0 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 2271AJ [0,0,0,0,0,0|2,0,1]=3 1 B12R1.56 CC(=O)C1=CC(C#N)=C(N)C=C1 3962AB [0,0,0,0,0,0|4,0,0]=4 2 B12R1.56 CC1=C(C=O)C=C(C(=O)O)C=C1 5888AJ [0,0,0,0,0,0|3,0,0]=3 3 B12R1.56 CC1=CC=C(C(=O)O)C=C1NN V6890 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.56 COC1=C(Br)C=CC(B(O)O)=C1 X1809 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.56 COC1=CC(=C(N)N)C=CC1=O 8532AC [0,0,0,0,0,0|2,0,1]=3 6 B12R1.56 COC1=CC(B(O)O)=CN=C1F Z1344 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.56 COC1=CC(C(N)=O)=CC=C1Br V3839 [0,0,0,0,0,0|2,0,0]=2 8 B12R1.56 COC1=CC([C@@H](C)N)=CC=C1F X9126 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.56 COC1=CC([C@@H](C)N)=CC=C1F X9637 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1[O-] X4407 [0,0,0,0,0,0|1,0,2]=3 11 B12R1.56 N#CC1=CC([N+](=O)[O-])=CC=C1O 5245AB [0,0,0,0,0,0|3,0,1]=4 12 B12R1.56 O=CC1=C(O)C=CC(C(=O)O)=C1 1099AQ [0,0,0,0,0,0|2,0,0]=2 13 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [1,0,0,0,0,0|2,0,0]=3 15 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [1,0,0,0,0,0|3,0,0]=4 16 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [1,0,0,0,0,0|3,0,0]=4 17 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [1,0,0,0,0,0|2,1,0]=4 19 B11R1.21 CC1=C(Cl)N=CC(C(N)=O)=C1 7444AE [1,0,0,0,0,0|3,0,0]=4 20 B11R1.21 CC1=CC(C(=O)O)=CNC1=O 0272AC [1,0,0,0,0,0|1,0,1]=3 21 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [1,0,0,0,0,0|3,0,0]=4 22 B11R1.21 CC1=CC=C(C(=O)O)N=C1C 2856AC [1,0,0,0,0,0|2,0,0]=3 23 B11R1.21 CC1=CC=C(C(=O)O)NC1=O 2494AA [1,0,0,0,0,0|2,0,1]=4 24 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br Y3916 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.21 NC(=O)C1=CC(N)=C(F)C=C1 6127AC [1,0,0,0,0,0|3,0,0]=4 26 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [1,0,0,0,0,0|1,0,0]=2 27 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 Z8676 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 V7781 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [1,0,0,0,0,0|3,0,0]=4 30 B11R1.21 NC(=O)C1=CC=C(N)C(N)=C1 8382AE [1,0,0,0,0,0|3,0,0]=4 31 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 5309AE [1,0,0,0,0,0|3,0,0]=4 32 B11R1.21 NC1=CC(C(=O)O)=CC=C1F V5597 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.21 NC1=CC(C(=O)O)=CC=C1O D461 [1,0,0,0,0,0|1,0,0]=2 34 B11R1.21 O=C(O)C1=CC(=O)C(O)=CO1 0899AQ [1,0,0,0,0,0|1,0,1]=3 35 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 X3304 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.21 O=C(O)C1=CC(Cl)=C(F)N=C1 4922AB [1,0,0,0,0,0|3,0,0]=4 37 B11R1.21 O=C(O)C1=CC(F)=C(F)N=C1 Y4245 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 1126AD [1,0,0,0,0,0|3,0,0]=4 39 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 X6546 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 Y6596 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 Y4247 [1,0,0,0,0,0|3,0,0]=4 42 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 1343AA [1,0,0,0,0,0|3,0,0]=4 43 B11R1.21 O=C([O-])C1=CC=C(F)C(F)=C1 3820AL [1,0,0,0,0,0|2,0,1]=4 44 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 