0 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,0,0,0,0,0|3,0,1]=4 1 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [0,0,0,0,0,0|2,0,1]=3 2 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [0,0,0,0,0,0|2,0,2]=4 3 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,0,0,0,0,0|2,0,1]=3 4 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,0,0,0,0,0|2,0,1]=3 5 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,0,0,0,0,0|1,0,0]=1 6 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [0,0,0,0,0,0|3,0,1]=4 7 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,0,0,0,0,0|2,0,1]=3 8 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [0,0,0,0,0,0|3,0,1]=4 9 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [0,0,0,0,0,0|3,0,1]=4 10 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,0,0,0,0,0|3,0,1]=4 11 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,0,0,0,0,0|3,0,1]=4 12 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,0,0,0,0,0|2,0,1]=3 13 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [0,0,0,0,0,0|3,0,0]=3 16 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,0,0,0,0,0|3,0,0]=3 17 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [0,0,0,0,0,0|2,0,2]=4 18 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [0,0,0,0,0,0|3,0,1]=4 19 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,0,0,0,0,0|3,0,1]=4 20 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,0,0,0,0,0|3,0,1]=4 21 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,0,0,0,0,0|3,0,1]=4 22 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 A977 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,0,0,0,0,0|2,0,1]=3 24 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 W4184 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,0,0,0,0,0|2,0,2]=4 26 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [0,0,0,0,0,0|2,0,2]=4 27 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.1 C=CCC1=CC=C(C)C=C1 1127AQ [1,0,0,0,0,0|1,0,0]=2 29 B10R1.1 C=CCC1=CC=C(Cl)C=C1 5641AD [1,0,0,0,0,0|2,0,0]=3 30 B10R1.1 C=COC1=CC=C(Br)C=C1 Y3507 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.1 CC1=CC=C(CNN)C=C1 8497AC [1,0,0,0,0,0|2,0,0]=3 32 B10R1.1 CC1=CC=C(N=[N+]=[N-])C=C1 0054AQ [1,0,0,0,0,0|3,0,0]=4 33 B10R1.1 CC1=CC=C(SCCl)C=C1 7374AL [1,0,0,0,0,0|2,0,1]=4 34 B10R1.1 CC1=NC=C(CC#N)C=C1 7400AB [1,0,0,0,0,0|2,0,1]=4 35 B10R1.1 CC1=NC=C(CCO)C=C1 0118AA [1,0,0,0,0,0|1,0,2]=4 36 B10R1.1 CCCC1=CC=C(C)C=C1 4911AL [1,0,0,0,0,0|1,0,1]=3 37 B10R1.1 CCCC1=CC=C(F)C=C1 2755AE [1,0,0,0,0,0|2,0,1]=4 38 B10R1.1 CNCC1=CC=C(N)C=C1 Q169 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.1 COCC1=CC=C(I)C=C1 5525AC [1,0,0,0,0,0|3,0,0]=4 40 B10R1.1 NCCC1=CC=C(Cl)C=C1 1166AJ [1,0,0,0,0,0|2,0,1]=4 41 B10R1.1 NNCC1=CC=C(F)C=C1 0826AC [1,0,0,0,0,0|3,0,0]=4 42 B10R1.1 NOCC1=CC=C(Br)C=C1 5547AB [1,0,0,0,0,0|3,0,0]=4 43 B10R1.1 O=CNC1=CC=C(Br)C=C1 1242AQ [1,0,0,0,0,0|2,0,0]=3 44 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [1,0,0,0,0,0|0,0,1]=2 45 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [1,0,0,0,0,0|1,0,1]=3 46 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [1,0,0,0,0,0|1,0,1]=3 47 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [1,0,0,0,0,0|2,0,1]=4 48 