0 B9R1.1 BrCC1=CN=C(Br)C=C1 Y3534 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [0,0,0,0,0,0|2,0,2]=4 2 B9R1.1 CC1=CC=C(C#N)N=N1 4296AE [0,0,0,0,0,0|3,0,1]=4 3 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [0,0,0,0,0,0|3,0,1]=4 4 B9R1.1 CC1=CN=C(CCl)C=N1 Y4151 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.1 CC1=CN=C(CCl)N=C1 5238AA [0,0,0,0,0,0|3,0,0]=3 6 B9R1.1 CC1=CN=C(CCl)N=C1 W8706 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.1 CC1=CN=C(CO)N=C1 5144AC [0,0,0,0,0,0|3,0,0]=3 8 B9R1.1 CC1=CN=C(NN)C=C1 6685AB [0,0,0,0,0,0|3,0,0]=3 9 B9R1.1 CC1=NC=C(CBr)C=N1 2514AC [0,0,0,0,0,0|3,0,0]=3 10 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.1 CC1=NC=C(CN)C=N1 6982AA [0,0,0,0,0,0|3,0,0]=3 12 B9R1.1 CC1=NN=C(NN)C=C1 W5942 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [0,0,0,0,0,0|2,0,0]=2 14 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [0,0,0,0,0,0|2,0,0]=2 15 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [0,0,0,0,0,0|2,0,0]=2 16 B9R1.1 CCC1=CC=C(S)C=C1 S243 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.1 CCC1=CN=C(N)C=N1 X9917 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.1 CCC1=CN=C(N)N=C1 W5969 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [0,0,0,0,0,0|2,0,1]=3 20 B9R1.1 CCC1=NC=C(Br)C=N1 W8957 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.1 CNC1=CC=C(N)C=C1 F921 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.1 CNC1=NC=C(N)C=C1 2702AB [0,0,0,0,0,0|3,0,0]=3 25 B9R1.1 CNC1=NC=C(N)C=N1 1831AJ [0,0,0,0,0,0|4,0,0]=4 26 B9R1.1 COC1=CN=C(I)C=N1 6098AC [0,0,0,0,0,0|2,0,0]=2 27 B9R1.1 COC1=NN=C(I)C=C1 8933AA [0,0,0,0,0,0|4,0,0]=4 28 B9R1.1 CSC1=CC=C(S)C=C1 U208 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.1 CSC1=NC=C(C)C=N1 Z2994 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.1 CSC1=NC=C(Cl)C=N1 2139AL [0,0,0,0,0,0|4,0,0]=4 33 B9R1.1 CSC1=NC=C(N)C=N1 6318AJ [0,0,0,0,0,0|4,0,0]=4 34 B9R1.1 CSC1=NC=C(O)C=N1 Z4789 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [0,0,0,0,0,0|4,0,0]=4 36 B9R1.1 ClC1=NC=C(CBr)C=C1 3738AB [0,0,0,0,0,0|3,0,0]=3 37 B9R1.1 ClCC1=CN=C(Cl)N=C1 7390AA [0,0,0,0,0,0|4,0,0]=4 38 B9R1.1 ClCC1=NC=C(Cl)C=C1 7439AC [0,0,0,0,0,0|3,0,0]=3 39 B9R1.1 N#CC1=CN=C(I)C=C1 V4938 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.1 NC1=CC=C(CO)N=C1 8824AH [0,0,0,0,0,0|3,0,0]=3 41 B9R1.1 NC1=NC=C(CO)C=N1 3624AA [0,0,0,0,0,0|4,0,0]=4 42 B9R1.1 NCC1=CN=C(Cl)C=N1 1378AA [0,0,0,0,0,0|2,0,0]=2 43 B9R1.1 NCC1=CNC(=O)C=C1 5770AA [0,0,0,0,0,0|3,0,1]=4 44 B9R1.1 NCC1=NC=C(Br)C=C1 8830AH [0,0,0,0,0,0|3,0,0]=3 45 B9R1.1 NCC1=NC=C(Br)C=C1 W3796 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.1 NCC1=NC=C(Br)C=N1 Z4014 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.1 NCC1=NC=C(Cl)C=N1 8838AH [0,0,0,0,0,0|4,0,0]=4 48 B9R1.1 NCC1=NC=C(Cl)C=N1 9256AH [0,0,0,0,0,0|4,0,0]=4 49 B9R1.1 NNC1=NC=C(Br)N=C1 0093AA [0,0,0,0,0,0|3,0,0]=3 50 B9R1.1 NNC1=NC=C(F)C=C1 Z4149 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.1 OCC1=CC=C(Cl)N=N1 0342AA [0,0,0,0,0,0|4,0,0]=4 52 B9R1.1 OCC1=NC=C(Cl)C=N1 4772AJ [0,0,0,0,0,0|4,0,0]=4 53 B9R1.1 OCC1=NC=C(F)C=C1 3321AB [0,0,0,0,0,0|3,0,0]=3 54 B8R1.2 BrCC1=NC=NC=C1 6571AA [1,0,0,0,0,0|3,0,0]=4 55 B8R1.2 C=CC1=NC=CN=C1 R581 [1,0,0,0,0,0|0,0,2]=3 56 B8R1.2 CC[N+]1=CC=CC=C1 E438 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.2 CNC1=CN=CN=C1 5460AB [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 COC1=CC=NN=C1 Z5489 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 ClCC1=NN=CC=C1 2587AB [1,0,0,0,0,0|3,0,0]=4 60 B8R1.2 ICC1=CN=CC=C1 5715AJ [1,0,0,0,0,0|2,0,0]=3 61 B8R1.2 NCC1=CC=CC=C1 7149AL [1,0,0,0,0,0|3,0,0]=4 62 B8R1.2 NCC1=CC=NC=N1 Y7101 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.2 NCC1=CC=NN=C1 X9904 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.2 NCC1=CN=NC=C1 0175AP [1,0,0,0,0,0|3,0,0]=4 65 B8R1.2 SCC1=CC=CN=C1 Z2753 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.3 CC1=CN=C(Br)C=N1 V9897 [1,0,0,0,0,0|1,0,0]=2 67 B8R1.3 CC1=CN=C(C)N=C1 1431AB [1,0,0,0,0,0|2,0,0]=3 68 B8R1.3 CC1=CN=C(I)C=C1 5573AJ [1,0,0,0,0,0|2,0,0]=3 69 B8R1.3 CC1=NC=C(F)C=N1 7849AB [1,0,0,0,0,0|3,0,0]=4 70 B8R1.3 NC1=CN=C(N)C=C1 X9372 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.3 NC1=CN=C(N)C=N1 1979AC [1,0,0,0,0,0|2,0,0]=3 72 B8R1.3 NC1=CN=C(O)C=C1 X9224 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.3 NC1=NC=C(O)C=C1 X4178 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.1 C=CCC1=CC=C(C)C=C1 1127AQ [0,1,0,0,0,0|2,0,1]=4 75 B10R1.1 CC1=CC=C(CNN)C=C1 8497AC [0,1,0,0,0,0|3,0,0]=4 76 B10R1.1 CC1=CC=C(SCCl)C=C1 7374AL [0,1,0,0,0,0|3,0,0]=4 77 B10R1.1 CC1=NC=C(CC#N)C=C1 7400AB [0,1,0,0,0,0|1,0,1]=3 78 B10R1.1 CC1=NC=C(CCO)C=C1 0118AA [0,1,0,0,0,0|1,0,0]=2 79 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [0,1,0,0,0,0|2,0,0]=3 80 