0 B9R1.6 B(C1=CN=CC=C1)(O)O PI-13311 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 C1=C(C=NC=N1)C(=O)O PI-21348 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 C1=CC(=CN=C1)C(=O)Cl PI-18307 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.6 C1=CC(=CN=C1)C(=O)N PI-14591 [0,0,0,0,0,0|0,0,0]=0 4 B9R1.6 C1=CC(=CN=C1)C(=S)N PI-41116 [0,0,0,0,0,0|0,1,0]=1 5 B9R1.6 C1=CC(=NN=C1)C(=O)Cl PI-48417 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 C1=CC=C(C=C1)C(=O)Br PI-46923 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 C1=CC=NC(=C1)C(=O)Cl PI-36884 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 C1=CC=NC(=C1)C(=O)O PI-44932 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 C1=CN=C(C=N1)C(=N)N PI-33861 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 C1=CN=C(N=C1)C(=N)N PI-45842 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.6 C1=CN=CC=C1C(=N)N PI-17542 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 C1=CN=CC=C1C(=N)N PI-36524 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.6 C1=CN=CC=C1C(=O)Cl PI-29544 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.6 C1=CN=CC=C1C(=O)N PI-46036 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.6 C1=CN=CC=C1C(=S)N PI-41117 [0,0,0,0,0,0|2,1,0]=3 16 B9R1.6 C1=CN=NC=C1C(=O)O PI-32630 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 C1=NC=CN=C1C(O)=O PI-14238 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 CC(=O)C1=CC=CC=N1 PI-48516 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 CC(=O)C1=CN=CN=C1 PI-40256 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 CC(=O)C1=NC=CC=N1 PI-42079 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.6 CC(=O)C1=NC=CN=C1 PI-16283 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 CC(=O)c1cccnc1 PI-32250 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.6 CC(=O)c1ccncc1 PI-38297 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.6 CC(C1=CC=CC=C1)N PI-32638 [0,0,0,0,0,0|2,0,1]=3 25 B9R1.6 CC(C1=CN=CN=C1)N PI-43048 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.6 CC(C1=NC=CN=C1)N PI-37121 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.6 CC(c1ccccn1)N PI-38576 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.6 CC(c1ccncc1)N PI-38572 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.6 CN(C1=CC=CC=C1)N PI-29778 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 C[C@@H](C1=CC=CC=C1)O PI-50011 [0,0,0,0,0,0|2,0,2]=4 31 B9R1.6 C[C@@H](N)c1ccccn1 PI-36896 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.6 C[C@@H](c1ccccc1)N PI-11219 [0,0,0,0,0,0|2,0,1]=3 33 B9R1.6 C[C@H](c1ccccc1)N PI-11221 [0,0,0,0,0,0|2,0,1]=3 34 B9R1.6 C[C@H](c1ccccc1)O PI-38963 [0,0,0,0,0,0|2,0,2]=4 35 B9R1.6 C[SiH](c1ccccc1)C PI-39122 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.6 N1=C(N=CC=C1)C(=O)O PI-36489 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.6 N=C(C1=CC=CN=C1)N PI-36525 [0,0,0,0,0,0|1,0,0]=1 38 B9R1.6 N=C(N)C1=CN=CC=C1 PI-30891 [0,0,0,0,0,0|1,0,0]=1 39 B9R1.6 NC(=N)c1ccccc1 PI-30200 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.6 NC(=N)c1ccccn1 PI-30669 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.6 NC(=O)c1cccnc1 PI-12870 [0,0,0,0,0,0|0,0,0]=0 42 B9R1.6 NC(=S)c1ccccc1 PI-29356 [0,0,0,0,0,0|1,1,0]=2 43 B9R1.6 NC(=S)c1cncnc1 PI-36422 [0,0,0,0,0,0|1,1,0]=2 44 B9R1.6 O=[N+](C1=CC=NC=C1)[O-] PI-46824 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.6 OB(O)c1ccccc1 PI-16480 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.6 OB(c1cncnc1)O PI-25045 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.6 OC(=O)c1cccnc1 PI-15824 [0,0,0,0,0,0|1,0,0]=1 48 B9R1.6 OC(=O)c1ccncn1 PI-32629 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.6 [O-]C(=O)c1ccccn1 PI-27190 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.2 BrCC1=CC=CC=C1 PI-36476 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 BrCC1=CN=CN=C1 PI-40551 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 C#CC1=CC=CC=C1 PI-48958 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 C#CC1=CN=CN=C1 PI-35998 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 C1=C(C=NC=N1)CO PI-32945 [1,0,0,0,0,0|1,0,2]=4 55 B8R1.2 C1=C(N=CC=N1)CN PI-42651 [1,0,0,0,0,0|1,0,1]=3 56 B8R1.2 C1=CC(=CN=C1)CCl PI-16717 [1,0,0,0,0,0|1,0,1]=3 57 B8R1.2 C1=CC(=CN=C1)NN PI-39291 [1,0,0,0,0,0|1,0,0]=2 58 B8R1.2 C1=CC=NC(=C1)NN PI-46991 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 C1=CC=NC(=C1)NN PI-50652 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 C1=CN=C(C=N1)NN PI-48275 [1,0,0,0,0,0|2,0,0]=3 61 B8R1.2 C1=CN=C(N=C1)C=O PI-32954 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 C1=CN=CN=C1C=O PI-34868 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 CCC1=NC=CN=C1 PI-11040 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 CNC1=CN=CC=C1 PI-11328 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 COC1=CN=CC=C1 PI-33889 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 COC1=NC=CN=C1 PI-11859 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.2 CSC1=NC=CN=C1 PI-11048 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 ClCC1=CN=CC=N1 PI-39634 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.2 N#Cc1cncnc1 PI-38932 [1,0,0,0,0,0|1,0,2]=4 70 B8R1.2 NCC1=CC=CC=C1 PI-37209 [1,0,0,0,0,0|1,0,1]=3 71 B8R1.2 NCC1=CC=NC=C1 PI-41875 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 NCc1ccccn1 PI-33905 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.2 NCc1cccnc1 PI-15236 [1,0,0,0,0,0|0,0,1]=2 74 B8R1.2 NCc1ccncc1 PI-31790 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.2 NNC1=CC=CC=C1 PI-41551 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.2 O=Cc1ccccn1 PI-33895 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.2 O=Cc1cccnc1 PI-33908 [1,0,0,0,0,0|0,0,0]=1 78 B8R1.2 O=Cc1ccncc1 PI-13140 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.2 OCC1=CC=CN=C1 PI-11019 [1,0,0,0,0,0|0,0,2]=3 80 B8R1.2 ONc1ccccc1 PI-38448 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 [C-]#CC1=CC=CC=C1 PI-48435 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 c1nccnc1C#N PI-11837 [1,0,0,0,0,0|1,0,2]=4 83 B10R1.13 B(C1=CN=C(C=C1)Br)(O)O PI-25364 [0,1,0,0,0,0|2,0,1]=4 84 B10R1.13 B(C1=CN=C(C=C1)C)(O)O PI-44977 [0,1,0,0,0,0|2,0,1]=4 85 B10R1.13 B(C1=CN=C(C=C1)F)(O)O PI-25465 [0,1,0,0,0,0|2,0,1]=4 86 B10R1.13 Brc1ccc(cc1)C(=O)O PI-27741 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.13 Brc1ccc(cc1)S(=O)[O-] PI-30223 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 Brc1ccc(cc1)[N+](=O)[O-] PI-30746 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 Brc1ccc(cn1)C(=O)O PI-10090 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.13 Brc1ccc(cn1)[N+](=O)[O-] PI-10084 [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 Brc1ccc(nc1)C(=O)O PI-10180 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 C1=C(C(=N)N)C=CC(=C1)F PI-38824 [0,1,0,0,0,0|2,0,0]=3 93 B10R1.13 C1=C(C=NC(=N1)N)[N+](=O)[O-] PI-14119 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl PI-23130 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl PI-36543 [0,1,0,0,0,0|2,0,0]=3 96 B10R1.13 C1=CC(=CC=C1C(=N)N)N PI-10167 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.13 C1=CC(=CC=C1C(=N)N)N PI-30927 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.13 C1=CC(=CC=C1C(=O)Cl)F PI-11984 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.13 C1=CC(=CC=C1C(=O)N)Cl PI-30790 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.13 C1=CC(=CC=C1C(=O)N)O PI-20729 [0,1,0,0,0,0|1,0,0]=2 101 B10R1.13 C1=CC(=CC=C1C(=O)O)I PI-12206 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 C1=CC(=CC=C1C(=O)O)S PI-11996 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.13 C1=CC(=CC=C1C(=O)[O-])F PI-28585 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.13 C1=CC(=CC=C1C(=S)N)Br PI-22614 [0,1,0,0,0,0|1,1,0]=3 105 B10R1.13 C1=CC(=CC=C1C(N)=O)F PI-28843 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 C1=CC(=CC=C1F)S(=O)[O-] PI-23445 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] PI-50479 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.13 C1=CC(=CC=C1S(=O)[O-])Cl PI-23131 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 C1=CC(=NC=C1C(=O)N)Cl PI-30802 [0,1,0,0,0,0|0,0,0]=1 110 B10R1.13 C1=CC(=NC=C1C(=O)N)N PI-17748 [0,1,0,0,0,0|0,0,0]=1 111 B10R1.13 C1=CC(=NC=C1C(=O)O)Cl PI-31219 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.13 C1=CC(=NC=C1C(=O)O)F PI-16388 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 C1=CC(=NC=C1C(=O)O)N PI-10089 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N PI-31194 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 C1=CC(=O)NC=C1C(=O)O PI-10378 [0,1,0,0,0,0|1,0,1]=3 116 B10R1.13 C1=CC(=O)NC=C1[N+](=O)[O-] PI-11016 [0,1,0,0,0,0|2,0,1]=4 117 B10R1.13 C1=CC(=O)OC=C1C(=O)O PI-31209 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 C1=C[N+](=CC=C1C(=O)O)[O-] PI-18162 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.13 CC(=O)C1=CC=C(C=C1)Br PI-44871 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 CC(=O)C1=CC=C(C=C1)N PI-29588 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 CC(=O)C1=CN=C(C=C1)N PI-34884 [0,1,0,0,0,0|1,0,0]=2 122 B10R1.13 CC(=O)C1=NC=C(C=C1)Br PI-41220 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.13 CC(=O)c1ccc(cc1)I PI-29117 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.13 CC(C1=CC=C(C=C1)Br)N PI-19358 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 CC(C1=CC=C(C=C1)Cl)N PI-47032 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 CC(C1=CC=C(O)C=C1)=O PI-37424 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.13 CC1=CC=C(C=C1)C(=N)N PI-29803 [0,1,0,0,0,0|2,0,0]=3 128 B10R1.13 CC1=CC=C(C=C1)C(=O)C PI-32267 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl PI-34220 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.13 CC1=CC=C(C=C1)C(=S)N PI-30352 [0,1,0,0,0,0|1,1,0]=3 131 B10R1.13 CC1=NC=C(C=C1)C(=O)C PI-34864 [0,1,0,0,0,0|1,0,0]=2 132 B10R1.13 CC1=NC=C(C=C1)[N+](=O)[O-] PI-24226 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.13 C[C@@H](c1ccc(cc1)Br)N PI-16658 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.13 C[C@@H](c1ccc(cc1)F)N PI-43974 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.13 Cc1ccc(cc1)S(=O)O PI-38460 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.13 Cc1ccc(cn1)C(=O)O PI-16698 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.13 Cc1cnc(cn1)C(=O)O PI-16774 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.13 Cc1ncc(cn1)C(=O)O PI-36501 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 ClC(=O)c1ccc(Cl)cc1 PI-34309 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.13 ClC(=O)c1ccc(cc1)Br PI-11966 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.13 ClC(=O)c1ccc(cc1)C PI-32402 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.13 Clc1ccc(cn1)B(O)O PI-25579 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.13 Clc1ccc(cn1)C(=O)Cl PI-12964 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.13 Clc1ccc(cn1)[N+](=O)[O-] PI-23540 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.13 Clc1ncc(cn1)[N+](=O)[O-] PI-17328 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.13 Fc1ccc(cc1)C(=O)O PI-16490 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 Fc1ccc(cc1)[N+](=O)[O-] PI-33135 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.13 Fc1ccc(cn1)[N+](=O)[O-] PI-34426 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.13 NC(=N)c1ccc(cc1)Cl PI-30146 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.13 NC(=O)c1ccc(cc1)Br PI-30860 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.13 NC(=S)c1ccc(cc1)Cl PI-30378 [0,1,0,0,0,0|1,1,0]=3 152 B10R1.13 NC(=S)c1ccc(cc1)O PI-20877 [0,1,0,0,0,0|1,1,0]=3 153 B10R1.13 Nc1ccc(cc1)C(=O)N PI-38043 [0,1,0,0,0,0|1,0,0]=2 154 B10R1.13 Nc1ccc(nc1)C(=O)N PI-36522 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.13 Nc1ccc(nc1)C(=O)O PI-10173 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.13 O=C(N)C1=CC=C(I)C=C1 PI-41985 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.13 O=C(N)C1=CN=C(C)C=C1 PI-37349 [0,1,0,0,0,0|0,0,0]=1 158 B10R1.13 O=[N+](C1=CN=C(Br)N=C1)[O-] PI-37039 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N PI-41430 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.13 O=[S@](C1=CC=C(C)C=C1)N PI-41427 [0,1,0,0,0,0|2,0,0]=3 161 B10R1.13 OC(=O)c1ccc(nn1)Cl PI-38350 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.13 OC(=O)c1cnc(cn1)Cl PI-38333 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.13 Oc1ccc(cc1)C(=N)N PI-20730 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.13 Oc1ccc(nn1)C(=O)O PI-14659 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.13 Oc1ncc(cn1)[N+](=O)[O-] PI-31942 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.13 Sc1ccc(cc1)[N+](=O)[O-] PI-21365 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.13 [O-]C1=CC=C([N+]([O-])=O)C=C1 PI-37341 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.15 BrCC(=O)c1ccccn1 PI-20524 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.15 BrCC(=O)c1ccncc1 PI-20526 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.15 C1=CC(=CN=C1)C(=NO)N PI-34835 [0,1,0,0,0,0|0,0,1]=2 171 B10R1.15 C1=CC(=CN=C1)C(=O)CBr PI-20525 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.15 C1=CC=C(C=C1)C(=O)C#N