0 B9R1.13 C1=CN(C=N1)CC(=O)O PI-10326 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.13 C1=CN(C=N1)CC(=O)O PI-11655 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.13 C1=CN(N=C1)CC(=O)O PI-35655 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.13 C1=COC=C1CC(=O)O PI-36295 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.13 C1=CSC(=C1)CC(=O)Cl PI-11881 [0,0,0,0,0,0|1,1,0]=2 5 B9R1.13 CC(=O)NC1=CC=CS1 PI-12512 [0,0,0,0,0,0|1,1,0]=2 6 B9R1.13 CC(=O)NC1=NC=CS1 PI-26514 [0,0,0,0,0,0|2,1,0]=3 7 B9R1.13 CC(C)CC1=NC=CS1 PI-11127 [0,0,0,0,0,0|2,1,1]=4 8 B9R1.13 CC(N)CC1=CC=CS1 PI-40008 [0,0,0,0,0,0|1,1,1]=3 9 B9R1.13 CC(N)Cc1ccco1 PI-36445 [0,0,0,0,0,0|1,0,1]=2 10 B9R1.13 CN(C)C=C1C=CC=C1 PI-48994 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.13 OC(=O)CC1=CC=C[CH-]1 PI-40764 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.13 OC(=O)Cc1c[nH]cn1 PI-21909 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.13 OC(=O)Cc1cccs1 PI-11148 [0,0,0,0,0,0|1,1,0]=2 14 B9R1.13 OC(=O)Cc1cscc1 PI-15240 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.8 CCCC1=NC=CN1 PI-24452 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.8 CNCC1=CC=NO1 PI-48159 [1,0,0,0,0,0|2,0,0]=3 17 B8R1.8 CSCC1=CC=CO1 PI-48491 [1,0,0,0,0,0|1,0,0]=2 18 B8R1.8 N#CCc1cccs1 PI-10786 [1,0,0,0,0,0|1,1,1]=4 19 B8R1.8 NCCc1cccs1 PI-11168 [1,0,0,0,0,0|1,1,1]=4 20 B8R1.8 O=C=Nc1cccs1 PI-27322 [1,0,0,0,0,0|1,1,1]=4 21 B8R1.8 OCCc1cccs1 PI-11150 [1,0,0,0,0,0|0,1,2]=4 22 B10R1.23 OC(=O)C(=O)c1cccs1 PI-12233 [0,1,0,0,0,0|1,1,1]=4 23 B10R1.27 C1=CSC=C1CC(=O)NN PI-29251 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.27 COC(=O)CC1=CC=CS1 PI-50442 [0,1,0,0,0,0|0,1,0]=2 25 B10R1.27 COC(=O)CC1=CSC=C1 PI-30743 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.27 COC(=O)CN1C=NC=N1 PI-19041 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.54 C1=C(N=C(S1)CC(=O)N)O PI-20872 [0,1,0,0,0,0|2,1,0]=4 28 B10R1.54 CC(=O)Cc1cnc(s1)N PI-15461 [0,1,0,0,0,0|1,1,0]=3 29 B10R1.54 CC(=O)NC1=NC=C(S1)Cl PI-26276 [0,1,0,0,0,0|2,1,0]=4 30 B10R1.54 CC(=O)Nc1scc(C)n1 PI-17263 [0,1,0,0,0,0|2,1,0]=4 31 B10R1.54 CC1=CSC(=C1)CC(=O)C PI-48378 [0,1,0,0,0,0|0,1,0]=2 32 B10R1.54 CC1=NN(C=C1)CC(=O)O PI-17370 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.54 Nc1nc(cs1)CC(=O)O PI-11022 [0,1,0,0,0,0|3,0,0]=4 34 B10R1.54 