0 B9R1.6 CC(=O)C1=CC=NC=N1 W6021 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 CC(=O)C1=CC=NN=C1 W6606 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=CN=CN=C1 X8651 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 CC(=O)C1=NC=CC=N1 7575AB [0,0,0,0,0,0|4,0,0]=4 4 B9R1.6 CC(Br)C1=NC=CN=C1 5526AC [0,0,0,0,0,0|3,0,1]=4 5 B9R1.6 CC(N)C1=CC=CC=N1 4915AJ [0,0,0,0,0,0|3,0,1]=4 6 B9R1.6 CC(N)C1=CC=NC=C1 W3800 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 CC(N)C1=CC=NC=C1 W6570 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 CC(N)C1=NC=CN=C1 Z2224 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 CN(C)C1=CN=CC=C1 9643AA [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 CP(C)C1=CC=CC=C1 0349AC [0,0,0,0,0,0|4,0,0]=4 11 B9R1.6 C[C@@H](N)C1=CC=NC=C1 4791AJ [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 C[C@@H](N)C1=NC=CC=C1 W6374 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 C[C@@H](O)C1=CN=CC=C1 1829AC [0,0,0,0,0,0|1,0,2]=3 14 B9R1.6 C[C@H](N)C1=NC=CC=C1 5348AB [0,0,0,0,0,0|3,0,1]=4 15 B9R1.6 C[C@H](N)C1=NC=CC=C1 W5086 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 C[C@H](O)C1=CN=CC=C1 7054AB [0,0,0,0,0,0|1,0,2]=3 17 B9R1.6 FC(F)C1=CC=CC=C1 X8304 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.6 FC(F)C1=CN=CC=C1 9427AE [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 N=C(N)C1=CN=CN=C1 7669AH [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 N=C(N)C1=NC=CC=C1 Z3386 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 N=C(N)C1=NC=CN=C1 R154 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 NC(=S)C1=NC=CC=N1 3907AE [0,0,0,0,0,0|3,1,0]=4 23 B9R1.6 O=C(F)C1=CC=CC=C1 3921AE [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 O=C(O)C1=NC=CC=C1 7630AF [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 O=C(O)C1=NN=CC=C1 X0237 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.6 O=C([O-])C1=CC=NC=C1 8981AL [0,0,0,0,0,0|3,0,0]=3 27 B9R1.6 OB(O)C1=CN=CC=C1 8784AD [0,0,0,0,0,0|2,0,1]=3 28 B9R1.6 OB(O)C1=CN=CN=C1 0635AP [0,0,0,0,0,0|3,0,1]=4 29 B8R1.2 BrCC1=NC=CN=C1 5266AJ [1,0,0,0,0,0|2,0,1]=4 30 B8R1.2 C#CC1=CN=CN=C1 W3340 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.2 CNC1=NC=CN=C1 3544AB [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 COC1=CN=CN=C1 W5346 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 ClCC1=CN=CC=N1 0741AB [1,0,0,0,0,0|2,0,1]=4 34 B8R1.2 Cl[Hg]C1=CC=CC=C1 7627AF [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 N#CC1=CC=CC=C1 E085 [1,0,0,0,0,0|1,0,2]=4 36 B8R1.2 N#CC1=CC=CN=N1 7702AB [1,0,0,0,0,0|1,0,2]=4 37 B8R1.2 N#CC1=CN=CN=C1 U582 [1,0,0,0,0,0|1,0,2]=4 38 B8R1.2 NCC1=CC=NC=C1 Z3385 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.2 NCC1=CN=CN=C1 W4845 [1,0,0,0,0,0|1,0,1]=3 40 B8R1.2 NCC1=NC=CN=C1 W5959 [1,0,0,0,0,0|1,0,1]=3 41 B8R1.2 NNC1=CC=CN=C1 Z1664 [1,0,0,0,0,0|1,0,0]=2 42 B8R1.2 NNC1=NN=CC=C1 X0228 [1,0,0,0,0,0|2,0,0]=3 43 B8R1.2 O=CC1=CC=NC=N1 W4791 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 OCC1=CN=CN=C1 W4842 [1,0,0,0,0,0|1,0,2]=4 45 B8R1.2 OCC1=CN=NC=C1 7045AB [1,0,0,0,0,0|1,0,2]=4 46 B10R1.13 CC(=O)C1=CC=C(C)C=N1 7521AB [0,1,0,0,0,0|3,0,0]=4 47 B10R1.13 CC(=O)C1=CC=C(F)N=C1 W8700 [0,1,0,0,0,0|1,0,0]=2 48 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,1,0,0,0,0|1,0,0]=2 49 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 Z5392 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.13 CC(=O)C1=NC=C(Cl)N=C1 W3479 [0,1,0,0,0,0|2,0,0]=3 51 B10R1.13 CC(=O)C1=NC=C(F)C=C1 V9103 [0,1,0,0,0,0|3,0,0]=4 52 B10R1.13 CC(=O)C1=NC=C(O)C=C1 0360AC [0,1,0,0,0,0|3,0,0]=4 53 B10R1.13 CC(N)C1=CC=C(Br)C=C1 V8869 [0,1,0,0,0,0|2,0,1]=4 54 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 V6495 [0,1,0,0,0,0|2,0,1]=4 55 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 Y9670 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.13 CC(N)C1=CC=C(F)C=C1 V5775 [0,1,0,0,0,0|2,0,1]=4 57 B10R1.13 CC1=CC=C(C(=N)N)C=C1 2887AJ [0,1,0,0,0,0|2,0,0]=3 58 B10R1.13 CC1=CC=C(C(C)N)C=C1 8708AB [0,1,0,0,0,0|2,0,1]=4 59 B10R1.13 CC1=CC=C(S(=O)O)C=C1 7653AB [0,1,0,0,0,0|3,0,0]=4 60 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 7866AF [0,1,0,0,0,0|3,0,0]=4 61 B10R1.13 CC1=CN=C(C(=O)O)C=C1 9308AA [0,1,0,0,0,0|3,0,0]=4 62 B10R1.13 CC1=CN=C(C(N)=O)C=N1 X0289 [0,1,0,0,0,0|1,0,0]=2 63 B10R1.13 CC1=NC=C(C(C)O)C=C1 0117AA [0,1,0,0,0,0|1,0,2]=4 64 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 V9278 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.13 CS(=O)C1=CC=C(F)C=C1 7689AJ [0,1,0,0,0,0|3,0,0]=4 66 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 4787AJ [0,1,0,0,0,0|2,0,1]=4 67 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 X9175 [0,1,0,0,0,0|2,0,1]=4 68 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 W5396 [0,1,0,0,0,0|2,0,1]=4 69 B10R1.13 FC(F)C1=CN=C(Br)C=C1 4209AA [0,1,0,0,0,0|2,0,1]=4 70 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 8632AE [0,1,0,0,0,0|2,0,1]=4 71 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 1266AB [0,1,0,0,0,0|2,0,0]=3 72 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C099 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2845AJ [0,1,0,0,0,0|2,0,0]=3 74 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 Z4383 [0,1,0,0,0,0|1,0,0]=2 75 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 W4430 [0,1,0,0,0,0|1,0,0]=2 76 B10R1.13 NC(=O)C1=NC=C(F)C=C1 6778AB [0,1,0,0,0,0|2,0,0]=3 77 B10R1.13 NC(=O)C1=NC=C(N)C=C1 W3172 [0,1,0,0,0,0|2,0,0]=3 78 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 W7734 [0,1,0,0,0,0|1,0,0]=2 79 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 V4765 [0,1,0,0,0,0|1,1,0]=3 80 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7847AF [0,1,0,0,0,0|2,0,0]=3 81 B10R1.13 NC1=CN=C(C(=O)O)C=C1 3083AJ [0,1,0,0,0,0|3,0,0]=4 82 B10R1.13 NC1=NC=C(B(O)O)C=C1 V8073 [0,1,0,0,0,0|2,0,1]=4 83 B10R1.13 NC1=NC=C(C(=O)O)N=C1 W6057 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.13 NC1=NN=C(C(=O)O)C=C1 X0293 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 W8994 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.13 O=C(O)C1=NC=C(I)C=C1 3537AB [0,1,0,0,0,0|3,0,0]=4 87 B10R1.13 O=C(O)C1=NC=C(O)C=C1 5863AH [0,1,0,0,0,0|3,0,0]=4 88 B10R1.13 O=C(O)C1=NC=C(O)N=C1 V1419 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 F105 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.13 O=C1C=CC(C(=O)O)=CO1 7614AF [0,1,0,0,0,0|2,0,0]=3 91 B10R1.13 O=S([O-])C1=CC=C(Br)C=C1 V3821 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.13 O=[N+]([O-])C1=CN=C(Br)N=C1 X9468 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.13 O=[N+]([O-])C1=CN=C(O)N=C1 W5445 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.13 O=[N+]([O-])C1=CN=C(S)C=C1 Y5022 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.15 C=C(CC)C1=CC=CC=C1 0460AB [0,1,0,0,0,0|3,0,0]=4 96 B10R1.15 C=CC(=O)C1=CC=CC=C1 1968AC [0,1,0,0,0,0|2,0,0]=3 97 B10R1.15 C=CS(=O)C1=CC=CC=C1 0500AB [0,1,0,0,0,0|3,0,0]=4 98 B10R1.15 CC(CN)C1=CC=CC=C1 W4299 [0,1,0,0,0,0|2,0,1]=4 99 B10R1.15 CCC(=O)C1=CC=CN=C1 Y5018 [0,1,0,0,0,0|1,0,0]=2 100 B10R1.15 CCC(=O)C1=NC=CC=C1 Y6177 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.15 CCN(N)C1=CC=CC=C1 4841AL [0,1,0,0,0,0|3,0,0]=4 102 B10R1.15 CNC(C)C1=CC=CC=C1 V5180 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.15 CNC(C)C1=CC=CN=C1 0995AD [0,1,0,0,0,0|1,0,1]=3 104 B10R1.15 COC(=O)C1=CC=NN=C1 W5569 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.15 COS(=O)C1=CC=CC=C1 0314AC [0,1,0,0,0,0|3,0,0]=4 106 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 V5313 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.15 C\C(=N\O)C1=CC=CN=C1 V6841 [0,1,0,0,0,0|1,0,1]=3 108 B10R1.15 NCC(N)C1=CC=CC=C1 8461AA [0,1,0,0,0,0|2,0,1]=4 109 B10R1.15 NCC(O)C1=CC=CN=C1 5727AC [0,1,0,0,0,0|0,0,2]=3 110 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 X3539 [0,1,0,0,0,0|1,0,2]=4 111 B10R1.15 NNC(=O)C1=NC=CN=C1 W8351 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.15 N\C(=N/O)C1=CC=CC=C1 3148AL [0,1,0,0,0,0|1,0,1]=3 113 B10R1.15 N\C(=N/O)C1=NC=CN=C1 4643AE [0,1,0,0,0,0|1,0,1]=3 114 B10R1.15 N\C(N=O)=C1/N=CC=CN1 2867AF [0,1,0,0,0,0|3,0,0]=4 115 B10R1.15 O=C(CBr)C1=CC=CC=N1 5318AB [0,1,0,0,0,0|3,0,0]=4 116 B10R1.15 O=C(CBr)C1=CC=CN=C1 C113 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7120AL [0,1,0,0,0,0|1,0,0]=2 118 B10R1.15 O=C(N[O-])C1=CC=CC=C1 7846AF [0,1,0,0,0,0|1,0,0]=2 119 B10R1.15 O=C(O[Ag])C1=CC=CC=C1 7828AF [0,1,0,0,0,0|2,0,0]=3 120 B10R1.28 CC(C)(O)C1=CC=CN=C1 Y7594 [0,1,0,0,0,0|1,0,2]=4 121 B10R1.28 FC(F)(F)C1=CC=CN=C1 V2215 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.28 NS(=O)(=O)C1=CC=CC=N1 9715AB [0,1,0,0,0,0|3,0,0]=4 123 B10R1.28 NS(=O)(=O)C1=CC=CN=C1 V4958 [0,1,0,0,0,0|1,0,0]=2 124 B10R1.28 O=P([O-])([O-])C1=CC=CC=C1 8802AL [0,1,0,0,0,0|3,0,0]=4 125 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 9505AJ [0,1,0,0,0,0|3,0,0]=4 126 B10R1.28 O=S(=O)([O-])C1=CC=CN=C1 7356AF [0,1,0,0,0,0|2,0,0]=3 127 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 2023AA [0,1,0,0,0,0|3,0,0]=4 128 B10R1.61 CC(=O)C1=C(F)C=NC=C1 W9003 [0,1,0,0,0,0|3,0,0]=4 129 B10R1.61 CC(=O)C1=CC=CN=C1Br W8693 [0,1,0,0,0,0|1,0,0]=2 130 B10R1.61 CC(=O)C1=CC=CN=C1C Y7806 [0,1,0,0,0,0|1,0,0]=2 131 B10R1.61 CC(=O)C1=CC=CN=C1Cl W6955 [0,1,0,0,0,0|1,0,0]=2 132 B10R1.61 CC(=O)C1=CC=CN=C1F Y4110 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.61 CC(=O)C1=CC=NC=C1N 5933AA [0,1,0,0,0,0|3,0,0]=4 134 B10R1.61 CC(=O)C1=NC=CC=C1Br Z3887 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.61 CC(=O)C1=NC=CN=C1Cl 3776AA [0,1,0,0,0,0|2,0,0]=3 136 B10R1.61 CC(N)C1=C(O)C=CC=C1 5161AJ [0,1,0,0,0,0|2,0,1]=4 137 B10R1.61 CC(N)C1=CC=CC=C1Cl V8121 [0,1,0,0,0,0|2,0,1]=4 138 B10R1.61 CC(N)C1=CC=CC=C1Cl X6241 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.61 CC(N)C1=CC=CC=C1F V7591 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.61 CC(O)C1=C(Cl)N=CC=C1 5872AA [0,1,0,0,0,0|1,0,2]=4 141 B10R1.61 CC1=C(C(=O)O)C=CC=N1 1002AB [0,1,0,0,0,0|1,0,0]=2 142 B10R1.61 CC1=C(C(N)=O)C=CC=N1 W7162 [0,1,0,0,0,0|0,0,0]=1 143 B10R1.61 CC1=C(C(N)=O)C=NC=C1 X7929 [0,1,0,0,0,0|0,0,0]=1 144 B10R1.61 CC1=CC=CC=C1C(=N)N 1807AJ [0,1,0,0,0,0|2,0,0]=3 145 B10R1.61 CC1=CC=CC=C1C(=N)N 5089AH [0,1,0,0,0,0|2,0,0]=3 146 B10R1.61 CC1=CC=NC=C1C(=O)O W9651 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.61 CC1=NC=CC=C1B(O)O W9274 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.61 CC1=NC=CC=C1B(O)O Z7106 [0,1,0,0,0,0|2,0,1]=4 149 B10R1.61 CC1=NC=CN=C1C(=O)O W6160 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 1179AL [0,1,0,0,0,0|2,0,1]=4 151 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl X9707 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.61 C[C@@H](N)C1=CC=CC=C1O X9575 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.61 FC(F)C1=C(Br)N=CC=C1 1062AD [0,1,0,0,0,0|2,0,1]=4 154 B10R1.61 FC1=NC=CC=C1C(F)F 4047AD [0,1,0,0,0,0|2,0,1]=4 155 B10R1.61 N=C(N)C1=C(Cl)C=CC=N1 2250AJ [0,1,0,0,0,0|3,0,0]=4 156 B10R1.61 N=C(N)C1=CC=CC=C1Br Y9512 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.61 N=C(N)C1=CC=CC=C1Cl Y8078 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.61 N=C(N)C1=CC=CC=C1F W7062 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 W3053 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.61 NC(=O)C1=C(F)N=CC=C1 W5777 [0,1,0,0,0,0|0,0,0]=1 161 B10R1.61 NC(=O)C1=C(N)C=CN=C1 W8196 [0,1,0,0,0,0|0,0,0]=1 162 B10R1.61 NC(=O)C1=C(N)C=NC=C1 W7596 [0,1,0,0,0,0|2,0,0]=3 163 B10R1.61 NC(=O)C1=CC=CN=C1N Y7441 [0,1,0,0,0,0|0,0,0]=1 164 B10R1.61 NC(=O)C1=NC=CC=C1N W6587 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.61 NC(=O)C1=NC=CN=C1Cl W4429 [0,1,0,0,0,0|1,0,0]=2 166 B10R1.61 NC(=S)C1=C(O)C=CC=C1 5069AH [0,1,0,0,0,0|1,1,0]=3 167 B10R1.61 NC(=S)C1=CC=CC=C1F I217 [0,1,0,0,0,0|1,1,0]=3 168 B10R1.61 NC1=C(C(=O)O)C=NC=N1 W4353 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] 5751AL [0,1,0,0,0,0|3,0,0]=4 170 B10R1.61 NC1=CN=CC=C1C(=O)O 9458AJ [0,1,0,0,0,0|3,0,0]=4 171 B10R1.61 NC1=NN=CC=C1C(=O)O W4411 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.61 O=C(O)C1=C(O)C=CC=C1 7849AF [0,1,0,0,0,0|2,0,0]=3 173 B10R1.61 O=C(O)C1=C(O)N=CN=C1 W7701 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.61 O=C(O)C1=CC=NNC1=O Z4861 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.61 O=C(O)C1=NC=CC=C1I W8180 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 7836AF [0,1,0,0,0,0|2,0,0]=3 177 B10R1.61 O=C([O-])C1=C(S)C=CC=C1 9154AL [0,1,0,0,0,0|2,0,0]=3 178 B10R1.61 O=C1C=CNC=C1[N+](=O)[O-] X5156 [0,1,0,0,0,0|2,0,1]=4 179 B10R1.61 O=[N+]([O-])C1=NC=CN=C1Cl Y5600 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 3551AC [0,1,0,0,0,0|3,0,0]=4 181 B10R1.113 CC(=O)C1=CC(C)=NC=C1 W5046 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 Y8387 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.113 CC(=O)C1=CC(F)=CN=C1 4092AB [0,1,0,0,0,0|1,0,0]=2 184 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 1448AL [0,1,0,0,0,0|3,0,0]=4 185 B10R1.113 CC(=O)C1=CN=CC(C)=C1 5943AB [0,1,0,0,0,0|1,0,0]=2 186 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 X3366 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 8967AB [0,1,0,0,0,0|3,0,0]=4 188 B10R1.113 CC(N)C1=CC=CC(Br)=C1 4929AJ [0,1,0,0,0,0|2,0,1]=4 189 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V4629 [0,1,0,0,0,0|2,0,1]=4 190 B10R1.113 CC(N)C1=CC=CC(F)=C1 1626AC [0,1,0,0,0,0|2,0,1]=4 191 B10R1.113 CC1=CC(C(C)N)=CC=C1 8402AE [0,1,0,0,0,0|2,0,1]=4 192 B10R1.113 CC1=CC(C(N)=O)=CC=C1 F917 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.113 CC1=CC(N(C)N)=CC=C1 4897AL [0,1,0,0,0,0|3,0,0]=4 194 B10R1.113 CC1=CC([C@@H](C)N)=CC=C1 W3022 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.113 CC1=CC=CC(C(=N)N)=C1 0599AB [0,1,0,0,0,0|2,0,0]=3 196 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 6759AA [0,1,0,0,0,0|2,0,1]=4 197 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 Z1666 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 X4842 [0,1,0,0,0,0|2,0,1]=4 199 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 6013AL [0,1,0,0,0,0|0,0,1]=2 200 B10R1.113 FC(F)C1=CN=CC(Br)=C1 9490AC [0,1,0,0,0,0|2,0,1]=4 201 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 Y6780 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.113 NC(=O)C1=CC(N)=CN=C1 W7302 [0,1,0,0,0,0|0,0,0]=1 203 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 Y9632 [0,1,0,0,0,0|1,0,0]=2 204 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 Y9875 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 4538AB [0,1,0,0,0,0|1,0,0]=2 206 B10R1.113 NC(=O)C1=NC(Cl)=NC=C1 Y8337 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 9338AB [0,1,0,0,0,0|2,0,0]=3 208 B10R1.113 NC(=O)C1=NC=CC(F)=C1 Y7165 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.113 NC(=S)C1=CC=CC(Br)=C1 V4474 [0,1,0,0,0,0|1,1,0]=3 210 B10R1.113 NC(=S)C1=CC=CC(F)=C1 V7493 [0,1,0,0,0,0|1,1,0]=3 211 B10R1.113 NC(=S)C1=CC=CC(I)=C1 8330AC [0,1,0,0,0,0|1,1,0]=3 212 B10R1.113 NC1=CC(C(=O)O)=NC=C1 5565AH [0,1,0,0,0,0|3,0,0]=4 213 B10R1.113 NC1=CC(C(=O)O)=NC=C1 X8464 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.113 NC1=CC(C(=O)O)=NC=C1 X9744 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.113 NC1=CC(C(=O)[O-])=CC=C1 5988AL [0,1,0,0,0,0|2,0,0]=3 216 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 W9613 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 6130AL [0,1,0,0,0,0|3,0,0]=4 218 B10R1.113 NC1=CN=CC(B(O)O)=C1 2762AA [0,1,0,0,0,0|2,0,1]=4 219 B10R1.113 NC1=CN=CC(C(=O)O)=N1 W7370 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.113 O=C(Cl)C1=CC=CC(I)=C1 6069AL [0,1,0,0,0,0|2,0,0]=3 221 B10R1.113 O=C(O)C1=CC(I)=NC=C1 Y9547 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.113 O=C(O)C1=CN=NC(Cl)=C1 9032AF [0,1,0,0,0,0|2,0,0]=3 223 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 B798 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.113 O=C([O-])C1=CC=CC(F)=C1 X2825 [0,1,0,0,0,0|2,0,0]=3 225 B10R1.113 O=C1C=C(C(=O)O)C=NN1 W8905 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.113 O=C1C=COC(C(=O)O)=C1 3223AL [0,1,0,0,0,0|3,0,0]=4 227 B10R1.113 O=[N+]([O-])C1=CC(F)=CN=C1 1349AA [0,1,0,0,0,0|2,0,0]=3 228 B10R1.113 O=[N+]([O-])C1=CN=CC(O)=C1 W4031 [0,1,0,0,0,0|2,0,0]=3 229 B10R2.320 BrC1=CC2=CC=CC=C12 