PI-11000 [0,1,0,0,0,0|1,0,1]=3 173 B10R1.15 C1=CC=C(C=C1)C(=O)C=O PI-30054 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.15 C1=CC=C(C=C1)C(=O)NO PI-10934 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.15 C1=CC=C(C=C1)C(CN)O PI-30384 [0,1,0,0,0,0|1,0,2]=4 176 B10R1.15 C1=CC=NC(=C1)C(=O)NN PI-50236 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.15 C1=CN=C(C=N1)C(=O)NN PI-35467 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.15 CC(=NO)C1=CC=CC=C1 PI-29764 [0,1,0,0,0,0|2,0,1]=4 179 B10R1.15 CC(C1=CC=CC=C1)NC PI-26776 [0,1,0,0,0,0|2,0,1]=4 180 B10R1.15 CC(CN)C1=CC=CC=C1 PI-10356 [0,1,0,0,0,0|2,0,1]=4 181 B10R1.15 CCC(=O)c1ccncc1 PI-36821 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.15 CCC(C1=CC=CC=C1)N PI-16663 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.15 CCN(C1=CC=CC=C1)N PI-29822 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.15 CC[C@@H](c1ccccc1)N PI-16662 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.15 CNC(=O)c1ccccc1 PI-29765 [0,1,0,0,0,0|1,0,0]=2 186 B10R1.15 COC(=N)C1=CC=CC=C1 PI-19741 [0,1,0,0,0,0|1,0,2]=4 187 B10R1.15 COC(=O)C1=CN=CC=C1 PI-33274 [0,1,0,0,0,0|1,0,0]=2 188 B10R1.15 COC(=O)C1=NC=CN=C1 PI-30782 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.15 COC(=O)c1ccccn1 PI-33273 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.15 C[C@H](CN)c1ccccc1 PI-10355 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.15 NCC(=O)c1ccccc1 PI-29691 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.15 NCC(O)c1ccccc1 PI-17268 [0,1,0,0,0,0|1,0,2]=4 193 B10R1.15 NC[C@H](c1ccccc1)O PI-30721 [0,1,0,0,0,0|1,0,2]=4 194 B10R1.15 NNC(=O)c1cccnc1 PI-18681 [0,1,0,0,0,0|0,0,0]=1 195 B10R1.15 OCC(=O)c1ccccc1 PI-11851 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.15 OC[C@@H](N)c1ccccc1 PI-16634 [0,1,0,0,0,0|1,0,2]=4 197 B10R1.15 OC[C@@H](c1ccccc1)N PI-16633 [0,1,0,0,0,0|1,0,2]=4 198 B10R1.15 O\N=C(/c1ccccc1)\Cl PI-23127 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.15 O\N=C(\c1ccccc1)/N PI-14770 [0,1,0,0,0,0|1,0,1]=3 200 B10R1.28 C1=CC(=CN=C1)C(F)(F)F PI-16950 [0,1,0,0,0,0|2,0,1]=4 201 B10R1.28 C1=CC(=CN=C1)S(=O)(=O)[O-] PI-46992 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.28 C1=CC=C(C=C1)S(=O)(=O)[O-] PI-17596 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.28 CP(=O)(C1=CC=CC=C1)O PI-30611 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.28 CS(=O)(=O)c1ccccc1 PI-24312 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.28 ClS(=O)(=O)c1cccnc1 PI-36817 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.28 ClS(=O)(=O)c1cccnc1 PI-36890 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.28 ClS(=O)(=O)c1nccnc1 PI-36830 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.28 OS(=O)(=O)c1cccnc1 PI-33168 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.61 B(C1=C(N=CC=C1)Br)(O)O PI-25583 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.61 C1=C(C(=NC=N1)N)C(=O)O PI-42082 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.61 C1=C(C(=O)NC=N1)[N+](=O)[O-] PI-21342 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.61 C1=CC(=C(N=C1)Br)C(=O)N PI-34520 [0,1,0,0,0,0|0,0,0]=1 213 B10R1.61 C1=CC(=C(N=C1)Br)C(=O)O PI-28439 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.61 C1=CC(=C(N=C1)Br)[N+](=O)[O-] PI-28253 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.61 C1=CC(=C(N=C1)Cl)C(=O)Cl PI-16729 [0,1,0,0,0,0|1,0,0]=2 216 B10R1.61 C1=CC(=C(N=C1)Cl)C(=O)N PI-24027 [0,1,0,0,0,0|0,0,0]=1 217 B10R1.61 C1=CC(=C(N=C1)N)[N+](=O)[O-] PI-10379 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.61 C1=CC=C(C(=C1)C(=O)N)Br PI-20527 [0,1,0,0,0,0|1,0,0]=2 219 B10R1.61 C1=CC=C(C(=C1)C(=O)N)Cl PI-23128 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.61 C1=CC=C(C(=C1)C(=O)N)F PI-27598 [0,1,0,0,0,0|1,0,0]=2 221 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I PI-18960 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.61 C1=CC=C(C(=C1)C(=O)O)S PI-40146 [0,1,0,0,0,0|2,0,0]=3 223 B10R1.61 C1=CC=C(C(=C1)C(=O)[O-])F PI-28576 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.61 C1=CC=C(C(=C1)C(=S)N)N PI-17294 [0,1,0,0,0,0|1,1,0]=3 225 B10R1.61 C1=CN=C(C(=O)N1)C(=O)[NH-] PI-49791 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.61 C1=CN=CC(=C1Br)C(=O)O PI-42057 [0,1,0,0,0,0|1,0,0]=2 227 B10R1.61 C1=CN=CC(=C1C(=O)O)F PI-34435 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.61 C1=CN=CC(=C1C(=O)O)N PI-33158 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.61 C1=CN=CC(=C1N)[N+](=O)[O-] PI-16571 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.61 C1=CNC(=S)C(=C1)C(=O)O PI-16712 [0,1,0,0,0,0|1,0,1]=3 231 B10R1.61 C1=CNC=C(C1=O)C(=O)O PI-32174 [0,1,0,0,0,0|1,0,1]=3 232 B10R1.61 C1=CNC=C(C1=O)[N+](=O)[O-] PI-12188 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.61 C1=CNC=C(C1=O)[N+](=O)[O-] PI-16572 [0,1,0,0,0,0|2,0,1]=4 234 B10R1.61 CC(=O)C1=C(C=NC=C1)N PI-48174 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.61 CC(=O)C1=CC=CC=C1Br PI-12211 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.61 CC(=O)C1=CC=CC=C1Cl PI-11622 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.61 CC(=O)C1=CC=CC=C1F PI-16975 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.61 CC(=O)C1=CC=CC=C1N PI-29399 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.61 CC(=O)c1ccccc1I PI-29345 [0,1,0,0,0,0|2,0,0]=3 240 B10R1.61 CC(=O)c1ccccc1N PI-11796 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.61 CC1=C(C=CN=C1)C(=O)O PI-48282 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.61 CC1=C(C=NC=C1)C(=O)O PI-48296 [0,1,0,0,0,0|1,0,0]=2 243 B10R1.61 CC1=C(C=NC=C1)[N+](=O)[O-] PI-10377 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.61 CC1=CC=CC=C1C(=O)C PI-12963 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.61 CC1=CC=CC=C1C(=O)Cl PI-34221 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 CC1=NC=CN=C1C(=O)C PI-11038 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.61 ClC(=O)c1ccccc1F PI-11847 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.61 NC(=O)c1nccnc1N PI-38832 [0,1,0,0,0,0|1,0,0]=2 249 B10R1.61 NC(=O)c1nccnc1O PI-38271 [0,1,0,0,0,0|1,0,0]=2 250 B10R1.61 NC(=S)c1ccccc1Br PI-22612 [0,1,0,0,0,0|1,1,0]=3 251 B10R1.61 NC(C1=CC=CC=C1O)=S PI-20875 [0,1,0,0,0,0|1,1,0]=3 252 B10R1.61 O=C(C1=C(Cl)C=NC=C1)O PI-37397 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.61 O=[N+](C1=C(Br)C=CN=C1)[O-] PI-37164 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 O=[N+](C1=CC=CN=C1F)[O-] PI-37086 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.61 OB(c1cccnc1Cl)O PI-25528 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.61 OB(c1cccnc1F)O PI-25252 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.61 OB(c1cnccc1C)O PI-25173 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.61 OC(=O)c1ccccc1F PI-16976 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.61 OC(=O)c1cccnc1Cl PI-31141 [0,1,0,0,0,0|1,0,0]=2 260 B10R1.61 OC(=O)c1cccnc1F PI-16387 [0,1,0,0,0,0|1,0,0]=2 261 B10R1.61 OC(=O)c1cccnc1N PI-31221 [0,1,0,0,0,0|1,0,0]=2 262 B10R1.61 OC(=O)c1cccnc1O PI-16700 [0,1,0,0,0,0|1,0,0]=2 263 B10R1.61 OC(=O)c1ccncc1Br PI-28140 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.61 OC(=O)c1ccncc1I PI-38273 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.61 OC(=O)c1ccncc1N PI-10177 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.61 OC(=O)c1ccncc1O PI-28020 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.61 OC(=O)c1cnccc1Cl PI-24019 [0,1,0,0,0,0|1,0,0]=2 268 B10R1.61 OC(=O)c1cnccc1N PI-10029 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.61 OC(=O)c1ncccc1Br PI-28360 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.61 OC(=O)c1ncccc1Cl PI-34714 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.61 OC(=O)c1ncccc1F PI-34434 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.61 OC(=O)c1ncccc1N PI-14129 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.61 OC(=O)c1ncccc1O PI-16553 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.61 OC(=O)c1nccnc1Cl PI-29423 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.61 OC(=O)c1nccnc1O PI-29323 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.61 [O-][N+](=O)c1ccccc1Cl PI-34106 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.61 [O-][N+](=O)c1ccccc1F PI-33137 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.61 [O-][N+](=O)c1ccccc1S PI-17367 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.61 [O-][N+](=O)c1cccnc1C PI-31380 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.61 [O-][N+](=O)c1cccnc1Cl PI-25662 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.61 [O-][N+](=O)c1cccnc1O PI-10109 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.61 [O-][N+](=O)c1cccnc1S PI-36518 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.61 [O-][N+](=O)c1cnccc1Cl PI-16715 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.61 [O-][N+](=O)c1cnccc1Cl PI-24477 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.113 B(C1=CC(=CN=C1)Br)(O)O PI-25584 [0,1,0,0,0,0|2,0,1]=4 286 B10R1.113 B(C1=CC(=CN=C1)C)(O)O PI-25250 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.113 Brc1cccc(c1)C(=N)N PI-30204 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.113 Brc1cccc(c1)C(=O)Cl PI-11911 [0,1,0,0,0,0|2,0,0]=3 289 B10R1.113 Brc1cccc(c1)C(=O)O PI-12741 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.113 Brc1cccc(c1)C(N)C PI-34608 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.113 Brc1cccc(c1)[C@@H](N)C PI-34607 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.113 Brc1cccc(c1)[N+](=O)[O-] PI-13640 [0,1,0,0,0,0|3,0,0]=4 293 B10R1.113 Brc1cccc(n1)C(=O)O PI-16042 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.113 Brc1nccc(c1)C(=O)O PI-28742 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.113 C1=C(C=NC=C1Br)C(=O)O PI-22834 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.113 C1=C(C=NC=C1Cl)C(=O)O PI-13096 [0,1,0,0,0,0|1,0,0]=2 297 B10R1.113 C1=C(C=NC=C1F)C(=O)O PI-19548 [0,1,0,0,0,0|1,0,0]=2 298 B10R1.113 C1=C(C=NC=C1N)C(=O)O PI-10028 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.113 C1=CC(=CC(=C1)Br)C(=S)N PI-22613 [0,1,0,0,0,0|1,1,0]=3 300 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)Cl PI-12189 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)N PI-23129 [0,1,0,0,0,0|1,0,0]=2 302 B10R1.113 C1=CC(=CC(=C1)Cl)C(=O)O PI-34230 [0,1,0,0,0,0|2,0,0]=3 303 B10R1.113 C1=CC(=CC(=C1)Cl)C(=S)N PI-15665 [0,1,0,0,0,0|1,1,0]=3 304 B10R1.113 C1=CC(=CC(=C1)F)C(=O)Cl PI-12124 [0,1,0,0,0,0|2,0,0]=3 305 B10R1.113 C1=CC(=CC(=C1)F)C(=O)O PI-10427 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.113 C1=CC(=CC(=C1)F)C(=O)[O-] PI-28584 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.113 C1=CC(=C[N+](=C1)[O-])C(=O)N PI-14714 [0,1,0,0,0,0|0,0,1]=2 308 B10R1.113 C1=CC(=C[N+](=C1)[O-])C(=S)N PI-17387 [0,1,0,0,0,0|0,1,1]=3 309 B10R1.113 C1=CC(=NC(=C1)N)C(=O)O PI-24258 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.113 C1=CN=C(C=C1Br)C(=O)O PI-35911 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.113 C1=CN=C(C=C1C(=O)O)Cl PI-16713 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.113 C1=CN=C(C=C1C(=O)O)N PI-28116 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.113 C1=CN=C(C=C1Cl)C(=O)Cl PI-33856 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.113 C1=CN=C(C=C1Cl)C(=O)O PI-34707 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.113 C1=CNC(=CC1=O)C(=O)O PI-34877 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.113 C1=CNC(=O)C=C1C(=O)O PI-28282 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.113 CC(=O)C1=CC(=CC=C1)I PI-29141 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.113 CC(=O)C1=CC(=CN=C1)Br PI-26605 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.113 CC(C1=CC(=CC=C1)F)N PI-34605 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.113 CC(C1=CC(=CC=C1)F)N PI-34606 [0,1,0,0,0,0|2,0,1]=4 321 B10R1.113 CC1=CC(=CC=C1)C(=N)N PI-30283 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.113 CC1=CC(=CC=C1)C(=O)C PI-10859 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.113 CC1=CC(=CC=C1)N(C)N PI-29882 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.113 CC1=CC(=CN=C1)C(=O)O PI-13102 [0,1,0,0,0,0|1,0,0]=2 325 B10R1.113 CC1=NC(=CC=C1)C(=O)O PI-31796 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.113 CC1=NC=CC(C(C)=O)=C1 PI-46770 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)N PI-17447 [0,1,0,0,0,0|0,0,1]=2 328 B10R1.113 C[N+]1=CC=CC(=C1)C(=O)O PI-17996 [0,1,0,0,0,0|1,0,1]=3 329 B10R1.113 C[n+]1cccc(c1)C(=O)[O-] PI-39076 [0,1,0,0,0,0|1,0,1]=3 330 B10R1.113 Clc1cccc(c1)[C@@H](N)C PI-34603 [0,1,0,0,0,0|2,0,1]=4 331 B10R1.113 Clc1cccc(c1)[C@H](N)C PI-34604 [0,1,0,0,0,0|2,0,1]=4 332 B10R1.113 Clc1cccc(n1)C(=O)O PI-10178 [0,1,0,0,0,0|3,0,0]=4 333 B10R1.113 Clc1cncc(c1)B(O)O PI-25937 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.113 Clc1nccc(c1)C(=O)C PI-38296 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.113 Fc1cccc(c1)C(=O)C PI-28549 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.113 Fc1cccc(c1)[N+](=O)[O-] PI-16966 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.113 Fc1cccc(n1)C(=O)O PI-34433 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.113 Fc1nccc(c1)C(=O)O PI-19547 [0,1,0,0,0,0|3,0,0]=4 339 B10R1.113 Ic1cccc(c1)C(=O)O