0 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 SPC-v154 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 SPC-h078 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 SPC-m248 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 CC1=CN=C(C(=O)O)C=N1 SPC-h803 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC1=CN=C(C(=O)O)N=C1 SPC-h567 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC1=NC=C(C(=O)O)C=N1 SPC-t870 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 SPC-g634 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.13 N=C(N)C1=CN=C(F)C=C1 SPC-j790 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 N=C(N)C1=NC=C(F)C=C1 SPC-k125 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 NC(=O)C1=NC=C(O)C=C1 SPC-u527 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.13 NC(=O)C1=NN=C(N)C=C1 SPC-r165 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.13 NC1=CN=C(C(=O)O)C=C1 SPC-g569 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.13 NC1=CN=C(C(=O)O)N=C1 SPC-t633 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.13 NC1=NC=C(B(O)O)C=C1 SPC-h371 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 NC1=NC=C(C(=O)O)C=C1 SPC-j431 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.13 NC1=NN=C(C(=O)O)C=C1 SPC-h063 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 SPC-k216 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 SPC-g051 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 SPC-g367 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 SPC-g701 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.13 O=C(O)C1=CN=C(F)C=C1 SPC-p809 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 SPC-g079 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 SPC-t053 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 SPC-k975 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 O=C(O)C1=NC=C(F)C=N1 SPC-h700 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SPC-g279 [0,0,0,0,0,0|1,0,0]=1 26 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 SPC-j945 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 O=C(O)C1=NN=C(O)C=C1 SPC-g471 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.13 O=C1C=CC(C(=O)O)=CO1 SPC-k150 [0,0,0,0,0,0|1,0,1]=2 29 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 SPC-g019 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 SPC-k199 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 OB(O)C1=CC=C(F)C=C1 SPC-q618 [0,0,0,0,0,0|2,0,1]=3 32 B10R1.13 OB(O)C1=CC=C(O)C=C1 SPC-s693 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.13 OB(O)C1=CN=C(Br)C=C1 SPC-s705 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.13 OB(O)C1=NC=C(F)C=C1 SPC-s700 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.13 OC1=CN=C(C(F)F)C=C1 SPC-d143 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.1 C#CC1=CC=C(Cl)C=C1 SPC-j149 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.1 C#CC1=CC=C(N)C=C1 SPC-t770 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.1 C=CC1=CN=C(F)C=C1 SPC-n214 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 C=CC1=NC=C(Cl)C=C1 SPC-t050 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 CC1=CN=C(C=O)C=N1 SPC-m053 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 CC1=CN=C(C=O)N=C1 SPC-k973 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.1 CC1=NC=C(C=O)C=C1 SPC-g684 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.1 NC1=NC=C(C=O)C=C1 SPC-h376 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.1 NC1=NC=C(CO)C=C1 SPC-j263 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.1 NNC1=CC=C(F)C=C1 SPC-k289 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.1 O=CC1=CN=C(Br)C=C1 SPC-j262 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.1 O=CC1=CN=C(Cl)C=N1 SPC-j256 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 