0 B8R1.7 CC(=O)C1=CNC=N1 P51504 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.7 CC(=O)C1=CNN=C1 H-8406 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.7 CC(=O)C1=NNC=C1 Q62132 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.7 CC(=O)C1NCCS1 M15825 [0,0,0,0,0,0|0,0,4]=4 4 B8R1.7 CC(C)C1=CC=CO1 A-982 [0,0,0,0,0,0|2,1,1]=4 5 B8R1.7 CC(C)N1C=CC=N1 Q67289 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.7 CC(N)C1=NC=CS1 P51364 [0,0,0,0,0,0|1,0,1]=2 7 B8R1.7 CC(N)C1=NOC=N1 L20790 [0,0,0,0,0,0|3,0,1]=4 8 B8R1.7 CC(O)C1=CN=CS1 O32402 [0,0,0,0,0,0|2,0,2]=4 9 B8R1.7 C[C@@H](N)C1=NC=CS1 P51442 [0,0,0,0,0,0|1,0,1]=2 10 B8R1.7 C[C@H](N)C1=NC=CS1 P51443 [0,0,0,0,0,0|1,0,1]=2 11 B8R1.7 N=C(N)C1=NC=CN1 C-2876 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.7 N=C(N)C1=NC=CN1 G-5793 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.7 N=C(N)C1=NC=CN1 L13001 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.7 N=C(N)C1=NC=CS1 G-6701 [0,0,0,0,0,0|2,0,0]=2 15 B8R1.7 NC(=O)C1=CC=CN1 P38018 [0,0,0,0,0,0|2,0,1]=3 16 B8R1.7 NC(=O)C1=CN=CO1 O31664 [0,0,0,0,0,0|3,1,0]=4 17 B8R1.7 NC(=O)C1=CN=CS1 O30585 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.7 NC(=O)C1=CNC=N1 M15544 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.7 NC(=O)C1=COC=N1 O34456 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.7 NC(=S)C1=CN=CS1 O30283 [0,0,0,0,0,0|3,1,0]=4 21 B8R1.7 NC(=S)C1=CNC=N1 O30571 [0,0,0,0,0,0|3,1,0]=4 22 B8R1.7 NC(=S)C1=COC=N1 O31656 [0,0,0,0,0,0|3,1,0]=4 23 B8R1.7 NC(=S)C1=CSC=N1 O30629 [0,0,0,0,0,0|3,1,0]=4 24 B8R1.7 O=C(Cl)C1=NC=CS1 O31126 [0,0,0,0,0,0|1,0,0]=1 25 B8R1.7 O=C(O)C1=CC=NS1 P51141 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.7 O=C(O)C1=CNN=N1 F-4261 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.7 O=C(O)C1=COC=N1 I-9284 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.7 O=C(O)C1=NC=CO1 F-4564 [0,0,0,0,0,0|1,1,0]=2 29 B8R1.7 O=C(O)C1=NC=NO1 H-8647 [0,0,0,0,0,0|2,1,0]=3 30 B8R1.7 O=C(O)C1=NN=NN1 F-4828 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.7 O=C(O)C1=NNC=C1 I-9172 [0,0,0,0,0,0|3,0,0]=3 32 B8R1.7 O=C(O)C1=NSC=C1 O30998 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.7 O=C(O)C1CC=CC1 G-6381 [0,0,0,0,0,0|3,0,1]=4 34 B8R1.7 O=C([O-])C1=NC=CO1 K16120 [0,0,0,0,0,0|1,1,0]=2 35 B8R1.7 O=[N+]([O-])C1=CN=CS1 O31946 [0,0,0,0,0,0|4,0,0]=4 36 B7R1.1 BrCC1=NC=CS1 O30113 [1,0,0,0,0,0|1,0,1]=3 37 B7R1.1 C(=O)C1=CN=CS1 Q52103 [1,0,0,0,0,0|2,0,0]=3 38 B7R1.1 C=CC1=NNC=C1 L18271 [1,0,0,0,0,0|2,0,1]=4 39 B7R1.1 COC1=NNC=C1 Q61554 [1,0,0,0,0,0|3,0,0]=4 40 B7R1.1 CSC1=CC=CS1 Q67758 [1,0,0,0,0,0|2,0,0]=3 41 B7R1.1 ClCC1=CC=CS1 G-5616 [1,0,0,0,0,0|2,0,1]=4 42 B7R1.1 ClCC1=NC=CS1 A-634 [1,0,0,0,0,0|1,0,1]=3 43 B7R1.1 N#CC1=NC=CN1 C-2923 [1,0,0,0,0,0|2,0,1]=4 44 B7R1.1 N#CC1=NC=CN1 C-2923-01 [1,0,0,0,0,0|2,0,1]=4 45 B7R1.1 NCC1=NC=CS1 G-7857 [1,0,0,0,0,0|1,0,1]=3 46 B7R1.1 NCC1=NC=CS1 G-7858 [1,0,0,0,0,0|1,0,1]=3 47 B7R1.1 NCC1=NN=CS1 I-9693 [1,0,0,0,0,0|2,0,1]=4 48 B7R1.1 O=CC1=CN=CO1 I-9061 [1,0,0,0,0,0|2,1,0]=4 49 B7R1.1 O=CC1=COC=N1 K12239 [1,0,0,0,0,0|2,0,0]=3 50 B7R1.1 O=CC1=CSC=N1 Q68013 [1,0,0,0,0,0|2,0,0]=3 51 B7R1.1 O=CC1=NNC=C1 O31194 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.1 OCC1=NC=CN1 Q65640 [1,0,0,0,0,0|1,0,2]=4 53 B7R1.1 OCC1=NC=CS1 A-635 [1,0,0,0,0,0|0,0,2]=3 54 B9R1.11 COC(=O)C1=CC=CN1 G-7797 [0,1,0,0,0,0|1,0,1]=3 55 B9R1.11 COC(=O)C1=CN=CO1 O30359 [0,1,0,0,0,0|2,1,0]=4 56 B9R1.11 COC(=O)C1=CN=CS1 P48087 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.11 COC(=O)C1=NC=CN1 G-6057 [0,1,0,0,0,0|1,0,0]=2 58 B9R1.11 COC(=O)C1=NC=CS1 P37422 [0,1,0,0,0,0|0,0,0]=1 59 B9R1.11 COC(=O)C1=NNC=C1 P40994 [0,1,0,0,0,0|2,0,0]=3 60 B9R1.11 NNC(=O)C1=CN=CS1 O30333 [0,1,0,0,0,0|3,0,0]=4 61 B9R1.11 NNC(=O)C1=COC=N1 O30605 [0,1,0,0,0,0|3,0,0]=4 62 B9R1.11 NNC(=O)C1=CSC=N1 O31923 [0,1,0,0,0,0|3,0,0]=4 63 B9R1.11 NNC(=O)C1=NC=CS1 O31112 [0,1,0,0,0,0|1,0,0]=2 64 B9R1.11 O=C(CBr)C1=CC=CS1 P43533 [0,1,0,0,0,0|1,0,0]=2 65 B9R1.11 O=C(CBr)C1=CSC=C1 O31908 [0,1,0,0,0,0|3,0,0]=4 66 B9R1.11 O=C(CBr)C1=CSC=N1 O31047 [0,1,0,0,0,0|2,0,0]=3 67 B9R1.11 O=C(CBr)C1=NC=CS1 O31894 [0,1,0,0,0,0|0,0,0]=1 68 B9R1.11 O=CC(=O)C1=CC=CS1 P41441 [0,1,0,0,0,0|1,0,1]=3 69 B9R1.19 CC(C)(C)C1=NC=CN1 C-2891 [0,1,0,0,0,0|2,0,1]=4 70 B9R1.19 CS(=O)(=O)C1=NNC=C1 Q64204 [0,1,0,0,0,0|3,0,0]=4 71 B9R1.35 CC(=O)C1=CC(Br)=CS1 Q67343 [0,1,0,0,0,0|1,0,0]=2 72 B9R1.35 CC(=O)C1=CN=C(N)S1 L18220 [0,1,0,0,0,0|2,0,0]=3 73 B9R1.35 CC(=O)C1=CSC(Cl)=C1 G-5625 [0,1,0,0,0,0|3,0,0]=4 74 B9R1.35 CC(=O)C1=NC(Br)=CS1 Q68164 [0,1,0,0,0,0|0,0,0]=1 75 B9R1.35 CC(=O)C1=NC(C)=CO1 M15480 [0,1,0,0,0,0|0,1,0]=2 76 B9R1.35 CC(=O)C1=NC=C(Br)S1 I-9633 [0,1,0,0,0,0|0,0,0]=1 77 B9R1.35 CC(=O)C1=NC=C(C)S1 O31088 [0,1,0,0,0,0|0,0,0]=1 78 B9R1.35 CC(=O)C1=NN(C)C=C1 K12255 [0,1,0,0,0,0|2,0,0]=3 79 B9R1.35 CC(=O)C1=NNC(N)=C1 G-7055 [0,1,0,0,0,0|2,0,0]=3 80 B9R1.35 CC(C)C1=NC(Br)=CS1 M23841 [0,1,0,0,0,0|1,0,1]=3 81 B9R1.35 CC(C)C1=NC(Cl)=NS1 L19669 [0,1,0,0,0,0|2,0,1]=4 82 B9R1.35 CC(C)C1=NC=C(Br)S1 O33541 [0,1,0,0,0,0|1,0,1]=3 83 B9R1.35 CC1=CC(C(=O)O)=NN1 G-6037 [0,1,0,0,0,0|3,0,0]=4 84 B9R1.35 CC1=CN=C(C(=O)[O-])O1 L21445 [0,1,0,0,0,0|1,1,0]=3 85 B9R1.35 CC1=CNC(C(C)C)=N1 P51555 [0,1,0,0,0,0|2,0,1]=4 86 B9R1.35 CC1=COC(C(=O)O)=C1 O29596 [0,1,0,0,0,0|2,1,0]=4 87 B9R1.35 CC1=CSC(C(=O)O)=C1 G-7586 [0,1,0,0,0,0|2,0,0]=3 88 B9R1.35 CC1=CSC(C(C)N)=N1 O31672 [0,1,0,0,0,0|1,0,1]=3 89 B9R1.35 CC1=NC(C(N)=O)=CS1 O34426 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.35 CC1=NSC(C(=O)[O-])=N1 P50213 [0,1,0,0,0,0|2,0,0]=3 91 B9R1.35 CN(C)C1=NC(Br)=CS1 N25117 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.35 CN1C=CC(C(=O)Cl)=N1 O30468 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.35 CN1C=CC(C(=O)O)=N1 K12250 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.35 CN1C=NC(C(=O)O)=C1 G-5691 [0,1,0,0,0,0|3,0,0]=4 95 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 I-9085 [0,1,0,0,0,0|1,0,2]=4 96 B9R1.35 FC(F)C1=NC=C(Br)S1 I-9986 [0,1,0,0,0,0|2,0,1]=4 97 B9R1.35 NC(=O)C1=CC=C(Br)N1 G-6434 [0,1,0,0,0,0|2,0,1]=4 98 B9R1.35 NC(=O)C1=CN=C(Br)S1 P35827 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.35 NC1=CN=C(C(=O)O)S1 G-5065 [0,1,0,0,0,0|1,0,0]=2 100 B9R1.35 NC1=NC(C(=O)O)=CO1 G-7158 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.35 NC1=NC(C(=O)O)=CS1 O30841 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.35 O=C(O)C1=CC(Cl)=CS1 O30065 [0,1,0,0,0,0|2,0,0]=3 103 B9R1.35 O=C(O)C1=CC=C(Cl)S1 G-6814 [0,1,0,0,0,0|2,0,0]=3 104 B9R1.35 O=C(O)C1=CC=C(F)S1 G-5621 [0,1,0,0,0,0|2,0,0]=3 105 B9R1.35 O=C(O)C1=CN=C(Cl)S1 O31901 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.35 O=C(O)C1=COC(Cl)=N1 O30387 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.35 O=C(O)C1=NC(Br)=CS1 G-6045 [0,1,0,0,0,0|1,0,0]=2 108 B9R1.35 O=C(O)C1=NC=C(Br)S1 I-9912 [0,1,0,0,0,0|1,0,0]=2 109 B9R1.35 O=C(O)C1=NC=C(Cl)S1 I-9904 [0,1,0,0,0,0|1,0,0]=2 110 B9R1.35 O=C(O)C1=NNC(Br)=C1 H-8089 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.35 O=C(O)C1=NNC(Cl)=C1 O34355 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.35 O=C(O)C1=NNC(F)=C1 