PI-12091 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.113 Ic1nccc(c1)C(=O)O PI-36519 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.113 NC(=O)c1cc(Br)cnc1 PI-30430 [0,1,0,0,0,0|0,0,0]=1 342 B10R1.113 NC(C1=CC=CC(O)=C1)=S PI-20876 [0,1,0,0,0,0|1,1,0]=3 343 B10R1.113 Nc1cccc(c1)C(=O)C PI-32567 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.113 Nc1cccc(c1)C(=O)N PI-30514 [0,1,0,0,0,0|1,0,0]=2 345 B10R1.113 O=C(C1=CC(C)=NC=C1)O PI-36276 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.113 O=C(C1=CC(C=CO1)=O)O PI-40052 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.113 O=C(C1=NC(Cl)=CN=C1)O PI-37167 [0,1,0,0,0,0|2,0,0]=3 348 B10R1.113 O=[N+](C1=CN=CC(Br)=C1)[O-] PI-37100 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.113 OC(=O)c1cc(Cl)nnc1 PI-38264 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.113 OC(=O)c1cccc(O)n1 PI-16038 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.113 Oc1cccc(c1)C(=O)C PI-31363 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.113 Oc1cccc(c1)C(=O)N PI-30785 [0,1,0,0,0,0|1,0,0]=2 353 B10R1.113 Oc1cccc(c1)C(=O)O PI-33399 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] PI-11942 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.113 Oc1cncc(c1)C(=O)O PI-10172 [0,1,0,0,0,0|1,0,0]=2 356 B10R1.113 S=C(N)C1=CC=CC(C)=C1 PI-19344 [0,1,0,0,0,0|1,1,0]=3 357 B10R2.320 C1=CC=CC2=C1CC2=O PI-40938 [0,0,0,1,0,0|2,0,0]=3 358 B8R1.7 C1=C(C=NO1)C(=O)O PI-14897 [0,0,0,0,1,0|2,0,0]=3 359 B8R1.7 C1=C(N=NS1)C(=O)O PI-28513 [0,0,0,0,1,0|3,0,0]=4 360 B8R1.7 C1=C(NC=N1)C(=O)O PI-31349 [0,0,0,0,1,0|2,0,0]=3 361 B8R1.7 C1=C(NC=N1)[N+](=O)[O-] PI-31145 [0,0,0,0,1,0|3,0,0]=4 362 B8R1.7 C1=C(ON=C1)C(=O)Cl PI-29789 [0,0,0,0,1,0|2,0,0]=3 363 B8R1.7 C1=C(SC=N1)C(=O)O PI-25160 [0,0,0,0,1,0|2,0,0]=3 364 B8R1.7 C1=CN=C(N1)C(=O)O PI-40003 [0,0,0,0,1,0|2,0,0]=3 365 B8R1.7 C1=CNC=C1C(=O)O PI-34087 [0,0,0,0,1,0|1,0,1]=3 366 B8R1.7 C1=CNC=C1C(=O)O PI-48299 [0,0,0,0,1,0|1,0,1]=3 367 B8R1.7 C1=COC(=C1)C(=O)N PI-17349 [0,0,0,0,1,0|1,0,0]=2 368 B8R1.7 C1=COC=C1C(=N)N PI-19708 [0,0,0,0,1,0|2,0,0]=3 369 B8R1.7 C1=COC=C1C(=O)Cl PI-46981 [0,0,0,0,1,0|2,0,0]=3 370 B8R1.7 C1=COC=C1C(=O)O PI-16502 [0,0,0,0,1,0|2,0,0]=3 371 B8R1.7 C1=COC=C1C(=S)N PI-19750 [0,0,0,0,1,0|1,1,0]=3 372 B8R1.7 C1=CON=C1C(=O)O PI-48871 [0,0,0,0,1,0|2,0,0]=3 373 B8R1.7 C1=CSC(=C1)C(=N)N PI-29689 [0,0,0,0,1,0|2,0,0]=3 374 B8R1.7 C1=CSC(=C1)C(=O)N PI-50586 [0,0,0,0,1,0|1,0,0]=2 375 B8R1.7 C1=CSC(=C1)C(=O)[O-] PI-11153 [0,0,0,0,1,0|2,0,0]=3 376 B8R1.7 C1=CSC(=C1)[N+](=O)[O-] PI-10995 [0,0,0,0,1,0|3,0,0]=4 377 B8R1.7 C1=CSC(=N1)C(=N)N PI-45383 [0,0,0,0,1,0|2,0,0]=3 378 B8R1.7 C1=CSC(=N1)C(C)=O PI-11117 [0,0,0,0,1,0|2,0,0]=3 379 B8R1.7 C1=N[NH]C=C1[N+]([O-])=O PI-40000 [0,0,0,0,1,0|3,0,0]=4 380 B8R1.7 CC(=O)C1=CC=CN1 PI-12083 [0,0,0,0,1,0|1,0,1]=3 381 B8R1.7 CC(=O)C1=CC=NN1 PI-44747 [0,0,0,0,1,0|2,0,0]=3 382 B8R1.7 CC(=O)C1=CN=CN1 PI-45218 [0,0,0,0,1,0|2,0,0]=3 383 B8R1.7 CC(=O)C1=CN=CN1 PI-45286 [0,0,0,0,1,0|2,0,0]=3 384 B8R1.7 CC(=O)c1cscc1 PI-16499 [0,0,0,0,1,0|2,0,0]=3 385 B8R1.7 CC(=O)n1cncc1 PI-31807 [0,0,0,0,1,0|2,0,0]=3 386 B8R1.7 CC(C1=NC=CN1)=O PI-39737 [0,0,0,0,1,0|2,0,0]=3 387 B8R1.7 CC(N)C1=CC=CS1 PI-40007 [0,0,0,0,1,0|2,0,1]=4 388 B8R1.7 ClC(=O)c1cscc1 PI-10762 [0,0,0,0,1,0|2,0,0]=3 389 B8R1.7 NC(=N)n1cccn1 PI-16548 [0,0,0,0,1,0|2,0,0]=3 390 B8R1.7 NC(=O)c1ncn[nH]1 PI-10146 [0,0,0,0,1,0|2,0,0]=3 391 B8R1.7 NC(=S)c1ccco1 PI-19230 [0,0,0,0,1,0|1,1,0]=3 392 B8R1.7 NC(=S)c1cccs1 PI-39110 [0,0,0,0,1,0|1,1,0]=3 393 B8R1.7 NC(=S)c1cscc1 PI-29381 [0,0,0,0,1,0|1,1,0]=3 394 B8R1.7 OC(=O)C1=CNN=N1 PI-40359 [0,0,0,0,1,0|3,0,0]=4 395 B8R1.7 OC(=O)c1c[nH]nc1 PI-32193 [0,0,0,0,1,0|2,0,0]=3 396 B8R1.7 OC(=O)c1cc[nH]n1 PI-34779 [0,0,0,0,1,0|2,0,0]=3 397 B8R1.7 OC(=O)c1ccc[nH]1 PI-27813 [0,0,0,0,1,0|1,0,1]=3 398 B8R1.7 OC(=O)c1cccs1 PI-38239 [0,0,0,0,1,0|2,0,0]=3 399 B8R1.7 OC(=O)c1ccno1 PI-29335 [0,0,0,0,1,0|2,0,0]=3 400 B8R1.7 OC(=O)c1cocn1 PI-43182 [0,0,0,0,1,0|2,0,0]=3 401 B8R1.7 OC(=O)c1cscc1 PI-10764 [0,0,0,0,1,0|2,0,0]=3 402 B8R1.7 OC(=O)c1cscn1 PI-28011 [0,0,0,0,1,0|2,0,0]=3 403 B8R1.7 OC(=O)c1n[nH]cn1 PI-10407 [0,0,0,0,1,0|3,0,0]=4 404 B8R1.7 [O-][N+](=O)c1cc[nH]n1 PI-36856 [0,0,0,0,1,0|3,0,0]=4 405 B8R1.7 [O-][N+](=O)c1ncc[nH]1 PI-10202 [0,0,0,0,1,0|3,0,0]=4 406 B8R1.7 [O-][N+](=O)n1cccn1 PI-16557 [0,0,0,0,1,0|3,0,0]=4 407 B10R1.18 BrC(=Cc1ccccc1)Br PI-35682 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-13521 [0,0,0,0,0,1|1,0,0]=2 409 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-16758 [0,0,0,0,0,1|1,0,0]=2 410 B10R1.18 C1=CC=C(C=C1)N=C(N)N PI-11304 [0,0,0,0,0,1|2,0,0]=3 411 B10R1.18 C1=CC=C(C=C1)OC(=O)N PI-10948 [0,0,0,0,0,1|1,0,0]=2 412 B10R1.18 C1=CC=NC(=C1)CC(=O)O PI-16725 [0,0,0,0,0,1|3,0,0]=4 413 B10R1.18 C1=CC=[N+](C=C1)CC(=O)N PI-15939 [0,0,0,0,0,1|2,0,0]=3 414 B10R1.18 CC(=CC1=CC=CC=C1)C PI-47118 [0,0,0,0,0,1|3,0,0]=4 415 B10R1.18 CC(=O)CC1=CC=NC=C1 PI-24530 [0,0,0,0,0,1|3,0,0]=4 416 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 PI-17935 [0,0,0,0,0,1|3,0,0]=4 417 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 PI-30609 [0,0,0,0,0,1|3,0,0]=4 418 B10R1.18 CC(CC1=NC=CC=C1)=O PI-41787 [0,0,0,0,0,1|3,0,0]=4 419 B10R1.18 ClC(=S)Oc1ccccc1 PI-13044 [0,0,0,0,0,1|2,1,0]=4 420 B10R1.18 NC(=Nc1ccccc1)N PI-20950 [0,0,0,0,0,1|2,0,0]=3 421 B10R1.18 OC(=O)Cc1cccnc1 PI-28588 [0,0,0,0,0,1|1,0,0]=2 422 B10R1.18 OC(=O)Cc1ccncc1 PI-16726 [0,0,0,0,0,1|3,0,0]=4 423 B10R1.18 OC(=O)Cc1cncnc1 PI-32944 [0,0,0,0,0,1|2,0,0]=3 424 B7R0.4 CC=CC=CC(=O)[O-] PI-15818 [1,0,1,0,0,0|1,0,1]=4 425 B7R1.3 Brc1cccnc1 PI-11914 [2,0,0,0,0,0|1,0,0]=3 426 B7R1.3 Brc1cccnn1 PI-37395 [2,0,0,0,0,0|2,0,0]=4 427 B7R1.3 Brc1ccnnc1 PI-34084 [2,0,0,0,0,0|2,0,0]=4 428 B7R1.3 C1=C(C=NC=N1)Br PI-16276 [2,0,0,0,0,0|2,0,0]=4 429 B7R1.3 C1=C(C=NC=N1)Cl PI-21317 [2,0,0,0,0,0|2,0,0]=4 430 B7R1.3 C1=C(C=NC=N1)F PI-28750 [2,0,0,0,0,0|2,0,0]=4 431 B7R1.3 C1=CC(=CN=C1)I PI-11390 [2,0,0,0,0,0|1,0,0]=3 432 B7R1.3 C1=CC(=CN=C1)O PI-44714 [2,0,0,0,0,0|0,0,1]=3 433 B7R1.3 C1=CC(=CN=C1)[O-] PI-42109 [2,0,0,0,0,0|0,0,1]=3 434 B7R1.3 C1=CC(=O)NC=C1 PI-13304 [2,0,0,0,0,0|2,0,0]=4 435 B7R1.3 C1=CC(=O)NC=C1 PI-49120 [2,0,0,0,0,0|2,0,0]=4 436 B7R1.3 C1=CC(=O)OC=C1 PI-46989 [2,0,0,0,0,0|2,0,0]=4 437 B7R1.3 C1=CC=C(C=C1)[Si] PI-45035 [2,0,0,0,0,0|1,1,0]=4 438 B7R1.3 C1=CN=C(C=N1)Br PI-47341 [2,0,0,0,0,0|2,0,0]=4 439 B7R1.3 C1=CN=C(C=N1)Cl PI-11831 [2,0,0,0,0,0|2,0,0]=4 440 B7R1.3 C1=CN=CC(=S)N1 PI-45037 [2,0,0,0,0,0|1,1,0]=4 441 B7R1.3 C1=COC=CC1=O PI-43972 [2,0,0,0,0,0|2,0,0]=4 442 B7R1.3 CC1=CN=CN=C1 PI-21343 [2,0,0,0,0,0|1,0,1]=4 443 B7R1.3 CC1=CN=NC=C1 PI-31701 [2,0,0,0,0,0|1,0,1]=4 444 B7R1.3 CC1=NC=CN=C1 PI-48495 [2,0,0,0,0,0|1,0,1]=4 445 B7R1.3 ClC1=NN=CC=C1 PI-37010 [2,0,0,0,0,0|2,0,0]=4 446 B7R1.3 Clc1cccnc1 PI-11921 [2,0,0,0,0,0|1,0,0]=3 447 B7R1.3 Fc1cccnc1 PI-16759 [2,0,0,0,0,0|1,0,0]=3 448 B7R1.3 Ic1ccccc1 PI-37973 [2,0,0,0,0,0|2,0,0]=4 449 B7R1.3 Ic1cnccn1 PI-38885 [2,0,0,0,0,0|2,0,0]=4 450 B7R1.3 N[n+]1ccccc1 PI-10984 [2,0,0,0,0,0|2,0,0]=4 451 B7R1.3 Nc1cccnn1 PI-38601 [2,0,0,0,0,0|1,0,0]=3 452 B7R1.3 Nc1ccnnc1 PI-35933 [2,0,0,0,0,0|1,0,0]=3 453 B7R1.3 Nc1cnccn1 PI-29636 [2,0,0,0,0,0|1,0,0]=3 454 B7R1.3 Nc1cncnc1 PI-38883 [2,0,0,0,0,0|1,0,0]=3 455 B7R1.3 O=C1C=CC=NN1 PI-40006 [2,0,0,0,0,0|1,0,0]=3 456 B7R1.3 O=C1C=CNC=C1 PI-33984 [2,0,0,0,0,0|2,0,0]=4 457 B7R1.3 Oc1cncnc1 PI-36495 [2,0,0,0,0,0|1,0,1]=4 458 B7R1.3 [S-]c1ccccc1 PI-17985 [2,0,0,0,0,0|1,1,0]=4 459 B9R1.1 C1=CC(=CC=C1C=O)Cl PI-34386 [1,1,0,0,0,0|1,0,0]=3 460 B9R1.1 C1=CC(=CC=C1C=O)F PI-33068 [1,1,0,0,0,0|1,0,0]=3 461 B9R1.1 C1=CC(=CC=C1CN)Cl PI-11469 [1,1,0,0,0,0|1,0,1]=4 462 B9R1.1 C1=CC(=CC=C1CN)I PI-33700 [1,1,0,0,0,0|1,0,1]=4 463 B9R1.1 C1=CC(=CC=C1CN)O PI-20736 [1,1,0,0,0,0|1,0,1]=4 464 B9R1.1 C1=CC(=CC=C1NN)Br PI-14502 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.1 C1=CC(=CC=C1NN)Br PI-50387 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.1 C1=CC(=CC=C1NN)Br PI-50485 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.1 C1=CC(=CC=C1NN)Cl PI-16438 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.1 C1=CC(=CC=C1NN)Cl PI-50281 [1,1,0,0,0,0|2,0,0]=4 469 B9R1.1 C1=CC(=CC=C1NN)F PI-31312 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.1 C1=CC(=CC=C1NN)I PI-29108 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.1 C1=CC(=NC=C1C#N)Br PI-16041 [1,1,0,0,0,0|0,0,2]=4 472 B9R1.1 C1=CC(=NC=C1C=O)Br PI-35910 [1,1,0,0,0,0|0,0,0]=2 473 B9R1.1 C1=CC(=NC=C1C=O)Cl PI-41221 [1,1,0,0,0,0|0,0,0]=2 474 B9R1.1 C1=CC(=NC=C1CBr)Br PI-50654 [1,1,0,0,0,0|1,0,1]=4 475 B9R1.1 C1=CC(=NC=C1CO)N PI-44054 [1,1,0,0,0,0|0,0,2]=4 476 B9R1.1 C1=CC(=NC=C1O)C=O PI-40986 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.1 C1=CC(=NN=C1NN)Cl PI-20234 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.1 C=Cc1ccc(cc1)Br PI-22599 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.1 C=Cc1ccc(cc1)Cl PI-38314 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.1 C=Cc1ccc(cc1)N PI-17562 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.1 C=Cc1ccc(nc1)C PI-38680 [1,1,0,0,0,0|1,0,0]=3 482 B9R1.1 CC1=CN=C(C=N1)CN PI-48153 [1,1,0,0,0,0|1,0,1]=4 483 B9R1.1 CC1=NC=C(C=C1)C=O PI-48154 [1,1,0,0,0,0|0,0,0]=2 484 B9R1.1 CNC1=CN=C(C=C1)Cl PI-45925 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.1 COC1=CN=C(C=C1)Br PI-45881 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.1 ClCc1ccc(Cl)nc1 PI-10395 [1,1,0,0,0,0|1,0,1]=4 487 B9R1.1 N#Cc1ccc(Cl)nc1 PI-16032 [1,1,0,0,0,0|0,0,2]=4 488 B9R1.1 N#Cc1ccc(N)nc1 PI-28520 [1,1,0,0,0,0|0,0,2]=4 489 B9R1.1 NCc1ccc(F)cc1 PI-11985 [1,1,0,0,0,0|1,0,1]=4 490 B9R1.1 NCc1ccc(cc1)Br PI-20544 [1,1,0,0,0,0|1,0,1]=4 491 B9R1.1 NCc1ccc(cc1)Br PI-38542 [1,1,0,0,0,0|1,0,1]=4 492 B9R1.1 NCc1ccc(nc1)Cl PI-39010 [1,1,0,0,0,0|0,0,1]=3 493 B9R1.1 NNc1ccc(C)cc1 PI-13126 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.1 O=CC1=CC=C(N)N=C1 PI-37351 [1,1,0,0,0,0|0,0,0]=2 495 B9R1.1 O=CC1=NC=C(F)C=C1 PI-37201 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.1 O=Cc1ccc(Br)cc1 PI-12729 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.1 O=Cc1ccc(cc1)I PI-27209 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.1 O=Cc1ccc(cc1)O PI-37802 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.1 O=Cc1cnc(N)nc1 PI-34787 [1,1,0,0,0,0|1,0,0]=3 500 B9R1.1 OCc1ccc(Cl)nc1 PI-16749 [1,1,0,0,0,0|0,0,2]=4 501 B9R1.2 Brc1cc(C=O)ncc1 PI-38308 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.2 C1=C(C=NC=C1Br)C#N PI-21589 [1,1,0,0,0,0|0,0,2]=4 503 B9R1.2 C1=C(C=NC=C1Br)CO PI-47170 [1,1,0,0,0,0|0,0,2]=4 504 B9R1.2 C1=C(C=NC=C1Cl)CO PI-34717 [1,1,0,0,0,0|0,0,2]=4 505 B9R1.2 C1=C(C=NC=C1F)NN PI-48989 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.2 C1=C(C=NC=C1N)C#N PI-36516 [1,1,0,0,0,0|0,0,2]=4 507 B9R1.2 C1=C(N=C(C=N1)Cl)NN PI-50493 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.2 C1=CC(=CC(=C1)Cl)NN PI-29369 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.2 C1=CC(=CC(=C1)F)NN PI-29439 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.2 C1=CC(=CC(=C1)I)C=O PI-27854 [1,1,0,0,0,0|1,0,0]=3 511 B9R1.2 C1=CC(=CC(=C1)N)C=O PI-27126 [1,1,0,0,0,0|1,0,0]=3 512 B9R1.2 C1=CC(=NC(=C1)Br)C=O PI-21494 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.2 C=CC1=CC(=CC=C1)Br PI-22598 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.2 C=Cc1cccc(c1)C PI-40767 [1,1,0,0,0,0|2,0,0]=4 515 B9R1.2 CC1=CC(=CC=C1)C=O PI-11938 [1,1,0,0,0,0|1,0,0]=3 516 B9R1.2 CC1=CC(=CC=C1)CN PI-35861 [1,1,0,0,0,0|1,0,1]=4 517 B9R1.2 CC1=CC(=CN=C1)C=O PI-43924 [1,1,0,0,0,0|0,0,0]=2 518 B9R1.2 CC1=NC(=CC=C1)C=O PI-16691 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.2 COc1cc(Br)cnc1 PI-38259 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.2 COc1cc(N)cnc1 PI-33855 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.2 Clc1cc(C=O)ncc1 PI-39303 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.2 FC1=NC(=CC=C1)C=O PI-39667 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.2 Fc1cc(cnc1)C#N PI-38882 [1,1,0,0,0,0|0,0,2]=4 524 B9R1.2 NCc1cccc(Cl)c1 PI-15673 [1,1,0,0,0,0|1,0,1]=4 525 B9R1.2 NCc1cccc(c1)Br PI-21372 [1,1,0,0,0,0|1,0,1]=4 526 B9R1.2 NCc1cccc(c1)Br PI-38545 [1,1,0,0,0,0|1,0,1]=4 527 B9R1.2 NCc1cccc(c1)F PI-23480 [1,1,0,0,0,0|1,0,1]=4 528 B9R1.2 NNc1cccc(c1)Br PI-29422 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.2 NNc1cccc(c1)C PI-29814 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.2 O=Cc1cccc(c1)Br PI-34503 [1,1,0,0,0,0|1,0,0]=3 531 B9R1.2 O=Cc1cccc(c1)Cl PI-27742 [1,1,0,0,0,0|1,0,0]=3 532 B9R1.2 O=Cc1cccc(c1)F PI-11925 [1,1,0,0,0,0|1,0,0]=3 533 B9R1.2 O=Cc1cccc(c1)N PI-11906 [1,1,0,0,0,0|1,0,0]=3 534 B9R1.2 O=Cc1cccc(c1)O PI-34273 [1,1,0,0,0,0|1,0,0]=3 535 B9R1.2 O=Cc1ccnc(c1)Br PI-27099 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.2 O=Cc1ccnc(c1)Cl PI-31791 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.2 OCC1=CC(N)=CN=C1 PI-35898 [1,1,0,0,0,0|0,0,2]=4 538 B9R1.8 C1=CC(=CN=C1)CCO PI-20772 [1,1,0,0,0,0|0,0,2]=4 539 B9R1.8 C1=CC(=CN=C1)N=C=S PI-43942 [1,1,0,0,0,0|0,1,1]=4 540 B9R1.8 C1=CC=C(C=C1)C=CBr PI-12915 [1,1,0,0,0,0|2,0,0]=4 541 B9R1.8 C1=CC=C(C=C1)CNN PI-12194 [1,1,0,0,0,0|1,0,1]=4 542 B9R1.8 C1=CC=C(C=C1)CNN PI-12195 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.8 C1=CC=C(C=C1)CON PI-48767 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.8 C=CCC1=CC=CC=C1 PI-36465 