O=CC1=CN=C(Cl)N=C1 SPC-h232 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.1 O=CC1=NC=C(F)C=N1 SPC-k786 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 O=CC1=NC=C(O)C=C1 SPC-u413 [1,0,0,0,0,0|1,0,0]=2 51 B9R1.1 O=CC1=NN=C(Cl)C=C1 SPC-m094 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 OCC1=NC=C(F)C=C1 SPC-h241 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.6 CC(=O)C1=CN=CN=C1 SPC-j094 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.6 CC(=O)C1=CN=NC=C1 SPC-r163 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.6 CC(=O)C1=NC=CC=N1 SPC-k981 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.6 CC(=O)C1=NN=CC=C1 SPC-j101 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.6 C[C@H](O)C1=CC=CC=C1 SPC-s644 [1,0,0,0,0,0|1,0,1]=3 58 B9R1.6 O=C(O)C1=CN=CN=C1 SPC-g357 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.6 O=C(O)C1=CN=NC=C1 SPC-n492 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.6 O=C(O)C1=NC=CC=N1 SPC-g298 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.6 O=C(O)C1=NC=CN=C1 SPC-g023 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.6 O=C(O)C1=NC=NC=C1 SPC-g351 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.6 O=C(O)C1=NN=CC=C1 SPC-g662 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.6 OB(O)C1=CC=NC=C1 SPC-g497 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 OB(O)C1=CN=CC=C1 SPC-g050 [1,0,0,0,0,0|2,0,1]=4 66 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 SPC-t403 [0,1,0,0,0,0|1,0,0]=2 67 B11R1.3 C#CC1=NC=C(C(=O)O)C=C1 SPC-v365 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.3 COC1=CN=C(C(=O)O)C=C1 SPC-k940 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.3 COC1=NC=C(B(O)O)C=C1 SPC-j894 [0,1,0,0,0,0|2,0,1]=4 70 B11R1.3 COC1=NC=C(C(=O)O)C=C1 SPC-t080 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 SPC-k202 [0,1,0,0,0,0|2,0,1]=4 72 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 SPC-p216 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 SPC-j432 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 SPC-t672 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 SPC-m416 [0,1,0,0,0,0|1,0,2]=4 76 B11R1.3 OCC1=CC=C(B(O)O)C=C1 SPC-n859 [0,1,0,0,0,0|1,0,1]=3 77 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-h020 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-m758 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-t952 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 SPC-u837 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.21 CC1=NC=C(C(=O)O)C=C1N SPC-m181 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.21 CN1C=C(C(=O)O)C=CC1=O SPC-j150 [0,1,0,0,0,0|1,0,1]=3 83 B11R1.21 CN1C=CC(C(=O)O)=CC1=O SPC-g869 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.21 CN1C=CC(C(N)=O)=CC1=O SPC-t892 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 SPC-n109 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br SPC-j257 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 SPC-t585 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 SPC-t067 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 SPC-m316 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 SPC-u326 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 SPC-g326 [0,1,0,0,0,0|3,0,0]=4 92 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 SPC-h297 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.22 COC(=O)C1=CNC(=O)C=C1 SPC-g661 [0,1,0,0,0,0|1,0,1]=3 94 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 SPC-g129 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 SPC-k788 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.22 COC(=O)C1=NC=C(C)C=N1 SPC-j807 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.22 COC(=O)C1=NC=C(F)C=C1 SPC-n445 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.22 