0 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 CC(N)C1=CC=NC=N1 Q51822 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.6 CC(N)C1=CC=NN=C1 G-7533 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 CC(N)C1=CC=NN=C1 L13924 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 CC(N)C1=CN=CN=C1 G-5168 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 CC(N)C1=CN=CN=C1 Q51812 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(N)C1=NC=CC=N1 Q55479 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 CC(O)C1=CN=CN=C1 Q55478 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.6 C[C@@H](N)C1=CN=CN=C1 I-9747 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.6 C[C@@H](N)C1=NC=CC=N1 Q57196 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 C[C@H](N)C1=CN=CN=C1 Q51933 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q57195 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q65669 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.6 O=S([O-])C1=CC=NC=C1 Q69553 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.6 OB(O)C1=CC=NC=C1 C-3686 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 OB(O)C1=CN=CN=C1 A-805 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.6 OB(O)C1=NC=NC=C1 H-8023 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.2 BrCC1=CC=CN=C1 P36550 [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 BrCC1=CN=CN=C1 Q65336 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 BrCC1=NC=NC=C1 P51553 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.2 C#CC1=CC=NC=C1 G-7546 [1,0,0,0,0,0|1,0,2]=4 41 B8R1.2 C#CC1=CC=NC=C1 L13525 [1,0,0,0,0,0|1,0,2]=4 42 B8R1.2 C=CC1=CC=CN=C1 O30687 [1,0,0,0,0,0|1,0,2]=4 43 B8R1.2 CNC1=CC=NC=N1 Q58573 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 CNC1=CN=CN=C1 L13923 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 CNC1=NN=CC=C1 O29994 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.2 COC1=CN=CN=C1 M15459 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.2 ClCC1=CC=CN=N1 C-2225 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.2 ClCC1=CN=CC=N1 C-2219 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.2 ClCC1=CN=CN=C1 C-2216 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.2 ClCC1=NC=CC=N1 C-2222 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.2 ClCC1=NC=CN=C1 L14125 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.2 ICC1=CC=CC=C1 P37031 [1,0,0,0,0,0|1,0,0]=2 53 B8R1.2 N#CC1=CC=NC=C1 Q58209 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 NCC1=CC=CN=N1 L21914 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 NCC1=CC=NC=C1 O30621 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.2 NCC1=CC=NC=N1 C-2474 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 NCC1=CC=NC=N1 L13752 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 NCC1=CC=NN=C1 C-3221 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 NCC1=CC=NN=C1 C-3221-01 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 NCC1=CN=CN=C1 C-3222 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.2 NCC1=CN=CN=C1 L14043 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 NCC1=NC=CC=N1 C-3224 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 NCC1=NC=CC=N1 C-3224-1 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.2 NCC1=NC=CN=C1 C-3223 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.2 NCC1=NN=CC=C1 C-2473 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.2 NNC1=CC=CN=C1 C-3227 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.2 NNC1=CC=NC=C1 C-3226 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 NNC1=CC=NC=C1 L19135 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 NNC1=CC=NC=C1 O31964 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 OCC1=CC=CN=N1 C-2224 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.2 OCC1=CC=NC=N1 C-2228 [1,0,0,0,0,0|2,0,0]=3 72 B8R1.2 OCC1=CC=NN=C1 C-2213 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.2 OCC1=CN=CC=N1 C-2217 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.2 OCC1=CN=CN=C1 C-2215 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.2 OCC1=NC=CC=N1 C-2220 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [0,1,0,0,0,0|1,0,2]=4 77 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [0,1,0,0,0,0|1,0,2]=4 78 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [0,1,0,0,0,0|1,0,2]=4 79 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [0,1,0,0,0,0|1,0,2]=4 80 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [0,1,0,0,0,0|1,0,2]=4 81 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [0,1,0,0,0,0|1,0,2]=4 82 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [0,1,0,0,0,0|1,0,2]=4 83 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [0,1,0,0,0,0|1,0,2]=4 84 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [0,1,0,0,0,0|1,0,0]=2 85 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [0,1,0,0,0,0|1,0,0]=2 86 B10R1.13 CC(C)C1=CN=C(N)C=C1 O34069 [0,1,0,0,0,0|2,0,0]=3 87 B10R1.13 CC(C)C1=CN=C(N)N=C1 Q52535 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 CC(C)C1=NC=C(Br)C=N1 L21812 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.13 CC(C)C1=NC=C(N)C=C1 G-7522 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.13 CC(C)C1=NN=C(Br)C=C1 P51559 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.13 CC(N)C1=NC=C(Br)C=N1 Q58772 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.13 CC(N)C1=NC=C(F)C=C1 C-3369 [0,1,0,0,0,0|2,0,0]=3 94 B10R1.13 CC(N)C1=NC=C(F)C=N1 L14507 [0,1,0,0,0,0|3,0,0]=4 95 B10R1.13 CC(N)C1=NC=C(F)C=N1 P51601 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [0,1,0,0,0,0|1,0,0]=2 97 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [0,1,0,0,0,0|0,0,0]=1 98 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [0,1,0,0,0,0|0,0,0]=1 99 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.13 CC(O)C1=CN=C(Cl)N=C1 L14659 [0,1,0,0,0,0|2,0,0]=3 101 B10R1.13 CC(O)C1=NC=C(F)C=N1 P51653 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [0,1,0,0,0,0|1,0,0]=2 103 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.13 CC1=NC=C(B(O)O)C=C1 Q66950 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.13 CN(C)C1=CC=C(Br)N=C1 O30431 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.13 CN(C)C1=NC=C(Br)C=C1 P39265 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.13 CN(C)C1=NC=C(I)C=C1 N26187 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.13 CN(C)C1=NC=C(N)C=C1 I-9568 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 C[C@@H](N)C1=CN=C(Cl)N=C1 F-4669 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 O32464 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 O32601 [0,1,0,0,0,0|3,0,0]=4 114 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 Q55738 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 NC1=CC=C(B(O)O)C=C1 Q66344 [0,1,0,0,0,0|2,0,0]=3 119 B10R1.13 NC1=CC=C(B(O)O)C=N1 G-5207 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 NC1=CC=C(C(F)F)C=N1 Q62377 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [0,1,0,0,0,0|2,0,1]=4 127 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.13 OB(O)C1=CC=C(O)N=C1 Q68881 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.13 OB(O)C1=CC=C(S)C=C1 P39473 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.13 OB(O)C1=CN=C(F)C=C1 P51343 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.13 OB(O)C1=NC=C(Br)C=C1 Q53805 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 OB(O)C1=NC=C(F)C=C1 O33560 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [0,1,0,0,0,0|0,0,3]=4 134 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [0,1,0,0,0,0|1,0,2]=4 135 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [0,1,0,0,0,0|1,0,2]=4 136 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [0,1,0,0,0,0|1,0,2]=4 137 B10R1.15 CCC(N)C1=CC=CC=C1 P39015 [0,1,0,0,0,0|1,0,0]=2 138 B10R1.15 CCC(N)C1=NC=CN=C1 L13036 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 P40939 [0,1,0,0,0,0|0,0,0]=1 140 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 P40176 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.15 CN[C@H](C)C1=CC=CC=C1 P37197 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.15 N#CC(N)C1=CC=NC=C1 F-4703 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.15 N=C(NN)C1=CC=CC=C1 O30004 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.15 NC(CO)C1=CC=NC=C1 Q53510 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.15 NCC(N)C1=CC=CC=C1 P40726 [0,1,0,0,0,0|1,0,0]=2 146 B10R1.15 NCC(O)C1=CC=CN=C1 O32747 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.15 NCC(O)C1=CC=CN=C1 P43089 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.15 NCC(O)C1=CC=NC=C1 P35258 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.15 NCC(O)C1=NC=CC=C1 P35259 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 P43243 [0,1,0,0,0,0|0,0,0]=1 151 B10R1.15 NC[C@H](O)C1=CC=CC=C1 P43317 [0,1,0,0,0,0|0,0,0]=1 152 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [0,1,0,0,0,0|1,0,2]=4 153 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.15 OC(CCl)C1=CC=CN=C1 O32660 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.28 CC(C)(N)C1=CC=CN=C1 S72454 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32487 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32488 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.28 CC(C)(N)C1=NC=CC=C1 O32489 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.28 CC(C)(O)C1=NC=CC=C1 M15802 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.28 FC(F)(F)C1=CC=NC=C1 Q52570 [0,1,0,0,0,0|3,0,0]=4 162 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [0,1,0,0,0,0|1,0,2]=4 165 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [0,1,0,0,0,0|1,0,2]=4 166 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [0,1,0,0,0,0|1,0,2]=4 167 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [0,1,0,0,0,0|1,0,2]=4 168 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [0,1,0,0,0,0|1,0,2]=4 169 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [0,1,0,0,0,0|1,0,2]=4 