0 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [0,0,0,0,0,0|1,0,3]=4 1 B11R1.3 CC(C)C1=NC=C(C=O)C=N1 X5148 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [0,0,0,0,0,0|2,0,1]=3 3 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [0,0,0,0,0,0|2,0,1]=3 4 B11R1.3 CN(C)C1=CC=C(C#N)C=N1 4854AD [0,0,0,0,0,0|3,0,1]=4 5 B11R1.3 CN(C)C1=NC=C(C=O)C=C1 Z0203 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.3 CN(C)C1=NC=C(C=O)C=N1 Z0688 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.3 CN(C)C1=NC=C(CN)C=C1 V5451 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [0,0,0,0,0,0|3,0,0]=3 9 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 W4398 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.3 [C@@H](C)(N)C1=CC=C(C#N)C=C1 0683AP [0,0,0,0,0,0|2,0,1]=3 11 B10R1.3 C#CC1=CC=C(CN)C=C1 0181AB [1,0,0,0,0,0|2,0,1]=4 12 B10R1.3 C=CC1=CC=C(C#N)C=C1 8141AJ [1,0,0,0,0,0|2,0,1]=4 13 B10R1.3 CCC1=CC=C(CBr)C=C1 9519AH [1,0,0,0,0,0|1,0,1]=3 14 B10R1.3 CCC1=CC=C(CN)C=C1 9087AE [1,0,0,0,0,0|1,0,1]=3 15 B10R1.3 CCC1=CC=C(NN)C=C1 8775AH [1,0,0,0,0,0|2,0,0]=3 16 B10R1.3 CSC1=CC=C(NN)C=C1 1474AE [1,0,0,0,0,0|3,0,0]=4 17 B10R1.3 CSC1=NC=C(C=O)C=C1 Z0204 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.3 N#CC1=CN=C(C=O)C=C1 W4334 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.3 NCC1=CC=C(CBr)C=C1 4131AB [1,0,0,0,0,0|2,0,1]=4 20 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 7787AC [1,0,0,0,0,0|3,0,0]=4 21 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [1,0,0,0,0,0|0,0,3]=4 22 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [1,0,0,0,0,0|1,0,2]=4 23 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [1,0,0,0,0,0|2,0,1]=4 24 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [1,0,0,0,0,0|2,0,0]=3 25 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [1,0,0,0,0,0|1,0,1]=3 26 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [1,0,0,0,0,0|0,1,0]=2 27 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [1,0,0,0,0,0|2,0,0]=3 29 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [1,0,0,0,0,0|2,0,0]=3 30 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [1,0,0,0,0,0|3,0,0]=4 31 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [1,0,0,0,0,0|3,0,0]=4 32 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [1,0,0,0,0,0|2,0,1]=4 33 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [1,0,0,0,0,0|2,0,1]=4 34 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [1,0,0,0,0,0|1,0,1]=3 35 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.13 CC1=CC[C@H](C(C)C)C=C1 3942AL [1,0,0,0,0,0|0,0,3]=4 37 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6241AL [1,0,0,0,0,0|2,0,1]=4 38 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6486AL [1,0,0,0,0,0|2,0,1]=4 39 B10R1.13 CN(C)C1=NC=C(N)C=C1 6679AB [1,0,0,0,0,0|3,0,0]=4 40 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [1,0,0,0,0,0|1,0,1]=3 43 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [1,0,0,0,0,0|2,0,0]=3 44 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [1,0,0,0,0,0|1,0,1]=3 45 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [1,0,0,0,0,0|2,0,0]=3 46 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.5 CCN(C)C1=CC=C(C=O)C=C1 