6794AA [1,0,0,0,0,0|2,0,1]=4 45 B11R1.266 C#CC1=CC=CC(C(N)=O)=C1 8729AB [1,0,0,0,0,0|2,0,1]=4 46 B11R1.266 CC(=O)C1=CC=CC(CCl)=C1 W6202 [1,0,0,0,0,0|3,0,0]=4 47 B11R1.266 CCC1=CC(C(C)=O)=CC=C1 1395AB [1,0,0,0,0,0|2,0,0]=3 48 B11R1.266 CCC1=CC=CC(C(N)=O)=N1 2254AC [1,0,0,0,0,0|3,0,0]=4 49 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 6504AB [1,0,0,0,0,0|2,0,0]=3 50 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 0646AE [1,0,0,0,0,0|2,0,0]=3 51 B11R1.266 CNC1=NC=CC(C(=O)O)=C1 3929AC [1,0,0,0,0,0|2,0,0]=3 52 B11R1.266 COC1=CC([N+](=O)[O-])=CN=C1 5408AA [1,0,0,0,0,0|2,0,1]=4 53 B11R1.266 COC1=CC=CC(B(O)O)=N1 X0754 [1,0,0,0,0,0|2,0,1]=4 54 B11R1.266 COC1=CC=CC([N+](=O)[O-])=C1 F824 [1,0,0,0,0,0|1,0,1]=3 55 B11R1.266 COC1=CN=CC(C(C)=O)=C1 X7999 [1,0,0,0,0,0|2,0,0]=3 56 B11R1.266 COC1=NC=CC(C(N)=O)=C1 Z6815 [1,0,0,0,0,0|2,0,0]=3 57 B11R1.266 COC1=NC=CC(C(N)=S)=C1 3499AF [1,0,0,0,0,0|2,1,0]=4 58 B11R1.266 N#CC1=CC(C(=O)O)=CN=C1 4593AC [1,0,0,0,0,0|3,0,0]=4 59 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 Z5234 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.266 NNC1=CC=CC(C(=O)O)=N1 4602AC [1,0,0,0,0,0|3,0,0]=4 61 B11R1.266 NNC1=NC=CC(C(=O)O)=C1 4603AC [1,0,0,0,0,0|3,0,0]=4 62 B11R1.266 O=C(Br)C1=CC=CC(CBr)=C1 7128AD [1,0,0,0,0,0|3,0,0]=4 63 B11R1.280 COC1=CC(CO)=CC=C1Br Z0261 [1,0,0,0,0,0|1,0,1]=3 64 B11R1.280 COC1=CC(OC)=C(S)C=C1 6358AD [1,0,0,0,0,0|2,1,0]=4 65 B11R1.280 N#CC1=C(Br)C=CC(C=O)=C1 4410AA [1,0,0,0,0,0|3,0,0]=4 66 B11R1.280 N#CC1=CC(C=O)=CC=C1N 7768AD [1,0,0,0,0,0|3,0,0]=4 67 B13R1.13 CC(C)C1=C(O)C=CC([N+](=O)[O-])=C1 9023AB [0,1,0,0,0,0|2,0,1]=4 68 B13R1.49 CNC(=O)C1=CC=C(Br)C(OC)=C1 Z6944 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.49 COC(=O)C1=CC(C=O)=C(N)C=C1 2929AC [0,1,0,0,0,0|3,0,0]=4 70 B13R1.49 COC(=O)C1=CC=C(Br)C(OC)=C1 W3727 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.49 COC(=O)C1=CC=C(F)C(C=O)=C1 X8918 [0,1,0,0,0,0|3,0,0]=4 72 B13R1.49 COC1=CC(C(=O)CBr)=CC=C1O 8316AE [0,1,0,0,0,0|1,0,0]=2 73 B13R1.298 COC1=C(Cl)C(Br)=CC([N+](=O)[O-])=C1 Y5926 [0,1,0,0,0,0|2,0,1]=4 74 B13R1.298 COC1=C(F)C(Cl)=CC(B(O)O)=C1 V2790 [0,1,0,0,0,0|2,0,1]=4 75 B13R1.298 COC1=C(F)C(F)=CC(B(O)O)=C1 V9185 [0,1,0,0,0,0|2,0,1]=4 76 B13R1.298 COC1=C(O)C(Cl)=CC(B(O)O)=C1 V9152 [0,1,0,0,0,0|1,0,1]=3 77 B13R1.354 CCCC1=CC(C(=O)O)=CC=C1F W6334 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.354 CCOC1=C(O)C=CC(C(=O)O)=C1 5314AE [0,1,0,0,0,0|0,0,0]=1 79 B13R1.354 CCOC1=CC(B(O)O)=CC=C1C Z1431 [0,1,0,0,0,0|2,0,1]=4 80 B13R1.354 CCOC1=CC([N+](=O)[O-])=CC=C1F Z7261 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.651 COC1=C(Br)C=C(Br)C(B(O)O)=C1 V8833 [0,1,0,0,0,0|2,0,1]=4 82 B13R1.651 COC1=C(Br)C=C(Cl)C(B(O)O)=C1 X2390 [0,1,0,0,0,0|2,0,1]=4 83 B13R1.651 COC1=C(C)C=C(F)C(C(=O)O)=C1 Z1818 [0,1,0,0,0,0|1,0,0]=2 84 B13R1.651 COC1=C(Cl)C=C(Cl)C(B(O)O)=C1 X0800 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.651 COC1=C(F)C=C(F)C(B(O)O)=C1 V2978 [0,1,0,0,0,0|2,0,1]=4 86 B13R1.651 COC1=C(F)C=C(N)C(C(=O)O)=C1 V7049 [0,1,0,0,0,0|1,0,0]=2 87 B13R1.651 COC1=CC([N+](=O)[O-])=C(C)C=C1Cl Z4959 [0,1,0,0,0,0|2,0,1]=4 88 B13R1.651 