Q52440 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.35 O=[N+]([O-])C1=NC=C(Br)S1 O32608 [0,1,0,0,0,0|2,0,0]=3 114 B9R1.41 CC(=O)C1=C(Br)C=CS1 Q65588 [0,1,0,0,0,0|1,0,0]=2 115 B9R1.41 CC(=O)C1=CC=NN1C N24556 [0,1,0,0,0,0|2,0,1]=4 116 B9R1.41 CC(=O)C1=NC=CN1C C-2913 [0,1,0,0,0,0|1,0,0]=2 117 B9R1.41 CC1=C(C(=O)Cl)SC=N1 F-4290 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.41 CC1=C(C(=O)O)N=CO1 O31842 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.41 CC1=C(C(=O)O)N=CS1 10657 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.41 CN1C=CN=C1C(=N)N C-2875 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.41 CN1C=CN=C1[N+](=O)[O-] Q69384 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.41 NC(=O)C1=CC=CN1N L13700 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.41 O=C(O)C1=C(Br)C=CS1 G-6768 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.41 O=C(O)C1=C(Br)N=CS1 Q68781 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.41 O=C(O)C1=C(Br)SC=N1 O34437 [0,1,0,0,0,0|3,0,0]=4 126 B9R1.41 O=C(O)C1=C(Cl)C=CN1 H-8302 [0,1,0,0,0,0|2,0,1]=4 127 B9R1.41 O=C(O)C1=NNC=C1F Q64164 [0,1,0,0,0,0|3,0,0]=4 128 B9R2.2 C1=CNC(C2CC2)=N1 C-2889 [0,0,0,1,0,0|2,0,1]=4 129 B7R1.18 O=C([O-])C1=CCC1 P50045 [0,0,0,0,1,0|2,0,1]=4 130 B9R1.6 CC(=O)C1=CC=CN=C1 P44672 [0,0,0,0,0,1|1,0,0]=2 131 B9R1.6 CC(=O)C1=CC=NN=C1 G-6740 [0,0,0,0,0,1|2,0,0]=3 132 B9R1.6 CC(=O)C1=CN=CN=C1 G-5167 [0,0,0,0,0,1|2,0,0]=3 133 B9R1.6 CC(=O)C1=NC=CC=N1 G-6326 [0,0,0,0,0,1|1,0,0]=2 134 B9R1.6 CC(=O)C1=NC=NC=C1 O34283 [0,0,0,0,0,1|1,0,0]=2 135 B9R1.6 CC(=O)C1=NN=CC=C1 C-2755 [0,0,0,0,0,1|1,0,0]=2 136 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [0,0,0,0,0,1|2,0,1]=4 137 B9R1.6 CC(N)C1=CC=NC=N1 Q51822 [0,0,0,0,0,1|2,0,1]=4 138 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [0,0,0,0,0,1|2,0,1]=4 139 B9R1.6 CC(N)C1=NC=CC=N1 Q55479 [0,0,0,0,0,1|2,0,1]=4 140 B9R1.6 CS(=O)C1=NC=CC=C1 O34232 [0,0,0,0,0,1|2,0,0]=3 141 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [0,0,0,0,0,1|2,0,1]=4 142 B9R1.6 C[C@@H](N)C1=NC=CC=N1 Q57196 [0,0,0,0,0,1|2,0,1]=4 143 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q57195 [0,0,0,0,0,1|2,0,1]=4 144 B9R1.6 C[C@H](N)C1=NC=CC=N1 Q65669 [0,0,0,0,0,1|2,0,1]=4 145 B9R1.6 N=C(N)C1=NC=CC=C1 O34083 [0,0,0,0,0,1|3,0,0]=4 146 B9R1.6 NC(=O)C1=NC=NC=C1 P51213 [0,0,0,0,0,1|2,0,0]=3 147 B9R1.6 O=C(O)C1=CC=CN=N1 C-2266 [0,0,0,0,0,1|2,0,0]=3 148 B9R1.6 O=C(O)C1=CC=NC=N1 C-2226 [0,0,0,0,0,1|2,0,0]=3 149 B9R1.6 O=C(O)C1=CC=NN=C1 C-3207 [0,0,0,0,0,1|3,0,0]=4 150 B9R1.6 O=C(O)C1=CN=CC=N1 C-3429 [0,0,0,0,0,1|2,0,0]=3 151 B9R1.6 O=C(O)C1=CN=CN=C1 C-3274 [0,0,0,0,0,1|3,0,0]=4 152 B9R1.6 O=C(O)C1=NC=CC=N1 C-3378 [0,0,0,0,0,1|2,0,0]=3 153 B9R1.6 O=S([O-])C1=CC=CN=C1 O32481 [0,0,0,0,0,1|3,0,0]=4 154 B9R1.6 O=S([O-])C1=NC=CC=C1 O32707 [0,0,0,0,0,1|3,0,0]=4 155 B9R1.13 O=C(O)CC1=CC=CS1 I-9532 [0,0,0,0,0,1|2,0,0]=3 156 B9R1.13 O=C(O)CC1=CNC=N1 H-8782 [0,0,0,0,0,1|3,0,0]=4 157 B9R1.13 O=C(O)CC1=CSC=N1 O30547 [0,0,0,0,0,1|3,0,0]=4 158 B9R1.13 O=C(O)CC1=NC=NN1 Q56325 [0,0,0,0,0,1|3,0,0]=4 159 B9R1.13 O=C(O)CC1=NNC=C1 P51092 [0,0,0,0,0,1|3,0,0]=4 160 B9R1.13 O=C(O)CC1=NNC=N1 G-7884 [0,0,0,0,0,1|3,0,0]=4 161 B6R1.2 BrC1=NC=CN1 P40717 [2,0,0,0,0,0|2,0,0]=4 162 B6R1.2 BrC1=NC=NS1 O33981 [2,0,0,0,0,0|2,0,0]=4 163 B6R1.2 BrC1=NN=CS1 G-7144 [2,0,0,0,0,0|2,0,0]=4 164 B6R1.2 CC1=COC=N1 M15472 [2,0,0,0,0,0|2,0,0]=4 165 B6R1.2 CN1C=CC=N1 G-7493 [2,0,0,0,0,0|2,0,0]=4 166 B6R1.2 ClC1=NC=CN1 O34261 [2,0,0,0,0,0|2,0,0]=4 167 B6R1.2 ClC1=NC=NS1 O33984 [2,0,0,0,0,0|2,0,0]=4 168 B6R1.2 IC1=NC=CN1 P38939 [2,0,0,0,0,0|2,0,0]=4 169 B6R1.2 IC1=NC=CO1 G-7159 [2,0,0,0,0,0|1,1,0]=4 170 B6R1.2 IC1=NC=CS1 A-965 [2,0,0,0,0,0|1,0,0]=3 171 B6R1.2 NC1=NC=CN1 I-9868 [2,0,0,0,0,0|2,0,0]=4 172 B6R1.2 NC1=NC=CO1 E-3055 [2,0,0,0,0,0|1,1,0]=4 173 B8R1.1 CC1=CSC(C#N)=N1 G-6557 [1,1,0,0,0,0|1,0,1]=4 174 B8R1.1 CC1=CSC(C=O)=C1 Q67410 [1,1,0,0,0,0|1,0,0]=3 175 B8R1.1 CC1=CSC(CO)=N1 O31821 [1,1,0,0,0,0|0,0,2]=4 176 B8R1.1 CC1=NC(C=O)=CO1 O30450 [1,1,0,0,0,0|2,0,0]=4 177 B8R1.1 CC1=NC(C=O)=CS1 O30852 [1,1,0,0,0,0|2,0,0]=4 178 B8R1.1 CC1=NC=C(C=O)S1 O31139 [1,1,0,0,0,0|2,0,0]=4 179 B8R1.1 CCC1=NC(Br)=CN1 K12066 [1,1,0,0,0,0|1,0,1]=4 180 B8R1.1 CCC1=NC=C(Br)S1 K12067 [1,1,0,0,0,0|0,0,1]=3 181 B8R1.1 CN1C=CC(C=O)=N1 O31801 [1,1,0,0,0,0|2,0,0]=4 182 B8R1.1 CN1C=NC(C=O)=C1 G-6087 [1,1,0,0,0,0|2,0,0]=4 183 B8R1.1 COC1=NC=C(Br)S1 M23855 [1,1,0,0,0,0|1,0,0]=3 184 B8R1.1 CSC1=CC(Br)=CS1 N26878 [1,1,0,0,0,0|2,0,0]=4 185 B8R1.1 CSC1=CC(C)=CS1 N26956 [1,1,0,0,0,0|2,0,0]=4 186 B8R1.1 CSC1=CC=C(Br)S1 Q67761 [1,1,0,0,0,0|2,0,0]=4 187 B8R1.1 CSC1=NC(Br)=CS1 O30757 [1,1,0,0,0,0|1,0,0]=3 188 B8R1.1 N#CC1=NC(Br)=CS1 I-9908 [1,1,0,0,0,0|1,0,1]=4 189 B8R1.1 N#CC1=NC(Cl)=CS1 C-2870 [1,1,0,0,0,0|1,0,1]=4 190 B8R1.1 N#CC1=NC=C(Br)S1 L13108 [1,1,0,0,0,0|1,0,1]=4 191 B8R1.1 N#CC1=NC=C(Cl)S1 S72515 [1,1,0,0,0,0|1,0,1]=4 192 B8R1.1 NC1=NC=C(C=O)S1 P43544 [1,1,0,0,0,0|2,0,0]=4 193 B8R1.1 NC1=NN=C(C=O)S1 Q70092 [1,1,0,0,0,0|1,0,0]=3 194 B8R1.1 NCC1=NC=C(Br)S1 I-9749 [1,1,0,0,0,0|1,0,1]=4 195 B8R1.1 NCC1=NC=C(Cl)S1 L14499 [1,1,0,0,0,0|1,0,1]=4 196 B8R1.1 O=CC1=CC(Cl)=CS1 O30331 [1,1,0,0,0,0|1,0,0]=3 197 B8R1.1 O=CC1=CC(I)=CN1 O30775 [1,1,0,0,0,0|1,0,1]=4 198 B8R1.1 O=CC1=CC=C(Cl)S1 G-5619 [1,1,0,0,0,0|1,0,0]=3 199 B8R1.1 O=CC1=CN=C(Br)S1 Q67553 [1,1,0,0,0,0|2,0,0]=4 200 B8R1.1 O=CC1=CN=C(Cl)S1 S70888 [1,1,0,0,0,0|2,0,0]=4 201 B8R1.1 O=CC1=CSC(Cl)=N1 O31704 [1,1,0,0,0,0|2,0,0]=4 202 B8R1.1 O=CC1=NC(Br)=CS1 Q68032 [1,1,0,0,0,0|0,0,0]=2 203 B8R1.1 O=CC1=NC=C(Br)S1 G-5715 [1,1,0,0,0,0|0,0,0]=2 204 B8R1.1 O=CC1=NC=C(Cl)S1 G-5979 [1,1,0,0,0,0|0,0,0]=2 205 B8R1.1 OCC1=NC(Br)=CS1 G-7038 [1,1,0,0,0,0|0,0,2]=4 206 B8R1.1 OCC1=NC=C(Br)S1 G-6844 [1,1,0,0,0,0|0,0,2]=4 207 B8R1.1 OCC1=NC=C(Cl)S1 I-9903 [1,1,0,0,0,0|0,0,2]=4 208 B8R1.8 COCC1=CC=CS1 N26844 [1,1,0,0,0,0|1,0,1]=4 209 B8R1.8 N#CCC1=NC=CS1 G-5780 [1,1,0,0,0,0|0,0,2]=4 210 B8R1.8 NCCC1=NN=CS1 G-7856 [1,1,0,0,0,0|1,0,1]=4 211 B8R1.8 O=CCN1C=CC=N1 S72479 [1,1,0,0,0,0|2,0,0]=4 212 B8R1.8 OCCC1=CC=CS1 I-9194 [1,1,0,0,0,0|1,0,1]=4 213 B8R1.8 OCCC1=NC=CS1 L19275 [1,1,0,0,0,0|0,0,1]=3 214 B8R1.11 CC1=CNN=C1C=O Q60308 [1,1,0,0,0,0|2,0,0]=4 215 B8R1.11 CN1C=CN=C1C=O Q67822 [1,1,0,0,0,0|1,0,0]=3 216 B8R1.11 CNC1=NC=CN1C H-8117 [1,1,0,0,0,0|2,0,0]=4 217 B8R1.11 CNC1=NC=CN1C H-8117-01 [1,1,0,0,0,0|2,0,0]=4 218 B8R1.11 CSC1=C(Br)C=CS1 N26856 [1,1,0,0,0,0|2,0,0]=4 219 B8R1.11 O=CC1=C(Br)C=CS1 Q66577 [1,1,0,0,0,0|1,0,0]=3 220 B8R1.11 O=CC1=C(Br)N=CS1 N26350 [1,1,0,0,0,0|2,0,0]=4 221 B8R1.38 COC(=O)C1C=CC1 P47818 [0,1,0,0,1,0|1,0,1]=4 222 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [0,1,0,0,0,1|1,0,0]=3 223 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [0,1,0,0,0,1|1,0,0]=3 224 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [0,1,0,0,0,1|1,0,0]=3 225 B10R1.13 CC(=O)C1=CN=C(C)N=C1 H-8030 [0,1,0,0,0,1|2,0,0]=4 226 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 Q54991 [0,1,0,0,0,1|2,0,0]=4 227 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [0,1,0,0,0,1|1,0,0]=3 228 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [0,1,0,0,0,1|1,0,0]=3 