COC(=O)C1=NC=C(N)C=C1 SPC-g909 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.22 COC(=O)C1=NC=C(N)C=N1 SPC-n443 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.22 COC(=O)C1=NC=C(N)C=N1 SPC-q138 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.22 COC(=O)C1=NC=C(N)N=C1 SPC-h355 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.22 COC(=O)C1=NC=C(O)C=C1 SPC-j676 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.22 COC(=O)C1=NC=C(O)C=N1 SPC-v239 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 SPC-j171 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.22 COC(=O)C1=NN=C(N)C=C1 SPC-h264 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.22 COC(=O)C1=NN=C(O)C=C1 SPC-g485 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 SPC-r400 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 SPC-k301 [0,1,0,0,0,0|1,0,0]=2 109 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O SPC-p660 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 SPC-g472 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 SPC-p379 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 SPC-p924 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 SPC-g171 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 SPC-j816 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 SPC-g789 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O SPC-j138 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O SPC-k826 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O SPC-n110 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.166 NC1=CC(F)=C([N+](=O)[O-])C=C1 SPC-g220 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.166 NC1=CC(F)=CN=C1C(=O)O SPC-t445 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.166 NC1=CC(F)=NC=C1C(=O)O SPC-p489 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SPC-k263 [0,1,0,0,0,0|1,0,0]=2 123 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 SPC-r421 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br SPC-s216 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl SPC-n021 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl SPC-g590 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F SPC-h201 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl SPC-m047 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 SPC-j998 [0,1,0,0,0,0|2,0,1]=4 130 B9R1.35 CC(=O)C1=CSC(Cl)=C1 SPC-h825 [0,0,0,0,1,0|3,0,0]=4 131 B9R1.35 CC1=CSC(C(=O)O)=C1 SPC-n156 [0,0,0,0,1,0|2,0,0]=3 132 B9R1.35 CC1=NNC(C(=O)O)=C1 SPC-k758 [0,0,0,0,1,0|3,0,0]=4 133 B9R1.35 CN1C=C(C(=O)O)C=N1 SPC-g547 [0,0,0,0,1,0|3,0,0]=4 134 B9R1.35 CN1C=CC(C(=O)O)=N1 SPC-t579 [0,0,0,0,1,0|3,0,0]=4 135 B9R1.35 CN1C=NC(C(=O)O)=C1 SPC-j762 [0,0,0,0,1,0|3,0,0]=4 136 B9R1.35 NC(=O)C1=CC=C(Br)N1 SPC-m101 [0,0,0,0,1,0|3,0,0]=4 137 B9R1.35 NC1=NC(C(=O)O)=CO1 SPC-k774 [0,0,0,0,1,0|3,0,0]=4 138 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SPC-g094 [0,0,0,0,1,0|2,0,0]=3 139 B9R1.35 O=C(O)C1=CC=C(F)S1 SPC-j710 [0,0,0,0,1,0|2,0,0]=3 140 B9R1.35 O=C(O)C1=CN=C(Br)S1 SPC-p181 [0,0,0,0,1,0|3,0,0]=4 141 B9R1.35 O=C(O)C1=CSC(Br)=C1 SPC-t048 [0,0,0,0,1,0|2,0,0]=3 142 B9R1.35 O=C(O)C1=CSC(Cl)=C1 SPC-j712 [0,0,0,0,1,0|2,0,0]=3 143 B9R1.35 O=C(O)C1=NC(Br)=CS1 SPC-k776 [0,0,0,0,1,0|3,0,0]=4 144 B9R1.35 O=C(O)C1=NC=C(Br)S1 SPC-n181 [0,0,0,0,1,0|3,0,0]=4 145 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SPC-j674 [0,0,0,0,0,1|2,0,0]=3 146 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 SPC-r243 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SPC-m376 [0,0,0,0,0,1|2,0,0]=3 148 B8R1.2 O=CC1=CN=CC=C1 SPC-g255 [2,0,0,0,0,0|1,0,0]=3 149 B8R1.2 O=CC1=CN=CN=C1 SPC-j129 [2,0,0,0,0,0|2,0,0]=4 150 B8R1.2 O=CC1=CN=NC=C1 SPC-n491 [2,0,0,0,0,0|2,0,0]=4 151 B8R1.2 O=CC1=NC=CC=N1 SPC-j098 [2,0,0,0,0,0|2,0,0]=4 152 B8R1.2 