170 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [0,1,0,0,0,0|1,0,2]=4 171 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [0,1,0,0,0,0|1,0,2]=4 172 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [0,1,0,0,0,0|1,0,2]=4 173 B10R1.61 CC(Br)C1=CC=CC=C1F O31043 [0,1,0,0,0,0|1,0,0]=2 174 B10R1.61 CC(C)C1=C(Br)C=NC=C1 Q54489 [0,1,0,0,0,0|2,0,0]=3 175 B10R1.61 CC(C)C1=CC=CN=C1N O33456 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.61 CC(C)C1=CC=NN=C1N Q69566 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.61 CC(C)C1=NC=CN=C1N K12340 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.61 CC(C)C1=NC=NC=C1N Q69561 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.61 CC(Cl)C1=CC=CC=C1Cl P40025 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.61 CC(N)C1=CC=CC=C1Br O34378 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.61 CC(N)C1=CC=CC=C1Cl P38305 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.61 CC(N)C1=CC=CC=C1F P36297 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.61 CC(N)C1=CC=CC=C1N P38310 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.61 CC(O)C1=C(F)C=NC=C1 Q65366 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.61 CC(O)C1=CC=CN=C1Br O30716 [0,1,0,0,0,0|1,0,0]=2 186 B10R1.61 CC(O)C1=CC=CN=C1Cl P41711 [0,1,0,0,0,0|1,0,0]=2 187 B10R1.61 CC(O)C1=CC=CN=C1F N26796 [0,1,0,0,0,0|1,0,0]=2 188 B10R1.61 CC1=C(B(O)O)C=CN=C1 I-9950 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.61 CC1=C(B(O)O)C=NC=C1 Q66522 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.61 CC1=C(C(=O)O)C=CN=C1 Q56301 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.61 CC1=CC=CC=C1C(C)N P38147 [0,1,0,0,0,0|1,0,0]=2 192 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.61 CC1=NC=CC=C1B(O)O N24577 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.61 CC1=NC=CC=C1B(O)O P43526 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [0,1,0,0,0,0|2,0,1]=4 196 B10R1.61 CC1=NC=NC=C1C(C)Cl Q58770 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.61 CN(C)C1=CC=CC=C1O P38469 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 H-8943 [0,1,0,0,0,0|0,0,0]=1 199 B10R1.61 C[C@@H](O)C1=CC=CN=C1N Q62533 [0,1,0,0,0,0|1,0,0]=2 200 B10R1.61 C[C@H](N)C1=CC=CC=C1Br P51405 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl P41701 [0,1,0,0,0,0|0,0,0]=1 202 B10R1.61 C[C@H](O)C1=CC=CN=C1N Q62532 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.61 FC(F)C1=C(Br)C=CN=C1 O30102 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.61 FC(F)C1=C(Br)C=NC=C1 O30389 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.61 FC(F)C1=CC=CN=C1Br O31963 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.61 N=C(N)C1=CC=CC=C1F P51589 [0,1,0,0,0,0|2,0,1]=4 207 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72547 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.61 NC1=C(B(O)O)C=NC=C1 S72548 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.61 NC1=C(C(=O)O)C=CN=C1 G-6779 [0,1,0,0,0,0|2,0,1]=4 210 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [0,1,0,0,0,0|2,0,1]=4 211 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [0,1,0,0,0,0|2,0,1]=4 212 B10R1.61 NC1=NC=CC=C1B(O)O Q68886 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 G-5495 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [0,1,0,0,0,0|2,0,1]=4 216 B10R1.61 O=C(O)C1=C(F)C=NC=C1 G-7559 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.61 O=C(O)C1=C(I)C=NC=C1 O31943 [0,1,0,0,0,0|2,0,1]=4 218 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.61 O=C1NC=CC=C1B(O)O G-7460 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N25518 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.61 OB(O)C1=C(Br)C=CN=C1 N26550 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.61 OB(O)C1=C(Br)C=CN=C1 O29115 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.61 OB(O)C1=C(Br)C=NC=C1 Q66417 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 M24062 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 N24124 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.61 OB(O)C1=C(F)C=CN=C1 Q54495 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.61 OB(O)C1=C(F)C=NC=C1 N24272 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.61 OB(O)C1=CC=CC=C1I Q67114 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.61 OB(O)C1=CC=CN=C1Br Q66269 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.61 OB(O)C1=NC=CC=C1F Q53806 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.61 OB(O)C1=NC=CC=C1O Q62472 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.113 C=C(C)C1=CC(C)=CC=C1 P42602 [0,1,0,0,0,0|1,0,1]=3 235 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [0,1,0,0,0,0|1,0,2]=4 236 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [0,1,0,0,0,0|1,0,2]=4 237 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [0,1,0,0,0,0|1,0,2]=4 238 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [0,1,0,0,0,0|1,0,2]=4 239 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [0,1,0,0,0,0|1,0,2]=4 240 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [0,1,0,0,0,0|1,0,2]=4 241 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 Q52823 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.113 CC(C)C1=CC(O)=NC=C1 Q52824 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.113 CC(C)C1=CC=CC(I)=N1 N26566 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.113 CC(C)C1=CN=CC(O)=C1 Q52825 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.113 CC(N)C1=CC(N)=CC=C1 P41777 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.113 CC(N)C1=CC(O)=CC=C1 P36908 [0,1,0,0,0,0|1,0,0]=2 247 B10R1.113 CC(N)C1=CC=CC(Br)=C1 O34417 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.113 CC(N)C1=CC=CC(Br)=C1 P36288 [0,1,0,0,0,0|1,0,0]=2 249 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 P39424 [0,1,0,0,0,0|1,0,0]=2 250 B10R1.113 CC(N)C1=CC=CC(F)=C1 P36296 [0,1,0,0,0,0|1,0,0]=2 251 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58352 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.113 CC(N)C1=CN=CC(F)=C1 Q58353 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.113 CC(O)C1=CC(Cl)=NC=C1 P42079 [0,1,0,0,0,0|1,0,0]=2 254 B10R1.113 CC(O)C1=NC=CC(Br)=C1 Q53431 [0,1,0,0,0,0|1,0,0]=2 255 B10R1.113 CC1=CC(C(C)N)=CC=C1 O30538 [0,1,0,0,0,0|1,0,0]=2 256 B10R1.113 CC1=CC(C(C)N)=CC=C1 P36543 [0,1,0,0,0,0|1,0,0]=2 257 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.113 CC1=NC(C(C)N)=NC=C1 Q58773 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.113 CC1=NC([C@@H](C)N)=CC=C1 Q58193 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.113 CC1=NC([C@H](C)N)=CC=C1 Q58196 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.113 CC1=NC=CC(B(O)O)=C1 O30330 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.113 CC1=NC=NC(C(C)N)=C1 Q56712 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N24376 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 M23880 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.113 CN(C)C1=CC=CC(F)=C1 P39813 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.113 CN(C)C1=NC=CC(N)=C1 M23713 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.113 C[C@@H](N)C1=CC(Cl)=NC=C1 F-4328 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 O29507 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 P43499 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 P51333 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 P51219 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.113 FC(F)C1=CC=CC(Br)=N1 Q52729 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.113 FC(F)C1=NC=CC(Br)=C1 O31681 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 P37042 [0,1,0,0,0,0|1,0,2]=4 275 B10R1.113 NC1=CN=CC(B(O)O)=C1 Q68878 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.113 NC1=CN=CC(C(F)F)=C1 Q57452 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.113 NC1=NC=CC(B(O)O)=C1 Q52829 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.113 NC1=NC=CC(C(=O)O)=C1 G-6760 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.113 NC1=NC=CC(C(F)F)=C1 L13093 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [0,1,0,0,0,0|2,0,1]=4 286 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [0,1,0,0,0,0|2,0,1]=4 288 B10R1.113 OB(O)C1=CC(Br)=CN=C1 P38023 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.113 OB(O)C1=CC(Cl)=CC=N1 Q53792 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.113 OB(O)C1=CC(F)=NC=C1 Q66308 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.113 OB(O)C1=CC(O)=CN=C1 Q68880 [0,1,0,0,0,0|3,0,0]=4 292 B10R1.113 OB(O)C1=CC=CC(I)=C1 Q66503 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.113 OB(O)C1=CC=NC(O)=C1 Q53788 [0,1,0,0,0,0|3,0,0]=4 294 B10R1.113 OB(O)C1=CN=CC(F)=C1 F-4263 [0,1,0,0,0,0|3,0,0]=4 295 B10R1.113 OB(O)C1=NC(Br)=CC=C1 Q53725 [0,1,0,0,0,0|3,0,0]=4 296 B10R1.113 OB(O)C1=NC(Cl)=CC=C1 A-717 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.113 OC1=CC(C(F)F)=NC=C1 O31481 [0,1,0,0,0,0|3,0,0]=4 298 B10R2.6 C1=CC(C2CC2)=CC=N1 N25361 [0,0,0,1,0,0|2,0,0]=3 299 B10R2.6 C1=CC=C(C2CN2)C=C1 P41085 [0,0,0,1,0,0|1,0,0]=2 300 B10R2.6 C1=CN=C(C2CC2)C=C1 K12338 [0,0,0,1,0,0|2,0,0]=3 301 B10R2.320 NC1CC2=C1C=CC=C2 L19725 [0,0,0,1,0,0|1,0,0]=2 302 B8R1.7 CC(C)C1=CC=CO1 A-982 [0,0,0,0,1,0|2,0,0]=3 303 B8R1.7 CC(C)N1C=CC=N1 Q67289 [0,0,0,0,1,0|3,0,0]=4 304 B8R1.7 CC(N)C1=CC=NN1 O29815 [0,0,0,0,1,0|3,0,0]=4 305 B8R1.7 CC(N)C1=NC=CS1 P51364 [0,0,0,0,1,0|3,0,0]=4 306 B8R1.7 CC(O)C1=CN=CS1 O32402 [0,0,0,0,1,0|2,0,0]=3 307 B8R1.7 CC(O)C1=CSC=C1 O31068 [0,0,0,0,1,0|1,0,0]=2 308 B8R1.7 C[C@@H](N)C1=NC=CS1 P51442 [0,0,0,0,1,0|3,0,0]=4 309 B8R1.7 C[C@@H](O)C1=CNN=C1 Q64405 [0,0,0,0,1,0|2,0,0]=3 310 B8R1.7 C[C@H](N)C1=CN=CO1 L19494 [0,0,0,0,1,0|3,0,0]=4 311 B8R1.7 C[C@H](N)C1=NC=CS1 P51443 [0,0,0,0,1,0|3,0,0]=4 312 B8R1.7 C[C@H](O)C1=CNN=C1 Q64406 [0,0,0,0,1,0|2,0,0]=3 313 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [0,0,0,0,0,1|1,0,2]=4 314 B10R1.18 CC(C)NC1=NN=CC=C1 O31988 [0,0,0,0,0,1|3,0,0]=4 315 B10R1.18 