0 B10R1.1 BrC1=CC=C(CCI)C=C1 P35777 [0,0,0,0,0,0|1,1,0]=2 1 B10R1.1 BrCCC1=CC=C(Br)C=C1 P40516 [0,0,0,0,0,0|1,1,0]=2 2 B10R1.1 C=COC1=CC=C(Br)C=C1 N25160 [0,0,0,0,0,0|2,1,1]=4 3 B10R1.1 CC1=CC=C(CCN)N=C1 Q58444 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.1 CC1=CN=C(CCN)N=C1 Q58694 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.1 CCCC1=CC=C(N)N=C1 Q52924 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.1 CCNC1=CC=C(Br)C=C1 P36614 [0,0,0,0,0,0|2,1,0]=3 7 B10R1.1 CCNC1=CC=C(Cl)C=C1 P41554 [0,0,0,0,0,0|2,1,0]=3 8 B10R1.1 CCNC1=CC=C(F)C=C1 O32514 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.1 CCNC1=CC=C(N)C=C1 P37237 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.1 CCNC1=CC=C(N)C=N1 Q58250 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.1 CCNC1=NC=C(Br)C=C1 P35747 [0,0,0,0,0,0|3,1,0]=4 12 B10R1.1 CCOC1=CC=C(F)C=C1 M23303 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.1 CCOC1=NC=C(Cl)C=C1 N25842 [0,0,0,0,0,0|3,1,0]=4 14 B10R1.1 CCOC1=NC=C(F)C=C1 N24463 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.1 CNCC1=CC=C(Br)N=C1 P42296 [0,0,0,0,0,0|3,1,0]=4 16 B10R1.1 CNCC1=CC=C(Cl)C=C1 P42874 [0,0,0,0,0,0|2,1,0]=3 17 B10R1.1 CNCC1=CC=C(N)C=C1 P38425 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.1 CNCC1=CC=C(O)C=C1 P36065 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.1 CNCC1=CN=C(Cl)C=C1 P42297 [0,0,0,0,0,0|3,1,0]=4 20 B10R1.1 CNCC1=CNC(=O)C=C1 L19901 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.1 COCC1=CC=C(Br)C=C1 Q67196 [0,0,0,0,0,0|2,1,0]=3 22 B10R1.1 COCC1=CN=C(Br)C=C1 N25975 [0,0,0,0,0,0|3,1,0]=4 23 B10R1.1 COCC1=NC=C(Br)C=C1 N27297 [0,0,0,0,0,0|3,1,0]=4 24 B10R1.1 FC1=CC=C(CCBr)C=C1 I-9285 [0,0,0,0,0,0|1,0,0]=1 25 B10R1.1 N#CCC1=CC=C(Br)N=C1 P41217 [0,0,0,0,0,0|1,1,2]=4 26 B10R1.1 N#CCC1=NC=C(Br)C=C1 G-5599 [0,0,0,0,0,0|1,1,2]=4 27 B10R1.1 N#CCC1=NC=C(F)C=C1 Q69905 [0,0,0,0,0,0|1,0,2]=3 28 B10R1.1 NCCC1=CC=C(Cl)N=C1 P37543 [0,0,0,0,0,0|1,1,0]=2 29 B10R1.1 NCCC1=CC=C(F)C=N1 Q58446 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.1 NCCC1=CC=C(I)C=C1 P36354 [0,0,0,0,0,0|0,1,0]=1 31 B10R1.1 NCCC1=CN=C(Cl)N=C1 Q65338 [0,0,0,0,0,0|2,1,0]=3 32 B10R1.1 NCCC1=CN=C(Cl)N=C1 Q65339 [0,0,0,0,0,0|2,1,0]=3 33 B10R1.1 NCCC1=NC=C(Br)C=C1 G-5600 [0,0,0,0,0,0|1,1,0]=2 34 B10R1.1 NNCC1=CC=C(Br)C=C1 C-3250 [0,0,0,0,0,0|1,1,0]=2 35 B10R1.1 NNCC1=CC=C(Br)C=C1 I-9319 [0,0,0,0,0,0|1,1,0]=2 36 B10R1.1 NNCC1=CC=C(Cl)C=C1 C-3251 [0,0,0,0,0,0|1,1,0]=2 37 B10R1.1 NNCC1=CC=C(Cl)C=C1 Q51808 [0,0,0,0,0,0|1,1,0]=2 38 B10R1.1 NNCC1=CC=C(F)C=C1 C-3247 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.1 NOCC1=CC=C(Cl)C=C1 O31868 [0,0,0,0,0,0|1,1,0]=2 40 B10R1.1 NOCC1=CC=C(F)C=C1 10767 [0,0,0,0,0,0|1,0,0]=1 41 B10R1.1 OCCC1=NC=C(Br)C=C1 G-5598 [0,0,0,0,0,0|2,1,0]=3 42 B10R1.1 OCCC1=NC=C(F)C=C1 O33379 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.1 BrCC1=CN=C(Br)C=C1 M23057 [1,0,0,0,0,0|2,1,0]=4 44 B9R1.1 BrCC1=NC=C(Br)C=C1 O32745 [1,0,0,0,0,0|2,1,0]=4 45 B9R1.1 C#CC1=CC=C(Br)C=C1 P36174 [1,0,0,0,0,0|0,1,2]=4 46 B9R1.1 C#CC1=CC=C(Cl)C=C1 C-3288 [1,0,0,0,0,0|0,1,2]=4 47 B9R1.1 C#CC1=CC=C(I)C=C1 P36173 [1,0,0,0,0,0|0,1,2]=4 48 B9R1.1 C#CC1=CN=C(F)C=C1 M22879 [1,0,0,0,0,0|1,0,2]=4 49 B9R1.1 C#CC1=NC=C(F)C=C1 M22957 [1,0,0,0,0,0|1,0,2]=4 50 B9R1.1 C=CC1=CN=C(F)C=C1 L14939 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.1 C=CC1=CN=C(F)C=C1 O29601 [1,0,0,0,0,0|1,0,2]=4 52 B9R1.1 CC1=CC=C(CN)C=N1 C-3518 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.1 CC1=CC=C(CN)N=N1 C-3426 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 CC1=CC=C(CO)C=N1 H-8186 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 CC1=CN=C(CN)C=N1 L14005 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.1 CC1=CN=C(CN)N=C1 G-7178 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 CC1=CN=C(CO)C=C1 N24952 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 CC1=NC=C(CN)C=N1 C-2844 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 CC1=NC=C(CN)N=C1 P50562 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 CC1=NN=C(CN)C=C1 I-9402 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.1 CCC1=CC=C(Br)N=C1 Q57112 [1,0,0,0,0,0|1,1,0]=3 62 B9R1.1 CCC1=CC=C(Cl)N=C1 Q57111 [1,0,0,0,0,0|1,1,0]=3 63 B9R1.1 CCC1=CC=C(N)C=N1 A-656 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.1 CCC1=CN=C(Cl)N=C1 G-6620 [1,0,0,0,0,0|2,1,0]=4 65 B9R1.1 CCC1=NC=C(Br)C=C1 G-6695 [1,0,0,0,0,0|1,1,0]=3 66 B9R1.1 CCC1=NC=C(Br)C=N1 O33428 [1,0,0,0,0,0|2,1,0]=4 67 B9R1.1 CCC1=NC=C(N)C=N1 G-7879 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 CNC1=CC=C(Br)N=C1 Q65482 [1,0,0,0,0,0|2,1,0]=4 69 B9R1.1 CNC1=CC=C(F)C=N1 Q58345 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [1,0,0,0,0,0|1,1,0]=3 71 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [1,0,0,0,0,0|2,0,0]=3 72 B9R1.1 CNC1=CC=C(N)N=C1 Q58290 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.1 CNC1=CC=C(N)N=C1 Q58291 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.1 CNC1=NC=C(Br)C=C1 P35851 [1,0,0,0,0,0|2,1,0]=4 76 B9R1.1 COC1=CN=C(Br)C=C1 Q67224 [1,0,0,0,0,0|2,1,0]=4 77 B9R1.1 COC1=CN=C(Cl)C=C1 Q67222 [1,0,0,0,0,0|2,1,0]=4 78 B9R1.1 COC1=CN=C(F)C=C1 N24701 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.1 COC1=CN=C(N)C=C1 G-7588 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 COC1=NC=C(C)C=C1 Q67071 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 COC1=NC=C(F)C=C1 P37735 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.1 COC1=NC=C(I)C=C1 Q67264 [1,0,0,0,0,0|2,1,0]=4 83 B9R1.1 COC1=NC=C(O)C=C1 Q67584 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.1 CSC1=CN=C(Br)C=C1 N24931 [1,0,0,0,0,0|2,1,0]=4 85 B9R1.1 CSC1=CN=C(F)C=C1 N26916 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.1 CSC1=NC=C(Br)C=C1 Q66696 [1,0,0,0,0,0|2,1,0]=4 87 B9R1.1 CSC1=NC=C(C)C=C1 N24295 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 CSC1=NC=C(Cl)C=C1 N24817 [1,0,0,0,0,0|2,1,0]=4 89 B9R1.1 ClC1=CN=C(CBr)C=C1 L18293 [1,0,0,0,0,0|2,1,0]=4 90 B9R1.1 ClCC1=CN=C(Br)C=C1 O34227 [1,0,0,0,0,0|2,1,0]=4 91 B9R1.1 FC1=CN=C(CBr)N=C1 Q52930 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.1 FC1=CN=C(CCl)C=C1 Q60053 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.1 FC1=CN=C(CCl)N=C1 L22238 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 FC1=CN=C(CCl)N=C1 Q56402 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 FC1=NC=C(CBr)C=C1 G-6035 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.1 FC1=NC=C(CCl)C=C1 F-4121 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.1 N#CC1=CC=C(F)N=C1 G-6861 [1,0,0,0,0,0|1,0,2]=4 98 B9R1.1 N#CC1=CC=C(S)C=C1 O30392 [1,0,0,0,0,0|1,0,2]=4 99 B9R1.1 NC1=NC=C(CO)C=C1 E-3098 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [1,0,0,0,0,0|0,1,0]=2 101 B9R1.1 NCC1=CC=C(O)C=N1 O29328 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.1 NCC1=CC=C(O)C=N1 O31467 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.1 NCC1=CN=C(Cl)C=C1 C-3459 [1,0,0,0,0,0|1,1,0]=3 104 B9R1.1 NCC1=CN=C(Cl)N=C1 G-6101 [1,0,0,0,0,0|2,1,0]=4 105 B9R1.1 NCC1=CN=C(Cl)N=C1 L13162 [1,0,0,0,0,0|2,1,0]=4 106 B9R1.1 NCC1=CN=C(F)C=C1 L18071 [1,0,0,0,0,0|1,0,0]=2 107 B9R1.1 NCC1=CN=C(N)C=C1 Q62313 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.1 NCC1=CNC(=O)C=C1 G-5535 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.1 NCC1=NC=C(Br)C=C1 G-7736 [1,0,0,0,0,0|1,1,0]=3 110 B9R1.1 NCC1=NC=C(Br)C=C1 L14589 [1,0,0,0,0,0|1,1,0]=3 111 B9R1.1 NCC1=NC=C(Br)C=C1 O30462 [1,0,0,0,0,0|1,1,0]=3 112 B9R1.1 NCC1=NC=C(Br)C=N1 G-7163 [1,0,0,0,0,0|2,1,0]=4 113 B9R1.1 NCC1=NC=C(Br)C=N1 L21926 [1,0,0,0,0,0|2,1,0]=4 114 B9R1.1 NCC1=NC=C(Cl)C=C1 O30447 [1,0,0,0,0,0|1,1,0]=3 115 B9R1.1 NCC1=NC=C(Cl)C=C1 O31783 [1,0,0,0,0,0|1,1,0]=3 116 B9R1.1 NCC1=NC=C(Cl)C=C1 P36637 [1,0,0,0,0,0|1,1,0]=3 117 B9R1.1 NCC1=NC=C(Cl)C=N1 P43786 [1,0,0,0,0,0|2,1,0]=4 118 B9R1.1 NCC1=NC=C(Cl)C=N1 Q56403 [1,0,0,0,0,0|2,1,0]=4 119 B9R1.1 NCC1=NC=C(Cl)N=C1 O31596 [1,0,0,0,0,0|2,1,0]=4 120 B9R1.1 NCC1=NC=C(F)C=C1 P37408 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.1 NCC1=NC=C(F)C=N1 L14273 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 NCC1=NC=C(F)C=N1 Q56302 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.1 NNC1=CC=C(Br)C=C1 P38159 [1,0,0,0,0,0|1,1,0]=3 124 B9R1.1 NNC1=CC=C(F)C=C1 P38478 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.1 NNC1=CC=C(F)N=C1 O32377 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.1 NNC1=CN=C(F)C=C1 Q52569 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.1 NNC1=NC=C(Cl)C=C1 Q67932 [1,0,0,0,0,0|2,1,0]=4 128 B9R1.1 N\N=C1\N=CC(F)=CN1 Q58690 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.1 O=CC1=CN=C(F)C=C1 P50975 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.1 O=CC1=NC=C(F)C=C1 O30696 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 OCC1=CC=C(Br)N=C1 O34239 [1,0,0,0,0,0|2,1,0]=4 132 B9R1.1 OCC1=CC=C(F)N=C1 O30867 [1,0,0,0,0,0|2,0,0]=3 133 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [1,0,0,0,0,0|2,0,0]=3 134 B9R1.1 OCC1=NC=C(Cl)C=C1 N24430 [1,0,0,0,0,0|2,1,0]=4 