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.8 CNCC1=CC=CN=C1 PI-46624 [1,1,0,0,0,0|0,0,1]=3 546 B9R1.8 C\C=C\C1=CC=CC=C1 PI-42685 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.8 C\C=C\C1=CC=CC=C1 PI-46536 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.8 N#CCc1cccnc1 PI-32834 [1,1,0,0,0,0|0,0,2]=4 549 B9R1.8 NCCc1cccnc1 PI-23439 [1,1,0,0,0,0|0,0,1]=3 550 B9R1.8 NOCc1ccccc1 PI-11329 [1,1,0,0,0,0|1,0,1]=4 551 B9R1.8 O=C=Nc1cccnc1 PI-38566 [1,1,0,0,0,0|0,0,1]=3 552 B9R1.8 ONCC1=CC=CC=C1 PI-42266 [1,1,0,0,0,0|1,0,1]=4 553 B9R1.15 BrC1=NC=CC=C1C=O PI-39999 [1,1,0,0,0,0|0,0,0]=2 554 B9R1.15 C1=CC(=C(N=C1)C=O)O PI-20863 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.15 C1=CC(=C(N=C1)Cl)C=O PI-34991 [1,1,0,0,0,0|0,0,0]=2 556 B9R1.15 C1=CC(=C(N=C1)Cl)CO PI-33153 [1,1,0,0,0,0|0,0,2]=4 557 B9R1.15 C1=CC(=C(N=C1)F)C=O PI-39564 [1,1,0,0,0,0|0,0,0]=2 558 B9R1.15 C1=CC(=C(N=C1)N)C#N PI-28310 [1,1,0,0,0,0|0,0,2]=4 559 B9R1.15 C1=CC=C(C(=C1)C=O)Br PI-11807 [1,1,0,0,0,0|1,0,0]=3 560 B9R1.15 C1=CC=C(C(=C1)CN)Br PI-11810 [1,1,0,0,0,0|1,0,1]=4 561 B9R1.15 C1=CC=C(C(=C1)CN)Cl PI-11822 [1,1,0,0,0,0|1,0,1]=4 562 B9R1.15 C1=CC=C(C(=C1)CN)F PI-31326 [1,1,0,0,0,0|1,0,1]=4 563 B9R1.15 C1=CC=C(C(=C1)NN)Br PI-11813 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.15 C1=CC=C(C(=C1)NN)Cl PI-29581 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.15 C1=CC=C(C(=C1)NN)F PI-16908 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.15 C1=CC=C(C(=C1)NN)F PI-31140 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.15 C1=CN=C(C(=N1)NN)Cl PI-50492 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.15 C1=CN=CC(=C1C=O)O PI-34863 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.15 C1=CN=CC(=C1Cl)C#N PI-48248 [1,1,0,0,0,0|0,0,2]=4 570 B9R1.15 C1=CN=CC(=C1Cl)CO PI-34716 [1,1,0,0,0,0|0,0,2]=4 571 B9R1.15 C1=CN=CC(=C1N)C=O PI-14094 [1,1,0,0,0,0|0,0,0]=2 572 B9R1.15 C=CC1=CC=CC=C1Br PI-14519 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.15 C=Cc1ccccc1F PI-33746 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.15 CC1=CC=CC=C1C=O PI-27677 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.15 CNc1cccnc1Cl PI-32645 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.15 COC1=C(N=CC=C1)I PI-26982 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.15 COc1cccnc1Br PI-26342 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.15 COc1cccnc1Cl PI-27671 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.15 N#Cc1cccnc1Cl PI-16699 [1,1,0,0,0,0|0,0,2]=4 580 B9R1.15 N#Cc1cccnc1F PI-24385 [1,1,0,0,0,0|0,0,2]=4 581 B9R1.15 N#Cc1cnccc1Br PI-35912 [1,1,0,0,0,0|0,0,2]=4 582 B9R1.15 N#Cc1cnccc1C PI-16376 [1,1,0,0,0,0|0,0,2]=4 583 B9R1.15 NC1=NC=CC=C1OC PI-39996 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.15 NCC1=NC=CN=C1Cl PI-42457 [1,1,0,0,0,0|1,0,1]=4 585 B9R1.15 NCc1ccccc1Br PI-38543 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.15 NNc1ccccc1C PI-29808 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.15 O=CC1=C(Cl)C=CN=C1 PI-37019 [1,1,0,0,0,0|0,0,0]=2 588 B9R1.15 O=CC1=CC=CC=C1I PI-27403 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.15 O=Cc1ccccc1Cl PI-34387 [1,1,0,0,0,0|1,0,0]=3 590 B9R1.15 O=Cc1ccccc1F PI-27600 [1,1,0,0,0,0|1,0,0]=3 591 B9R1.15 O=Cc1cccnc1N PI-15940 [1,1,0,0,0,0|0,0,0]=2 592 B9R1.15 O=Cc1cnccc1Br PI-36813 [1,1,0,0,0,0|0,0,0]=2 593 B9R1.15 OCc1cccnc1N PI-33953 [1,1,0,0,0,0|0,0,2]=4 594 B9R1.11 C1=COC(=C1)C(=NO)N PI-19376 [0,1,0,0,1,0|1,0,1]=4 595 B9R1.11 C1=CSC(=C1)C(=NO)N PI-29669 [0,1,0,0,1,0|1,0,1]=4 596 B9R1.11 C1=CSC(=C1)C(=O)CCl PI-29443 [0,1,0,0,1,0|2,0,0]=4 597 B9R1.11 C1=CSC(=N1)C(=O)CBr PI-45387 [0,1,0,0,1,0|2,0,0]=4 598 B9R1.11 C1=CSC=C1C(=O)CBr PI-29147 [0,1,0,0,1,0|2,0,0]=4 599 B9R1.11 C1=CSC=C1C(=O)NN PI-29542 [0,1,0,0,1,0|1,0,0]=3 600 B9R1.11 C1=NNC(=N1)C(=O)NN PI-28276 [0,1,0,0,1,0|2,0,0]=4 601 B9R1.11 CCC(=O)C1=CC=CS1 PI-32561 [0,1,0,0,1,0|2,0,0]=4 602 B9R1.11 CCC(=O)C1=NC=CS1 PI-48498 [0,1,0,0,1,0|2,0,0]=4 603 B9R1.11 CCC(=O)c1ccco1 PI-17052 [0,1,0,0,1,0|2,0,0]=4 604 B9R1.11 COC(=O)C1=CC=CO1 PI-13054 [0,1,0,0,1,0|2,0,0]=4 605 B9R1.11 COC(=O)C1=CC=NN1 PI-50563 [0,1,0,0,1,0|2,0,0]=4 606 B9R1.11 COC(=O)C1=CN=CN1 PI-40206 [0,1,0,0,1,0|2,0,0]=4 607 B9R1.11 COC(=O)C1=CN=CS1 PI-25162 [0,1,0,0,1,0|2,0,0]=4 608 B9R1.11 COC(=O)C1=COC=C1 PI-19097 [0,1,0,0,1,0|2,0,0]=4 609 B9R1.11 COC(=O)c1cccs1 PI-30692 [0,1,0,0,1,0|2,0,0]=4 610 B9R1.11 NNC(=O)c1ccco1 PI-28398 [0,1,0,0,1,0|1,0,0]=3 611 B9R1.11 NNC(=O)c1cccs1 PI-18375 [0,1,0,0,1,0|1,0,0]=3 612 B9R1.11 O=C(C1=CC=CN1)OC PI-42625 [0,1,0,0,1,0|1,0,1]=4 613 B9R1.11 O=C(C1=CNC=C1)OC PI-46831 [0,1,0,0,1,0|1,0,1]=4 614 B9R1.19 C1=CSC(=C1)S(=O)(=O)N PI-29805 [0,1,0,0,1,0|2,0,0]=4 615 B9R1.35 Brc1scc(c1)C(=O)O PI-35044 [0,1,0,0,1,0|2,0,0]=4 616 B9R1.35 C1=C(N=C(S1)Br)C(=O)O PI-25633 [0,1,0,0,1,0|2,0,0]=4 617 B9R1.35 C1=C(N=C(S1)C(=O)O)Br PI-45389 [0,1,0,0,1,0|2,0,0]=4 618 B9R1.35 C1=C(N=C(S1)N)C(=O)O PI-16258 [0,1,0,0,1,0|2,0,0]=4 619 B9R1.35 C1=C(OC(=C1)Br)C(=O)Cl PI-21496 [0,1,0,0,1,0|2,0,0]=4 620 B9R1.35 C1=C(OC(=C1)Br)C(=O)O PI-21497 [0,1,0,0,1,0|2,0,0]=4 621 B9R1.35 C1=C(OC(=C1)N)C(=O)O PI-19351 [0,1,0,0,1,0|2,0,0]=4 622 B9R1.35 C1=C(SC(=C1)Br)C(=O)Cl PI-45457 [0,1,0,0,1,0|2,0,0]=4 623 B9R1.35 C1=C(SC(=C1)Br)C(=O)N PI-29907 [0,1,0,0,1,0|1,0,0]=3 624 B9R1.35 C1=C(SC(=C1)Br)C(=O)O PI-16448 [0,1,0,0,1,0|2,0,0]=4 625 B9R1.35 C1=C(SC(=C1)Cl)C(=O)O PI-30361 [0,1,0,0,1,0|2,0,0]=4 626 B9R1.35 C1=C(SC(=N1)Br)C(=O)O PI-25655 [0,1,0,0,1,0|2,0,0]=4 627 B9R1.35 C1=C(SC(=N1)C)C(=O)O PI-36606 [0,1,0,0,1,0|2,0,0]=4 628 B9R1.35 C1=C(SC=C1C(=O)N)Br PI-44107 [0,1,0,0,1,0|1,0,0]=3 629 B9R1.35 CC(=O)C1=CC(Br)=CS1 PI-29021 [0,1,0,0,1,0|2,0,0]=4 630 B9R1.35 CC(=O)C1=CC=C(S1)Br PI-16279 [0,1,0,0,1,0|2,0,0]=4 631 B9R1.35 CC(=O)C1=CC=C(S1)I PI-26551 [0,1,0,0,1,0|2,0,0]=4 632 B9R1.35 CC(=O)C1=NC=C(S1)Br PI-43922 [0,1,0,0,1,0|2,0,0]=4 633 B9R1.35 CC(=O)N1C=C(C=N1)I PI-31343 [0,1,0,0,1,0|2,0,0]=4 634 B9R1.35 CC(=O)c1c[nH]c(C)n1 PI-36304 [0,1,0,0,1,0|2,0,0]=4 635 B9R1.35 CC(=O)c1cc(cs1)Cl PI-38201 [0,1,0,0,1,0|2,0,0]=4 636 B9R1.35 CC(C1=CN=C(N)S1)=O PI-46739 [0,1,0,0,1,0|2,0,0]=4 637 B9R1.35 CC1=CC=C(O1)C(=O)Cl PI-19122 [0,1,0,0,1,0|2,0,0]=4 638 B9R1.35 CC1=CC=C(O1)C(=O)O PI-17727 [0,1,0,0,1,0|2,0,0]=4 639 B9R1.35 CC1=CC=C(S1)C(=O)C PI-27153 [0,1,0,0,1,0|2,0,0]=4 640 B9R1.35 CC1=CC=C(S1)C(=O)O PI-11163 [0,1,0,0,1,0|2,0,0]=4 641 B9R1.35 CC1=CSC(=C1)C(=O)O PI-29136 [0,1,0,0,1,0|2,0,0]=4 642 B9R1.35 Cc1cc(no1)C(=O)O PI-36872 [0,1,0,0,1,0|2,0,0]=4 643 B9R1.35 Cc1nc(co1)C(=O)O PI-38605 [0,1,0,0,1,0|2,0,0]=4 644 B9R1.35 Clc1ccc(s1)C(=O)Cl PI-26633 [0,1,0,0,1,0|2,0,0]=4 645 B9R1.35 Cn1cc(nc1)C(=O)O PI-38169 [0,1,0,0,1,0|2,0,0]=4 646 B9R1.35 Cn1ccc(n1)C(=O)O PI-38564 [0,1,0,0,1,0|2,0,0]=4 647 B9R1.35 O=C(C1=CSC(Cl)=C1)O PI-46668 [0,1,0,0,1,0|2,0,0]=4 648 B9R1.35 OC(=O)C1=CC(Br)=CN1 PI-39658 [0,1,0,0,1,0|1,0,1]=4 649 B9R1.35 OC(=O)c1c[nH]c(C)c1 PI-36150 [0,1,0,0,1,0|1,0,1]=4 650 B9R1.35 OC(=O)c1cc(Br)cs1 PI-29188 [0,1,0,0,1,0|2,0,0]=4 651 B9R1.35 OC(=O)c1cc([nH]n1)Cl PI-39269 [0,1,0,0,1,0|2,0,0]=4 652 B9R1.35 OC(=O)c1cc(no1)Br PI-39414 [0,1,0,0,1,0|2,0,0]=4 653 B9R1.35 OC(=O)c1ncc(s1)Br PI-39239 [0,1,0,0,1,0|2,0,0]=4 654 B9R1.41 C1=C(C(=CS1)Br)C(=O)O PI-29187 [0,1,0,0,1,0|2,0,0]=4 655 B9R1.41 C1=CSC(=C1Br)C(=O)Cl PI-29405 [0,1,0,0,1,0|2,0,0]=4 656 B9R1.41 C1=CSC(=C1Br)C(=O)O PI-22617 [0,1,0,0,1,0|2,0,0]=4 657 B9R1.41 C1=CSC(=C1Cl)C(=O)Cl PI-20245 [0,1,0,0,1,0|2,0,0]=4 658 B9R1.41 C1=CSC(=C1Cl)C(=O)N PI-29148 [0,1,0,0,1,0|1,0,0]=3 659 B9R1.41 C1=CSC(=C1Cl)C(=O)O PI-10801 [0,1,0,0,1,0|2,0,0]=4 660 B9R1.41 C1=NC(=C(N1)C(=O)N)N PI-10147 [0,1,0,0,1,0|1,0,0]=3 661 B9R1.41 C1=NC(=C(S1)N)C(=O)N PI-48355 [0,1,0,0,1,0|1,0,0]=3 662 B9R1.41 C1=NNC(=C1C(=O)N)N PI-13039 [0,1,0,0,1,0|1,0,0]=3 663 B9R1.41 C1=NNC(=C1C(=O)N)N PI-35654 [0,1,0,0,1,0|1,0,0]=3 664 B9R1.41 C1=NNC(=C1C(=O)O)N PI-13600 [0,1,0,0,1,0|2,0,0]=4 665 B9R1.41 CC(=O)C1=C(C=CS1)N PI-26559 [0,1,0,0,1,0|2,0,0]=4 666 B9R1.41 CC(=O)C1=CC=CN1C PI-12067 [0,1,0,0,1,0|1,0,1]=4 667 B9R1.41 CC1=C(C=CO1)C(=O)Cl PI-19717 [0,1,0,0,1,0|2,0,0]=4 668 B9R1.41 CC1=C(C=NO1)C(=O)Cl PI-42959 [0,1,0,0,1,0|2,0,0]=4 669 B9R1.41 CC1=C(C=NO1)C(=O)O PI-10238 [0,1,0,0,1,0|2,0,0]=4 670 B9R1.41 CC1=C(OC=C1)C(=O)O PI-17475 [0,1,0,0,1,0|2,0,0]=4 671 B9R1.41 CC1=C(SC=C1)C(=O)C PI-35069 [0,1,0,0,1,0|2,0,0]=4 672 B9R1.41 CC1=C(SC=C1)C(=O)Cl PI-11936 [0,1,0,0,1,0|2,0,0]=4 673 B9R1.41 CC1=C(SC=C1)C(=O)N PI-29912 [0,1,0,0,1,0|1,0,0]=3 674 B9R1.41 CC1=C(SC=C1)C(=O)O PI-11161 [0,1,0,0,1,0|2,0,0]=4 675 B9R1.41 CC1=C(SC=N1)C(=O)O PI-11138 [0,1,0,0,1,0|2,0,0]=4 676 B9R1.41 CN1C=CN=C1C(=O)O PI-45034 [0,1,0,0,1,0|2,0,0]=4 677 B9R1.41 Cn1cncc1C(=O)O PI-35821 [0,1,0,0,1,0|2,0,0]=4 678 B9R1.41 NC(=O)c1[nH]cnc1N PI-31291 [0,1,0,0,1,0|1,0,0]=3 679 B9R1.41 NC(=O)c1nc[nH]c1N PI-36874 [0,1,0,0,1,0|1,0,0]=3 680 B9R1.41 NC(=O)c1sccc1N PI-14136 [0,1,0,0,1,0|1,0,0]=3 681 B9R1.41 O=C(C1=C(Br)SC=C1)O PI-41655 [0,1,0,0,1,0|2,0,0]=4 682 B9R1.41 O=C(C1=C(N)SC=C1)N PI-37067 [0,1,0,0,1,0|1,0,0]=3 683 B9R1.41 OC(=O)c1occc1Br PI-39205 [0,1,0,0,1,0|2,0,0]=4 684 B9R1.41 OC(=O)c1sccc1O PI-36902 [0,1,0,0,1,0|2,0,0]=4 685 B11R1.20 C1=CC(=CC=C1CC(=O)Cl)F PI-28554 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.20 C1=CC(=CC=C1CC(=O)N)O PI-16441 [0,1,0,0,0,1|1,0,0]=3 687 B11R1.20 C1=CC(=CC=C1CC(=O)O)Br PI-12711 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.20 C1=CC(=CC=C1CC(=O)O)Cl PI-32618 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.20 C1=CC(=CC=C1CC(=O)O)N PI-25083 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.20 C1=CC(=CC=C1CC(C)=O)F PI-39618 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.20 C1=CC(=CC=C1N)N=C(N)N PI-47263 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.20 C1=CC(=CC=C1N=C(N)N)I PI-47260 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.20 C1=CC(=CC=C1OC(=O)Cl)Cl PI-18893 [0,1,0,0,0,1|2,0,0]=4 694 B11R1.20 C1=CC(=NC=C1CC(=O)O)Cl PI-32201 [0,1,0,0,0,1|1,0,0]=3 695 B11R1.20 CC(=O)Cc1ccc(cc1)Br PI-38548 [0,1,0,0,0,1|2,0,0]=4 696 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 PI-26690 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.20 CC(=O)NC1=CC=C(C=C1)Br PI-24030 [0,1,0,0,0,1|2,0,0]=4 698 B11R1.20 CC(=O)NC1=CC=C(C=C1)F PI-34152 [0,1,0,0,0,1|2,0,0]=4 699 B11R1.20 CC(=O)NC1=CC=C(C=C1)S PI-26064 [0,1,0,0,0,1|2,0,0]=4 700 B11R1.20 CC(=O)OC1=CC=C(C=C1)F PI-16968 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.20 CC(=O)OC1=CC=C(C=C1)O PI-49042 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.20 CC(=O)Oc1ccc(cc1)Br PI-35155 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.20 CC(=O)SC1=CC=C(C=C1)I PI-35183 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.20 CC(OC1=CC=C(N)C=C1)=O PI-37062 [0,1,0,0,0,1|2,0,0]=4 705 B11R1.20 CC1=CC=C(C=C1)CC(=O)O PI-30795 [0,1,0,0,0,1|2,0,0]=4 706 B11R1.20 CC1=CC=C(C=C1)NC(=O)N PI-24527 [0,1,0,0,0,1|1,0,0]=3 707 B11R1.20 CC1=CC=C(C=C1)NC(=S)N PI-24528 [0,1,0,0,0,1|1,1,0]=4 708 B11R1.20 ClC(=O)Cc1ccc(Br)cc1 PI-22240 [0,1,0,0,0,1|2,0,0]=4 709 B11R1.20 ClC(=O)Cc1ccc(C)cc1 PI-24891 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.20 NC(=S)Nc1ccc(cc1)Br PI-22567 [0,1,0,0,0,1|1,1,0]=4 711 B11R1.20 NC(=S)Nc1ccc(cc1)Cl PI-30541 [0,1,0,0,0,1|1,1,0]=4 712 B11R1.20 NC(=S)Nc1ccc(cc1)O PI-20852 [0,1,0,0,0,1|1,1,0]=4 713 B11R1.20 OC(=O)Cc1ccc(F)cc1 PI-16969 [0,1,0,0,0,1|2,0,0]=4 714 B11R1.20 OC(=O)Cc1ccc(I)cc1 PI-30230 [0,1,0,0,0,1|2,0,0]=4 715 B11R1.20 OC(=O)Cc1ccc(O)cc1 PI-11992 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.20 OC(=O)Cc1ccc(S)cc1 PI-30560 [0,1,0,0,0,1|2,0,0]=4 717 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)Br PI-12709 [0,1,0,0,0,1|2,0,0]=4 718 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)N PI-18442 [0,1,0,0,0,1|2,0,0]=4 719 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)O PI-33913 [0,1,0,0,0,1|2,0,0]=4 720 B11R1.36 C=C(C1=CC=CC=C1)C(=O)O PI-11241 [0,1,0,0,0,1|2,0,0]=4 721 B11R1.36 CC(C(=O)O)c1ccccc1 PI-11879 [0,1,0,0,0,1|2,0,0]=4 722 B11R1.36 CC(C1=CC=CC=C1)C(=O)O PI-10358 [0,1,0,0,0,1|2,0,0]=4 723 B11R1.36 C[C@@H](c1ccccc1)C(=O)O PI-10357 [0,1,0,0,0,1|2,0,0]=4 724 B11R1.36 FC(C(=O)O)c1ccccc1 PI-30175 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.36 N[C@@H](c1ccccc1)C(=O)N PI-37984 [0,1,0,0,0,1|1,0,0]=3 726 B11R1.36 O=C(C(=O)C)c1ccccc1 PI-32566 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.36 O=C(C(=O)O)c1ccccc1 PI-30769 [0,1,0,0,0,1|2,0,0]=4 728 B11R1.36 O[C@@H](C(=O)O)c1ccccc1 PI-10352 [0,1,0,0,0,1|2,0,0]=4 729 B11R1.36 O[C@@H](c1ccccc1)C(=O)O PI-10351 [0,1,0,0,0,1|2,0,0]=4 730 B11R1.40 C1=CC=C(C=C1)C=C(C=O)Br PI-12957 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.40 C1=CC=C(C=C1)CC(=O)NN PI-30983 [0,1,0,0,0,1|1,0,0]=3 732 B11R1.40 C1=CC=C(C=C1)NC(=S)NN PI-29671 [0,1,0,0,0,1|1,1,0]=4 733 B11R1.40 C=CC(OC1=CC=CC=C1)=O PI-41188 [0,1,0,0,0,1|2,0,0]=4 734 B11R1.40 CCC(=O)CC1=CC=CC=C1 PI-47129 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.40 CNC(=S)Nc1ccccc1 PI-24288 [0,1,0,0,0,1|1,1,0]=4 736 B11R1.40 CNC(=S)Nc1ccccc1 PI-30591 [0,1,0,0,0,1|1,1,0]=4 737 B11R1.40 COC(=O)CC1=NC=CN=C1 PI-29522 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.40 ClCC(=O)Nc1ccccc1 PI-15656 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Br PI-14498 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)O PI-10304 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.86 CC(=O)Cc1ccccc1F