184674 [0,2,0,0,0,0|2,0,0]=4 661 B15R1.1004 C#CCNc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_100000038162 [0,2,0,0,0,0|2,0,0]=4 662 B15R1.1004 C=CCNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100015514636 [0,2,0,0,0,0|2,0,0]=4 663 B15R1.1004 C=CCNc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_100015514636 [0,2,0,0,0,0|2,0,0]=4 664 B15R1.1004 CCCNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100000210303 [0,2,0,0,0,0|2,0,0]=4 665 B15R1.1004 CCCNc1cc(ccc1O)S(=O)(=O)C 7a_100000186253_100000210303 [0,2,0,0,0,0|2,0,0]=4 666 B15R1.1004 COCNc1cc(ccc1C)S(=O)(=O)N 2230a_100000740146_100000766300 [0,2,0,0,0,0|2,0,0]=4 667 B15R1.1004 COCSc1cc(ccc1C)S(=O)(=O)C 62a_100000766300_100010175561 [0,2,0,0,0,0|2,0,0]=4 668 B15R1.1004 COCSc1cc(ccc1C)S(=O)(=O)C 62a_100010175561_100000766300 [0,2,0,0,0,0|2,0,0]=4 669 B15R1.1004 COCSc1cc(ccc1C)S(=O)(=O)N 62a_100000766300_100011847911 [0,2,0,0,0,0|2,0,0]=4 670 B15R1.1004 COCSc1cc(ccc1C)S(=O)(=O)N 62a_100011847911_100000766300 [0,2,0,0,0,0|2,0,0]=4 671 B15R1.1004 COCSc1cc(ccc1F)S(=O)(=O)C 62a_100000766300_200000048130 [0,2,0,0,0,0|2,0,0]=4 672 B15R1.1004 COCSc1cc(ccc1F)S(=O)(=O)C 62a_200000048130_100000766300 [0,2,0,0,0,0|2,0,0]=4 673 B15R1.1004 COCSc1cc(ccc1F)S(=O)(=O)N 62a_100000164542_100000766300 [0,2,0,0,0,0|2,0,0]=4 674 B15R1.1004 COCSc1cc(ccc1F)S(=O)(=O)N 62a_100000766300_100000164542 [0,2,0,0,0,0|2,0,0]=4 675 B15R1.1004 COCSc1cc(ccc1N)S(=O)(=O)C 62a_100000743533_100000766300 [0,2,0,0,0,0|2,0,0]=4 676 B15R1.1004 COCSc1cc(ccc1N)S(=O)(=O)C 62a_100000766300_100000743533 [0,2,0,0,0,0|2,0,0]=4 677 B15R1.1004 COCSc1cc(ccc1N)S(=O)(=O)N 62a_100000736770_100000766300 [0,2,0,0,0,0|2,0,0]=4 678 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCC#N)O 7a_100000186253_100011215382 [0,2,0,0,0,0|2,0,0]=4 679 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCC=O)O 34a_100000186253_200009817547 [0,2,0,0,0,0|2,0,0]=4 680 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCC=O)O 7a_100000186253_200015260668 [0,2,0,0,0,0|2,0,0]=4 681 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCCF)O 34a_100000186253_100011217306 [0,2,0,0,0,0|2,0,0]=4 682 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCCF)O 7a_100000186253_100011217306 [0,2,0,0,0,0|2,0,0]=4 683 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCCO)O 34a_100000186253_100000211926 [0,2,0,0,0,0|2,0,0]=4 