Nc1nc(cs1)CC(=O)O PI-12833 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.64 CC1=C(C=CO1)SC(=O)C PI-46984 [0,1,0,0,0,0|3,0,0]=4 36 B8R1.7 C1=C(NC=N1)C(=O)O PI-31349 [0,0,0,0,1,0|3,0,0]=4 37 B8R1.7 C1=C(ON=C1)C(=O)Cl PI-29789 [0,0,0,0,1,0|2,0,0]=3 38 B8R1.7 C1=C(SC=N1)C(=O)O PI-25160 [0,0,0,0,1,0|2,1,0]=4 39 B8R1.7 C1=CN=C(N1)C(=O)O PI-40003 [0,0,0,0,1,0|3,0,0]=4 40 B8R1.7 C1=CNC=C1C(=O)O PI-34087 [0,0,0,0,1,0|3,0,0]=4 41 B8R1.7 C1=CNC=C1C(=O)O PI-48299 [0,0,0,0,1,0|3,0,0]=4 42 B8R1.7 C1=COC(=C1)C(=O)N PI-17349 [0,0,0,0,1,0|1,0,0]=2 43 B8R1.7 C1=COC=C1C(=O)Cl PI-46981 [0,0,0,0,1,0|3,0,0]=4 44 B8R1.7 C1=COC=C1C(=O)O PI-16502 [0,0,0,0,1,0|3,0,0]=4 45 B8R1.7 C1=CON=C1C(=O)O PI-48871 [0,0,0,0,1,0|3,0,0]=4 46 B8R1.7 C1=CSC(=C1)C(=N)N PI-29689 [0,0,0,0,1,0|2,1,0]=4 47 B8R1.7 C1=CSC(=C1)C(=O)N PI-50586 [0,0,0,0,1,0|1,1,0]=3 48 B8R1.7 C1=CSC(=C1)C(=O)[O-] PI-11153 [0,0,0,0,1,0|1,1,0]=3 49 B8R1.7 C1=CSC(=C1)[N+](=O)[O-] PI-10995 [0,0,0,0,1,0|2,1,0]=4 50 B8R1.7 C1=CSC(=N1)C(C)=O PI-11117 [0,0,0,0,1,0|1,1,0]=3 51 B8R1.7 CC(=O)C1=CC=CN1 PI-12083 [0,0,0,0,1,0|1,0,0]=2 52 B8R1.7 CC(=O)C1=CC=NN1 PI-44747 [0,0,0,0,1,0|2,0,0]=3 53 B8R1.7 CC(=O)C1=CN=CN1 PI-45218 [0,0,0,0,1,0|2,0,0]=3 54 B8R1.7 CC(=O)C1=CN=CN1 PI-45286 [0,0,0,0,1,0|2,0,0]=3 55 B8R1.7 CC(=O)c1cscc1 PI-16499 [0,0,0,0,1,0|2,0,0]=3 56 B8R1.7 CC(=O)n1cncc1 PI-31807 [0,0,0,0,1,0|3,0,0]=4 57 B8R1.7 CC(C1=CC=CS1)O PI-12508 [0,0,0,0,1,0|0,1,2]=4 58 B8R1.7 CC(C1=CC=C[CH-]1)O PI-44457 [0,0,0,0,1,0|1,0,2]=4 59 B8R1.7 CC(C1=NC=CN1)=O PI-39737 [0,0,0,0,1,0|2,0,0]=3 60 B8R1.7 CC(N)C1=CC=CS1 PI-40007 [0,0,0,0,1,0|1,1,1]=4 61 B8R1.7 C[C@@H](O)c1cccs1 PI-12507 [0,0,0,0,1,0|0,1,2]=4 62 B8R1.7 ClC(=O)c1cscc1 PI-10762 [0,0,0,0,1,0|3,0,0]=4 63 B8R1.7 NC(=S)c1ccco1 PI-19230 [0,0,0,0,1,0|1,1,0]=3 64 B8R1.7 NC(=S)c1cccs1 PI-39110 [0,0,0,0,1,0|1,2,0]=4 65 B8R1.7 OB(c1ccco1)O PI-33002 [0,0,0,0,1,0|2,0,1]=4 66 B8R1.7 OC(=O)c1cc[nH]n1 PI-34779 [0,0,0,0,1,0|3,0,0]=4 67 B8R1.7 OC(=O)c1ccc[nH]1 PI-27813 [0,0,0,0,1,0|2,0,0]=3 68 B8R1.7 OC(=O)c1cccs1 PI-38239 [0,0,0,0,1,0|1,1,0]=3 69 B8R1.7 OC(=O)c1ccno1 PI-29335 [0,0,0,0,1,0|2,0,0]=3 70 B8R1.7 OC(=O)c1cocn1 PI-43182 [0,0,0,0,1,0|3,0,0]=4 71 B8R1.7 OC(=O)c1cscc1 PI-10764 [0,0,0,0,1,0|3,0,0]=4 72 B8R1.7 OC(=O)c1cscn1 PI-28011 [0,0,0,0,1,0|3,0,0]=4 73 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-13521 [0,0,0,0,0,1|2,0,0]=3 74 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-16758 [0,0,0,0,0,1|2,0,0]=3 75 B10R1.18 C1=CC=C(C=C1)OC(=O)N PI-10948 [0,0,0,0,0,1|3,0,0]=4 76 B10R1.18 C1=CC=NC(=C1)CC(=O)O PI-16725 [0,0,0,0,0,1|2,0,0]=3 77 B10R1.18 C1=CC=[N+](C=C1)CC(=O)N PI-15939 [0,0,0,0,0,1|3,0,0]=4 78 B10R1.18 CC(=CC1=CC=CC=C1)C PI-47118 [0,0,0,0,0,1|2,0,1]=4 79 B10R1.18 CC(=O)CC1=CC=NC=C1 PI-24530 [0,0,0,0,0,1|1,0,0]=2 80 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 PI-17935 [0,0,0,0,0,1|2,0,0]=3 81 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 PI-30609 [0,0,0,0,0,1|2,0,0]=3 82 B10R1.18 CC(=O)NC1=NC=CC=N1 PI-44088 [0,0,0,0,0,1|2,0,0]=3 83 B10R1.18 CC(CC1=NC=CC=C1)=O PI-41787 [0,0,0,0,0,1|1,0,0]=2 84 B10R1.18 CC(Cc1ccccn1)C PI-13337 [0,0,0,0,0,1|2,0,1]=4 85 B10R1.18 OC(=O)Cc1cccnc1 PI-28588 [0,0,0,0,0,1|2,0,0]=3 86 B10R1.18 OC(=O)Cc1ccncc1 PI-16726 [0,0,0,0,0,1|2,0,0]=3 87 B10R1.18 OC(=O)Cc1cncnc1 PI-32944 [0,0,0,0,0,1|3,0,0]=4 88 B10R1.66 C1=COC(=C1)C=C[N+](=O)[O-] PI-17051 [0,0,0,0,0,1|2,0,1]=4 89 B10R1.66 C1=COC(=C1)CNC(=S)N PI-17050 [0,0,0,0,0,1|1,1,0]=3 90 B10R1.66 C1=CSC(=N1)CCC(=O)O PI-24109 [0,0,0,0,0,1|2,1,0]=4 91 B10R1.66 CC(=O)C=CC1=CC=CO1 PI-17492 [0,0,0,0,0,1|0,0,1]=2 92 B10R1.66 CC(=O)C=CC1=CC=CS1 PI-29954 [0,0,0,0,0,1|0,1,1]=3 93 B10R1.66 OC(=O)CCc1cccs1 PI-24513 [0,0,0,0,0,1|1,1,0]=3 94 B10R1.66 OC(=O)\C=C\c1ccco1 PI-28626 [0,0,0,0,0,1|1,0,1]=3 95 B10R1.66 OC(=O)\C=C\c1ccco1 PI-31027 [0,0,0,0,0,1|1,0,1]=3 96 B10R1.66 OC(=O)\C=C\c1cccs1 PI-28053 [0,0,0,0,0,1|1,1,1]=4 97 B10R1.66 OC(=O)\C=C\c1cccs1 PI-39126 [0,0,0,0,0,1|1,1,1]=4 98 B7R0.4 CC=CC=CC(=O)[O-] PI-15818 [1,0,1,0,0,0|2,0,0]=4 99 B7R0.7 CC=CC(=O)OC=C PI-13581 [1,0,1,0,0,0|1,0,1]=4 100 B7R1.1 C1=C(N=CS1)C=O PI-25454 [2,0,0,0,0,0|2,0,0]=4 101 B7R1.1 C1=C(NC=N1)C=O PI-34783 [2,0,0,0,0,0|2,0,0]=4 102 B7R1.1 C1=CNC=C1C=O PI-34088 [2,0,0,0,0,0|2,0,0]=4 103 B7R1.1 C1=COC(=C1)CS PI-48474 [2,0,0,0,0,0|0,1,0]=3 104 B7R1.1 C1=CSC(=C1)C=O PI-44709 [2,0,0,0,0,0|0,1,0]=3 105 B7R1.1 C1=CSC(=C1)CCl PI-50490 [2,0,0,0,0,0|1,1,0]=4 106 B7R1.1 C1=CSC(=C1)CO PI-11151 [2,0,0,0,0,0|0,1,1]=4 107 B7R1.1 CCC1=CC=CS1 PI-10993 [2,0,0,0,0,0|0,1,0]=3 108 B7R1.1 CCC1=CSC=C1 PI-35073 [2,0,0,0,0,0|2,0,0]=4 109 B7R1.1 CCN1C=CC=C1 PI-12065 [2,0,0,0,0,0|2,0,0]=4 110 B7R1.1 CCc1ncc[nH]1 PI-31817 [2,0,0,0,0,0|2,0,0]=4 