135 B9R1.1 OCC1=NC=C(F)C=C1 C-3467 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.1 OCC1=NC=C(F)C=N1 G-6053 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,0,0,0,0,0|2,0,1]=4 140 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.8 N#CCC1=CC=NC=C1 P41732 [1,0,0,0,0,0|1,0,2]=4 144 B9R1.8 NCCC1=CC=NC=N1 L14509 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.8 NCCC1=NC=CC=N1 L14904 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.8 NCCC1=NC=CC=N1 Q55474 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.8 NCCC1=NC=NC=C1 Q56454 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,0,0,0,0,0|1,0,0]=2 149 B9R1.8 NNCC1=CC=CN=C1 O31533 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.8 NNCC1=CC=NC=C1 C-3253 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.8 NNCC1=CC=NC=C1 L13556 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.8 NNCC1=CC=NC=C1 O32212 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.8 NNCC1=CN=CC=C1 C-3254 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.8 NNCC1=CN=CN=C1 C-3759 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.8 NNCC1=NC=CC=C1 C-3255 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.8 NNCC1=NC=CC=C1 O31423 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.8 NNCC1=NC=CC=N1 C-2760 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.8 NNCC1=NC=CN=C1 G-5311 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.8 OCCC1=CC=NC=N1 Q56821 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.8 OCCC1=NC=CC=N1 Q56820 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 O32008 [1,0,0,0,0,0|3,0,0]=4 165 B11R1.1 BrCCCC1=CC=C(Br)C=C1 O28558 [0,1,0,0,0,0|1,1,0]=3 166 B11R1.1 BrCCOC1=CC=C(Br)C=C1 P40240 [0,1,0,0,0,0|1,1,0]=3 167 B11R1.1 C#CCOC1=CC=C(Br)C=C1 P38782 [0,1,0,0,0,0|1,1,1]=4 168 B11R1.1 C#CCOC1=CC=C(C)C=C1 P37379 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.1 C#CCOC1=CC=C(Cl)C=C1 P40177 [0,1,0,0,0,0|1,1,1]=4 170 B11R1.1 C#CCOC1=CC=C(F)C=C1 P42073 [0,1,0,0,0,0|1,0,1]=3 171 B11R1.1 C#CCOC1=CC=C(N)C=C1 P39226 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.1 C=CCOC1=CC=C(Br)C=C1 M22970 [0,1,0,0,0,0|1,1,1]=4 173 B11R1.1 C=CCOC1=CC=C(Cl)C=C1 P41385 [0,1,0,0,0,0|1,1,1]=4 174 B11R1.1 CC1=CC=C(C#CCO)C=C1 O27973 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.1 CC1=CC=C(CCCN)C=C1 P37491 [0,1,0,0,0,0|1,0,0]=2 176 B11R1.1 CC1=CC=C(CCCO)C=C1 P37548 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.1 CC1=CC=C(NCCN)N=C1 Q58257 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.1 CC1=CC=C(OCCN)C=C1 P39224 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.1 CC1=CC=C(OCCO)C=C1 P41034 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.1 CCCNC1=CC=C(Br)C=C1 L20694 [0,1,0,0,0,0|1,1,0]=3 181 B11R1.1 CCCOC1=NC=C(Cl)C=C1 Q67615 [0,1,0,0,0,0|2,1,0]=4 182 B11R1.1 CCOCC1=CC=C(Br)C=C1 Q68272 [0,1,0,0,0,0|1,1,0]=3 183 B11R1.1 CCOCC1=CN=C(N)C=C1 O29975 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.1 CNCCC1=CC=C(Br)C=C1 P36407 [0,1,0,0,0,0|0,1,0]=2 185 B11R1.1 CNCCC1=CC=C(C)C=C1 P39523 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.1 CNCCC1=CC=C(Cl)C=C1 P38411 [0,1,0,0,0,0|0,1,0]=2 187 B11R1.1 CNCCC1=CC=C(F)C=C1 P38002 [0,1,0,0,0,0|0,0,0]=1 188 B11R1.1 COCOC1=CC=C(Br)C=C1 Q66626 [0,1,0,0,0,0|2,1,0]=4 189 B11R1.1 COCOC1=CC=C(C)C=C1 Q67077 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.1 COCOC1=CC=C(Cl)C=C1 Q66756 [0,1,0,0,0,0|2,1,0]=4 191 B11R1.1 COCOC1=CC=C(F)C=C1 Q66729 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.1 COCOC1=CN=C(F)C=C1 Q67767 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.1 CO\C=N\C1=CC=C(F)C=C1 L18577 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.1 ClC1=CC=C(CCCBr)C=C1 P36856 [0,1,0,0,0,0|1,1,0]=3 195 B11R1.1 ClC1=CC=C(OCCBr)C=C1 P39956 [0,1,0,0,0,0|1,1,0]=3 196 B11R1.1 ClCCOC1=CC=C(Br)C=C1 Q66285 [0,1,0,0,0,0|1,1,0]=3 197 B11R1.1 FC1=CC=C(CCCBr)C=C1 P39413 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.1 FCCOC1=CC=C(Br)C=C1 Q66290 [0,1,0,0,0,0|1,1,0]=3 199 B11R1.1 N#CCCC1=CC=C(Cl)C=C1 P38827 [0,1,0,0,0,0|0,1,1]=3 200 B11R1.1 N#CCNC1=CC=C(Cl)C=C1 P39380 [0,1,0,0,0,0|0,1,2]=4 201 B11R1.1 N#CCOC1=CC=C(F)C=C1 P39441 [0,1,0,0,0,0|0,0,2]=3 202 B11R1.1 NC1=CC=C(CCCO)C=C1 O28226 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.1 NC1=CC=C(NCCO)C=C1 P40155 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.1 NC1=CC=C(OCCO)C=C1 P36875 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.1 NCCCC1=CC=C(Br)C=C1 P36773 [0,1,0,0,0,0|0,1,0]=2 206 B11R1.1 NCCCC1=CC=C(Cl)C=C1 P40263 [0,1,0,0,0,0|0,1,0]=2 207 B11R1.1 NCCCC1=CC=C(F)C=C1 P43064 [0,1,0,0,0,0|0,0,0]=1 208 B11R1.1 NCCCC1=CC=C(N)C=C1 P35188 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.1 NCCNC1=CC=C(Br)C=C1 P37781 [0,1,0,0,0,0|0,1,0]=2 210 B11R1.1 NCCNC1=CC=C(F)C=C1 P37782 [0,1,0,0,0,0|0,0,0]=1 211 B11R1.1 NCCNC1=NC=C(Br)C=C1 P40044 [0,1,0,0,0,0|1,1,0]=3 212 B11R1.1 NCCOC1=CC=C(Br)C=C1 P39225 [0,1,0,0,0,0|0,1,0]=2 213 B11R1.1 NCCOC1=CC=C(Cl)C=C1 P39041 [0,1,0,0,0,0|0,1,0]=2 214 B11R1.1 NCCOC1=CC=C(Cl)C=N1 Q58385 [0,1,0,0,0,0|1,1,0]=3 215 B11R1.1 NCCOC1=CC=C(F)C=C1 P37101 [0,1,0,0,0,0|0,0,0]=1 216 B11R1.1 NCCOC1=CC=C(N)C=C1 P36425 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.1 NCCOC1=CC=C(O)C=C1 P37780 [0,1,0,0,0,0|1,0,0]=2 218 B11R1.1 NCCOC1=NC=C(Cl)C=C1 Q62434 [0,1,0,0,0,0|1,1,0]=3 219 B11R1.1 NCCSC1=CC=C(Br)C=C1 P36571 [0,1,0,0,0,0|0,1,0]=2 220 B11R1.1 OCC#CC1=CC=C(Br)C=C1 O27965 [0,1,0,0,0,0|1,1,1]=4 221 B11R1.1 OCC#CC1=CC=C(Cl)C=C1 O27975 [0,1,0,0,0,0|1,1,1]=4 222 B11R1.1 OCC#CC1=CC=C(F)C=C1 O27979 [0,1,0,0,0,0|1,0,1]=3 223 B11R1.1 OCCCC1=CC=C(Br)C=C1 P39318 [0,1,0,0,0,0|1,1,0]=3 224 B11R1.1 OCCCC1=CC=C(F)C=C1 P36540 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.1 OCCOC1=CC=C(Br)C=C1 P38648 [0,1,0,0,0,0|1,1,0]=3 226 B11R1.1 OCCOC1=CC=C(Cl)C=C1 P40217 [0,1,0,0,0,0|1,1,0]=3 227 B11R1.1 OCCOC1=CC=C(F)C=C1 P39022 [0,1,0,0,0,0|1,0,0]=2 228 B11R1.1 OCCOC1=CC=C(I)C=C1 P39004 [0,1,0,0,0,0|1,1,0]=3 229 B11R1.1 OCCOC1=NC=C(Br)C=C1 N25245 [0,1,0,0,0,0|2,1,0]=4 230 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 P42284 [0,1,0,0,0,0|2,1,0]=4 231 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 P36150 [0,1,0,0,0,0|2,1,0]=4 232 B11R1.20 CC(C)NC1=CC=C(F)C=C1 P36529 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Q66408 [0,1,0,0,0,0|2,1,0]=4 234 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Q67546 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.20 CC(C)OC1=CN=C(F)C=C1 N25011 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.20 CC(N)CC1=CC=C(Br)C=C1 P41684 [0,1,0,0,0,0|0,1,0]=2 238 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 P43234 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.20 CN(C)CC1=CC=C(N)C=C1 P36889 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.20 N=C(N)CC1=CC=C(F)N=C1 H-8033 [0,1,0,0,0,0|1,0,1]=3 241 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 O31092 [0,1,0,0,0,0|1,0,1]=3 242 B11R1.20 O=C(O)CC1=CC=C(F)C=N1 I-9943 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.22 C#CC(O)C1=CC=C(Cl)C=C1 P38985 [0,1,0,0,0,0|1,1,1]=4 244 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [0,1,0,0,0,0|0,1,2]=4 245 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [0,1,0,0,0,0|0,0,2]=3 246 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [0,1,0,0,0,0|0,1,0]=2 247 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [0,1,0,0,0,0|0,0,0]=1 248 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [0,1,0,0,0,0|1,1,0]=3 249 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [0,1,0,0,0,0|1,1,0]=3 250 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [0,1,0,0,0,0|1,0,1]=3 251 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [0,1,0,0,0,0|1,1,0]=3 256 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [0,1,0,0,0,0|1,1,0]=3 257 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,1,0,0,0,0|1,1,0]=3 259 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,1,0,0,0,0|1,1,0]=3 261 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,1,0,0,0,0|1,1,0]=3 262 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,1,0,0,0,0|1,0,0]=2 263 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,1,0,0,0,0|0,1,0]=2 265 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,1,0,0,0,0|0,1,0]=2 266 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,1,0,0,0,0|0,0,0]=1 267 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,1,0,0,0,0|1,1,0]=3 268 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,1,0,0,0,0|1,1,0]=3 269 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,1,0,0,0,0|1,0,0]=2 270 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,1,0,0,0,0|1,1,0]=3 271 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,1,0,0,0,0|1,1,0]=3 272 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,1,0,0,0,0|1,0,0]=2 273 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 O31201 [0,1,0,0,0,0|1,1,1]=4 274 B11R1.81 CC1=CC(=O)N(CCN)C=N1 Q58727 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.81 CC1=CC(F)=CC=C1CC#N A-659 [0,1,0,0,0,0|0,0,2]=3 