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [1,0,0,0,0,0|2,0,0]=3 49 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [1,0,0,0,0,0|2,0,1]=4 50 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [1,0,0,0,0,0|1,0,1]=3 51 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [1,0,0,0,0,0|2,0,1]=4 52 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [1,0,0,0,0,0|2,0,0]=3 53 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [1,0,0,0,0,0|2,0,0]=3 54 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [1,0,0,0,0,0|3,0,0]=4 55 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [1,0,0,0,0,0|3,0,0]=4 56 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [1,0,0,0,0,0|1,0,1]=3 57 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [1,0,0,0,0,0|2,0,0]=3 58 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [1,0,0,0,0,0|1,0,0]=2 60 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [1,0,0,0,0,0|1,0,0]=2 61 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 3942AL [1,0,0,0,0,0|0,0,3]=4 62 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [1,0,0,0,0,0|1,0,1]=3 65 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [1,0,0,0,0,0|2,0,0]=3 66 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [1,0,0,0,0,0|1,0,1]=3 67 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 7653AF [1,0,0,0,0,0|3,0,0]=4 69 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [1,0,0,0,0,0|3,0,0]=4 70 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [1,0,0,0,0,0|3,0,0]=4 71 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [1,0,0,0,0,0|2,0,1]=4 72 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [1,0,0,0,0,0|2,0,1]=4 73 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [1,0,0,0,0,0|2,0,1]=4 74 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [1,0,0,0,0,0|2,0,1]=4 75 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [1,0,0,0,0,0|2,0,0]=3 76 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [1,0,0,0,0,0|0,0,2]=3 77 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [1,0,0,0,0,0|2,0,1]=4 78 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [1,0,0,0,0,0|2,0,1]=4 79 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [1,0,0,0,0,0|2,0,1]=4 80 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [1,0,0,0,0,0|2,0,1]=4 81 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [1,0,0,0,0,0|2,0,1]=4 82 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 X9190 [0,1,0,0,0,0|1,0,1]=3 83 B12R1.5 COC1=CC=C(C(O)CN)C=C1 5057AH [0,1,0,0,0,0|2,0,1]=4 84 B12R1.5 COC1=CC=C(N(C)C=O)C=C1 6568AL [0,1,0,0,0,0|1,0,0]=2 85 B12R1.5 CSC1=CC=C(C(=O)C=O)C=C1 7517AB [0,1,0,0,0,0|1,0,1]=3 86 B12R1.5 N#CC1=CC=C(C(=O)C=O)C=C1 W4089 [0,1,0,0,0,0|1,0,2]=4 87 B12R1.9 CC(C)(CN)C1=CC=C(Cl)C=C1 Z6247 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.12 O=CC(C=O)C1=CC=C(F)C=C1 4244AE [0,1,0,0,0,0|1,0,1]=3 89 B12R1.16 CC1=CC=C([C@H](N)CCO)C=C1 1218AL [0,1,0,0,0,0|1,0,2]=4 90 B12R1.16 O=C\C=C(/Cl)C1=CC=C(Cl)C=C1 V8620 [0,1,0,0,0,0|2,0,1]=4 91 B12R1.20 CC(=O)C(Br)C1=CC=C(O)C=C1 6547AC [0,1,0,0,0,0|2,0,0]=3 92 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 4424AE [0,1,0,0,0,0|2,0,0]=3 93 B12R1.20 CC(C1=CC=C(Br)C=C1)N(C)C 4167AD [0,1,0,0,0,0|3,0,0]=4 94 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 