111 B7R1.1 CCn1cccn1 PI-35920 [2,0,0,0,0,0|2,0,0]=4 112 B7R1.1 COc1cccs1 PI-33573 [2,0,0,0,0,0|1,1,0]=4 113 B7R1.1 NCc1cccs1 PI-11152 [2,0,0,0,0,0|1,1,0]=4 114 B7R1.1 O=CC1=NC=CO1 PI-39572 [2,0,0,0,0,0|1,0,0]=3 115 B7R1.1 O=Cc1cc[nH]n1 PI-39063 [2,0,0,0,0,0|2,0,0]=4 116 B7R1.1 O=Cc1ccc[nH]1 PI-16523 [2,0,0,0,0,0|1,0,0]=3 117 B7R1.1 O=Cc1cnco1 PI-38922 [2,0,0,0,0,0|1,0,0]=3 118 B7R1.1 O=Cc1cncs1 PI-25019 [2,0,0,0,0,0|1,1,0]=4 119 B7R1.1 O=Cc1cscc1 PI-10763 [2,0,0,0,0,0|2,0,0]=4 120 B7R1.1 O=Cc1ncc[nH]1 PI-24015 [2,0,0,0,0,0|2,0,0]=4 121 B7R1.1 O=Cc1nccs1 PI-11133 [2,0,0,0,0,0|1,1,0]=4 122 B7R1.1 OCc1cnco1 PI-38536 [2,0,0,0,0,0|1,0,1]=4 123 B9R0.2 CC=CC=CCOC(=O)C PI-40367 [0,1,1,0,0,0|1,0,0]=3 124 B9R1.11 CC(C1=CC=CO1)NO PI-19088 [1,1,0,0,0,0|1,0,1]=4 125 B9R1.11 CCC(=O)c1ccco1 PI-17052 [1,1,0,0,0,0|0,0,2]=4 126 B9R1.11 COC(=O)C1=CC=CO1 PI-13054 [1,1,0,0,0,0|1,0,1]=4 127 B9R1.11 NCC(c1ccco1)O PI-15941 [1,1,0,0,0,0|1,0,1]=4 128 B9R1.12 CCCCC1=CC=CS1 PI-44597 [1,1,0,0,0,0|0,1,1]=4 129 B9R1.19 CS(=O)(=O)C1=CC=CS1 PI-29538 [0,1,0,0,1,0|1,1,0]=4 130 B9R1.35 C1=C(OC(=C1)Br)C(=O)Cl PI-21496 [0,1,0,0,1,0|1,0,0]=3 131 B9R1.35 C1=C(OC(=C1)Br)C(=O)O PI-21497 [0,1,0,0,1,0|1,0,0]=3 132 B9R1.35 C1=C(OC(=C1)Br)[N+](=O)[O-] PI-17302 [0,1,0,0,1,0|2,0,0]=4 133 B9R1.35 C1=C(OC(=C1)N)C(=O)O PI-19351 [0,1,0,0,1,0|1,0,0]=3 134 B9R1.35 C1=C(SC(=C1)Br)C(=O)Cl PI-45457 [0,1,0,0,1,0|1,1,0]=4 135 B9R1.35 C1=C(SC(=C1)Br)C(=O)N PI-29907 [0,1,0,0,1,0|1,1,0]=4 136 B9R1.35 C1=C(SC(=C1)Br)C(=O)O PI-16448 [0,1,0,0,1,0|1,1,0]=4 137 B9R1.35 C1=C(SC(=C1)Cl)C(=O)O PI-30361 [0,1,0,0,1,0|1,1,0]=4 138 B9R1.35 CC(=O)C1=CC(Br)=CS1 PI-29021 [0,1,0,0,1,0|0,1,0]=3 139 B9R1.35 CC(=O)C1=CC=C(S1)Br PI-16279 [0,1,0,0,1,0|0,1,0]=3 140 B9R1.35 CC(=O)C1=CC=C(S1)I PI-26551 [0,1,0,0,1,0|0,1,0]=3 141 B9R1.35 CC(=O)C1=NC=C(S1)Br PI-43922 [0,1,0,0,1,0|1,1,0]=4 142 B9R1.35 CC(=O)N1C=C(C=N1)I PI-31343 [0,1,0,0,1,0|2,0,0]=4 143 B9R1.35 CC(=O)c1c[nH]c(C)n1 PI-36304 [0,1,0,0,1,0|2,0,0]=4 144 B9R1.35 CC(=O)c1cc(cs1)Cl PI-38201 [0,1,0,0,1,0|0,1,0]=3 145 B9R1.35 CC(C1=CN=C(N)S1)=O PI-46739 [0,1,0,0,1,0|1,1,0]=4 146 B9R1.35 CC1=CC=C(O1)C(=O)Cl PI-19122 [0,1,0,0,1,0|1,0,0]=3 147 B9R1.35 CC1=CC=C(O1)C(=O)O PI-17727 [0,1,0,0,1,0|1,0,0]=3 148 B9R1.35 CC1=CC=C(S1)C(=O)C PI-27153 [0,1,0,0,1,0|0,1,0]=3 149 B9R1.35 CC1=CC=C(S1)C(=O)O PI-11163 [0,1,0,0,1,0|1,1,0]=4 150 B9R1.35 CC1=CSC(=C1)C(=O)O PI-29136 [0,1,0,0,1,0|1,1,0]=4 151 B9R1.35 Clc1ccc(s1)C(=O)Cl PI-26633 [0,1,0,0,1,0|1,1,0]=4 152 B9R1.35 OC(=O)C1=CC(Br)=CN1 PI-39658 [0,1,0,0,1,0|2,0,0]=4 153 B9R1.35 OC(=O)c1cc(Br)cs1 PI-29188 [0,1,0,0,1,0|1,1,0]=4 154 B9R1.35 OC(=O)c1cc(no1)Br PI-39414 [0,1,0,0,1,0|2,0,0]=4 155 B9R1.41 C1=CSC(=C1Br)C(=O)Cl PI-29405 [0,1,0,0,1,0|1,1,0]=4 156 B9R1.41 C1=CSC(=C1Br)C(=O)O PI-22617 [0,1,0,0,1,0|1,1,0]=4 157 B9R1.41 C1=CSC(=C1Cl)C(=O)Cl PI-20245 [0,1,0,0,1,0|1,1,0]=4 158 B9R1.41 C1=CSC(=C1Cl)C(=O)N PI-29148 [0,1,0,0,1,0|1,1,0]=4 159 B9R1.41 C1=CSC(=C1Cl)C(=O)O PI-10801 [0,1,0,0,1,0|1,1,0]=4 160 B9R1.41 CC(=O)C1=C(C=CS1)N PI-26559 [0,1,0,0,1,0|0,1,0]=3 161 B9R1.41 CC(=O)C1=CC=CN1C PI-12067 [0,1,0,0,1,0|1,0,0]=3 162 B9R1.41 CC1=C(OC=C1)C(=O)O PI-17475 [0,1,0,0,1,0|1,0,0]=3 163 B9R1.41 CC1=C(SC=C1)C(=O)C PI-35069 [0,1,0,0,1,0|0,1,0]=3 164 B9R1.41 CC1=C(SC=C1)C(=O)Cl PI-11936 [0,1,0,0,1,0|1,1,0]=4 165 B9R1.41 CC1=C(SC=C1)C(=O)N PI-29912 [0,1,0,0,1,0|1,1,0]=4 166 B9R1.41 CC1=C(SC=C1)C(=O)O PI-11161 [0,1,0,0,1,0|1,1,0]=4 167 B9R1.41 NC(=O)c1sccc1N PI-14136 [0,1,0,0,1,0|1,1,0]=4 168 B9R1.41 OC(=O)c1occc1Br PI-39205 [0,1,0,0,1,0|1,0,0]=3 169 B9R1.41 OC(=O)c1sccc1O PI-36902 [0,1,0,0,1,0|1,1,0]=4 170 B11R1.20 C1=C(C=NC(=N1)CC(=O)O)F PI-45132 [0,1,0,0,0,1|2,0,0]=4 171 B11R1.20 C1=CC(=CC=C1CC(=O)Cl)F PI-28554 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.20 C1=CC(=CC=C1CC(=O)N)O PI-16441 [0,1,0,0,0,1|2,0,0]=4 173 B11R1.20 C1=CC(=CC=C1CC(=O)O)Br PI-12711 [0,1,0,0,0,1|2,0,0]=4 174 B11R1.20 C1=CC(=CC=C1CC(=O)O)Cl PI-32618 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.20 C1=CC(=CC=C1CC(=O)O)N PI-25083 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.20 C1=CC(=CC=C1CC(C)=O)F PI-39618 [0,1,0,0,0,1|1,0,0]=3 177 B11R1.20 C1=CC(=NC=C1CC(=O)O)Cl PI-32201 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.20 CC(=O)Cc1ccc(cc1)Br PI-38548 [0,1,0,0,0,1|1,0,0]=3 179 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 PI-26690 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.20 CC(=O)NC1=CC=C(C=C1)Br PI-24030 [0,1,0,0,0,1|2,0,0]=4 181 B11R1.20 CC(=O)NC1=CC=C(C=C1)F PI-34152 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.20 CC(=O)NC1=CC=C(C=C1)S PI-26064 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.20 CC(=O)NC1=NC=C(C=C1)N