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [0,1,0,0,0,0|3,0,0]=4 81 B10R1.1 CCNC1=CC=C(F)C=C1 5502AB [0,1,0,0,0,0|3,0,0]=4 82 B10R1.1 CCNC1=CC=C(O)C=C1 0115AC [0,1,0,0,0,0|3,0,0]=4 83 B10R1.1 CCNC1=NC=C(Br)C=C1 W8816 [0,1,0,0,0,0|2,0,0]=3 84 B10R1.1 CCNC1=NC=C(Br)C=N1 V5881 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.1 CCOC1=CN=C(Cl)C=C1 Z5197 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.1 CCOC1=CN=C(Cl)N=C1 2711AC [0,1,0,0,0,0|3,0,0]=4 87 B10R1.1 CCSC1=NC=C(Br)C=N1 V8149 [0,1,0,0,0,0|3,0,0]=4 88 B10R1.1 CNCC1=CC=C(N)C=C1 Q169 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [0,1,0,0,0,0|3,0,0]=4 90 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [0,1,0,0,0,0|3,0,0]=4 91 B10R1.3 C#CC1=CC=C(OC)N=C1 0197AC [0,1,0,0,0,0|1,0,2]=4 92 B10R1.3 C#CC1=NC=C(OC)C=C1 3383AA [0,1,0,0,0,0|1,0,2]=4 93 B10R1.3 CCC1=CC=C(CBr)C=C1 9519AH [0,1,0,0,0,0|2,0,0]=3 94 B10R1.3 CCC1=CC=C(CN)C=C1 9087AE [0,1,0,0,0,0|2,0,0]=3 95 B10R1.3 CCC1=CC=C(NN)C=C1 8775AH [0,1,0,0,0,0|3,0,0]=4 96 B10R1.3 COC1=CC=C(CN)C=N1 V4770 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.3 COC1=CN=C(CCl)C=C1 2740AC [0,1,0,0,0,0|2,0,0]=3 98 B10R1.3 COC1=CN=C(OC)C=C1 Z0918 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.3 COC1=NC=C(CBr)C=C1 Y7368 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.3 COC1=NC=C(CCl)C=C1 3509AA [0,1,0,0,0,0|2,0,0]=3 101 B10R1.3 COC1=NC=C(NN)C=C1 Z4309 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.3 CSC1=NC=C(C=O)C=C1 Z0204 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.3 CSC1=NC=C(CO)C=N1 X6040 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.3 N#CC1=CC=C(CN)C=N1 5786AH [0,1,0,0,0,0|2,0,1]=4 105 B10R1.3 N#CC1=CC=C(CN)C=N1 9499AA [0,1,0,0,0,0|2,0,1]=4 106 B10R1.3 N#CC1=CN=C(CCl)C=C1 2881AC [0,1,0,0,0,0|2,0,1]=4 107 B10R1.3 N#CC1=CN=C(CO)C=C1 3483AB [0,1,0,0,0,0|2,0,1]=4 108 B10R1.3 NCC1=CC=C(CBr)C=C1 4131AB [0,1,0,0,0,0|3,0,0]=4 109 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [0,1,0,0,0,0|2,0,1]=4 110 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,1,0,0,0,0|2,0,1]=4 111 B10R1.13 CC(=O)C1=CN=C(O)C=N1 2581AA [0,1,0,0,0,0|1,0,1]=3 112 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [0,1,0,0,0,0|3,0,0]=4 113 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [0,1,0,0,0,0|2,0,0]=3 114 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,1,0,0,0,0|3,0,0]=4 117 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [0,1,0,0,0,0|3,0,0]=4 118 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [0,1,0,0,0,0|2,0,0]=3 119 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 CC(O)C1=NC=C(F)C=N1 W9323 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [0,1,0,0,0,0|1,0,0]=2 122 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [0,1,0,0,0,0|1,0,0]=2 123 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [0,1,0,0,0,0|2,0,0]=3 124 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 3942AL [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 CC1=CN=C(B(O)O)C=C1 X0752 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.13 CC1=CN=C(C(=N)N)C=N1 1246AC [0,1,0,0,0,0|1,0,1]=3 128 B10R1.13 CC1=CN=C(C(=N)N)C=N1 2786AA [0,1,0,0,0,0|1,0,1]=3 129 B10R1.13 CC1=NC=C(B(O)O)C=C1 Z7105 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.13 CN(C)C1=NC=C(N)C=C1 6679AB [0,1,0,0,0,0|3,0,0]=4 131 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [0,1,0,0,0,0|3,0,0]=4 135 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,1,0,0,0,0|3,0,0]=4 136 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [0,1,0,0,0,0|3,0,0]=4 137 B10R1.13 NC1=CC=C(C(F)F)N=C1 5273AC [0,1,0,0,0,0|3,0,0]=4 138 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=N1 X9187 [0,1,0,0,0,0|3,0,0]=4 139 B10R1.25 CC1=CC(Br)=CN=C1CN Z0423 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.25 CC1=CC(C)=C(CO)N=C1 0399AB [0,1,0,0,0,0|2,0,0]=3 141 B10R1.25 CC1=CC(F)=NC=C1CO Z0173 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.25 CC1=CC=C(CO)C(=O)N1 4788AB [0,1,0,0,0,0|2,0,1]=4 143 B10R1.25 CC1=CN=C(C#N)C(Br)=C1 W6422 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.25 CC1=CN=C(C#N)C(C)=C1 Y4016 [0,1,0,0,0,0|2,0,1]=4 145 B10R1.25 CC1=NC(C)=C(CO)C=N1 0806AC [0,1,0,0,0,0|3,0,0]=4 146 B10R1.25 CC1=NC=C(C#N)C(Cl)=C1 5039AB [0,1,0,0,0,0|2,0,1]=4 147 B10R1.25 CC1=NC=C(CN)C(C)=N1 4205AB [0,1,0,0,0,0|3,0,0]=4 148 B10R1.25 CC1=NC=C(CN)C(N)=N1 3846AC [0,1,0,0,0,0|3,0,0]=4 149 B10R1.25 CCC1=C(Br)C=C(N)C=C1 5299AH [0,1,0,0,0,0|3,0,0]=4 150 B10R1.25 CCC1=C(N)C=C(C)N=C1 7618AB [0,1,0,0,0,0|1,0,0]=2 151 B10R1.25 CCC1=CC=C(Br)C=C1N 3118AJ [0,1,0,0,0,0|3,0,0]=4 152 B10R1.25 CCC1=CC=C(C)C=C1C Y1729 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.25 CCC1=CC=C(C)N=C1N X4575 [0,1,0,0,0,0|1,0,0]=2 154 B10R1.25 CNC1=C(Cl)C=C(N)C=N1 2678AD [0,1,0,0,0,0|3,0,0]=4 155 B10R1.25 CNC1=NC=C(Cl)C=C1F V4437 [0,1,0,0,0,0|3,0,0]=4 156 B10R1.25 COC1=C(Br)N=C(N)C=C1 