K940 [0,0,0,1,0,0|3,0,0]=4 230 B8R1.7 CC(=O)C1=CNC=N1 9304AB [0,0,0,0,1,0|2,0,0]=3 231 B8R1.7 CC(=O)C1=CNN=C1 1947AB [0,0,0,0,1,0|2,0,0]=3 232 B8R1.7 CC(=O)C1=CSC=N1 W5893 [0,0,0,0,1,0|2,0,0]=3 233 B8R1.7 CC(=O)C1=NC=CN1 5223AE [0,0,0,0,1,0|2,0,0]=3 234 B8R1.7 CC(C)=C1C=CC=C1 1050AB [0,0,0,0,1,0|2,0,0]=3 235 B8R1.7 CC(N)C1=COC=C1 2007AB [0,0,0,0,1,0|2,0,1]=4 236 B8R1.7 CC(N)C1=NC=CS1 V9472 [0,0,0,0,1,0|2,0,1]=4 237 B8R1.7 CC(N)C1=NC=CS1 W6267 [0,0,0,0,1,0|2,0,1]=4 238 B8R1.7 N1N=CC(C(=O)O)=N1 Y1161 [0,0,0,0,1,0|3,0,0]=4 239 B8R1.7 N=C(N)C1=CC=CS1 7913AB [0,0,0,0,1,0|2,0,0]=3 240 B8R1.7 NC(=O)C1=CC=CS1 X6987 [0,0,0,0,1,0|1,0,0]=2 241 B8R1.7 NC(=O)C1=CN=CS1 Y5540 [0,0,0,0,1,0|1,0,0]=2 242 B8R1.7 NC(=O)C1=NC=CO1 4142AC [0,0,0,0,1,0|1,0,0]=2 243 B8R1.7 NC(=S)C1=CC=CO1 5874AD [0,0,0,0,1,0|1,1,0]=3 244 B8R1.7 NC(=S)C1=COC=N1 Y5223 [0,0,0,0,1,0|1,1,0]=3 245 B8R1.7 O=C(O)C1=CC=CN1 Q622 [0,0,0,0,1,0|1,0,1]=3 246 B8R1.7 O=C(O)C1=CC=NS1 0659AA [0,0,0,0,1,0|2,0,0]=3 247 B8R1.7 O=C(O)C1=CN=CO1 X4661 [0,0,0,0,1,0|2,0,0]=3 248 B8R1.7 O=C(O)C1=CSN=C1 Z5157 [0,0,0,0,1,0|2,0,0]=3 249 B8R1.7 O=C([O-])C1=CC=CS1 Z2610 [0,0,0,0,1,0|2,0,0]=3 250 B8R1.7 O=[N+]([O-])C1=CC=CN1 W7207 [0,0,0,0,1,0|2,0,1]=4 251 B8R1.7 O=[N+]([O-])C1=CC=CS1 L329 [0,0,0,0,1,0|3,0,0]=4 252 B8R1.7 O=[N+]([O-])C1=CN=CS1 V3357 [0,0,0,0,1,0|3,0,0]=4 253 B10R1.18 CC(=O)CC1=CC=NC=C1 4765AJ [0,0,0,0,0,1|3,0,0]=4 254 B10R1.18 CC(=O)CC1=NC=CC=C1 W7508 [0,0,0,0,0,1|3,0,0]=4 255 B10R1.18 CC(=O)C[N+]1=CC=CC=C1 4736AL [0,0,0,0,0,1|3,0,0]=4 256 B10R1.18 CC(=O)NC1=CC=NC=C1 7350AB [0,0,0,0,0,1|3,0,0]=4 257 B10R1.18 CC(=O)NC1=CN=CC=C1 6108AE [0,0,0,0,0,1|1,0,0]=2 258 B10R1.18 CC(=O)NC1=NC=CC=C1 Y5038 [0,0,0,0,0,1|3,0,0]=4 259 B10R1.18 CC(=O)SC1=CC=CC=C1 9002AL [0,0,0,0,0,1|2,0,0]=3 260 B10R1.18 CC(N)CC1=CC=CN=C1 V7434 [0,0,0,0,0,1|1,0,1]=3 261 B10R1.18 NC(=O)CC1=CC=CN=C1 4754AB [0,0,0,0,0,1|0,0,0]=1 262 B10R1.18 NC(=O)CC1=NC=CC=N1 Z3997 [0,0,0,0,0,1|3,0,0]=4 263 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 4299AL [0,0,0,0,0,1|2,0,0]=3 264 B10R1.18 NC(=O)OC1=CC=CC=C1 7861AF [0,0,0,0,0,1|1,0,0]=2 265 B10R1.18 NC(=S)NC1=CC=NC=C1 5284AD [0,0,0,0,0,1|2,1,0]=4 266 B7R1.3 BrC1=CN=NC=C1 5826AA [2,0,0,0,0,0|2,0,0]=4 267 B7R1.3 BrC1=CN=NC=C1 Z1972 [2,0,0,0,0,0|2,0,0]=4 268 B7R1.3 CC1=CN=CN=C1 V0658 [2,0,0,0,0,0|1,0,1]=4 269 B7R1.3 ClC1=CN=CN=C1 X3259 [2,0,0,0,0,0|2,0,0]=4 270 B7R1.3 NC1=CC=CC=C1 7089AL [2,0,0,0,0,0|1,0,0]=3 271 B7R1.3 NC1=CC=CC=C1 7670AF [2,0,0,0,0,0|1,0,0]=3 272 B7R1.3 NC1=CC=NC=C1 2631AL [2,0,0,0,0,0|2,0,0]=4 273 B7R1.3 NC1=NN=CC=C1 W9214 [2,0,0,0,0,0|1,0,0]=3 274 B7R1.3 O=C1C=CC=CO1 X6757 [2,0,0,0,0,0|2,0,0]=4 275 B7R1.3 O=C1C=COC=C1 1768AA [2,0,0,0,0,0|2,0,0]=4 276 B7R1.3 OC1=CC=NN=C1 Y3331 [2,0,0,0,0,0|1,0,1]=4 277 B9R1.1 C#CC1=CC=C(Cl)N=C1 2313AB [1,1,0,0,0,0|1,0,1]=4 278 B9R1.1 C#CC1=CC=C(O)N=C1 3388AA [1,1,0,0,0,0|1,0,1]=4 279 B9R1.1 C#CC1=CN=C(F)C=C1 3250AC [1,1,0,0,0,0|1,0,1]=4 280 B9R1.1 C#CC1=CN=C(N)C=C1 2749AC [1,1,0,0,0,0|1,0,1]=4 281 B9R1.1 C=CC1=CN=C(C)C=C1 Q615 [1,1,0,0,0,0|1,0,0]=3 282 B9R1.1 CC1=CN=C(C=O)C=N1 Y9267 [1,1,0,0,0,0|1,0,0]=3 283 B9R1.1 CC1=NC=C(C=O)C=C1 W6750 [1,1,0,0,0,0|0,0,0]=2 284 B9R1.1 CC1=NC=C(C=O)C=N1 W9344 [1,1,0,0,0,0|1,0,0]=3 285 B9R1.1 CC1=NC=C(CCl)C=C1 Z3855 [1,1,0,0,0,0|1,0,1]=4 286 B9R1.1 CC1=NC=C(NN)C=C1 W9248 [1,1,0,0,0,0|1,0,0]=3 287 B9R1.1 CCC1=CC=C(Br)N=C1 0198AB [1,1,0,0,0,0|1,0,1]=4 288 B9R1.1 CCC1=CN=C(N)C=C1 Y5080 [1,1,0,0,0,0|1,0,1]=4 289 B9R1.1 CNC1=CN=C(Cl)C=C1 3620AA [1,1,0,0,0,0|2,0,0]=4 290 B9R1.1 COC1=CN=C(F)C=C1 Z0149 [1,1,0,0,0,0|2,0,0]=4 291 B9R1.1 COC1=CN=C(I)C=C1 V3638 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.1 COC1=CN=C(N)C=C1 X3522 [1,1,0,0,0,0|2,0,0]=4 293 B9R1.1 CSC1=CN=C(N)C=C1 2168AC [1,1,0,0,0,0|2,0,0]=4 294 B9R1.1 ClC1=NC=C(CBr)C=C1 X4352 [1,1,0,0,0,0|1,0,1]=4 295 B9R1.1 FC1=NC=C(CBr)C=C1 Y6935 [1,1,0,0,0,0|1,0,1]=4 296 B9R1.1 N#CC1=CC=C(F)N=C1 Z4696 [1,1,0,0,0,0|0,0,2]=4 297 B9R1.1 NC1=NC=C(C=O)C=C1 0819AC [1,1,0,0,0,0|0,0,0]=2 298 B9R1.1 NCC1=CC=C(Br)N=C1 X9441 [1,1,0,0,0,0|0,0,1]=3 299 B9R1.1 NCC1=CC=C(O)C=C1 X6145 [1,1,0,0,0,0|1,0,1]=4 300 B9R1.1 NCC1=CN=C(Cl)C=C1 8881AH [1,1,0,0,0,0|0,0,1]=3 301 B9R1.1 NCC1=CN=C(F)C=C1 0174AP [1,1,0,0,0,0|0,0,1]=3 302 B9R1.1 NNC1=CC=C(Br)C=C1 V2246 [1,1,0,0,0,0|2,0,0]=4 303 B9R1.1 NNC1=CC=C(Cl)C=C1 2700AL [1,1,0,0,0,0|2,0,0]=4 304 B9R1.1 NNC1=CC=C(Cl)C=C1 6459AL [1,1,0,0,0,0|2,0,0]=4 305 B9R1.1 NNC1=CC=C(I)C=C1 0740AP [1,1,0,0,0,0|2,0,0]=4 306 B9R1.1 NNC1=CC=C(I)C=C1 H231 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.1 O=CC1=CC=C([O-])C=C1 6126AE [1,1,0,0,0,0|1,0,0]=3 308 B9R1.1 O=CC1=CN=C(Cl)N=C1 X2947 [1,1,0,0,0,0|1,0,0]=3 309 B9R1.1 O=CC1=CN=C(F)C=C1 W7817 [1,1,0,0,0,0|0,0,0]=2 310 B9R1.1 O=CC1=NC=C(Cl)N=C1 4431AC [1,1,0,0,0,0|1,0,0]=3 311 B9R1.1 O=CC1=NC=C(O)C=C1 Y8673 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.1 O=CC1=NN=C(Cl)C=C1 W5271 [1,1,0,0,0,0|1,0,0]=3 313 B9R1.1 O=CC1=NN=C(O)C=C1 V9271 [1,1,0,0,0,0|1,0,0]=3 314 B9R1.2 C=CC1=CC(C)=CC=C1 9514AF [1,1,0,0,0,0|2,0,0]=4 315 B9R1.2 C=CC1=CC=CC(Br)=C1 0458AB [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 C=CC1=CC=CC(Cl)=C1 V0700 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.2 CC1=CC(C=O)=CN=C1 X8532 [1,1,0,0,0,0|0,0,0]=2 318 B9R1.2 CC1=CC(C=O)=NC=C1 W6792 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.2 CC1=CN=CC(CCl)=C1 X8521 [1,1,0,0,0,0|1,0,1]=4 320 B9R1.2 CC1=CN=CC(CO)=C1 W9908 [1,1,0,0,0,0|0,0,2]=4 321 B9R1.2 CC1=NC=CC(C=O)=C1 I239 [1,1,0,0,0,0|2,0,0]=4 322 B9R1.2 CCC1=CN=CC(Br)=C1 W3099 [1,1,0,0,0,0|1,0,1]=4 323 B9R1.2 COC1=CN=CC(Cl)=C1 V9845 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.2 COC1=CN=CC(O)=C1 X8916 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.2 N#CC1=CC(Cl)=CN=C1 W6624 [1,1,0,0,0,0|0,0,2]=4 326 B9R1.2 N#CC1=CC(O)=CN=C1 W3332 [1,1,0,0,0,0|0,0,2]=4 327 B9R1.2 N#CC1=CN=CC(N)=C1 X4718 [1,1,0,0,0,0|0,0,2]=4 328 B9R1.2 NC1=CC(C=O)=CC=C1 Y7351 [1,1,0,0,0,0|1,0,0]=3 329 B9R1.2 NNC1=CN=CC(Cl)=N1 V7012 [1,1,0,0,0,0|2,0,0]=4 330 B9R1.2 O=CC1=CC(Cl)=NC=C1 X8543 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.2 O=CC1=CC(Cl)=NC=C1 Z8697 [1,1,0,0,0,0|2,0,0]=4 332 B9R1.2 O=CC1=CN=CC(Cl)=C1 W9911 [1,1,0,0,0,0|0,0,0]=2 333 B9R1.2 O=CC1=NC=CC(Cl)=C1 W7511 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.2 OCC1=CC(Cl)=CN=C1 V0671 [1,1,0,0,0,0|0,0,2]=4 335 B9R1.2 OCC1=CN=CC(F)=C1 1380AB [1,1,0,0,0,0|0,0,2]=4 336 B9R1.8 C=COC1=CC=CC=C1 1277AQ [1,1,0,0,0,0|2,0,0]=4 337 B9R1.8 CNCC1=CN=CC=C1 7435AH [1,1,0,0,0,0|0,0,1]=3 338 B9R1.8 COCC1=CC=CN=C1 5231AH [1,1,0,0,0,0|0,0,2]=4 339 B9R1.8 C\C=C/C1=CC=CC=C1 7457AL [1,1,0,0,0,0|2,0,0]=4 340 B9R1.8 C\N=C\C1=CC=CC=C1 R179 [1,1,0,0,0,0|1,0,1]=4 341 B9R1.8 NCCC1=CC=CC=C1 5784AL [1,1,0,0,0,0|1,0,1]=4 342 B9R1.8 NCCC1=CC=CN=C1 9756AD [1,1,0,0,0,0|0,0,1]=3 343 B9R1.8 NCCC1=CC=CN=C1 W8702 [1,1,0,0,0,0|0,0,1]=3 344 B9R1.8 N\N=C\C1=CC=CC=C1 7871AF [1,1,0,0,0,0|1,0,0]=3 345 B9R1.8 O=S=NC1=CC=CC=C1 8948AJ [1,1,0,0,0,0|2,0,0]=4 346 B9R1.8 OCCC1=CC=CN=C1 Y9667 [1,1,0,0,0,0|0,0,2]=4 347 B9R1.8 ONCC1=CC=CC=C1 9353AB [1,1,0,0,0,0|1,0,1]=4 348 B9R1.8 S=C=NC1=CC=CN=C1 Y7833 [1,1,0,0,0,0|0,1,1]=4 349 B9R1.15 BrCC1=CC=CN=C1Br Y4790 [1,1,0,0,0,0|1,0,1]=4 350 B9R1.15 C=CC1=C(Cl)C=CC=C1 0459AB [1,1,0,0,0,0|2,0,0]=4 351 B9R1.15 C=CC1=CC=CC=C1F 7948AJ [1,1,0,0,0,0|2,0,0]=4 352 B9R1.15 C=CC1=CC=CC=C1N Y8954 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.15 CC1=C(C=O)C=CC=N1 W7274 [1,1,0,0,0,0|0,0,0]=2 354 B9R1.15 CC1=C(C=O)C=CN=C1 Y9992 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.15 CC1=C(CBr)C=NC=C1 Z4138 [1,1,0,0,0,0|1,0,1]=4 356 B9R1.15 CC1=C(CO)C=NC=C1 6388AB [1,1,0,0,0,0|0,0,2]=4 357 B9R1.15 CC1=CC=CN=C1C=O W6954 [1,1,0,0,0,0|2,0,0]=4 358 B9R1.15 CC1=CC=NC=C1CN 4365AD [1,1,0,0,0,0|0,0,1]=3 359 B9R1.15 CC1=NC=CC=C1C#N 8848AA [1,1,0,0,0,0|0,0,2]=4 360 B9R1.15 CC1=NC=CN=C1C=O 2084AB [1,1,0,0,0,0|1,0,0]=3 361 B9R1.15 CCC1=CC=CN=C1Cl 6759AC [1,1,0,0,0,0|1,0,1]=4 362 B9R1.15 CCC1=CC=CN=C1N 5897AB [1,1,0,0,0,0|1,0,1]=4 363 B9R1.15 CNC1=CC=CN=C1Cl N415 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.15 COC1=C(N)C=CN=C1 Y9329 [1,1,0,0,0,0|2,0,0]=4 365 B9R1.15 COC1=CC=CN=C1C 5357AH [1,1,0,0,0,0|2,0,0]=4 