CC(C)OC1=NC=CC=C1 N24110 [0,0,0,0,0,1|2,0,0]=3 316 B10R1.18 FC(F)OC1=NC=CC=C1 O32452 [0,0,0,0,0,1|3,0,0]=4 317 B7R1.3 CC1=CC=CN=N1 G-5190 [2,0,0,0,0,0|2,0,0]=4 318 B7R1.3 CC1=CN=CN=C1 O30773 [2,0,0,0,0,0|2,0,0]=4 319 B7R1.3 CC1=CN=NC=C1 G-5111 [2,0,0,0,0,0|2,0,0]=4 320 B7R1.3 CC1=NC=CC=N1 Q60049 [2,0,0,0,0,0|2,0,0]=4 321 B7R1.3 CC1=NC=NC=C1 G-5230 [2,0,0,0,0,0|2,0,0]=4 322 B7R1.3 OC1=CC=NN=C1 H-8637 [2,0,0,0,0,0|2,0,0]=4 323 B7R1.3 OC1=CN=CN=C1 I-9410 [2,0,0,0,0,0|2,0,0]=4 324 B7R1.3 OC1=CN=CN=C1 N25469 [2,0,0,0,0,0|2,0,0]=4 325 B7R1.3 SC1=CC=CN=C1 Q62383 [2,0,0,0,0,0|1,1,0]=4 326 B9R1.1 BrCC1=CN=C(Br)C=C1 M23057 [1,1,0,0,0,0|2,0,0]=4 327 B9R1.1 BrCC1=NC=C(Br)C=C1 O32745 [1,1,0,0,0,0|2,0,0]=4 328 B9R1.1 C#CC1=CC=C(Br)C=C1 P36174 [1,1,0,0,0,0|0,0,2]=4 329 B9R1.1 C#CC1=CC=C(Cl)C=C1 C-3288 [1,1,0,0,0,0|0,0,2]=4 330 B9R1.1 C#CC1=CC=C(I)C=C1 P36173 [1,1,0,0,0,0|0,0,2]=4 331 B9R1.1 CC1=CC=C(CN)C=N1 C-3518 [1,1,0,0,0,0|2,0,0]=4 332 B9R1.1 CC1=CC=C(CO)C=N1 H-8186 [1,1,0,0,0,0|1,0,0]=3 333 B9R1.1 CC1=CN=C(CO)C=C1 N24952 [1,1,0,0,0,0|1,0,0]=3 334 B9R1.1 CC1=CN=C(CO)N=C1 G-6318 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.1 CC1=NC=C(CO)C=N1 A-728 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.1 CCC1=CC=C(Br)N=C1 Q57112 [1,1,0,0,0,0|1,0,0]=3 337 B9R1.1 CCC1=CC=C(Cl)N=C1 Q57111 [1,1,0,0,0,0|1,0,0]=3 338 B9R1.1 CCC1=CC=C(N)C=N1 A-656 [1,1,0,0,0,0|1,0,0]=3 339 B9R1.1 CCC1=CN=C(Cl)N=C1 G-6620 [1,1,0,0,0,0|2,0,0]=4 340 B9R1.1 CCC1=NC=C(Br)C=C1 G-6695 [1,1,0,0,0,0|1,0,0]=3 341 B9R1.1 CCC1=NC=C(Br)C=N1 O33428 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.1 CCC1=NC=C(N)C=N1 G-7879 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.1 CNC1=CC=C(Br)N=C1 Q65482 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.1 CNC1=CC=C(F)C=N1 Q58345 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [1,1,0,0,0,0|1,0,0]=3 346 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [1,1,0,0,0,0|1,0,0]=3 347 B9R1.1 CNC1=CC=C(N)N=C1 Q58290 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.1 CNC1=CC=C(N)N=C1 Q58291 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [1,1,0,0,0,0|1,0,0]=3 350 B9R1.1 CNC1=NC=C(Br)C=C1 P35851 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.1 COC1=CN=C(Br)C=C1 Q67224 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.1 COC1=CN=C(Cl)C=C1 Q67222 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.1 COC1=CN=C(F)C=C1 N24701 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.1 COC1=CN=C(N)C=C1 G-7588 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.1 COC1=NC=C(C)C=C1 Q67071 [1,1,0,0,0,0|2,0,0]=4 356 B9R1.1 COC1=NC=C(F)C=C1 P37735 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.1 COC1=NC=C(I)C=C1 Q67264 [1,1,0,0,0,0|2,0,0]=4 358 B9R1.1 COC1=NC=C(O)C=C1 Q67584 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.1 CSC1=CN=C(Br)C=C1 N24931 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.1 CSC1=CN=C(F)C=C1 N26916 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.1 CSC1=NC=C(Br)C=C1 Q66696 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.1 CSC1=NC=C(C)C=C1 N24295 [1,1,0,0,0,0|2,0,0]=4 363 B9R1.1 CSC1=NC=C(Cl)C=C1 N24817 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.1 ClC1=CN=C(CBr)C=C1 L18293 [1,1,0,0,0,0|2,0,0]=4 365 B9R1.1 ClCC1=CN=C(Br)C=C1 O34227 [1,1,0,0,0,0|2,0,0]=4 366 B9R1.1 FC1=CN=C(CCl)C=C1 Q60053 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.1 FC1=NC=C(CBr)C=C1 G-6035 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.1 FC1=NC=C(CCl)C=C1 F-4121 [1,1,0,0,0,0|2,0,0]=4 369 B9R1.1 N#CC1=CC=C(S)C=C1 O30392 [1,1,0,0,0,0|1,0,1]=4 370 B9R1.1 NC1=CN=C(CO)N=C1 Q52401 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.1 NC1=NC=C(CO)C=C1 E-3098 [1,1,0,0,0,0|1,0,0]=3 372 B9R1.1 NC1=NC=C(CO)C=N1 I-9630 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [1,1,0,0,0,0|1,0,0]=3 374 B9R1.1 NCC1=CC=C(O)C=N1 O29328 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.1 NCC1=CC=C(O)C=N1 O31467 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.1 NCC1=CN=C(Cl)C=C1 C-3459 [1,1,0,0,0,0|2,0,0]=4 377 B9R1.1 NCC1=CN=C(F)C=C1 L18071 [1,1,0,0,0,0|2,0,0]=4 378 B9R1.1 NCC1=CN=C(N)C=C1 Q62313 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.1 NCC1=CNC(=O)C=C1 G-5535 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.1 NCC1=NC=C(Br)C=C1 G-7736 [1,1,0,0,0,0|2,0,0]=4 381 B9R1.1 NCC1=NC=C(Br)C=C1 L14589 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.1 NCC1=NC=C(Br)C=C1 O30462 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.1 NCC1=NC=C(Cl)C=C1 O30447 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.1 NCC1=NC=C(Cl)C=C1 O31783 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.1 NCC1=NC=C(Cl)C=C1 P36637 [1,1,0,0,0,0|2,0,0]=4 386 B9R1.1 NCC1=NC=C(F)C=C1 P37408 [1,1,0,0,0,0|2,0,0]=4 387 B9R1.1 NNC1=CC=C(Br)C=C1 P38159 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.1 NNC1=CC=C(F)C=C1 P38478 [1,1,0,0,0,0|2,0,0]=4 389 B9R1.1 OCC1=CC=C(Br)N=C1 O34239 [1,1,0,0,0,0|1,0,0]=3 390 B9R1.1 OCC1=CC=C(Cl)N=N1 I-9934 [1,1,0,0,0,0|2,0,0]=4 391 B9R1.1 OCC1=CC=C(F)N=C1 O30867 [1,1,0,0,0,0|1,0,0]=3 392 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [1,1,0,0,0,0|0,0,0]=2 393 B9R1.1 OCC1=CN=C(Cl)N=C1 C-2773 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.1 OCC1=NC=C(Br)C=N1 L22275 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.1 OCC1=NC=C(Cl)C=C1 N24430 [1,1,0,0,0,0|1,0,0]=3 396 B9R1.1 OCC1=NC=C(Cl)C=N1 O33482 [1,1,0,0,0,0|2,0,0]=4 397 B9R1.1 OCC1=NC=C(Cl)N=C1 G-5313 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.1 OCC1=NC=C(F)C=C1 C-3467 [1,1,0,0,0,0|1,0,0]=3 399 B9R1.1 OCC1=NC=C(F)C=N1 G-6053 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.2 BrCC1=CC=CC(Br)=N1 P35902 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.2 C#CC1=CC(O)=CC=C1 P42883 [1,1,0,0,0,0|0,0,2]=4 402 B9R1.2 C#CC1=CC=CC(Br)=C1 O27910 [1,1,0,0,0,0|0,0,2]=4 403 B9R1.2 C#CC1=CC=CC(C)=C1 P36176 [1,1,0,0,0,0|0,0,2]=4 404 B9R1.2 CC1=CC(CN)=CC=N1 Q62498 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.2 CC1=CC(CN)=NC=C1 O29857 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.2 CC1=CC(CN)=NC=C1 O31684 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.2 CC1=CC=CC(CN)=N1 P35737 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.2 CC1=CC=CC(CN)=N1 P36768 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.2 CC1=CN=CC(CCl)=C1 O33584 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.2 CC1=CN=CC(CO)=C1 I-9425 [1,1,0,0,0,0|1,0,0]=3 411 B9R1.2 CC1=CN=NC(CO)=C1 Q56709 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.2 CC1=NC(CO)=NC=C1 G-7252 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.2 CC1=NC=CC(CN)=C1 O31522 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.2 CC1=NC=CC(CO)=C1 O30864 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.2 CC1=NC=CC(CO)=N1 Q58594 [1,1,0,0,0,0|2,0,0]=4 416 B9R1.2 CC1=NC=NC(CO)=C1 G-7256 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.2 CCC1=CC(Br)=NC=C1 P45487 [1,1,0,0,0,0|1,0,0]=3 418 B9R1.2 CCC1=CC(Cl)=NC=N1 P51150 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.2 CCC1=CC=CC(Br)=N1 Q52717 [1,1,0,0,0,0|1,0,0]=3 420 B9R1.2 CCC1=CC=CC(Cl)=N1 Q62319 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.2 CCC1=CC=CC(F)=N1 Q62318 [1,1,0,0,0,0|1,0,0]=3 422 B9R1.2 CCC1=NC=CC(Cl)=N1 L18383 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.2 CCC1=NC=CC(N)=C1 L18226 [1,1,0,0,0,0|1,0,0]=3 424 B9R1.2 CNC1=CC(Br)=CN=C1 P51196 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.2 CNC1=CC(C)=CC=N1 Q58361 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.2 CNC1=CC(C)=CC=N1 Q58362 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.2 CNC1=CC(O)=CC=C1 P41161 [1,1,0,0,0,0|1,0,0]=3 428 B9R1.2 CNC1=CC=CC(F)=N1 Q58333 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.2 CNC1=CC=CC(I)=C1 P37043 [1,1,0,0,0,0|1,0,0]=3 430 B9R1.2 CNC1=NC=CC(I)=C1 N26836 [1,1,0,0,0,0|2,0,0]=4 431 B9R1.2 COC1=CC(C)=CN=C1 N25271 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.2 COC1=CC(F)=NC=C1 Q67856 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.2 COC1=CC(N)=CN=C1 Q56314 [1,1,0,0,0,0|2,0,0]=4 434 B9R1.2 COC1=CC=CC(I)=N1 O32550 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.2 COC1=CN=CC(Cl)=C1 S70722 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.2 COC1=CN=CC(N)=C1 G-6107 [1,1,0,0,0,0|2,0,0]=4 437 B9R1.2 COC1=CN=CC(O)=C1 O31805 [1,1,0,0,0,0|2,0,0]=4 438 B9R1.2 COC1=NC=CC(Br)=C1 Q67517 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.2 COC1=NC=CC(Cl)=C1 Q68014 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.2 COC1=NC=CC(I)=C1 Q67717 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.2 COC1=NC=CC(N)=C1 G-5580 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.2 COC1=NC=CC(O)=C1 N25339 [1,1,0,0,0,0|2,0,0]=4 443 B9R1.2 CSC1=CC(F)=NC=C1 N26858 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.2 CSC1=CC=CC(Br)=N1 P51643 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.2 CSC1=CN=CC(Br)=C1 Q67547 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.2 CSC1=CN=CC(Cl)=C1 N26275 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.2 CSC1=CN=CC(O)=C1 N26050 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.2 ClC1=CN=CC(CBr)=C1 Q53180 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.2 ClC1=NC(CBr)=CC=C1 N26153 [1,1,0,0,0,0|2,0,0]=4 450 B9R1.2 ClCC1=CC(Cl)=CN=C1 F-4077 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.2 ClCC1=CC(Cl)=NC=C1 I-9215 [1,1,0,0,0,0|2,0,0]=4 452 B9R1.2 ClCC1=CN=CC(Cl)=C1 Q53715 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.2 FC1=CN=CC(CCl)=C1 C-3497 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.2 NC1=CC(C=O)=CC=C1 O30581 [1,1,0,0,0,0|0,0,2]=4 455 B9R1.2 NC1=CC(CO)=NC=C1 P43136 [1,1,0,0,0,0|1,0,0]=3 456 B9R1.2 NC1=CC(CO)=NC=N1 Q57201 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.2 NC1=NC=CC(CO)=C1 G-7574 [1,1,0,0,0,0|1,0,0]=3 458 B9R1.2 NCC1=CC(=O)NC=C1 C-3609 [1,1,0,0,0,0|2,0,0]=4 459 B9R1.2 NCC1=CC(=O)NC=C1 P44155 [1,1,0,0,0,0|2,0,0]=4 460 B9R1.2 NCC1=CC(Br)=CN=C1 