Y4109 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.25 COC1=C(C)N=C(C)N=C1 6536AA [0,1,0,0,0,0|3,0,0]=4 158 B10R1.25 COC1=C(Cl)C=C(Br)N=C1 4837AA [0,1,0,0,0,0|3,0,0]=4 159 B10R1.25 COC1=C(Cl)C=C(C)C=C1 7494AD [0,1,0,0,0,0|3,0,0]=4 160 B10R1.25 COC1=C(F)C=C(N)C=N1 W9142 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.25 COC1=C(N)C=C(F)C=N1 3720AA [0,1,0,0,0,0|3,0,0]=4 162 B10R1.25 COC1=CC=C(C)C=C1F Z0570 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.25 COC1=CN=C(Br)C=C1O 6191AA [0,1,0,0,0,0|3,0,0]=4 164 B10R1.25 COC1=NC=C(C)C=C1Cl W9916 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.25 COC1=NC=C(C)C=C1I Z8220 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.25 COC1=NC=C(C)C=C1O Z8657 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.25 COC1=NC=C(Cl)C=C1O Z9050 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.25 COC1=NC=C(F)C=C1F 9839AC [0,1,0,0,0,0|3,0,0]=4 169 B10R1.25 COC1=NC=C(N)C=C1C X9137 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.25 COC1=NC=C(O)C=C1C Y3854 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.25 COC1=NC=C(O)C=C1Cl Y3795 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.25 CSC1=NC=C(Br)C=C1Br Z0015 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.25 CSC1=NC=C(Br)C=C1C Z0037 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.25 CSC1=NC=C(Cl)C=C1Br Z0035 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.25 ClCC1=C(Cl)C=C(Cl)N=C1 1489AC [0,1,0,0,0,0|3,0,0]=4 176 B10R1.25 ClCC1=CC=C(Cl)N=C1Cl X3262 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.25 NC1=NC(Cl)=CN=C1C=O 4744AC [0,1,0,0,0,0|2,0,1]=4 178 B10R1.25 NCC1=NC=C(F)C=C1F Y4056 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.25 OCC1=C(Cl)C=C(Cl)C=N1 2625AB [0,1,0,0,0,0|3,0,0]=4 180 B10R1.25 OCC1=C(Cl)C=C(Cl)N=C1 1488AC [0,1,0,0,0,0|3,0,0]=4 181 B10R1.25 OCC1=CC=C(Br)N=C1Br Z4877 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.25 OCC1=CC=C(Br)N=C1Cl 4356AA [0,1,0,0,0,0|3,0,0]=4 183 B10R1.25 OCC1=NC=C(Br)C=C1Br 4357AA [0,1,0,0,0,0|3,0,0]=4 184 B10R1.25 OCC1=NC=C(Cl)C=C1Br Y3911 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 2176AB [0,1,0,0,0,0|3,0,0]=4 186 B10R1.176 CC1=C(Cl)N=C(C#N)C=C1 3873AC [0,1,0,0,0,0|2,0,1]=4 187 B10R1.176 CC1=C(F)C=C(CBr)C=C1 7166AA [0,1,0,0,0,0|3,0,0]=4 188 B10R1.176 CC1=C(O)C=CC(CO)=N1 6598AB [0,1,0,0,0,0|3,0,0]=4 189 B10R1.176 CC1=CC(C#N)=CN=C1C 3057AJ [0,1,0,0,0,0|2,0,1]=4 190 B10R1.176 CC1=CC(CO)=CN=C1Cl Z1025 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.176 CC1=CC(CO)=NC=C1Br Z1545 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.176 CC1=CC=C(C#N)N=C1Br 6430AJ [0,1,0,0,0,0|2,0,1]=4 193 B10R1.176 CC1=CC=C(C#N)N=C1C 8796AB [0,1,0,0,0,0|2,0,1]=4 194 B10R1.176 CCC1=CC(C)=C(C)C=C1 6497AL [0,1,0,0,0,0|2,0,0]=3 195 B10R1.176 CCC1=CC(F)=C(N)C=C1 2714AC [0,1,0,0,0,0|3,0,0]=4 196 B10R1.176 CCC1=CC(F)=C(N)C=C1 3498AA [0,1,0,0,0,0|3,0,0]=4 197 B10R1.176 CCC1=CC(N)=C(F)C=C1 7951AA [0,1,0,0,0,0|3,0,0]=4 198 B10R1.176 CCC1=CC(N)=C(N)C=C1 2716AA [0,1,0,0,0,0|3,0,0]=4 199 B10R1.176 CNC1=CC=C(C)C(Br)=C1 2220AJ [0,1,0,0,0,0|3,0,0]=4 200 B10R1.176 CNC1=CC=C(C)C(Cl)=C1 V7723 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.176 CNC1=NC=C(Br)C(C)=C1 V3524 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.176 COC1=CC(Br)=C(F)C=N1 4132AC [0,1,0,0,0,0|3,0,0]=4 203 B10R1.176 COC1=CC(N)=C(N)C=N1 Y7353 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.176 COC1=CC=C(Br)C(Br)=N1 5173AC [0,1,0,0,0,0|3,0,0]=4 205 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 2890AC [0,1,0,0,0,0|3,0,0]=4 206 B10R1.176 COC1=CC=C(N)C(N)=N1 Q058 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.176 COC1=CN=C(C)C(Br)=C1 X3672 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.176 COC1=CN=C(Cl)C(Br)=C1 Z6642 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.176 COC1=CN=C(Cl)C(C)=C1 Z0824 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.176 COC1=CN=C(Cl)C(Cl)=C1 X5152 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.176 COC1=CN=C(F)C(I)=C1 Y3900 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.176 COC1=NC=C(Br)C(N)=C1 4442AA [0,1,0,0,0,0|3,0,0]=4 213 B10R1.176 COC1=NC=C(Cl)C(Br)=C1 Y1187 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.176 COC1=NC=C(Cl)C(O)=C1 Y3794 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.176 COC1=NC=C(F)C(N)=C1 8645AB [0,1,0,0,0,0|3,0,0]=4 216 B10R1.176 CSC1=NC(C)=C(Br)C=C1 Z0023 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.176 OCC1=CC(Br)=C(Cl)N=C1 2742AF [0,1,0,0,0,0|3,0,0]=4 218 B10R1.176 OCC1=CC=C(O)C(Br)=N1 5393AD [0,1,0,0,0,0|3,0,0]=4 219 B10R1.176 OCC1=NC=C(F)C(Cl)=C1 Y7094 [0,1,0,0,0,0|3,0,0]=4 220 B8R1.1 BrCC1=CC(Br)=NO1 4667AC [0,0,0,0,1,0|3,0,0]=4 221 B8R1.1 BrCC1=CSC(Br)=C1 Z2517 [0,0,0,0,1,0|3,0,0]=4 222 B8R1.1 CC1=CC(C#N)=CS1 5746AB [0,0,0,0,1,0|2,0,1]=4 223 B8R1.1 CC1=CC(C#N)=NN1 