PI-38595 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.86 CC(=O)NC1=CC=CC=C1Br PI-50525 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.86 CC(=O)NC1=CC=CC=C1F PI-34151 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.86 CC(=O)NC1=CC=CC=C1O PI-11773 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.86 CC(=O)Nc1ccccc1N PI-39094 [0,1,0,0,0,1|2,0,0]=4 746 B11R1.86 CC(=O)OC1=CC=CC=C1Cl PI-10924 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.86 CC1=CC=CC=C1N=C(N)N PI-47265 [0,1,0,0,0,1|2,0,0]=4 748 B11R1.86 CC1=CC=CC=C1NC(=S)N PI-24519 [0,1,0,0,0,1|1,1,0]=4 749 B11R1.86 ClC(=O)Cc1ccccc1C PI-24889 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.86 NC(=S)Nc1ccccc1Br PI-22565 [0,1,0,0,0,1|1,1,0]=4 751 B11R1.86 NC(=S)Nc1ccccc1F PI-29832 [0,1,0,0,0,1|1,1,0]=4 752 B11R1.86 OC(=O)Cc1ccccc1C PI-30825 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.86 OC(=O)Cc1ccccc1Cl PI-11828 [0,1,0,0,0,1|2,0,0]=4 754 B11R1.86 OC(=O)Cc1ccccc1F PI-16981 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.86 OC(=O)Cc1ccccc1I PI-12208 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.157 C1=CC(=CC(=C1)Br)CC(=O)O PI-22281 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.157 C1=CC(=CC(=C1)Cl)CC(=O)O PI-16021 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.157 C1=CC(=CC(=C1)Cl)N=C(N)N PI-47259 [0,1,0,0,0,1|2,0,0]=4 759 B11R1.157 C1=CC(=CC(=C1)I)CC(=O)O PI-30249 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.157 CC(=O)Cc1cccc(c1)Br PI-38558 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br PI-50520 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.157 CC(=O)NC1=CC(=CC=C1)F PI-23433 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.157 CC(=O)NC1=CC=CC(=C1)N PI-17432 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.157 CC(=O)OC1=CC(=CC=C1)F PI-26855 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.157 CC1=CC(=CC=C1)NC(=S)N PI-24525 [0,1,0,0,0,1|1,1,0]=4 766 B11R1.157 NC(=S)Nc1cccc(c1)Br PI-22566 [0,1,0,0,0,1|1,1,0]=4 767 B11R1.157 NC(=S)Nc1cccc(c1)Cl PI-40813 [0,1,0,0,0,1|1,1,0]=4 768 B11R1.157 OC(=O)Cc1cccc(c1)F PI-16930 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.157 OC(=O)Cc1cccc(c1)N PI-31063 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.157 OC(=O)Cc1cccc(c1)O PI-11931 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.509 C1=CC=C(C=C1)OP(=O)(N)N PI-30898 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.509 NS(=O)(=O)Cc1ccccc1 PI-30638 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.3 BrCc1ccc(cc1)C(=O)O PI-11969 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.3 C#CC1=CC=C(C=C1)C(=O)O PI-46517 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.3 C1=CC(=CC=C1C(=O)O)NN PI-11467 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.3 C1=CC(=CC=C1CO)C(=O)O PI-24305 [0,2,0,0,0,0|2,0,0]=4 777 B11R1.3 C1=CC(=NC=C1C(=O)O)NN PI-35028 [0,2,0,0,0,0|1,0,0]=3 778 B11R1.3 C=Cc1ccc(cc1)C(=O)O PI-30056 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N PI-16159 [0,2,0,0,0,0|2,0,0]=4 780 B11R1.3 CC(=O)C1=CC=C(C=C1)C=O PI-27504 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.3 CC(C1=CC=C(SC)C=C1)=O PI-16796 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.3 CCC1=CC=C(C=C1)C(=O)C PI-12886 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.3 CCC1=CC=C(C=C1)C(=O)Cl PI-12125 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.3 CCC1=CC=C(C=C1)C(=O)N PI-30492 [0,2,0,0,0,0|1,0,0]=3 785 B11R1.3 COC1=CC=C(C=C1)C(=O)N PI-10932 [0,2,0,0,0,0|1,0,0]=3 786 B11R1.3 COC1=NC=C(C=C1)C(=S)N PI-26214 [0,2,0,0,0,0|0,1,0]=3 787 B11R1.3 COC1=NC=C(C=C1)[N+](=O)[O-] PI-16710 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.3 COc1ccc(cc1)C(=N)N PI-38826 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.3 COc1ccc(cc1)C(=O)O PI-31764 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.3 COc1ccc(cc1)C(Cl)=O PI-31760 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.3 COc1ccc(cn1)C(=O)O PI-28741 [0,2,0,0,0,0|1,0,0]=3 792 B11R1.3 COc1ncc(nc1)C(=O)O PI-38849 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.3 ClCc1ccc(cc1)C(=O)O PI-16127 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.3 N#Cc1ccc(cc1)C(=O)Cl PI-20292 [0,2,0,0,0,0|2,0,0]=4 795 B11R1.3 NC(=O)C1=CC=C(C=C1)C#N PI-30451 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.3 NCc1ccc(cc1)C(=O)O PI-13119 [0,2,0,0,0,0|2,0,0]=4 797 B11R1.3 O=C(N)C1=CC=C(NN)C=C1 PI-41015 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.3 O=C(O)C1=CC=C(CC)C=C1 PI-10223 [0,2,0,0,0,0|2,0,0]=4 799 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 PI-27393 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.3 O=Cc1ccc(cc1)C(=O)O PI-18766 [0,2,0,0,0,0|2,0,0]=4 801 B11R1.3 OC(=O)c1ccc(cc1)C#N PI-31249 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.19 Brc1ccc(cc1)S(=O)(=O)N PI-38845 [0,2,0,0,0,0|2,0,0]=4 803 B11R1.19 Cc1ccc(cn1)S(=O)(=O)Cl PI-39352 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.19 Fc1ccc(cc1)S(=O)(=O)N PI-10430 [0,2,0,0,0,0|2,0,0]=4 805 B11R1.19 Oc1ccc(cc1)S(=O)(=O)N PI-20732 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.21 C1=C(C(=CC=C1C(=O)O)C)N PI-31125 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.21 C1=C(C(=O)NC=C1C(=O)O)Cl PI-16724 [0,2,0,0,0,0|1,0,1]=4 808 B11R1.21 C1=C(C=NC(=C1Br)Br)[N+](=O)[O-] PI-47241 [0,2,0,0,0,0|2,0,0]=4 809 B11R1.21 C1=C(C=NC(=C1Br)F)C(=O)O PI-36514 [0,2,0,0,0,0|1,0,0]=3 810 B11R1.21 C1=C(C=NC(=C1Cl)Cl)C(=O)O PI-16262 [0,2,0,0,0,0|1,0,0]=3 811 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Br)F PI-14433 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Cl)Cl PI-34219 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Cl)F PI-34234 [0,2,0,0,0,0|2,0,0]=4 814 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)F)F PI-32220 [0,2,0,0,0,0|2,0,0]=4 815 B11R1.21 C1=CC(=C(C=C1C(=O)N)Cl)Cl PI-30402 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.21 C1=CC(=C(C=C1C(=O)N)N)Cl PI-24201 [0,2,0,0,0,0|1,0,0]=3 817 B11R1.21 C1=CC(=C(C=C1C(=O)N)O)O PI-11250 [0,2,0,0,0,0|1,0,0]=3 818 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)O PI-10053 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)F PI-16072 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)N PI-32812 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)O PI-19535 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Br PI-16062 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)N PI-30637 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)O PI-50668 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)F PI-16994 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)F PI-23589 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)I PI-33357 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)N PI-30353 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.21 C1=CC(=C(C=C1C(=S)N)Cl)F PI-17455 [0,2,0,0,0,0|1,1,0]=4 830 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)F PI-43296 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl PI-29417 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F PI-30165 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br PI-12717 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F PI-28452 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.21 CC(=O)c1ccc(Cl)c(C)c1 PI-29523 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.21 CC(=O)c1ccc(F)c(Cl)c1 PI-16917 [0,2,0,0,0,0|2,0,0]=4 837 B11R1.21 CC(=O)c1ccc(c(c1)C)O PI-29955 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O PI-30431 [0,2,0,0,0,0|2,0,0]=4 839 B11R1.21 CC(=O)c1ccc(c(c1)F)O PI-23584 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O PI-29084 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.21 CC1=C(C=C(C=C1)C(=N)N)F PI-23735 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)Br PI-30577 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)O PI-10230 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)C PI-23822 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)F PI-23749 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)C PI-30714 [0,2,0,0,0,0|1,0,0]=3 847 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F PI-23731 [0,2,0,0,0,0|1,0,0]=3 848 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)N PI-30259 [0,2,0,0,0,0|1,0,0]=3 849 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C PI-27799 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F PI-31159 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I PI-31314 [0,2,0,0,0,0|2,0,0]=4 852 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O PI-10215 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.21 CC1=C(C=CC(=C1)C(=O)C)F PI-30538 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.21 CC1=C(C=CC(=C1)C(=O)Cl)F PI-23750 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)Br PI-30206 [0,2,0,0,0,0|1,0,0]=3 856 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)N PI-35808 [0,2,0,0,0,0|1,0,0]=3 857 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br PI-22129 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl PI-31518 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F PI-23746 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O PI-20807 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.21 CC1=CC(=CN=C1Br)[N+](=O)[O-] PI-27363 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.21 CC1=CC(=CN=C1F)[N+](=O)[O-] PI-34428 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.21 CC1=CC(=CN=C1N)[N+](=O)[O-] PI-30236 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.21 ClC(=O)c1ccc(C)c(Br)c1 PI-22136 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.21 NC(=N)c1ccc(c(c1)N)N PI-38924 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.21 O=C(N)C1=CC=C(F)C(C)=C1 PI-23732 [0,2,0,0,0,0|1,0,0]=3 867 B11R1.21 O=C(N)C1=CC=C(F)C(Cl)=C1 PI-20058 [0,2,0,0,0,0|1,0,0]=3 868 B11R1.21 O=C(N)C1=CC=C(F)C(F)=C1 PI-30958 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.21 OC(=O)C1=CC(I)=C(Br)C=C1 PI-39647 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.21 OC(=O)c1ccc(C)c(Cl)c1 PI-30672 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.21 OC(=O)c1ccc(Cl)c(F)c1 PI-16071 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.21 OC(=O)c1ccc(N)c(C)c1 PI-27395 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.21 OC(=O)c1ccc(O)c(N)c1 PI-10926 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.21 OC(=O)c1ccc(O)c(O)c1 PI-20424 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.21 OC(=O)c1ccc(c(c1)Br)C PI-30921 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.21 OC(=O)c1ccc(c(c1)Br)Cl PI-14390 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.21 OC(=O)c1ccc(c(c1)Br)F PI-16063 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.21 OC(=O)c1ccc(c(c1)F)F PI-10196 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.21 OC(=O)c1ccc(c(c1)F)O PI-23588 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.21 OC(=O)c1ccc(c(c1)N)Cl PI-10214 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.21 OC(=O)c1ccc(c(c1)N)N PI-27800 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.21 OC(=O)c1ccc(c(c1)O)Cl PI-19468 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.21 OC(=O)c1ccc(c(c1)S)N PI-27183 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.21 OC(=O)c1cnc(c(c1)Br)C PI-39237 [0,2,0,0,0,0|1,0,0]=3 885 B11R1.21 OC(=O)c1cnc(c(c1)Br)Cl PI-34711 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.21 OC(=O)c1cnc(c(c1)Br)O PI-35284 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.21 OC(=O)c1cnc(c(c1)I)O PI-39189 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.21 [O-][N+](=O)c1cnc(Cl)c(C)c1 PI-16722 [0,2,0,0,0,0|2,0,0]=4 889 B11R1.21 [O-][N+](=O)c1cnc(c(c1)Br)N PI-38917 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.22 BrC1=CC=C(C(CBr)=O)C=N1 PI-41793 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.22 BrCC(=O)c1ccc(F)cc1 PI-16507 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.22 BrCC(=O)c1ccc(cc1)Cl PI-12174 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.22 C1=C(N=CC(=N1)Cl)C(=O)NN PI-50494 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.22 C1=CC(=CC=C1C(=NO)N)Br PI-14454 [0,2,0,0,0,0|1,0,1]=4 895 B11R1.22 C1=CC(=CC=C1C(=NO)N)Cl PI-30654 [0,2,0,0,0,0|1,0,1]=4 896 B11R1.22 C1=CC(=CC=C1C(=NO)N)F PI-23442 [0,2,0,0,0,0|1,0,1]=4 897 B11R1.22 C1=CC(=CC=C1C(=O)C=O)Br PI-41036 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.22 C1=CC(=CC=C1C(=O)C=O)Cl PI-33167 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.22 C1=CC(=CC=C1C(=O)C=O)F PI-41037 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.22 C1=CC(=CC=C1C(=O)CBr)O PI-10322 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.22 C1=CC(=CC=C1C(=O)CCl)F PI-28553 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.22 C1=CC(=CC=C1C(=O)CF)Cl PI-30480 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.22 C1=CC(=CC=C1C(=O)CN)Br PI-29690 [0,2,0,0,0,0|1,0,0]=3 904 B11R1.22 C1=CC(=CC=C1C(=O)CN)Cl PI-16147 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.22 C1=CC(=CC=C1C(=O)CN)F PI-10226 [0,2,0,0,0,0|1,0,0]=3 906 B11R1.22 C1=CC(=CC=C1C(=O)CN)O PI-49411 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.22 C1=CC(=CC=C1C(=O)CO)Br PI-30487 [0,2,0,0,0,0|2,0,0]=4 908 B11R1.22 C1=CC(=CC=C1C(=O)CO)Cl PI-30418 [0,2,0,0,0,0|2,0,0]=4 909 B11R1.22 C1=CC(=CC=C1C(=O)CO)F PI-30583 