366 B9R1.15 COC1=CC=CN=C1F Z0246 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.15 CSC1=CC=CN=C1F Z0373 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.15 N#CC1=C(Cl)C=CN=C1 V0837 [1,1,0,0,0,0|0,0,2]=4 369 B9R1.15 N#CC1=C(I)N=CC=C1 V6164 [1,1,0,0,0,0|0,0,2]=4 370 B9R1.15 N#CC1=C(N)C=CN=C1 Y7671 [1,1,0,0,0,0|0,0,2]=4 371 B9R1.15 N#CC1=CC=CN=C1Br W4329 [1,1,0,0,0,0|0,0,2]=4 372 B9R1.15 N#CC1=CC=CN=C1N V1371 [1,1,0,0,0,0|0,0,2]=4 373 B9R1.15 NC1=C(C=O)C=CN=C1 W6929 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.15 NC1=C(C=O)C=NC=N1 8310AA [1,1,0,0,0,0|1,0,0]=3 375 B9R1.15 NC1=CC=NC=C1C=O W6220 [1,1,0,0,0,0|0,0,0]=2 376 B9R1.15 NC1=CC=NC=C1C=O W9562 [1,1,0,0,0,0|0,0,0]=2 377 B9R1.15 NCC1=C(I)C=CC=C1 5274AB [1,1,0,0,0,0|1,0,1]=4 378 B9R1.15 NCC1=NC=CN=C1Cl W8381 [1,1,0,0,0,0|1,0,1]=4 379 B9R1.15 NCC1=NC=CN=C1Cl W9640 [1,1,0,0,0,0|1,0,1]=4 380 B9R1.15 NNC1=C(Cl)C=CC=C1 2065AL [1,1,0,0,0,0|2,0,0]=4 381 B9R1.15 NNC1=C(Cl)N=CC=C1 2782AA [1,1,0,0,0,0|1,0,0]=3 382 B9R1.15 NNC1=NC=CN=C1Cl W7528 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.15 O=CC1=C(O)C=NC=C1 W3998 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.15 O=CC1=NC=CN=C1Cl X0372 [1,1,0,0,0,0|1,0,0]=3 385 B9R1.15 OCC1=C(Cl)C=CN=C1 Z4482 [1,1,0,0,0,0|0,0,2]=4 386 B9R1.11 CCC(=O)C1=CC=CN1 2175AL [0,1,0,0,1,0|1,0,1]=4 387 B9R1.11 CNC(=O)C1=CNN=C1 7283AJ [0,1,0,0,1,0|1,0,0]=3 388 B9R1.11 CNC(=O)N1C=CN=C1 8667AE [0,1,0,0,1,0|1,0,0]=3 389 B9R1.11 COC(=O)C1=CC=NO1 W3292 [0,1,0,0,1,0|2,0,0]=4 390 B9R1.11 COC(=O)C1=CN=CN1 5358AA [0,1,0,0,1,0|2,0,0]=4 391 B9R1.11 COC(=O)C1=CN=CO1 Y7252 [0,1,0,0,1,0|2,0,0]=4 392 B9R1.11 COC(=O)C1=COC=N1 8746AA [0,1,0,0,1,0|2,0,0]=4 393 B9R1.11 COC(=O)C1=CSC=N1 Y5483 [0,1,0,0,1,0|2,0,0]=4 394 B9R1.11 COC(=O)C1=NC=CN1 W3783 [0,1,0,0,1,0|2,0,0]=4 395 B9R1.11 COC(=O)N1C=CC=C1 3202AE [0,1,0,0,1,0|2,0,0]=4 396 B9R1.11 CSC(=O)C1=CC=CO1 9771AJ [0,1,0,0,1,0|2,0,0]=4 397 B9R1.11 N=C(NO)C1=CC=CS1 Z3343 [0,1,0,0,1,0|2,0,0]=4 398 B9R1.11 NNC(=O)C1=CN=CS1 Y6785 [0,1,0,0,1,0|1,0,0]=3 399 B9R1.11 NNC(=O)C1=CSC=N1 Y5141 [0,1,0,0,1,0|1,0,0]=3 400 B9R1.11 O=C(CBr)C1=CC=CN1 Z2515 [0,1,0,0,1,0|1,0,1]=4 401 B9R1.11 O=C(CBr)C1=CC=CS1 Y6915 [0,1,0,0,1,0|2,0,0]=4 402 B9R1.11 O=C(CBr)C1=NC=CS1 W5467 [0,1,0,0,1,0|2,0,0]=4 403 B9R1.35 CC(=O)C1=CSC(Br)=C1 W7213 [0,1,0,0,1,0|2,0,0]=4 404 B9R1.35 CC(=O)C1=CSC(C)=N1 7831AD [0,1,0,0,1,0|2,0,0]=4 405 B9R1.35 CC(=O)C1=CSC(Cl)=C1 Z0709 [0,1,0,0,1,0|2,0,0]=4 406 B9R1.35 CC(=O)C1=CSC(N)=N1 X8554 [0,1,0,0,1,0|2,0,0]=4 407 B9R1.35 CC(=O)C1=NC(C)=CS1 0755AQ [0,1,0,0,1,0|2,0,0]=4 408 B9R1.35 CC(=O)C1=NC=C(C)S1 Y9563 [0,1,0,0,1,0|2,0,0]=4 409 B9R1.35 CC(=O)C1=NOC(C)=C1 1733AB [0,1,0,0,1,0|2,0,0]=4 410 B9R1.35 CC1=CC(C(=O)O)=CO1 Y8297 [0,1,0,0,1,0|2,0,0]=4 411 B9R1.35 CC1=CC(C(=O)O)=CS1 Y8110 [0,1,0,0,1,0|2,0,0]=4 412 B9R1.35 CC1=CC(C(N)=O)=NO1 W5607 [0,1,0,0,1,0|1,0,0]=3 413 B9R1.35 CC1=CN=C(C(=O)O)S1 X0108 [0,1,0,0,1,0|2,0,0]=4 414 B9R1.35 CC1=CSC(C(=O)O)=C1 Z0185 [0,1,0,0,1,0|2,0,0]=4 415 B9R1.35 CC1=CSC(C(=O)O)=N1 X0105 [0,1,0,0,1,0|2,0,0]=4 416 B9R1.35 CC1=CSC(C(N)=O)=C1 Y4172 [0,1,0,0,1,0|1,0,0]=3 417 B9R1.35 CC1=NC(C(=O)O)=CN1 W3181 [0,1,0,0,1,0|2,0,0]=4 418 B9R1.35 CC1=NC(C(=O)O)=CO1 W4681 [0,1,0,0,1,0|2,0,0]=4 419 B9R1.35 CC1=NC(C(=O)O)=CS1 W5694 [0,1,0,0,1,0|2,0,0]=4 420 B9R1.35 CC1=NC=C(C(=O)O)O1 Y5240 [0,1,0,0,1,0|2,0,0]=4 421 B9R1.35 CN1C=CC(C(=O)O)=C1 W5804 [0,1,0,0,1,0|1,0,1]=4 422 B9R1.35 CN1C=CC(C(N)=O)=N1 4721AC [0,1,0,0,1,0|1,0,0]=3 423 B9R1.35 CN1C=NC(C(N)=O)=C1 X9760 [0,1,0,0,1,0|1,0,0]=3 424 B9R1.35 NC(=O)C1=CC(Br)=CN1 V4097 [0,1,0,0,1,0|0,0,1]=3 425 B9R1.35 NC(=O)C1=CC(Br)=CO1 6539AC [0,1,0,0,1,0|1,0,0]=3 426 B9R1.35 NC(=O)C1=CC(Br)=CS1 V7917 [0,1,0,0,1,0|1,0,0]=3 427 B9R1.35 NC(=O)C1=CC=C(Br)O1 6684AE [0,1,0,0,1,0|1,0,0]=3 428 B9R1.35 NC(=O)C1=CC=C(Br)S1 Z2951 [0,1,0,0,1,0|1,0,0]=3 429 B9R1.35 NC(=O)C1=CC=C(Cl)S1 7651AD [0,1,0,0,1,0|1,0,0]=3 430 B9R1.35 NC(=O)C1=CN=C(Br)S1 W8754 [0,1,0,0,1,0|1,0,0]=3 431 B9R1.35 NC(=O)C1=CSC(Br)=N1 3082AC [0,1,0,0,1,0|1,0,0]=3 432 B9R1.35 NC1=NNC(C(=O)O)=C1 4542AA [0,1,0,0,1,0|2,0,0]=4 433 B9R1.35 O=C(O)C1=CC(Br)=CO1 Z4623 [0,1,0,0,1,0|2,0,0]=4 434 B9R1.35 O=C(O)C1=CC(Br)=NO1 W7690 [0,1,0,0,1,0|2,0,0]=4 435 B9R1.35 O=C(O)C1=CC=C(F)S1 W6292 [0,1,0,0,1,0|2,0,0]=4 436 B9R1.35 O=C(O)C1=CC=C(I)S1 8970AB [0,1,0,0,1,0|2,0,0]=4 437 B9R1.35 O=C(O)C1=COC(Br)=C1 5491AJ [0,1,0,0,1,0|2,0,0]=4 438 B9R1.35 O=C(O)C1=COC(Br)=N1 Z3924 [0,1,0,0,1,0|2,0,0]=4 439 B9R1.35 O=C(O)C1=CSC(Br)=N1 W6688 [0,1,0,0,1,0|2,0,0]=4 440 B9R1.35 O=C(O)C1=CSC(Cl)=C1 W5762 [0,1,0,0,1,0|2,0,0]=4 441 B9R1.35 O=C(O)C1=CSC(Cl)=N1 W6687 [0,1,0,0,1,0|2,0,0]=4 442 B9R1.35 O=C(O)C1=NC=C(Br)S1 Y4853 [0,1,0,0,1,0|2,0,0]=4 443 B9R1.35 O=C(O)C1=NNC(Br)=C1 6022AA [0,1,0,0,1,0|2,0,0]=4 444 B9R1.35 O=C(O)C1=NNC(Cl)=C1 Y4463 [0,1,0,0,1,0|2,0,0]=4 445 B9R1.35 O=C(O)C1=NNC(O)=C1 4841AC [0,1,0,0,1,0|2,0,0]=4 446 B9R1.41 CC(=O)C1=C(C)N=CS1 4928AB [0,1,0,0,1,0|2,0,0]=4 447 B9R1.41 CC(=O)C1=C(N)SC=C1 9394AH [0,1,0,0,1,0|2,0,0]=4 448 B9R1.41 CC(=O)C1=CC=NN1C Y5278 [0,1,0,0,1,0|2,0,0]=4 449 B9R1.41 CC(=O)C1=NC=CN1C 3329AC [0,1,0,0,1,0|2,0,0]=4 450 B9R1.41 CC1=C(C(=O)O)C=CN1 4732AB [0,1,0,0,1,0|1,0,1]=4 451 B9R1.41 CC1=C(C(=O)O)C=CO1 Y9842 [0,1,0,0,1,0|2,0,0]=4 452 B9R1.41 CC1=C(C(=O)O)C=CS1 W4117 [0,1,0,0,1,0|2,0,0]=4 453 B9R1.41 CC1=C(C(=O)O)N=CO1 X8680 [0,1,0,0,1,0|2,0,0]=4 454 B9R1.41 CC1=C(C(=O)O)N=CS1 X8003 [0,1,0,0,1,0|2,0,0]=4 455 B9R1.41 CC1=C(C(N)=O)SN=N1 9076AA [0,1,0,0,1,0|2,0,0]=4 456 B9R1.41 CC1=CNN=C1C(=O)O 6212AJ [0,1,0,0,1,0|2,0,0]=4 457 B9R1.41 CC1=CSC=C1C(=O)O Z5123 [0,1,0,0,1,0|2,0,0]=4 458 B9R1.41 CC1=NSC=C1C(=O)O Y7681 [0,1,0,0,1,0|2,0,0]=4 459 B9R1.41 NC(=O)C1=C(Br)C=CS1 Z2703 [0,1,0,0,1,0|1,0,0]=3 460 B9R1.41 NC(=O)C1=C(Cl)C=CS1 Z2723 [0,1,0,0,1,0|1,0,0]=3 461 B9R1.41 NC(=O)C1=C(N)SC=C1 W3069 [0,1,0,0,1,0|1,0,0]=3 462 B9R1.41 NC(=O)C1=C(N)SC=N1 W6941 [0,1,0,0,1,0|1,0,0]=3 463 B9R1.41 NC(=O)C1=C(O)C=CS1 8373AB [0,1,0,0,1,0|1,0,0]=3 464 B9R1.41 NC(=O)C1=C(O)NC=N1 Q084 [0,1,0,0,1,0|1,0,0]=3 465 B9R1.41 NC(=O)C1=CC=CN1N W3458 [0,1,0,0,1,0|0,0,1]=3 466 B9R1.41 NC(=O)C1=NNC=C1Br W9599 [0,1,0,0,1,0|1,0,0]=3 467 B9R1.41 NC1=C(C(=O)O)SC=C1 V6581 [0,1,0,0,1,0|2,0,0]=4 468 B9R1.41 NC1=CNN=C1C(=O)O Y7141 [0,1,0,0,1,0|2,0,0]=4 469 B9R1.41 O=C(O)C1=C(Br)C=CO1 Z5464 [0,1,0,0,1,0|2,0,0]=4 470 B9R1.41 O=C(O)C1=C(Br)C=NN1 Z3880 [0,1,0,0,1,0|2,0,0]=4 471 B9R1.41 O=C(O)C1=C(Br)SC=N1 X8679 [0,1,0,0,1,0|2,0,0]=4 472 B9R1.41 O=C(O)C1=C(F)C=CS1 W5425 [0,1,0,0,1,0|2,0,0]=4 473 B9R1.41 O=C(O)C1=C(O)C=CS1 7114AB [0,1,0,0,1,0|2,0,0]=4 474 B9R1.41 O=C(O)C1=CSC=C1Br Y7756 [0,1,0,0,1,0|2,0,0]=4 475 B9R1.41 O=C(O)C1=NNC=C1Cl W8728 [0,1,0,0,1,0|2,0,0]=4 476 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 9287AB [0,1,0,0,0,1|2,0,0]=4 477 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 7126AD [0,1,0,0,0,1|2,0,0]=4 478 B11R1.20 CC(=O)CC1=CC=C(I)C=C1 1094AB [0,1,0,0,0,1|2,0,0]=4 479 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 Q226 [0,1,0,0,0,1|2,0,0]=4 480 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 9364AB [0,1,0,0,0,1|2,0,0]=4 481 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 3597AB [0,1,0,0,0,1|2,0,0]=4 482 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 1638AC [0,1,0,0,0,1|1,0,0]=3 483 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 Y6115 [0,1,0,0,0,1|1,0,0]=3 484 B11R1.20 NC(=O)NC1=CC=C(Br)C=C1 6622AD [0,1,0,0,0,1|1,0,0]=3 485 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 V3810 [0,1,0,0,0,1|1,1,0]=4 486 B11R1.20 O=C(Cl)OC1=CC=C(Cl)C=C1 1997AC [0,1,0,0,0,1|2,0,0]=4 487 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 5630AH [0,1,0,0,0,1|2,0,0]=4 488 B11R1.36 CC(=O)C(Br)C1=CC=CC=C1 U801 [0,1,0,0,0,1|2,0,0]=4 489 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Y8969 [0,1,0,0,0,1|2,0,0]=4 490 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 U170 [0,1,0,0,0,1|2,0,0]=4 491 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 0850AC [0,1,0,0,0,1|1,0,0]=3 492 B11R1.36 NC(=O)C(O)C1=CC=CC=C1 3705AE [0,1,0,0,0,1|1,0,0]=3 493 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 7117AH [0,1,0,0,0,1|1,0,0]=3 494 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 5421AJ [0,1,0,0,0,1|1,0,0]=3 495 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 6492AB [0,1,0,0,0,1|2,0,0]=4 496 B11R1.40 C=CC(=O)NC1=CC=CC=C1 1202AB [0,1,0,0,0,1|2,0,0]=4 497 B11R1.40 CNC(=O)CC1=CC=CC=C1 8080AE [0,1,0,0,0,1|1,0,0]=3 498 B11R1.40 COC(=O)CC1=CC=CN=C1 X5277 [0,1,0,0,0,1|1,0,0]=3 499 B11R1.40 COC(=O)CC1=CN=CC=N1 4720AB [0,1,0,0,0,1|2,0,0]=4 500 B11R1.40 NNC(=O)NC1=CC=CC=C1 5322AE [0,1,0,0,0,1|1,0,0]=3 501 B11R1.40 N\C(CC1=CC=CC=C1)=N/O 6479AD [0,1,0,0,0,1|1,0,1]=4 502 B11R1.40 O=C(CBr)NC1=CC=CC=C1 7553AB [0,1,0,0,0,1|2,0,0]=4 503 B11R1.40 O=C(CCl)NC1=CC=CC=C1 V6785 [0,1,0,0,0,1|2,0,0]=4 504 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 9403AJ [0,1,0,0,0,1|2,0,0]=4 505 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 0110AB [0,1,0,0,0,1|2,0,0]=4 506 B11R1.86 CC(=O)NC1=CC=CN=C1C Y5364 [0,1,0,0,0,1|1,0,0]=3 507 B11R1.86 CC(=O)OC1=C(Cl)C=CC=C1 5581AL [0,1,0,0,0,1|2,0,0]=4 508 B11R1.86 CC(=O)OC1=CC=CC=C1I 0334AE [0,1,0,0,0,1|2,0,0]=4 509 B11R1.86 N=C(N)NC1=C(Cl)C=CC=C1 7455AH [0,1,0,0,0,1|2,0,0]=4 510 B11R1.86 NC(=O)CC1=CC=CC=C1Br V7162 [0,1,0,0,0,1|1,0,0]=3 511 B11R1.86 NC(=O)CC1=CC=CC=C1Cl 5189AJ [0,1,0,0,0,1|1,0,0]=3 512 B11R1.86 NC(=O)NC1=CC=CC=C1Br 5783AA [0,1,0,0,0,1|1,0,0]=3 513 B11R1.86 O=C(O)CC1=CC=CN=C1Cl Y5005 [0,1,0,0,0,1|1,0,0]=3 514 B11R1.86 O=C(O)CN1C=CC=NC1=O 4217AF [0,1,0,0,0,1|2,0,0]=4 515 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 8966AA [0,1,0,0,0,1|2,0,0]=4 516 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 9330AB [0,1,0,0,0,1|2,0,0]=4 517 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 Z4634 [0,1,0,0,0,1|2,0,0]=4 518 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 W7149 [0,1,0,0,0,1|1,0,0]=3 519 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 4909AB [0,1,0,0,0,1|1,0,0]=3 520 B11R1.3 C#CC1=CC=C(C(=O)[O-])C=C1 4378AD [0,2,0,0,0,0|2,0,0]=4 521 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 5611AH [0,2,0,0,0,0|1,1,0]=4 522 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 9791AL [0,2,0,0,0,0|2,0,0]=4 523 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 7697AB [0,2,0,0,0,0|2,0,0]=4 524 B11R1.3 CNC1=NC=C([N+](=O)[O-])C=C1 V1367 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.3 COC1=NC=C(C(=N)N)C=C1 W4265 [0,2,0,0,0,0|1,0,0]=3 526 B11R1.3 COC1=NN=C(C(=O)O)C=C1 Y9484 [0,2,0,0,0,0|2,0,0]=4 527 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 X8931 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.3 N#CC1=CC=C(C(=N)N)C=C1 6152AJ [0,2,0,0,0,0|2,0,0]=4 529 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 3169AB [0,2,0,0,0,0|1,0,0]=3 530 B11R1.3 N#CC1=NC=C([N+](=O)[O-])C=C1 X8498 [0,2,0,0,0,0|2,0,0]=4 531 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 6545AE [0,2,0,0,0,0|1,0,0]=3 532 B11R1.3 NC(=O)C1=CC=C(CCl)C=C1 2990AC [0,2,0,0,0,0|1,0,0]=3 533 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 X5512 [0,2,0,0,0,0|1,0,0]=3 534 B11R1.3 NNC1=NC=C([N+](=O)[O-])C=C1 V7030 [0,2,0,0,0,0|2,0,0]=4 535 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=N1 4509AB [0,2,0,0,0,0|2,0,0]=4 536 B11R1.3 O=[N+]([O-])C1=CN=C(CO)C=C1 4653AB [0,2,0,0,0,0|2,0,0]=4 537 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=N1 W6471 [0,2,0,0,0,0|2,0,0]=4 538 B11R1.19 CS(=O)(=O)C1=CN=C(Br)C=C1 W5582 [0,2,0,0,0,0|2,0,0]=4 539 B11R1.19 CS(=O)(=O)C1=CN=C(N)C=C1 V5420 [0,2,0,0,0,0|2,0,0]=4 540 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 R868 [0,2,0,0,0,0|2,0,0]=4 541 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 Y9036 [0,2,0,0,0,0|1,0,0]=3 542 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 V6556 [0,2,0,0,0,0|2,0,0]=4 543 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 8306AB [0,2,0,0,0,0|2,0,0]=4 544 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)N=C1 1001AD [0,2,0,0,0,0|1,0,0]=3 545 B11R1.21 CC(=O)C1=CC(Cl)=C(O)C=C1 2899AB [0,2,0,0,0,0|2,0,0]=4 546 B11R1.21 CC(=O)C1=CC=C(Br)C(C)=C1 V5550 [0,2,0,0,0,0|2,0,0]=4 547 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 L433 [0,2,0,0,0,0|2,0,0]=4 548 B11R1.21 CC(=O)C1=CC=C(Cl)C(F)=C1 7623AA [0,2,0,0,0,0|2,0,0]=4 549 B11R1.21 CC(=O)C1=CC=C(Cl)C(N)=C1 V7793 [0,2,0,0,0,0|2,0,0]=4 550 B11R1.21 CC(=O)C1=CC=C(F)C(N)=C1 Z6029 [0,2,0,0,0,0|2,0,0]=4 551 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 Z1157 [0,2,0,0,0,0|2,0,0]=4 552 B11R1.21 CC(=O)C1=CC=C(N)C(F)=C1 X8376 [0,2,0,0,0,0|2,0,0]=4 553 B11R1.21 CC1=C(Cl)N=CC(C(=O)O)=C1 Y9777 [0,2,0,0,0,0|1,0,0]=3 554 B11R1.21 CC1=C(F)C=C(C(=N)N)C=C1 5833AD [0,2,0,0,0,0|2,0,0]=4 555 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 8761AA [0,2,0,0,0,0|1,0,0]=3 556 B11R1.21 CC1=CC(C(=O)O)=CC=C1I W6695 [0,2,0,0,0,0|2,0,0]=4 557 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1F N395 [0,2,0,0,0,0|2,0,0]=4 558 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 2090AJ [0,2,0,0,0,0|2,0,0]=4 559 B11R1.21 CC1=CC=C(C(N)=O)C=C1C 5611AE [0,2,0,0,0,0|1,0,0]=3 560 B11R1.21 CC1=NC=C(C(=O)O)C=C1Br 3254AA [0,2,0,0,0,0|1,0,0]=3 561 B11R1.21 CC1=NC=C(C(=O)O)N=C1C 6284AA [0,2,0,0,0,0|2,0,0]=4 562 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1N B344 [0,2,0,0,0,0|2,0,0]=4 563 B11R1.21 CN1C=C(C(=O)O)C=CC1=O 4744AB [0,2,0,0,0,0|1,0,1]=4 564 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 Y6979 [0,2,0,0,0,0|2,0,0]=4 565 B11R1.21 N=C(N)C1=CC=C(N)C(N)=C1 Z5036 [0,2,0,0,0,0|2,0,0]=4 566 B11R1.21 NC(=O)C1=CC(F)=C(Cl)C=C1 3859AC [0,2,0,0,0,0|1,0,0]=3 567 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 0685AF [0,2,0,0,0,0|1,0,0]=3 568 B11R1.21 NC(=O)C1=CC=C(Br)C(F)=C1 V7636 [0,2,0,0,0,0|1,0,0]=3 569 B11R1.21 NC(=O)C1=CC=C(F)C(Br)=C1 V6034 [0,2,0,0,0,0|1,0,0]=3 570 B11R1.21 NC(=O)C1=CC=C(F)C(Cl)=C1 Y9866 [0,2,0,0,0,0|1,0,0]=3 571 B11R1.21 NC(=S)C1=CC=C(Cl)C(Cl)=C1 7596AD [0,2,0,0,0,0|1,1,0]=4 572 B11R1.21 NC1=CC(C(=O)O)=CC=C1F X2787 [0,2,0,0,0,0|2,0,0]=4 573 B11R1.21 NC1=CC=C(C(=O)O)C=C1I W4421 [0,2,0,0,0,0|2,0,0]=4 574 B11R1.21 NC1=NC=C(C(=O)O)C=C1Br W3918 [0,2,0,0,0,0|1,0,0]=3 575 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 9297AB [0,2,0,0,0,0|2,0,0]=4 576 B11R1.21 O=C(O)C1=CC(F)=C(Cl)N=C1 Y8936 [0,2,0,0,0,0|1,0,0]=3 577 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 4787AB [0,2,0,0,0,0|2,0,0]=4 578 B11R1.21 O=C(O)C1=CC=C(I)C(Br)=C1 Z4496 [0,2,0,0,0,0|2,0,0]=4 579 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 Z4560 [0,2,0,0,0,0|1,0,0]=3 580 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(Br)=C1 W3443 [0,2,0,0,0,0|2,0,0]=4 581 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(Cl)=C1 W4609 [0,2,0,0,0,0|2,0,0]=4 582 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(F)=C1 X7340 [0,2,0,0,0,0|2,0,0]=4 583 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(Br)=C1 V3981 [0,2,0,0,0,0|2,0,0]=4 584 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Cl)=C1 W4607 [0,2,0,0,0,0|2,0,0]=4 585 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(F)=C1 Z6632 [0,2,0,0,0,0|2,0,0]=4 586 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 5639AH [0,2,0,0,0,0|1,0,1]=4 587 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 Z5095 [0,2,0,0,0,0|2,0,0]=4 588 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 1635AE [0,2,0,0,0,0|1,0,0]=3 589 B11R1.22 CC1=CC=C(\C(N)=N/O)C=C1 9986AA [0,2,0,0,0,0|1,0,1]=4 590 B11R1.22 CNC(=O)C1=CC=C(Cl)N=C1 5281AE [0,2,0,0,0,0|0,0,0]=2 591 B11R1.22 COC(=O)C1=CN=C(O)C=C1 W7719 [0,2,0,0,0,0|1,0,0]=3 592 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 W4394 [0,2,0,0,0,0|2,0,0]=4 593 B11R1.22 COC(=O)C1=NC=C(N)N=C1 W3046 [0,2,0,0,0,0|2,0,0]=4 594 B11R1.22 COC(=O)C1=NC=C(O)N=C1 W3047 [0,2,0,0,0,0|2,0,0]=4 595 B11R1.22 COC(=O)C1=NN=C(C)C=C1 1449AA [0,2,0,0,0,0|2,0,0]=4 596 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 W7653 [0,2,0,0,0,0|2,0,0]=4 597 B11R1.22 COC(=O)C1=NN=C(N)C=C1 V9902 [0,2,0,0,0,0|2,0,0]=4 598 B11R1.22 N#CC(=O)C1=CC=C(Cl)C=C1 5602AH [0,2,0,0,0,0|1,0,1]=4 599 B11R1.22 N=C(NO)C1=CC=C(N)N=C1 1482AH [0,2,0,0,0,0|1,0,0]=3 600 B11R1.22 NC(=NO)C1=CN=C(Cl)C=C1 4043AE [0,2,0,0,0,0|0,0,1]=3 601 B11R1.22 NC1=CC=C(\C(N)=N\O)C=C1 V4875 [0,2,0,0,0,0|1,0,1]=4 602 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 Y5103 [0,2,0,0,0,0|1,0,0]=3 603 