COC1=CC([N+](=O)[O-])=C(F)C=C1F 5985AD [0,1,0,0,0,0|2,0,1]=4 89 B13R1.651 COC1=CC([N+](=O)[O-])=C(N)C=C1C 8141AB [0,1,0,0,0,0|2,0,1]=4 90 B13R1.651 COC1=CC([N+](=O)[O-])=C(N)C=C1Cl 5099AD [0,1,0,0,0,0|2,0,1]=4 91 B13R1.3091 COC1=C(OC)C=C(C(C)O)C=C1 4922AJ [0,1,0,0,0,0|1,0,1]=3 92 B13R1.3091 COC1=CC(C(=O)O)=CC=C1CBr 2516AJ [0,1,0,0,0,0|1,0,0]=2 93 B13R1.3091 COC1=CC(C(=O)O)=CN=C1OC V7667 [0,1,0,0,0,0|1,0,0]=2 94 B13R1.3091 COC1=CC=C(C(=N)N)C=C1OC 2087AJ [0,1,0,0,0,0|2,0,0]=3 95 B13R1.3091 COC1=CC=C(C(C)=O)N=C1OC 0878AD [0,1,0,0,0,0|2,0,0]=3 96 B13R1.3230 COC1=C(Cl)C(B(O)O)=CC=C1Cl V9426 [0,1,0,0,0,0|2,0,1]=4 97 B13R1.3230 COC1=C(F)C(B(O)O)=CC=C1Br V9423 [0,1,0,0,0,0|2,0,1]=4 98 B13R1.3230 COC1=C(F)C(B(O)O)=CC=C1F Z0578 [0,1,0,0,0,0|2,0,1]=4 99 B13R2.430 CC(N)C1=CC=C2OCOC2=C1 1241AD [0,0,0,1,0,0|2,0,1]=4 100 B13R2.430 C[C@@H](N)C1=CC2=C(C=C1)OCO2 8347AH [0,0,0,1,0,0|2,0,1]=4 101 B13R2.430 C[C@H](N)C1=CC2=C(C=C1)OCO2 8391AH [0,0,0,1,0,0|2,0,1]=4 102 B13R2.430 N=C(N)C1=CC2=C(C=C1)OCO2 9614AH [0,0,0,1,0,0|2,0,0]=3 103 B13R2.430 N=C(N)C1=CC=C2OCOC2=C1 6155AH [0,0,0,1,0,0|2,0,0]=3 104 B13R2.430 NC(=O)C1=CC=C2OCOC2=C1 Y9199 [0,0,0,1,0,0|1,0,0]=2 105 B13R2.430 O=C(O)C1=CC2=C(C=C1)CNC2 1358AJ [0,0,0,1,0,0|3,0,0]=4 106 B13R2.430 O=C(O)C1=CC2=C(C=C1)CNC2 V3422 [0,0,0,1,0,0|3,0,0]=4 107 B13R2.430 O=C(O)C1=CC2=C(C=N1)OC=C2 W6445 [0,0,0,1,0,0|2,0,1]=4 108 B13R2.430 O=C(O)C1=CC=C2CCOC2=C1 Z4578 [0,0,0,1,0,0|1,0,0]=2 109 B13R2.430 O=C(O)C1=CC=C2NC=NC2=C1 Z7733 [0,0,0,1,0,0|2,0,1]=4 110 B13R2.430 O=C(O)C1=CN=C2C=COC2=C1 Z8614 [0,0,0,1,0,0|2,0,1]=4 111 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 2729AE [0,0,0,0,1,0|3,0,0]=4 112 B11R1.48 CCC1=C(C)C=C(C(=O)O)S1 5555AB [0,0,0,0,1,0|3,0,0]=4 113 B11R1.64 CCC1=C(C)SC=C1C(=O)O 1763AF [0,0,0,0,1,0|3,0,0]=4 114 B13R1.52 N#CC1=CC(CC(=O)O)=CC=C1F 7283AB [0,0,0,0,0,1|3,0,0]=4 115 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [2,0,0,0,0,0|2,0,0]=4 116 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [2,0,0,0,0,0|1,0,1]=4 117 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [2,0,0,0,0,0|2,0,0]=4 118 B10R1.13 O=C(O)C1=CN=C(O)N=C1 W5910 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [2,0,0,0,0,0|2,0,0]=4 120 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [2,0,0,0,0,0|2,0,0]=4 121 B10R1.113 CC1=CC(C(=N)N)=CC=C1 2354AJ [2,0,0,0,0,0|2,0,0]=4 122 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [2,0,0,0,0,0|2,0,0]=4 123 B10R1.113 CC1=NC(C(=O)O)=NC=C1 Z5358 [2,0,0,0,0,0|2,0,0]=4 124 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 7814AH [2,0,0,0,0,0|1,0,0]=3 125 B10R1.113 O=C(O)C1=CN=CC(I)=C1 Z4205 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.113 O=C([O-])C1=CC(O)=CC=C1 8975AL [2,0,0,0,0,0|0,0,1]=3 128 B10R1.176 CC1=C(O)C=CC(CO)=C1 9583AA [2,0,0,0,0,0|0,0,1]=3 129 B10R1.176 CC1=C(O)C=CC(CO)=N1 6598AB [2,0,0,0,0,0|1,0,1]=4 130 B10R1.176 CC1=CC(C=O)=CN=C1Br Z0993 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.176 CC1=CC(CO)=CC=C1N 2117AF [2,0,0,0,0,0|1,0,1]=4 132 B10R1.176 CC1=CC=C(C=O)C=C1O Z0696 [2,0,0,0,0,0|1,0,0]=3 133 B10R1.176 CC1=NC(C=O)=CC=C1Br Z0161 [2,0,0,0,0,0|2,0,0]=4 134 B10R1.176 