W5930 [0,0,0,0,1,0|2,0,1]=4 224 B8R1.1 CC1=CC(C#N)=NO1 V0794 [0,0,0,0,1,0|2,0,1]=4 225 B8R1.1 CC1=CC(CBr)=NO1 Y7388 [0,0,0,0,1,0|2,0,0]=3 226 B8R1.1 CC1=CC(CN)=NO1 8858AH [0,0,0,0,1,0|2,0,0]=3 227 B8R1.1 CC1=CC=C(CCl)S1 4231AB [0,0,0,0,1,0|3,0,0]=4 228 B8R1.1 CC1=CC=C(CN)S1 V3761 [0,0,0,0,1,0|3,0,0]=4 229 B8R1.1 CC1=CC=C(CO)S1 V7056 [0,0,0,0,1,0|3,0,0]=4 230 B8R1.1 CC1=CNC(CN)=N1 3888AJ [0,0,0,0,1,0|1,0,1]=3 231 B8R1.1 CC1=CNC(CO)=C1 4693AD [0,0,0,0,1,0|1,0,1]=3 232 B8R1.1 CC1=CSC(C#N)=C1 8938AE [0,0,0,0,1,0|2,0,1]=4 233 B8R1.1 CC1=CSC(CN)=C1 Y6895 [0,0,0,0,1,0|2,0,0]=3 234 B8R1.1 CC1=CSC(NN)=N1 7074AA [0,0,0,0,1,0|3,0,0]=4 235 B8R1.1 CC1=CSC(NN)=N1 8798AH [0,0,0,0,1,0|3,0,0]=4 236 B8R1.1 CC1=NC(CBr)=NO1 4500AF [0,0,0,0,1,0|2,0,0]=3 237 B8R1.1 CC1=NC(CCl)=CS1 2148AC [0,0,0,0,1,0|2,0,0]=3 238 B8R1.1 CC1=NC(CN)=NN1 3635AD [0,0,0,0,1,0|2,0,0]=3 239 B8R1.1 CC1=NC(CO)=NO1 8569AD [0,0,0,0,1,0|2,0,0]=3 240 B8R1.1 CC1=NC=C(CN)S1 9600AB [0,0,0,0,1,0|2,0,0]=3 241 B8R1.1 CC1=NC=C(CO)O1 8519AH [0,0,0,0,1,0|2,0,0]=3 242 B8R1.1 CC1=NN=C(CN)O1 8854AH [0,0,0,0,1,0|3,0,0]=4 243 B8R1.1 CC1=NOC(C#N)=C1 7530AE [0,0,0,0,1,0|2,0,1]=4 244 B8R1.1 CC1=NOC(C=O)=C1 Y9882 [0,0,0,0,1,0|2,0,1]=4 245 B8R1.1 CC1=NOC(CCl)=C1 5416AB [0,0,0,0,1,0|2,0,0]=3 246 B8R1.1 CC1=NOC(CN)=C1 0875AC [0,0,0,0,1,0|2,0,0]=3 247 B8R1.1 CC1=NOC(CN)=C1 Y7628 [0,0,0,0,1,0|2,0,0]=3 248 B8R1.1 CC1=NOC(CN)=N1 8442AD [0,0,0,0,1,0|2,0,0]=3 249 B8R1.1 CCC1=CN=C(Br)S1 1608AJ [0,0,0,0,1,0|2,0,0]=3 250 B8R1.1 CCC1=CSC(Cl)=N1 V9898 [0,0,0,0,1,0|2,0,0]=3 251 B8R1.1 CCC1=CSC(N)=N1 V5347 [0,0,0,0,1,0|2,0,0]=3 252 B8R1.1 CCC1=NC(=S)NN1 8795AE [0,0,0,0,1,0|2,0,1]=4 253 B8R1.1 CCC1=NC(Br)=CS1 2688AJ [0,0,0,0,1,0|2,0,0]=3 254 B8R1.1 CCC1=NC=C(Br)S1 1720AA [0,0,0,0,1,0|2,0,0]=3 255 B8R1.1 CCC1=NN=C(N)N1 V4525 [0,0,0,0,1,0|2,0,1]=4 256 B8R1.1 CCC1=NN=C(O)O1 1883AE [0,0,0,0,1,0|3,0,0]=4 257 B8R1.1 CCC1=NOC(N)=C1 2151AC [0,0,0,0,1,0|2,0,0]=3 258 B8R1.1 CCC1CSC(C)=N1 5718AL [0,0,0,0,1,0|1,0,2]=4 259 B8R1.1 CCN1C=C(Cl)C=N1 9799AC [0,0,0,0,1,0|2,0,0]=3 260 B8R1.1 CCN1C=C(I)C=N1 V3768 [0,0,0,0,1,0|2,0,0]=3 261 B8R1.1 CCN1C=CC(Br)=N1 1225AD [0,0,0,0,1,0|3,0,0]=4 262 B8R1.1 CCN1C=CC(C)=N1 9609AD [0,0,0,0,1,0|2,0,0]=3 263 B8R1.1 CCN1C=CC(I)=N1 X6246 [0,0,0,0,1,0|3,0,0]=4 264 B8R1.1 CCN1C=NC(N)=N1 3203AE [0,0,0,0,1,0|2,0,0]=3 265 B8R1.1 CN1C=C(CCl)C=N1 8978AE [0,0,0,0,1,0|2,0,0]=3 266 B8R1.1 CN1C=CC(CCl)=N1 1837AF [0,0,0,0,1,0|3,0,0]=4 267 B8R1.1 CN1C=CC(CN)=N1 3880AJ [0,0,0,0,1,0|3,0,0]=4 268 B8R1.1 CN1C=CC(CO)=N1 Y5569 [0,0,0,0,1,0|3,0,0]=4 269 B8R1.1 CN1C=NC(CCl)=N1 X9907 [0,0,0,0,1,0|2,0,0]=3 270 B8R1.1 CN1C=NC(CN)=C1 6782AA [0,0,0,0,1,0|2,0,0]=3 271 B8R1.1 CNC1=NC(C)=CS1 V4374 [0,0,0,0,1,0|2,0,0]=3 272 B8R1.1 CNC1=NN=C(C)S1 3670AL [0,0,0,0,1,0|3,0,0]=4 273 B8R1.1 COC1=CC(N)=NN1 2004AA [0,0,0,0,1,0|3,0,0]=4 274 B8R1.1 COC1=NC=C(Br)S1 Y9132 [0,0,0,0,1,0|3,0,0]=4 275 B8R1.1 CSC1=CC(Br)=CS1 Z0932 [0,0,0,0,1,0|3,0,0]=4 276 B8R1.1 CSC1=CC(C)=CS1 Z0195 [0,0,0,0,1,0|2,0,0]=3 277 B8R1.1 CSC1=CN=C(N)S1 6948AC [0,0,0,0,1,0|3,0,0]=4 278 B8R1.1 CSC1=NC(Br)=CS1 Y8174 [0,0,0,0,1,0|3,0,0]=4 279 B8R1.1 CSC1=NC(Br)=NS1 X6379 [0,0,0,0,1,0|3,0,0]=4 280 B8R1.1 CSC1=NC(C)=CS1 2874AJ [0,0,0,0,1,0|2,0,0]=3 281 B8R1.1 CSC1=NNC(Br)=N1 4966AD [0,0,0,0,1,0|3,0,0]=4 282 B8R1.1 ClC1=NC(CBr)=CO1 Y5526 [0,0,0,0,1,0|3,0,0]=4 283 B8R1.1 ClCC1=CC(Br)=CS1 8780AA [0,0,0,0,1,0|3,0,0]=4 284 B8R1.1 ClCC1=CSC(Br)=N1 7296AB [0,0,0,0,1,0|3,0,0]=4 285 B8R1.1 NCC1=CC(Br)=CS1 W6461 [0,0,0,0,1,0|3,0,0]=4 286 B8R1.1 NCC1=CC(Br)=NO1 W9337 [0,0,0,0,1,0|3,0,0]=4 287 B8R1.1 OCC1=CC(Br)=CO1 8845AB [0,0,0,0,1,0|3,0,0]=4 288 B8R1.1 OCC1=COC(Br)=N1 1802AA [0,0,0,0,1,0|3,0,0]=4 289 B8R1.1 OCC1=COC(Cl)=N1 Y5525 [0,0,0,0,1,0|3,0,0]=4 290 B8R1.1 OCC1=CSC(Cl)=C1 1477AC [0,0,0,0,1,0|3,0,0]=4 291 B8R1.1 OCC1=CSC(Cl)=N1 7297AB [0,0,0,0,1,0|3,0,0]=4 292 B8R1.1 OCC1=NC(Br)=CS1 0499AB [0,0,0,0,1,0|3,0,0]=4 293 B8R1.1 OCC1=NC=C(Br)S1 5203AC [0,0,0,0,1,0|3,0,0]=4 294 B7R1.3 CC1=CC=CN=N1 X0232 [2,0,0,0,0,0|2,0,0]=4 295 B7R1.3 CC1=CCC=CC1 7751AF [2,0,0,0,0,0|2,0,0]=4 296 B7R1.3 SC1=NC=CN=C1 2178AE [2,0,0,0,0,0|1,0,0]=3 297 B9R1.2 CC1=CC(CCl)=NC=C1 4926AB [1,1,0,0,0,0|2,0,0]=4 298 B9R1.2 CC1=CC(CN)=CN=C1 2036AC [1,1,0,0,0,0|2,0,0]=4 299 B9R1.2 CC1=CC(CN)=NC=C1 Y7378 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.2 CC1=CC(CO)=NC=C1 Z4739 [1,1,0,0,0,0|2,0,0]=4 301 B9R1.2 CC1=CC=CC(CBr)=N1 Y9700 [1,1,0,0,0,0|2,0,0]=4 302 B9R1.2 CC1=CN=CC(C=O)=N1 2745AA [1,1,0,0,0,0|1,0,1]=4 303 B9R1.2 CC1=CN=CC(CCl)=N1 2673AC [1,1,0,0,0,0|1,0,0]=3 304 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [1,1,0,0,0,0|2,0,0]=4 305 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [1,1,0,0,0,0|1,0,0]=3 306 B9R1.2 CCC1=CC(N)=NC=N1 3305AC [1,1,0,0,0,0|2,0,0]=4 307 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [1,1,0,0,0,0|1,0,0]=3 308 B9R1.2 COC1=CC(C)=CN=C1 2251AC [1,1,0,0,0,0|2,0,0]=4 