229 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 G-7164 [0,1,0,0,0,1|1,0,0]=3 230 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [0,1,0,0,0,1|1,0,0]=3 231 B10R1.13 CC(=O)C1=NC=C(C)C=N1 O31005 [0,1,0,0,0,1|1,0,0]=3 232 B10R1.13 CC(=O)C1=NC=C(C)N=C1 F-4678 [0,1,0,0,0,1|1,0,0]=3 233 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [0,1,0,0,0,1|1,0,0]=3 234 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 O30416 [0,1,0,0,0,1|1,0,0]=3 235 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [0,1,0,0,0,1|1,0,0]=3 236 B10R1.13 CC(=O)C1=NC=C(F)C=N1 O30210 [0,1,0,0,0,1|1,0,0]=3 237 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 L13130 [0,1,0,0,0,1|1,0,0]=3 238 B10R1.13 CC(=O)C1=NN=C(O)C=C1 P51623 [0,1,0,0,0,1|1,0,0]=3 239 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [0,1,0,0,0,1|2,0,0]=4 240 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [0,1,0,0,0,1|2,0,0]=4 241 B10R1.13 NC(=O)C1=CC=C(Br)N=C1 P35365 [0,1,0,0,0,1|2,0,0]=4 242 B10R1.13 NC(=O)C1=CC=C(F)N=C1 Q58490 [0,1,0,0,0,1|2,0,0]=4 243 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 O30890 [0,1,0,0,0,1|2,0,0]=4 244 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 N24759 [0,1,0,0,0,1|2,0,0]=4 245 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [0,1,0,0,0,1|2,0,0]=4 246 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [0,1,0,0,0,1|2,0,0]=4 247 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 O31863 [0,1,0,0,0,1|2,0,0]=4 248 B10R1.13 NC(=O)C1=NN=C(N)C=C1 G-7026 [0,1,0,0,0,1|2,0,0]=4 249 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [0,1,0,0,0,1|2,0,0]=4 250 B10R1.13 NC1=CN=C(C(=O)O)C=N1 10608 [0,1,0,0,0,1|2,0,0]=4 251 B10R1.13 NC1=CN=C(C(=O)O)N=C1 O33536 [0,1,0,0,0,1|2,0,0]=4 252 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [0,1,0,0,0,1|2,0,0]=4 253 B10R1.13 NC1=NN=C(C(=O)O)C=C1 G-5218 [0,1,0,0,0,1|2,0,0]=4 254 B10R1.13 O=C(Cl)C1=NC=C(Cl)C=C1 N25108 [0,1,0,0,0,1|2,0,0]=4 255 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [0,1,0,0,0,1|2,0,0]=4 256 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [0,1,0,0,0,1|2,0,0]=4 257 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [0,1,0,0,0,1|2,0,0]=4 258 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 Q52548 [0,1,0,0,0,1|2,0,0]=4 259 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 G-7253 [0,1,0,0,0,1|2,0,0]=4 260 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 B-1219 [0,1,0,0,0,1|2,0,0]=4 261 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [0,1,0,0,0,1|2,0,0]=4 262 B10R1.13 O=C(O)C1=NC=C(F)C=N1 H-8066 [0,1,0,0,0,1|2,0,0]=4 263 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [0,1,0,0,0,1|2,0,0]=4 264 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 L14250 [0,1,0,0,0,1|2,0,0]=4 265 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 B-1753 [0,1,0,0,0,1|2,0,0]=4 266 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [0,1,0,0,0,1|1,0,1]=4 267 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [0,1,0,0,0,1|1,0,1]=4 268 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [0,1,0,0,0,1|1,0,0]=3 269 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [0,1,0,0,0,1|2,0,0]=4 270 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [0,1,0,0,0,1|1,0,0]=3 271 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [0,1,0,0,0,1|1,0,0]=3 272 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [0,1,0,0,0,1|1,0,0]=3 273 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [0,1,0,0,0,1|2,0,0]=4 274 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [0,1,0,0,0,1|1,0,0]=3 