CC1=NC(C=O)=CC=C1F 4137AC [2,0,0,0,0,0|2,0,0]=4 135 B10R1.176 O=CC1=CC=C(F)C(I)=C1 W4645 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.176 O=CC1=CC=C(I)C(F)=C1 X8505 [2,0,0,0,0,0|2,0,0]=4 137 B10R1.176 O=CC1=CC=C(O)C(I)=C1 X5653 [2,0,0,0,0,0|1,0,0]=3 138 B10R1.176 OCC1=CC(O)=C(I)C=C1 2103AC [2,0,0,0,0,0|1,0,1]=4 139 B10R1.172 C=CC1=CC=CC(C=O)=C1 0260AB [2,0,0,0,0,0|1,0,1]=4 140 B10R1.172 C=CC1=NC=CC(OC)=C1 3214AB [2,0,0,0,0,0|2,0,0]=4 141 B10R1.172 CNC1=CC=CC(OC)=C1 V4822 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.172 CSC1=CC=CC(C=O)=C1 5233AH [2,0,0,0,0,0|0,1,0]=3 143 B10R1.30 COC1=CC(=O)C=CC1=O 2859AB [2,0,0,0,0,0|0,0,1]=3 144 B10R1.30 COC1=CC(Br)=CN=C1O Z8058 [2,0,0,0,0,0|2,0,0]=4 145 B10R1.30 COC1=CC(F)=CC=C1C Z1199 [2,0,0,0,0,0|2,0,0]=4 146 B10R1.30 COC1=CC(F)=CC=C1F F188 [2,0,0,0,0,0|2,0,0]=4 147 B10R1.30 COC1=CC(F)=CC=C1I Z0604 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.30 COC1=CC(I)=CC=C1N V5279 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.30 COC1=CC(N)=CC=C1F V4508 [2,0,0,0,0,0|2,0,0]=4 150 B12R1.48 CC1=CC(C(=O)O)=CC=C1C=O V4609 [1,1,0,0,0,0|0,0,1]=3 151 B12R1.48 CCC1=C(Br)C=C(C(=O)O)C=C1 6984AC [1,1,0,0,0,0|2,0,0]=4 152 B12R1.48 CCC1=CC=C(C(=O)O)C=C1I 6156AJ [1,1,0,0,0,0|2,0,0]=4 153 B12R1.48 CCC1=CC=C(C(=O)O)C=C1O Q690 [1,1,0,0,0,0|1,0,0]=3 154 B12R1.48 COC1=C(Br)C=C(C(N)=O)C=C1 6775AD [1,1,0,0,0,0|2,0,0]=4 155 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 5479AC [1,1,0,0,0,0|1,0,1]=4 156 B12R1.232 CC(=O)C1=C(C)C=C(C)C(C)=C1 6898AD [1,1,0,0,0,0|2,0,0]=4 157 B12R1.232 CC1=C(C)NC(=O)C(C(=O)O)=C1 7229AB [1,1,0,0,0,0|2,0,0]=4 158 B12R1.232 CC1=C(Cl)C=C(N)C(C(=O)O)=C1 V3515 [1,1,0,0,0,0|1,0,0]=3 159 B12R1.232 CC1=C(I)C=C(C(=O)O)C(O)=C1 Z1826 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.232 CC1=C(N)C=C(C(=O)O)C(Br)=C1 1570AC [1,1,0,0,0,0|2,0,0]=4 161 B12R1.232 CC1=CC(C)=C(I)C=C1C(=O)O 1531AC [1,1,0,0,0,0|2,0,0]=4 162 B12R1.232 CC1=CC(O)=C(C)C=C1C(=O)O 6178AJ [1,1,0,0,0,0|0,0,0]=2 163 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 2878AL [1,1,0,0,0,0|2,0,0]=4 164 B12R1.232 NC1=C(Cl)C=C(O)C(C(=O)O)=C1 V1240 [1,1,0,0,0,0|2,0,0]=4 165 B12R1.232 NC1=C(F)C=C(Cl)C(C(=O)O)=C1 V3771 [1,1,0,0,0,0|2,0,0]=4 166 B12R1.232 NC1=C(F)C=C(F)C(C(=O)O)=C1 V7064 [1,1,0,0,0,0|2,0,0]=4 167 B12R1.232 NC1=CC(Cl)=C(Cl)C=C1C(=O)O W4361 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1Cl 2380AC [1,1,0,0,0,0|2,0,0]=4 169 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1O 8358AA [1,1,0,0,0,0|2,0,0]=4 170 B12R1.232 O=C(O)C1=CC(O)=C(Br)C=C1Br W3127 [1,1,0,0,0,0|1,0,0]=3 171 B12R1.367 CC1=C(Br)C=CC(C(=O)CBr)=C1 3315AB [1,1,0,0,0,0|2,0,0]=4 172 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 4488AE [1,1,0,0,0,0|2,0,0]=4 173 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1C 2008AL [1,1,0,0,0,0|2,0,0]=4 174 B12R1.367 CCC(=O)C1=CC=C(Br)C(C)=C1 V4296 [1,1,0,0,0,0|2,0,0]=4 175 B12R1.367 COC(=O)C1=CC(N)=C(O)N=C1 V4477 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 Z4261 [1,1,0,0,0,0|1,0,0]=3 177 B12R1.367 COC(=O)C1=CN=C(O)C(Cl)=C1 1162AD [1,1,0,0,0,0|2,0,0]=4 178 B12R1.367 COC(=O)C1=NC(C)=C(Br)C=C1 Y3851 