O=CC1=NC=CN=C1 SPC-j095 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.2 OCC1=CN=CC=C1 SPC-g084 [2,0,0,0,0,0|1,0,1]=4 154 B8R1.3 OC1=CN=C(Br)C=C1 SPC-g192 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.3 OC1=CN=C(Cl)C=C1 SPC-g273 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.3 COC1=CN=C(C=O)N=C1 SPC-u633 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.3 COC1=CN=C(CO)C=C1 SPC-n798 [1,1,0,0,0,0|1,0,1]=4 158 B10R1.3 COC1=NC=C(C=O)C=C1 SPC-n262 [1,1,0,0,0,0|1,0,0]=3 159 B10R1.3 COC1=NC=C(CO)C=C1 SPC-j652 [1,1,0,0,0,0|1,0,1]=4 160 B10R1.3 O=CC1=CC=C(CCl)C=C1 SPC-u418 [1,1,0,0,0,0|1,0,0]=3 161 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 SPC-u337 [1,1,0,0,0,0|1,0,0]=3 162 B10R1.25 NC1=CC(Br)=CN=C1C=O SPC-r224 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 SPC-g540 [1,1,0,0,0,0|1,0,0]=3 164 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 SPC-g415 [1,1,0,0,0,0|1,0,0]=3 165 B10R1.25 O=CC1=CC=C(Br)N=C1Br SPC-j482 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.25 O=CC1=CC=C(Cl)N=C1Cl SPC-j232 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.25 O=CC1=CN=C(Cl)C=C1Cl SPC-j753 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.25 O=CC1=NC=C(Br)C=C1F SPC-r172 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.176 CC1=C(F)C=CC(C=O)=N1 SPC-n216 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 SPC-t001 [1,1,0,0,0,0|1,0,0]=3 171 B10R1.15 COC(=O)C1=CN=CN=C1 SPC-j093 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.15 COC(=O)C1=NC=CC=N1 SPC-g360 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.15 COC(=O)C1=NC=NC=C1 SPC-g743 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.15 COC(=O)C1=NN=CC=C1 SPC-g720 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SPC-t740 [1,1,0,0,0,0|1,0,1]=4 176 B10R1.28 CC(C)(O)C1=CC=CC=C1 SPC-g210 [1,1,0,0,0,0|1,0,1]=4 177 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 SPC-n890 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 SPC-n891 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.61 CC(=O)C1=C(F)C=CC=N1 SPC-j546 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.61 CC(=O)C1=C(N)N=CC=C1 SPC-r191 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.61 CC(=O)C1=CC=CN=C1Cl SPC-j606 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SPC-g617 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.61 CC1=C(C(=O)O)C=NN=C1 SPC-j591 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.61 CC1=CN=CN=C1C(=O)O SPC-t697 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.61 CC1=NC=CN=C1C(=O)O SPC-j734 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.61 NC(=O)C1=C(N)C=CN=C1 SPC-p487 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.61 NC(=O)C1=C(N)C=CN=C1 SPC-s982 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.61 NC1=C(C(=O)O)C=NC=C1 SPC-g169 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.61 NC1=CC=CN=C1C(=O)O SPC-g425 [1,1,0,0,0,0|1,0,0]=3 190 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 SPC-g116 [1,1,0,0,0,0|1,0,0]=3 191 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 SPC-t006 [1,1,0,0,0,0|1,0,0]=3 192 B10R1.61 O=C(O)C1=C(F)C=CC=N1 SPC-g454 [1,1,0,0,0,0|1,0,0]=3 193 B10R1.61 O=C(O)C1=C(F)C=NC=C1 SPC-g759 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.61 O=C(O)C1=C(F)C=NC=N1 SPC-t058 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.61 O=C(O)C1=CC=CN=C1Br SPC-m969 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.61 O=C(O)C1=NC=CC=C1O SPC-k065 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.61 O=C(O)C1=NC=CN=C1Cl SPC-j425 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.61 O=C(O)C1=NC=CN=C1O SPC-g411 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SPC-g746 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SPC-g513 [1,1,0,0,0,0|1,0,0]=3 201 