276 B11R1.81 CCOC1=C(Cl)C=C(O)C=C1 N25182 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.81 CCOC1=C(F)C=C(O)C=C1 N24700 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.81 CCOC1=CC=C(Br)C=C1C Q67231 [0,1,0,0,0,0|2,1,0]=4 279 B11R1.81 CCOC1=CC=C(C)C=C1Br Q66572 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.81 CCOC1=CC=C(Cl)C=C1Br N25533 [0,1,0,0,0,0|2,1,0]=4 281 B11R1.81 CCOC1=CC=C(Cl)C=C1O N25020 [0,1,0,0,0,0|2,1,0]=4 282 B11R1.81 CCOC1=CC=C(F)C=C1Br Q66396 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.81 CCOC1=CC=C(F)C=C1Cl Q67082 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.81 CCOC1=CC=C(F)C=C1F N26821 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.81 CCOC1=CC=C(F)C=C1O N25130 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.81 CCOC1=CN=C(F)C=C1I N27779 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.81 CNCC1=CC=C(C)C=C1C P36179 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.81 CNCC1=CC=C(Cl)C=C1Cl G-5816 [0,1,0,0,0,0|2,1,0]=4 289 B11R1.81 CNCC1=CC=C(F)C=C1F P36557 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.81 ClC1=CC=C(CCBr)C(Cl)=C1 P42712 [0,1,0,0,0,0|1,1,0]=3 291 B11R1.81 FC1=CC=C(CCBr)C(F)=C1 P39746 [0,1,0,0,0,0|1,0,0]=2 292 B11R1.81 NC1=CC(=O)N(CCO)C=C1 Q54921 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.81 NCCC1=CC=C(Br)C=C1Br P41426 [0,1,0,0,0,0|0,1,0]=2 294 B11R1.81 NCCC1=CC=C(F)C=C1F P41573 [0,1,0,0,0,0|0,0,0]=1 295 B11R1.81 NNCC1=CC=C(Cl)C=C1Cl Q51856 [0,1,0,0,0,0|1,1,0]=3 296 B11R1.81 NNCC1=CC=C(F)C=C1Cl Q51854 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.81 O=C1C=C(Br)C=CN1CCF Q55601 [0,1,0,0,0,0|2,1,0]=4 298 B11R1.81 O=C1C=C(Br)C=CN1CCO Q55600 [0,1,0,0,0,0|2,1,0]=4 299 B11R1.81 OCCC1=CC=C(Br)C=C1Cl P35108 [0,1,0,0,0,0|1,1,0]=3 300 B11R1.81 OCCC1=CC=C(Cl)C=C1Br O29351 [0,1,0,0,0,0|1,1,0]=3 301 B11R1.81 OCCC1=CC=C(Cl)C=C1Cl P35959 [0,1,0,0,0,0|1,1,0]=3 302 B11R1.81 OCCC1=CC=C(F)C=C1F O27872 [0,1,0,0,0,0|1,0,0]=2 303 B11R1.81 OCCC1=NC=C(F)C=C1F Q54945 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.81 O\N=C\C1=CC=C(F)C=C1F M23302 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.83 CCC1=CC=C(CCN)C=C1 P36862 [0,1,0,0,0,0|1,0,0]=2 306 B11R1.83 CCC1=CC=C(CNC)C=C1 P37356 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.83 CCCC1=CN=C(OC)C=C1 N26472 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.83 CCNC1=CC=C(CC)C=C1 P37885 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.83 CCNC1=CC=C(OC)C=C1 P42858 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.83 CCOC1=CC=C(CBr)C=C1 P39282 [0,1,0,0,0,0|2,1,0]=4 311 B11R1.83 CNCC1=CC=C(C#N)C=C1 P38675 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.83 CNCC1=CC=C(CN)C=C1 P38885 [0,1,0,0,0,0|3,0,0]=4 313 B11R1.83 COC1=CC=C(CCBr)C=C1 P41235 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.83 COC1=CC=C(CNN)C=C1 C-3256 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.83 COCC1=CC=C(C=O)C=C1 N25868 [0,1,0,0,0,0|3,0,0]=4 316 B11R1.83 COCC1=CC=C(CO)C=C1 M23214 [0,1,0,0,0,0|3,0,0]=4 317 B11R1.83 N#CC1=CC=C(CC=O)C=C1 K12007 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.192 CC1=C(F)C=CC(CC=O)=N1 Q53006 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.192 CC1=C(F)C=CC(CCO)=N1 Q53007 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.192 CC1=CC=C(CC#N)C=C1C P38953 [0,1,0,0,0,0|1,0,2]=4 321 B11R1.192 CCOC1=CC(F)=C(C)C=C1 N24366 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.192 CCOC1=CC=C(Br)C(C)=C1 Q66720 [0,1,0,0,0,0|2,1,0]=4 323 B11R1.192 CCOC1=CC=C(Br)C(Cl)=C1 Q66397 [0,1,0,0,0,0|2,1,0]=4 324 B11R1.192 CCOC1=CC=C(Br)C(F)=C1 Q67492 [0,1,0,0,0,0|2,1,0]=4 325 B11R1.192 CCOC1=CC=C(C)C(Br)=C1 N26273 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.192 CCOC1=CC=C(C)C(O)=C1 N25713 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.192 CCOC1=CC=C(F)C(O)=C1 N25197 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.192 CCOC1=CC=C(O)C(Cl)=C1 N25132 [0,1,0,0,0,0|3,0,0]=4 329 B11R1.192 CNCC1=CC=C(C)C(C)=C1 P40736 [0,1,0,0,0,0|3,0,0]=4 330 B11R1.192 CNCC1=CC=C(F)C(Br)=C1 Q66119 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.192 CNCC1=CC=C(F)C(Cl)=C1 Q66040 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.192 CNCC1=CC=C(F)C(F)=C1 P36292 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.192 COCC1=CC=C(Br)C(C)=C1 N26886 [0,1,0,0,0,0|2,1,0]=4 334 B11R1.192 COCC1=CC=C(Cl)C(Br)=C1 N26925 [0,1,0,0,0,0|2,1,0]=4 335 B11R1.192 ClC1=CC=C(CCBr)C=C1Cl P38351 [0,1,0,0,0,0|1,1,0]=3 336 B11R1.192 FC1=CC=C(CCBr)C=C1F P40504 [0,1,0,0,0,0|1,0,0]=2 337 B11R1.192 N#CCC1=CC=C(Br)C(F)=C1 H-8275 [0,1,0,0,0,0|0,1,2]=4 338 B11R1.192 NCCC1=CC=C(Cl)C(F)=C1 O32009 [0,1,0,0,0,0|0,1,0]=2 339 B11R1.192 NCCC1=CC=C(F)C(F)=C1 P39635 [0,1,0,0,0,0|0,0,0]=1 340 B11R1.192 OCCC1=CC(Br)=C(Cl)N=C1 L18305 [0,1,0,0,0,0|2,1,0]=4 341 B11R1.192 OCCC1=CC=C(F)C(F)=C1 P39050 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.192 OCCC1=CC=C(O)C(O)=C1 M15188 [0,1,0,0,0,0|2,0,0]=3 343 B11R2.34 BrC1=CC=C(C2CC2)C=C1 O30566 [0,0,0,1,0,0|1,1,0]=3 344 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [0,0,0,1,0,0|1,1,0]=3 345 B11R2.34 CC1=CC=C(C2CN2)C=C1 P36371 [0,0,0,1,0,0|1,0,0]=2 346 B11R2.34 ClC1=CC=C(C2CN2)C=C1 P36104 [0,0,0,1,0,0|0,1,0]=2 347 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Q67831 [0,0,0,1,0,0|2,1,0]=4 348 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [0,0,0,1,0,0|1,0,0]=2 349 B11R2.34 FC1=NC=C(C2CC2)C=C1 N26245 [0,0,0,1,0,0|2,0,0]=3 350 B11R2.34 NC1=CC=C(C2CC2)C=C1 P38877 [0,0,0,1,0,0|2,0,0]=3 351 B11R2.34 NC1=CC=C(C2CC2)N=C1 P42501 [0,0,0,1,0,0|3,0,0]=4 352 B11R2.34 OC1=CC=C(C2CC2)C=C1 P42947 [0,0,0,1,0,0|2,0,0]=3 353 B11R2.36 BrC1=CC2=C(C=C1)CCN2 M15579 [0,0,0,1,0,0|0,1,0]=2 354 B11R2.36 BrC1=CC2=C(C=C1)CNC2 O32275 [0,0,0,1,0,0|2,1,0]=4 355 B11R2.36 BrC1=CC=C2C=NNC2=C1 C-2007 [0,0,0,1,0,0|1,1,1]=4 356 B11R2.36 BrC1=CC=C2CNCC2=C1 C-3625 [0,0,0,1,0,0|2,1,0]=4 357 B11R2.36 CC1=CC2=C(C=C1)C=NN2 L13557 [0,0,0,1,0,0|2,0,1]=4 358 B11R2.36 CC1=CC2=C(C=C1)NCC2 O32270 [0,0,0,1,0,0|3,0,0]=4 359 B11R2.36 CC1=CC2=C(C=CN2)C=C1 P43296 [0,0,0,1,0,0|1,0,2]=4 360 B11R2.36 ClC1=CC2=C(C=C1)C=NN2 C-2037 [0,0,0,1,0,0|1,1,1]=4 361 B11R2.36 ClC1=CC2=C(C=C1)CCN2 M15570 [0,0,0,1,0,0|0,1,0]=2 362 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 I-9317 [0,0,0,1,0,0|0,1,2]=4 363 B11R2.36 ClC1=CC=C2OCCC2=C1 M15833 [0,0,0,1,0,0|2,1,0]=4 364 B11R2.36 FC1=CC2=C(C=C1)CCN2 D-2527 [0,0,0,1,0,0|0,0,0]=1 365 B11R2.36 FC1=CC2=C(C=C1)CNC2 L13810 [0,0,0,1,0,0|2,0,0]=3 366 B11R2.36 FC1=CC2=C(C=CN2)C=C1 C-3360 [0,0,0,1,0,0|0,0,2]=3 367 B11R2.36 FC1=CC2=C(C=NN2)N=C1 P48504 [0,0,0,1,0,0|2,0,1]=4 368 B11R2.36 FC1=CC=C2C=NNC2=C1 C-2106 [0,0,0,1,0,0|1,0,1]=3 369 B11R2.36 FC1=CC=C2C=NNC2=N1 K12063 [0,0,0,1,0,0|2,0,1]=4 370 B11R2.36 FC1=CC=C2N=CSC2=C1 Q65372 [0,0,0,1,0,0|2,0,1]=4 371 B11R2.36 FC1=CC=C2NN=CC2=C1 C-2101 [0,0,0,1,0,0|3,0,0]=4 372 B11R2.36 FC1=CC=C2OC=CC2=C1 P39420 [0,0,0,1,0,0|2,0,1]=4 373 B11R2.36 FC1=CC=C2OCCC2=C1 Q65592 [0,0,0,1,0,0|2,0,0]=3 374 B11R2.36 FC1=CC=C2SC=CC2=C1 P51244 [0,0,0,1,0,0|2,0,1]=4 375 B11R2.36 FC1=CN=C2C=CNC2=C1 10546 [0,0,0,1,0,0|1,0,2]=4 376 B11R2.36 FC1=NC2=C(C=CN2)C=C1 G-6609 [0,0,0,1,0,0|1,0,2]=4 377 B11R2.36 FC1=NC=C2C=CNC2=C1 P44375 [0,0,0,1,0,0|1,0,2]=4 378 B11R2.36 IC1=CC2=C(C=C1)CCN2 O31769 [0,0,0,1,0,0|0,1,0]=2 379 B11R2.36 IC1=CC2=C(C=C1)CNC2 H-8930 [0,0,0,1,0,0|2,1,0]=4 380 B11R2.36 IC1=CC2=C(C=C1)CNC2 M15878 [0,0,0,1,0,0|2,1,0]=4 381 B11R2.36 IC1=CC=C2C=CNC2=C1 L14002 [0,0,0,1,0,0|0,1,2]=4 382 B11R2.36 IC1=CC=C2C=NNC2=C1 C-2108 [0,0,0,1,0,0|1,1,1]=4 383 B11R2.36 NC1=CC2=C(C=C1)C=NN2 C-2138 [0,0,0,1,0,0|2,0,1]=4 384 B11R2.36 NC1=CC2=C(C=C1)CCN2 P40883 [0,0,0,1,0,0|1,0,0]=2 385 B11R2.36 NC1=CC2=C(C=CN2)C=C1 Q55305 [0,0,0,1,0,0|1,0,2]=4 386 B11R2.36 NC1=CC=C2OCCC2=C1 M15806 [0,0,0,1,0,0|3,0,0]=4 387 B11R2.36 NC1=NC=C2CCNC2=N1 S72520 [0,0,0,1,0,0|3,0,0]=4 388 B11R2.36 OC1=CC2=C(C=C1)CNC2 Q57110 [0,0,0,1,0,0|3,0,0]=4 389 B11R2.36 OC1=CC2=C(C=C1)N=CN2 F-4234 [0,0,0,1,0,0|2,0,1]=4 390 B11R2.36 OC1=CC2=C(C=C1)NCC2 O32235 [0,0,0,1,0,0|3,0,0]=4 391 B11R2.36 OC1=CC2=C(C=C1)OCC2 N25202 [0,0,0,1,0,0|3,0,0]=4 392 B11R2.36 OC1=CC=C2C=NNC2=C1 C-2424 [0,0,0,1,0,0|2,0,1]=4 393 B9R1.7 CC1=CC=C(CCO)O1 P51657 [0,0,0,0,1,0|3,0,0]=4 394 B9R1.7 CC1=CSC(CCN)=N1 L20707 [0,0,0,0,1,0|3,0,0]=4 395 B9R1.7 CC1=NC(CCN)=CN1 O32293 [0,0,0,0,1,0|3,0,0]=4 396 B9R1.7 CC1=NOC(CCN)=C1 L19848 [0,0,0,0,1,0|3,0,0]=4 397 B9R1.7 CN1C=C(CCN)C=N1 O29786 [0,0,0,0,1,0|3,0,0]=4 398 B8R1.2 BrCC1=CC=CN=C1 P36550 [2,0,0,0,0,0|2,0,0]=4 399 B8R1.2 ICC1=CC=CC=C1 P37031 [2,0,0,0,0,0|1,0,0]=3 400 B8R1.2 NCC1=CC=CN=N1 L21914 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.2 NCC1=CC=NC=C1 O30621 [2,0,0,0,0,0|1,0,0]=3 402 B8R1.2 NCC1=CC=NC=N1 C-2474 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.2 NCC1=CC=NC=N1 L13752 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.2 NCC1=CC=NN=C1 C-3221 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.2 NCC1=CC=NN=C1 C-3221-01 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.2 NCC1=CN=CN=C1 C-3222 