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.367 NC[C@@H](O)C1=CC(O)=C(O)C=C1 9726AB [1,1,0,0,0,0|1,0,1]=4 180 B12R1.367 O=C(CCl)C1=CC=C(O)C(Cl)=C1 2324AE [1,1,0,0,0,0|2,0,0]=4 181 B12R1.367 O=C(CO)C1=CC(Cl)=C(Cl)C=C1 9016AC [1,1,0,0,0,0|2,0,0]=4 182 B12R1.893 CC(=O)C1=CC=C(O)C(C)=C1C 7691AB [1,1,0,0,0,0|1,0,0]=3 183 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C 2119AF [1,1,0,0,0,0|2,0,0]=4 184 B12R1.893 CC1=CC=C(C(=O)O)C(I)=C1C 5511AA [1,1,0,0,0,0|1,0,0]=3 185 B12R1.1005 CC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 8744AA [1,1,0,0,0,0|2,0,0]=4 186 B12R1.1005 CC(=O)C1=CC(F)=C(O)C(F)=C1 3797AD [1,1,0,0,0,0|2,0,0]=4 187 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1N Z1761 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.1005 CC1=CC(B(O)O)=CC(C)=C1O Z1125 [1,1,0,0,0,0|1,0,1]=4 189 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Cl Z1063 [1,1,0,0,0,0|1,0,0]=3 190 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1O 6672AB [1,1,0,0,0,0|0,0,0]=2 191 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1N 0906AA [1,1,0,0,0,0|2,0,0]=4 192 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(Cl)=C1O 2864AE [1,1,0,0,0,0|1,0,1]=4 193 B12R1.1005 CC1=CC([N+](=O)[O-])=CC(N)=C1O 9457AB [1,1,0,0,0,0|1,0,1]=4 194 B12R1.1005 NC1=C(I)C=C(C(=O)O)C=C1I 0823AB [1,1,0,0,0,0|2,0,0]=4 195 B12R1.1005 NC1=CC(C(=O)O)=CC(Br)=C1F Z9454 [1,1,0,0,0,0|2,0,0]=4 196 B12R1.1005 NC1=CC(C(=O)O)=CC(Cl)=C1Cl 7049AB [1,1,0,0,0,0|2,0,0]=4 197 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 Y3753 [1,1,0,0,0,0|2,0,0]=4 198 B12R1.1005 O=C(O)C1=CC(F)=C(F)C(Cl)=C1 Z1789 [1,1,0,0,0,0|2,0,0]=4 199 B12R1.1005 O=C(O)C1=CC(I)=C(Br)C(I)=C1 3451AC [1,1,0,0,0,0|2,0,0]=4 200 B12R1.1005 O=C(O)C1=CC(I)=C(I)C(I)=C1 1545AB [1,1,0,0,0,0|2,0,0]=4 201 B12R1.1005 O=C(O)C1=NC(Br)=C(O)C(Br)=C1 V7091 [1,1,0,0,0,0|2,0,0]=4 202 B12R1.11 COC1=CC(B(O)O)=CC(C)=C1 X0963 [1,1,0,0,0,0|1,0,1]=4 203 B12R1.11 COC1=CC(Br)=CC(C(C)=O)=C1 1554AA [1,1,0,0,0,0|1,0,0]=3 204 B12R1.11 COC1=CC(Br)=CC(C(N)=O)=C1 Z7853 [1,1,0,0,0,0|1,0,0]=3 205 B12R1.11 COC1=CC(C(=N)N)=CC(Cl)=C1 1226AD [1,1,0,0,0,0|2,0,0]=4 206 B12R1.11 COC1=CC(C(N)=O)=CC(C)=C1 5032AA [1,1,0,0,0,0|1,0,0]=3 207 B12R1.11 COC1=CC(C)=CC(C(C)=O)=C1 5959AB [1,1,0,0,0,0|1,0,0]=3 208 B12R1.11 COC1=CC([N+](=O)[O-])=CC(F)=C1 V7416 [1,1,0,0,0,0|1,0,1]=4 209 B12R1.11 CSC1=CC(Cl)=CC(C(=O)O)=C1 Z0676 [1,1,0,0,0,0|0,1,0]=3 210 B12R1.11 N#CC1=CC(C(=O)O)=CC(Cl)=C1 3680AB [1,1,0,0,0,0|2,0,0]=4 211 B12R1.11 O=CC1=CC(Cl)=CC(C(=O)O)=C1 5856AJ [1,1,0,0,0,0|2,0,0]=4 212 B12R1.258 CC(=O)C1=CC(C(C)C)=CC=C1 5442AB [1,1,0,0,0,0|2,0,0]=4 213 B12R1.258 CC(C)C1=NC(C(=O)O)=CC=C1 3982AB [1,1,0,0,0,0|2,0,0]=4 214 B12R1.258 CC(N)C1=CC(C(=O)O)=CC=C1 1912AJ [1,1,0,0,0,0|1,0,0]=3 215 B12R1.258 CN(C)C1=CC=CC(C(=O)O)=N1 3343AJ [1,1,0,0,0,0|2,0,0]=4 216 B12R1.279 CCOC1=CC=CC(C(C)=O)=C1 4956AE [1,1,0,0,0,0|1,0,0]=3 217 B12R1.279 COCC1=CC=CC(C(=O)O)=C1 3575AB [1,1,0,0,0,0|0,0,0]=2 218 B12R1.435 CCC1=CC(C(=O)CBr)=CC=C1 2268AJ [1,1,0,0,0,0|2,0,0]=4 219 B12R1.435 CCC1=NC(C(=O)OC)=CC=C1 0924AA [1,1,0,0,0,0|2,0,0]=4 220 B12R1.435 COC(=O)C1=CC(OC)=CN=C1 Z0489 [1,1,0,0,0,0|1,0,0]=3 221 