B10R1.113 CC1=CC(C(=O)O)=CN=N1 SPC-v546 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.113 CC1=CC(C(=O)O)=NC=N1 SPC-m029 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.113 CC1=CC(C(=O)O)=NN=C1 SPC-m730 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.113 CC1=CC=NC(C(=O)O)=N1 SPC-k969 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 SPC-m628 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SPC-g504 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SPC-g233 [1,1,0,0,0,0|1,0,0]=3 208 B10R1.113 NC1=NC=CC(C(=O)O)=C1 SPC-g225 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SPC-s846 [1,1,0,0,0,0|1,0,0]=3 210 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 SPC-g633 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 SPC-h274 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 SPC-m109 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.113 O=C(O)C1=CC(F)=CN=C1 SPC-g694 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SPC-g630 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 SPC-t071 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 SPC-g340 [1,1,0,0,0,0|1,0,0]=3 217 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 SPC-m984 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 SPC-g574 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SPC-g433 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SPC-k816 [1,1,0,0,0,0|1,0,0]=3 221 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 SPC-t005 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.113 O=C(O)C1=NC=CC(I)=C1 SPC-m662 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 SPC-n990 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.14 COC(=O)C1=CC(Br)=CN1 SPC-g315 [0,1,0,0,1,0|2,0,0]=4 225 B10R1.14 COC(=O)C1=CC(Br)=CS1 SPC-j659 [0,1,0,0,1,0|2,0,0]=4 226 B10R1.14 COC(=O)C1=CC(Cl)=CS1 SPC-k813 [0,1,0,0,1,0|2,0,0]=4 227 B10R1.14 COC(=O)C1=CC=C(Br)S1 SPC-j660 [0,1,0,0,1,0|2,0,0]=4 228 B10R1.14 COC(=O)C1=CC=C(N)O1 SPC-k486 [0,1,0,0,1,0|2,0,0]=4 229 B10R1.14 COC(=O)C1=CSC(Cl)=C1 SPC-k869 [0,1,0,0,1,0|2,0,0]=4 230 B10R1.194 CC1=CNC(C(=O)O)=C1C SPC-h485 [0,1,0,0,1,0|2,0,0]=4 231 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 SPC-g090 [0,1,0,0,0,1|1,0,0]=3 232 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 SPC-g230 [0,1,0,0,0,1|1,0,0]=3 233 B12R1.49 COC(=O)CC1=CN=C(Br)C=C1 SPC-v078 [0,1,0,0,0,1|2,0,0]=4 234 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 SPC-k031 [0,1,0,0,0,1|2,0,0]=4 235 B12R1.233 NC1=CC(Br)=CN=C1CC(=O)O SPC-u042 [0,1,0,0,0,1|2,0,0]=4 236 B12R1.5 COC(=O)C1=CN=C(C#N)C=C1 SPC-k435 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 SPC-r195 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 SPC-t843 [0,2,0,0,0,0|1,0,0]=3 239 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 SPC-j651 [0,2,0,0,0,0|1,0,0]=3 240 B12R1.5 COC(=O)C1=NC=C(OC)C=C1 SPC-k939 [0,2,0,0,0,0|1,0,0]=3 241 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 SPC-v364 [0,2,0,0,0,0|2,0,0]=4 242 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 SPC-u160 [0,2,0,0,0,0|1,0,0]=3 243 B12R1.48 COC1=C(Cl)C=C(C(=O)O)N=C1 SPC-r180 [0,2,0,0,0,0|1,0,0]=3 244 B12R1.256 O=C(O)C1=CN=C(C(F)F)C=C1 SPC-d151 [0,2,0,0,0,0|2,0,0]=4 245 B12R1.256 O=C(O)C1=NC=C([N+](=O)[O-])C=C1 SPC-g362 [0,2,0,0,0,0|1,0,1]=4 246 B12R1.256 O=C(O)C1=NN=C(C(=O)O)C=C1 SPC-j176 [0,2,0,0,0,0|2,0,0]=4 247 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 SPC-v064 [0,2,0,0,0,0|1,0,0]=3 248 B12R1.452 N#CC1=CC(Cl)=C(C(=O)O)C=C1 SPC-r012 [0,2,0,0,0,0|1,0,0]=3 249 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=N1 SPC-u454 [0,2,0,0,0,0|2,0,0]=4 250 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F SPC-h458 [0,2,0,0,0,0|1,0,0]=3 251 B12R1.367 COC(=O)C1=CC(=O)N(C)C=C1 SPC-j274 [0,2,0,0,0,0|2,0,0]=4 252 B12R1.367 COC(=O)C1=CC(Br)=C(O)C=C1 