5546AH [0,1,0,0,0,0|1,0,0]=2 48 B12R1.5 COC1=CC=C(C(O)CN)C=C1 5057AH [0,1,0,0,0,0|3,0,0]=4 49 B12R1.6 CC(C)(C)C1=CC=C(C#N)C=N1 3626AJ [0,1,0,0,0,0|2,0,1]=4 50 B12R1.6 CC(C)(C)C1=CC=C(NN)C=C1 6754AE [0,1,0,0,0,0|2,0,0]=3 51 B12R1.6 CC(C)(C)C1=NC=C(C=O)C=N1 5122AH [0,1,0,0,0,0|2,0,0]=3 52 B12R1.6 CC(C)(O)C1=CC=C(C=O)C=N1 6521AC [0,1,0,0,0,0|1,0,0]=2 53 B12R1.6 O=CC1=CC=C(S(=O)(=O)Cl)C=C1 9447AL [0,1,0,0,0,0|3,0,0]=4 54 B12R1.48 CC(C)C1=CC=C(C#N)C(=O)N1 5964AE [0,1,0,0,0,0|2,0,1]=4 55 B12R1.48 CC(C)C1=NC(Cl)=C(C#N)C=C1 8462AC [0,1,0,0,0,0|2,0,1]=4 56 B12R1.48 CC1=C(C=O)C=CC(N(C)C)=C1 0821AD [0,1,0,0,0,0|1,0,0]=2 57 B12R1.48 CC1=CC(B(O)O)=CC=C1C=O Z0569 [0,1,0,0,0,0|3,0,0]=4 58 B12R1.48 CC1=CC(C(=O)O)=CC=C1C=O V4609 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.48 CN(C)C1=NC(Cl)=C(C=O)C=C1 3066AA [0,1,0,0,0,0|2,0,0]=3 60 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 5479AC [0,1,0,0,0,0|2,0,1]=4 61 B12R1.48 O=CC1=C(Cl)C=C(B(O)O)C=C1 X1310 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.113 CC(C)C1=CC=C(CNN)C=C1 0542AD [0,1,0,0,0,0|1,0,1]=3 63 B12R1.113 CCCC1=CC=C(C(C)N)C=C1 2970AF [0,1,0,0,0,0|2,0,1]=4 64 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 7699AC [0,1,0,0,0,0|2,0,1]=4 65 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 W6734 [0,1,0,0,0,0|2,0,1]=4 66 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 2886AC [0,1,0,0,0,0|2,0,1]=4 67 B12R1.113 O=CCC1=CC=C([N+](=O)[O-])C=C1 7227AA [0,1,0,0,0,0|3,0,0]=4 68 B12R1.256 C=C(C)C1=CC=C(C(=C)C)C=C1 8094AA [0,1,0,0,0,0|1,0,2]=4 69 B12R1.256 CC(=O)C1=CN=C(C(=O)O)C=C1 Y9735 [0,1,0,0,0,0|2,0,1]=4 70 B12R1.256 CC(C)C1=CC=C(C(C)N)C=C1 8973AE [0,1,0,0,0,0|1,0,1]=3 71 B12R1.256 CC(C)C1=CC=C(C(N)=S)C=C1 5121AE [0,1,0,0,0,0|0,1,0]=2 72 B12R1.256 CC(C)C1=NC=C([N+](=O)[O-])C=C1 5913AA [0,1,0,0,0,0|2,0,0]=3 73 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 2416AJ [0,1,0,0,0,0|1,0,0]=2 74 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 2771AB [0,1,0,0,0,0|1,0,0]=2 75 B12R1.256 CN(C)C1=CC=C([N+](=O)[O-])C=C1 Z3701 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.256 CS(=O)C1=CC=C(C(=O)O)C=C1 4031AB [0,1,0,0,0,0|2,0,0]=3 77 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2000AA [0,1,0,0,0,0|1,0,0]=2 78 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 2927AH [0,1,0,0,0,0|1,0,0]=2 79 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 1165AB [0,1,0,0,0,0|2,0,0]=3 80 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 9180AH [0,1,0,0,0,0|1,0,0]=2 81 B12R1.256 C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1 5765AB [0,1,0,0,0,0|2,0,0]=3 82 B12R1.256 NC(=O)C1=CC=C(C(N)=O)C=C1 9023AL [0,1,0,0,0,0|2,0,1]=4 83 B12R1.452 O=CC1=CC=C([N+](=O)[O-])C(Cl)=C1 2402AL [0,1,0,0,0,0|3,0,0]=4 84 B10R1.31 CC(=O)C1=CC(C=O)=CS1 3015AE [0,0,0,0,1,0|2,0,1]=4 85 B10R1.31 CC(C)N1C=CC(C=O)=C1 4717AH [0,0,0,0,1,0|1,0,0]=2 86 B10R1.31 CN(C)C1=CC=C(C=O)O1 1748AE [0,0,0,0,1,0|2,0,0]=3 87 B12R1.4 CC(C)NC1=CC=C(C#N)C=C1 V4214 [0,0,0,0,0,1|1,0,1]=3 88 B12R1.4 CC(C)NC1=CC=C(C#N)C=N1 V3593 [0,0,0,0,0,1|2,0,1]=4 89 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 7098AC [0,0,0,0,0,1|1,0,1]=3 90 B12R1.4 CC(C)OC1=CC=C(CO)C=C1 1352AL [0,0,0,0,0,1|0,0,2]=3 