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.2 NCC1=CN=CN=C1 L14043 [2,0,0,0,0,0|2,0,0]=4 408 B8R1.2 NCC1=NC=CC=N1 C-3224 [2,0,0,0,0,0|2,0,0]=4 409 B8R1.2 NCC1=NC=CC=N1 C-3224-1 [2,0,0,0,0,0|2,0,0]=4 410 B8R1.2 NCC1=NC=CN=C1 C-3223 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.2 NCC1=NN=CC=C1 C-2473 [2,0,0,0,0,0|2,0,0]=4 412 B8R1.2 NNC1=CC=CN=C1 C-3227 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 NNC1=CC=NC=C1 C-3226 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 NNC1=CC=NC=C1 L19135 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.2 NNC1=CC=NC=C1 O31964 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.3 CC1=CC=C(F)C=N1 P38896 [2,0,0,0,0,0|1,0,0]=3 417 B8R1.3 CC1=CN=C(I)C=C1 O29967 [2,0,0,0,0,0|1,1,0]=4 418 B8R1.3 FC1=CC=C(Br)N=C1 E-3090 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.3 NC1=CC=C(O)C=N1 E-3088 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.3 NC1=NC=C(Br)C=C1 G-5636 [2,0,0,0,0,0|1,1,0]=4 421 B8R1.3 NC1=NC=C(F)C=N1 O32924 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.3 NC1=NN=C(F)C=C1 O29638 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.3 [O-][N+]1=CC=C(F)C=C1 G-5918 [2,0,0,0,0,0|2,0,0]=4 424 B10R1.3 C#CC1=CC=C(CN)C=C1 O28144 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.3 C#CC1=CC=C(CO)C=C1 O28046 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.3 C#CC1=CC=C(NC)C=C1 M22819 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.3 CCC1=CC=C(CO)C=C1 Q68223 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.3 CCC1=NC=C(C=O)C=C1 Q60469 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.3 CNC1=CC=C(CO)C=C1 P40364 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.3 COC1=CC=C(CBr)C=C1 Q67503 [1,1,0,0,0,0|1,1,0]=4 431 B10R1.3 COC1=CC=C(CN)N=C1 Q52335 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.3 COC1=CC=C(NN)C=C1 P43291 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.3 COC1=NC=C(CN)C=C1 C-3721 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.3 COC1=NC=C(CN)C=C1 G-6806 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.3 CSC1=CC=C(NN)C=C1 O30693 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.3 N#CC1=CC=C(CN)C=C1 P42878 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.3 N#CC1=CC=C(CO)C=C1 P35569 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.3 N#CC1=CN=C(CN)C=C1 L14637 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.3 N#CC1=CN=C(CN)C=C1 Q52612 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.3 N#CC1=CN=C(CN)C=C1 Q52613 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.3 NCC1=CC=C(CBr)C=C1 P38676 [1,1,0,0,0,0|0,1,0]=3 442 B10R1.3 NCC1=CC=C(CO)C=C1 P38312 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.3 O=CC1=CC=C(CCl)C=C1 P45270 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.3 O=CC1=CC=C(CO)C=C1 P37667 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.3 OCC1=CC=C(CBr)C=C1 O28910 [1,1,0,0,0,0|1,1,0]=4 446 B10R1.3 OCC1=CC=C(CCl)C=C1 P40748 [1,1,0,0,0,0|1,1,0]=4 447 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [1,1,0,0,0,0|1,0,1]=4 448 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [1,1,0,0,0,0|1,0,1]=4 449 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [1,1,0,0,0,0|0,1,0]=3 450 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [1,1,0,0,0,0|0,1,0]=3 451 B10R1.13 CC(C)C1=CN=C(N)C=C1 O34069 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.13 CC(C)C1=NC=C(N)C=C1 G-7522 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [1,1,0,0,0,0|0,1,0]=3 454 B10R1.13 CC(N)C1=NC=C(F)C=C1 C-3369 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.13 CC(N)C1=NC=C(F)C=N1 L14507 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.13 CC(N)C1=NC=C(F)C=N1 P51601 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [1,1,0,0,0,0|1,1,0]=4 458 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,1,0,0,0,0|1,0,0]=3 459 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [1,1,0,0,0,0|1,1,0]=4 461 B10R1.13 CC(O)C1=NC=C(F)C=N1 P51653 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [1,1,0,0,0,0|1,1,0]=4 465 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [1,1,0,0,0,0|1,1,0]=4 466 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 O32464 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 O32601 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 Q55738 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [1,1,0,0,0,0|1,1,0]=4 470 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [1,1,0,0,0,0|1,1,0]=4 471 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [1,1,0,0,0,0|1,1,0]=4 472 B10R1.13 N=C(N)C1=CN=C(F)C=C1 G-5718 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.13 N=C(N)C1=NC=C(F)C=C1 C-2886 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.25 CC1=CC(Br)=CC=C1CO P40596 [1,1,0,0,0,0|1,1,0]=4 477 B10R1.25 CC1=CC(Br)=CN=C1CN O31469 [1,1,0,0,0,0|1,1,0]=4 478 B10R1.25 CC1=CC(C)=C(CN)C=N1 Q62835 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.25 CC1=CC(Cl)=CC=C1CO P41778 [1,1,0,0,0,0|1,1,0]=4 480 B10R1.25 CC1=CC(Cl)=CN=C1CN O31462 [1,1,0,0,0,0|1,1,0]=4 481 B10R1.25 CC1=CC(F)=CC=C1CO Q67889 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.25 CC1=CC(F)=CN=C1CN O30931 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.25 CC1=CC(F)=NC=C1CO N25094 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.25 CC1=CC(O)=CC=C1CO Q68377 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.25 CC1=CC=C(CN)C(Cl)=N1 O31295 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.25 CC1=CC=C(CO)C(Br)=C1 N24923 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.25 CC1=CC=C(CO)C(C)=C1 P40779 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.25 CC1=CC=C(CO)C(Cl)=C1 N25728 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.25 CC1=CC=C(CO)C(F)=C1 Q67939 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.25 CC1=CC=C(CO)C(O)=C1 N25355 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.25 CC1=CN=C(CN)C(Br)=C1 O31519 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.25 CC1=CN=C(CN)C(C)=C1 O31461 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.25 CC1=NC(F)=CC=C1CO N25785 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.25 CCC1=CC=C(Cl)C=C1N O29377 [1,1,0,0,0,0|0,1,0]=3 495 B10R1.25 CCC1=NC=C(Br)C=C1N G-7153 [1,1,0,0,0,0|1,1,0]=4 496 B10R1.25 CCN1C=CC(Br)=CC1=O I-9771 [1,1,0,0,0,0|1,1,0]=4 497 B10R1.25 CCN1C=CC(N)=CC1=O G-5850 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.25 CCN1C=CC(N)=CC1=O G-5850-01 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.25 CNC1=CC=C(C)C=C1F P37822 [1,1,0,0,0,0|2,0,0]=4 500 B10R1.25 COC1=C(Br)N=C(F)C=C1 N26207 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.25 COC1=C(C)C=C(O)C=C1 N25234 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.25 COC1=C(Cl)C=C(I)C=C1 N24180 [1,1,0,0,0,0|1,1,0]=4 503 B10R1.25 COC1=CC=C(Br)C=C1F I-9161 [1,1,0,0,0,0|1,1,0]=4 504 B10R1.25 COC1=CC=C(Br)C=C1N Q67396 [1,1,0,0,0,0|1,1,0]=4 505 B10R1.25 COC1=CC=C(C)C=C1F Q67608 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.25 COC1=CC=C(F)N=C1C N26375 [1,1,0,0,0,0|2,0,0]=4 507 B10R1.25 COC1=CC=C(I)C=C1Br Q68173 [1,1,0,0,0,0|1,1,0]=4 508 B10R1.25 COC1=CC=C(O)C=C1Br Q66991 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.25 COC1=CC=C(O)C=C1Cl Q67654 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.25 COC1=CC=C(O)C=C1F Q67009 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.25 COC1=CN=C(F)C=C1Br N25531 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.25 COC1=CN=C(F)C=C1C N24782 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.25 COC1=CN=C(F)C=C1I N25508 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.25 CSC1=C(C)N=C(F)C=C1 N26850 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.25 CSC1=C(Cl)C=C(Br)C=C1 N26937 [1,1,0,0,0,0|1,1,0]=4 516 B10R1.25 CSC1=C(Cl)C=C(O)C=C1 N27242 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.25 CSC1=CC=C(Br)C=C1C Q68080 [1,1,0,0,0,0|1,1,0]=4 518 B10R1.25 CSC1=CC=C(Br)C=C1F Q67467 [1,1,0,0,0,0|1,1,0]=4 519 B10R1.25 CSC1=CC=C(C)C=C1Br Q67598 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.25 CSC1=CC=C(Cl)C=C1Br N24474 [1,1,0,0,0,0|1,1,0]=4 521 B10R1.25 CSC1=CC=C(F)C=C1Br Q67404 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.25 CSC1=CC=C(F)C=C1C N24243 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.25 CSC1=CC=C(F)C=C1F Q67753 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.25 CSC1=CC=C(F)C=C1O N25555 [1,1,0,0,0,0|1,0,0]=3 525 B10R1.25 CSC1=CC=C(F)N=C1F O30966 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.25 CSC1=CC=C(N)C=C1F O29735 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.25 FC1=CN=C(CCl)C(Cl)=C1 O29584 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.25 FC1=CN=C(CCl)C(F)=C1 H-8134 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.25 NC1=CC=C(CO)C(Cl)=C1 O27967 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.25 NCC1=C(Cl)C=C(Cl)N=C1 O29513 [1,1,0,0,0,0|1,1,0]=4 531 B10R1.25 NCC1=C(Cl)C=C(Cl)N=C1 O29722 [1,1,0,0,0,0|1,1,0]=4 532 B10R1.25 NCC1=CC=C(Br)C=C1Cl P36148 [1,1,0,0,0,0|0,1,0]=3 533 B10R1.25 NCC1=NC=C(Br)C=C1Cl O31368 [1,1,0,0,0,0|1,1,0]=4 534 B10R1.25 NCC1=NC=C(Br)C=C1Cl Q52674 [1,1,0,0,0,0|1,1,0]=4 535 B10R1.25 NCC1=NC=C(Br)C=C1F G-5486 [1,1,0,0,0,0|1,1,0]=4 536 B10R1.25 NCC1=NC=C(Br)C=C1F L21921 [1,1,0,0,0,0|1,1,0]=4 537 B10R1.25 NCC1=NC=C(Cl)C=C1Br O31603 [1,1,0,0,0,0|1,1,0]=4 538 B10R1.25 NCC1=NC=C(Cl)C=C1F O31483 [1,1,0,0,0,0|1,1,0]=4 539 B10R1.25 NCC1=NC=C(F)C=C1Br O30989 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.25 NCC1=NC=C(F)C=C1Cl O31210 [1,1,0,0,0,0|1,0,0]=3 541 B10R1.25 NCC1=NC=C(F)C=C1F O30027 [1,1,0,0,0,0|1,0,0]=3 542 B10R1.25 NCC1=NC=C(F)C=C1F O30032 [1,1,0,0,0,0|1,0,0]=3 543 B10R1.25 NNC1=CC=C(I)C=C1Cl P51462 [1,1,0,0,0,0|1,1,0]=4 544 B10R1.25 O=CC1=CC=C(F)C=C1O L13983 [1,1,0,0,0,0|1,0,1]=4 545 B10R1.25 OCC1=CC=C(Br)C=C1Cl P40293 [1,1,0,0,0,0|1,1,0]=4 546 B10R1.25 OCC1=CC=C(Cl)C=C1Br N24970 [1,1,0,0,0,0|1,1,0]=4 547 B10R1.25 OCC1=CC=C(F)N=C1F N24594 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.25 OCC1=CC=C(O)C=C1F O30496 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.25 OCC1=NC=C(F)C=C1Br O29605 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.25 OCC1=NC=C(F)C=C1Cl O29470 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.25 OCC1=NC=C(F)C=C1F H-8135 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.176 C#CC1=CC=C(F)C(F)=C1 P41247 [1,1,0,0,0,0|0,0,2]=4 553 B10R1.176 C=CC1=CC=C(F)C(F)=C1 P38224 [1,1,0,0,0,0|0,0,2]=4 554 B10R1.176 CC1=C(Cl)C=CC(CN)=C1 A-961 [1,1,0,0,0,0|0,1,0]=3 555 B10R1.176 CC1=C(Cl)C=CC(CO)=C1 N25889 [1,1,0,0,0,0|1,1,0]=4 556 B10R1.176 CC1=C(Cl)N=CC(CN)=C1 O31410 [1,1,0,0,0,0|1,1,0]=4 557 B10R1.176 CC1=CC(CN)=CC=C1Br P41109 [1,1,0,0,0,0|0,1,0]=3 558 B10R1.176 CC1=CC(CN)=CN=C1Cl N26394 [1,1,0,0,0,0|1,1,0]=4 559 B10R1.176 CC1=CC(CN)=NC=C1Br O31342 [1,1,0,0,0,0|1,1,0]=4 560 B10R1.176 CC1=CC(CO)=CC=C1Br N24431 [1,1,0,0,0,0|1,1,0]=4 561 B10R1.176 CC1=CC(CO)=CN=C1F N26380 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.176 CC1=CC=C(CO)C=C1Br Q67930 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.176 CC1=NC(CCl)=CC=C1F Q56664 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.176 CC1=NC(CN)=CC=C1O Q62258 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.176 CCC1=CC=C(F)C(Br)=C1 N24841 [1,1,0,0,0,0|0,0,0]=2 566 B10R1.176 CCC1=CC=C(N)C(F)=C1 O34054 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.176 CCC1=NC=C(F)C(Cl)=N1 Q58683 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.176 CN1C=C(CN)C=CC1=O L22212 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.176 CN1C=C(CN)C=CC1=O Q51823 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.176 CN1C=CC(CN)=CC1=O C-3606 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.176 CN1C=CC(CN)=CC1=O G-6746 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.176 COC1=CC=C(Br)C(I)=C1 Q68050 [1,1,0,0,0,0|1,1,0]=4 573 B10R1.176 COC1=CC=C(Br)C(O)=C1 Q66993 [1,1,0,0,0,0|1,1,0]=4 574 B10R1.176 COC1=CC=C(C)C(Br)=C1 N24125 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.176 COC1=CC=C(C)C(F)=C1 Q67079 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.176 COC1=CC=C(C)C(O)=C1 Q67987 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.176 COC1=CC=C(F)C(I)=C1 N24584 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.176 COC1=CC=C(F)C(O)=C1 Q67529 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.176 COC1=CC=C(I)C(Br)=C1 Q67866 [1,1,0,0,0,0|1,1,0]=4 580 B10R1.176 COC1=CC=C(N)C(I)=C1 Q52916 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.176 COC1=CC=C(N)C(O)=C1 M15200 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.176 COC1=CC=C(N)C(O)=C1 M15201 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.176 COC1=CC=C(O)C(C)=C1 Q67705 [1,1,0,0,0,0|2,0,0]=4 584 B10R1.176 COC1=CN=C(F)C(C)=C1 N25926 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.176 COC1=CN=C(F)C(I)=C1 N25099 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.176 COC1=CN=C(F)C(O)=C1 N27785 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.176 COC1=NC(C)=C(F)C=C1 P38455 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.176 COC1=NC=C(F)C(N)=C1 Q52643 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.176 COC1=NC=C(F)C(O)=C1 O31520 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.176 CSC1=CC(F)=C(F)C=C1 N24442 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.176 CSC1=CC(O)=C(C)C=C1 N26961 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.176 CSC1=CC(O)=C(F)C=C1 N27741 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.176 CSC1=CC=C(Br)C(C)=C1 N24368 [1,1,0,0,0,0|1,1,0]=4 594 B10R1.176 CSC1=CC=C(Br)C(F)=C1 N24385 [1,1,0,0,0,0|1,1,0]=4 595 B10R1.176 CSC1=CC=C(O)C(C)=C1 N24608 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.176 FC1=CC=C(CCl)N=C1Br O30914 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.176 FC1=NC=C(C[Ho])C=C1Br P44199 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.176 NC1=CC=C(CO)C=C1Cl O27969 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.176 NCC1=CC(Br)=C(Cl)N=C1 O29516 [1,1,0,0,0,0|1,1,0]=4 600 B10R1.176 NCC1=CC(Cl)=C(Cl)N=C1 O29515 [1,1,0,0,0,0|1,1,0]=4 601 B10R1.176 NCC1=CC(Cl)=C(Cl)N=C1 O31357 [1,1,0,0,0,0|1,1,0]=4 602 B10R1.176 NCC1=CC=C(Cl)C(F)=C1 P36420 [1,1,0,0,0,0|0,1,0]=3 603 B10R1.176 NCC1=CN=C(O)C(Br)=C1 P43424 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.176 NCC1=CN=C(O)C(Cl)=C1 O29589 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 P46505 [1,1,0,0,0,0|1,1,0]=4 606 B10R1.176 NCC1=NC(Cl)=C(Cl)C=C1 Q62451 [1,1,0,0,0,0|1,1,0]=4 607 B10R1.176 O=CC1=CC=C(F)C(O)=C1 Q67727 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.176 OCC1=CC(Cl)=C(F)C=N1 Q56522 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.176 OCC1=CC(O)=C(F)C=C1 N25036 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.176 OCC1=CC=C(Br)C(Cl)=C1 Q67931 [1,1,0,0,0,0|1,1,0]=4 611 B10R1.176 OCC1=CC=C(Cl)C(O)=C1 N25640 [1,1,0,0,0,0|1,1,0]=4 612 B10R1.176 OCC1=CC=C(O)C(Br)=C1 Q68849 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.4 BrCCC1=CC=CC=C1Br O28100 [1,1,0,0,0,0|1,0,0]=3 614 B10R1.4 CC1=CC=CC=C1CCBr O28115 [1,1,0,0,0,0|1,0,0]=3 615 B10R1.4 CC1=CC=CN=C1CCN P35791 [1,1,0,0,0,0|1,0,0]=3 616 B10R1.4 CCCC1=C(C)C=CN=C1 N27219 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.4 CCNC1=CC=CC=C1Br P36583 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.4 CCNC1=CC=CC=C1Cl P41555 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.4 CCNC1=CC=CC=C1F P39148 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.4 CCNC1=CC=CC=C1N P39464 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.4 CNCC1=CC=CC=C1C P35580 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.4 CNCC1=CC=CC=C1N P40191 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.4 COCC1=CC=CC=C1Br Q67462 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.4 NC1=C(CCF)C=NC=C1 Q65355 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.4 NCCC1=C(Br)C=CC=N1 L13097 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.4 NCCC1=CC=CC=C1N P42500 [1,1,0,0,0,0|0,0,0]=2 627 B10R1.4 NCCC1=CC=CC=C1O M22991 [1,1,0,0,0,0|0,0,0]=2 628 B10R1.4 NCCC1=NC=CC=C1F Q58445 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.4 NCCN1C=CC=NC1=O L18972 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.4 NCCN1N=CC=CC1=O L20650 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.4 NNCC1=C(Br)C=CC=C1 G-5141 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.4 NNCC1=C(Br)C=CC=C1 Q51807 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.4 NNCC1=C(Cl)C=CC=C1 C-3252 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.4 NNCC1=C(F)C=CC=C1 C-3249 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.4 OC1=CC=CC=C1CCBr P37343 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.4 OCCC1=C(Cl)C=NC=C1 Q69549 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.4 OCCC1=CC=CC=C1O P36102 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.4 OCCC1=NC=CC=C1F L14825 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.10 CC1=CC(CCBr)=CC=C1 P40673 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.10 CC1=CC(CCCl)=CC=C1 P38353 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.10 CC1=CC(CCI)=CC=C1 M23009 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.10 CC1=CC(CCN)=CC=C1 P37429 [1,1,0,0,0,0|0,0,0]=2 643 B10R1.10 CC1=CC(CCN)=NC=C1 Q53269 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.10 CC1=CC=CC(CCO)=N1 Q52530 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.10 CC1=CN=CC(CCN)=C1 Q64732 [1,1,0,0,0,0|1,0,0]=3 646 B10R1.10 CC1=CN=CC(CCO)=C1 Q64733 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.10 CC1=NC=CC(CCN)=C1 O31989 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.10 CCCC1=CC=CC(N)=C1 M23710 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.10 CCCC1=CC=CC(N)=N1 O31120 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.10 CCNC1=CC=CC(Br)=C1 P38317 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.10 CCNC1=CC=CC(Cl)=C1 P41014 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.10 CCNC1=CC=CC(F)=C1 