684 B15R1.1004 CS(=O)(=O)c1ccc(c(c1)NCCO)O 7a_100000186253_100000211926 [0,2,0,0,0,0|2,0,0]=4 685 B15R1.1004 CSCNc1cc(ccc1O)S(=O)(=O)C 34a_100000186253_100011218213 [0,2,0,0,0,0|1,1,0]=4 686 B15R1.9233 CCNc1cc(ccc1O)S(=O)(=O)CC 34a_100000210498_100000210202 [0,2,0,0,0,0|2,0,0]=4 687 B15R1.9233 CCNc1cc(ccc1O)S(=O)(=O)CC 7a_100000210498_100000210202 [0,2,0,0,0,0|2,0,0]=4 688 B15R1.9233 CCNc1cc(ccc1O)S(=O)(=O)NC 34a_100000732981_100000210202 [0,2,0,0,0,0|2,0,0]=4 689 B15R1.9233 CCS(=O)(=O)c1ccc(c(c1)NCF)O 34a_100000210498_100015361967 [0,2,0,0,0,0|2,0,0]=4 690 B15R1.9233 CCS(=O)(=O)c1ccc(c(c1)NCF)O 7a_100000210498_100015361967 [0,2,0,0,0,0|2,0,0]=4 691 B15R1.9233 CNS(=O)(=O)c1ccc(c(c1)NCF)O 34a_100000732981_100015361967 [0,2,0,0,0,0|2,0,0]=4 692 B15R1.16546 CCOc1cc(c(cc1N)Cl)S(=O)(=O)N 34a_200010005463_100000210202 [0,2,0,0,0,0|2,0,0]=4 693 B15R1.16546 CCOc1cc(c(cc1N)Cl)S(=O)(=O)N 7a_200010005463_100000210202 [0,2,0,0,0,0|2,0,0]=4 694 B15R1.16546 Nc1cc(c(cc1OCF)S(=O)(=O)N)Cl 34a_200010005463_100015361967 [0,2,0,0,0,0|2,0,0]=4 695 B15R1.16546 Nc1cc(c(cc1OCF)S(=O)(=O)N)Cl 7a_200010005463_100015361967 [0,2,0,0,0,0|2,0,0]=4 696 B15R1.917 CS(=O)(=O)c1ccc(c(c1)S(=O)(=O)C)O 271570a_203496583355_100000017565 [0,2,0,0,0,0|1,1,0]=4 697 B15R1.3761 COc1ccc(cc1C(=O)C)S(=O)(=O)C 1458a_100000694808_200000210301 [0,2,0,0,0,0|2,0,0]=4 698 B15R1.3761 COc1ccc(cc1C(=O)C)S(=O)(=O)N 1458a_100000181335_200000210301 [0,2,0,0,0,0|2,0,0]=4 699 B15R1.3761 COc1ccc(cc1C(=O)[13CH3])S(=O)(=O)C 1458a_100000694808_200025704644 [0,2,0,0,0,0|2,0,0]=4 700 B15R1.3761 COc1ccc(cc1C(=O)[13CH3])S(=O)(=O)N 1458a_100000181335_200025704644 [0,2,0,0,0,0|2,0,0]=4 701 B15R1.8397 CC(=O)c1cc(c(cc1O)Cl)S(=O)(=O)N 1458a_200000026728_200000210301 [0,2,0,0,0,0|2,0,0]=4 702 B15R1.8397 [13CH3]C(=O)c1cc(c(cc1O)Cl)S(=O)(=O)N 1458a_200000026728_200025704644 [0,2,0,0,0,0|2,0,0]=4 703 B15R1.3601 CCNS(=O)(=O)c1ccc(c(c1)OC)Br 270084a_100015525214_100000765252 [0,2,0,0,0,0|2,0,0]=4 704 B15R1.3601 CCNS(=O)(=O)c1ccc(c(c1)OC)Br 274078a_100015525214_100000765252 [0,2,0,0,0,0|2,0,0]=4 705 B15R1.3601 CCNS(=O)(=O)c1ccc(c(c1)OC)F 270084a_100015525214_100000717096 [0,2,0,0,0,0|2,0,0]=4 706 B15R1.3601 CCNS(=O)(=O)c1ccc(c(c1)OC)F 274078a_100015525214_100000717096 [0,2,0,0,0,0|2,0,0]=4 707 B15R1.4049 CN(C)S(=O)(=O)c1ccc(c(c1)N[13CH3])O 34a_100000736736_200025704644 [0,2,0,0,0,0|2,0,0]=4 