V7421 [0,1,0,0,0,0|2,0,0]=3 95 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 5426AJ [0,1,0,0,0,0|2,0,0]=3 96 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Br)C=C1 3070AC [0,1,0,0,0,0|2,0,0]=3 97 B12R1.20 O=C(O)C(Br)C1=CC=C(Cl)C=C1 Y6551 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.20 O=C(O)C(Br)C1=CC=C(F)C=C1 1179AQ [0,1,0,0,0,0|2,0,0]=3 99 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(Cl)C=C1 Z5112 [0,1,0,0,0,0|2,0,0]=3 100 B12R1.20 O=C([O-])C(O)C1=CC=C(O)C=C1 0691AC [0,1,0,0,0,0|2,0,0]=3 101 B12R1.367 CC1=CC=C(C(N)CO)C=C1C 4968AH [0,1,0,0,0,0|1,0,2]=4 102 B12R1.367 CCC(C)C1=CC(Br)=C(O)C=C1 7213AE [0,1,0,0,0,0|2,0,1]=4 103 B12R1.1703 CC1=CC=C(C(N)CO)C(C)=C1 4966AH [0,1,0,0,0,0|1,0,2]=4 104 B12R1.1703 CCC(N)C1=C(C)C=C(C)C=C1 1957AF [0,1,0,0,0,0|2,0,1]=4 105 B12R2.79 NC1CC1C2=CC=C(Br)C=C2 1156AJ [0,0,0,1,0,0|2,0,1]=4 106 B12R2.290 CC1=CC=C(C2(N)CC2)C=C1 6903AB [0,0,0,1,0,0|2,0,1]=4 107 B12R2.612 CC1=CC2=C(C=C1)C(N)CC2 8637AA [0,0,0,1,0,0|2,0,1]=4 108 B12R2.612 CC1=CC2=C(C=C1)C(O)CC2 3976AB [0,0,0,1,0,0|2,0,1]=4 109 B12R2.612 CN1C=CC2=CC(O)=CC=C21 6291AA [0,0,0,1,0,0|3,0,0]=4 110 B10R1.14 CNC(C)C1=CC=C(C)S1 0044AD [0,0,0,0,1,0|3,0,0]=4 111 B12R1.49 CC(CN)OC1=CC=C(F)C=C1 8141AC [0,0,0,0,0,1|2,0,1]=4 112 B12R1.49 CC1=CC=C(OC(C)CN)C=C1 7330AE [0,0,0,0,0,1|1,0,1]=3 113 B12R1.49 CCC(C)OC1=CC=C(N)C=C1 6254AE [0,0,0,0,0,1|2,0,1]=4 114 B12R1.49 O=CC(Cl)CC1=CC=C(Cl)C=C1 Y6536 [0,0,0,0,0,1|2,0,0]=3 115 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [2,0,0,0,0,0|2,0,0]=4 116 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [2,0,0,0,0,0|0,0,0]=2 118 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [2,0,0,0,0,0|2,0,0]=4 119 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [2,0,0,0,0,0|2,0,0]=4 120 B9R1.1 CCC1=CC=C(S)C=C1 S243 [2,0,0,0,0,0|1,0,0]=3 121 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [2,0,0,0,0,0|2,0,0]=4 122 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.1 CNC1=CC=C(N)C=C1 F921 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.1 CSC1=CC=C(S)C=C1 U208 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [2,0,0,0,0,0|1,0,1]=4 127 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [2,0,0,0,0,0|2,0,0]=4 128 B9R1.8 CNCC1=CC=CC=C1 3855AD [2,0,0,0,0,0|2,0,0]=4 129 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [2,0,0,0,0,0|1,0,1]=4 130 B9R1.8 O=CNC1=NC=CC=C1 1807AL [2,0,0,0,0,0|2,0,0]=4 131 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [2,0,0,0,0,0|1,0,1]=4 133 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [2,0,0,0,0,0|2,0,0]=4 134 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [2,0,0,0,0,0|2,0,0]=4 135 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [2,0,0,0,0,0|2,0,0]=4 136 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [2,0,0,0,0,0|2,0,0]=4 137 B11R1.1 C=CCCC1=CC=C(C)C=C1 6965AD [1,1,0,0,0,0|1,0,0]=3 138 B11R1.1 C=CCOC1=CC=C(N)C=C1 5430AD [1,1,0,0,0,0|2,0,0]=4 139 B11R1.1 CC1=CC=C(CN=[N+]=[N-])C=C1 5559AD [1,1,0,0,0,0|2,0,0]=4 140 B11R1.1 CC1=CC=C(NCCO)C=C1 9296AD [1,1,0,0,0,0|0,0,2]=4 141 B11R1.1 CC1=CC=C(OCCBr)C=C1 V3999 [1,1,0,0,0,0|1,0,1]=4 142 B11R1.1 CC1=CC=C(OCCCl)C=C1 7057AD [1,1,0,0,0,0|1,0,1]=4 143 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [1,1,0,0,0,0|1,0,1]=4 