B12R1.435 COC(=O)C1=CC=CC(CCl)=C1 F527 [1,1,0,0,0,0|2,0,0]=4 222 B12R1.435 COC(=O)C1=CN=CC(SC)=C1 7104AJ [1,1,0,0,0,0|1,1,0]=4 223 B12R1.435 COC1=CC(C(=O)C=O)=CC=C1 X9328 [1,1,0,0,0,0|0,0,1]=3 224 B12R1.435 COC1=CC(C(=O)NN)=NC=C1 V3996 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.435 COC1=CC(C(O)CN)=CC=C1 9377AJ [1,1,0,0,0,0|1,0,1]=4 226 B12R1.435 COC1=CC=CC(C(=O)C#N)=C1 4276AH [1,1,0,0,0,0|1,0,0]=3 227 B12R1.435 COC1=CC=CC(C(N)CO)=C1 1466AJ [1,1,0,0,0,0|1,0,1]=4 228 B12R1.435 COC1=CC=CC(C(O)CN)=C1 2592AB [1,1,0,0,0,0|1,0,1]=4 229 B12R1.435 COC1=NC(C(=O)NN)=CC=C1 0798AF [1,1,0,0,0,0|2,0,0]=4 230 B12R1.435 COC1=NC=CC(C(=O)NN)=C1 V4065 [1,1,0,0,0,0|2,0,0]=4 231 B12R1.440 COC1=C(C)C(C(N)=O)=CC=C1 6316AA [1,1,0,0,0,0|1,0,0]=3 232 B12R1.440 COC1=C(O)C(C(C)=O)=CC=C1 0906AC [1,1,0,0,0,0|1,0,0]=3 233 B12R1.440 COC1=CC=CC(C(=O)O)=C1I 6985AB [1,1,0,0,0,0|0,0,0]=2 234 B12R1.440 COC1=NC=CC(C(=O)O)=C1C 3726AA [1,1,0,0,0,0|1,0,0]=3 235 B12R1.440 O=C(O)C1=CC=CC(CF)=C1Cl 5453AC [1,1,0,0,0,0|2,0,0]=4 236 B12R1.453 CC1=C(C(=O)O)C=C(CN)C=C1 2975AJ [1,1,0,0,0,0|2,0,0]=4 237 B12R1.453 CCC1=CC(C(=O)O)=C(O)C=C1 6359AJ [1,1,0,0,0,0|1,0,0]=3 238 B12R1.453 COC1=CC(C(=O)O)=C(Cl)N=C1 1598AC [1,1,0,0,0,0|1,0,0]=3 239 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=N1 Z8102 [1,1,0,0,0,0|1,0,0]=3 240 B12R1.453 COC1=CC=C(F)C(C(=O)O)=N1 1127AD [1,1,0,0,0,0|1,0,0]=3 241 B12R1.453 COC1=CC=C(I)C(C(N)=O)=C1 2240AA [1,1,0,0,0,0|1,0,0]=3 242 B12R1.453 COC1=CC=C(N)C(C(=O)O)=N1 Z2691 [1,1,0,0,0,0|1,0,0]=3 243 B12R1.453 COC1=CC=C(N)C(C(C)=O)=C1 9390AH [1,1,0,0,0,0|1,0,0]=3 244 B12R1.453 N#CC1=CC(C(=O)O)=C(N)C=C1 6998AC [1,1,0,0,0,0|2,0,0]=4 245 B12R1.453 N#CC1=CC=C(I)C(C(=O)O)=C1 1122AB [1,1,0,0,0,0|2,0,0]=4 246 B12R1.78 CCC1=CC=C(OC)C(OC)=C1 Z4915 [1,1,0,0,0,0|1,0,1]=4 247 B12R1.78 COC1=C(CO)C=C(C=O)C=C1 9440AE [1,1,0,0,0,0|2,0,0]=4 248 B12R1.78 COC1=C(OC)N=C(CO)C=C1 6314AE [1,1,0,0,0,0|1,0,1]=4 249 B12R1.78 COC1=C(OC)N=CC(CO)=C1 9116AC [1,1,0,0,0,0|1,0,1]=4 250 B12R1.78 COC1=C(SC)C=CC(C=O)=C1 2317AJ [1,1,0,0,0,0|0,1,0]=3 251 B12R1.78 COC1=CC(C=O)=CC=C1C#N Z0386 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.78 COC1=CC(C=O)=CN=C1OC Y6600 [1,1,0,0,0,0|1,0,0]=3 253 B12R1.286 COC1=CC(CCO)=CC=C1O W4745 [1,1,0,0,0,0|0,0,1]=3 254 B12R1.449 COC1=C(Br)C=C(O)C(C=O)=C1 6112AJ [1,1,0,0,0,0|1,0,0]=3 255 B12R1.449 COC1=C(O)C=C(Cl)C(C=O)=C1 6127AD [1,1,0,0,0,0|0,0,0]=2 256 B14R1.343 COC1=C(O)C(Br)=CC(CC(=O)O)=C1 7002AD [0,1,0,0,0,1|0,0,0]=2 257 B14R1.3405 COC(=O)CC1=CC=C(O)C(OC)=C1 X5169 [0,1,0,0,0,1|0,0,0]=2 258 B14R1.3651 C=C(C)CC1=CC=C(OC)C(OC)=C1 4887AD [0,1,0,0,0,1|2,0,0]=4 259 B14R1.3651 COC1=C(OC)C=C(CC(=N)N)C=C1 9290AE [0,1,0,0,0,1|2,0,0]=4 260 B14R1.3651 COC1=CC=C(C[C@H](C)O)C=C1OC W3494 [0,1,0,0,0,1|1,0,1]=4 261 B14R1.12 CS(=O)(=O)C1=CC(C(=O)O)=CC=C1F 6166AJ [0,2,0,0,0,0|1,1,0]=4 262 B14R1.31 COC1=C(C(C)C)C=C(C(C)=O)C=C1 5247AD [0,2,0,0,0,0|2,0,0]=4 263 B14R1.706 COC(=O)C1=C(C)C=CC(C(=O)O)=C1 8530AA [0,2,0,0,0,0|1,0,0]=3 264 B14R1.6035 O=C(O)C1=CC([N+](=O)[O-])=C(O)C=C1O 6557AA [0,2,0,0,0,0|2,0,0]=4 265 B14R1.14211 CC1=CC(C(=O)O)=CC(C(=O)O)=C1O 3537AE [0,2,0,0,0,0|2,0,0]=4 266 B14R1.14211 