P39149 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.10 CCOC1=CC=CC(F)=C1 Q66827 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.10 CNCC1=CC(O)=CC=C1 P42117 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.10 CNCC1=CC=CC(C)=C1 P38357 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.10 COCC1=CC(Br)=CC=C1 Q67458 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.10 FC1=CC(CCBr)=CC=C1 P39371 [1,1,0,0,0,0|1,0,0]=3 658 B10R1.10 FC1=CN=CC(CCBr)=C1 Q64580 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.10 N#CCC1=CC=CC(N)=C1 P37983 [1,1,0,0,0,0|0,0,2]=4 660 B10R1.10 NC1=CC(CCO)=CC=C1 O31199 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.10 NC1=CC(CCO)=NC=C1 Q53462 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.10 NCCC1=CC(Br)=NC=C1 H-8231 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.10 NCCC1=CC(F)=CN=C1 Q64579 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.10 NCCC1=CC(O)=CC=C1 M23068 [1,1,0,0,0,0|0,0,0]=2 665 B10R1.10 NCCC1=CC=CC(Cl)=C1 G-6963 [1,1,0,0,0,0|0,0,0]=2 666 B10R1.10 NCCC1=CC=CC(I)=C1 P34955 [1,1,0,0,0,0|0,0,0]=2 667 B10R1.10 NCCC1=CC=CC(N)=C1 P36157 [1,1,0,0,0,0|0,0,0]=2 668 B10R1.10 NCCC1=NC=CC(F)=C1 Q53270 [1,1,0,0,0,0|1,0,0]=3 669 B10R1.10 NNCC1=CC(Br)=CN=C1 Q51914 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.10 NNCC1=CC(Cl)=CC=C1 Q51809 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.10 NNCC1=CC(F)=CC=C1 C-3248 [1,1,0,0,0,0|1,0,0]=3 672 B10R1.10 NNCC1=CC(F)=CC=C1 Q51806 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.10 NNCC1=CC=CC(Br)=C1 L20978 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.10 OCCC1=CC(F)=CN=C1 Q64578 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.10 OCCC1=CC=CC(O)=C1 P41607 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.10 OCCC1=NC(Cl)=CC=C1 Q69232 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.10 OCCC1=NC=CC(Br)=C1 S72505 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [1,1,0,0,0,0|0,0,0]=2 685 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [1,1,0,0,0,0|1,0,0]=3 687 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [1,1,0,0,0,0|1,0,0]=3 689 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [1,1,0,0,0,0|0,0,0]=2 690 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [1,1,0,0,0,0|0,0,0]=2 691 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.17 C#CCOC1=CC=CC=C1 P41520 [1,1,0,0,0,0|1,0,1]=4 693 B10R1.17 C=COCC1=CC=CC=C1 I-9956 [1,1,0,0,0,0|1,0,1]=4 694 B10R1.17 CCCCC1=CC=NC=C1 O30545 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.17 CNCCC1=CC=CC=C1 P37213 [1,1,0,0,0,0|0,0,0]=2 696 B10R1.17 CNCCC1=CC=NC=C1 P37446 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.17 CNCCC1=NC=CC=C1 P40087 [1,1,0,0,0,0|1,0,0]=3 698 B10R1.17 ICCCC1=CC=CC=C1 P38180 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.17 NCC#CC1=CC=CC=N1 Q58471 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.17 NCC#CC1=CC=CC=N1 Q58472 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.17 NCCCC1=CC=NC=C1 P38929 [1,1,0,0,0,0|1,0,0]=3 702 B10R1.17 NCCNC1=NC=CC=C1 P34736 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.17 NCCNC1=NC=CC=C1 P36299 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.17 NCCOC1=CC=CN=C1 O34354 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.17 NCCOC1=CC=NC=C1 P51450 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.17 NCCOC1=NC=CC=C1 O34316 [1,1,0,0,0,0|1,0,0]=3 707 B10R1.17 NC\C=C\C1=CC=CN=C1 Q58489 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.17 NNCCC1=CC=NC=C1 Q58254 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.17 O=CCOC1=CC=CC=C1 K12296 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.17 OCCCC1=NC=CC=C1 P39056 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.18 NC(=S)CC1=CC=NC=C1 Q58253 [1,1,0,0,0,0|1,0,1]=4 713 B12R1.1 BrC1=CC=C(CCCCI)C=C1 M23180 [0,2,0,0,0,0|1,1,0]=4 714 B12R1.1 BrCCCCC1=CC=C(Br)C=C1 P35349 [0,2,0,0,0,0|1,1,0]=4 715 B12R1.1 CC1=CC=C(CCCCBr)C=C1 P34730 [0,2,0,0,0,0|2,0,0]=4 716 B12R1.1 CC1=CC=C(CCCCI)C=C1 M23181 [0,2,0,0,0,0|2,0,0]=4 717 B12R1.1 CC1=CC=C(CCCCN)C=C1 P40979 [0,2,0,0,0,0|1,0,0]=3 718 B12R1.1 CC1=CC=C(CCCCO)C=C1 P37587 [0,2,0,0,0,0|2,0,0]=4 719 B12R1.1 CC1=CC=C(CNCCO)C=C1 P38262 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.1 CCCNCC1=CC=C(Br)C=C1 P41052 [0,2,0,0,0,0|1,1,0]=4 721 B12R1.1 CCCNCC1=CC=C(C)C=C1 P38355 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.1 CCCNCC1=CC=C(Cl)C=C1 P37471 [0,2,0,0,0,0|1,1,0]=4 723 B12R1.1 CCCNCC1=CC=C(F)C=C1 P36342 [0,2,0,0,0,0|1,0,0]=3 724 B12R1.1 CNCCCC1=CC=C(Br)C=C1 P35409 [0,2,0,0,0,0|0,1,0]=3 725 B12R1.1 CNCCCC1=CC=C(F)C=C1 P37997 [0,2,0,0,0,0|0,0,0]=2 726 B12R1.1 CNCCOC1=CC=C(N)C=C1 P39260 [0,2,0,0,0,0|1,0,0]=3 727 B12R1.1 COCCOC1=CC=C(N)C=C1 P38759 [0,2,0,0,0,0|2,0,0]=4 728 B12R1.1 ClC1=CC=C(CCCCBr)C=C1 M22750 [0,2,0,0,0,0|1,1,0]=4 729 B12R1.1 ClC1=CC=C(CCCCI)C=C1 M22752 [0,2,0,0,0,0|1,1,0]=4 730 B12R1.1 ClC1=CC=C(OCCCBr)C=C1 P39095 [0,2,0,0,0,0|1,1,0]=4 731 B12R1.1 FC1=CC=C(CCCCBr)C=C1 M22793 [0,2,0,0,0,0|1,0,0]=3 732 B12R1.1 FC1=CC=C(CCCCI)C=C1 M22744 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.1 FC1=CC=C(OCCCBr)C=C1 P42593 [0,2,0,0,0,0|1,0,0]=3 734 B12R1.1 NCCCCC1=CC=C(Br)C=C1 P42241 [0,2,0,0,0,0|0,1,0]=3 735 B12R1.1 NCCCCC1=CC=C(F)C=C1 P41110 [0,2,0,0,0,0|0,0,0]=2 736 B12R1.1 NCCCCC1=CC=C(I)C=C1 P41122 [0,2,0,0,0,0|0,1,0]=3 737 B12R1.1 NCCCCC1=CC=C(O)C=C1 P39592 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.1 NCCCOC1=CC=C(F)C=C1 P42484 [0,2,0,0,0,0|0,0,0]=2 739 B12R1.1 OCCCCC1=CC=C(Br)C=C1 P36218 [0,2,0,0,0,0|1,1,0]=4 740 B12R1.1 OCCCCC1=CC=C(Cl)C=C1 P40038 [0,2,0,0,0,0|1,1,0]=4 741 B12R1.1 OCCCCC1=CC=C(F)C=C1 P38247 [0,2,0,0,0,0|1,0,0]=3 742 B12R1.1 OCCNCC1=CC=C(Br)C=C1 P36123 [0,2,0,0,0,0|1,1,0]=4 743 B12R1.1 OCCNCC1=CC=C(Cl)C=C1 P38261 [0,2,0,0,0,0|1,1,0]=4 744 B12R1.1 OCCNCC1=CC=C(F)C=C1 P39606 [0,2,0,0,0,0|1,0,0]=3 745 B12R1.16 CC1=CC=C(C(N)CCO)C=C1 P36618 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.16 CC1=CC=C([C@@H](N)CCO)C=C1 P42260 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.16 CC1=CC=C([C@H](N)CCO)C=C1 P42755 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.16 NC(CCO)C1=CC=C(Br)C=C1 P36052 [0,2,0,0,0,0|1,1,0]=4 749 B12R1.16 NC(CCO)C1=CC=C(Cl)C=C1 P36616 [0,2,0,0,0,0|1,1,0]=4 750 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 P37084 [0,2,0,0,0,0|1,0,0]=3 751 B12R1.16 NC1=CC=C(C(N)CCO)C=C1 P35426 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.16 N[C@@H](CCO)C1=CC=C(Br)C=C1 P42566 [0,2,0,0,0,0|1,1,0]=4 753 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 P35435 [0,2,0,0,0,0|1,1,0]=4 754 B12R1.16 N[C@@H](CCO)C1=CC=C(F)C=C1 P39529 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.16 N[C@H](CCO)C1=CC=C(Br)C=C1 P42268 [0,2,0,0,0,0|1,1,0]=4 756 B12R1.16 N[C@H](CCO)C1=CC=C(Cl)C=C1 P42266 [0,2,0,0,0,0|1,1,0]=4 757 B12R1.16 N[C@H](CCO)C1=CC=C(F)C=C1 P39530 [0,2,0,0,0,0|1,0,0]=3 758 B12R1.16 OCCC(O)C1=CC=C(Br)C=C1 P39649 [0,2,0,0,0,0|1,1,0]=4 759 B12R1.21 CC(C)COC1=CC=C(Br)C=C1 N25559 [0,2,0,0,0,0|1,1,0]=4 760 B12R1.21 CC(C)COC1=CC=C(F)C=C1 N26826 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.21 CC(C)NCC1=CC=C(Br)C=C1 P37152 [0,2,0,0,0,0|1,1,0]=4 762 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 P38287 [0,2,0,0,0,0|1,1,0]=4 763 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 P41482 [0,2,0,0,0,0|1,0,0]=3 764 B12R1.21 CC(N)COC1=CC=C(Br)C=C1 P36534 [0,2,0,0,0,0|0,1,0]=3 765 B12R1.21 CC(N)COC1=CC=C(Cl)C=C1 P39492 [0,2,0,0,0,0|0,1,0]=3 766 B12R1.21 CC(N)COC1=CC=C(F)C=C1 P42374 [0,2,0,0,0,0|0,0,0]=2 767 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 P36503 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.21 CC1=CC=C(OCC(C)N)C=C1 P39024 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.21 CN(C)CCC1=CC=C(N)C=C1 P37394 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.21 NC(=O)CCC1=CC=C(Br)C=C1 P37285 [0,2,0,0,0,0|0,1,0]=3 771 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 P38386 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.21 NC(=O)CNC1=CC=C(N)C=C1 Q66022 [0,2,0,0,0,0|1,0,1]=4 773 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 P37247 [0,2,0,0,0,0|1,0,1]=4 774 B12R1.21 O=C(Cl)CCC1=CC=C(Br)C=C1 N24618 [0,2,0,0,0,0|1,1,0]=4 775 B12R1.21 O=C(Cl)CSC1=CC=C(F)C=C1 L19955 [0,2,0,0,0,0|1,0,1]=4 776 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 P38000 [0,2,0,0,0,0|1,0,0]=3 777 B12R1.21 O=C(O)CCC1=CC=C(F)N=C1 O29534 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 P40757 [0,2,0,0,0,0|1,1,0]=4 779 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 P38616 [0,2,0,0,0,0|1,0,1]=4 780 B12R1.49 CC(CN)OC1=CC=C(Cl)C=C1 P40582 [0,2,0,0,0,0|0,1,0]=3 781 B12R1.49 CC1=CC=C(CC(N)CO)C=C1 P38590 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.49 CC1=CC=C(C[C@H](N)CO)C=C1 P35566 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 O31002 [0,2,0,0,0,0|1,1,0]=4 784 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 P37023 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.49 NC(CO)CC1=CC=C(Br)C=C1 P35633 [0,2,0,0,0,0|0,1,0]=3 786 B12R1.49 NC(CO)CC1=CC=C(Cl)C=C1 P38593 [0,2,0,0,0,0|0,1,0]=3 787 B12R1.49 NC(CO)CC1=CC=C(F)C=C1 P38588 [0,2,0,0,0,0|0,0,0]=2 788 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 P37292 [0,2,0,0,0,0|0,1,1]=4 789 B12R1.49 N[C@@H](CO)CC1=CC=C(Cl)C=C1 P39975 [0,2,0,0,0,0|0,1,0]=3 790 B12R1.49 N[C@@H](CO)CC1=CC=C(F)C=C1 P38643 [0,2,0,0,0,0|0,0,0]=2 791 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 M23085 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.49 N[C@H](CO)CC1=CC=C(Br)C=C1 P36332 [0,2,0,0,0,0|0,1,0]=3 793 B12R1.49 N[C@H](CO)CC1=CC=C(Cl)C=C1 P39974 [0,2,0,0,0,0|0,1,0]=3 794 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 P40016 [0,2,0,0,0,0|0,0,0]=2 795 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 P37803 [0,2,0,0,0,0|1,0,0]=3 796 B12R1.49 O=C(CBr)CC1=CC=C(Cl)C=C1 O29303 [0,2,0,0,0,0|1,1,0]=4 797 B12R1.49 O=C(CBr)NC1=CC=C(F)C=C1 P39650 [0,2,0,0,0,0|1,0,1]=4 798 B12R1.69 CCCOC1=CC=C(Br)C=C1Cl Q67556 [0,2,0,0,0,0|1,1,0]=4 799 B12R1.69 CCCOC1=CC=C(F)C=C1Br Q67430 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.69 CCCOC1=CC=C(F)C=C1F N26501 [0,2,0,0,0,0|1,0,0]=3 801 B12R1.69 CNCCC1=CC=C(Cl)C=C1Cl P36311 [0,2,0,0,0,0|0,1,0]=3 802 B12R1.69 COCOC1=CC=C(F)C=C1Br Q67117 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.69 COCOC1=CC=C(F)C=C1Cl Q67017 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.69 COCOC1=CC=C(F)C=C1F Q66869 [0,2,0,0,0,0|2,0,0]=4 805 B12R1.69 FC1=CC=C(CCCBr)C(F)=C1 P42800 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.69 NCCCC1=CC=C(Cl)C=C1Cl P41145 [0,2,0,0,0,0|0,1,0]=3 807 B12R1.69 NCCCC1=CC=C(F)C=C1F P38446 [0,2,0,0,0,0|0,0,0]=2 808 B12R1.69 NCCOC1=CC=C(Cl)C=C1Cl P42342 [0,2,0,0,0,0|0,1,0]=3 809 B12R1.69 NCCOC1=NC=C(Cl)C=C1Cl Q58389 [0,2,0,0,0,0|1,1,0]=4 810 B12R1.69 NCCOC1=NC=C(Cl)C=C1Cl Q58390 [0,2,0,0,0,0|1,1,0]=4 811 B12R1.69 OCCCC1=CC=C(F)C=C1F P34818 [0,2,0,0,0,0|1,0,0]=3 812 B12R1.71 C#CC1=CC=C(OCCC)C=C1 P38335 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.71 CCC1=CC=C(CCCO)C=C1 O28817 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.71 CCC1=CC=C(OCCN)C=C1 P36697 [0,2,0,0,0,0|1,0,0]=3 815 B12R1.71 CCC1=CC=C(OCCO)C=C1 P37522 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.71 CCOCC1=CC=C(C=O)C=C1 Q68273 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.71 CCOCC1=CC=C(CO)C=C1 Q68755 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.71 CNCCC1=CC=C(OC)C=C1 P38192 [0,2,0,0,0,0|1,0,0]=3 819 B12R1.71 COC1=CC=C(CCCBr)C=C1 O28114 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.71 COC1=CC=C(CCCI)C=C1 O28095 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.71 COC1=CC=C(CCCN)C=C1 P38522 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.71 COC1=CC=C(CCCO)C=C1 P37549 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.71 COC1=CC=C(NCCN)C=C1 P39417 [0,2,0,0,0,0|1,0,0]=3 824 B12R1.71 COC1=CC=C(OCCN)C=C1 P37768 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.71 COC1=CC=C(OCCO)C=C1 P37559 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.71 CSC1=CC=C(OCCN)C=C1 P42324 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.71 N#CC1=CC=C(OCCN)C=C1 P36696 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.71 O=CC1=CC=C(OCCBr)C=C1 Q69372 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.71 O=CC1=CC=C(OCCF)C=C1 Q69754 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.71 OCC1=CC=C(OCCF)C=C1 Q69755 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.385 CC1=CC(OCCN)=CC=C1Cl P36839 [0,2,0,0,0,0|0,1,0]=3 832 B12R1.385 CC1=CC=C(CCCN)C=C1C P41304 [0,2,0,0,0,0|1,0,0]=3 833 B12R1.385 CC1=CC=C(OCCBr)C=C1C P38742 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.385 CC1=CC=C(OCCN)C=C1C M23033 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.385 CC1=CC=C(SCCO)C=C1Br O31390 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.385 CCCOC1=CC=C(Br)C(F)=C1 Q67470 [0,2,0,0,0,0|1,1,0]=4 837 B12R1.385 CCCOC1=CC=C(C)C(Br)=C1 N26854 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.385 CCCOC1=CC=C(N)C(N)=C1 O31767 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.385 CNCCC1=CC=C(Cl)C(Cl)=C1 P37636 [0,2,0,0,0,0|0,1,0]=3 840 B12R1.385 COCOC1=CC=C(F)C(F)=C1 Q66975 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.385 FC1=CC=C(CCCBr)C=C1F P42798 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.385 NCCCC1=CC=C(Cl)C(Cl)=C1 P36171 [0,2,0,0,0,0|0,1,0]=3 843 B12R1.385 NCCCC1=CC=C(Cl)C(F)=C1 P37976 [0,2,0,0,0,0|0,1,0]=3 844 B12R1.385 NCCCC1=CC=C(F)C(F)=C1 P38447 [0,2,0,0,0,0|0,0,0]=2 845 B12R1.385 NCCCC1=CC=C(O)C(O)=C1 P37643 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.385 OCCCC1=CC=C(F)C(F)=C1 P38961 [0,2,0,0,0,0|1,0,0]=3 847 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 L19340 [0,2,0,0,0,0|1,0,1]=4 848 B12R1.19 CC(C)OC1=CC=C(F)C(F)=C1 N24491 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.19 CC(C)OC1=CC=C(F)C(O)=C1 N25367 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 P36216 [0,2,0,0,0,0|1,0,1]=4 851 B12R1.20 CC(C)C(N)C1=CC=C(Cl)C=C1 P36067 [0,2,0,0,0,0|1,1,0]=4 852 B12R1.20 CC(N)C(O)C1=CC=C(Cl)C=C1 P37279 [0,2,0,0,0,0|0,1,0]=3 853 B12R1.20 CC(N)C(O)C1=CC=C(Cl)C=C1 P39460 [0,2,0,0,0,0|0,1,0]=3 854 B12R1.20 CC1=CC=C(C(N)C(C)C)C=C1 P35720 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 O28686 [0,2,0,0,0,0|1,0,1]=4 856 B12R1.106 CC(C)(N)CC1=CC=C(F)C=C1 P42336 [0,2,0,0,0,0|0,0,0]=2 857 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 L20915 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.106 FC1=CC=C(C[B-](F)(F)F)C=C1 P51396 [0,2,0,0,0,0|2,0,0]=4 859 B12R1.106 NS(=O)(=O)CC1=CC=C(Cl)C=C1 P36442 [0,2,0,0,0,0|1,1,0]=4 860 B12R1.233 CC(C)NC1=CC=C(F)C=C1F P42072 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.233 CC(C)OC1=CC=C(F)C=C1Br Q67190 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.233 CC(C)OC1=CC=C(F)C=C1F Q67332 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 H-8931 [0,2,0,0,0,0|1,0,1]=4 864 B12R1.233 FC1=CC=C(OC(F)F)C(Br)=C1 O29616 [0,2,0,0,0,0|2,0,0]=4 865 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 P35874 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.5 CCC(O)C1=CC=C(OC)C=C1 P37583 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.5 COC1=CC=C(C(N)CO)C=C1 P41432 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.5 COC1=CC=C(C(O)CN)C=C1 P37470 [0,2,0,0,0,0|1,0,0]=3 869 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 P43091 [0,2,0,0,0,0|2,0,0]=4 870 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 P40188 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.9 CC(O)(CN)C1=CC=C(Br)C=C1 Q66028 [0,2,0,0,0,0|0,1,0]=3 872 B12R1.12 CCC(CC)C1=CC=C(N)C=C1 O30912 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.12 NCC(CN)C1=CC=C(F)C=C1 Q70068 [0,2,0,0,0,0|0,0,0]=2 874 B12R1.367 CC1=CC=C(C(N)CO)C=C1C P35197 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.367 CC1=CC=C(C(O)CN)C=C1C P36058 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.367 NC(CO)C1=CC=C(Cl)C(F)=C1 P42063 [0,2,0,0,0,0|1,1,0]=4 877 B12R1.367 NC(CO)C1=CC=C(F)C(Cl)=C1 P35017 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.367 NC(CO)C1=CC=C(F)C(F)=C1 P39677 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.367 NCC(=O)C1=CC=C(Cl)C(Cl)=C1 P38157 [0,2,0,0,0,0|0,1,1]=4 880 B12R1.367 NCC(=O)C1=CC=C(F)C(F)=C1 P42286 [0,2,0,0,0,0|0,0,1]=3 881 B12R1.367 NCC(O)C1=CC=C(Cl)C(Cl)=C1 P38572 [0,2,0,0,0,0|0,1,0]=3 882 B12R1.367 NCC(O)C1=CC=C(F)C(F)=C1 P43069 [0,2,0,0,0,0|0,0,0]=2 883 B12R1.367 N[C@@H](CO)C1=CC=C(F)C(Cl)=C1 P35016 [0,2,0,0,0,0|1,0,0]=3 884 B12R1.367 N[C@@H](CO)C1=CC=C(F)C(F)=C1 P39117 [0,2,0,0,0,0|1,0,0]=3 885 B12R1.367 N[C@H](CO)C1=CC=C(F)C(Cl)=C1 P37881 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.367 N[C@H](CO)C1=CC=C(F)C(F)=C1 P41874 [0,2,0,0,0,0|1,0,0]=3 887 B12R1.1703 CC1=CC=C(C(N)CO)C(C)=C1 P35198 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.1703 CC1=CC=C(C(O)CN)C(C)=C1 P41631 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.1703 CCC(=O)C1=CC=C(F)C=C1Cl O29563 [0,2,0,0,0,0|1,0,1]=4 890 B12R1.1703 NCC(=O)C1=CC=C(Cl)C=C1Cl P36823 [0,2,0,0,0,0|0,1,1]=4 891 B12R1.1703 NCC(=O)C1=CC=C(F)C=C1F P36056 [0,2,0,0,0,0|0,0,1]=3 892 B12R1.1703 NCC(O)C1=CC=C(Cl)C=C1Cl P35367 [0,2,0,0,0,0|0,1,0]=3 893 B12R1.1703 NCC(O)C1=CC=C(F)C=C1F P37724 [0,2,0,0,0,0|0,0,0]=2 894 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1Cl O31207 [0,2,0,0,0,0|1,0,1]=4 895 B12R1.112 CCOC1=CC=C(F)C=C1C=O Q68807 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.114 COC1=CC=C(CCN)C(F)=C1 P38246 [0,2,0,0,0,0|1,0,0]=3 897 B12R1.544 FC1=C(F)C(F)=C(CCBr)C=C1 L21645 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.1095 CCOC1=C(Cl)C=C(F)C=C1Br O29214 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.1095 FC1=CC(F)=C(CCBr)C(F)=C1 I-9716 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.1123 CCOC1=C(F)C=C(F)C(Br)=C1 Q68338 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.1123 CCOC1=CC(F)=C(F)C=C1Br Q67487 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.1123 FC1=CC(F)=C(CCBr)C=C1F I-9708 [0,2,0,0,0,0|1,0,0]=3 903 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 M23131 [0,2,0,0,0,0|1,0,0]=3 904 B12R1.113 NCCC1=CC=C(C(=O)O)C=C1 P37127 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 O30369 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.116 CCOC1=CC=C(CCN)C=C1 P36961 [0,2,0,0,0,0|1,0,0]=3 907 B12R1.116 CCOC1=CC=C(CCO)C=C1 O28110 [0,2,0,0,0,0|2,0,0]=4 908 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [1,0,0,1,0,0|2,0,0]=4 909 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [1,0,0,1,0,0|0,0,0]=2 910 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [1,0,0,1,0,0|2,0,0]=4 911 B10R2.7 C1=CC=C2CNCC2=C1 P44607 [1,0,0,1,0,0|2,0,0]=4 912 B10R2.7 C1=CN=C2CCNC2=C1 O29585 [1,0,0,1,0,0|1,0,0]=3 913 B10R2.7 C1=CN=C2NCCC2=C1 C-3425 [1,0,0,1,0,0|1,0,0]=3 914 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [1,0,0,1,0,0|0,0,0]=2 915 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 G-6479 [0,1,0,1,0,0|0,1,0]=3 916 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 P38383 [0,1,0,1,0,0|1,1,0]=4 917 B12R2.24 BrC1=CC2=C(CCNC2)N=C1 G-7628 [0,1,0,1,0,0|1,1,0]=4 918 B12R2.24 BrC1=CC2=C(CCNC2)N=C1 P51123 [0,1,0,1,0,0|1,1,0]=4 919 B12R2.24 BrC1=CC2=C(CCNC2)N=C1 Q52029 [0,1,0,1,0,0|1,1,0]=4 920 B12R2.24 BrC1=CC=C2CCNCC2=C1 G-6480 [0,1,0,1,0,0|0,1,0]=3 921 B12R2.24 BrC1=CC=C2CCNCC2=C1 G-6480-01 [0,1,0,1,0,0|0,1,0]=3 922 B12R2.24 BrC1=CC=C2CNCCC2=C1 L13599 [0,1,0,1,0,0|1,1,0]=4 923 B12R2.24 BrC1=CC=C2CNCCC2=C1 L14008 [0,1,0,1,0,0|1,1,0]=4 924 B12R2.24 BrC1=CC=C2NCCOC2=C1 O34410 [0,1,0,1,0,0|1,1,0]=4 925 B12R2.24 BrC1=CN=C2OCCNC2=C1 S72702 [0,1,0,1,0,0|1,1,0]=4 926 B12R2.24 BrC1=NC2=C(C=C1)OCCN2 P44709 [0,1,0,1,0,0|1,1,0]=4 927 B12R2.24 CC1=CC=C2CCCNC2=N1 O34003 [0,1,0,1,0,0|2,0,0]=4 928 B12R2.24 ClC1=CC2=C(CCNC2)N=C1 P51098 [0,1,0,1,0,0|1,1,0]=4 929 B12R2.24 IC1=CC2=C(C=C1)OCCC2 P36651 [0,1,0,1,0,0|1,1,0]=4 930 B12R2.24 IC1=CC=C2CCCNC2=C1 N25660 [0,1,0,1,0,0|0,1,0]=3 931 B12R2.24 NC1=CC2=C(CCNC2)N=C1 P51089 [0,1,0,1,0,0|2,0,0]=4 932 B12R2.24 NC1=CC2=C(CCNC2)N=C1 S72684 [0,1,0,1,0,0|2,0,0]=4 933 B12R2.24 OC1=CC2=C(C=C1)CNCC2 L18301 [0,1,0,1,0,0|2,0,0]=4 934 B12R2.24 OC1=CC=C2OCCOC2=C1 O33980 [0,1,0,1,0,0|2,0,0]=4 935 B12R2.79 CC1=CC=C(C2CC2N)C=C1 Q69960 [0,1,0,1,0,0|1,0,0]=3 936 B12R2.79 FC1=CC=C(C2CC2Br)C=C1 O29607 [0,1,0,1,0,0|1,0,0]=3 937 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 O34315 [0,1,0,1,0,0|0,1,0]=3 938 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 Q69959 [0,1,0,1,0,0|0,1,0]=3 939 B12R2.79 NC1CC1C2=CC=C(Cl)C=C2 Q69961 [0,1,0,1,0,0|0,1,0]=3 940 B12R2.79 NC1CC1C2=CC=C(F)C=C2 O34585 [0,1,0,1,0,0|0,0,0]=2 941 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 O34571 [0,1,0,1,0,0|0,0,0]=2 942 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 O34573 [0,1,0,1,0,0|0,0,0]=2 943 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(O)C=C2 L14742 [0,1,0,1,0,0|1,0,0]=3 944 B12R2.79 N[C@H]1C[C@@H]1C2=CN=C(Br)C=C2 L14757 [0,1,0,1,0,0|1,1,0]=4 945 B12R2.132 CC1=CC2=C(C=C1)CCC2N P38544 [0,1,0,1,0,0|1,0,0]=3 946 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 A-507 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.132 NC1=NNC2=C1C=C(F)C=C2 P51011 [0,1,0,1,0,0|1,0,1]=4 948 B12R2.132 NC1CCC2=C1C=C(Br)C=C2 P42338 [0,1,0,1,0,0|0,1,0]=3 949 B12R2.132 NC1CCC2=C1C=C(Cl)C=C2 P36711 [0,1,0,1,0,0|0,1,0]=3 950 B12R2.132 NC1CCC2=C1C=C(F)C=C2 M23347 [0,1,0,1,0,0|0,0,0]=2 951 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 L18503 [0,1,0,1,0,0|1,0,0]=3 952 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 I-9219 [0,1,0,1,0,0|1,1,0]=4 953 B12R2.132 O=C1CCC2=C1C=C(I)C=C2 P41205 [0,1,0,1,0,0|1,1,0]=4 954 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 A-509 [0,1,0,1,0,0|1,1,0]=4 955 B12R2.132 O=C1COC2=CC=C(F)C=C12 B-1139 [0,1,0,1,0,0|1,0,1]=4 956 B12R2.132 O=C1NCC2=C1C=C(F)C=C2 O33569 [0,1,0,1,0,0|1,0,1]=4 957 B12R2.132 OC1CCC2=C1C=C(Cl)C=C2 P37662 [0,1,0,1,0,0|1,1,0]=4 958 B12R2.132 OC1CCC2=CC=C(Br)C=C21 N24956 [0,1,0,1,0,0|1,1,0]=4 959 B12R2.294 BrC1=CC=C(OC2CC2)C=C1 P38401 [0,1,0,1,0,0|1,1,0]=4 960 B12R2.294 FC1=CC=C(NC2CC2)C=C1 P41523 [0,1,0,1,0,0|1,0,0]=3 961 B12R2.2302 BrC1=CC=C(C2CCC2)C=C1 N25053 [0,1,0,1,0,0|1,1,0]=4 962 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 P44403 [0,1,0,1,0,0|0,1,0]=3 963 B12R2.2302 BrC1=CC=C(C2COC2)C=C1 G-7440 [0,1,0,1,0,0|1,1,0]=4 964 B12R2.2302 NC1=CC=C(N2CCC2)C=C1 P38671 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.2302 OC1=CC=C(C2CCC2)C=C1 N25921 [0,1,0,1,0,0|2,0,0]=4 966 B12R2.606 CC1=CC2=C(C=C(F)C=C2)N1 Q69286 [0,1,0,1,0,0|0,0,2]=4 967 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 P44528 [0,1,0,1,0,0|1,0,1]=4 968 B12R2.606 NC1=NC2=CC=C(F)C=C2S1 M22877 [0,1,0,1,0,0|1,0,1]=4 969 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 G-5187 [0,1,0,1,0,0|0,1,1]=4 970 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 O30335 [0,1,0,1,0,0|1,0,1]=4 971 B12R2.606 O=C1CC2=CC=C(F)N=C2N1 Q55137 [0,1,0,1,0,0|1,0,1]=4 972 B12R2.606 O=C1CC2=CN=C(F)C=C2N1 Q53179 [0,1,0,1,0,0|1,0,1]=4 973 B12R2.606 O=C1CC2=NC=C(F)C=C2N1 10549 [0,1,0,1,0,0|1,0,1]=4 974 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 P37814 [0,1,0,1,0,0|2,0,0]=4 975 B12R2.290 NC1(C2=CC=C(Br)C=C2)CC1 P38660 [0,1,0,1,0,0|1,1,0]=4 976 B12R2.290 NC1(C2=CC=C(Cl)C=C2)CC1 P36388 [0,1,0,1,0,0|1,1,0]=4 977 B12R2.290 NC1(C2=CC=C(F)C=C2)CC1 P37943 [0,1,0,1,0,0|1,0,0]=3 978 B12R2.290 NC1(C2=CC=C(I)C=C2)CC1 P36947 [0,1,0,1,0,0|1,1,0]=4 979 B12R2.612 FC1=CC2=C(C=C1)C(Br)=NN2 O32918 [0,1,0,1,0,0|1,0,1]=4 980 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NN2 L21927 [0,1,0,1,0,0|1,0,1]=4 981 B12R2.612 FC1=CC2=C(C=C1)C(I)=NN2 O30390 [0,1,0,1,0,0|1,0,1]=4 982 B12R2.612 NC1CCC2=C1C=CC(Br)=C2 P40299 [0,1,0,1,0,0|1,1,0]=4 983 B12R2.612 NC1CCC2=C1C=CC(F)=C2 Q66157 [0,1,0,1,0,0|1,0,0]=3 984 B12R2.612 OC1CCC2=C1C=CC(Br)=C2 Q66199 [0,1,0,1,0,0|1,1,0]=4 985 B12R2.246 FC1=CC(Br)=C2CC=CC2=C1 L14632 [0,1,0,1,0,0|1,0,1]=4 986 B12R2.246 FC1=CC2=C(C=CN2)C(Br)=C1 L14887 [0,1,0,1,0,0|0,0,2]=4 987 B12R2.246 FC1=CC2=C(C=CN2)C(Cl)=C1 Q55399 [0,1,0,1,0,0|0,0,2]=4 988 B12R2.246 FC1=CC2=C(C=CN2)C(F)=C1 O32254 [0,1,0,1,0,0|0,0,2]=4 989 B12R2.246 FC1=CC2=C(C=NN2)C(Br)=C1 O30602 [0,1,0,1,0,0|1,0,1]=4 990 B12R2.246 FC1=CC2=C(C=NN2)C(F)=C1 M15093 [0,1,0,1,0,0|1,0,1]=4 991 B12R2.246 NC1=CC(F)=CC2=C1C=CN2 M24091 [0,1,0,1,0,0|0,0,2]=4 992 B12R2.246 OC1=CC(F)=CC2=C1C=CN2 Q55401 [0,1,0,1,0,0|0,0,2]=4 993 B12R2.1317 CC1=CC(F)=NC=C1C2CC2 N25398 [0,1,0,1,0,0|2,0,0]=4 994 B12R2.1317 ClC1=CC=C(C2CO2)C(Cl)=C1 P41495 [0,1,0,1,0,0|1,1,0]=4 995 B12R2.1317 FC1=CC(F)=C(C2CC2)C=C1 N26993 [0,1,0,1,0,0|1,0,0]=3 996 B12R2.9 O=CC1=CC=C(C2CC2)C=C1 O28320 [0,1,0,1,0,0|2,0,0]=4 997 B12R2.9 OCC1=CC=C(C2CC2)C=C1 O28315 [0,1,0,1,0,0|2,0,0]=4 998 B12R2.44 COC1=CC2=C(C=C1)CCN2 O34504 [0,1,0,1,0,0|1,0,0]=3 999 B12R2.44 N#CC1=CC2=C(C=C1)CCN2 O34342 [0,1,0,1,0,0|1,0,0]=3 1000 B12R2.82 CC1=C(F)C=CC2=C1NC=C2 O32895 [0,1,0,1,0,0|0,0,2]=4 1001 B12R2.82 FC1=C(Br)C2=C(C=CN2)C=C1 O32143 [0,1,0,1,0,0|0,0,2]=4 1002 B12R2.82 FC1=C(Br)C=CC2=C1NCC2 P47167 [0,1,0,1,0,0|0,1,0]=3 1003 B12R2.82 FC1=CC=C2C=NNC2=C1Cl N27284 [0,1,0,1,0,0|1,0,1]=4 1004 B12R2.82 NC1=C2NN=CC2=CC=C1F Q53619 [0,1,0,1,0,0|1,0,1]=4 1005 B12R2.100 CC1=CC2=C(C=C1F)NC=C2 M15088 [0,1,0,1,0,0|0,0,2]=4 1006 B12R2.100 FC1=C(Br)C=C2C=CNC2=C1 L13071 [0,1,0,1,0,0|0,0,2]=4 1007 B12R2.100 FC1=C(Br)C=C2C=NNC2=C1 H-8193 [0,1,0,1,0,0|1,0,1]=4 1008 B12R2.100 FC1=CC2=C(C=C1F)NC=C2 O32300 [0,1,0,1,0,0|0,0,2]=4 1009 B12R2.100 FC1=CC2=C(C=C1F)NCC2 M15600 [0,1,0,1,0,0|0,0,0]=2 1010 B12R2.100 FC1=CC2=C(C=CN2)C=C1Cl M15526 [0,1,0,1,0,0|0,0,2]=4 1011 B12R2.100 FC1=CC2=C(C=NN2)C=C1I Q69892 [0,1,0,1,0,0|1,0,1]=4 1012 B12R2.100 NC1=CC2=C(C=C1F)NC=C2 L14424 [0,1,0,1,0,0|0,0,2]=4 1013 B12R2.100 OC1=CC2=C(C=C1F)NN=C2 L14950 [0,1,0,1,0,0|1,0,1]=4 1014 B12R2.291 CC1=CC(C2CC2)=CC=C1Br N26041 [0,1,0,1,0,0|1,1,0]=4 1015 B12R2.291 ClC1=CC=C(C2CO2)C=C1Cl P37615 [0,1,0,1,0,0|1,1,0]=4 1016 B12R2.291 FC1=NC=C(C2CC2)C=C1I N26996 [0,1,0,1,0,0|2,0,0]=4 1017 B8R1.1 NCC1=CC(Br)=CS1 O33586 [1,0,0,0,1,0|1,1,0]=4 1018 B8R1.1 NCC1=CC(Cl)=CS1 L13105 [1,0,0,0,1,0|1,1,0]=4 1019 B8R1.1 NCC1=CC(Cl)=CS1 O31449 [1,0,0,0,1,0|1,1,0]=4 1020 B8R1.1 NCC1=CC=C(Br)S1 L14034 [1,0,0,0,1,0|1,1,0]=4 1021 B8R1.1 NCC1=CC=C(Cl)S1 I-9793 [1,0,0,0,1,0|1,1,0]=4 1022 B8R1.1 NCC1=CC=C(Cl)S1 P39739 [1,0,0,0,1,0|1,1,0]=4 1023 B8R1.1 NCC1=CC=C(F)S1 G-6513 [1,0,0,0,1,0|1,0,0]=3 1024 B8R1.1 NCC1=CSC(Br)=C1 O33369 [1,0,0,0,1,0|1,1,0]=4 1025 B8R1.1 NCC1=CSC(Br)=C1 O34212 [1,0,0,0,1,0|1,1,0]=4 1026 B8R1.1 NCC1=CSC(Cl)=C1 G-5520 [1,0,0,0,1,0|1,1,0]=4 1027 B8R1.1 NCC1=NNC(F)=C1 Q52442 [1,0,0,0,1,0|2,0,0]=4 1028 B8R1.1 OCC1=CC=C(F)S1 G-6512 [1,0,0,0,1,0|2,0,0]=4 1029 B8R1.8 NCCC1=CC=CO1 O34064 [1,0,0,0,1,0|1,0,0]=3 1030 B8R1.8 NCCC1=CSC=C1 G-7583 [1,0,0,0,1,0|1,0,0]=3 1031 B8R1.8 NCCN1C=CC=C1 P38998 [1,0,0,0,1,0|1,0,0]=3 1032 B8R1.8 NCCN1C=CC=N1 P43070 [1,0,0,0,1,0|2,0,0]=4 1033 B8R1.8 NCCN1C=CN=C1 O32262 [1,0,0,0,1,0|2,0,0]=4 1034 B8R1.8 NCCN1C=CN=C1 P37320 [1,0,0,0,1,0|2,0,0]=4 1035 B8R1.8 OCCC1=CC=CS1 I-9194 [1,0,0,0,1,0|2,0,0]=4