144 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 1755AC [1,1,0,0,0,0|1,0,0]=3 145 B11R1.1 O=CNCC1=CC=C(Cl)C=C1 3648AL [1,1,0,0,0,0|1,0,0]=3 146 B11R1.1 O=C\C=C\C1=CC=C(F)C=C1 0552AQ [1,1,0,0,0,0|1,0,1]=4 147 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [1,1,0,0,0,0|1,0,0]=3 150 B11R1.20 CC1=CC=C(N=C(N)N)C=C1 7745AB [1,1,0,0,0,0|2,0,0]=4 151 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [1,1,0,0,0,0|2,0,0]=4 152 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [1,1,0,0,0,0|1,0,0]=3 153 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 W8749 [1,1,0,0,0,0|1,0,0]=3 154 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 6320AE [1,1,0,0,0,0|2,0,0]=4 155 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [1,1,0,0,0,0|1,0,0]=3 156 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [1,1,0,0,0,0|2,0,0]=4 157 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 4488AD [1,1,0,0,0,0|1,1,0]=4 158 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [1,1,0,0,0,0|2,0,0]=4 159 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [1,1,0,0,0,0|2,0,0]=4 160 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 3963AE [1,1,0,0,0,0|2,0,0]=4 161 B11R1.81 C=CCC1=CC=C(F)C=C1Cl X7339 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.81 CC1=CC=C(CC#N)C(C)=C1 8114AE [1,1,0,0,0,0|1,0,1]=4 163 B11R1.81 O=CNC1=C(Br)C=C(F)C=C1 Y2967 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.83 COC1=CC=C(CNO)C=C1 7133AB [1,1,0,0,0,0|1,0,1]=4 165 B11R1.83 COC1=CC=C(NC=O)C=C1 6567AL [1,1,0,0,0,0|1,0,0]=3 166 B11R1.83 COCC1=CC=C(CO)C=C1 8790AH [1,1,0,0,0,0|2,0,0]=4 167 B11R1.83 COCC1=CC=C(OC)C=C1 W3311 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.83 NCCC1=CC=C(CO)C=C1 9331AH [1,1,0,0,0,0|1,0,1]=4 169 B11R1.192 C=CCC1=CC(Cl)=C(Cl)C=C1 7092AD [1,1,0,0,0,0|2,0,0]=4 170 B11R1.192 C=CCC1=CC=C(O)C(O)=C1 W2121 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.192 O=CCC1=CC=C(Cl)C(Cl)=C1 W9614 [1,1,0,0,0,0|1,0,0]=3 172 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [1,1,0,0,0,0|0,0,1]=3 173 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [1,1,0,0,0,0|1,0,0]=3 174 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [1,1,0,0,0,0|1,0,0]=3 175 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [1,1,0,0,0,0|1,0,0]=3 176 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [1,1,0,0,0,0|1,0,1]=4 177 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 W4398 [1,1,0,0,0,0|1,0,1]=4 178 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [1,1,0,0,0,0|1,0,1]=4 179 B11R1.3 O=[N+]([O-])C1=CC=C(CS)C=C1 0403AQ [1,1,0,0,0,0|2,0,0]=4 180 B11R1.3 [C@@H](C)(N)C1=CC=C(C#N)C=C1 0683AP [1,1,0,0,0,0|1,0,1]=4 181 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [1,1,0,0,0,0|1,0,1]=4 182 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [1,1,0,0,0,0|1,0,1]=4 183 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [1,1,0,0,0,0|1,0,1]=4 184 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [1,1,0,0,0,0|2,0,0]=4 185 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 0487AB [1,1,0,0,0,0|2,0,0]=4 186 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3478AC [1,1,0,0,0,0|2,0,0]=4 187 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3773AA [1,1,0,0,0,0|2,0,0]=4 