708 B15R1.4049 CN(C)S(=O)(=O)c1ccc(c(c1)N[13CH3])O 7a_100000736736_200025704644 [0,2,0,0,0,0|2,0,0]=4 709 B15R1.4049 CN(C)S(=O)(=O)c1ccc(c(c1)O[13CH3])N 34a_100012337789_200025704644 [0,2,0,0,0,0|2,0,0]=4 710 B15R1.4049 CN(C)S(=O)(=O)c1ccc(c(c1)O[13CH3])N 7a_100012337789_200025704644 [0,2,0,0,0,0|2,0,0]=4 711 B15R1.4049 CNc1cc(ccc1O)S(=O)(=O)N(C)C 34a_100000736736_200000210301 [0,2,0,0,0,0|2,0,0]=4 712 B15R1.4049 CNc1cc(ccc1O)S(=O)(=O)N(C)C 7a_100000736736_200000210301 [0,2,0,0,0,0|2,0,0]=4 713 B15R1.4049 COc1cc(ccc1Br)S(=O)(=O)N(C)C 270084a_100102631434_100000765252 [0,2,0,0,0,0|2,0,0]=4 714 B15R1.4049 COc1cc(ccc1Br)S(=O)(=O)N(C)C 274078a_100102631434_100000765252 [0,2,0,0,0,0|2,0,0]=4 715 B15R1.4049 COc1cc(ccc1F)S(=O)(=O)N(C)C 270084a_100102631434_100000717096 [0,2,0,0,0,0|2,0,0]=4 716 B15R1.4049 COc1cc(ccc1F)S(=O)(=O)N(C)C 274078a_100102631434_100000717096 [0,2,0,0,0,0|2,0,0]=4 717 B15R1.4049 COc1cc(ccc1N)S(=O)(=O)N(C)C 34a_100012337789_200000210301 [0,2,0,0,0,0|2,0,0]=4 718 B15R1.4049 COc1cc(ccc1N)S(=O)(=O)N(C)C 7a_100012337789_200000210301 [0,2,0,0,0,0|2,0,0]=4 719 B15R1.16219 CCS(=O)(=O)c1ccc(c(c1)NC)OC 34a_100000061299_200000210301 [0,2,0,0,0,0|2,0,0]=4 720 B15R1.16219 CCS(=O)(=O)c1ccc(c(c1)NC)OC 7a_100000061299_200000210301 [0,2,0,0,0,0|2,0,0]=4 721 B15R1.16219 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])OC 34a_100000061299_200025704644 [0,2,0,0,0,0|2,0,0]=4 722 B15R1.16219 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])OC 7a_100000061299_200025704644 [0,2,0,0,0,0|2,0,0]=4 723 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 270084a_100102657272_100000212161 [0,2,0,0,0,0|1,0,0]=3 724 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 274078a_100102657272_100000212161 [0,2,0,0,0,0|1,0,0]=3 725 B15R1.16219 CNS(=O)(=O)c1ccc(c(c1)OC)OC 40a_100102657272_100010304489 [0,2,0,0,0,0|1,0,0]=3 726 B15R1.9551 CCNc1ccc(cc1OC)S(=O)(=O)C 34a_100011900471_100000210202 [0,2,0,0,0,0|2,0,0]=4 727 B15R1.9551 CNCc1ccc(cc1OC)S(=O)(=O)[O-] 26a_100102657272_100000037119 [0,2,0,0,0,0|1,0,1]=4 728 B15R1.9551 COc1cc(ccc1NCF)S(=O)(=O)C 34a_100011900471_100015361967 [0,2,0,0,0,0|2,0,0]=4 729 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000210301 [1,0,0,1,0,0|2,0,0]=4 730 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200025704644 [1,0,0,1,0,0|2,0,0]=4 731 B15R2.42998 CS(=O)(=O)Nc1ccc2c(c1)CCO2 