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br PI-20532 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.22 C1=CC(=CC=C1C(=O)NN)F PI-23456 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.22 C1=CC(=CC=C1C(=O)NN)I PI-50270 [0,2,0,0,0,0|1,0,0]=3 913 B11R1.22 C1=CC(=CC=C1C(=O)NN)N PI-50237 [0,2,0,0,0,0|1,0,0]=3 914 B11R1.22 C1=CC(=CC=C1C(=O)NN)O PI-50238 [0,2,0,0,0,0|1,0,0]=3 915 B11R1.22 C1=CC(=NC=C1C(=O)NN)Cl PI-50259 [0,2,0,0,0,0|0,0,0]=2 916 B11R1.22 C1=CC(=NC=C1C(=O)NN)N PI-36889 [0,2,0,0,0,0|0,0,0]=2 917 B11R1.22 C1=CC(=NC=C1C(OC)=O)Cl PI-16721 [0,2,0,0,0,0|1,0,0]=3 918 B11R1.22 CC1=CC=C(C=C1)C(=NO)N PI-30254 [0,2,0,0,0,0|1,0,1]=4 919 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr PI-27801 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.22 CC1=CC=C(C=C1)C(=O)CN PI-30703 [0,2,0,0,0,0|1,0,0]=3 921 B11R1.22 CC1=CC=C(C=C1)C(=O)NN PI-24359 [0,2,0,0,0,0|1,0,0]=3 922 B11R1.22 CC1=CC=C(C=C1)C(=O)OC PI-50597 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.22 CC1=CN=C(C=N1)C(=O)NN PI-50303 [0,2,0,0,0,0|1,0,0]=3 924 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br PI-12718 [0,2,0,0,0,0|2,0,0]=4 925 B11R1.22 CCC(=O)C1=CC=C(C=C1)N PI-17560 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.22 CNC(=O)c1ccc(cc1)N PI-38046 [0,2,0,0,0,0|1,0,0]=3 927 B11R1.22 COC(=O)C1=CC=C(C=C1)Br PI-11276 [0,2,0,0,0,0|2,0,0]=4 928 B11R1.22 COC(=O)C1=CC=C(C=C1)I PI-18765 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.22 COC(=O)C1=CC=C(C=C1)N PI-12227 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.22 COC(=O)C1=CN=C(C=C1)Br PI-48738 [0,2,0,0,0,0|1,0,0]=3 931 B11R1.22 COC(=O)C1=CN=C(C=N1)Cl PI-35905 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.22 COC(=O)C1=CN=C(N=C1)Cl PI-40861 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.22 COC(=O)c1ccc(=O)oc1 PI-27764 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.22 COC(=O)c1ccc(Cl)cc1 PI-30070 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.22 COC(=O)c1ccc(nc1)C PI-10340 [0,2,0,0,0,0|1,0,0]=3 936 B11R1.22 COC(=O)c1cnc(C)cn1 PI-25000 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.22 NC1=CC=C(C([O-4][K+2])=O)C=C1 PI-50445 [0,2,0,0,0,0|2,0,0]=4 938 B11R1.22 NNC(=O)c1ccc(C)nc1 PI-24807 [0,2,0,0,0,0|0,0,0]=2 939 B11R1.22 NNC(=O)c1ccc(cc1)Cl PI-23138 [0,2,0,0,0,0|1,0,0]=3 940 B11R1.22 O=C(C#N)C1=CC=C(Cl)C=C1 PI-40041 [0,2,0,0,0,0|1,0,1]=4 941 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 PI-16967 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.22 O=C(OC)C1=CN=C(N)C=C1 PI-35070 [0,2,0,0,0,0|1,0,0]=3 943 B11R1.166 Brc1ccc(C(=O)C)c(F)c1 PI-30799 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.166 Brc1ccc(C(=O)O)c(F)c1 PI-16060 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.166 C1=C(C(=CN=C1Cl)[N+](=O)[O-])Cl PI-40868 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.166 C1=C(C(=NC(=C1)Cl)N)[N+](=O)[O-] PI-10388 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.166 C1=C(C(=NC(=N1)Cl)Cl)C(=O)N PI-40260 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.166 C1=CC(=C(C=C1Br)Cl)C(=O)O PI-28671 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.166 C1=CC(=C(C=C1Br)N)C(=O)O PI-18326 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.166 C1=CC(=C(C=C1Br)O)C(=O)O PI-21374 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)N PI-30371 [0,2,0,0,0,0|1,0,0]=3 952 B11R1.166 C1=CC(=C(C=C1Cl)F)C(=O)Cl PI-11845 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)N PI-35500 [0,2,0,0,0,0|1,0,0]=3 954 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O PI-33938 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O PI-16061 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)Cl PI-20069 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)N PI-20057 [0,2,0,0,0,0|1,0,0]=3 958 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)O PI-16103 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)Cl PI-14894 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)N PI-31316 [0,2,0,0,0,0|1,0,0]=3 961 B11R1.166 C1=CC(=C(C=C1F)I)C(=O)O PI-34280 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.166 C1=CC(=C(C=C1N)Cl)C(=O)O PI-10541 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.166 C1=CC(=C(C=C1N)F)C(=O)O PI-27599 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.166 C1=CC(=C(C=C1O)F)C(=O)O PI-28723 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br PI-41212 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.166 CC(=O)C1=C(C)N=C(C)C=N1 PI-11037 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)O PI-43291 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Br PI-20599 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl PI-33128 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O PI-30853 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Br PI-14425 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Cl PI-28768 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)F PI-16939 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)O PI-42987 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)Cl PI-12994 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)F PI-16148 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)N PI-30973 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.166 CC(C1=CC=C(F)C=C1O)=O PI-23585 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)Cl PI-39384 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O PI-10190 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)C PI-12264 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.166 CC1=C(C=CC(=N1)Cl)[N+](=O)[O-] PI-16723 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.166 CC1=C(C=CC(=N1)F)[N+](=O)[O-] PI-34429 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.166 CC1=C(C=CC(=N1)N)[N+](=O)[O-] PI-16707 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)C PI-11718 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.166 CC1=CC(=C(C=C1)C(=O)N)O PI-28583 [0,2,0,0,0,0|1,0,0]=3 987 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C PI-16114 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F PI-18894 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O PI-15312 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])Cl PI-10387 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])F PI-16767 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.166 CC1=CC(=NC=C1[N+](=O)[O-])N PI-16706 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.166 CC1=CC(=O)C(=CN1)C(=O)O PI-13132 [0,2,0,0,0,0|1,0,1]=4 994 B11R1.166 CC1=CC=C(C(=O)N1)C(=O)O PI-18513 [0,2,0,0,0,0|1,0,1]=4 995 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])Br PI-10392 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])Cl PI-34455 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])N PI-16705 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.166 CC1=NC(=NC=C1C(=O)C)N PI-14033 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.166 Cc1ccc(C(=O)O)c(Cl)n1 PI-16720 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O PI-22123 [0,2,0,0,0,0|2,0,0]=4 1001 B11R1.166 Cc1ccc(c(c1)N)C(=O)N PI-30565 [0,2,0,0,0,0|1,0,0]=3 1002 B11R1.166 Cc1ccc(c(c1)N)C(=O)O PI-34285 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.166 Cc1ccc(c(c1)O)C(=O)C PI-29847 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)Cl PI-31177 [0,2,0,0,0,0|1,0,0]=3 1005 B11R1.166 ClC1=CC=C([N+]([O-])=O)C(Br)=N1 PI-46681 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.166 ClC1=NC=C(C(=N1)Cl)C(=O)Cl PI-40259 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.166 Clc1ccc(C(=O)O)c(F)c1 PI-16109 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.166 Clc1ccc(C(=O)O)c(N)c1 PI-14296 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.166 Clc1ccc(C(=S)N)c(Cl)c1 PI-30416 [0,2,0,0,0,0|1,1,0]=4 1010 B11R1.166 Clc1ccc(c(c1)Br)C(=O)O PI-20610 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.166 Fc1ccc(C(=O)O)c(F)c1 PI-10195 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.166 Fc1ccc(C(=O)O)c(N)c1 PI-16067 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.166 Fc1ccc(C(=O)O)c(O)c1 PI-34804 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.166 Ic1ccc(C(=O)O)c(N)c1 PI-35979 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.166 Ic1ccc(c(c1)O)C(=O)C PI-30931 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.166 Nc1ccc(c(c1)C)C(=O)O PI-38300 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.166 O=C(C1=NC=C(Cl)N=C1Cl)N PI-46710 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.166 O=C(O)C1=C(C)N=C(C)C=C1 PI-37311 [0,2,0,0,0,0|1,0,0]=3 1019 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I PI-41942 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.166 OC(=O)c1cnc(cc1Cl)Cl PI-38189 [0,2,0,0,0,0|1,0,0]=3 1021 B11R1.166 Oc1ccc(C(=O)C)c(O)c1 PI-15410 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.166 Oc1ccc(C(=O)O)c(Cl)c1 PI-18689 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.166 Oc1ccc(c(c1)O)C(=O)N PI-10047 [0,2,0,0,0,0|1,0,0]=3 1024 B11R1.166 [O-][N+](=O)c1ccc(Cl)nc1Cl PI-22843 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.166 [O-][N+](=O)c1ccc(nc1C)Br PI-39053 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.166 [O-][N+](=O)c1ccc(nc1C)O PI-39015 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.166 [O-][N+](=O)c1ccc(nc1F)C PI-16768 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.166 [O-][N+](=O)c1cnc(cc1Br)Br PI-39314 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.166 [O-][N+](=O)c1cnc(cc1C)Br PI-10391 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.7 C1=CC(=CN=C1)S(=O)(=O)NN PI-50591 [0,2,0,0,0,0|1,0,0]=3 1031 B11R1.16 C1=CC(=CN=C1)C(=O)NCO PI-10800 [0,2,0,0,0,0|0,0,0]=2 1032 B11R1.16 C1=CC=C(C=C1)C(=O)N=C=O PI-50644 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.16 C=COC(=O)C1=CC=CC=C1 PI-44652 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.16 CCOC(=O)C1=CN=CC=C1 PI-39994 [0,2,0,0,0,0|1,0,0]=3 1035 B11R1.16 CNOC(=O)C1=CC=CC=C1 PI-46922 [0,2,0,0,0,0|1,0,0]=3 1036 B11R1.16 COCC(=O)c1ccccc1 PI-11856 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.16 ClCCC(=O)c1ccccc1 PI-11246 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.16 N#CCC(=O)c1ccccc1 PI-14837 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.16 O=C(OCCl)C1=CC=CC=C1 PI-40036 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.16 O\N=C\C(=O)c1ccccc1 PI-29665 [0,2,0,0,0,0|1,0,1]=4 1041 B11R1.16 S=C=NC(=O)c1ccccc1 PI-14851 [0,2,0,0,0,0|1,0,1]=4 1042 B11R1.23 BrCC(=O)c1cccc(Br)c1 PI-22228 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.23 C1=C(C=CC=C1C(OC)=O)O PI-18286 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.23 C1=C(C=NC=C1Br)C(=O)NN PI-50341 [0,2,0,0,0,0|0,0,0]=2 1045 B11R1.23 C1=CC(=CC(=C1)Br)C(=O)NN PI-20531 [0,2,0,0,0,0|1,0,0]=3 1046 B11R1.23 C1=CC(=CC(=C1)Cl)C(=O)CBr PI-20200 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.23 C1=CC(=CC(=C1)Cl)C(=O)CCl PI-32569 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.23 C1=CC(=CC(=C1)Cl)C(=O)NN PI-23137 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.23 C1=CC(=CC(=C1)F)C(=O)CBr PI-31564 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.23 C1=CC(=CC(=C1)F)C(=O)NN PI-23455 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.23 C1=CC(=CC(=C1)I)C(=O)NN PI-50336 [0,2,0,0,0,0|1,0,0]=3 1052 B11R1.23 C1=CC(=CC(=C1)N)C(=O)NN PI-30136 [0,2,0,0,0,0|1,0,0]=3 1053 B11R1.23 C1=CN=C(C=C1C(=O)NN)N PI-30745 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.23 CC1=CC(=CC=C1)C(=NO)N PI-19541 [0,2,0,0,0,0|1,0,1]=4 1055 B11R1.23 CC1=CC(=CC=C1)C(=O)NN PI-24087 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.23 CC1=CC(=CC=C1)C(=O)OC PI-50285 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.23 CCC(=O)C1=CC(=CC=C1)F PI-28550 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.23 CCC(=O)C1=CC(=CC=C1)O PI-17471 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.23 CCC(=O)c1cccc(c1)Cl PI-13415 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.23 CNC(=O)C1=CC(=CC=C1)N PI-17436 [0,2,0,0,0,0|1,0,0]=3 1061 B11R1.23 CNC(=O)c1cc(Cl)ccn1 PI-35278 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.23 COC(=O)C1=CC(=CC=C1)Br PI-29779 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.23 COC(=O)C1=CC(=CC=C1)Cl PI-14890 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.23 COC(=O)C1=CC(=CC=C1)F PI-34142 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.23 COC(=O)C1=CN=CC(=N1)Br PI-50062 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.23 COC(=O)c1cccc(c1)N PI-10944 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.23 COC(=O)c1cncc(Br)c1 PI-22189 [0,2,0,0,0,0|1,0,0]=3 1068 B11R1.23 COC(=O)c1cnnc(c1)Cl PI-38433 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 PI-41906 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.222 BrCC(=O)c1ccccc1Br PI-31567 [0,2,0,0,0,0|2,0,0]=4 1071 B11R1.222 BrCC(=O)c1ccccc1Cl PI-20199 [0,2,0,0,0,0|2,0,0]=4 1072 B11R1.222 BrCC(=O)c1ccccc1F PI-17348 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.222 BrCC(=O)c1ccccc1O PI-31566 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.222 C1=CC(=C(N=C1)N)C(=O)NN PI-50253 [0,2,0,0,0,0|0,0,0]=2 1075 B11R1.222 C1=CC=C(C(=C1)C(=O)NN)Br PI-50495 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.222 C1=CC=C(C(=C1)C(=O)NN)F PI-23454 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.222 