309 B9R1.2 COC1=CN=CC(Br)=N1 Y5654 [1,1,0,0,0,0|1,0,0]=3 310 B9R1.2 COC1=CN=CC(F)=C1 Y3600 [1,1,0,0,0,0|2,0,0]=4 311 B9R1.2 COC1=CN=CC(I)=C1 1202AF [1,1,0,0,0,0|2,0,0]=4 312 B9R1.2 COC1=CN=CC(N)=C1 2136AJ [1,1,0,0,0,0|2,0,0]=4 313 B9R1.2 COC1=NC(C)=CN=C1 2865AB [1,1,0,0,0,0|1,0,0]=3 314 B9R1.2 CSC1=NC(C)=CN=C1 2879AB [1,1,0,0,0,0|1,0,0]=3 315 B9R1.2 CSC1=NC=CC(Cl)=C1 W5514 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.2 ClCC1=CC(Cl)=CN=C1 2237AJ [1,1,0,0,0,0|2,0,0]=4 317 B9R1.2 ClCC1=CN=CC(Br)=C1 Z8207 [1,1,0,0,0,0|2,0,0]=4 318 B9R1.2 ClCC1=CN=CC(Cl)=C1 2236AJ [1,1,0,0,0,0|2,0,0]=4 319 B9R1.2 FC1=CC=CC(CBr)=N1 Z3784 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.2 NC1=CC(CO)=CN=C1 Z2689 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.2 NCC1=CC(Cl)=CN=C1 5679AJ [1,1,0,0,0,0|2,0,0]=4 322 B9R1.2 NCC1=CC=CC(Br)=N1 X7041 [1,1,0,0,0,0|2,0,0]=4 323 B9R1.2 NCC1=NC(Br)=CC=C1 5367AC [1,1,0,0,0,0|2,0,0]=4 324 B9R1.2 NCC1=NC(F)=CC=C1 4862AA [1,1,0,0,0,0|2,0,0]=4 325 B9R1.2 NCC1=NC(F)=CC=C1 Y8188 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.2 NCC1=NC=CC(Br)=C1 W8887 [1,1,0,0,0,0|2,0,0]=4 327 B9R1.2 NCC1=NC=CC(Br)=C1 Z3782 [1,1,0,0,0,0|2,0,0]=4 328 B9R1.2 O=CC1=NC(Cl)=CN=C1 3835AC [1,1,0,0,0,0|1,0,1]=4 329 B9R1.2 OCC1=CN=CC(Br)=N1 3660AA [1,1,0,0,0,0|1,0,0]=3 330 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [1,1,0,0,0,0|0,0,0]=2 332 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [1,1,0,0,0,0|2,0,0]=4 333 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [1,1,0,0,0,0|1,0,0]=3 334 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [1,1,0,0,0,0|2,0,0]=4 335 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [1,1,0,0,0,0|1,0,0]=3 336 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [1,1,0,0,0,0|1,0,0]=3 337 B9R1.8 BrCCC1=CC=CC=N1 5125AB [1,1,0,0,0,0|1,0,0]=3 338 B9R1.8 CCNC1=NC=CN=C1 Z2415 [1,1,0,0,0,0|0,0,0]=2 339 B9R1.8 CNCC1=CC=CC=C1 3855AD [1,1,0,0,0,0|2,0,0]=4 340 B9R1.8 CNCC1=CC=CC=N1 7146AD [1,1,0,0,0,0|1,0,0]=3 341 B9R1.8 CNCC1=CC=NC=N1 6023AD [1,1,0,0,0,0|2,0,0]=4 342 B9R1.8 CNCC1=NC=CC=N1 X8879 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.8 CNCC1=NC=CN=C1 X9439 [1,1,0,0,0,0|0,0,0]=2 344 B9R1.8 ClCCC1=NC=CC=C1 X6257 [1,1,0,0,0,0|1,0,0]=3 345 B9R1.8 NCCC1=CC=CN=C1 5033AC [1,1,0,0,0,0|1,0,0]=3 346 B9R1.8 NCCC1=CN=CC=N1 1878AJ [1,1,0,0,0,0|0,0,0]=2 347 B9R1.8 NCCC1=NC=CN=C1 Y9352 [1,1,0,0,0,0|0,0,0]=2 348 B9R1.8 NNCC1=CC=CC=N1 4874AC [1,1,0,0,0,0|2,0,0]=4 349 B9R1.8 NOCC1=CC=CN=C1 7306AJ [1,1,0,0,0,0|2,0,0]=4 350 B9R1.8 OCCC1=CN=CN=C1 W8980 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.8 OCCC1=NC=CN=C1 Z5014 [1,1,0,0,0,0|0,0,0]=2 352 B9R1.15 CC1=C(CBr)C=NC=C1 Y7235 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.15 CC1=C(NN)N=CC=N1 0201AB [1,1,0,0,0,0|2,0,0]=4 354 B9R1.15 CC1=CC=CN=C1CBr Y9115 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.15 CC1=CC=CN=C1CO 0931AC [1,1,0,0,0,0|2,0,0]=4 356 B9R1.15 CC1=NC=CC=C1CCl 8680AB [1,1,0,0,0,0|2,0,0]=4 357 B9R1.15 CC1=NC=CN=C1CCl 2672AC [1,1,0,0,0,0|1,0,0]=3 358 B9R1.15 CC1=NC=CN=C1CO 8119AA [1,1,0,0,0,0|1,0,0]=3 359 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [1,1,0,0,0,0|1,0,0]=3 360 B9R1.15 CCC1=CC=CC=C1C Z4941 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.15 CCC1=NC=CN=C1N 5741AC [1,1,0,0,0,0|0,0,0]=2 362 B9R1.15 CCC1=[N+]([O-])C=CC=C1 7886AF [1,1,0,0,0,0|1,0,1]=4 363 B9R1.15 CNC1=CC=CN=C1N 8234AB [1,1,0,0,0,0|2,0,0]=4 364 B9R1.15 CNC1=NC=CC=C1N 6884AB [1,1,0,0,0,0|2,0,0]=4 365 B9R1.15 CNC1=NC=CN=C1N Y6424 [1,1,0,0,0,0|1,0,0]=3 366 B9R1.15 COC1=C(Br)C=CN=C1 X8928 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.15 COC1=CC=CN=C1I Y4758 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.15 COC1=CN=CC=C1O 9525AB [1,1,0,0,0,0|2,0,0]=4 369 B9R1.15 COC1=NC=CC=C1F Z7565 [1,1,0,0,0,0|2,0,0]=4 370 B9R1.15 CSC1=NC=CC=C1Br V6364 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.15 CSC1=NC=CN=C1Cl 0040AP [1,1,0,0,0,0|1,0,0]=3 372 B9R1.15 ClCC1=NC=CC=C1Br Z8668 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.15 ClCC1=NC=CN=C1Cl W6373 [1,1,0,0,0,0|1,0,0]=3 374 B9R1.15 FC1=CC=CN=C1CCl X7998 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.15 NC1=C(CO)C=NC=C1 W3010 [1,1,0,0,0,0|2,0,0]=4 376 B9R1.15 NC1=C(CO)N=CC=C1 5776AJ [1,1,0,0,0,0|2,0,0]=4 377 B9R1.15 NC1=NC=CN=C1C=O W5450 [1,1,0,0,0,0|1,0,1]=4 378 B9R1.15 NCC1=C(F)N=CC=C1 3392AC [1,1,0,0,0,0|2,0,0]=4 379 B9R1.15 NCC1=CC=CN=C1Br 0546AB [1,1,0,0,0,0|2,0,0]=4 380 B9R1.15 NCC1=CC=CN=C1Cl 8496AH [1,1,0,0,0,0|2,0,0]=4 381 B9R1.15 NCC1=CC=CN=C1Cl Y8187 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.15 NCC1=CC=CN=C1F W4328 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.15 OCC1=C(Cl)C=CN=C1 V0669 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.15 OCC1=NC=CC=C1Br W6721 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.15 