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 L165 [0,2,0,0,0,0|1,0,0]=3 604 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 W8329 [0,2,0,0,0,0|1,0,0]=3 605 B11R1.22 NNC(=O)C1=CC=C(I)C=C1 X8275 [0,2,0,0,0,0|1,0,0]=3 606 B11R1.22 NNC(=O)C1=NC=C(Cl)N=C1 W8760 [0,2,0,0,0,0|1,0,0]=3 607 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 7597AD [0,2,0,0,0,0|1,0,1]=4 608 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 0082AE [0,2,0,0,0,0|2,0,0]=4 609 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 5413AB [0,2,0,0,0,0|2,0,0]=4 610 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 Z3623 [0,2,0,0,0,0|2,0,0]=4 611 B11R1.166 CC(=O)C1=C(Br)C=C(Br)C=C1 3856AB [0,2,0,0,0,0|2,0,0]=4 612 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 2758AC [0,2,0,0,0,0|2,0,0]=4 613 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 2994AB [0,2,0,0,0,0|2,0,0]=4 614 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 4310AA [0,2,0,0,0,0|2,0,0]=4 615 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 0678AC [0,2,0,0,0,0|2,0,0]=4 616 B11R1.166 CC(=O)C1=CC=C(C)C=C1O Y9837 [0,2,0,0,0,0|2,0,0]=4 617 B11R1.166 CC(=O)C1=CC=C(F)C=C1Br Z6300 [0,2,0,0,0,0|2,0,0]=4 618 B11R1.166 CC(=O)C1=CC=C(F)C=C1C X8299 [0,2,0,0,0,0|2,0,0]=4 619 B11R1.166 CC(=O)C1=CC=C(F)N=C1F 5538AC [0,2,0,0,0,0|1,0,0]=3 620 B11R1.166 CC(=O)C1=CC=C(N)C=C1F Y7069 [0,2,0,0,0,0|2,0,0]=4 621 B11R1.166 CC(=O)C1=CC=C(N)C=C1O W4814 [0,2,0,0,0,0|2,0,0]=4 622 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br W7388 [0,2,0,0,0,0|2,0,0]=4 623 B11R1.166 CC(=O)C1=CN=C(N)N=C1C 7651AE [0,2,0,0,0,0|2,0,0]=4 624 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 Y6583 [0,2,0,0,0,0|1,0,0]=3 625 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 V1675 [0,2,0,0,0,0|1,0,0]=3 626 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=C1 Y9253 [0,2,0,0,0,0|1,0,0]=3 627 B11R1.166 CC1=C(C(=O)O)C=NC(F)=C1 Y4793 [0,2,0,0,0,0|1,0,0]=3 628 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 Y8311 [0,2,0,0,0,0|1,0,0]=3 629 B11R1.166 CC1=CC(C)=NC=C1[N+](=O)[O-] X8842 [0,2,0,0,0,0|2,0,0]=4 630 B11R1.166 CC1=CC(F)=NC=C1[N+](=O)[O-] N396 [0,2,0,0,0,0|2,0,0]=4 631 B11R1.166 CC1=CC(N)=NC=C1C(=O)O 9417AA [0,2,0,0,0,0|1,0,0]=3 632 B11R1.166 CC1=CC=C(C(=N)N)C(Cl)=C1 1657AJ [0,2,0,0,0,0|2,0,0]=4 633 B11R1.166 CC1=CC=C(C(=O)O)C(C)=N1 8698AB [0,2,0,0,0,0|1,0,0]=3 634 B11R1.166 CC1=CC=C(C(=O)O)C(N)=N1 3156AH [0,2,0,0,0,0|1,0,0]=3 635 B11R1.166 CC1=CC=C(C(N)=O)C(O)=C1 V1241 [0,2,0,0,0,0|1,0,0]=3 636 B11R1.166 CC1=CC=C([N+](=O)[O-])C(F)=N1 N389 [0,2,0,0,0,0|2,0,0]=4 637 B11R1.166 CC1=NC(Br)=CC=C1C(=O)O Y3603 [0,2,0,0,0,0|1,0,0]=3 638 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 1550AC [0,2,0,0,0,0|2,0,0]=4 639 B11R1.166 N=C(N)C1=C(F)C=C(F)C=C1 1881AF [0,2,0,0,0,0|2,0,0]=4 640 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 4921AH [0,2,0,0,0,0|2,0,0]=4 641 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 1045AA [0,2,0,0,0,0|1,0,0]=3 642 B11R1.166 NC(=O)C1=C(F)C=C(Cl)C=C1 0977AA [0,2,0,0,0,0|1,0,0]=3 643 B11R1.166 NC(=O)C1=CC=C(Br)C=C1N Y7066 [0,2,0,0,0,0|1,0,0]=3 644 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Cl I649 [0,2,0,0,0,0|1,0,0]=3 645 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N 9852AB [0,2,0,0,0,0|0,0,0]=2 646 B11R1.166 NC(=O)C1=CC=C(F)C=C1Cl N615 [0,2,0,0,0,0|1,0,0]=3 647 B11R1.166 NC(=O)C1=CC=C(F)C=C1N Z3951 [0,2,0,0,0,0|1,0,0]=3 648 B11R1.166 NC(=O)C1=CC=C(N)C=C1F 2625AJ [0,2,0,0,0,0|1,0,0]=3 649 B11R1.166 NC(=O)C1=CC=C(N)C=C1O 8918AB [0,2,0,0,0,0|1,0,0]=3 650 B11R1.166 NC(=O)C1=CN=C(Cl)N=C1Cl X9578 [0,2,0,0,0,0|1,0,0]=3 651 B11R1.166 NC(=O)C1=NC=C(Cl)N=C1Cl 3337AB [0,2,0,0,0,0|1,0,0]=3 652 B11R1.166 NC(=S)C1=C(Cl)C=C(Cl)C=C1 2662AB [0,2,0,0,0,0|1,1,0]=4 653 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 X9391 [0,2,0,0,0,0|1,0,0]=3 654 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 W7166 [0,2,0,0,0,0|1,0,0]=3 655 B11R1.166 NC1=C(C(=O)O)C=NC(=O)N1 4638AB [0,2,0,0,0,0|2,0,0]=4 656 B11R1.166 NC1=C(C(=O)O)C=NC(Cl)=C1 1373AA [0,2,0,0,0,0|1,0,0]=3 657 B11R1.166 NC1=CC(Cl)=NC=C1[N+](=O)[O-] W4940 [0,2,0,0,0,0|2,0,0]=4 658 B11R1.166 NC1=CC(I)=CC=C1C(=O)O W4360 [0,2,0,0,0,0|2,0,0]=4 659 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 R830 [0,2,0,0,0,0|2,0,0]=4 660 B11R1.166 NC1=CC(O)=C(C(=O)[O-])C=C1 6048AA [0,2,0,0,0,0|2,0,0]=4 661 B11R1.166 NC1=CC(O)=CC=C1C(=O)O X8023 [0,2,0,0,0,0|2,0,0]=4 662 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 P262 [0,2,0,0,0,0|2,0,0]=4 663 B11R1.166 NC1=CC=C([N+](=O)[O-])C(N)=N1 1923AL [0,2,0,0,0,0|2,0,0]=4 664 B11R1.166 NC1=NC(Cl)=NC=C1C(=O)O 2075AC [0,2,0,0,0,0|2,0,0]=4 665 B11R1.166 NC1=NC=C(C(=O)O)C(N)=N1 Z2443 [0,2,0,0,0,0|2,0,0]=4 666 B11R1.166 NC1=NC=C([N+](=O)[O-])C(Br)=C1 2981AC [0,2,0,0,0,0|2,0,0]=4 667 B11R1.166 NC1=NC=C([N+](=O)[O-])C(Cl)=C1 W4800 [0,2,0,0,0,0|2,0,0]=4 668 B11R1.166 O=C(O)C1=C(Br)C=C(Br)N=C1 1337AC [0,2,0,0,0,0|1,0,0]=3 669 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 5021AH [0,2,0,0,0,0|2,0,0]=4 670 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 Z3983 [0,2,0,0,0,0|1,0,0]=3 671 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br W6933 [0,2,0,0,0,0|1,0,0]=3 672 B11R1.166 O=C(O)C1=CC=C(Br)N=C1F Z8316 [0,2,0,0,0,0|1,0,0]=3 673 B11R1.166 O=C(O)C1=CN=C(Cl)N=C1Cl X2143 [0,2,0,0,0,0|2,0,0]=4 674 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl Z5074 [0,2,0,0,0,0|1,0,0]=3 675 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl Y8676 [0,2,0,0,0,0|2,0,0]=4 676 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1Br W9498 [0,2,0,0,0,0|2,0,0]=4 677 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1O W9526 [0,2,0,0,0,0|2,0,0]=4 678 B11R1.166 O=[N+]([O-])C1=CC=C(F)N=C1F V6777 [0,2,0,0,0,0|2,0,0]=4 679 B11R1.166 O=[N+]([O-])C1=CN=C(Br)C=C1Br W6349 [0,2,0,0,0,0|2,0,0]=4 680 B11R1.166 O=[N+]([O-])C1=CN=C(Br)C=C1Cl 2326AA [0,2,0,0,0,0|2,0,0]=4 681 B11R1.7 O=S(=O)(NO)C1=CC=CC=C1 7672AF [0,2,0,0,0,0|2,0,0]=4 682 B11R1.16 CCCC(=O)C1=CN=CC=C1 8727AA [0,2,0,0,0,0|1,0,0]=3 683 B11R1.16 CCCC(=O)C1=NC=CN=C1 9293AB [0,2,0,0,0,0|2,0,0]=4 684 B11R1.16 CCNC(=O)C1=CC=CN=C1 8551AL [0,2,0,0,0,0|0,0,0]=2 685 B11R1.16 CCOC(=O)C1=NC=CN=C1 X5895 [0,2,0,0,0,0|2,0,0]=4 686 B11R1.16 CNOC(=O)C1=CC=CC=C1 8702AL [0,2,0,0,0,0|1,0,0]=3 687 B11R1.16 N#CCC(=O)C1=CC=CN=C1 W5295 [0,2,0,0,0,0|0,0,1]=3 688 B11R1.16 N#C\N=C(/N)C1=CN=CC=C1 8996AE [0,2,0,0,0,0|1,0,0]=3 689 B11R1.23 CC1=CC(\C(N)=N\O)=CC=C1 2551AE [0,2,0,0,0,0|1,0,1]=4 690 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 7236AB [0,2,0,0,0,0|2,0,0]=4 691 B11R1.23 CNC(=O)C1=CC(Cl)=NC=C1 Z9574 [0,2,0,0,0,0|2,0,0]=4 692 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 V6197 [0,2,0,0,0,0|1,0,0]=3 693 B11R1.23 CNC(=O)C1=CC=CC(F)=C1 V7378 [0,2,0,0,0,0|1,0,0]=3 694 B11R1.23 COC(=O)C1=CC=CC(N)=C1 3819AC [0,2,0,0,0,0|2,0,0]=4 695 B11R1.23 COC(=O)C1=CC=C[N+]([O-])=C1 5036AD [0,2,0,0,0,0|1,0,1]=4 696 B11R1.23 COC(=O)C1=CN=CC(F)=C1 V6033 [0,2,0,0,0,0|1,0,0]=3 697 B11R1.23 COC(=O)C1=CN=CC(N)=C1 4299AJ [0,2,0,0,0,0|1,0,0]=3 698 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 W6055 [0,2,0,0,0,0|2,0,0]=4 699 B11R1.23 COC(=O)C1=NC(C)=CN=C1 7130AJ [0,2,0,0,0,0|2,0,0]=4 700 B11R1.23 COC(=O)C1=NC(N)=CN=C1 X9326 [0,2,0,0,0,0|2,0,0]=4 701 B11R1.23 N#CC(=O)C1=CC(Br)=CC=C1 5306AH [0,2,0,0,0,0|1,0,1]=4 702 B11R1.23 N#CC(=O)C1=CC=CC(Cl)=C1 5318AH [0,2,0,0,0,0|1,0,1]=4 703 B11R1.23 NC1=CC(\C(N)=N\O)=CC=C1 2356AL [0,2,0,0,0,0|1,0,1]=4 704 B11R1.23 NNC(=O)C1=CC(Br)=NC=C1 V4994 [0,2,0,0,0,0|2,0,0]=4 705 B11R1.23 NNC(=O)C1=CC(N)=NC=C1 Z2507 [0,2,0,0,0,0|2,0,0]=4 706 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AB [0,2,0,0,0,0|1,0,0]=3 707 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 8613AC [0,2,0,0,0,0|1,0,0]=3 708 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 V6203 [0,2,0,0,0,0|1,0,0]=3 709 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 2340AE [0,2,0,0,0,0|1,0,0]=3 710 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 Z2867 [0,2,0,0,0,0|2,0,0]=4 711 B11R1.23 N\C(=N/O)C1=CC(F)=CC=C1 5430AE [0,2,0,0,0,0|1,0,1]=4 712 B11R1.23 N\C(N=O)=C1/C=CNC(Cl)=C1 0861AF [0,2,0,0,0,0|2,0,0]=4 713 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 