O31870 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.2 NCC1=CC(Cl)=NC=C1 I-9257 [1,1,0,0,0,0|2,0,0]=4 462 B9R1.2 NCC1=CC(Cl)=NC=C1 L22480 [1,1,0,0,0,0|2,0,0]=4 463 B9R1.2 NCC1=CC(F)=CC=N1 Q52932 [1,1,0,0,0,0|2,0,0]=4 464 B9R1.2 NCC1=CC(F)=NC=C1 O29911 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.2 NCC1=CC(F)=NC=C1 O31041 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.2 NCC1=CC(O)=CC=C1 P36367 [1,1,0,0,0,0|1,0,0]=3 467 B9R1.2 NCC1=CC=CC(=O)N1 O30155 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.2 NCC1=CC=CC(F)=C1 N26365 [1,1,0,0,0,0|1,0,0]=3 469 B9R1.2 NCC1=CN=CC(F)=C1 C-3498 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.2 NCC1=CN=CC(N)=C1 O29974 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.2 NCC1=CN=CC(N)=C1 O31108 [1,1,0,0,0,0|2,0,0]=4 472 B9R1.2 NCC1=C[N+]([O-])=CC=C1 Q55759 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.2 NCC1=NC(Br)=CC=C1 O34414 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.2 NCC1=NC(F)=CC=C1 O30290 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.2 NCC1=NC(F)=CC=C1 O31621 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.2 NCC1=NC(N)=CC=C1 L20065 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.2 NCC1=NC(N)=CC=C1 Q62425 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.2 NCC1=NC(N)=CC=C1 Q62426 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.2 NCC1=NC=CC(Br)=C1 G-5659 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.2 NCC1=NC=CC(Br)=C1 O33288 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.2 NCC1=NC=CC(Br)=C1 Q51926 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.2 NCC1=NC=CC(Cl)=C1 I-9896 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.2 NCC1=NC=CC(Cl)=C1 Q56342 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.2 NCC1=NC=CC(F)=C1 O29654 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.2 NCC1=NC=CC(O)=C1 O29566 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.2 O=C1C=C(CO)C=CN1 C-2797 [1,1,0,0,0,0|1,0,0]=3 487 B9R1.2 O=C1C=CC=C(CO)N1 Q52489 [1,1,0,0,0,0|1,0,0]=3 488 B9R1.2 OC1=CC=CC(CBr)=C1 O29845 [1,1,0,0,0,0|1,0,0]=3 489 B9R1.2 OCC1=CC(Cl)=CN=C1 P39543 [1,1,0,0,0,0|1,0,0]=3 490 B9R1.2 OCC1=CC(Cl)=NC=C1 Q67739 [1,1,0,0,0,0|1,0,0]=3 491 B9R1.2 OCC1=CC(Cl)=NC=N1 G-7201 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.2 OCC1=CC(F)=CN=C1 C-3496 [1,1,0,0,0,0|1,0,0]=3 493 B9R1.2 OCC1=CC(F)=NC=C1 P41706 [1,1,0,0,0,0|1,0,0]=3 494 B9R1.2 OCC1=CN=CC(Br)=C1 P38449 [1,1,0,0,0,0|1,0,0]=3 495 B9R1.2 OCC1=NC(Br)=CC=C1 P38733 [1,1,0,0,0,0|1,0,0]=3 496 B9R1.2 OCC1=NC(F)=CC=C1 P38880 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.2 OCC1=NC=CC(Br)=C1 B-1208 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.2 OCC1=NC=CC(F)=C1 O29281 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 O29734 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.8 BrCCC1=CC=NC=C1 Q62364 [1,1,0,0,0,0|1,0,0]=3 501 B9R1.8 BrCCC1=CN=CC=C1 Q62363 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.8 C=CCC1=CC=CC=N1 Q62450 [1,1,0,0,0,0|1,0,1]=4 503 B9R1.8 CCNC1=NN=CC=C1 O31986 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.8 CNCC1=CC=CN=C1 P35002 [1,1,0,0,0,0|1,0,0]=3 505 B9R1.8 CNCC1=CC=NC=C1 P36555 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.8 CNCC1=CN=CN=C1 G-7225 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.8 CNCC1=NC=CC=C1 P39822 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.8 CNCC1=NC=CC=N1 L18100 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.8 N#CCC1=CC=NC=C1 P41732 [1,1,0,0,0,0|1,0,1]=4 510 B9R1.8 NCCC1=CC=NC=N1 L14509 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.8 NCCC1=NC=CC=N1 L14904 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.8 NCCC1=NC=CC=N1 Q55474 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.8 NCCC1=NC=NC=C1 Q56454 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.8 NNCC1=CC=CC=C1 P43525 [1,1,0,0,0,0|1,0,0]=3 515 B9R1.8 NNCC1=CC=CN=C1 O31533 [1,1,0,0,0,0|2,0,0]=4 516 B9R1.8 NNCC1=CC=NC=C1 C-3253 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.8 NNCC1=CC=NC=C1 L13556 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.8 NNCC1=CC=NC=C1 O32212 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.8 NNCC1=CN=CC=C1 C-3254 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.8 NNCC1=NC=CC=C1 C-3255 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.8 NNCC1=NC=CC=C1 O31423 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.8 O=CCC1=CN=CC=C1 Q60356 [1,1,0,0,0,0|1,0,1]=4 523 B9R1.8 OCCC1=CC=CN=C1 O28068 [1,1,0,0,0,0|1,0,0]=3 524 B9R1.8 OCCC1=CC=NC=C1 P37585 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.8 OCCC1=CC=NC=N1 Q56821 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.8 OCCC1=NC=CC=N1 Q56820 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 O32008 [1,1,0,0,0,0|1,0,1]=4 528 B9R1.15 BrCC1=CC=CN=C1Br O30364 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.15 BrCC1=NC=CC=C1Br O34067 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.15 C#CC1=CC=CC=C1Br O27884 [1,1,0,0,0,0|0,0,2]=4 531 B9R1.15 C#CC1=CC=CC=C1C O28000 [1,1,0,0,0,0|0,0,2]=4 532 B9R1.15 C#CC1=CC=CC=C1N L13529 [1,1,0,0,0,0|0,0,2]=4 533 B9R1.15 C#CC1=CC=CC=C1O O30353 [1,1,0,0,0,0|0,0,2]=4 534 B9R1.15 C=CC1=CC=CC=C1N O30540 [1,1,0,0,0,0|0,0,2]=4 535 B9R1.15 CC1=C(CBr)C=CC=N1 L22017 [1,1,0,0,0,0|2,0,0]=4 536 B9R1.15 CC1=C(CCl)C=CN=C1 L18062 [1,1,0,0,0,0|2,0,0]=4 537 B9R1.15 CC1=C(CN)C=CN=C1 O30239 [1,1,0,0,0,0|2,0,0]=4 538 B9R1.15 CC1=C(CN)C=NC=C1 G-7930 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.15 CC1=C(CO)C=NC=C1 G-7931 [1,1,0,0,0,0|1,0,0]=3 540 B9R1.15 CC1=C(CO)N=CC=C1 Q62329 [1,1,0,0,0,0|1,0,0]=3 541 B9R1.15 CC1=CC=CN=C1CBr O30100 [1,1,0,0,0,0|2,0,0]=4 542 B9R1.15 CC1=CC=CN=C1CN P40986 [1,1,0,0,0,0|2,0,0]=4 543 B9R1.15 CC1=CN=CC=C1CO C-2894 [1,1,0,0,0,0|1,0,0]=3 544 B9R1.15 CC1=NC=CC=C1CCl L13040 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.15 CC1=NC=CC=C1CN P37228 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.15 CC1=NC=CC=C1CO 10789 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.15 CC1=NC=CN=C1CO I-9745 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.15 CCC1=C(Br)C=CN=C1 G-5778 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.15 CCC1=C(Br)C=CN=C1 L22190 [1,1,0,0,0,0|1,0,0]=3 550 B9R1.15 CCC1=C(Br)C=CN=C1 Q52444 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.15 CCC1=C(Br)C=NC=C1 P44427 [1,1,0,0,0,0|1,0,0]=3 552 B9R1.15 CCC1=CC=CN=C1N P38117 [1,1,0,0,0,0|1,0,0]=3 553 B9R1.15 CCC1=NC=NC=C1F C-2874 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.15 CNC1=NC=CC=C1F Q69363 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.15 CNC1=NC=CC=C1I N27017 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.15 CNC1=NC=CC=C1N M23208 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.15 COC1=C(Br)C=CN=C1 H-8447 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.15 COC1=C(Br)C=CN=C1 O30229 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.15 COC1=C(Br)C=NC=C1 O30836 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.15 COC1=C(I)C=NC=C1 N24568 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.15 COC1=C(N)C=CN=C1 I-9880 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.15 COC1=C(N)C=NC=C1 O31833 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.15 COC1=C(O)C=NC=C1 O30206 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.15 COC1=CC=CN=C1Br Q70056 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.15 COC1=CC=CN=C1Cl Q67413 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.15 COC1=CC=CN=C1F Q67464 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.15 COC1=CC=CN=C1N Q67917 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.15 COC1=NC=CC=C1Br Q66368 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.15 COC1=NC=CC=C1Cl Q67093 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.15 COC1=NC=CC=C1O Q67611 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.15 CSC1=C(Br)C=CN=C1 N25058 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.15 CSC1=C(F)C=NC=C1 N26954 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.15 CSC1=CC=CN=C1Cl N24208 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.15 CSC1=CC=CN=C1F Q67766 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.15 CSC1=NC=CC=C1Cl N27821 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.15 ClC1=CC=CN=C1CBr O29992 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.15 ClC1=CC=CN=C1CBr O30940 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.15 ClCC1=CC=CN=C1Cl G-5569 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.15 FC1=C(CCl)C=CC=N1 Q55014 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.15 FC1=CC=CN=C1CBr F-4122 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.15 FC1=CC=CN=C1CBr L22053 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.15 FC1=CN=CC=C1CBr Q64618 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.15 FC1=NC=CC=C1CBr P38938 [1,1,0,0,0,0|2,0,0]=4 584 B9R1.15 NC1=C(CO)C=NC=C1 O34460 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.15 NC1=CC=CC=C1CO G-7793 [1,1,0,0,0,0|0,0,0]=2 586 B9R1.15 NC1=NC=CC=C1CO O32321 [1,1,0,0,0,0|1,0,0]=3 587 B9R1.15 NC1=NC=NC=C1CO Q58609 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.15 NCC1=C(Br)C=NC=C1 Q52844 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.15 NCC1=C(Cl)C=NC=C1 O29784 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.15 NCC1=C(F)C=NC=C1 O30341 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.15 NCC1=C(F)C=NC=C1 O31298 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.15 NCC1=C(N)C=CN=C1 Q53195 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.15 NCC1=C(O)C=CN=C1 Q62259 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.15 NCC1=CC=CC=C1Br P38336 [1,1,0,0,0,0|1,0,0]=3 595 B9R1.15 NCC1=CC=CC=C1I P38307 [1,1,0,0,0,0|1,0,0]=3 596 B9R1.15 NCC1=CC=CN=C1Cl G-7575 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.15 NCC1=CC=CN=C1Cl O31037 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.15 