40a_100000736984_100000738038 [0,0,0,1,0,1|2,0,0]=4 732 B15R2.42998 CS(=O)(=O)Nc1ccc2c(c1)OCO2 40a_100000209953_100000738038 [0,0,0,1,0,1|1,0,0]=3 733 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)CCO2 270084a_100102657272_100000230168 [0,1,0,1,0,0|2,0,0]=4 734 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)CCO2 274078a_100102657272_100000230168 [0,1,0,1,0,0|2,0,0]=4 735 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)OCO2 270084a_100102657272_100000759609 [0,1,0,1,0,0|1,0,0]=3 736 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)OCO2 274078a_100102657272_100000759609 [0,1,0,1,0,0|1,0,0]=3 737 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [1,0,0,0,0,1|2,0,0]=4 738 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [1,0,0,0,0,1|2,0,0]=4 739 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [1,0,0,0,0,1|2,0,0]=4 740 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [1,0,0,0,0,1|2,0,0]=4 741 B13R1.80 CCc1cccc(c1)NS(=O)(=O)C 40a_100000211250_100000738038 [1,0,0,0,0,1|2,0,0]=4 742 B13R1.80 CNc1cccc(c1)CS(=O)(=O)C 2230a_100000747548_200000210301 [1,0,0,0,0,1|2,0,0]=4 743 B13R1.80 CNc1cccc(c1)CS(=O)(=O)C 34a_100000747548_200000210301 [1,0,0,0,0,1|2,0,0]=4 744 B13R1.80 CNc1cccc(c1)CS(=O)(=O)C 7a_100000747548_200000210301 [1,0,0,0,0,1|2,0,0]=4 745 B13R1.80 CNc1cccc(c1)NS(=O)(=O)C 34a_100000736748_200000210301 [1,0,0,0,0,1|2,0,0]=4 746 B13R1.80 COc1cccc(c1)NS(=O)(=O)C 40a_100000210024_100000738038 [1,0,0,0,0,1|1,0,0]=3 747 B13R1.80 CS(=O)(=O)Cc1cccc(c1)N[13CH3] 2230a_100000747548_200025704644 [1,0,0,0,0,1|2,0,0]=4 748 B13R1.80 CS(=O)(=O)Cc1cccc(c1)N[13CH3] 34a_100000747548_200025704644 [1,0,0,0,0,1|2,0,0]=4 749 B13R1.80 CS(=O)(=O)Cc1cccc(c1)N[13CH3] 7a_100000747548_200025704644 [1,0,0,0,0,1|2,0,0]=4 750 B13R1.80 CS(=O)(=O)Cc1cccc(c1)S[13CH3] 62a_200009814643_200025704644 [1,0,0,0,0,1|1,1,0]=4 751 B13R1.80 CS(=O)(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_200009814643 [1,0,0,0,0,1|1,1,0]=4 752 B13R1.80 CS(=O)(=O)Nc1cccc(c1)N[13CH3] 34a_100000736748_200025704644 [1,0,0,0,0,1|2,0,0]=4 753 B13R1.80 CS(=O)(=O)Nc1cccc(c1)S[13CH3] 62a_100000165606_200025704644 [1,0,0,0,0,1|1,1,0]=4 754 B13R1.80 CS(=O)(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000165606 [1,0,0,0,0,1|1,1,0]=4 755 B13R1.80 CSc1cccc(c1)CS(=O)(=O)C 62a_200000210301_200009814643 [1,0,0,0,0,1|1,1,0]=4 756 