Y1217 [0,2,0,0,0,0|2,0,0]=4 714 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 Y7249 [0,2,0,0,0,0|2,0,0]=4 715 B11R1.222 CCC(=O)C1=CC=CC=C1C V4211 [0,2,0,0,0,0|2,0,0]=4 716 B11R1.222 CCC(=O)C1=CC=CC=C1Cl Z4973 [0,2,0,0,0,0|2,0,0]=4 717 B11R1.222 CNC(=O)C1=C(F)C=CC=C1 2080AL [0,2,0,0,0,0|1,0,0]=3 718 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 5571AJ [0,2,0,0,0,0|1,0,0]=3 719 B11R1.222 CNC(=O)C1=C(O)C=CC=N1 2289AJ [0,2,0,0,0,0|2,0,0]=4 720 B11R1.222 CNC(=O)C1=CC=CC=C1S 0033AP [0,2,0,0,0,0|1,0,0]=3 721 B11R1.222 CNC(=O)C1=CC=CN=C1Cl 5008AE [0,2,0,0,0,0|0,0,0]=2 722 B11R1.222 CNC(=O)C1=CC=CN=C1N 3745AC [0,2,0,0,0,0|0,0,0]=2 723 B11R1.222 COC(=O)C1=C(I)N=CC=C1 V9048 [0,2,0,0,0,0|1,0,0]=3 724 B11R1.222 COC(=O)C1=C(N)N=CN=C1 W8049 [0,2,0,0,0,0|2,0,0]=4 725 B11R1.222 COC(=O)C1=C(O)N=CC=C1 W7787 [0,2,0,0,0,0|1,0,0]=3 726 B11R1.222 COC(=O)C1=CC=CN=C1Br Z0661 [0,2,0,0,0,0|1,0,0]=3 727 B11R1.222 COC(=O)C1=CC=COC1=O 8572AD [0,2,0,0,0,0|2,0,0]=4 728 B11R1.222 COC(=O)C1=CN=CC=C1C X4936 [0,2,0,0,0,0|1,0,0]=3 729 B11R1.222 COC(=O)C1=NC=CN=C1C Z4722 [0,2,0,0,0,0|2,0,0]=4 730 B11R1.222 C\C(NO)=C1\C=CC=CC1=O 0747AD [0,2,0,0,0,0|2,0,0]=4 731 B11R1.222 N#CC(=O)C1=C(Cl)C=CC=C1 1673AJ [0,2,0,0,0,0|1,0,1]=4 732 B11R1.222 N#CC(=O)C1=CC=CC=C1F V7828 [0,2,0,0,0,0|1,0,1]=4 733 B11R1.222 NCC(=O)C1=CC=CC=C1F W9587 [0,2,0,0,0,0|1,0,0]=3 734 B11R1.222 NNC(=O)C1=CC=CC=C1Br 9319AD [0,2,0,0,0,0|1,0,0]=3 735 B11R1.222 O=C(CBr)C1=CC=CC=C1F V7141 [0,2,0,0,0,0|2,0,0]=4 736 B11R1.87 CC1=C(S(=O)(=O)O)C=NC=C1 6590AB [0,2,0,0,0,0|2,0,0]=4 737 B11R1.87 NS(=O)(=O)C1=CC=CN=C1Cl 2022AE [0,2,0,0,0,0|1,0,0]=3 738 B11R1.155 CC1=CC(S(=O)(=O)O)=CN=C1 6589AB [0,2,0,0,0,0|2,0,0]=4 739 B11R1.155 CS(=O)(=O)C1=CN=CC(Br)=C1 Y9128 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.155 NS(=O)(=O)C1=CC(Cl)=CC=C1 8888AA [0,2,0,0,0,0|2,0,0]=4 741 B11R1.155 O=S(=O)(Cl)C1=CC(Br)=CN=C1 W7641 [0,2,0,0,0,0|2,0,0]=4 742 B11R1.53 C#CC1=CC=CC=C1C(=O)O X5254 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.53 CCC1=NC=CC=C1C(=O)O 4086AB [0,2,0,0,0,0|1,0,0]=3 744 B11R1.53 CNC1=C(C(N)=O)C=CC=C1 1673AC [0,2,0,0,0,0|1,0,0]=3 745 B11R1.53 CNC1=C([N+](=O)[O-])C=NC=C1 W3560 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.53 CNC1=NC=CC=C1[N+](=O)[O-] V5831 [0,2,0,0,0,0|2,0,0]=4 747 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 V1937 [0,2,0,0,0,0|2,0,0]=4 748 B11R1.53 COC1=CC=NC=C1C(=O)O Z6400 [0,2,0,0,0,0|1,0,0]=3 749 B11R1.53 COC1=NC=CC=C1C(C)=O 5873AA [0,2,0,0,0,0|1,0,0]=3 750 B11R1.53 COC1=NC=CN=C1C(=O)O Z4703 [0,2,0,0,0,0|2,0,0]=4 751 B11R1.53 N#CC1=C(C(N)=O)C=CC=C1 5587AL [0,2,0,0,0,0|1,0,0]=3 752 B11R1.53 N#CC1=NC=CC=C1[N+](=O)[O-] N440 [0,2,0,0,0,0|2,0,0]=4 753 B11R1.53 O=C(O)C1=CC=CC=C1CBr X0137 [0,2,0,0,0,0|2,0,0]=4 754 B11R1.53 O=CC1=NC=CC=C1[N+](=O)[O-] Y6840 [0,2,0,0,0,0|2,0,0]=4 755 B11R1.53 O=[IH2]C1=C(C(=O)O)C=CC=C1 7834AF [0,2,0,0,0,0|2,0,0]=4 756 B11R1.156 CC(=O)C1=C(C)C=CC=C1C 0896AB [0,2,0,0,0,0|2,0,0]=4 757 B11R1.156 CC(=O)C1=C(F)C=CC=C1Cl V8421 [0,2,0,0,0,0|2,0,0]=4 758 B11R1.156 CC(=O)C1=C(O)C=CC=C1Br W6967 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.156 CC1=C(C(=O)Cl)C(Cl)=CC=C1 5526AJ [0,2,0,0,0,0|2,0,0]=4 760 B11R1.156 CC1=CC=CC(C)=C1C(N)=O 5515AE [0,2,0,0,0,0|1,0,0]=3 761 B11R1.156 CC1=CC=NC(C)=C1C(=O)O 1387AJ [0,2,0,0,0,0|1,0,0]=3 762 B11R1.156 CC1=NC=CC(C)=C1[N+](=O)[O-] Z7174 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.156 CC1=NC=CC(N)=C1[N+](=O)[O-] W5065 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.156 N=C(N)C1=C(Cl)C=CC=C1Cl 4934AH [0,2,0,0,0,0|2,0,0]=4 765 B11R1.156 NC(=O)C1=C(Br)C=NC=C1F Z4108 [0,2,0,0,0,0|2,0,0]=4 766 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1Cl V0556 [0,2,0,0,0,0|1,0,0]=3 767 B11R1.156 NC(=O)C1=C(Cl)N=CN=C1Cl 5217AC [0,2,0,0,0,0|1,0,0]=3 768 B11R1.156 NC(=O)C1=C(F)C=CC=C1Br 2020AL [0,2,0,0,0,0|1,0,0]=3 769 B11R1.156 NC(=O)C1=C(F)C=CC=C1Cl R427 [0,2,0,0,0,0|1,0,0]=3 770 B11R1.156 NC(=S)C1=C(F)C=CC=C1F Y6316 [0,2,0,0,0,0|1,1,0]=4 771 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=N1 Z4930 [0,2,0,0,0,0|1,0,0]=3 772 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 3274AH [0,2,0,0,0,0|2,0,0]=4 773 B11R1.156 NC1=NC=CC(Br)=C1[N+](=O)[O-] W8715 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Br Y3742 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.156 O=C(O)C1=C(Br)N=CC=C1O Z7668 [0,2,0,0,0,0|1,0,0]=3 776 B11R1.156 O=C(O)C1=C(F)C=CN=C1Cl 1651AJ [0,2,0,0,0,0|1,0,0]=3 777 B11R1.156 O=C(O)C1=C(F)N=CC=C1I W9065 [0,2,0,0,0,0|1,0,0]=3 778 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl 6169AA [0,2,0,0,0,0|2,0,0]=4 779 B11R1.156 O=C([O-])C1=C(Cl)C=CC=C1Cl 3819AL [0,2,0,0,0,0|2,0,0]=4 780 B11R1.156 O=[N+]([O-])C1=C(Br)C=CN=C1Br Y7250 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.156 O=[N+]([O-])C1=C(O)C=CN=C1Cl W7497 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.159 CC(=O)C1=C(F)C(Cl)=CC=C1 8191AA [0,2,0,0,0,0|2,0,0]=4 783 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F X4555 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O Z4323 [0,2,0,0,0,0|2,0,0]=4 785 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl W6990 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N X3777 [0,2,0,0,0,0|2,0,0]=4 787 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O Y8724 [0,2,0,0,0,0|2,0,0]=4 788 B11R1.159 CC(=O)C1=CC=CC(F)=C1Cl X8155 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.159 CC(=O)C1=CC=CC(F)=C1O 0838AC [0,2,0,0,0,0|2,0,0]=4 790 B11R1.159 CC1=C(F)C=CC=C1C(N)=O 2425AL [0,2,0,0,0,0|1,0,0]=3 791 B11R1.159 CC1=C(I)C=CC=C1C(=O)O X2813 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.159 CC1=CN=CC([N+](=O)[O-])=C1N Z4319 [0,2,0,0,0,0|2,0,0]=4 793 B11R1.159 CN1C=CC=C(C(=O)O)C1=O 7787AA [0,2,0,0,0,0|1,0,1]=4 794 B11R1.159 NC(=O)C1=C(Cl)C(F)=CC=C1 8088AE [0,2,0,0,0,0|1,0,0]=3 795 B11R1.159 NC(=O)C1=CC=CC(Br)=C1F V8396 [0,2,0,0,0,0|1,0,0]=3 796 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N Z4759 [0,2,0,0,0,0|1,0,0]=3 797 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1Cl V1409 [0,2,0,0,0,0|1,0,0]=3 798 B11R1.159 NC(=O)C1=CC=CC(F)=C1F 6164AD [0,2,0,0,0,0|1,0,0]=3 799 B11R1.159 NC1=C(Br)C(C(=O)O)=CC=C1 V3721 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 X8028 [0,2,0,0,0,0|2,0,0]=4 801 B11R1.159 NC1=C(O)C(C(=O)O)=CC=C1 X8030 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 8344AB [0,2,0,0,0,0|2,0,0]=4 803 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 X4483 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Br Z4927 [0,2,0,0,0,0|2,0,0]=4 805 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl X8043 [0,2,0,0,0,0|2,0,0]=4 806 B11R1.159 O=C(O)C1=CC=CC(F)=C1I X4486 [0,2,0,0,0,0|2,0,0]=4 807 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br 3273AC [0,2,0,0,0,0|2,0,0]=4 808 B11R1.159 O=C(O)C1=CC=CC(I)=C1Cl A542 [0,2,0,0,0,0|2,0,0]=4 809 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1O W5375 [0,2,0,0,0,0|2,0,0]=4 810 B11R1.159 O=[N+]([O-])C1=CN=CC(Cl)=C1Cl 8314AB [0,2,0,0,0,0|2,0,0]=4 811 B11R1.159 O=[N+]([O-])C1=CN=CC(Cl)=C1O X5153 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 X4553 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 7032AB [0,2,0,0,0,0|2,0,0]=4 814 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl 1939AF [0,2,0,0,0,0|1,0,0]=3 815 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F X8969 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.167 CC(=O)C1=CC(C)=CC=C1F X8298 [0,2,0,0,0,0|2,0,0]=4 817 B11R1.167 CC(=O)C1=CC(F)=CC=C1N Z4461 [0,2,0,0,0,0|2,0,0]=4 818 B11R1.167 CC(=O)C1=CC(O)=CC=C1F V3358 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 4311AB [0,2,0,0,0,0|1,0,0]=3 820 B11R1.167 CC1=C(C(N)=O)C=C(F)C=C1 9177AA [0,2,0,0,0,0|1,0,0]=3 821 B11R1.167 CC1=CC=C(O)C(C(N)=O)=C1 V1242 [0,2,0,0,0,0|1,0,0]=3 822 B11R1.167 CC1=CN=C(Br)C([N+](=O)[O-])=C1 W4687 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 Z4478 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 W7762 [0,2,0,0,0,0|1,0,0]=3 825 B11R1.167 CC1=CN=C(Cl)C([N+](=O)[O-])=C1 W4686 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.167 CC1=CN=C(N)C(C(N)=O)=C1 0576AA [0,2,0,0,0,0|0,0,0]=2 