NCC1=CC=CN=C1N Q58373 [1,1,0,0,0,0|2,0,0]=4 599 B9R1.15 NCC1=NC=CC=C1Br P43535 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.15 NCC1=NC=CC=C1Cl L14332 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.15 NCC1=NC=CC=C1Cl P37858 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.15 NCC1=NC=CC=C1F L21946 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.15 NCC1=NC=CC=C1F P45775 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.15 O=C1NC=CC=C1CO L18304 [1,1,0,0,0,0|1,0,0]=3 605 B9R1.15 O=CC1=C(I)C=CC=C1 G-5775 [1,1,0,0,0,0|0,0,2]=4 606 B9R1.15 OCC1=C(Br)C=CN=C1 N25303 [1,1,0,0,0,0|1,0,0]=3 607 B9R1.15 OCC1=C(Br)C=CN=C1 N25521 [1,1,0,0,0,0|1,0,0]=3 608 B9R1.15 OCC1=C(Br)C=CN=C1 N25828 [1,1,0,0,0,0|1,0,0]=3 609 B9R1.15 OCC1=C(Br)C=NC=C1 P41171 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.15 OCC1=C(Cl)C=CN=C1 O31919 [1,1,0,0,0,0|1,0,0]=3 611 B9R1.15 OCC1=C(Cl)C=NC=C1 P36007 [1,1,0,0,0,0|1,0,0]=3 612 B9R1.15 OCC1=C(Cl)N=CN=C1 F-4870 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.15 OCC1=C(F)C=CN=C1 L14446 [1,1,0,0,0,0|1,0,0]=3 614 B9R1.15 OCC1=C(F)C=CN=C1 Q55508 [1,1,0,0,0,0|1,0,0]=3 615 B9R1.15 OCC1=C(F)C=NC=C1 G-5482 [1,1,0,0,0,0|1,0,0]=3 616 B9R1.15 OCC1=CC=CN=C1Br P41707 [1,1,0,0,0,0|1,0,0]=3 617 B9R1.15 OCC1=CC=CN=C1Cl C-3458 [1,1,0,0,0,0|1,0,0]=3 618 B9R1.15 OCC1=CC=CN=C1F Q67775 [1,1,0,0,0,0|1,0,0]=3 619 B9R1.15 OCC1=NC=CC=C1F C-2822 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.15 OCC1=NC=CC=C1O P41369 [1,1,0,0,0,0|1,0,0]=3 621 B9R1.15 OCC1=NC=CN=C1Cl C-3728 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.15 [O-][N+]1=CC=CC=C1CCl O31709 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.11 NC(CO)C1=CC=CO1 P39130 [0,1,0,0,1,0|2,0,0]=4 624 B9R1.11 NC(CO)C1=CSC=C1 P42431 [0,1,0,0,1,0|2,0,0]=4 625 B9R1.11 NCC(O)C1=CC=CO1 P39131 [0,1,0,0,1,0|1,0,0]=3 626 B9R1.11 OC[C@@H](O)C1=CC=CO1 P51763 [0,1,0,0,1,0|1,0,0]=3 627 B9R1.35 CC(O)C1=CN(C)C=N1 C-3678 [0,1,0,0,1,0|2,0,0]=4 628 B9R1.35 CC(O)C1=CN(C)N=C1 O30374 [0,1,0,0,1,0|2,0,0]=4 629 B9R1.35 CC(O)C1=CSC(Cl)=C1 G-6181 [0,1,0,0,1,0|1,0,0]=3 630 B9R1.35 CC(O)C1=NN(C)C=C1 Q62131 [0,1,0,0,1,0|2,0,0]=4 631 B9R1.35 CC1=CC=C([C@@H](C)N)O1 P43691 [0,1,0,0,1,0|2,0,0]=4 632 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 I-9085 [0,1,0,0,1,0|1,0,0]=3 633 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 P40160 [0,1,0,0,0,1|0,0,2]=4 634 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 P41430 [0,1,0,0,0,1|0,0,2]=4 635 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 P42284 [0,1,0,0,0,1|1,0,0]=3 636 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 P36150 [0,1,0,0,0,1|1,0,0]=3 637 B11R1.20 CC(C)NC1=CC=C(F)C=C1 P36529 [0,1,0,0,0,1|1,0,0]=3 638 B11R1.20 CC(C)NC1=NC=C(Br)C=C1 P38063 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Q66408 [0,1,0,0,0,1|1,0,0]=3 640 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Q67546 [0,1,0,0,0,1|1,0,0]=3 641 B11R1.20 CC(C)OC1=CC=C(N)C=N1 Q53684 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [0,1,0,0,0,1|1,0,0]=3 643 B11R1.20 CC(C)OC1=CN=C(F)C=C1 N25011 [0,1,0,0,0,1|2,0,0]=4 644 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 Q67257 [0,1,0,0,0,1|2,0,0]=4 645 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 N24389 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.20 CC(C)OC1=NC=C(I)C=C1 N24494 [0,1,0,0,0,1|2,0,0]=4 647 B11R1.20 CC(C)OC1=NC=C(O)C=C1 N26096 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.20 CC(N)CC1=CC=C(Br)C=C1 P41684 [0,1,0,0,0,1|1,0,0]=3 649 B11R1.20 CN(C)CC1=CC=C(N)C=C1 P36889 [0,1,0,0,0,1|2,0,0]=4 650 B11R1.36 CC(C)C(=O)C1=CC=NC=C1 L20820 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.36 CC(C)C(C)C1=CC=CC=C1 P43269 [0,1,0,0,0,1|1,0,0]=3 652 B11R1.36 CC(C)C(N)C1=CC=CC=C1 P36744 [0,1,0,0,0,1|1,0,0]=3 653 B11R1.36 CC(C)C(O)C1=CC=NC=C1 L20534 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 P51547 [0,1,0,0,0,1|1,0,1]=4 655 B11R1.40 CC(C#N)NC1=CC=CC=C1 M15456 [0,1,0,0,0,1|1,0,0]=3 656 B11R1.40 CC(CN)OC1=CC=CC=C1 P36860 [0,1,0,0,0,1|1,0,0]=3 657 B11R1.40 CC(CN)SC1=CC=CC=N1 Q58359 [0,1,0,0,0,1|2,0,0]=4 658 B11R1.40 CCC(Br)CC1=CC=NC=C1 Q58440 [0,1,0,0,0,1|2,0,0]=4 659 B11R1.40 CCC(N)CC1=CC=CC=C1 P38928 [0,1,0,0,0,1|1,0,0]=3 660 B11R1.40 CCC(O)CC1=CC=NC=C1 Q58397 [0,1,0,0,0,1|1,0,0]=3 661 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [0,1,0,0,0,1|1,0,0]=3 662 B11R1.40 NCC(=O)NC1=CC=CC=C1 P37442 [0,1,0,0,0,1|0,0,2]=4 663 B11R1.40 O=C(CBr)CC1=CC=CC=C1 O31255 [0,1,0,0,0,1|0,0,2]=4 664 B11R1.40 O=C(CBr)NC1=CC=CC=C1 P37595 [0,1,0,0,0,1|0,0,2]=4 665 B11R1.40 O=C(CC1=CC=CC=C1)NO P37592 [0,1,0,0,0,1|1,0,1]=4 666 B11R1.86 CC(=O)OC1=CC=CC=C1Br P40333 [0,1,0,0,0,1|0,0,2]=4 667 B11R1.86 CC(C)NC1=CC=CC=C1Br P40936 [0,1,0,0,0,1|1,0,0]=3 668 B11R1.86 CC(C)NC1=CC=CC=C1Cl P36079 [0,1,0,0,0,1|1,0,0]=3 669 B11R1.86 CC(C)NC1=CC=CC=C1F P42616 [0,1,0,0,0,1|1,0,0]=3 670 B11R1.86 CC(C)NC1=CC=CC=C1N P36500 [0,1,0,0,0,1|1,0,0]=3 671 B11R1.86 CC(C)NC1=CC=NC=C1N Q58287 [0,1,0,0,0,1|2,0,0]=4 672 B11R1.86 CC(C)OC1=CC=CC=C1F Q67217 [0,1,0,0,0,1|1,0,0]=3 673 B11R1.86 CC(C)OC1=CC=CN=C1F N27027 [0,1,0,0,0,1|2,0,0]=4 674 B11R1.86 CC(C)OC1=NC=CC=C1Br Q67456 [0,1,0,0,0,1|2,0,0]=4 675 B11R1.86 CC(C)OC1=NC=CC=C1Cl N26015 [0,1,0,0,0,1|2,0,0]=4 676 B11R1.86 CC(N)CC1=C(O)C=CC=C1 L19732 [0,1,0,0,0,1|1,0,0]=3 677 B11R1.86 CN(C)CC1=CC=CC=C1Br Q68057 [0,1,0,0,0,1|2,0,0]=4 678 B11R1.86 CN(C)CC1=CC=CC=C1N P40192 [0,1,0,0,0,1|2,0,0]=4 679 B11R1.86 NC1=CC=CC=C1CC(=O)O P38750 [0,1,0,0,0,1|1,0,1]=4 680 B11R1.86 OB(O)CC1=C(Cl)C=CC=C1 L20522 [0,1,0,0,0,1|2,0,0]=4 681 B11R1.86 OC1=CC=CC=C1OC(F)F M15813 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 P38633 [0,1,0,0,0,1|0,0,2]=4 683 B11R1.157 CC(C)NC1=CC=CC(Br)=C1 P41926 [0,1,0,0,0,1|1,0,0]=3 684 B11R1.157 CC(C)NC1=CC=CC(Cl)=C1 P38903 [0,1,0,0,0,1|1,0,0]=3 685 B11R1.157 CC(C)NC1=CC=CC(F)=C1 P42251 [0,1,0,0,0,1|1,0,0]=3 686 B11R1.157 CC(C)OC1=CC(F)=CC=C1 Q66828 [0,1,0,0,0,1|1,0,0]=3 687 B11R1.157 CC(C)OC1=CC=CC(O)=C1 N24861 [0,1,0,0,0,1|1,0,0]=3 688 B11R1.157 CC(C)OC1=CN=CC(Br)=C1 Q67028 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.157 CC(C)OC1=CN=CC(O)=C1 N26113 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.157 CC(C)OC1=NC(Cl)=CC=C1 N25603 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.157 CC(C)OC1=NC=CC(I)=C1 N24860 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.157 CC1=CC(CB(O)O)=CC=C1 L20484 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.157 CC1=CC(NC(C)C)=CC=C1 P42983 [0,1,0,0,0,1|1,0,0]=3 694 B11R1.157 CN(C)CC1=CC(N)=CC=C1 P39096 [0,1,0,0,0,1|2,0,0]=4 695 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 Q67698 [0,1,0,0,0,1|2,0,0]=4 696 B11R1.157 FC1=CC(OC(F)F)=CC=C1 O31131 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.3 C#CC1=CC=C(B(O)O)C=C1 P39238 [0,2,0,0,0,0|2,0,0]=4 698 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 O28118 [0,2,0,0,0,0|1,0,1]=4 699 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,2,0,0,0,0|0,0,2]=4 700 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 O27944 [0,2,0,0,0,0|2,0,0]=4 701 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,2,0,0,0,0|0,0,2]=4 702 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,2,0,0,0,0|0,0,2]=4 703 B11R1.3 CC(N)C1=CC=C(C#N)C=C1 P35710 [0,2,0,0,0,0|1,0,0]=3 704 B11R1.3 CC(N)C1=CC=C(CO)C=C1 P38103 [0,2,0,0,0,0|1,0,0]=3 705 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 P37663 [0,2,0,0,0,0|0,0,0]=2 706 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [0,2,0,0,0,0|1,0,0]=3 707 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [0,2,0,0,0,0|0,0,0]=2 708 B11R1.3 CN(C)C1=CC=C(CN)C=C1 P40156 [0,2,0,0,0,0|2,0,0]=4 709 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O28119 [0,2,0,0,0,0|2,0,0]=4 710 B11R1.3 CNC1=CC=C(N(C)C)C=C1 P37575 [0,2,0,0,0,0|2,0,0]=4 711 B11R1.3 COC1=CN=C([C@@H](C)N)C=C1 Q62470 [0,2,0,0,0,0|2,0,0]=4 712 B11R1.3 NCC1=CC=C(B(O)O)C=C1 O30152 [0,2,0,0,0,0|2,0,0]=4 713 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 G-6969 [0,2,0,0,0,0|2,0,0]=4 715 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 P49742 [0,2,0,0,0,0|2,0,0]=4 716 B11R1.19 CC(C)(C)C1=CC=C(N)N=C1 Q52925 [0,2,0,0,0,0|2,0,0]=4 717 B11R1.19 CC(C)(C)C1=CN=C(Cl)C=C1 P49958 [0,2,0,0,0,0|2,0,0]=4 718 B11R1.19 CC(C)(C)C1=CNC(=O)C=C1 Q52705 [0,2,0,0,0,0|2,0,0]=4 719 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P40451 [0,2,0,0,0,0|1,0,0]=3 720 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P42464 [0,2,0,0,0,0|1,0,0]=3 721 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 P40452 [0,2,0,0,0,0|1,0,0]=3 722 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 O30550 [0,2,0,0,0,0|1,0,0]=3 723 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 P42234 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.19 CC(C)(N)C1=NC=C(F)C=C1 Q69598 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 P39871 [0,2,0,0,0,0|0,0,0]=2 726 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 Q53407 [0,2,0,0,0,0|1,0,0]=3 727 B11R1.19 CC(C)(O)C1=CN=C(Cl)N=C1 Q58686 [0,2,0,0,0,0|2,0,0]=4 728 B11R1.19 CC(C)(O)C1=NC=C(O)C=N1 Q62952 [0,2,0,0,0,0|2,0,0]=4 729 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 P36818 [0,2,0,0,0,0|1,0,0]=3 730 B11R1.19 CC1=CC=C(C(C)(C)N)C=N1 Q58436 [0,2,0,0,0,0|2,0,0]=4 731 B11R1.19 CC1=CC=C(C(C)(C)O)C=N1 O33635 [0,2,0,0,0,0|1,0,0]=3 732 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1765 [0,2,0,0,0,0|2,0,0]=4 733 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1766 [0,2,0,0,0,0|2,0,0]=4 734 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 G-6636-1 [0,2,0,0,0,0|2,0,0]=4 735 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H-8848 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 L14045 [0,2,0,0,0,0|2,0,0]=4 737 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O32785 [0,2,0,0,0,0|2,0,0]=4 738 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P45972 [0,2,0,0,0,0|2,0,0]=4 739 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P48341 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P50560 [0,2,0,0,0,0|2,0,0]=4 741 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q54491 [0,2,0,0,0,0|2,0,0]=4 742 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56087 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56091 [0,2,0,0,0,0|2,0,0]=4 744 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q69557 [0,2,0,0,0,0|2,0,0]=4 745 B11R1.19 CS(=N)(=O)C1=CC=C(Cl)C=C1 F-4632 [0,2,0,0,0,0|1,0,1]=4 746 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 M15585 [0,2,0,0,0,0|2,0,0]=4 747 B11R1.21 CC(=O)C1=CC=C(Br)C(Cl)=C1 M15796 [0,2,0,0,0,0|0,0,2]=4 748 B11R1.21 CC(=O)C1=CC=C(Cl)C(Br)=C1 Q66292 [0,2,0,0,0,0|0,0,2]=4 749 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 N25331 [0,2,0,0,0,0|0,0,2]=4 750 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 N25776 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.21 CC(C)C1=CC=C(Br)C(N)=N1 Q53515 [0,2,0,0,0,0|2,0,0]=4 752 B11R1.21 CC(C)C1=CC=C(Cl)C(Br)=C1 Q67346 [0,2,0,0,0,0|1,0,0]=3 753 B11R1.21 CC(C)C1=CC=C(Cl)C(O)=C1 Q67377 [0,2,0,0,0,0|1,0,0]=3 754 B11R1.21 CC(C)C1=CC=C(I)C(Br)=C1 Q67564 [0,2,0,0,0,0|1,0,0]=3 755 B11R1.21 CC(C)C1=CC=C(O)C(Br)=C1 Q67536 [0,2,0,0,0,0|1,0,0]=3 756 B11R1.21 CC(C)C1=CC=C(O)C(Cl)=N1 Q68845 [0,2,0,0,0,0|2,0,0]=4 757 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 P36289 [0,2,0,0,0,0|1,0,0]=3 758 B11R1.21 CC(N)C1=CC=C(Cl)C(F)=C1 P36050 [0,2,0,0,0,0|1,0,0]=3 759 B11R1.21 CC(N)C1=CC=C(F)C(F)=C1 P39119 [0,2,0,0,0,0|1,0,0]=3 760 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 Q67058 [0,2,0,0,0,0|0,0,0]=2 761 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 N24268 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 N25142 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 N26054 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl Q66430 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.21 CC1=CC([C@@H](C)N)=NC=C1Br P43692 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.21 CC1=CC([C@H](C)N)=NC=C1Br O29651 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.21 CC1=CC=C(B(O)O)C=C1Br Q67305 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66342 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.21 CC1=CC=C(B(O)O)C=C1N Q66343 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.21 CC1=CC=C(C(C)O)C=C1C M22902 [0,2,0,0,0,0|0,0,0]=2 771 B11R1.21 CC1=CC=C(N(C)C)C=C1Br N25454 [0,2,0,0,0,0|2,0,0]=4 772 B11R1.21 NC1=C(S)C=C(C(=O)O)C=C1 A-871 [0,2,0,0,0,0|1,0,1]=4 773 B11R1.21 NC1=C(S)C=CC(C(=O)O)=C1 H-8774 [0,2,0,0,0,0|1,0,1]=4 774 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66341 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.21 NC1=CC(B(O)O)=CC=C1Cl Q66772 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.21 NC1=CC(C(=O)O)=CC=C1S K16116 [0,2,0,0,0,0|1,0,1]=4 777 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10924 [0,2,0,0,0,0|2,0,0]=4 778 B11R1.21 NC1=CC=C(B(O)O)C=C1F K10938 [0,2,0,0,0,0|2,0,0]=4 779 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 P37038 [0,2,0,0,0,0|1,0,1]=4 780 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 K13440 [0,2,0,0,0,0|1,0,1]=4 781 B11R1.21 OB(O)C1=CC(Br)=C(Cl)C=C1 N24750 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.21 OB(O)C1=CC(Br)=C(F)C=C1 N25430 [0,2,0,0,0,0|2,0,0]=4 783 B11R1.21 OB(O)C1=CC(Cl)=C(Br)C=C1 N25064 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 P44661 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 N24197 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.21 OB(O)C1=CC(O)=C(Br)C=C1 N25862 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 N25249 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 N24560 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.21 OB(O)C1=CC=C(O)C(Cl)=C1 Q66714 [0,2,0,0,0,0|2,0,0]=4 790 B11R1.21 OB(O)C1=CC=C(O)C(F)=C1 O31813 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.22 C#CC(O)C1=CC=C(Cl)C=C1 P38985 [0,2,0,0,0,0|0,0,1]=3 792 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [0,2,0,0,0,0|1,0,0]=3 793 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [0,2,0,0,0,0|1,0,0]=3 794 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [0,2,0,0,0,0|0,0,2]=4 799 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [0,2,0,0,0,0|1,0,0]=3 800 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [0,2,0,0,0,0|0,0,0]=2 801 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [0,2,0,0,0,0|1,0,0]=3 802 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [0,2,0,0,0,0|1,0,0]=3 803 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [0,2,0,0,0,0|1,0,0]=3 804 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [0,2,0,0,0,0|1,0,0]=3 805 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [0,2,0,0,0,0|1,0,0]=3 806 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [0,2,0,0,0,0|0,0,0]=2 807 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [0,2,0,0,0,0|2,0,0]=4 808 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [0,2,0,0,0,0|1,0,0]=3 809 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [0,2,0,0,0,0|1,0,0]=3 810 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [0,2,0,0,0,0|1,0,0]=3 811 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [0,2,0,0,0,0|0,0,2]=4 812 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [0,2,0,0,0,0|0,0,0]=2 813 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [0,2,0,0,0,0|0,0,0]=2 814 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [0,2,0,0,0,0|0,0,0]=2 815 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [0,2,0,0,0,0|1,0,0]=3 817 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [0,2,0,0,0,0|1,0,0]=3 818 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [0,2,0,0,0,0|1,0,0]=3 819 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [0,2,0,0,0,0|1,0,0]=3 820 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [0,2,0,0,0,0|1,0,0]=3 821 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 O31201 [0,2,0,0,0,0|0,0,2]=4 822 B11R1.166 CC(=O)C1=CC=C(C)C=C1Br P42929 [0,2,0,0,0,0|0,0,2]=4 823 B11R1.166 CC(=O)C1=CC=C(N)C=C1Cl O32522 [0,2,0,0,0,0|0,0,2]=4 824 B11R1.166 CC(C)C1=C(I)C=C(Cl)C=C1 N26662 [0,2,0,0,0,0|1,0,0]=3 825 B11R1.166 CC(C)C1=CC=C(Cl)C=C1N Q68189 [0,2,0,0,0,0|1,0,0]=3 826 B11R1.166 CC(C)C1=CN=C(Cl)C=C1N O32387 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.166 CC(C)N1C=CC(N)=CC1=O L21753 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.166 CC(C)N1C=CC(N)=CC1=O Q52511 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.166 CC(Cl)C1=NC=C(Cl)C=C1F Q54853 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.166 CC(N)C1=CC=C(F)C=C1F P37148 [0,2,0,0,0,0|1,0,0]=3 831 B11R1.166 CC(N)C1=NC=C(Cl)C=C1Br O29726 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.166 CC(N)C1=NC=C(Cl)C=C1Br O31000 [0,2,0,0,0,0|2,0,0]=4 833 B11R1.166 CC(N)C1=NC=C(Cl)C=C1F O32078 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.166 CC(N)C1=NC=C(F)C=C1Cl O29261 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.166 CC(N)C1=NC=C(F)C=C1Cl O32103 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.166 CC(O)C1=NC=C(Br)C=C1F H-8321 [0,2,0,0,0,0|1,0,0]=3 837 B11R1.166 CC(O)C1=NC=C(Cl)C=C1Br O29987 [0,2,0,0,0,0|1,0,0]=3 838 B11R1.166 CC(O)C1=NC=C(Cl)C=C1F O31489 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.166 CC(O)C1=NC=C(F)C=C1F O29489 [0,2,0,0,0,0|1,0,0]=3 840 B11R1.166 CC1=CC(Br)=CC=C1B(O)O N25479 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 C-3216 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.166 CC1=CC(O)=CC=C1B(O)O Q66536 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.166 CC1=CC=C(B(O)O)C(Br)=C1 N26773 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 G-5911 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.166 CC1=CC=C(C(C)N)C(C)=C1 P42949 [0,2,0,0,0,0|1,0,0]=3 846 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 N26369 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.166 NC1=CC(I)=CC=C1C(=O)O O32287 [0,2,0,0,0,0|1,0,1]=4 848 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br P37092 [0,2,0,0,0,0|1,0,1]=4 849 B11R1.166 O=C(O)C1=CC=C(F)C=C1O M22934 [0,2,0,0,0,0|1,0,1]=4 850 B11R1.166 O=C(O)C1=CC=C(I)C=C1F P43484 [0,2,0,0,0,0|1,0,1]=4 851 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl Q66502 [0,2,0,0,0,0|1,0,1]=4 852 B11R1.166 OB(O)C1=C(Cl)C=C(Br)C=C1 N25136 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.166 OB(O)C1=CC=C(Br)C=C1F N24200 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.166 OB(O)C1=CC=C(Br)C=C1O N27788 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Br N24488 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O N25789 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.166 OB(O)C1=CC=C(F)C=C1Br N25282 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.166 OB(O)C1=CC=C(F)C=C1O N24631 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.166 OB(O)C1=CC=C(O)C=C1Cl O30606 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.166 OB(O)C1=CC=C(O)C=C1F N24632 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.166 OC1=CC(F)=CC=C1C(F)F O32122 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.7 CC(C)(CN)C1=CC=CC=C1 P39760 [0,2,0,0,0,0|1,0,0]=3 863 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Q54944 [0,2,0,0,0,0|1,0,0]=3 864 B11R1.7 CC(N)(CO)C1=CC=CC=C1 P35233 [0,2,0,0,0,0|0,0,0]=2 865 B11R1.7 NCC(F)(F)C1=NC=CC=C1 L14284 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.7 OCC(F)(F)C1=NC=CC=C1 C-2830 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.12 COC(OC)C1=NC=NC=C1 O31202 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 M15334 [0,2,0,0,0,0|1,0,1]=4 869 B11R1.16 C=CCC(O)C1=NC=CC=C1 L20408 [0,2,0,0,0,0|1,0,0]=3 870 B11R1.16 CC(CCN)C1=CC=CC=C1 P38414 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.16 CC(CCN)C1=CC=NC=C1 Q58360 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.16 CCCC(N)C1=CC=CC=C1 P39016 [0,2,0,0,0,0|1,0,0]=3 873 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58232 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.16 CCNC(C)C1=CC=NC=C1 Q58233 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.16 