B13R1.80 CSc1cccc(c1)CS(=O)(=O)C 62a_200009814643_200000210301 [1,0,0,0,0,1|1,1,0]=4 757 B13R1.80 CSc1cccc(c1)CS(=O)(=O)N 62a_100000725052_200000210301 [1,0,0,0,0,1|1,1,0]=4 758 B13R1.80 CSc1cccc(c1)CS(=O)(=O)N 62a_200000210301_100000725052 [1,0,0,0,0,1|1,1,0]=4 759 B13R1.80 CSc1cccc(c1)NS(=O)(=O)C 40a_100000210049_100000738038 [1,0,0,0,0,1|1,1,0]=4 760 B13R1.80 CSc1cccc(c1)NS(=O)(=O)C 62a_100000165606_200000210301 [1,0,0,0,0,1|1,1,0]=4 761 B13R1.80 CSc1cccc(c1)NS(=O)(=O)C 62a_200000210301_100000165606 [1,0,0,0,0,1|1,1,0]=4 762 B13R1.80 [13CH3]Sc1cccc(c1)CS(=O)(=O)N 62a_100000725052_200025704644 [1,0,0,0,0,1|1,1,0]=4 763 B13R1.80 [13CH3]Sc1cccc(c1)CS(=O)(=O)N 62a_200025704644_100000725052 [1,0,0,0,0,1|1,1,0]=4 764 B13R1.53 COc1cc(ccc1S(=O)(=O)C)O 271570a_203496583355_100010732494 [0,0,0,0,1,1|1,0,0]=3 765 B15R1.4027 CCc1cc(ccc1O)SCS(=O)(=O)N 62a_100000741382_100012338938 [0,0,0,0,0,2|2,0,0]=4 766 B15R1.4027 CCc1cc(ccc1O)SCS(=O)(=O)[O-] 62a_100009817235_100012338938 [0,0,0,0,0,2|1,0,1]=4 767 B15R1.4027 COc1cc(ccc1Br)NCS(=O)(=O)[O-] 34a_100000765947_100009817235 [0,0,0,0,0,2|1,0,1]=4 768 B15R1.4027 COc1cc(ccc1Br)OCS(=O)(=O)[O-] 34a_100011827694_100009817235 [0,0,0,0,0,2|1,0,1]=4 769 B15R1.4027 COc1cc(ccc1Br)SCS(=O)(=O)N 62a_100000741382_100012353699 [0,0,0,0,0,2|2,0,0]=4 770 B15R1.4027 COc1cc(ccc1Br)SCS(=O)(=O)N 62a_100012353699_100000741382 [0,0,0,0,0,2|2,0,0]=4 771 B15R1.4027 COc1cc(ccc1Br)SCS(=O)(=O)[O-] 62a_100009817235_100012353699 [0,0,0,0,0,2|1,0,1]=4 772 B15R1.4027 COc1cc(ccc1Br)SCS(=O)(=O)[O-] 62a_100012353699_100009817235 [0,0,0,0,0,2|1,0,1]=4 773 B15R1.4027 COc1cc(ccc1C)NCS(=O)(=O)[O-] 34a_100011279678_100009817235 [0,0,0,0,0,2|1,0,1]=4 774 B15R1.4027 COc1cc(ccc1C)OCS(=O)(=O)[O-] 34a_100009865632_100009817235 [0,0,0,0,0,2|1,0,1]=4 775 B15R1.4027 COc1cc(ccc1C)SCS(=O)(=O)N 62a_100000741382_100011830276 [0,0,0,0,0,2|2,0,0]=4 776 B15R1.4027 COc1cc(ccc1C)SCS(=O)(=O)N 62a_100011830276_100000741382 [0,0,0,0,0,2|2,0,0]=4 777 B15R1.4027 COc1cc(ccc1C)SCS(=O)(=O)[O-] 62a_100009817235_100011830276 [0,0,0,0,0,2|1,0,1]=4 778 B15R1.4027 COc1cc(ccc1C)SCS(=O)(=O)[O-] 62a_100011830276_100009817235 [0,0,0,0,0,2|1,0,1]=4 779 B15R1.4027 COc1cc(ccc1Cl)CNS(=O)(=O)C 40a_100015204853_100000738038 [0,0,0,0,0,2|2,0,0]=4 780 B15R1.4027 COc1cc(ccc1Cl)NCS(=O)(=O)[O-] 34a_100000742311_100009817235 [0,0,0,0,0,2|1,0,1]=4 781 B15R1.4027 