SPC-t211 [0,2,0,0,0,0|0,0,0]=2 253 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 SPC-h086 [0,2,0,0,0,0|1,0,1]=4 254 B12R1.367 COC(=O)C1=CN=C(I)C(O)=C1 SPC-t430 [0,2,0,0,0,0|2,0,0]=4 255 B12R1.367 COC(=O)C1=CN=C(O)C(O)=C1 SPC-m075 [0,2,0,0,0,0|1,0,0]=3 256 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 SPC-n444 [0,2,0,0,0,0|2,0,0]=4 257 B12R1.367 COC(=O)C1=NC(O)=C(O)C=C1 SPC-t463 [0,2,0,0,0,0|1,0,0]=3 258 B12R1.367 COC(=O)C1=NC=C(N)C(C)=C1 SPC-m143 [0,2,0,0,0,0|2,0,0]=4 259 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 SPC-n442 [0,2,0,0,0,0|1,0,0]=3 260 B12R1.893 NC1=C(C(=O)O)C=CC(Br)=C1F SPC-m953 [0,2,0,0,0,0|1,0,0]=3 261 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1F SPC-t528 [0,2,0,0,0,0|1,0,0]=3 262 B12R1.893 O=C(O)C1=CN=C(Cl)C(F)=C1Cl SPC-p463 [0,2,0,0,0,0|2,0,0]=4 263 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl SPC-u237 [0,2,0,0,0,0|2,0,0]=4 264 B12R1.893 OB(O)C1=CC=C(O)C(F)=C1F SPC-s024 [0,2,0,0,0,0|1,0,1]=4 265 B12R1.16 CCOC(=O)C1=CN=C(C)C=C1 SPC-j626 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 SPC-g103 [0,2,0,0,0,0|1,0,0]=3 267 B12R1.1703 COC(=O)C1=C(F)C=C(O)C=N1 SPC-q116 [0,2,0,0,0,0|1,0,0]=3 268 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 SPC-u789 [0,2,0,0,0,0|2,0,0]=4 269 B12R1.1703 COC(=O)C1=C(N)N=C(Cl)C=C1 SPC-h361 [0,2,0,0,0,0|2,0,0]=4 270 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1Cl SPC-r418 [0,2,0,0,0,0|2,0,0]=4 271 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl SPC-q139 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1F SPC-j930 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1N SPC-j271 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O SPC-u257 [0,2,0,0,0,0|2,0,0]=4 275 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O SPC-k091 [0,2,0,0,0,0|2,0,0]=4 276 B12R1.57 O=CC1=C(C(=O)O)C=CC(Br)=C1 SPC-t990 [0,2,0,0,0,0|1,0,0]=3 277 B12R1.1000 CC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 SPC-r415 [0,2,0,0,0,0|2,0,0]=4 278 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 SPC-u070 [0,0,0,1,0,1|2,0,0]=4 279 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 SPC-h316 [0,0,0,1,0,1|2,0,0]=4 280 B12R2.606 NC1=NC2=C(C=C(O)C=C2)S1 SPC-k660 [0,0,0,1,0,1|1,1,0]=4 281 B12R2.606 NC1=NC2=C(C=CC(O)=C2)S1 SPC-p166 [0,0,0,1,0,1|2,0,0]=4 282 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 SPC-g349 [0,0,0,1,0,1|2,0,0]=4 283 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 SPC-p794 [0,0,0,1,0,1|2,0,0]=4 284 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 SPC-g276 [0,0,0,1,0,1|2,0,0]=4 285 B12R2.606 OC1=CC2=C(C=C1)N=C(Cl)S2 SPC-t581 [0,0,0,1,0,1|1,1,0]=4 286 B12R2.612 CC1=CNC2=C1C=CC(O)=C2 SPC-t978 [0,1,0,1,0,0|2,0,0]=4 287 B12R2.612 NC1=CC2=C(C=C1)C(=O)NC2 SPC-h457 [0,1,0,1,0,0|2,0,0]=4 288 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 SPC-u370 [0,1,0,1,0,0|1,0,0]=3 289 B12R2.612 O=C1NCC2=C1C=CC(Br)=C2 SPC-q927 [0,1,0,1,0,0|2,0,0]=4 290 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 SPC-q956 [0,1,0,1,0,0|1,0,0]=3 291 B12R2.612 OB1OCC2=C1C=CC(O)=C2 SPC-n932 [0,1,0,1,0,0|1,0,1]=4 292 B8R1.1 CC1=CC(C=O)=CS1 SPC-k319 [1,0,0,0,1,0|2,0,0]=4 293 B8R1.1 O=CC1=CC(Br)=CS1 SPC-t562 [1,0,0,0,1,0|2,0,0]=4 294 B8R1.1 O=CC1=CSC(Br)=C1 SPC-r371 [1,0,0,0,1,0|2,0,0]=4 295 B8R1.1 O=CC1=CSC(Cl)=C1 SPC-j711 [1,0,0,0,1,0|2,0,0]=4 296 B8R1.7 CC(=O)C1=CSC=C1 SPC-g143 [1,0,0,0,1,0|2,0,0]=4 297 B8R1.7 O=C(O)C1=CC=CN1 SPC-g146 [1,0,0,0,1,0|1,0,0]=3 298 B8R1.7 O=C(O)C1=CNN=C1 SPC-g179 [1,0,0,0,1,0|2,0,0]=4 299 B8R1.7 O=C(O)C1=COC=C1 SPC-n400 [1,0,0,0,1,0|1,0,0]=3 300 B8R1.7 O=C(O)C1=COC=N1 SPC-g687 [1,0,0,0,1,0|2,0,0]=4 301 B8R1.7 O=C(O)C1=CSN=C1 SPC-r366 [1,0,0,0,1,0|2,0,0]=4 302 B8R1.7 O=C(O)C1=NNC=C1 SPC-g199 [1,0,0,0,1,0|2,0,0]=4 303 B10R1.18 O=C(O)CC1=CN=NC=C1 SPC-j090 [1,0,0,0,0,1|2,0,0]=4