CNCC(C)C1=CC=CC=C1 P37180 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.16 CNCC(O)C1=CC=CN=C1 Q58187 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.16 CNCC(O)C1=NC=CC=C1 L20626 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.16 COCC(N)C1=CC=CC=C1 P40515 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 P35167 [0,2,0,0,0,0|1,0,0]=3 880 B11R1.16 COC[C@@H](N)C1=CC=CN=C1 P43472 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.16 COC[C@H](N)C1=CC=CC=C1 P36845 [0,2,0,0,0,0|1,0,0]=3 882 B11R1.16 COC[C@H](N)C1=CC=CN=C1 P43473 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.16 CONC(=O)C1=CC=CC=C1 Q65648 [0,2,0,0,0,0|0,0,2]=4 884 B11R1.16 NCCC(O)C1=CC=CC=C1 P37784 [0,2,0,0,0,0|0,0,0]=2 885 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 P35908 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 P40616 [0,2,0,0,0,0|1,0,0]=3 887 B11R1.16 OCC[C@H](O)C1=CC=NC=C1 Q62763 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.23 C#CC(O)C1=CC=CC(Cl)=C1 P38984 [0,2,0,0,0,0|0,0,1]=3 889 B11R1.23 C#CC(O)C1=CC=CC(F)=C1 O31432 [0,2,0,0,0,0|0,0,1]=3 890 B11R1.23 CC1=CC(C(=O)CBr)=CC=C1 O28559 [0,2,0,0,0,0|0,0,2]=4 891 B11R1.23 CC1=CC(C(N)CO)=CC=C1 P42443 [0,2,0,0,0,0|1,0,0]=3 892 B11R1.23 CC1=CC(C(O)CN)=CC=C1 P37590 [0,2,0,0,0,0|0,0,0]=2 893 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 P42962 [0,2,0,0,0,0|1,0,0]=3 894 B11R1.23 CCC(N)C1=CC=CC(Cl)=C1 P38298 [0,2,0,0,0,0|1,0,0]=3 895 B11R1.23 CCC(O)C1=CC=CC(Cl)=C1 P38851 [0,2,0,0,0,0|0,0,0]=2 896 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 Q66806 [0,2,0,0,0,0|0,0,2]=4 897 B11R1.23 NC(CO)C1=CC=CC(Br)=C1 P40234 [0,2,0,0,0,0|1,0,0]=3 898 B11R1.23 NC(CO)C1=CC=CC(Cl)=C1 P40407 [0,2,0,0,0,0|1,0,0]=3 899 B11R1.23 NC(CO)C1=CC=CC(F)=C1 P40409 [0,2,0,0,0,0|1,0,0]=3 900 B11R1.23 NCC(=O)C1=CC=CC(Br)=C1 P37041 [0,2,0,0,0,0|0,0,2]=4 901 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 P37749 [0,2,0,0,0,0|0,0,2]=4 902 B11R1.23 NCC(=O)C1=CC=CC(F)=C1 P35035 [0,2,0,0,0,0|0,0,2]=4 903 B11R1.23 NCC(=O)C1=CC=CC(O)=C1 P41173 [0,2,0,0,0,0|0,0,2]=4 904 B11R1.23 NCC(O)C1=CC=CC(Br)=C1 P38183 [0,2,0,0,0,0|0,0,0]=2 905 B11R1.23 NCC(O)C1=CC=CC(Cl)=C1 P37589 [0,2,0,0,0,0|0,0,0]=2 906 B11R1.23 NCC(O)C1=CC=CC(F)=C1 P38243 [0,2,0,0,0,0|0,0,0]=2 907 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 P51568 [0,2,0,0,0,0|0,0,0]=2 908 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 P39827 [0,2,0,0,0,0|1,0,0]=3 909 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 P35059 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 P42255 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 P39826 [0,2,0,0,0,0|1,0,0]=3 912 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=N1 Q53157 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 P36766 [0,2,0,0,0,0|1,0,0]=3 914 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 P38815 [0,2,0,0,0,0|1,0,0]=3 915 B11R1.222 C#CC(O)C1=CC=CC=C1Cl P40184 [0,2,0,0,0,0|0,0,1]=3 916 B11R1.222 CC1=CC=CC=C1C(=O)CBr O28087 [0,2,0,0,0,0|0,0,2]=4 917 B11R1.222 CC1=CC=CC=C1C(N)CO P42682 [0,2,0,0,0,0|1,0,0]=3 918 B11R1.222 CC1=CC=CC=C1C(O)CN P41633 [0,2,0,0,0,0|0,0,0]=2 919 B11R1.222 CCC(N)C1=CC=CC=C1C P37948 [0,2,0,0,0,0|1,0,0]=3 920 B11R1.222 CCC(N)C1=CC=CC=C1Cl Q66027 [0,2,0,0,0,0|1,0,0]=3 921 B11R1.222 CNC(=O)C1=CC=CC=C1Br P37075 [0,2,0,0,0,0|0,0,2]=4 922 B11R1.222 CNC(=O)C1=CC=CC=C1C O32523 [0,2,0,0,0,0|0,0,2]=4 923 B11R1.222 NC(CO)C1=CC=CC=C1Br P42427 [0,2,0,0,0,0|1,0,0]=3 924 B11R1.222 NC(CO)C1=CC=CC=C1Cl P41841 [0,2,0,0,0,0|1,0,0]=3 925 B11R1.222 NC(CO)C1=CC=CC=C1F P40408 [0,2,0,0,0,0|1,0,0]=3 926 B11R1.222 NCC(=O)C1=CC=CC=C1Br P35565 [0,2,0,0,0,0|0,0,2]=4 927 B11R1.222 NCC(=O)C1=CC=CC=C1Cl P40753 [0,2,0,0,0,0|0,0,2]=4 928 B11R1.222 NCC(=O)C1=CC=CC=C1O P37785 [0,2,0,0,0,0|0,0,2]=4 929 B11R1.222 NCC(O)C1=CC=CC=C1Br P36482 [0,2,0,0,0,0|0,0,0]=2 930 B11R1.222 NCC(O)C1=CC=CC=C1Cl P39491 [0,2,0,0,0,0|0,0,0]=2 931 B11R1.222 NCC(O)C1=CC=CC=C1F P38828 [0,2,0,0,0,0|0,0,0]=2 932 B11R1.222 N[C@@H](CO)C1=CC=CC=C1Cl P42273 [0,2,0,0,0,0|1,0,0]=3 933 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl P39761 [0,2,0,0,0,0|1,0,0]=3 934 B11R1.222 O=C(CBr)C1=CC=CC=C1Br P37875 [0,2,0,0,0,0|0,0,2]=4 935 B11R1.222 O=C(CF)C1=CC=CC=C1F P51651 [0,2,0,0,0,0|0,0,2]=4 936 B11R1.87 CC(C)(C)C1=CC=CC=C1F Q69360 [0,2,0,0,0,0|1,0,0]=3 937 B11R1.87 CC(C)(N)C1=CC=CC=C1Br P40555 [0,2,0,0,0,0|1,0,0]=3 938 B11R1.87 CC(C)(N)C1=CC=CC=C1Cl P37789 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.87 CC(C)(N)C1=CC=CC=C1F P36303 [0,2,0,0,0,0|1,0,0]=3 940 B11R1.87 CC(C)(N)C1=NC=CC=C1F Q69599 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 D-2711 [0,2,0,0,0,0|0,0,0]=2 942 B11R1.87 CC(C)(O)C1=CC=CC=C1I Q69151 [0,2,0,0,0,0|0,0,0]=2 943 B11R1.87 CC1=CC=CC=C1C(C)(C)N P38926 [0,2,0,0,0,0|1,0,0]=3 944 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Br P51334 [0,2,0,0,0,0|1,0,1]=4 945 B11R1.155 CC(C)(C)C1=CC(N)=NC=C1 Q52923 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.155 CC(C)(C)C1=CN=CC(N)=C1 P51650 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.155 CC(C)(N)C1=CC(Br)=CN=C1 Q56651 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.155 CC(C)(N)C1=CC=CC(Br)=C1 O32516 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.155 CC(C)(N)C1=CC=CC(Cl)=C1 P40456 [0,2,0,0,0,0|1,0,0]=3 950 B11R1.155 CC(C)(N)C1=CC=CC(F)=C1 P36302 [0,2,0,0,0,0|1,0,0]=3 951 B11R1.155 CC(C)(N)C1=NC(F)=CC=C1 Q69597 [0,2,0,0,0,0|2,0,0]=4 952 B11R1.155 CC(C)(O)C1=CC(Br)=CN=C1 N25428 [0,2,0,0,0,0|1,0,0]=3 953 B11R1.155 CC(C)(O)C1=CC(Br)=NC=C1 Q61023 [0,2,0,0,0,0|1,0,0]=3 954 B11R1.155 CC(C)(O)C1=CC(N)=NC=C1 Q62274 [0,2,0,0,0,0|1,0,0]=3 955 B11R1.155 CC(F)(F)C1=CC=CC(Br)=N1 K12077 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.155 CC1=CC(C(C)(C)N)=CC=C1 P38927 [0,2,0,0,0,0|1,0,0]=3 957 B11R1.53 C#CC1=CC=CC=C1B(O)O Q65557 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.53 C#CC1=CC=CC=C1C(=O)O O28760 [0,2,0,0,0,0|1,0,1]=4 959 B11R1.53 C#CC1=CC=CC=C1C(C)=O O29479 [0,2,0,0,0,0|0,0,2]=4 960 B11R1.53 CC(C)C1=C(C=O)C=CC=N1 Q60359 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.53 CC(C)C1=C(C=O)N=CC=C1 Q62375 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.53 CC(C)C1=C(CO)N=CC=C1 Q62374 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.53 CC(C)C1=CC=CC=C1CBr I-9078 [0,2,0,0,0,0|1,0,0]=3 964 B11R1.53 CC(C)C1=CC=NC=C1C=O Q60343 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.53 CN(C)C1=CC=CC=C1C=O Q68631 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.53 COC1=CC=CC=C1C(C)N P38299 [0,2,0,0,0,0|1,0,0]=3 967 B11R1.53 COC1=NC=CC=C1C(C)O P42615 [0,2,0,0,0,0|1,0,0]=3 968 B11R1.53 N#CC1=CC=CC=C1B(O)O Q66418 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.53 NCC1=CC=CC=C1B(O)O O34146 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.53 NCC1=CC=CC=C1C(=O)O O28742 [0,2,0,0,0,0|1,0,1]=4 971 B11R1.53 O=C(O)C1=CC=CC=C1CO O34075 [0,2,0,0,0,0|1,0,1]=4 972 B11R1.156 CC(O)C1=C(Cl)C=NC=C1Cl Q69903 [0,2,0,0,0,0|1,0,0]=3 973 B11R1.156 CC(O)C1=C(I)C=CN=C1F N26441 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 I-9230 [0,2,0,0,0,0|1,0,1]=4 975 B11R1.156 C[C@@H](O)C1=C(Cl)C=NC=C1Cl Q69902 [0,2,0,0,0,0|1,0,0]=3 976 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl Q69901 [0,2,0,0,0,0|1,0,0]=3 977 B11R1.156 FC1=C(C(Cl)Cl)C(Cl)=CC=C1 P43232 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.156 NC1=CC=CC(I)=C1C(=O)O O32252 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br Q67183 [0,2,0,0,0,0|1,0,1]=4 980 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F C-3485 [0,2,0,0,0,0|1,0,1]=4 981 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O Q66580 [0,2,0,0,0,0|1,0,1]=4 982 B11R1.156 OB(O)C1=C(Br)C=CC=C1Br N24222 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Br Q66801 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O N25356 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.156 OB(O)C1=C(I)C=CC=C1F Q66793 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.156 OB(O)C1=C(O)C=CC=C1F P51507 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.156 OB(O)C1=C(O)C=CC=C1O O29455 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 M23816 [0,2,0,0,0,0|0,0,2]=4 989 B11R1.159 CC(O)C1=CC=CC(Cl)=C1Cl P37496 [0,2,0,0,0,0|0,0,0]=2 990 B11R1.159 CC1=C(B(O)O)C=CC=C1F N24187 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.159 CC1=C(B(O)O)C=CC=C1O N27745 [0,2,0,0,0,0|2,0,0]=4 992 B11R1.159 CC1=C(Br)C=CC=C1B(O)O Q67304 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O Q66298 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 Q66499 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.159 CC1=C(F)C(C(=O)O)=CC=C1 Q67898 [0,2,0,0,0,0|1,0,1]=4 996 B11R1.159 CC1=C(N)C(C(C)C)=CC=C1 F-4250 [0,2,0,0,0,0|1,0,0]=3 997 B11R1.159 CC1=C(N)C(C(C)C)=NC=C1 K16137 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.159 CC1=CC=CC(B(O)O)=C1O N24258 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.159 FC1=CC=CC(C(F)F)=C1I O32081 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 P35150 [0,2,0,0,0,0|1,0,1]=4 1001 B11R1.159 NC1=C(I)C=CC=C1C(=O)O O32276 [0,2,0,0,0,0|1,0,1]=4 1002 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 N24320 [0,2,0,0,0,0|1,0,1]=4 1003 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O P51774 [0,2,0,0,0,0|1,0,1]=4 1004 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O Q66616 [0,2,0,0,0,0|1,0,1]=4 1005 B11R1.159 O=C(O)C1=CC=CC(I)=C1F Q67650 [0,2,0,0,0,0|1,0,1]=4 1006 B11R1.159 OB(O)C1=C(Br)C(F)=CC=C1 N26461 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 N25968 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.159 OB(O)C1=CC=CC(Br)=C1F Q66366 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.159 OB(O)C1=CC=CC(Cl)=C1O Q66633 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl G-7117 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.159 OB(O)C1=CC=CC(F)=C1O Q66632 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.159 OB(O)C1=CC=CC(I)=C1F Q66484 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.167 CC(=O)C1=CC(C)=CC=C1Br