188 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5422AL [1,1,0,0,0,0|2,0,0]=4 189 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5497AL [1,1,0,0,0,0|2,0,0]=4 190 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X3142 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 0063AQ [1,1,0,0,0,0|2,0,0]=4 192 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 5137AJ [1,1,0,0,0,0|2,0,0]=4 193 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [1,1,0,0,0,0|1,0,1]=4 194 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [1,1,0,0,0,0|1,0,1]=4 195 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [1,1,0,0,0,0|1,0,1]=4 196 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [1,1,0,0,0,0|0,0,1]=3 197 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [1,1,0,0,0,0|0,0,1]=3 198 B11R1.21 CC(C)C1=CC(Br)=C(O)C=C1 6556AD [1,1,0,0,0,0|1,0,1]=4 199 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 7727AC [1,1,0,0,0,0|2,0,0]=4 200 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 V8866 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [1,1,0,0,0,0|1,0,1]=4 202 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [1,1,0,0,0,0|1,0,0]=3 203 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [1,1,0,0,0,0|2,0,0]=4 204 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3798AA [1,1,0,0,0,0|2,0,0]=4 205 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3799AA [1,1,0,0,0,0|2,0,0]=4 206 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [1,1,0,0,0,0|0,0,1]=3 207 B11R1.21 CC1=CC=C(C(F)F)C=C1F 1136AD [1,1,0,0,0,0|2,0,0]=4 208 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [1,1,0,0,0,0|1,0,0]=3 209 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [1,1,0,0,0,0|2,0,0]=4 210 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 1180AL [1,1,0,0,0,0|2,0,0]=4 211 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 4775AA [1,1,0,0,0,0|2,0,0]=4 212 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 X9639 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 W5394 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 7502AA [1,1,0,0,0,0|2,0,0]=4 215 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 2069AA [1,1,0,0,0,0|2,0,0]=4 216 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [1,1,0,0,0,0|0,0,1]=3 219 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [1,1,0,0,0,0|1,0,1]=4 220 B11R1.166 CC(=O)C1=CC=C(Br)C=C1N X9573 [1,1,0,0,0,0|1,0,1]=4 221 B11R1.166 CC1=CC(N)=C(N(C)C)C=C1 6144AD [1,1,0,0,0,0|1,0,1]=4 222 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 1178AL [1,1,0,0,0,0|2,0,0]=4 223 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 2379AC [1,1,0,0,0,0|2,0,0]=4 224 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8708 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8720 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.7 C=C[Si](C)(Cl)C1=CC=CC=C1 0115AQ [1,1,0,0,0,0|1,1,0]=4 227 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 3361AA [1,1,0,0,0,0|1,0,1]=4 228 B11R1.7 CC(C)(CN)C1=CC=CC=C1 0879AB [1,1,0,0,0,0|1,0,1]=4 229 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [1,1,0,0,0,0|0,0,2]=4 230 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [1,1,0,0,0,0|1,0,1]=4 231 B11R1.12 CCC(CN)C1=CC=CC=C1 V4239 [1,1,0,0,0,0|1,0,1]=4 232 B11R1.12 CCC(NC)C1=CC=CC=C1 8595AL [1,1,0,0,0,0|1,0,1]=4 233 B11R1.12 CCC(NN)C1=CC=CC=C1 8342AH [1,1,0,0,0,0|2,0,0]=4 234 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 3045AC [1,1,0,0,0,0|0,0,2]=4 235 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 7034AA [1,1,0,0,0,0|0,0,2]=4 236 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 1033AL [1,1,0,0,0,0|2,0,0]=4 237 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [1,1,0,0,0,0|1,0,1]=4 238 B11R1.16 CC(N=C=O)C1=CC=CC=C1 6171AD [1,1,0,0,0,0|0,0,1]=3 239 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [1,1,0,0,0,0|1,0,1]=4 240 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [1,1,0,0,0,0|1,0,1]=4 241 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [1,1,0,0,0,0|1,0,1]=4 242 B11R1.23 O=CC(=O)C1=CC=CC(Br)=C1 X8794 [1,1,0,0,0,0|1,0,1]=4 243 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [1,1,0,0,0,0|1,0,0]=3 244 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 Y1505 [1,1,0,0,0,0|1,0,0]=3 245 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [1,1,0,0,0,0|1,0,0]=3 246 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 Z5933 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [1,1,0,0,0,0|1,0,0]=3 248 B11R1.314 CC1=CC=C(C(N)C(=O)O)S1 4881AC [0,1,0,0,1,0|2,0,0]=4 249 B13R1.5 COC1=CC=C(OC(C)CN)C=C1 5943AC [0,1,0,0,0,1|1,0,1]=4 250 B13R1.133 CC(CC1=CC=C(Br)C=C1)C(=O)O Y5507 [0,1,0,0,0,1|1,0,0]=3 251 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O 0111AE [0,1,0,0,0,1|1,0,0]=3 252 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O X6269 [0,1,0,0,0,1|1,0,0]=3 253 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)O 8891AE [0,1,0,0,0,1|1,0,0]=3 254 B13R1.133 CC1=CC=C(OC(C)C(=O)O)C=C1 7688AD [0,1,0,0,0,1|0,0,0]=2 255 B13R1.133 CC1=CC=C(\C=C(\C)[N+](=O)[O-])C=C1 X6155 [0,1,0,0,0,1|1,0,1]=4 256 B13R1.133 C[C@H](OC1=CC=C(O)C=C1)C(=O)O V2122 [0,1,0,0,0,1|1,0,0]=3 257 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 5562AH [0,1,0,0,0,1|2,0,0]=4 258 B13R1.133 O=C(O)C(F)CC1=CC=C(O)C=C1 7683AB [0,1,0,0,0,1|2,0,0]=4 259 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(O)C=C1 1582AB [0,1,0,0,0,1|2,0,0]=4 260 B13R1.145 COC(CC1=CC=C(C)C=C1)OC 0502AQ [0,1,0,0,0,1|2,0,0]=4 261 B13R1.145 O=CC(C=O)OC1=CC=C(Cl)C=C1 0572AF [0,1,0,0,0,1|1,0,1]=4 262 B13R1.249 CC(C)(C=O)SC1=CC=C(Cl)C=C1 5707AE [0,1,0,0,0,1|1,0,0]=3 263 B13R1.2879 CC1=C(C)C=C(OC(C)CN)C=C1 8125AC [0,1,0,0,0,1|1,0,1]=4 264 B13R1.36 COC1=CC=C(C(N)C(=O)O)C=C1 6236AA [0,2,0,0,0,0|1,0,0]=3 265 B13R1.36 COC1=CC=C(C(O)C(=O)O)C=C1 X3138 [0,2,0,0,0,0|1,0,0]=3 266 B13R1.36 COC1=CC=C([C@@H](N)C(=O)O)C=C1 1870AB [0,2,0,0,0,0|1,0,0]=3 267 B13R1.36 CSC1=CC=C(C(N)C(=O)O)C=C1 V7512 [0,2,0,0,0,0|1,0,0]=3 268 B13R1.139 CCOC1=CC=C(C(=O)C=O)C=C1 3202AA [0,2,0,0,0,0|1,0,1]=4 269 B13R1.139 CCOC1=CC=C(C(C)NC)C=C1 V9168 [0,2,0,0,0,0|2,0,0]=4 270 B13R1.187 CC(C)(C#N)C1=CC=C(CBr)C=C1 3491AA [0,2,0,0,0,0|1,0,1]=4 271 B13R1.187 COC1=CC=C(C(C)(C)CN)C=C1 V6337 [0,2,0,0,0,0|1,0,1]=4 272 B13R1.537 CCC(C)C1=CC=C(C(C)=O)C=C1 9413AE [0,2,0,0,0,0|1,0,1]=4 273 B13R1.537 CCC(C)C1=CC=C(C(C)N)C=C1 6520AE [0,2,0,0,0,0|1,0,1]=4 274 B13R1.522 CC(C)(C(=O)O)C1=CC=C(F)C=C1 3686AF [0,2,0,0,0,0|1,0,0]=3 275 B13R1.522 CC(C)(C(=O)O)C1=CC=C(N)C=C1 1128AJ [0,2,0,0,0,0|1,0,0]=3 276 B13R1.522 CC(O)(C(=O)O)C1=CC=C(O)C=C1 V0013 [0,2,0,0,0,0|1,0,0]=3 277 B13R1.706 CC(=O)C(C#N)C1=CC=C(Br)C=C1 V6918 [0,2,0,0,0,0|1,0,1]=4 278 B13R1.706 CC(=O)C(C#N)C1=CC=C(Cl)C=C1 7333AB [0,2,0,0,0,0|1,0,1]=4 279 B13R1.706 CC(=O)C(C#N)C1=CC=C(F)C=C1 B837 [0,2,0,0,0,0|1,0,1]=4 280 B13R1.706 CC1=CC=C(C(CN)N(C)C)C=C1 2122AF [0,2,0,0,0,0|1,0,1]=4 281 B13R1.706 CC1=CC=C([C@H](CN)C(=O)O)C=C1 W6457 [0,2,0,0,0,0|0,0,0]=2 282 B13R1.706 CCC(C(=O)O)C1=CC=C(Br)C=C1 4665AF [0,2,0,0,0,0|1,0,0]=3 283 B13R1.706 CCC(C(=O)O)C1=CC=C(N)C=C1 3036AB [0,2,0,0,0,0|1,0,0]=3 284 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 2650AE [0,2,0,0,0,0|1,0,1]=4 285 B13R1.132 CC(=O)N[C@@H](C)C1=NC=C(F)C=C1 Y6480 [0,2,0,0,0,0|2,0,0]=4 286 B13R1.132 NC(=O)CC(N)C1=CC=C(F)C=C1 9513AE [0,2,0,0,0,0|2,0,0]=4 287 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(O)C=C1 7665AA [0,2,0,0,0,0|2,0,0]=4 288 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 X9801 [0,2,0,0,0,0|2,0,0]=4 289 B13R1.163 NC(C(=O)O)C1=C(F)C=C(Br)C=C1 5425AJ [0,2,0,0,0,0|2,0,0]=4 290 B13R1.163 O=C(O)C(O)C1=CC=C(F)C=C1F F064 [0,2,0,0,0,0|2,0,0]=4 291 B13R1.510 CC(=O)N(C)C1=CC(Cl)=C(Cl)C=C1 5374AB [0,2,0,0,0,0|2,0,0]=4 292 B13R1.510 NC(C(=O)O)C1=CC=C(Cl)C(Cl)=C1 5415AJ [0,2,0,0,0,0|2,0,0]=4 293 B13R1.510 NC(C(=O)O)C1=CC=C(F)C(F)=C1 7710AD [0,2,0,0,0,0|2,0,0]=4 294 B13R1.4656 CC1=CC(C)=C(C(=O)C=O)C(C)=C1 W3109 [0,2,0,0,0,0|1,0,1]=4 295 B11R2.36 CC1=CC2=C(C=C1)N=CS2 8274AJ [1,0,0,1,0,0|1,1,0]=4 296 B11R2.36 CC1=CC2=C(C=C1)SC=N2 2988AB [1,0,0,1,0,0|2,0,0]=4 297 B11R2.36 CC1=CC=C2CCNC2=C1 3598AJ [1,0,0,1,0,0|1,0,1]=4 298 B11R2.36 ClC1=CC=C2CC=CC2=C1 5224AB [1,0,0,1,0,0|2,0,0]=4 299 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [1,0,0,1,0,0|1,0,1]=4 300 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [1,0,0,1,0,0|1,0,1]=4 301 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [1,0,0,1,0,0|1,0,1]=4 302 B13R2.43 CC1=CC2=C(C=C1)NC(C=O)=N2 3264AJ [0,0,0,1,0,1|1,0,1]=4 303 B13R2.43 CC1=CC2=C(C=C1)SC(C=O)=C2 8888AD [0,0,0,1,0,1|0,0,2]=4 304 B13R2.43 CC1=CC=C2NC(C=O)=NC2=C1 0537AD [0,0,0,1,0,1|1,0,1]=4 305 B13R2.3028 CC1CC2=C(C=C(Br)C=C2)C1=O V3829 [0,0,0,1,0,1|1,0,0]=3 306 B13R2.3028 CN1CC2=C(C=C(N)C=C2)C1=O 8222AE [0,0,0,1,0,1|2,0,0]=4 307 B13R2.2130 CN1C=CC2=C1C=CC(CN)=C2 Y4487 [0,1,0,1,0,0|2,0,0]=4 308 B13R2.2130 COC1=CC2=C(C=C1)N(C)C=C2 V4681 [0,1,0,1,0,0|2,0,0]=4 309 B13R2.102 CC1=CC=C(C2(CN)CC2)C=C1 9522AE [0,1,0,1,0,0|1,0,1]=4 310 B13R2.12 CC1=CC=C(C2NCCS2)C=C1 7863AE [0,1,0,1,0,0|2,0,0]=4 311 B13R2.5179 CC1=CC2=CC=CC(C)=C2C=C1 5914AE [0,1,0,1,0,0|1,0,1]=4 312 B13R2.5190 CC1=CC2=C(C=C1)N(C)C(N)=N2 5022AJ [0,1,0,1,0,0|2,0,0]=4 313 B13R2.5190 CN1C(=O)CC2=C1C=CC(Br)=C2 Y8209 [0,1,0,1,0,0|2,0,0]=4 314 B13R2.5190 CN1C(=O)CC2=C1C=CC(N)=C2 Y8210 [0,1,0,1,0,0|2,0,0]=4 315 B13R2.5190 CN1C(=O)OC2=CC(N)=CC=C21 4705AF [0,1,0,1,0,0|2,0,0]=4 316 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y7506 [1,0,0,0,0,1|2,0,0]=4 317 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [1,0,0,0,0,1|1,0,1]=4 318 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [1,0,0,0,0,1|1,0,1]=4 319 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [1,0,0,0,0,1|1,0,1]=4 320 B13R1.14 CCC(C)NCC1=CC=C(C)C=C1 8083AC [0,0,0,0,0,2|1,0,1]=4