PI-14240 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.20 CC(=O)OC1=CC=C(C=C1)F PI-16968 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.20 CC(=O)OC1=CC=C(C=C1)O PI-49042 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.20 CC(=O)Oc1ccc(cc1)Br PI-35155 [0,1,0,0,0,1|2,0,0]=4 187 B11R1.20 CC(=O)SC1=CC=C(C=C1)I PI-35183 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.20 CC(OC1=CC=C(N)C=C1)=O PI-37062 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.20 CC1=CC=C(C=C1)CC(=O)O PI-30795 [0,1,0,0,0,1|2,0,0]=4 190 B11R1.20 CC1=CN=C(C=C1)CC(=O)O PI-48028 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.20 ClC(=O)Cc1ccc(Br)cc1 PI-22240 [0,1,0,0,0,1|2,0,0]=4 192 B11R1.20 ClC(=O)Cc1ccc(C)cc1 PI-24891 [0,1,0,0,0,1|2,0,0]=4 193 B11R1.20 OC(=O)Cc1ccc(F)cc1 PI-16969 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.20 OC(=O)Cc1ccc(I)cc1 PI-30230 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.20 OC(=O)Cc1ccc(O)cc1 PI-11992 [0,1,0,0,0,1|2,0,0]=4 196 B11R1.20 OC(=O)Cc1ccc(S)cc1 PI-30560 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)Br PI-12709 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)N PI-18442 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)O PI-33913 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.36 C1=CN=CC=C1C(C(=O)O)N PI-36241 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.36 C1C=CCC(=C1)C(C(=O)O)N PI-28324 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.36 CC(C(=O)O)c1ccccc1 PI-11879 [0,1,0,0,0,1|2,0,0]=4 203 B11R1.36 CC(C1=CC=CC=C1)C(=O)O PI-10358 [0,1,0,0,0,1|2,0,0]=4 204 B11R1.36 C[C@@H](c1ccccc1)C(=O)O PI-10357 [0,1,0,0,0,1|2,0,0]=4 205 B11R1.36 FC(C(=O)O)c1ccccc1 PI-30175 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.36 N[C@@H](c1ccccc1)C(=O)N PI-37984 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.36 O=C(C(=O)C)c1ccccc1 PI-32566 [0,1,0,0,0,1|1,0,1]=4 208 B11R1.36 O[C@@H](C(=O)O)c1ccccc1 PI-10352 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.36 O[C@@H](c1ccccc1)C(=O)O PI-10351 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.40 C1=CC=C(C=C1)CC(=O)NN PI-30983 [0,1,0,0,0,1|2,0,0]=4 211 B11R1.40 CCC(=O)CC1=CC=CC=C1 PI-47129 [0,1,0,0,0,1|1,0,0]=3 212 B11R1.40 COC(=O)CC1=CC=CC=N1 PI-48279 [0,1,0,0,0,1|1,0,0]=3 213 B11R1.40 COC(=O)CC1=NC=CN=C1 PI-29522 [0,1,0,0,0,1|1,0,0]=3 