O29725 [0,2,0,0,0,0|0,0,2]=4 1014 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F P37541 [0,2,0,0,0,0|0,0,2]=4 1015 B11R1.167 CC(=O)C1=CC(O)=CC=C1C N26381 [0,2,0,0,0,0|0,0,2]=4 1016 B11R1.167 CC(C)C1=C(Cl)C=CC(Br)=C1 N25225 [0,2,0,0,0,0|1,0,0]=3 1017 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N24267 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.167 CC(C)C1=CC(Br)=CC=C1I Q67805 [0,2,0,0,0,0|1,0,0]=3 1019 B11R1.167 CC(C)C1=CC(Br)=CC=C1O Q67880 [0,2,0,0,0,0|1,0,0]=3 1020 B11R1.167 CC(C)C1=CC(O)=CC=C1Br N25884 [0,2,0,0,0,0|1,0,0]=3 1021 B11R1.167 CC(C)C1=NC(Cl)=CC=C1Br Q62469 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.167 CC(C)N1C=C(Br)C=CC1=O Q67740 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.167 CC(O)C1=CC(Br)=CC=C1F Q66925 [0,2,0,0,0,0|0,0,0]=2 1024 B11R1.167 CC1=CC=C(Br)C(B(O)O)=C1 N26851 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.167 CC1=CC=C(Br)C=C1B(O)O N25858 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.167 CC1=CC=C(Cl)C(B(O)O)=C1 Q66271 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.167 CC1=CC=C(I)C=C1C(=O)O P43248 [0,2,0,0,0,0|1,0,1]=4 1028 B11R1.167 CC1=CC=C(N)C=C1C(=O)O P43309 [0,2,0,0,0,0|1,0,1]=4 1029 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 N24688 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.167 CC1=CC=C(O)C=C1B(O)O N25272 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.167 CC1=CN=C(F)C(C(C)O)=C1 N26930 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.167 NC1=CC=C(F)C(B(O)O)=C1 N25572 [0,2,0,0,0,0|2,0,0]=4 1033 B11R1.167 OB(O)C1=CC(Br)=CC=C1Br Q66796 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.167 OB(O)C1=CC(Br)=CC=C1O N24388 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.167 OB(O)C1=CC(Cl)=CC=C1Br N24945 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.167 OB(O)C1=CC(Cl)=CC=C1O Q66631 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.167 OB(O)C1=CC(F)=CC=C1Br Q66800 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.167 OB(O)C1=CC(F)=CC=C1O Q66483 [0,2,0,0,0,0|2,0,0]=4 1039 B11R1.167 OB(O)C1=CC(I)=CC=C1Br N24772 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.167 OB(O)C1=CC(O)=CC=C1Br Q67431 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.167 OB(O)C1=CC(O)=CC=C1F N24783 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.167 OC1=CC=C(F)C=C1C(F)F O29287 [0,2,0,0,0,0|2,0,0]=4 1043 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 P43442 [0,2,0,0,0,0|0,0,2]=4 1044 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 N24889 [0,2,0,0,0,0|0,0,2]=4 1045 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 O30551 [0,2,0,0,0,0|0,0,2]=4 1046 B11R1.74 CC(C)C1=CC(Br)=CC(Br)=C1 P43231 [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.74 CC(C)C1=CC(Br)=CC(I)=C1 N27290 [0,2,0,0,0,0|1,0,0]=3 1048 B11R1.74 CC(C)C1=CC(Cl)=CC(Cl)=C1 N26874 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.74 CC(C)C1=CC(O)=CC(=O)O1 L22273 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.74 CC(C)C1=CC(O)=CC(Br)=C1 N25795 [0,2,0,0,0,0|1,0,0]=3 1051 B11R1.74 CC(O)C1=CC(Cl)=CC(Cl)=C1 P40306 [0,2,0,0,0,0|0,0,0]=2 1052 B11R1.74 CC1=CC(B(O)O)=CC(O)=C1 N26309 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.74 CC1=CC(Br)=CC(B(O)O)=C1 Q66359 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 P37229 [0,2,0,0,0,0|1,0,1]=4 1055 B11R1.74 CC1=CC(Br)=CC(C(C)N)=C1 P43562 [0,2,0,0,0,0|1,0,0]=3 1056 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 Q66609 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 Q66831 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 O32304 [0,2,0,0,0,0|1,0,1]=4 1059 B11R1.74 CN(C)C1=CC(F)=CC(Br)=C1 N24299 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.74 CN(C)C1=CC(F)=CC(I)=C1 N26585 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.74 CN(C)C1=CC(F)=CC(O)=C1 N27265 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 Q67862 [0,2,0,0,0,0|1,0,1]=4 1063 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 P42451 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.74 OB(O)C1=CC(Cl)=CC(Br)=C1 Q67379 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.74 OB(O)C1=CC(F)=CC(Cl)=C1 Q66814 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.74 OB(O)C1=CC(O)=CC(Cl)=C1 N25649 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 Q66713 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.266 C#CC1=CC(B(O)O)=CC=C1 G-5867 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 O28043 [0,2,0,0,0,0|1,0,1]=4 1070 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 O28811 [0,2,0,0,0,0|0,0,2]=4 1071 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 P39070 [0,2,0,0,0,0|1,0,1]=4 1072 B11R1.266 CC(C)C1=CC(C=O)=CC=C1 Q68460 [0,2,0,0,0,0|1,0,0]=3 1073 B11R1.266 CC(C)C1=CC(CBr)=CC=C1 I-9079 [0,2,0,0,0,0|1,0,0]=3 1074 B11R1.266 CC(C)C1=CC(CO)=CC=C1 Q68461 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.266 CC(C)C1=NC(C#N)=CC=C1 C-3364 [0,2,0,0,0,0|2,0,0]=4 1076 B11R1.266 CCC1=CC(B(O)O)=CC=C1 Q67300 [0,2,0,0,0,0|2,0,0]=4 1077 B11R1.266 CCC1=CC(C(=O)O)=CC=C1 P37036 [0,2,0,0,0,0|1,0,1]=4 1078 B11R1.266 CNC1=CC(C(=O)O)=CC=C1 P37710 [0,2,0,0,0,0|1,0,1]=4 1079 B11R1.266 COC1=CC=CC(C(C)C)=C1 N26938 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.266 COC1=CC=CC(C(C)C)=N1 Q67092 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 10633 [0,2,0,0,0,0|1,0,1]=4 1082 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 O28911 [0,2,0,0,0,0|1,0,1]=4 1083 B11R1.266 O=C(O)C1=CC=CC(CS)=C1 P39077 [0,2,0,0,0,0|1,0,1]=4 1084 B11R1.266 OB(O)C1=CC=CC(CBr)=C1 P37725 [0,2,0,0,0,0|2,0,0]=4 1085 B11R2.4 NC1CC1C2=CC=CC=C2 Q54793 [0,0,0,1,0,1|1,0,0]=3 1086 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 L14213 [0,0,0,1,0,1|1,0,0]=3 1087 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 L22363 [0,0,0,1,0,1|1,0,0]=3 1088 B11R2.10 CC1=NC2=C(C=CN=C2)O1 O34256 [0,0,0,1,0,1|1,0,1]=4 1089 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 L14886 [0,0,0,1,0,1|1,0,0]=3 1090 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 I-9534 [0,0,0,1,0,1|1,0,0]=3 1091 B11R2.238 C1=CC(CC2CO2)=CC=N1 Q53152 [0,0,0,1,0,1|1,0,0]=3 1092 B11R2.238 C1=CC=C(NC2CC2)C=C1 M22854 [0,0,0,1,0,1|1,0,0]=3 1093 B11R2.34 BrC1=CC=C(C2CC2)C=C1 O30566 [0,1,0,1,0,0|1,0,0]=3 1094 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [0,1,0,1,0,0|0,0,0]=2 1095 B11R2.34 CC1=CC=C(C2CN2)C=C1 P36371 [0,1,0,1,0,0|1,0,0]=3 1096 B11R2.34 ClC1=CC=C(C2CN2)C=C1 P36104 [0,1,0,1,0,0|1,0,0]=3 1097 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Q67831 [0,1,0,1,0,0|2,0,0]=4 1098 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [0,1,0,1,0,0|0,0,0]=2 1099 B11R2.34 FC1=NC=C(C2CC2)C=C1 N26245 [0,1,0,1,0,0|2,0,0]=4 1100 B11R2.34 NC1=CC=C(C2CC2)C=C1 P38877 [0,1,0,1,0,0|1,0,0]=3 1101 B11R2.34 NC1=CC=C(C2CC2)N=C1 P42501 [0,1,0,1,0,0|2,0,0]=4 1102 B11R2.34 OC1=CC=C(C2CC2)C=C1 P42947 [0,1,0,1,0,0|1,0,0]=3 1103 B11R2.1 BrC1=COC2=CC=CC=C12 O30635 [0,1,0,1,0,0|1,0,1]=4 1104 B11R2.1 CC1=CNC2=C1C=CC=C2 I-9262 [0,1,0,1,0,0|1,0,1]=4 1105 B11R2.1 CC1=NNC2=C1C=CC=C2 C-2144 [0,1,0,1,0,0|1,0,1]=4 1106 B11R2.1 CC1=NOC2=CC=CC=C21 O30125 [0,1,0,1,0,0|0,0,1]=3 1107 B11R2.1 O=C1NCC2=C1C=CC=C2 I-9101 [0,1,0,1,0,0|0,0,2]=4 1108 B11R2.1 OB1OCC2=CC=NC=C12 F-4657 [0,1,0,1,0,0|2,0,0]=4 1109 B11R2.1 OC1=CNC2=CC=CC=C12 Q52523 [0,1,0,1,0,0|0,0,2]=4 1110 B11R2.1 OC1CCC2=C1C=CN=C2 S72817 [0,1,0,1,0,0|1,0,0]=3 1111 B11R2.40 NC1(C2=CC=CC=C2)CC1 P38187 [0,1,0,1,0,0|1,0,0]=3 1112 B11R2.40 NC1(C2=CC=CN=C2)CC1 P37810 [0,1,0,1,0,0|2,0,0]=4 1113 B11R2.40 NC1(C2=CC=NC=C2)CC1 G-7840 [0,1,0,1,0,0|2,0,0]=4 1114 B11R2.40 NC1(C2=CC=NC=C2)CC1 Q66089 [0,1,0,1,0,0|2,0,0]=4 1115 B11R2.40 NC1(C2=NC=CC=C2)CC1 P37811 [0,1,0,1,0,0|2,0,0]=4 1116 B11R2.239 C1=CC=C(C2CCN2)C=C1 O28163 [0,1,0,1,0,0|1,0,0]=3 1117 B11R2.239 C1=CC=C(C2CNC2)C=C1 10749 [0,1,0,1,0,0|1,0,0]=3 1118 B11R2.239 C1=CC=C(C2CNC2)C=C1 M22666 [0,1,0,1,0,0|1,0,0]=3 1119 B11R2.239 C1=CN=C(C2CNC2)C=C1 P46398 [0,1,0,1,0,0|2,0,0]=4 1120 B11R2.55 BrC1=CC=CC=C1C2CO2 P36453 [0,1,0,1,0,0|0,0,0]=2 1121 B11R2.55 CC1=C(C2CC2)C=NC=C1 N26487 [0,1,0,1,0,0|2,0,0]=4 1122 B11R2.55 CC1=NC=CC=C1C2CC2 N26392 [0,1,0,1,0,0|2,0,0]=4 1123 B11R2.55 ClC1=CC=CC=C1C2CO2 P36976 [0,1,0,1,0,0|0,0,0]=2 1124 B11R2.55 ClC1=CC=CN=C1C2CC2 N25876 [0,1,0,1,0,0|2,0,0]=4 1125 B11R2.55 FC1=CC=CC=C1C2CO2 Q66192 [0,1,0,1,0,0|0,0,0]=2 1126 B11R2.55 FC1=NC=CC=C1C2CC2 N26254 [0,1,0,1,0,0|2,0,0]=4 1127 B11R2.55 NC1=CC=CC=C1C2CC2 N24777 [0,1,0,1,0,0|1,0,0]=3 1128 B11R2.55 NC1=CC=CC=C1C2CC2 P51441 [0,1,0,1,0,0|1,0,0]=3 1129 B11R2.35 BrC1=CC(C2CO2)=CC=C1 P39092 [0,1,0,1,0,0|0,0,0]=2 1130 B11R2.35 BrC1=CC=CC(C2CC2)=C1 O31879 [0,1,0,1,0,0|1,0,0]=3 1131 B11R2.35 BrC1=CN=CC(C2CC2)=C1 N25476 [0,1,0,1,0,0|2,0,0]=4 1132 B11R2.35 ClC1=CC(C2CC2)=CC=N1 I-9975 [0,1,0,1,0,0|2,0,0]=4 1133 B11R2.35 ClC1=CC(C2CO2)=CC=C1 P39883 [0,1,0,1,0,0|0,0,0]=2 1134 B11R2.35 FC1=CC(C2CO2)=CC=C1 P40300 [0,1,0,1,0,0|0,0,0]=2 1135 B11R2.35 FC1=CN=CC(C2CC2)=C1 N27151 [0,1,0,1,0,0|2,0,0]=4 1136 B11R2.35 NC1=CC(C2CC2)=NC=C1 M23384 [0,1,0,1,0,0|2,0,0]=4 1137 B11R2.35 OC1=CC=CC(C2CC2)=C1 O30101 [0,1,0,1,0,0|1,0,0]=3 1138 B7R1.1 BrCC1=COC=C1 O29970 [1,0,0,0,1,0|2,0,0]=4 1139 B7R1.1 BrCC1=CSC=C1 Q68601 [1,0,0,0,1,0|2,0,0]=4 1140 B7R1.1 CSC1=CC=CS1 Q67758 [1,0,0,0,1,0|2,0,0]=4 1141 B7R1.1 ClCC1=CC=CS1 G-5616 [1,0,0,0,1,0|2,0,0]=4 1142 B7R1.1 NCC1=COC=C1 O34052 [1,0,0,0,1,0|2,0,0]=4 1143 B7R1.1 OCC1=CN=CN1 O33324 [1,0,0,0,1,0|2,0,0]=4 1144 B7R1.1 OCC1=CNN=C1 C-2849 [1,0,0,0,1,0|2,0,0]=4 1145 B7R1.1 OCC1=COC=N1 G-6097 [1,0,0,0,1,0|2,0,0]=4 1146 B7R1.1 OCC1=CSC=N1 O30740 [1,0,0,0,1,0|2,0,0]=4 1147 B7R1.1 OCC1=NC=CN1 Q65640 [1,0,0,0,1,0|2,0,0]=4 1148 B7R1.1 OCC1=NC=CS1 A-635 [1,0,0,0,1,0|2,0,0]=4 1149 B7R1.1 OCC1=NNC=C1 G-5586 [1,0,0,0,1,0|2,0,0]=4 1150 B7R1.1 OCC1=NOC=C1 G-7175 [1,0,0,0,1,0|2,0,0]=4 1151 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P40366 [0,0,0,0,0,2|0,0,2]=4 1152 B11R1.91 CC(N)COC1=CC=CC=C1 P38614 [0,0,0,0,0,2|1,0,0]=3 1153 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P50961 [0,0,0,0,0,2|2,0,0]=4