O=C(O)C1=CC([N+](=O)[O-])=C(O)C(Br)=C1 V7215 [0,2,0,0,0,0|2,0,0]=4 267 B14R1.358 COC(=O)C1=CC(OC)=C(N)C(Br)=C1 9372AE [0,2,0,0,0,0|1,0,0]=3 268 B14R1.358 COC(=O)C1=CC(OC)=C(O)C(N)=C1 3433AF [0,2,0,0,0,0|0,0,0]=2 269 B14R1.358 COC(=O)C1=CC(OC)=C(O)C(O)=C1 2291AL [0,2,0,0,0,0|0,0,0]=2 270 B14R1.436 CCCC1=CC(C(=O)OC)=CC=C1O X8745 [0,2,0,0,0,0|1,0,0]=3 271 B14R1.436 CCNC1=CC(C(=O)OC)=CC=C1N Z8748 [0,2,0,0,0,0|2,0,0]=4 272 B14R1.436 COC(=O)C1=CC=C(O)C(NC=O)=C1 V2787 [0,2,0,0,0,0|1,0,1]=4 273 B14R1.626 CCNC(=O)C1=CC=C(Br)C(OC)=C1 Z6951 [0,2,0,0,0,0|2,0,0]=4 274 B14R1.626 CCOC(=O)C1=CC(C=O)=C(O)C=C1 0533AQ [0,2,0,0,0,0|2,0,0]=4 275 B14R1.626 COC1=CC([C@H](N)CCO)=CC=C1O 1209AL [0,2,0,0,0,0|1,0,1]=4 276 B14R1.1864 CCC(O)C1=CC=C(OC)C(OC)=C1 X6698 [0,2,0,0,0,0|1,0,1]=4 277 B14R1.1864 COC(=O)C1=CC(C=O)=C(OC)C=C1 7032AJ [0,2,0,0,0,0|2,0,0]=4 278 B14R1.1864 COC(=O)C1=CC(CCl)=C(OC)C=C1 4675AB [0,2,0,0,0,0|2,0,0]=4 279 B14R1.1864 COC1=C(OC)C=C(C(O)CN)C=C1 4963AH [0,2,0,0,0,0|1,0,1]=4 280 B14R1.1864 COC1=C(OC)C=C(\C(N)=N/O)C=C1 2681AE [0,2,0,0,0,0|1,0,0]=3 281 B14R1.1864 COC1=CC=C(C(=O)C=O)C=C1OC W3562 [0,2,0,0,0,0|0,0,1]=3 282 B14R1.2283 COC(=O)C1=C(Br)C=C(F)C(OC)=C1 7247AC [0,2,0,0,0,0|1,0,0]=3 283 B14R1.350 COC1=C(OC)C(Br)=CC(C(=O)O)=C1 7055AD [0,2,0,0,0,0|0,0,0]=2 284 B14R1.350 COC1=C(OC)C(Cl)=CC(B(O)O)=C1 Y2532 [0,2,0,0,0,0|1,0,1]=4 285 B14R1.350 COC1=CC([N+](=O)[O-])=CC(O)=C1OC 3734AB [0,2,0,0,0,0|1,0,1]=4 286 B14R1.5293 CCOC1=C(Cl)C(N)=CC(C(=O)O)=N1 5056AC [0,2,0,0,0,0|2,0,0]=4 287 B14R1.441 C=CCC1=C(OC)C=CC(C(=O)O)=C1 9180AE [0,2,0,0,0,0|1,0,1]=4 288 B14R1.441 CCOC1=CC(C(=O)O)=CC=C1OC 8772AD [0,2,0,0,0,0|0,0,0]=2 289 B14R1.676 CC(=O)NC1=C(O)C=CC(C(=O)O)=C1 2871AF [0,2,0,0,0,0|1,0,0]=3 290 B14R1.3329 CCCC1=CC(C(C)=O)=C(O)C=C1O 7137AE [0,2,0,0,0,0|2,0,0]=4 291 B14R1.1851 COC1=C(OC)C=C(C(C)=O)C(O)=C1 Y1992 [0,2,0,0,0,0|1,0,0]=3 292 B14R1.1851 COC1=C(OC)C=C([N+](=O)[O-])C(N)=C1 1805AC [0,2,0,0,0,0|1,0,1]=4 293 B14R1.1851 COC1=CC(F)=C(C(=O)O)C=C1OC 2423AC [0,2,0,0,0,0|0,0,0]=2 294 B14R1.2288 COC1=CC(Br)=C(OC)C=C1C(=O)O X0252 [0,2,0,0,0,0|1,0,0]=3 295 B14R1.43 CNC1=CC(C(=O)O)=CC=C1[N+](=O)[O-] V4356 [0,2,0,0,0,0|1,0,1]=4 296 B14R1.43 COC1=CC(C(=O)O)=CC=C1B(O)O Z0820 [0,2,0,0,0,0|0,0,0]=2 297 B14R1.2023 COC1=CC=C(C(=O)O)C(C)=C1OC 8405AB [0,2,0,0,0,0|0,0,0]=2 298 B14R1.2023 COC1=CC=C(C(=O)O)C(N)=C1OC Z2483 [0,2,0,0,0,0|0,0,0]=2 299 B14R1.2023 COC1=CC=C(C(C)=O)C(N)=C1OC W6525 [0,2,0,0,0,0|1,0,0]=3 300 B14R1.2023 COC1=CC=C([N+](=O)[O-])C(Cl)=C1OC V2944 [0,2,0,0,0,0|1,0,1]=4 301 B14R1.6723 CCOC1=CC=C(B(O)O)C=C1OC Z8054 [0,2,0,0,0,0|1,0,1]=4 302 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 7853AE [0,0,1,1,0,0|1,0,1]=4 303 B12R2.1384 O=C(O)C1=CC=C2C=CC2=C1 L676 [1,0,0,1,0,0|1,0,1]=4 304 B12R2.44 O=CC1=CC=C2N=COC2=C1 3572AC [1,0,0,1,0,0|1,0,1]=4 305 B14R2.1008 O=C(O)CC1=CC=C2CCCC2=C1 7897AB [0,0,0,1,0,1|2,0,0]=4 306 B14R2.24358 CC1=CNC2=C1C=C(C(=O)O)C=C2 Y9555 [0,1,0,1,0,0|2,0,0]=4 307 B14R2.24358 CN1C=NC2=CC=C(C(=O)O)C=C21 W6788 [0,1,0,1,0,0|2,0,0]=4 308 B14R2.24358 O=C(O)C1=CC2=C(C=C1)CCC2=O W7273 [0,1,0,1,0,0|2,0,0]=4 309 B14R2.966 COC(=O)C1=CC2=C(C=CO2)C=C1 8743AB [0,1,0,1,0,0|1,0,1]=4 