OCC1=NC=CC=C1Cl Z4931 [1,1,0,0,0,0|2,0,0]=4 386 B9R1.69 CC1=C(Br)C=C(O)C=N1 Y8080 [1,1,0,0,0,0|2,0,0]=4 387 B9R1.69 CC1=C(Cl)C=C(N)C=N1 4848AC [1,1,0,0,0,0|2,0,0]=4 388 B9R1.69 CC1=C(Cl)N=CC(N)=N1 6250AB [1,1,0,0,0,0|2,0,0]=4 389 B9R1.69 CC1=CC(C)=C(I)N=C1 6146AB [1,1,0,0,0,0|2,0,0]=4 390 B9R1.69 CC1=CC(C)=NC=C1O 8941AD [1,1,0,0,0,0|2,0,0]=4 391 B9R1.69 CC1=CC(I)=C(Br)N=C1 0052AC [1,1,0,0,0,0|2,0,0]=4 392 B9R1.69 CC1=CC(I)=C(Cl)N=C1 8904AB [1,1,0,0,0,0|2,0,0]=4 393 B9R1.69 CC1=CC=C(Br)N=C1Br 4933AH [1,1,0,0,0,0|2,0,0]=4 394 B9R1.69 CC1=CC=C(C)C(N)=C1 7917AF [1,1,0,0,0,0|2,0,0]=4 395 B9R1.69 CC1=CC=C(C)C(S)=C1 L103 [1,1,0,0,0,0|2,0,0]=4 396 B9R1.69 CC1=CC=C(Cl)N=C1I 3354AD [1,1,0,0,0,0|2,0,0]=4 397 B9R1.69 CC1=CC=C(I)C(N)=N1 W9073 [1,1,0,0,0,0|2,0,0]=4 398 B9R1.69 CC1=CC=C(N)C(O)=N1 Z8999 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.69 CC1=CC=C(N)N=C1N 7196AB [1,1,0,0,0,0|2,0,0]=4 400 B9R1.69 CC1=CC=C(O)C(Cl)=N1 V5467 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.69 CC1=CC=C(O)C(F)=N1 N386 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.69 CC1=CC=C(O)C(N)=N1 W4287 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.69 CC1=CN=C(Br)C=C1Cl 0797AA [1,1,0,0,0,0|2,0,0]=4 404 B9R1.69 CC1=CN=C(Cl)C(C)=C1 Y9908 [1,1,0,0,0,0|2,0,0]=4 405 B9R1.69 CC1=CN=C(Cl)C=C1C 1648AJ [1,1,0,0,0,0|2,0,0]=4 406 B9R1.69 CC1=CN=C(F)C(O)=C1 Y3761 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.69 CC1=CN=C(N)C(N)=C1 W4808 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.69 CC1=CN=C(N)C=C1Br 0796AA [1,1,0,0,0,0|2,0,0]=4 409 B9R1.69 CC1=CN=C(N)C=C1Cl 0795AA [1,1,0,0,0,0|2,0,0]=4 410 B9R1.69 CC1=CN=C(O)C(N)=C1 Z8991 [1,1,0,0,0,0|2,0,0]=4 411 B9R1.69 CC1=NC(N)=C(N)C=C1 3859AB [1,1,0,0,0,0|2,0,0]=4 412 B9R1.69 CC1=NC=C(Br)C(Cl)=C1 Z6267 [1,1,0,0,0,0|2,0,0]=4 413 B9R1.69 CC1=NC=C(Cl)C=C1Br Y6602 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.69 CC1=NC=C(Cl)C=C1F Z8272 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.69 CC1=NC=C(Cl)N=C1Cl 5741AJ [1,1,0,0,0,0|1,0,0]=3 416 B9R1.69 CC1=NC=C(F)C(Cl)=C1 Y7793 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.69 CC1=NC=C(I)C(N)=C1 X5596 [1,1,0,0,0,0|2,0,0]=4 418 B9R1.69 CC1=NC=C(N)N=C1Br 1542AC [1,1,0,0,0,0|1,0,0]=3 419 B9R1.69 ClC1=CN=C(Br)C(Cl)=N1 3570AA [1,1,0,0,0,0|2,0,0]=4 420 B9R1.69 NC1=NC(Cl)=CN=C1Cl 7076AA [1,1,0,0,0,0|2,0,0]=4 421 B9R1.69 NC1=NC=C(Cl)N=C1N 4922AA [1,1,0,0,0,0|2,0,0]=4 422 B9R1.7 CC1=CC=C(CCN)S1 5238AJ [0,1,0,0,1,0|2,0,0]=4 423 B9R1.7 CC1=CC=C(CCN)S1 9610AD [0,1,0,0,1,0|2,0,0]=4 424 B9R1.7 CC1=CN(CCN)N=C1 7229AC [0,1,0,0,1,0|1,0,0]=3 425 B9R1.7 CC1=CN=C(CCN)N1 2107AF [0,1,0,0,1,0|0,0,1]=3 426 B9R1.7 CC1=CNC(CCN)=N1 4655AC [0,1,0,0,1,0|0,0,1]=3 427 B9R1.7 CC1=CSC(CC#N)=N1 Y8135 [0,1,0,0,1,0|1,0,1]=4 428 B9R1.7 CC1=CSC(CCN)=N1 9292AB [0,1,0,0,1,0|1,0,0]=3 429 B9R1.7 CC1=NC(CCN)=NN1 9125AB [0,1,0,0,1,0|1,0,0]=3 430 B9R1.7 CC1=NN=C(CCN)S1 0496AF [0,1,0,0,1,0|2,0,0]=4 431 B9R1.7 CCCC1=CSC(N)=N1 Y6326 [0,1,0,0,1,0|2,0,0]=4 432 B9R1.7 CCCC1=NC(C)=CN1 4781AB [0,1,0,0,1,0|0,0,1]=3 433 B9R1.7 CCCC1=NC(N)=NO1 5513AD [0,1,0,0,1,0|2,0,0]=4 434 B9R1.7 CCCC1=NNC(N)=N1 6472AE [0,1,0,0,1,0|2,0,0]=4 435 B9R1.7 CCCC1=NOC(N)=C1 Z2752 [0,1,0,0,1,0|2,0,0]=4 436 B9R1.7 CCCN1C=C(N)C=N1 0139AD [0,1,0,0,1,0|2,0,0]=4 437 B9R1.7 CCCN1C=C(N)C=N1 V2887 [0,1,0,0,1,0|2,0,0]=4 438 B9R1.7 CCCN1C=NC(Br)=C1 3912AD [0,1,0,0,1,0|2,0,0]=4 439 B9R1.7 CCOC1=CC(N)=NO1 5802AJ [0,1,0,0,1,0|2,0,0]=4 440 B9R1.7 CCOC1=NC(Br)=CS1 Y8398 [0,1,0,0,1,0|2,0,0]=4 441 B9R1.7 CN1C=C(CCO)C=N1 9262AA [0,1,0,0,1,0|1,0,0]=3 442 B9R1.7 CNCC1=CC(Br)=CS1 0077AF [0,1,0,0,1,0|2,0,0]=4 443 B9R1.7 CNCC1=CC(C)=CS1 Y4552 [0,1,0,0,1,0|1,0,0]=3 444 B9R1.7 CNCC1=CC(C)=NN1 2949AD [0,1,0,0,1,0|1,0,0]=3 445 B9R1.7 CNCC1=CC=C(C)S1 2719AC [0,1,0,0,1,0|2,0,0]=4 446 B9R1.7 CNCC1=CC=C(C)S1 5250AC [0,1,0,0,1,0|2,0,0]=4 447 B9R1.7 CNCC1=NC(C)=CS1 3596AL [0,1,0,0,1,0|1,0,0]=3 448 B9R1.7 CNCC1=NC(C)=NO1 3562AF [0,1,0,0,1,0|1,0,0]=3 449 B9R1.7 CNCC1=NN=C(C)O1 2037AF [0,1,0,0,1,0|2,0,0]=4 450 B9R1.7 COCN1C=C(N)C=N1 0110AA [0,1,0,0,1,0|2,0,0]=4 451 B9R1.7 NC1=NC=C(CCO)S1 1301AA [0,1,0,0,1,0|2,0,0]=4 452 B9R1.7 NCCC1=CC(Br)=CS1 1027AJ [0,1,0,0,1,0|2,0,0]=4 453 B9R1.7 NCCC1=CC(Br)=CS1 1159AJ [0,1,0,0,1,0|2,0,0]=4 454 B9R1.21 CCC1=NC(CCl)=NO1 2841AC [0,1,0,0,1,0|1,0,0]=3 455 B9R1.21 CCC1=NC(CN)=NO1 0339AD [0,1,0,0,1,0|1,0,0]=3 456 B9R1.21 CCC1=NN=C(CCl)O1 2346AE [0,1,0,0,1,0|2,0,0]=4 457 B9R1.21 CCC1=NNC(C=O)=C1 5334AH [0,1,0,0,1,0|1,0,1]=4 458 B9R1.21 CCC1=NOC(CCl)=C1 7414AE [0,1,0,0,1,0|1,0,0]=3 459 B9R1.21 CCC1=NOC(CCl)=N1 2845AL [0,1,0,0,1,0|1,0,0]=3 460 B9R1.21 CCC1=NOC(CN)=C1 7203AA [0,1,0,0,1,0|1,0,0]=3 461 B9R1.21 CCC1=NOC(CN)=C1 9790AE [0,1,0,0,1,0|1,0,0]=3 462 B9R1.21 CCC1=NOC(CO)=N1 8642AH [0,1,0,0,1,0|1,0,0]=3 463 B9R1.21 CCN1C=CC(CN)=N1 4395AF [0,1,0,0,1,0|2,0,0]=4 464 B9R1.22 CC1=NC(C)=C(CO)O1 7282AD [0,1,0,0,1,0|2,0,0]=4 465 B9R1.22 CC1=NC(C)=C(CO)S1 W6569 [0,1,0,0,1,0|2,0,0]=4 466 B9R1.22 CC1=NC(CCl)=C(C)O1 Y4075 [0,1,0,0,1,0|2,0,0]=4 467 B9R1.22 CC1=NN(C)C(CBr)=C1 Z2962 [0,1,0,0,1,0|2,0,0]=4 468 B9R1.22 CC1=NN(C)C=C1CN 3406AA [0,1,0,0,1,0|2,0,0]=4 469 B9R1.22 CCN1N=C(C)C=C1C 9243AA [0,1,0,0,1,0|2,0,0]=4 470 B9R1.22 CCN1N=C(C)C=C1N 1314AE [0,1,0,0,1,0|2,0,0]=4 471 B9R1.23 CC1=CC(CCl)=NN1C Z2645 [0,1,0,0,1,0|2,0,0]=4 472 B9R1.35 CC(=O)C1=NC(C)=CN1 2011AB [0,1,0,0,1,0|0,0,2]=4 473 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [0,1,0,0,1,0|1,0,1]=4 474 B9R1.35 CC(C)C1=CSC(N)=N1 V7811 [0,1,0,0,1,0|2,0,0]=4 475 B9R1.35 CC(C)C1=NOC(N)=N1 2275AE [0,1,0,0,1,0|2,0,0]=4 476 B9R1.35 CC(C)C1=NSC(Br)=N1 3128AJ [0,1,0,0,1,0|2,0,0]=4 477 B9R1.35 CC(C)N1C=C(N)C=N1 Z7920 [0,1,0,0,1,0|2,0,0]=4 478 B9R1.35 CC(N)C1=CN(C)N=C1 Y4659 [0,1,0,0,1,0|1,0,0]=3 479 B9R1.35 CC1=CNC(C(C)C)=N1 1747AJ [0,1,0,0,1,0|0,0,1]=3 480 B9R1.35 CC1=NC(C(C)N)=CS1 0056AE [0,1,0,0,1,0|1,0,0]=3 481 B9R1.35 CC1=NNC(C(C)C)=C1 3767AD [0,1,0,0,1,0|1,0,0]=3 482 B9R1.35 CC1=NOC(C(C)N)=N1 1042AD [0,1,0,0,1,0|1,0,0]=3 483 B9R1.132 CC1=C(CO)C=NN1C 7840AC [0,1,0,0,1,0|2,0,0]=4 484 B9R1.132 CCC1=NNC(C)=C1Br 8992AE [0,1,0,0,1,0|1,0,0]=3 485 B9R1.132 CCN1N=CC(Br)=C1C 9826AC [0,1,0,0,1,0|2,0,0]=4 486 B9R1.132 CCN1N=CC(N)=C1C 0396AD [0,1,0,0,1,0|2,0,0]=4 487 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [0,2,0,0,0,0|2,0,0]=4 488 B11R1.1 CC1=CC=C(NCCO)C=C1 9296AD [0,2,0,0,0,0|2,0,0]=4 489 B11R1.1 CC1=CC=C(OCCBr)C=C1 V3999 [0,2,0,0,0,0|2,0,0]=4 490 B11R1.1 CC1=CC=C(OCCCl)C=C1 7057AD [0,2,0,0,0,0|2,0,0]=4 491 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [0,2,0,0,0,0|2,0,0]=4 492 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [0,2,0,0,0,0|2,0,0]=4 493 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [0,2,0,0,0,0|1,0,0]=3 494 B11R1.1 CCCNC1=NC=C(Br)C=C1 Z6268 [0,2,0,0,0,0|2,0,0]=4 495 B11R1.1 CCCOC1=NC=C(Br)C=C1 V8001 [0,2,0,0,0,0|2,0,0]=4 496 B11R1.1 CCNCC1=CN=C(Cl)C=C1 S696 [0,2,0,0,0,0|2,0,0]=4 497 B11R1.1 NCCNC1=CC=C(Br)C=N1 0255AB [0,2,0,0,0,0|2,0,0]=4 498 B11R1.1 OCCCC1=CC=C(Br)N=C1 0074AC [0,2,0,0,0,0|2,0,0]=4 499 B11R1.1 OCCNC1=NC=C(Br)C=C1 2906AF [0,2,0,0,0,0|2,0,0]=4 500 B11R1.1 OCCOC1=NC=C(Br)C=C1 Z0377 [0,2,0,0,0,0|2,0,0]=4 501 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,2,0,0,0,0|1,0,1]=4 502 B11R1.20 CC(C)OC1=CN=C(Cl)C=N1 1633AA [0,2,0,0,0,0|1,0,0]=3 503 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [0,2,0,0,0,0|2,0,0]=4 504 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [0,2,0,0,0,0|2,0,0]=4 505 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [0,2,0,0,0,0|2,0,0]=4 506 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,2,0,0,0,0|1,0,1]=4 507 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 W8749 [0,2,0,0,0,0|1,0,1]=4 508 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,2,0,0,0,0|2,0,0]=4 509 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,2,0,0,0,0|2,0,0]=4 510 B11R1.22 CC1=CN=C(C(=O)NN)C=N1 1913AE [0,2,0,0,0,0|1,0,1]=4 511 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,2,0,0,0,0|2,0,0]=4 512 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,2,0,0,0,0|2,0,0]=4 513 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,2,0,0,0,0|2,0,0]=4 514 B11R1.81 CCOC1=C(Br)C=C(C)C=C1 Y3561 [0,2,0,0,0,0|2,0,0]=4 515 B11R1.81 CCOC1=C(F)C=C(N)C=N1 Z5272 [0,2,0,0,0,0|2,0,0]=4 516 B11R1.81 CCOC1=C(I)C=C(Br)C=N1 0529AF [0,2,0,0,0,0|2,0,0]=4 517 B11R1.81 CCOC1=NC=C(Br)C=C1Br Z0903 [0,2,0,0,0,0|2,0,0]=4 518 B11R1.81 CCOC1=NC=C(N)C=C1Br Z7984 [0,2,0,0,0,0|2,0,0]=4 519 B11R1.81 NCCC1=NC=C(Cl)C=C1Cl 1080AJ [0,2,0,0,0,0|2,0,0]=4 520 B11R1.83 CCNC1=CC=C(C#N)C=N1 Z6380 [0,2,0,0,0,0|1,0,1]=4 521 B11R1.83 CCOC1=NC=C(C#N)C=C1 8337AC [0,2,0,0,0,0|1,0,1]=4 522 B11R1.83 CCOC1=NC=C(CN)C=C1 6330AE [0,2,0,0,0,0|1,0,0]=3 523 B11R1.83 COCC1=CC=C(CO)C=C1 8790AH [0,2,0,0,0,0|2,0,0]=4 524 B11R1.83 COCC1=CC=C(OC)C=C1 W3311 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.83 NCCC1=CC=C(CO)C=C1 9331AH [0,2,0,0,0,0|2,0,0]=4 526 B11R1.192 CCNC1=CC(C)=C(C)C=C1 8938AD [0,2,0,0,0,0|2,0,0]=4 527 B11R1.192 CCOC1=CC=C(Br)C(C)=N1 Z0727 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.192 CCOC1=CN=C(Cl)C(Cl)=C1 Z9772 [0,2,0,0,0,0|2,0,0]=4 529 B11R1.192 CCOC1=NC=C(Br)C(C)=C1 Z0729 [0,2,0,0,0,0|2,0,0]=4 530 B11R1.3 CC(=O)C1=CN=C(C#N)C=N1 5435AC [0,2,0,0,0,0|0,0,2]=4 531 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [0,2,0,0,0,0|2,0,0]=4 532 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [0,2,0,0,0,0|2,0,0]=4 533 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 3415AB [0,2,0,0,0,0|2,0,0]=4 534 B11R1.3 CN(C)C1=NC=C(CN)C=C1 V5451 [0,2,0,0,0,0|2,0,0]=4 535 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [0,2,0,0,0,0|2,0,0]=4 536 B11R1.279 CCC1=CC=C(OC)C(Br)=C1 V9924 [0,2,0,0,0,0|2,0,0]=4 537 B11R1.279 CCC1=CC=C(OC)C=C1O 2074AL [0,2,0,0,0,0|2,0,0]=4 538 B11R1.279 COC1=CC=C(CO)N=C1Br 5072AC [0,2,0,0,0,0|2,0,0]=4 539 B11R1.279 COC1=CC=C(OC)C(Br)=N1 Z8277 [0,2,0,0,0,0|2,0,0]=4 540 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 1609AJ [0,2,0,0,0,0|2,0,0]=4 541 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 W5164 [0,2,0,0,0,0|2,0,0]=4 542 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 5454AB [0,2,0,0,0,0|2,0,0]=4 543 B11R1.19 CC1=CN=C(C(F)(F)F)C=C1 8203AA [0,2,0,0,0,0|2,0,0]=4 544 B11R1.19 CC1=CN=C(C(F)(F)F)C=N1 0589AQ [0,2,0,0,0,0|1,0,0]=3 545 B11R1.19 CC1=NC=C(C(F)(F)F)C=C1 X3274 [0,2,0,0,0,0|2,0,0]=4 546 B11R1.21 CC(=O)C1=CN=C(C)C(C)=N1 7817AB [0,2,0,0,0,0|0,0,1]=3 547 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [0,2,0,0,0,0|2,0,0]=4 548 B11R1.21 CC1=C(C)N=C(C(N)=O)C=N1 4144AB [0,2,0,0,0,0|1,0,1]=4 549 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [0,2,0,0,0,0|2,0,0]=4 550 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [0,2,0,0,0,0|2,0,0]=4 551 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 Z5384 [0,2,0,0,0,0|1,0,1]=4 552 B11R1.166 CC1=NC(Cl)=C(C(C)C)C=N1 7391AC [0,2,0,0,0,0|2,0,0]=4 553 B11R1.166 CN(C)C1=NC=C(Br)N=C1Br W8724 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.37 C=CC1=CC(C)=CN=C1OC 2595AD [0,2,0,0,0,0|2,0,0]=4 555 B11R1.37 CC1=NC(C#N)=C(C#N)N=C1 4860AE [0,2,0,0,0,0|1,0,1]=4 556 B11R1.37 COC1=C(OC)N=C(C)C=C1 0928AF [0,2,0,0,0,0|2,0,0]=4 557 B11R1.277 CC1=NC(C)=C(C)N=C1C=O 9745AA [0,2,0,0,0,0|1,0,1]=4 558 B11R1.277 NC1=NC(Cl)=C(Cl)N=C1CO W9722 [0,2,0,0,0,0|2,0,0]=4 559 B11R1.280 COC1=NC(C=O)=C(C)C=C1 4488AA [0,2,0,0,0,0|2,0,0]=4 560 B11R2.34 BrC1=CC=C(C2CC2)N=C1 8560AB [0,1,0,1,0,0|2,0,0]=4 561 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Y3582 [0,1,0,1,0,0|2,0,0]=4 562 B11R2.36 CC1=CC=C2CCNC2=C1 3598AJ [0,1,0,1,0,0|2,0,0]=4 563 B11R2.36 CC1=NC=C2CSCC2=N1 U689 [0,1,0,1,0,0|2,0,0]=4 564 B11R2.36 ClC1=CC2=C(C=N1)CCN2 1608AB [0,1,0,1,0,0|2,0,0]=4 565 B7R1.1 BrCC1=CN=CS1 Y7777 [1,0,0,0,1,0|2,0,0]=4 566 B7R1.1 BrCC1=COC=N1 1429AA [1,0,0,0,1,0|2,0,0]=4 567 B7R1.1 BrCC1=NC=CN1 1423AC [1,0,0,0,1,0|1,0,1]=4 568 B7R1.1 CCC1=CC=NO1 3273AB [1,0,0,0,1,0|1,0,0]=3 569 B7R1.1 CCC1=CNC=N1 6226AL [1,0,0,0,1,0|0,0,1]=3 570 B7R1.1 CCC1=CNN=C1 5501AD [1,0,0,0,1,0|1,0,0]=3 571 B7R1.1 CCC1=NN=CO1 5828AA [1,0,0,0,1,0|2,0,0]=4 572 B7R1.1 CCC1=NNC=C1 6654AA [1,0,0,0,1,0|1,0,0]=3 573 B7R1.1 CNC1=NC=CO1 6947AC [1,0,0,0,1,0|2,0,0]=4 574 B7R1.1 COC1=CC=CO1 2109AL [1,0,0,0,1,0|2,0,0]=4 575 B7R1.1 CSC1=CNC=N1 X6327 [1,0,0,0,1,0|1,0,1]=4 576 B7R1.1 CSC1=NC=CO1 6777AD [1,0,0,0,1,0|2,0,0]=4 577 B7R1.1 ClCC1=CN=CO1 8892AA [1,0,0,0,1,0|2,0,0]=4 578 B7R1.1 ClCC1=COC=N1 0393AC [1,0,0,0,1,0|2,0,0]=4 579 B7R1.1 ClCC1=NC=CS1 1126AC [1,0,0,0,1,0|2,0,0]=4 580 B7R1.1 ClCC1=NC=CS1 W5535 [1,0,0,0,1,0|2,0,0]=4 581 B7R1.1 NCC1=CC=CN1 W7617 [1,0,0,0,1,0|1,0,1]=4 582 B7R1.1 NCC1=CC=NN1 4193AH [1,0,0,0,1,0|2,0,0]=4 583 B7R1.1 NCC1=COC=C1 Y7389 [1,0,0,0,1,0|2,0,0]=4 584 B7R1.1 NCC1=COC=C1 Y9148 [1,0,0,0,1,0|2,0,0]=4 585 B7R1.1 NCC1=COC=N1 Y1477 [1,0,0,0,1,0|2,0,0]=4 586 B7R1.1 NCC1=CON=C1 3103AA [1,0,0,0,1,0|2,0,0]=4 587 B7R1.1 NCC1=CON=C1 8976AA [1,0,0,0,1,0|2,0,0]=4 588 B7R1.1 NCC1=CSC=C1 Z3907 [1,0,0,0,1,0|2,0,0]=4 589 B7R1.1 NCC1=CSC=N1 0159AD [1,0,0,0,1,0|2,0,0]=4 590 B7R1.1 NCC1=NC=CN1 1371AB [1,0,0,0,1,0|1,0,1]=4 591 B7R1.1 NCC1=NC=CO1 0960AA [1,0,0,0,1,0|2,0,0]=4 592 B7R1.1 NCC1=NC=NN1 1729AJ [1,0,0,0,1,0|2,0,0]=4 593 B7R1.1 NCC1=NC=NN1 8323AH [1,0,0,0,1,0|2,0,0]=4 594 B7R1.1 NCC1=NOC=N1 1799AE [1,0,0,0,1,0|2,0,0]=4 595 B7R1.1 OCC1=CC=NO1 6850AC [1,0,0,0,1,0|2,0,0]=4 596 B7R1.1 OCC1=NNC=C1 X6393 [1,0,0,0,1,0|2,0,0]=4 597 B7R1.1 OCN1C=CN=C1 9540AF [1,0,0,0,1,0|2,0,0]=4 598 B7R1.2 CC1=CC(N)=CS1 Z4474 [1,0,0,0,1,0|2,0,0]=4 599 B7R1.2 CC1=CN=C(N)N1 0439AC [1,0,0,0,1,0|1,0,1]=4 600 B7R1.2 CC1=CN=C(N)N1 3105AA [1,0,0,0,1,0|1,0,1]=4 601 B7R1.2 CC1=CN=C(N)N1 X7979 [1,0,0,0,1,0|1,0,1]=4 602 B7R1.2 CC1=COC(C)=N1 5323AL [1,0,0,0,1,0|1,0,0]=3 603 B7R1.2 CC1=CSC(N)=C1 5740AC [1,0,0,0,1,0|2,0,0]=4 604 B7R1.2 CC1=NC(Br)=CN1 W3545 [1,0,0,0,1,0|1,0,1]=4 605 B7R1.2 CC1=NC(Br)=NN1 8783AD [1,0,0,0,1,0|2,0,0]=4 606 B7R1.2 CC1=NC(Cl)=NN1 4748AD [1,0,0,0,1,0|2,0,0]=4 607 B7R1.2 CC1=NC(N)=CS1 7776AC [1,0,0,0,1,0|2,0,0]=4 608 B7R1.2 CC1=NC=C(N)S1 Z5289 [1,0,0,0,1,0|2,0,0]=4 609 B7R1.2 CC1=NN(C)N=C1 8968AB [1,0,0,0,1,0|1,0,0]=3 610 B7R1.2 CC1=NN=C(C)O1 Z4081 [1,0,0,0,1,0|2,0,0]=4 611 B7R1.2 CC1=NNC(Br)=C1 Z4899 [1,0,0,0,1,0|2,0,0]=4 612 B7R1.2 CC1=NOC(N)=N1 1713AE [1,0,0,0,1,0|2,0,0]=4 613 B7R1.2 CC1=NSC(Br)=N1 7937AB [1,0,0,0,1,0|2,0,0]=4 614 B7R1.2 CC1=NSC(N)=C1 1797AB [1,0,0,0,1,0|2,0,0]=4 615 B7R1.2 CC1=NSC(N)=N1 3695AA [1,0,0,0,1,0|2,0,0]=4 616 B7R1.2 CN1C=NC(Cl)=N1 5746AE [1,0,0,0,1,0|2,0,0]=4 617 B7R1.2 CN1C=NC(I)=C1 V8393 [1,0,0,0,1,0|2,0,0]=4 618 B7R1.2 CN1C=NC(N)=C1 W8501 [1,0,0,0,1,0|2,0,0]=4 619 B7R1.2 CN1C=NC(N)=N1 6721AB [1,0,0,0,1,0|2,0,0]=4