C1=CC=C(C(=C1)C(=O)NN)N PI-30252 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.222 C1=CC=C(C(=C1)C(=O)NN)O PI-29980 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.222 C1=CN=C(C(=N1)C(=O)NN)N PI-50451 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.222 CC1=C(C=CC=N1)C(=O)OC PI-13128 [0,2,0,0,0,0|1,0,0]=3 1081 B11R1.222 CC1=CC=CC=C1C(=O)CBr PI-31565 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.222 CC1=CC=CC=C1C(=O)NN PI-24611 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.222 CCC(=O)C1=CC=CC=C1F PI-16905 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.222 CCC(=O)c1ccccc1O PI-15452 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.222 COC(=O)C1=C(C=CN=C1)N PI-33897 [0,2,0,0,0,0|1,0,0]=3 1086 B11R1.222 COC(=O)C1=C(N=CC=C1)Cl PI-24397 [0,2,0,0,0,0|1,0,0]=3 1087 B11R1.222 COC(=O)C1=C(N=CC=C1)N PI-35287 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.222 COC(=O)C1=CC=CC=C1Br PI-50462 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.222 COC(=O)C1=CC=CC=C1Cl PI-34231 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.222 COC(=O)C1=CC=CC=C1F PI-34134 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.222 COC(=O)C1=CC=CC=C1S PI-50244 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.222 COC(=O)C1=NC=CN=C1N PI-10107 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.222 COC(=O)c1ccccc1I PI-10942 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.222 COC(=O)c1nccnc1Cl PI-38428 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.222 O=C(C1=CC=CNC1=O)OC PI-40201 [0,2,0,0,0,0|1,0,1]=4 1096 B11R1.222 OC1=NC=CN=C1C(=O)OC PI-40997 [0,2,0,0,0,0|2,0,0]=4 1097 B11R1.222 ONC(=O)c1ccccc1O PI-31365 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.87 C1=CC=C(C(=C1)F)S(=O)(=O)N PI-23446 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.87 C1=CC=C(C(=C1)S(=O)(=O)N)Cl PI-23132 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.87 Clc1ccncc1S(=O)(=O)N PI-12776 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.87 Nc1ccccc1S(=O)(=O)N PI-30481 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.87 O=S(C1=CC=CC=C1Br)(N)=O PI-14384 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.155 C1=CC(=CC(=C1)S(=O)(=O)N)F PI-23447 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.155 O=S(C1=CC(F)=CN=C1)(Cl)=O PI-37000 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.155 O=S(C1=CC=CC(Br)=C1)(N)=O PI-35263 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.53 C#CC1=CC=CC=C1C(=O)O PI-46516 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.53 C1=CC=C(C(=C1)C#N)C(=O)N PI-30209 [0,2,0,0,0,0|1,0,0]=3 1108 B11R1.53 C1=CC=C(C(=C1)C#N)C(=O)O PI-10222 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.53 C1=CC=C(C(=C1)CCl)C(=O)Cl PI-46932 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O PI-32625 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.53 CC(=O)C1=CC=CC=C1C#N PI-30977 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.53 CCC1=NC=CN=C1C(=O)C PI-11774 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.53 CNC1=CC=CC=C1C(=O)N PI-30904 [0,2,0,0,0,0|1,0,0]=3 1114 B11R1.53 CNC1=CC=CC=C1C(=O)O PI-50482 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.53 COC1=C(C=CC=N1)[N+](=O)[O-] PI-40023 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] PI-24318 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.53 COC1=C(C=NC=C1)[N+](=O)[O-] PI-29475 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.53 COC1=CC=CC=C1C(=O)N PI-30368 [0,2,0,0,0,0|1,0,0]=3 1119 B11R1.53 COC1=NC=NC=C1C(=O)O PI-45147 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.53 COc1ccccc1C(=O)C PI-12757 [0,2,0,0,0,0|2,0,0]=4 1121 B11R1.53 COc1ccccc1C(=O)Cl PI-11858 [0,2,0,0,0,0|2,0,0]=4 1122 B11R1.53 COc1ncccc1C(=O)O PI-16704 [0,2,0,0,0,0|1,0,0]=3 1123 B11R1.53 CSC1=C(C=CC=N1)C(=O)Cl PI-30995 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.53 NNc1ccccc1C(=O)O PI-18621 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.53 O=Cc1ccccc1C(=O)O PI-36784 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.156 C1=CC(=C(C(=C1)Br)C(=O)O)N PI-36015 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)Cl)Cl PI-11762 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)Cl)F PI-30935 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)N)Cl PI-33780 [0,2,0,0,0,0|1,0,0]=3 1130 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)N)F PI-28735 [0,2,0,0,0,0|1,0,0]=3 1131 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)F PI-16105 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.156 C1=CC(=C(C(=C1)Cl)C(=O)O)N PI-10860 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)Cl)F PI-32221 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)N)F PI-16897 [0,2,0,0,0,0|1,0,0]=3 1135 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)N)N PI-15919 [0,2,0,0,0,0|1,0,0]=3 1136 B11R1.156 C1=CC(=C(C(=C1)F)C(=O)O)O PI-34340 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.156 C1=CC(=C(C(=C1)I)C(=O)O)F PI-34284 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.156 C1=CC(=C(C(=C1)O)C(=O)N)O PI-30464 [0,2,0,0,0,0|1,0,0]=3 1139 B11R1.156 CC(=O)c1c(Cl)cccc1Cl PI-20998 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.156 CC(=O)c1c(F)cccc1Cl PI-20054 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.156 CC(=O)c1c(F)cccc1F PI-31057 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.156 CC(=O)c1c(O)cccc1O PI-11029 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)C PI-30312 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.156 CC1=C(C(=CC=C1)C)C(=O)O PI-27811 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.156 CC1=C(C(=CC=C1)Cl)C(=O)N PI-30032 [0,2,0,0,0,0|1,0,0]=3 1146 B11R1.156 CC1=C(C(=NC=C1)N)[N+](=O)[O-] PI-23435 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.156 CC1=C(C(=NC=N1)C)C(=O)O PI-35013 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.156 CC1=NC=CC(=C1[N+](=O)[O-])Cl PI-43298 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.156 ClC(=O)c1c(Cl)cccc1Br PI-20619 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.156 OC(=O)c1c(C)cccc1Cl PI-11820 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.156 OC(=O)c1c(C)cccc1F PI-10193 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.156 OC(=O)c1c(C)cccc1N PI-18553 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.156 OC(=O)c1c(Cl)cccc1Br PI-20612 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.156 OC(=O)c1c(Cl)cccc1Cl PI-14298 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.156 OC(=O)c1c(Cl)ncnc1Cl PI-38834 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.156 OC(=O)c1c(F)cccc1Br PI-10187 [0,2,0,0,0,0|2,0,0]=4 1157 B11R1.156 OC(=O)c1c(F)cccc1F PI-31178 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.156 OC(=O)c1c(N)cccc1F PI-16068 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.156 OC(=O)c1c(N)cccc1I PI-36088 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.156 OC(=O)c1c(O)cccc1O PI-32768 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.156 [O-][N+](=O)c1c(C)ccnc1Cl PI-10386 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.156 [O-][N+](=O)c1c(Cl)ccnc1N PI-36449 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.156 [O-][N+](=O)c1c(N)ccnc1Cl PI-39438 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.159 C1=CC(=C(C(=C1)Br)N)C(=O)O PI-27326 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.159 C1=CC(=C(C(=C1)Cl)Cl)C(=O)Cl PI-11727 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.159 C1=CC(=C(C(=C1)Cl)Cl)C(=S)N PI-30957 [0,2,0,0,0,0|1,1,0]=4 1167 B11R1.159 C1=CC(=C(C(=C1)Cl)F)C(=O)Cl PI-20070 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.159 C1=CC(=C(C(=C1)Cl)F)C(=O)O PI-16070 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.159 C1=CC(=C(C(=C1)F)Cl)C(=O)O PI-18055 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.159 C1=CC(=C(C(=C1)F)F)C(=O)Cl PI-21145 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.159 C1=CC(=C(C(=C1)F)F)C(=O)N PI-21125 [0,2,0,0,0,0|1,0,0]=3 1172 B11R1.159 C1=CC(=C(C(=C1)F)F)C(=O)O PI-10290 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.159 C1=CC(=C(C(=C1)F)N)C(=O)O PI-10452 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.159 C1=CC(=C(C(=C1)N)F)C(=O)O PI-34457 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.159 C1=CC(=C(C(=C1)N)N)C(=O)N PI-48121 [0,2,0,0,0,0|1,0,0]=3 1176 B11R1.159 C1=CC(=C(C(=C1)N)N)C(=O)O PI-39985 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.159 C1=CC(=C(C(=C1)N)O)C(=O)O PI-14096 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.159 C1=CC(=C(C(=C1)O)O)C(=O)O PI-16110 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.159 CC(=O)C1=C(C(=CC=C1)Cl)Cl PI-20997 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.159 CC(=O)C1=C(C(=CC=C1)N)O PI-10229 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)O PI-30124 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.159 CC(=O)c1cccc(Br)c1F PI-34270 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.159 CC(=O)c1cccc(c1F)F PI-21122 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.159 CC(=O)c1cccc(c1O)N PI-39350 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O PI-41897 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O PI-29482 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.159 CC1=C(C(=CC=C1)C(=O)C)C PI-30311 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.159 CC1=C(C(=CC=C1)C(=O)Cl)C PI-21939 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)C PI-27770 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)Cl PI-31520 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)F PI-10191 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)N PI-10074 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.159 CC1=C(C=CC=C1Br)C(=O)O PI-22125 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.159 CC1=C(C=CC=C1O)C(=O)O PI-11926 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.159 ClC(=O)c1cccc(c1C)Br PI-39385 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.159 NC(=O)c1cccc(c1F)Cl PI-30045 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.159 O=C(N)C1=CC=CC(C)=C1C PI-30715 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.159 O=C(O)C1=CC=CC(N)=C1C PI-16107 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.159 O=[N+](C1=CN=CC(Br)=C1Cl)[O-] PI-37203 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.159 OC(=O)c1cccc(C)c1Br PI-22122 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.159 OC(=O)c1cccc(Cl)c1N PI-10209 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.159 OC(=O)c1cccc(F)c1C PI-10192 [0,2,0,0,0,0|2,0,0]=4 1203 B11R1.159 OC(=O)c1cccc(I)c1N PI-35980 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.159 OC(=O)c1cccc(O)c1N PI-30706 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.159 OC(=O)c1cccc(c1Br)F PI-10189 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.159 OC(=O)c1cccc(c1F)Br PI-10188 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.159 OC(=O)c1cccc(c1O)F PI-23590 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.167 Brc1ccc(Cl)c(c1)C(=O)Cl PI-20620 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.167 Brc1ccc(I)c(c1)C(=O)O PI-21527 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.167 Brc1ccc(c(c1)C(=O)Cl)C PI-39383 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.167 Brc1ccc(c(c1)C(=O)O)Br PI-27786 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.167 Brc1ccc(c(c1)C(=O)O)Cl PI-28277 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.167 Brc1ccc(c(c1)C(=O)O)F PI-16059 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.167 Brc1cnc(N)c(c1)C(=O)O PI-22190 [0,2,0,0,0,0|1,0,0]=3 1215 B11R1.167 Brc1cnc(c(n1)C(=O)N)N PI-38833 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.167 C1=C(C(=NN=C1Cl)Cl)C(=O)O PI-41119 [0,2,0,0,0,0|2,0,0]=4 1217 B11R1.167 C1=C(C(=O)NC=C1Br)C(=O)O PI-12916 [0,2,0,0,0,0|1,0,1]=4 1218 B11R1.167 C1=C(C(=O)NC=C1Cl)C(=O)O PI-30553 [0,2,0,0,0,0|1,0,1]=4 1219 B11R1.167 C1=C(C=NC(=C1C(=O)O)Cl)Br PI-24300 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])Br)Br PI-47235 [0,2,0,0,0,0|2,0,0]=4 1221 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])Cl)Br PI-34472 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])Cl)Cl PI-35813 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])N)Br PI-28755 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])N)Cl PI-16043 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.167 C1=C(C=NC(=C1[N+](=O)[O-])N)Cl PI-31794 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.167 C1=C(Cl)C=CC(=C1C(N)=O)O PI-12030 [0,2,0,0,0,0|1,0,0]=3 1227 B11R1.167 C1=C(N=C(C(=N1)Br)C(=O)O)Br PI-45629 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.167 C1=C(N=C(C(=N1)N)C(=O)O)Br PI-41222 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)N PI-16097 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.167 C1=CC(=C(C=C1Br)C(=O)O)S PI-44100 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)Cl)F PI-28486 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)N)Cl PI-30757 [0,2,0,0,0,0|1,0,0]=3 1233 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)N)N PI-30674 [0,2,0,0,0,0|1,0,0]=3 1234 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Br PI-20611 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)Cl PI-16113 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)F