310 B14R2.966 NCC(O)C1=CC2=C(C=C1)OCO2 1460AJ [0,1,0,1,0,0|1,0,1]=4 311 B14R2.966 N\C(=N/O)C1=CC=C2OCOC2=C1 Y9174 [0,1,0,1,0,0|1,0,0]=3 312 B14R2.2167 COC1=C(Br)C=C2CCC(=O)C2=C1 1157AQ [0,1,0,1,0,0|2,0,0]=4 313 B14R2.2167 COC1=CC2=C(C=C1F)CCC2=O 2902AC [0,1,0,1,0,0|2,0,0]=4 314 B14R2.8824 O=C(O)C1=CC(Br)=C2OCOC2=C1 6479AJ [0,1,0,1,0,0|0,0,0]=2 315 B14R2.601 CC1=CC2=C(C=CC(C(=O)O)=C2)O1 7480AD [0,1,0,1,0,0|1,0,0]=3 316 B14R2.601 CC1=CC2=CC=C(C(=O)O)C=C2N1 1365AC [0,1,0,1,0,0|2,0,0]=4 317 B14R2.601 CC1CC2=CC(C(=O)O)=CC=C2O1 7747AC [0,1,0,1,0,0|1,0,0]=3 318 B14R2.601 O=C1NC2=C(C=C(C(=O)O)C=C2)O1 5433AE [0,1,0,1,0,0|1,0,1]=4 319 B14R2.601 O=C1NC2=CC(C(=O)O)=CC=C2O1 0025AC [0,1,0,1,0,0|1,0,1]=4 320 B14R2.781 NC(=O)C1=CC2=C(C=C1)OCCO2 3077AB [0,1,0,1,0,0|1,0,0]=3 321 B14R2.781 NC(=O)C1=CC2=C(C=C1)OCCO2 5078AC [0,1,0,1,0,0|1,0,0]=3 322 B14R2.781 O=C(O)C1=CC2=C(C=C1)CCCO2 7460AB [0,1,0,1,0,0|1,0,0]=3 323 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCO2 3164AC [0,1,0,1,0,0|1,0,0]=3 324 B14R2.781 O=C(O)C1=CC=C2NCCNC2=C1 9587AH [0,1,0,1,0,0|2,0,0]=4 325 B14R2.781 O=C(O)C1=CC=C2OCC=CC2=C1 7461AB [0,1,0,1,0,0|1,0,0]=3 326 B14R2.781 O=C(O)C1=CN=C2OCCOC2=C1 Z8969 [0,1,0,1,0,0|1,0,0]=3 327 B14R2.624 NC1=CC2=C(C=C1[N+](=O)[O-])OCO2 7419AE [0,1,0,1,0,0|1,0,1]=4 328 B14R2.624 O=C(O)C1=C(Br)C=C2OCOC2=C1 X8055 [0,1,0,1,0,0|0,0,0]=2 329 B14R2.624 O=[N+]([O-])C1=C(Br)C=C2OCOC2=C1 V7727 [0,1,0,1,0,0|1,0,1]=4 330 B14R2.624 O=[N+]([O-])C1=CC2=C(C=C1Cl)OCO2 Y2830 [0,1,0,1,0,0|1,0,1]=4 331 B14R2.5719 O=C(O)C1=CC2=C(C=C1)C(=O)CC2 W5629 [0,1,0,1,0,0|1,0,1]=4 332 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 2990AB [1,0,0,0,1,0|2,0,0]=4 333 B10R1.58 CN1N=C(C(=O)O)C=C1O Y9543 [1,0,0,0,1,0|2,0,0]=4 334 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 6451AD [1,0,0,0,1,0|2,0,0]=4 335 B10R1.31 CCC1=CC(C(=O)O)=CS1 Y1108 [1,0,0,0,1,0|2,0,0]=4 336 B10R1.31 CCC1=CC=C(C(=O)O)O1 8236AB [1,0,0,0,1,0|2,0,0]=4 337 B10R1.31 CCC1=CC=C(C(=O)O)S1 Z2977 [1,0,0,0,1,0|2,0,0]=4 338 B10R1.31 COC1=CC=C(C(=O)O)O1 3836AF [1,0,0,0,1,0|1,0,0]=3 339 B10R1.31 COC1=NOC(C(=O)O)=C1 6455AA [1,0,0,0,1,0|2,0,0]=4 340 B10R1.39 COC1=CSC=C1C(N)=O Y9743 [1,0,0,0,1,0|2,0,0]=4 341 B12R1.438 COC1=CC(CC(=O)O)=CC=N1 6367AB [1,0,0,0,0,1|1,0,0]=3 342 B12R1.438 COC1=CC=CC(CC(=N)N)=C1 1110AJ [1,0,0,0,0,1|2,0,0]=4 343 B12R1.438 O=C(O)CC1=CC(CCl)=CC=C1 4272AH [1,0,0,0,0,1|2,0,0]=4 344 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 1358AA [0,0,0,0,1,1|1,0,0]=3 345 B12R1.57 COC1=C(C(=O)O)C=CC(I)=C1 1142AQ [0,0,0,0,1,1|1,0,0]=3 346 B12R1.57 COC1=CC(Br)=CC=C1C(N)=O V7847 [0,0,0,0,1,1|2,0,0]=4 347 B12R1.57 COC1=CC(N)=CC=C1C(C)=O 8976AB [0,0,0,0,1,1|2,0,0]=4 348 B12R1.57 COC1=CC(O)=CC=C1C(=O)O X8080 [0,0,0,0,1,1|0,0,0]=2 349 B12R1.87 CCC1=C(C(=O)O)C=CC=C1Br X3631 [0,0,0,0,1,1|2,0,0]=4 350 B12R1.87 COC1=C(C(C)=O)C=CC=C1Cl 6987AC [0,0,0,0,1,1|2,0,0]=4 351 B12R1.87 COC1=C(C)C=CC=C1C(C)=O 5079AH [0,0,0,0,1,1|2,0,0]=4 352 B14R1.42 COC1=C(Br)C=CC(\C=C\C(=O)O)=C1 Y2708 [0,0,0,0,0,2|1,0,0]=3 353 B14R1.42 COC1=CC(\C=C\C(=O)O)=CC=C1F X2821 [0,0,0,0,0,2|1,0,0]=3 354 B14R1.42 COC1=CC(\C=C\C(N)=O)=CC=C1O W2104 [0,0,0,0,0,2|1,0,0]=3