827 B11R1.167 CC1=CNC(=O)C(C(=O)O)=C1 4899AB [0,2,0,0,0,0|1,0,1]=4 828 B11R1.167 CC1=NC=C(Cl)C=C1[N+](=O)[O-] Z8280 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 Y4678 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.167 NC(=O)C1=C(Cl)C=CC(F)=C1 4150AC [0,2,0,0,0,0|1,0,0]=3 831 B11R1.167 NC(=O)C1=C(N)N=CC(Br)=C1 8666AB [0,2,0,0,0,0|0,0,0]=2 832 B11R1.167 NC(=O)C1=CC(Br)=CC=C1Cl V4012 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.167 NC(=O)C1=CC(Br)=CC=C1I Z4555 [0,2,0,0,0,0|1,0,0]=3 834 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl Z0829 [0,2,0,0,0,0|0,0,0]=2 835 B11R1.167 NC(=O)C1=CC(F)=CN=C1Cl 1698AC [0,2,0,0,0,0|0,0,0]=2 836 B11R1.167 NC1=C([N+](=O)[O-])C=C(I)C=N1 2060AB [0,2,0,0,0,0|2,0,0]=4 837 B11R1.167 O=C(Cl)C1=CC(Cl)=CC=C1Cl E633 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.167 O=C(O)C1=CC(F)=CN=C1F 0695AF [0,2,0,0,0,0|1,0,0]=3 839 B11R1.167 O=C(O)C1=CC(I)=CC=C1I Z1811 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl 6435AE [0,2,0,0,0,0|1,0,0]=3 841 B11R1.167 O=C(O)C1=CC(O)=CC=C1F X2155 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.167 O=C(O)C1=CC(O)=CC=C1I X8082 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl 5941AB [0,2,0,0,0,0|1,0,0]=3 844 B11R1.167 O=C([O-])C1=CC(F)=CC=C1F W6704 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.167 O=C([O-])C1=CC(O)=CC=C1O M915 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.167 O=[N+]([O-])C1=C(O)N=CC(I)=C1 8470AD [0,2,0,0,0,0|2,0,0]=4 847 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 X8328 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 Z6809 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 Z4893 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 X3116 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.74 N=C(N)C1=CC(Cl)=CC(Cl)=C1 7826AD [0,2,0,0,0,0|2,0,0]=4 852 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 Y7546 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 Z0270 [0,2,0,0,0,0|1,0,0]=3 854 B11R1.74 NC(=O)C1=CC(Cl)=NC(Cl)=C1 Z1030 [0,2,0,0,0,0|2,0,0]=4 855 B11R1.74 NC(=O)C1=CC(F)=CC(F)=C1 Z0102 [0,2,0,0,0,0|1,0,0]=3 856 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=C1 X8029 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.74 NC1=CC(C(=O)O)=CC(F)=C1 W8462 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 6925AA [0,2,0,0,0,0|2,0,0]=4 859 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 Z5106 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 5927AL [0,2,0,0,0,0|2,0,0]=4 861 B11R1.74 O=C(O)C1=CC(I)=CC(F)=C1 X4491 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=C1 7506AB [0,2,0,0,0,0|2,0,0]=4 863 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 5335AH [0,2,0,0,0,0|2,0,0]=4 864 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 7186AB [0,2,0,0,0,0|2,0,0]=4 865 B11R1.266 CNC1=CN=CC(C(=O)O)=C1 6280AJ [0,2,0,0,0,0|1,0,0]=3 866 B11R1.266 COC1=CC(C(=N)N)=CC=C1 2322AJ [0,2,0,0,0,0|2,0,0]=4 867 B11R1.266 COC1=CC(C(=O)O)=CN=C1 W4373 [0,2,0,0,0,0|1,0,0]=3 868 B11R1.266 COC1=CC(C(N)=O)=NC=C1 V8887 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.266 COC1=CC=CC(C(N)=O)=N1 4601AF [0,2,0,0,0,0|2,0,0]=4 870 B11R1.266 COC1=CN=CC(C(=O)O)=C1 Y6897 [0,2,0,0,0,0|1,0,0]=3 871 B11R1.266 N#CC1=CC(C(N)=O)=CC=C1 0969AE [0,2,0,0,0,0|1,0,0]=3 872 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 5247AA [0,2,0,0,0,0|1,0,0]=3 873 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 Z4812 [0,2,0,0,0,0|1,0,0]=3 874 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 Q654 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.266 NCC1=CC(C(N)=O)=CC=C1 Z6536 [0,2,0,0,0,0|1,0,0]=3 876 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 X0219 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.266 O=C(O)C1=CC=CC(CO)=C1 X8078 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.69 CC1=NC=C(Cl)C(=O)N1 2416AB [0,0,1,1,0,0|1,0,1]=4 879 B11R2.10 BrC1=NC2=CC=CN=C2S1 W6173 [0,0,0,1,0,1|1,1,0]=4 880 B11R2.10 CC1=NC2=CC=CN=C2N1 V7266 [0,0,0,1,0,1|1,0,0]=3 881 B11R2.10 CC1=NC2=NC=CC=C2O1 W8875 [0,0,0,1,0,1|1,0,1]=4 882 B11R2.10 ClC1=NC2=CC=CN=C2S1 Z5341 [0,0,0,1,0,1|1,1,0]=4 883 B11R2.10 ClC1=NC2=NC=CC=C2S1 W3319 [0,0,0,1,0,1|1,0,1]=4 884 B11R2.10 NC1=CC2=CC=CC=C2S1 W6356 [0,0,0,1,0,1|1,1,0]=4 885 B11R2.10 NC1=NC2=C(C=CN=C2)O1 Z3900 [0,0,0,1,0,1|0,0,1]=3 886 B11R2.10 O=C1CC2=C(C=CC=N2)N1 3636AB [0,0,0,1,0,1|1,0,0]=3 887 B11R2.10 O=C1CC2=CC=CN=C2N1 W7017 [0,0,0,1,0,1|0,0,0]=2 888 B11R2.10 O=C1CC2=CN=CC=C2N1 6234AA [0,0,0,1,0,1|0,0,0]=2 889 B11R2.10 O=C1NC2=CC=CN=C2N1 W3559 [0,0,0,1,0,1|0,0,0]=2 890 B11R2.10 S=C1NC2=C(N=CC=C2)N1 2997AB [0,0,0,1,0,1|0,1,0]=3 891 B11R2.10 S=C1NC2=C(N=CC=C2)O1 8657AA [0,0,0,1,0,1|1,0,1]=4 892 B11R2.10 SC1=NC2=C(C=NC=C2)S1 9765AC [0,0,0,1,0,1|0,1,1]=4 893 B11R2.10 SC1=NC2=CC=CN=C2S1 V6699 [0,0,0,1,0,1|1,1,0]=4 894 B11R2.10 SC1=NC2=NC=CC=C2O1 Z4832 [0,0,0,1,0,1|0,1,1]=4 895 B11R2.10 SC1=NC2=NC=CC=C2S1 V9923 [0,0,0,1,0,1|0,1,1]=4 896 B11R2.1 BrC1=CNC2=C1C=NC=N2 W3850 [0,1,0,1,0,0|2,0,0]=4 897 B11R2.1 BrC1=CSC2=C1C=NC=C2 Y5372 [0,1,0,1,0,0|1,1,0]=4 898 B11R2.1 BrC1=CSC2=NC=CC=C12 Z4557 [0,1,0,1,0,0|1,1,0]=4 899 B11R2.1 BrC1=NNC2=C1C=NC=N2 X9616 [0,1,0,1,0,0|2,0,0]=4 900 B11R2.1 CC1=CNC2=C1C=CC=N2 W7016 [0,1,0,1,0,0|1,0,0]=3 901 B11R2.1 CC1=CNC2=C1C=NC=C2 1454AB [0,1,0,1,0,0|1,0,0]=3 902 B11R2.1 CC1=NNC2=C1C=CC=C2 W5365 [0,1,0,1,0,0|2,0,0]=4 903 B11R2.1 CC1=NNC2=NC=CC=C12 X9179 [0,1,0,1,0,0|1,0,0]=3 904 B11R2.1 IC1=CNC2=C1C=NC=N2 W3851 [0,1,0,1,0,0|2,0,0]=4 905 B11R2.1 NC1=CNC2=C1C=CC=N2 X8537 [0,1,0,1,0,0|1,0,0]=3 906 B11R2.1 NC1=NCC2=C1C=CC=C2 2334AL [0,1,0,1,0,0|2,0,0]=4 907 B11R2.1 NC1=NNC2=NC=CN=C12 W8581 [0,1,0,1,0,0|2,0,0]=4 908 B11R2.1 NC1=NOC2=NC=CN=C12 W8582 [0,1,0,1,0,0|1,0,1]=4 909 B11R2.1 NC1=NSC2=CC=CC=C21 D152 [0,1,0,1,0,0|1,1,0]=4 910 B11R2.1 NC1=NSC2=NC=CC=C12 W7047 [0,1,0,1,0,0|0,1,0]=3 911 B11R2.1 O=C1CCC2=NC=CC=C12 W5126 [0,1,0,1,0,0|1,0,0]=3 912 B11R2.1 O=C1CSC2=CC=CC=C12 X9761 [0,1,0,1,0,0|2,0,0]=4 913 B11R2.1 O=C1NCC2=C1C=CC=N2 5330AB [0,1,0,1,0,0|0,0,0]=2 914 B11R2.1 O=C1SSC2=C1C=CC=C2 6202AB [0,1,0,1,0,0|2,0,0]=4 915 B11R2.239 C1=CC(C2CNC2)=CN=C1 4511AA [0,1,0,1,0,0|1,0,1]=4 916 B7R1.1 C=CC1=CN=CN1 4743AB [1,0,0,0,1,0|2,0,0]=4 917 B7R1.1 C=CC1=NC=CS1 Y1855 [1,0,0,0,1,0|2,0,0]=4 918 B7R1.1 NCC1=CC=CN1 X9903 [1,0,0,0,1,0|0,0,2]=4 919 B7R1.1 NCC1=CC=NO1 6076AB [1,0,0,0,1,0|1,0,1]=4 920 B7R1.1 NCC1=CN=CO1 7605AH [1,0,0,0,1,0|1,0,1]=4 921 B7R1.1 NCC1=CN=CO1 X9388 [1,0,0,0,1,0|1,0,1]=4 922 B7R1.1 NCC1=CN=CS1 7784AH [1,0,0,0,1,0|1,0,1]=4 923 B7R1.1 NCC1=CN=CS1 W3518 [1,0,0,0,1,0|1,0,1]=4 924 B7R1.1 NCC1=CN=CS1 Z3440 [1,0,0,0,1,0|1,0,1]=4 925 B7R1.1 NCC1=CNC=C1 4647AC [1,0,0,0,1,0|0,0,2]=4 926 B7R1.1 NCC1=CNC=N1 W7724 [1,0,0,0,1,0|1,0,1]=4 927 B7R1.1 NCC1=COC=N1 Y6958 [1,0,0,0,1,0|1,0,1]=4 928 B7R1.1 NCC1=CSC=C1 Y8534 [1,0,0,0,1,0|1,0,1]=4 929 B7R1.1 NCC1=CSC=N1 6554AH [1,0,0,0,1,0|1,0,1]=4 930 B7R1.1 NCC1=NC=CN1 6710AA [1,0,0,0,1,0|1,0,1]=4 931 B7R1.1 NCC1=NC=CS1 3144AC [1,0,0,0,1,0|1,0,1]=4 932 B7R1.1 NCC1=NC=CS1 W6779 [1,0,0,0,1,0|1,0,1]=4 933 B7R1.1 NCC1=NNC=C1 W5849 [1,0,0,0,1,0|1,0,1]=4 934 B7R1.1 NCC1=NNC=C1 X6524 [1,0,0,0,1,0|1,0,1]=4 935 B7R1.1 NCC1=NOC=C1 5768AA [1,0,0,0,1,0|1,0,1]=4 936 B7R1.1 O=CC1=CC=NS1 7399AB [1,0,0,0,1,0|1,0,0]=3 937 B7R1.1 O=CC1=CNN=C1 9871AH [1,0,0,0,1,0|1,0,0]=3 938 B7R1.1 O=CC1=CON=C1 0015AC [1,0,0,0,1,0|1,0,0]=3 939 B7R1.1 O=CC1=CSN=N1 2643AB [1,0,0,0,1,0|2,0,0]=4 940 B7R1.1 O=CC1=NC=CS1 0841AA [1,0,0,0,1,0|1,0,0]=3 941 B11R1.91 CC(=O)C#CC1=CC=CC=C1 W3943 [0,0,0,0,0,2|2,0,0]=4 942 B11R1.91 CC(=O)CSC1=CC=CC=C1 4421AE [0,0,0,0,0,2|2,0,0]=4 943 B11R1.91 N=C(N)CSC1=CC=CC=C1 0460AF [0,0,0,0,0,2|2,0,0]=4 944 B11R1.91 N=C(N)NCC1=CC=CC=C1 8483AD [0,0,0,0,0,2|2,0,0]=4 945 B11R1.91 NC(=O)COC1=CC=CC=C1 6854AE [0,0,0,0,0,2|1,0,0]=3 946 B11R1.91 NC(=S)COC1=CC=CC=C1 9422AJ [0,0,0,0,0,2|1,1,0]=4 947 B11R1.91 O=C(O)COC1=CN=CC=C1 4069AE [0,0,0,0,0,2|1,0,0]=3 948 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 U931 [0,0,0,0,0,2|1,0,0]=3 949 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 Y8120 [0,0,0,0,0,2|1,0,0]=3 950 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 Z3718 [0,0,0,0,0,2|2,0,0]=4