214 B11R1.40 ClCC(=O)Nc1ccccc1 PI-15656 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.40 O=C(OC)CC1=NC=CC=N1 PI-46781 [0,1,0,0,0,1|1,0,0]=3 216 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Br PI-14498 [0,1,0,0,0,1|2,0,0]=4 217 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)O PI-10304 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.86 CC(=O)Cc1ccccc1F PI-38595 [0,1,0,0,0,1|1,0,0]=3 219 B11R1.86 CC(=O)NC1=CC=CC=C1Br PI-50525 [0,1,0,0,0,1|2,0,0]=4 220 B11R1.86 CC(=O)NC1=CC=CC=C1F PI-34151 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.86 CC(=O)NC1=CC=CC=C1O PI-11773 [0,1,0,0,0,1|2,0,0]=4 222 B11R1.86 CC(=O)Nc1ccccc1N PI-39094 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.86 CC(=O)OC1=CC=CC=C1Cl PI-10924 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.86 ClC(=O)Cc1ccccc1C PI-24889 [0,1,0,0,0,1|2,0,0]=4 225 B11R1.86 OC(=O)Cc1ccccc1C PI-30825 [0,1,0,0,0,1|2,0,0]=4 226 B11R1.86 OC(=O)Cc1ccccc1Cl PI-11828 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.86 OC(=O)Cc1ccccc1F PI-16981 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.86 OC(=O)Cc1ccccc1I PI-12208 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.157 C1=CC(=CC(=C1)Br)CC(=O)O PI-22281 [0,1,0,0,0,1|2,0,0]=4 230 B11R1.157 C1=CC(=CC(=C1)Cl)CC(=O)O PI-16021 [0,1,0,0,0,1|2,0,0]=4 231 B11R1.157 C1=CC(=CC(=C1)I)CC(=O)O PI-30249 [0,1,0,0,0,1|2,0,0]=4 232 B11R1.157 CC(=O)Cc1cccc(c1)Br PI-38558 [0,1,0,0,0,1|1,0,0]=3 233 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br PI-50520 [0,1,0,0,0,1|2,0,0]=4 234 B11R1.157 CC(=O)NC1=CC(=CC=C1)F PI-23433 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.157 CC(=O)NC1=CC=CC(=C1)N PI-17432 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.157 CC(=O)NC1=CC=NC(=O)N1 PI-18201 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.157 CC(=O)OC1=CC(=CC=C1)F PI-26855 [0,1,0,0,0,1|2,0,0]=4 238 B11R1.157 CC1=NC(=CC=C1)NC(=O)C PI-46994 [0,1,0,0,0,1|2,0,0]=4 239 B11R1.157 OC(=O)Cc1cccc(c1)F PI-16930 [0,1,0,0,0,1|2,0,0]=4 240 B11R1.157 OC(=O)Cc1cccc(c1)N PI-31063 [0,1,0,0,0,1|2,0,0]=4 241 B11R1.157 OC(=O)Cc1cccc(c1)O PI-11931 [0,1,0,0,0,1|2,0,0]=4 242 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 PI-28365 [0,1,0,0,0,1|2,0,0]=4 243 B11R1.25 C1=COC(=C1)CNC(=O)CCl PI-17331 [0,1,0,0,0,1|0,0,0]=2 244 B11R1.25 CCC(=O)SCC1=CC=CO1 