PI-28487 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.167 C1=CC(=C(C=C1Cl)C(=O)O)O PI-33939 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.167 C1=CC(=C(C=C1F)C(=O)Cl)Br PI-28051 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.167 C1=CC(=C(C=C1F)C(=O)Cl)Cl PI-34138 [0,2,0,0,0,0|2,0,0]=4 1240 B11R1.167 C1=CC(=C(C=C1F)C(=O)N)Cl PI-28878 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.167 C1=CC(=C(C=C1F)C(=O)N)F PI-21126 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.167 C1=CC(=C(C=C1F)C(=O)N)N PI-31251 [0,2,0,0,0,0|1,0,0]=3 1243 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)Br PI-16102 [0,2,0,0,0,0|2,0,0]=4 1244 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)O PI-28413 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)Cl PI-44655 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)F PI-18130 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.167 C1=CC(=C(C=C1N)C(=O)O)F PI-16066 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.167 C1=CC(=C(C=C1N)C(=O)O)O PI-33946 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)F PI-40483 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)N PI-50076 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)O PI-15407 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)O PI-11257 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)F PI-28256 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)O PI-16161 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)Cl PI-31000 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.167 CC(=O)C1=C(N=CC(=C1)Br)F PI-48367 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.167 CC(C1=CC(F)=CC=C1I)=O PI-41210 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.167 CC(C1=CC(F)=CC=C1N)=O PI-46722 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O PI-31513 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)Cl PI-23751 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)N PI-23733 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.167 CC1=C(C=C(C=C1)I)C(=O)O PI-35497 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.167 CC1=C(C=C(C=N1)Br)[N+](=O)[O-] PI-42988 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.167 CC1=CC(=C(C=C1)Br)C(=O)O PI-22124 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)C PI-23365 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)O PI-16116 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.167 CC1=CC(=C(C=C1)Cl)C(=O)O PI-44945 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)C PI-30627 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O PI-10194 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O PI-44708 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)N PI-11516 [0,2,0,0,0,0|1,0,0]=3 1272 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)C PI-16152 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)N PI-32434 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)O PI-12037 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.167 CC1=CC(=C(N=C1)Cl)[N+](=O)[O-] PI-34983 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.167 CC1=CC(=C(N=C1)F)[N+](=O)[O-] PI-34427 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.167 CC1=CC(=C(N=C1)N)[N+](=O)[O-] PI-34453 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.167 Cc1ccc(c(c1)C(=O)O)I PI-44956 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.167 Cc1ccc(c(c1)C(=O)O)N PI-11791 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.167 Clc1ccc(c(c1)C(=O)C)Cl PI-11720 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.167 Clc1ccc(c(c1)C(=O)Cl)Cl PI-12081 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.167 Fc1ccc(Cl)c(c1)C(=O)C PI-29442 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.167 Fc1ccc(F)c(c1)C(=O)O PI-16919 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.167 Fc1ccc(I)c(c1)C(=O)O PI-34282 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.167 Fc1ccc(c(c1)C(=O)Cl)F PI-28434 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.167 Fc1ccc(c(c1)C(=O)O)C PI-16069 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.167 Fc1ccc(c(c1)C(=O)O)N PI-16065 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.167 Ic1ccc(N)c(c1)C(=O)O PI-16099 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.167 Ic1ccc(c(c1)C(=O)O)Br PI-21526 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.167 Ic1cnc(c(c1)[N+](=O)[O-])N PI-14241 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.167 NC1=CC(C(O)=O)=C(N)C=C1 PI-31741 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.167 Nc1ccc(O)cc1C(O)=O PI-10210 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.167 Nc1ccc(c(c1)C(=O)O)Br PI-33365 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.167 Nc1ccc(c(c1)C(=O)O)Cl PI-27966 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.167 O=C(N)C1=CC(Br)=CC=C1O PI-30813 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.167 O=C(O)C1=CC(F)=CC=C1Cl PI-16104 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.167 O=C([O-])C1=CC(N)=CC=C1O PI-35671 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.167 O=C([O-])C1=CC(O)=CC=C1O PI-12846 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.167 Oc1ccc(O)c(c1)C(=O)C PI-31206 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.167 Oc1ccc(c(c1)C(=O)O)F PI-23587 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.167 Oc1ccc(c(c1)C(=O)O)O PI-12845 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.74 C1=C(C=C(C=C1Br)Br)C(=O)N PI-20958 [0,2,0,0,0,0|1,0,0]=3 1303 B11R1.74 C1=C(C=C(C=C1Br)I)C(=O)O PI-21371 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=N)N PI-30342 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=O)Cl PI-11893 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=O)N PI-21002 [0,2,0,0,0,0|1,0,0]=3 1307 B11R1.74 C1=C(C=C(C=C1Cl)Cl)C(=O)O PI-11891 [0,2,0,0,0,0|2,0,0]=4 1308 B11R1.74 C1=C(C=C(C=C1F)Br)C(=O)O PI-16064 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)Cl PI-31045 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)N PI-21127 [0,2,0,0,0,0|1,0,0]=3 1311 B11R1.74 C1=C(C=C(C=C1N)N)C(=O)O PI-33050 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.74 C1=C(C=C(C=C1O)Br)C(=O)O PI-47172 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.74 C1=C(C=C(C=C1O)Cl)C(=O)O PI-47171 [0,2,0,0,0,0|2,0,0]=4 1314 B11R1.74 CC(=O)C1=CC(=CC(=C1)Br)Br PI-40368 [0,2,0,0,0,0|2,0,0]=4 1315 B11R1.74 CC(=O)C1=CC(=CC(=C1)Cl)Cl PI-29140 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.74 CC(C1=CC(F)=CC(F)=C1)=O PI-16883 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.74 CC(C1=CC(O)=CC(O)=C1)=O PI-11032 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.74 Cc1cc(C)cc(c1)C(=O)C PI-30691 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.74 Cc1cc(C)cc(c1)C(=O)O PI-31207 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.74 Cc1cc(F)cc(c1)C(=O)O PI-34459 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.74 Cc1cc(O)cc(c1)C(=O)O PI-39027 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.74 Clc1cc(Br)cc(c1)C(=O)O PI-35805 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.74 Fc1cc(F)cc(c1)C(=O)O PI-10428 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.74 Ic1cc(I)cc(c1)C(=O)O PI-36327 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.74 OC(=O)c1cc(Br)cc(c1)Br PI-20961 [0,2,0,0,0,0|2,0,0]=4 1326 B11R1.74 Oc1cc(O)cc(c1)C(=O)O PI-33401 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.266 C1=CC(=CC(=C1)C(=N)N)C=O PI-30727 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.266 C1=CC(=CC(=C1)C(=O)Cl)CCl PI-35901 [0,2,0,0,0,0|2,0,0]=4 1329 B11R1.266 C1=CC(=CC(=C1)C(=O)O)C#N PI-16124 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.266 C1=CC(=CC(=C1)C(=O)O)CCl PI-27471 [0,2,0,0,0,0|2,0,0]=4 1331 B11R1.266 C1=CC(=CC(=C1)C(=O)O)CN PI-30963 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.266 C1=CC(=CC(=C1)C(=O)O)CN PI-33743 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.266 CC(=O)C1=CC(=CC=C1)OC PI-44646 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.266 CC(=O)C1=CC=CC(=C1)CCl PI-16155 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.266 CCC1=CC(=CC=C1)C(=O)C PI-22041 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.266 COC1=CC(=NC=C1)C(=O)N PI-26971 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.266 COC1=CC=CC(=C1)C(=O)Cl PI-50560 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.266 COC1=CC=CC(=C1)C(=O)O PI-33400 [0,2,0,0,0,0|2,0,0]=4 1339 B11R1.266 COC1=CN=CC(=C1)C(=O)O PI-39997 [0,2,0,0,0,0|1,0,0]=3 1340 B11R1.266 COc1cccc(c1)C(=O)N PI-30738 [0,2,0,0,0,0|1,0,0]=3 1341 B11R1.266 N#Cc1cccc(c1)C(=O)C PI-29763 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.266 NCc1cccc(c1)C(=O)N PI-38245 [0,2,0,0,0,0|1,0,0]=3 1343 B11R1.266 O=Cc1cccc(c1)C(=O)O PI-31248 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.266 OCC1=CC=CC(=C1)C(O)=O PI-42488 [0,2,0,0,0,0|2,0,0]=4 1345 B9R1.69 CC1=NC=C(C(=O)N1)I PI-47320 [0,0,1,1,0,0|1,0,1]=4 1346 B11R2.10 C1=CC2=C(NC(=O)O2)N=C1 PI-13499 [0,0,0,1,0,1|0,0,0]=2 1347 B11R2.10 C1=CC=C2C(=C1)N=C(S2)N PI-45314 [0,0,0,1,0,1|1,1,0]=4 1348 B11R2.10 C1=CC=C2C(=C1)NC(=S)N2 PI-13021 [0,0,0,1,0,1|1,1,0]=4 1349 B11R2.10 C1=CC=C2C(=C1)NC(=S)O2 PI-32430 [0,0,0,1,0,1|1,1,0]=4 1350 B11R2.10 C1=CN=CC2=C1NC(=O)N2 PI-47254 [0,0,0,1,0,1|0,0,0]=2 1351 B11R2.10 C1C(=O)CC2=CC=CC=C21 PI-11611 [0,0,0,1,0,1|2,0,0]=4 1352 B11R2.10 CC1=CC2=CC=CC=C2N1 PI-31662 [0,0,0,1,0,1|2,0,0]=4 1353 B11R2.10 CC1=NC2=CC=CC=C2N1 PI-11865 [0,0,0,1,0,1|2,0,0]=4 1354 B11R2.10 Clc1nc2c([nH]1)cccc2 PI-31005 [0,0,0,1,0,1|2,0,0]=4 1355 B11R2.10 Clc1nc2c(s1)cccn2 PI-34998 [0,0,0,1,0,1|1,0,1]=4 1356 B11R2.10 Nc1nc2c(s1)cccc2 PI-31667 [0,0,0,1,0,1|1,1,0]=4 1357 B11R2.10 Nc1nc2ccccc2[nH]1 PI-31350 [0,0,0,1,0,1|2,0,0]=4 1358 B11R2.10 Nc1nc2ccccc2o1 PI-17283 [0,0,0,1,0,1|1,0,1]=4 1359 B11R2.10 O=C1Cc2c(N1)cccc2 PI-11084 [0,0,0,1,0,1|1,0,0]=3 1360 B11R2.10 O=C1Cc2ccccc2O1 PI-18682 [0,0,0,1,0,1|2,0,0]=4 1361 B11R2.10 O=c1oc2ccccc2[nH]1 PI-11480 [0,0,0,1,0,1|1,0,0]=3 1362 B11R2.10 O=c1sc2ccccc2[nH]1 PI-12052 [0,0,0,1,0,1|1,0,0]=3 1363 B11R2.10 Oc1nc2ccccc2[nH]1 PI-16421 [0,0,0,1,0,1|1,0,1]=4 1364 B11R2.1 BrC1=CSC2=NC=CC=C21 PI-46726 [0,1,0,1,0,0|1,1,0]=4 1365 B11R2.1 C1=CC2=C(NC=C2Br)N=C1 PI-41228 [0,1,0,1,0,0|1,0,0]=3 1366 B11R2.1 C1=CC2=C(NC=C2Cl)N=C1 PI-42708 [0,1,0,1,0,0|1,0,0]=3 1367 B11R2.1 C1=CC2=C(NN=C2C=C1)Br PI-34805 [0,1,0,1,0,0|2,0,0]=4 1368 B11R2.1 C1=CC2=NNC(=O)N2C=C1 PI-11229 [0,1,0,1,0,0|2,0,0]=4 1369 B11R2.1 C1=CC=C2C(=C1)C(=CN2)Br PI-34828 [0,1,0,1,0,0|2,0,0]=4 1370 B11R2.1 C1=CC=C2C(=C1)C(=NO2)N PI-14154 [0,1,0,1,0,0|1,0,1]=4 1371 B11R2.1 C1=CC=C2C(=C1)C(=O)NS2 PI-11536 [0,1,0,1,0,0|1,0,0]=3 1372 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-27871 [0,1,0,1,0,0|2,0,0]=4 1373 B11R2.1 C1C(=O)C2=CC=CC=C2O1 PI-33947 [0,1,0,1,0,0|2,0,0]=4 1374 B11R2.1 C1CC(=O)C2=CC=CC=C21 PI-12356 [0,1,0,1,0,0|2,0,0]=4 1375 B11R2.1 Cc1c[nH]c2c1cccc2 PI-10761 [0,1,0,1,0,0|2,0,0]=4 1376 B11R2.1 ClC1=CNC2=C1C=NC=C2 PI-36987 [0,1,0,1,0,0|1,0,0]=3 1377 B11R2.1 NC1=CNC2=C1C=NC=C2 PI-36984 [0,1,0,1,0,0|1,0,0]=3 1378 B11R2.1 NC1=NSC2=NC=CC=C21 PI-46733 [0,1,0,1,0,0|0,1,0]=3 1379 B11R2.1 O=C1C2=CC=CC=C2SC1 PI-42644 [0,1,0,1,0,0|2,0,0]=4 1380 B11R2.1 O=C1OCc2c1cccc2 PI-33738 [0,1,0,1,0,0|2,0,0]=4 1381 B11R2.1 O=C1SSC2=CC=CC=C12 PI-41753 [0,1,0,1,0,0|2,0,0]=4 1382 B7R1.1 C1=C(C=N[NH]1)C=O PI-39404 [1,0,0,0,1,0|1,0,0]=3 1383 B7R1.1 C1=C(N=CS1)C=O PI-25454 [1,0,0,0,1,0|1,0,0]=3 1384 B7R1.1 C1=C(N=NS1)C=O PI-29425 [1,0,0,0,1,0|2,0,0]=4 1385 B7R1.1 C1=C(NC=N1)C=O PI-34783 [1,0,0,0,1,0|1,0,0]=3 1386 B7R1.1 C1=C(SC=N1)CN PI-45069 [1,0,0,0,1,0|1,0,1]=4 1387 B7R1.1 C1=C(SC=N1)CN PI-45398 [1,0,0,0,1,0|1,0,1]=4 1388 B7R1.1 C1=CNC=C1C=O PI-34088 [1,0,0,0,1,0|0,0,1]=3 1389 B7R1.1 C1=CSC(=C1)C=O PI-44709 [1,0,0,0,1,0|1,0,0]=3 1390 B7R1.1 C1=CSC(=N1)CN PI-45385 [1,0,0,0,1,0|1,0,1]=4 1391 B7R1.1 C1=CSC(=N1)NN PI-44075 [1,0,0,0,1,0|2,0,0]=4 1392 B7R1.1 C1=CSC=C1CN PI-31789 [1,0,0,0,1,0|1,0,1]=4 1393 B7R1.1 NCc1cccs1 PI-11152 [1,0,0,0,1,0|1,0,1]=4 1394 B7R1.1 NNC1=NC=CS1 PI-41794 [1,0,0,0,1,0|2,0,0]=4 1395 B7R1.1 O=CC1=NC=CO1 PI-39572 [1,0,0,0,1,0|1,0,0]=3 1396 B7R1.1 O=Cc1cc[nH]n1 PI-39063 [1,0,0,0,1,0|1,0,0]=3 1397 B7R1.1 O=Cc1ccc[nH]1 PI-16523 [1,0,0,0,1,0|0,0,1]=3 1398 B7R1.1 O=Cc1cnco1 PI-38922 [1,0,0,0,1,0|1,0,0]=3 1399 B7R1.1 O=Cc1cncs1 PI-25019 [1,0,0,0,1,0|1,0,0]=3 1400 B7R1.1 O=Cc1cscc1 PI-10763 [1,0,0,0,1,0|1,0,0]=3 1401 B7R1.1 O=Cc1ncc[nH]1 PI-24015 [1,0,0,0,1,0|1,0,0]=3 1402 B7R1.1 O=Cc1nccs1 PI-11133 [1,0,0,0,1,0|1,0,0]=3 1403 B11R1.91 C1=CC(=CN=C1)C=C[N+](=O)[O-] PI-27470 [0,0,0,0,0,2|2,0,0]=4 1404 B11R1.91 C1=CC=C(C=C1)C=CC(=O)[O-] PI-12955 [0,0,0,0,0,2|2,0,0]=4 1405 B11R1.91 C1=CC=C(C=C1)CCC(=O)Cl PI-11944 [0,0,0,0,0,2|2,0,0]=4 1406 B11R1.91 C1=CC=C(C=C1)NCC(=O)O PI-14870 [0,0,0,0,0,2|2,0,0]=4 1407 B11R1.91 C1=CC=C(C=C1)OCC(=O)O PI-32615 [0,0,0,0,0,2|2,0,0]=4 1408 B11R1.91 C1=CC=C(C=C1)OCC(=O)[O-] PI-50538 [0,0,0,0,0,2|2,0,0]=4 1409 B11R1.91 CC(=O)NNc1ccccc1 PI-32317 [0,0,0,0,0,2|2,0,0]=4 1410 B11R1.91 NC(=O)\C=C\c1ccccc1 PI-30792 [0,0,0,0,0,2|1,0,0]=3 1411 B11R1.91 NC(=S)NCc1ccccc1 PI-20347 [0,0,0,0,0,2|1,1,0]=4 1412 B11R1.91 OC(=O)C#Cc1ccccc1 PI-28707 [0,0,0,0,0,2|2,0,0]=4 1413 B11R1.91 OC(=O)\C=C\c1cccnc1 PI-28055 [0,0,0,0,0,2|1,0,0]=3 1414 B11R1.91 [O-]C(=O)CNc1ccccc1 PI-17946 [0,0,0,0,0,2|2,0,0]=4