275 B10R1.15 NNC(=O)C1=NC=NC=C1 O30565 [0,1,0,0,0,1|2,0,0]=4 276 B10R1.15 O=C(CBr)C1=CC=CC=N1 Q58258 [0,1,0,0,0,1|1,0,0]=3 277 B10R1.15 O=C(CBr)C1=CC=CN=C1 Q55443 [0,1,0,0,0,1|1,0,0]=3 278 B10R1.15 O=C(CBr)C1=CN=CN=C1 Q54899 [0,1,0,0,0,1|2,0,0]=4 279 B10R1.15 O=C(CBr)C1=NC=CC=N1 L22105 [0,1,0,0,0,1|1,0,0]=3 280 B10R1.15 O=C(CBr)C1=NC=CC=N1 Q52568 [0,1,0,0,0,1|1,0,0]=3 281 B10R1.15 O=C(CBr)C1=NC=NC=C1 P51516 [0,1,0,0,0,1|1,0,0]=3 282 B10R1.15 O=C(CCl)C1=CC=CN=C1 O29841 [0,1,0,0,0,1|1,0,0]=3 283 B10R1.15 O=C(CCl)C1=NC=CN=C1 L19661 [0,1,0,0,0,1|1,0,0]=3 284 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 G-7564 [0,1,0,0,0,1|2,0,0]=4 285 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Q54381 [0,1,0,0,0,1|1,0,0]=3 286 B10R1.61 CC(=O)C1=CC=CN=C1Br F-4747 [0,1,0,0,0,1|1,0,0]=3 287 B10R1.61 CC(=O)C1=CC=CN=C1C Q52526 [0,1,0,0,0,1|1,0,0]=3 288 B10R1.61 CC(=O)C1=CC=CN=C1F O30900 [0,1,0,0,0,1|1,0,0]=3 289 B10R1.61 CC(=O)C1=CC=CN=C1N Q52860 [0,1,0,0,0,1|1,0,0]=3 290 B10R1.61 CC(=O)C1=CN=CN=C1C Q58769 [0,1,0,0,0,1|2,0,0]=4 291 B10R1.61 CC(=O)C1=NC=CC=C1Cl G-7206 [0,1,0,0,0,1|1,0,0]=3 292 B10R1.61 CC(=O)C1=NC=CC=C1F O30529 [0,1,0,0,0,1|1,0,0]=3 293 B10R1.61 CC(=O)C1=NC=CC=C1O P41694 [0,1,0,0,0,1|1,0,0]=3 294 B10R1.61 CC(=O)C1=NC=CN=C1Cl G-7946 [0,1,0,0,0,1|1,0,0]=3 295 B10R1.61 CC1=C(C(=O)O)N=NC=C1 L13035 [0,1,0,0,0,1|2,0,0]=4 296 B10R1.61 CC1=CC=NC=C1C(=O)O G-5539 [0,1,0,0,0,1|2,0,0]=4 297 B10R1.61 CC1=CN=CN=C1C(=O)O O33331 [0,1,0,0,0,1|2,0,0]=4 298 B10R1.61 CC1=NC=CC=C1C(=O)O E-3023 [0,1,0,0,0,1|2,0,0]=4 299 B10R1.61 CC1=NC=CN=C1C(=O)O G-5660 [0,1,0,0,0,1|2,0,0]=4 300 B10R1.61 NC(=O)C1=C(N)C=CN=C1 C-3535 [0,1,0,0,0,1|2,0,0]=4 301 B10R1.61 NC(=O)C1=CC=CN=C1F N25255 [0,1,0,0,0,1|2,0,0]=4 302 B10R1.61 NC(=O)C1=NC=CC=C1N C-3697 [0,1,0,0,0,1|2,0,0]=4 303 B10R1.61 NC1=C(C(=O)O)C=NC=C1 G-5409 [0,1,0,0,0,1|2,0,0]=4 304 B10R1.61 NC1=C(C(=O)O)N=CN=C1 Q57220 [0,1,0,0,0,1|2,0,0]=4 305 B10R1.61 NC1=CC=CN=C1C(=O)O C-3331 [0,1,0,0,0,1|2,0,0]=4 306 B10R1.61 O=C(Cl)C1=CC=CN=C1Br N24418 [0,1,0,0,0,1|2,0,0]=4 307 B10R1.61 O=C(Cl)C1=CC=CN=C1F N25171 [0,1,0,0,0,1|2,0,0]=4 308 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 E-3001 [0,1,0,0,0,1|2,0,0]=4 309 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 H-8359 [0,1,0,0,0,1|2,0,0]=4 310 B10R1.61 O=C(O)C1=CN=CC=C1F O34100 [0,1,0,0,0,1|2,0,0]=4 311 B10R1.61 O=C(O)C1=NC=CC=C1F H-8045 [0,1,0,0,0,1|2,0,0]=4 312 B10R1.61 O=C(O)C1=NC=CC=C1O I-9324 [0,1,0,0,0,1|2,0,0]=4 313 B10R1.61 O=C(O)C1=NC=CN=C1Br S70901 [0,1,0,0,0,1|2,0,0]=4 314 B10R1.61 O=C(O)C1=NC=CN=C1Cl G-5403 [0,1,0,0,0,1|2,0,0]=4 315 B10R1.61 O=C(O)C1=NC=CN=C1I O29988 [0,1,0,0,0,1|2,0,0]=4 316 B10R1.61 O=C(O)C1=NC=CN=C1O C-3727 [0,1,0,0,0,1|2,0,0]=4 317 B10R1.61 O=C(O)C1=NC=NC=C1Cl P51523 [0,1,0,0,0,1|2,0,0]=4 318 B10R1.61 O=C(O)C1=NC=NC=C1F O33158 [0,1,0,0,0,1|2,0,0]=4 319 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Q62345 [0,1,0,0,0,1|2,0,0]=4 320 B10R1.113 CC(=O)C1=CC(C)=NC=N1 M15580 [0,1,0,0,0,1|1,0,0]=3 321 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 O32374 [0,1,0,0,0,1|1,0,0]=3 322 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C-3316 [0,1,0,0,0,1|2,0,0]=4 323 B10R1.113 CC(=O)C1=CC(F)=CN=C1 P43295 [0,1,0,0,0,1|1,0,0]=3 324 B10R1.113 CC(=O)C1=NC=CC(C)=C1 P37184 [0,1,0,0,0,1|1,0,0]=3 325 B10R1.113 CC(=O)C1=NC=CC(C)=N1 Q65344 [0,1,0,0,0,1|1,0,0]=3 326 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 P37163 [0,1,0,0,0,1|1,0,0]=3 327 B10R1.113 CC1=CC(C(=O)O)=NN=C1 L14505 [0,1,0,0,0,1|2,0,0]=4 328 B10R1.113 CC1=CN=CC(C(=O)O)=C1 I-9162 [0,1,0,0,0,1|2,0,0]=4 329 B10R1.113 CC1=CN=CC(C(=O)O)=N1 G-6898 [0,1,0,0,0,1|2,0,0]=4 330 B10R1.113 CC1=NC(C(=O)O)=NC=C1 L14301 [0,1,0,0,0,1|2,0,0]=4 331 B10R1.113 CC1=NC=NC(C(=O)O)=C1 I-9646 [0,1,0,0,0,1|2,0,0]=4 332 B10R1.113 NC(=O)C1=CC(Cl)=CN=C1 O29660 [0,1,0,0,0,1|2,0,0]=4 333 B10R1.113 NC(=O)C1=CC(F)=CN=C1 P36523 [0,1,0,0,0,1|2,0,0]=4 334 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 O30750 [0,1,0,0,0,1|2,0,0]=4 335 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 G-6824 [0,1,0,0,0,1|2,0,0]=4 336 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 G-7501 [0,1,0,0,0,1|2,0,0]=4 337 B10R1.113 NC1=NC=CC(C(=O)O)=N1 O31660 [0,1,0,0,0,1|2,0,0]=4 338 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 Q66304 [0,1,0,0,0,1|2,0,0]=4 339 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 Q68020 [0,1,0,0,0,1|2,0,0]=4 340 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 G-6966 [0,1,0,0,0,1|2,0,0]=4 341 B10R1.113 O=C(O)C1=CC(F)=CN=C1 C-3613 [0,1,0,0,0,1|2,0,0]=4 342 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 L13496 [0,1,0,0,0,1|2,0,0]=4 343 B10R1.113 O=C(O)C1=CC=CC(S)=N1 Q58206 [0,1,0,0,0,1|2,0,0]=4 344 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 G-6839 [0,1,0,0,0,1|2,0,0]=4 345 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C-2323 [0,1,0,0,0,1|2,0,0]=4 346 B10R1.113 O=C(O)C1=CN=CC(O)=C1 G-7172 [0,1,0,0,0,1|2,0,0]=4 347 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 O30875 [0,1,0,0,0,1|2,0,0]=4 348 B10R1.113 O=C(O)C1=NC(O)=NC=C1 O30222 [0,1,0,0,0,1|2,0,0]=4 349 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B-1209 [0,1,0,0,0,1|2,0,0]=4 350 B10R1.113 O=C(O)C1=NC=CC(F)=C1 O30336 [0,1,0,0,0,1|2,0,0]=4 351 B10R1.113 O=C(O)C1=NC=CC(I)=C1 G-6705 [0,1,0,0,0,1|2,0,0]=4 352 B10R1.23 NC(C(=O)O)C1=CC=CS1 O28791 [0,1,0,0,0,1|2,0,0]=4 353 B10R1.23 N[C@@H](C(=O)O)C1=CC=CS1 G-7084 [0,1,0,0,0,1|2,0,0]=4 354 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 P36827 [0,1,0,0,0,1|2,0,0]=4 355 B10R1.27 COC(=O)CC1=CNC=N1 K13414 [0,1,0,0,0,1|2,0,0]=4 356 B10R1.54 CC(=O)NC1=NC=C(Br)S1 O30838 [0,1,0,0,0,1|0,0,0]=2 357 B10R1.54 CC(=O)NC1CC=C(Br)S1 P43456 [0,1,0,0,0,1|1,0,1]=4 358 B10R1.54 O=C(O)CC1=CC=C(Br)S1 O31012 [0,1,0,0,0,1|2,0,0]=4 359 B10R1.54 O=C(O)CC1=NC(Cl)=CS1 G-6709 [0,1,0,0,0,1|1,0,0]=3 360 B10R1.54 O=C(O)CC1=NC=C(Cl)S1 G-6000 [0,1,0,0,0,1|1,0,0]=3 361 B10R1.54 O=C(O)CC1=NC=C(O)N1 F-4532 [0,1,0,0,0,1|2,0,0]=4 362 B10R1.11 CCOC(=O)C1=CN=CS1 A-893 [0,2,0,0,0,0|2,0,0]=4 363 B10R1.11 CCOC(=O)C1=CNC=N1 P39470 [0,2,0,0,0,0|2,0,0]=4 364 B10R1.11 CCOC(=O)C1=COC=N1 G-6096 [0,2,0,0,0,0|2,0,0]=4 365 B10R1.11 CCOC(=O)C1=NC=CS1 O31759 [0,2,0,0,0,0|0,0,0]=2 366 B10R1.11 CCOC(=O)C1=NOC=C1 G-5148 [0,2,0,0,0,0|2,0,0]=4 367 B10R1.11 N#CCC(=O)C1=CC=CO1 P38856 [0,2,0,0,0,0|1,1,0]=4 368 B10R1.11 N#CCC(=O)C1=CC=CS1 P38721 [0,2,0,0,0,0|1,0,0]=3 369 B10R1.14 CNC(=O)C1=COC(N)=N1 L18604 [0,2,0,0,0,0|2,0,0]=4 370 B10R1.14 CNC(=O)C1=CSC(Br)=N1 P42699 [0,2,0,0,0,0|2,0,0]=4 371 B10R1.14 COC(=O)C1=CC(Br)=CS1 G-5587 [0,2,0,0,0,0|1,0,0]=3 372 B10R1.14 COC(=O)C1=CC(Cl)=CN1 Q53057 [0,2,0,0,0,0|1,0,1]=4 373 B10R1.14 COC(=O)C1=CC(Cl)=CS1 L22458 [0,2,0,0,0,0|1,0,0]=3 374 B10R1.14 COC(=O)C1=CC=C(Br)N1 O30342 [0,2,0,0,0,0|1,0,1]=4 375 B10R1.14 COC(=O)C1=CC=C(Br)S1 G-5588 [0,2,0,0,0,0|1,0,0]=3 376 B10R1.14 COC(=O)C1=CC=C(N)O1 G-7080 [0,2,0,0,0,0|1,1,0]=4 377 B10R1.14 COC(=O)C1=CN(C)C=N1 O30861 [0,2,0,0,0,0|2,0,0]=4 378 B10R1.14 COC(=O)C1=COC(Br)=N1 O31619 [0,2,0,0,0,0|2,0,0]=4 379 B10R1.14 COC(=O)C1=COC(N)=N1 Q54663 [0,2,0,0,0,0|2,0,0]=4 380 B10R1.14 COC(=O)C1=CSC(C)=N1 