PI-48511 [0,1,0,0,0,1|0,0,0]=2 245 B11R1.25 COC(=O)C=CC1=CC=CS1 PI-29331 [0,1,0,0,0,1|0,1,1]=4 246 B11R1.25 COC(=O)CCc1ccc[nH]1 PI-39032 [0,1,0,0,0,1|1,0,0]=3 247 B11R1.35 C1=COC(=C1)CC(C(=O)O)N PI-43398 [0,1,0,0,0,1|1,0,0]=3 248 B11R1.35 C1=COC(=C1)CC(C(=O)O)N PI-43461 [0,1,0,0,0,1|1,0,0]=3 249 B11R1.35 C1=CSC(=C1)CC(C(=O)O)N PI-25746 [0,1,0,0,0,1|1,1,0]=4 250 B11R1.35 OC(=O)[C@H](Cc1cccs1)N PI-25369 [0,1,0,0,0,1|1,1,0]=4 251 B11R1.77 C1=CSC(=C1)C(CC(=O)O)N PI-17003 [0,1,0,0,0,1|1,1,0]=4 252 B11R1.77 C1=CSC(=C1)C(CC(=O)O)N PI-17004 [0,1,0,0,0,1|1,1,0]=4 253 B11R1.30 CCOC(=O)CC1=CC=CS1 PI-19733 [0,2,0,0,0,0|0,1,0]=3 254 B11R1.30 CCOC(=O)CC1=CSC=C1 PI-19515 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.30 CCOC(=O)CC1=NC=CS1 PI-50060 [0,2,0,0,0,0|1,1,0]=4 256 B11R1.39 COC(=O)CC1=CSC(N)=N1 PI-39587 [0,2,0,0,0,0|2,0,0]=4 257 B11R1.43 CN(C)CC1=CC=C(O1)CO PI-17659 [0,2,0,0,0,0|2,0,0]=4 258 B11R1.76 CC1=CC=C(O1)C[N+](C)(C)C PI-17728 [0,2,0,0,0,0|2,0,0]=4 259 B9R1.6 CC(=O)C1=CC=CC=N1 PI-48516 [0,0,1,1,0,0|1,0,1]=4 260 B9R1.6 CC(=O)c1cccnc1 PI-32250 [0,0,1,1,0,0|1,0,1]=4 261 B11R2.10 C1C(=O)CC2=CC=CC=C21 PI-11611 [0,0,0,1,0,1|1,0,0]=3 262 B11R2.10 CC1=CC2=CC=CC=C2C1 PI-30321 [0,0,0,1,0,1|2,0,0]=4 263 B11R2.10 O=C1Cc2c(N1)cccc2 PI-11084 [0,0,0,1,0,1|2,0,0]=4 264 B11R2.10 O=C1Cc2ccccc2O1 PI-18682 [0,0,0,1,0,1|2,0,0]=4 265 B9R1.8 C=CCC1=CC=CC=C1 PI-36465 [1,0,0,0,0,1|1,0,1]=4 266 B9R1.8 CCCC1=CC=CC=N1 PI-13326 [1,0,0,0,0,1|1,0,1]=4 267 B9R1.8 CCCC1=CC=NC=C1 PI-28052 [1,0,0,0,0,1|1,0,1]=4 268 B9R1.8 CNCC1=CC=CN=C1 PI-46624 [1,0,0,0,0,1|2,0,0]=4 269 B9R1.8 COCC1=CC=CC=C1 PI-19695 [1,0,0,0,0,1|2,0,0]=4 270 B9R1.8 COCc1ccccn1 PI-38670 [1,0,0,0,0,1|2,0,0]=4 271 B9R1.8 C\C=C\C1=CC=CC=C1 PI-42685 [1,0,0,0,0,1|1,0,1]=4 272 B9R1.8 C\C=C\C1=CC=CC=C1 PI-46536 [1,0,0,0,0,1|1,0,1]=4 273 B11R1.91 C1=CC=C(C=C1)CCC(=O)Cl PI-11944 [0,0,0,0,0,2|2,0,0]=4 274 B11R1.91 C1=CC=C(C=C1)NCC(=O)O PI-14870 [0,0,0,0,0,2|2,0,0]=4 275 B11R1.91 C1=CC=C(C=C1)OCC(=O)O PI-32615 [0,0,0,0,0,2|2,0,0]=4 276 B11R1.91 C1=CC=C(C=C1)OCC(=O)[O-] PI-50538 [0,0,0,0,0,2|2,0,0]=4 277 B11R1.91 C1=CN=C(N=C1)SCC(=O)O PI-21347 [0,0,0,0,0,2|2,0,0]=4 278 B11R1.91 C1=CN=CC=C1SCC(=O)Cl PI-45977 [0,0,0,0,0,2|2,0,0]=4 279 B11R1.91 CC(=O)NNc1ccccc1 PI-32317 [0,0,0,0,0,2|2,0,0]=4 280 B11R1.91 [O-]C(=O)CNc1ccccc1 PI-17946 [0,0,0,0,0,2|2,0,0]=4