COc1cc(ccc1Cl)OCS(=O)(=O)[O-] 34a_100012186310_100009817235 [0,0,0,0,0,2|1,0,1]=4 782 B15R1.4027 COc1cc(ccc1Cl)SCS(=O)(=O)N 62a_100000741382_100011356853 [0,0,0,0,0,2|2,0,0]=4 783 B15R1.4027 COc1cc(ccc1Cl)SCS(=O)(=O)N 62a_100011356853_100000741382 [0,0,0,0,0,2|2,0,0]=4 784 B15R1.4027 COc1cc(ccc1Cl)SCS(=O)(=O)[O-] 62a_100009817235_100011356853 [0,0,0,0,0,2|1,0,1]=4 785 B15R1.4027 COc1cc(ccc1Cl)SCS(=O)(=O)[O-] 62a_100011356853_100009817235 [0,0,0,0,0,2|1,0,1]=4 786 B15R1.4027 COc1cc(ccc1F)CNS(=O)(=O)C 40a_100020626639_100000738038 [0,0,0,0,0,2|2,0,0]=4 787 B15R1.4027 COc1cc(ccc1F)NCS(=O)(=O)[O-] 34a_100000701188_100009817235 [0,0,0,0,0,2|1,0,1]=4 788 B15R1.4027 COc1cc(ccc1F)NNS(=O)(=O)C 40a_102515433066_100000738038 [0,0,0,0,0,2|2,0,0]=4 789 B15R1.4027 COc1cc(ccc1F)OCS(=O)(=O)[O-] 34a_100012001760_100009817235 [0,0,0,0,0,2|1,0,1]=4 790 B15R1.4027 COc1cc(ccc1F)SCS(=O)(=O)N 62a_100000741382_100011934186 [0,0,0,0,0,2|2,0,0]=4 791 B15R1.4027 COc1cc(ccc1F)SCS(=O)(=O)N 62a_100011934186_100000741382 [0,0,0,0,0,2|2,0,0]=4 792 B15R1.4027 COc1cc(ccc1F)SCS(=O)(=O)[O-] 62a_100009817235_100011934186 [0,0,0,0,0,2|1,0,1]=4 793 B15R1.4027 COc1cc(ccc1F)SCS(=O)(=O)[O-] 62a_100011934186_100009817235 [0,0,0,0,0,2|1,0,1]=4 794 B15R1.4027 COc1cc(ccc1I)NCS(=O)(=O)[O-] 34a_100000746945_100009817235 [0,0,0,0,0,2|1,0,1]=4 795 B15R1.4027 COc1cc(ccc1N)OCS(=O)(=O)[O-] 34a_100015326901_100009817235 [0,0,0,0,0,2|1,0,1]=4 796 B15R1.4027 COc1cc(ccc1N)SCS(=O)(=O)N 62a_100000741382_100015196925 [0,0,0,0,0,2|2,0,0]=4 797 B15R1.4027 COc1cc(ccc1N)SCS(=O)(=O)N 62a_100011279103_100000741382 [0,0,0,0,0,2|2,0,0]=4 798 B15R1.4027 COc1cc(ccc1N)SCS(=O)(=O)[O-] 62a_100009817235_100015196925 [0,0,0,0,0,2|1,0,1]=4 799 B15R1.4027 COc1cc(ccc1N)SCS(=O)(=O)[O-] 62a_100011279103_100009817235 [0,0,0,0,0,2|1,0,1]=4 800 B15R1.4027 COc1cc(ccc1O)CNS(=O)(=O)C 40a_100000185554_100000738038 [0,0,0,0,0,2|1,0,0]=3 801 B15R1.4027 COc1cc(ccc1O)NCS(=O)(=O)[O-] 34a_100000726020_100009817235 [0,0,0,0,0,2|0,0,1]=3 802 B15R1.4027 COc1cc(ccc1O)SCS(=O)(=O)N 62a_100000741382_100000694246 [0,0,0,0,0,2|1,0,0]=3 803 B15R1.4027 COc1cc(ccc1O)SCS(=O)(=O)[O-] 62a_100009817235_100000694246 [0,0,0,0,0,2|0,0,1]=3 804 B15R1.4027 COc1nc(ccc1O)SCS(=O)(=O)N 62a_100000741382_100010893133 [0,0,0,0,0,2|2,0,0]=4 805 B15R1.4027 COc1nc(ccc1O)SCS(=O)(=O)[O-] 62a_100009817235_100010893133 [0,0,0,0,0,2|1,0,1]=4