O34523 [0,2,0,0,0,0|2,0,0]=4 381 B10R1.14 COC(=O)C1=NC(Br)=CS1 G-7043 [0,2,0,0,0,0|0,0,0]=2 382 B10R1.14 COC(=O)C1=NC=C(Br)S1 I-9906 [0,2,0,0,0,0|0,0,0]=2 383 B10R1.14 COC(=O)C1=NC=C(C)O1 L13687 [0,2,0,0,0,0|0,1,0]=3 384 B10R1.14 COC(=O)C1=NN(C)C=C1 K12251 [0,2,0,0,0,0|2,0,0]=4 385 B10R1.14 COC(=O)C1=NN(C)C=N1 M15206 [0,2,0,0,0,0|2,0,0]=4 386 B10R1.14 COC(=O)C1=NNC(Br)=N1 M15625 [0,2,0,0,0,0|2,0,0]=4 387 B10R1.14 COC(=O)C1=NNC(Cl)=C1 L21402 [0,2,0,0,0,0|2,0,0]=4 388 B10R1.14 COC(=O)C1=NNC(I)=C1 I-9421 [0,2,0,0,0,0|2,0,0]=4 389 B10R1.149 COC(=O)C1=C(Br)C=CN1 G-6702 [0,2,0,0,0,0|1,0,1]=4 390 B10R1.149 COC(=O)C1=C(Br)N=CS1 Q68782 [0,2,0,0,0,0|2,0,0]=4 391 B10R1.149 COC(=O)C1=C(C)C=CN1 G-7400 [0,2,0,0,0,0|1,0,1]=4 392 B10R1.149 COC(=O)C1=C(C)OC=N1 O30830 [0,2,0,0,0,0|2,0,0]=4 393 B10R1.149 COC(=O)C1=C(Cl)C=CN1 G-6436 [0,2,0,0,0,0|1,0,1]=4 394 B10R1.149 COC(=O)C1=C(N)C=CO1 I-9332 [0,2,0,0,0,0|1,1,0]=4 395 B10R1.149 COC(=O)C1=C(N)C=CO1 L14050 [0,2,0,0,0,0|1,1,0]=4 396 B10R1.149 COC(=O)C1=C(N)N=CS1 O30619 [0,2,0,0,0,0|2,0,0]=4 397 B10R1.149 COC(=O)C1=NNC=C1Br O30681 [0,2,0,0,0,0|2,0,0]=4 398 B10R1.149 COC(=O)C1=NNC=C1F F-4791 [0,2,0,0,0,0|2,0,0]=4 399 B10R1.149 COC(=O)C1=NNC=C1N G-5583 [0,2,0,0,0,0|2,0,0]=4 400 B10R1.55 C[Si](C)(C)C1=NC(Br)=CS1 Q68012 [0,2,0,0,0,0|1,1,0]=4 401 B10R1.31 CC(C)C1=NC(C=O)=CS1 O30485 [0,2,0,0,0,0|1,0,1]=4 402 B10R1.31 CC(C)C1=NC(CCl)=CS1 O30430 [0,2,0,0,0,0|1,0,1]=4 403 B10R1.31 CC(C)C1=NC(CN)=CS1 O30461 [0,2,0,0,0,0|1,0,1]=4 404 B10R1.31 CCC1=CC=C(C(=O)O)S1 Q68130 [0,2,0,0,0,0|2,0,0]=4 405 B10R1.31 COC1=CSC(C(=O)O)=C1 O30204 [0,2,0,0,0,0|2,0,0]=4 406 B10R1.31 O=CC1=CC=C(C(=O)O)S1 O31938 [0,2,0,0,0,0|2,0,0]=4 407 B10R1.58 O=C(O)C1=CC(Br)=C(Cl)S1 O30383 [0,2,0,0,0,0|2,0,0]=4 408 B10R1.59 CC(=O)C1=NN(C)C=C1Cl K12253 [0,2,0,0,0,0|2,0,0]=4 409 B10R1.59 NC(=O)C1=C(N)C=C(Br)S1 Q63313 [0,2,0,0,0,0|2,0,0]=4 410 B10R1.59 O=C(O)C1=C(Br)C=C(Br)S1 Q67324 [0,2,0,0,0,0|2,0,0]=4 411 B10R1.194 CC1=C(C(=O)O)SC=C1Br Q65603 [0,2,0,0,0,0|2,0,0]=4 412 B8R1.4 CC1=CN=CC(Br)=C1 G-7029 [0,0,1,1,0,0|2,0,0]=4 413 B8R1.4 CC1=CN=CC(Br)=N1 O30568 [0,0,1,1,0,0|2,0,0]=4 414 B8R1.4 CC1=CN=CC(F)=C1 P38200 [0,0,1,1,0,0|2,0,0]=4 415 B8R1.4 CC1=CN=CC(N)=C1 S70885 [0,0,1,1,0,0|2,0,0]=4 416 B8R1.4 CC1=CN=CC(N)=N1 O31827 [0,0,1,1,0,0|2,0,0]=4 417 B8R1.4 CC1=CN=CC(O)=C1 O30725 [0,0,1,1,0,0|1,1,0]=4 418 B8R1.4 CC1=CN=NC(=O)C1 O30337 [0,0,1,1,0,0|2,0,0]=4 419 B8R1.4 SC1=CC(Br)=CN=C1 Q62298 [0,0,1,1,0,0|1,0,1]=4 420 B8R1.5 CC1=C(N)N=CC=N1 Q56445 [0,0,1,1,0,0|2,0,0]=4 421 B8R1.5 CC1=CC=CN=C1C Q57216 [0,0,1,1,0,0|2,0,0]=4 422 B8R1.5 CC1=NC=CN=C1Cl L18121 [0,0,1,1,0,0|2,0,0]=4 423 B8R1.2 C(=O)C1=CC=NN=C1 C-2212 [1,0,0,0,0,1|2,0,0]=4 424 B8R1.2 C(=O)C1=CN=CC=N1 C-2218 [1,0,0,0,0,1|1,0,0]=3 425 B8R1.2 C(=O)C1=CN=CN=C1 A-903 [1,0,0,0,0,1|2,0,0]=4 426 B8R1.2 C(=O)C1=NC=CC=N1 C-2221 [1,0,0,0,0,1|1,0,0]=3 427 B8R1.2 C(=O)C1=NN=CC=C1 C-2223 [1,0,0,0,0,1|1,0,0]=3 428 B8R1.2 C=CC1=CC=CN=C1 O30687 [1,0,0,0,0,1|1,0,1]=4 429 B8R1.2 CNC1=CC=NC=N1 Q58573 [1,0,0,0,0,1|2,0,0]=4 430 B8R1.2 CNC1=NN=CC=C1 O29994 [1,0,0,0,0,1|2,0,0]=4 431 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [0,0,0,0,0,2|1,0,0]=3 432 B10R1.18 CC(=O)NC1=NC=NC=C1 O29559 [0,0,0,0,0,2|1,0,0]=3 433 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [0,0,0,0,0,2|2,0,0]=4 434 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [0,0,0,0,0,2|2,0,0]=4 435 B10R1.18 O=C([O-])CC1=NC=CC=N1 Q51814 [0,0,0,0,0,2|2,0,0]=4 436 B10R1.18 O=C([O-])CC1=NN=CC=C1 L13418 [0,0,0,0,0,2|2,0,0]=4 437 B10R1.66 CC(=O)CCC1=NC=CS1 L20139 [0,0,0,0,0,2|0,0,0]=2