91 B12R1.4 CC(C)OC1=CC=C(CO)C=N1 Z2084 [0,0,0,0,0,1|1,0,2]=4 92 B12R1.4 CC(C)OC1=CC=C(NN)C=C1 8783AH [0,0,0,0,0,1|2,0,0]=3 93 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 V5334 [0,0,0,0,0,1|2,0,1]=4 94 B12R1.4 COC1=CC=C(NC(C)C)C=C1 8375AA [0,0,0,0,0,1|2,0,0]=3 95 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [2,0,0,0,0,0|2,0,0]=4 96 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [2,0,0,0,0,0|0,0,1]=3 97 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [2,0,0,0,0,0|2,0,0]=4 98 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [2,0,0,0,0,0|2,0,0]=4 99 B9R1.1 CCC1=CC=C(S)C=C1 S243 [2,0,0,0,0,0|0,1,0]=3 100 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [2,0,0,0,0,0|1,0,0]=3 101 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.1 CNC1=CC=C(N)C=C1 F921 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.1 CSC1=CC=C(S)C=C1 U208 [2,0,0,0,0,0|1,1,0]=4 105 B9R1.1 NCC1=CNC(=O)C=C1 5770AA [2,0,0,0,0,0|2,0,0]=4 106 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [2,0,0,0,0,0|2,0,0]=4 107 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [2,0,0,0,0,0|2,0,0]=4 108 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [2,0,0,0,0,0|1,0,0]=3 109 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [2,0,0,0,0,0|2,0,0]=4 110 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [2,0,0,0,0,0|2,0,0]=4 111 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [2,0,0,0,0,0|1,0,0]=3 112 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [2,0,0,0,0,0|2,0,0]=4 113 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [2,0,0,0,0,0|2,0,0]=4 114 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [2,0,0,0,0,0|2,0,0]=4 115 B11R1.83 CCCC1=CC=C(NN)C=C1 1149AE [1,1,0,0,0,0|2,0,0]=4 116 B11R1.83 CCOC1=CC=C(NN)C=C1 9336AE [1,1,0,0,0,0|2,0,0]=4 117 B11R1.83 COC1=CC=C(NC=O)C=C1 6567AL [1,1,0,0,0,0|1,0,0]=3 118 B11R1.83 COC1=CC=C(\C=N\O)C=C1 5634AH [1,1,0,0,0,0|1,0,1]=4 119 B11R1.83 COCC1=CC=C(CO)C=C1 8790AH [1,1,0,0,0,0|0,0,2]=4 120 B11R1.83 COCC1=CC=C(OC)C=C1 W3311 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.83 COCC1=NC=C(C=O)C=N1 4865AH [1,1,0,0,0,0|2,0,0]=4 122 B11R1.83 N#CC1=CC=C(CCCl)C=C1 4983AA [1,1,0,0,0,0|1,0,1]=4 123 B11R1.83 N#CC1=CC=C(CCN)C=C1 W3652 [1,1,0,0,0,0|1,0,1]=4 124 B11R1.83 NCCC1=CC=C(CO)C=C1 9331AH [1,1,0,0,0,0|0,0,2]=4 125 B11R1.83 O=CC1=CC=C(CCO)C=C1 8288AA [1,1,0,0,0,0|0,0,0]=2 126 B11R1.279 CC1=CC(C#N)=CC=C1C=O Z0464 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.279 CCC1=CC=C(OC)C(Br)=C1 V9924 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.279 CCC1=CC=C(OC)C=C1O 2074AL [1,1,0,0,0,0|2,0,0]=4 129 B11R1.279 COC1=C(Br)N=C(C=O)C=C1 3741AB [1,1,0,0,0,0|2,0,0]=4 130 B11R1.279 COC1=NC(Cl)=C(C=O)C=C1 6514AC [1,1,0,0,0,0|2,0,0]=4 131 B11R1.279 COC1=NC=C(C=O)C=C1Br Z0761 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.279 COC1=NC=C(C=O)C=C1C Y3925 [1,1,0,0,0,0|2,0,0]=4 133 B11R1.279 COC1=NC=C(C=O)C=C1F Z5255 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.279 CSC1=C(C)C=C(C=O)C=N1 Z0025 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.279 N#CC1=CC=C(C=O)C(O)=C1 S689 [1,1,0,0,0,0|1,0,1]=4 136 B11R1.279 N#CC1=CC=C(C=O)C=C1Br 5479AJ [1,1,0,0,0,0|1,0,1]=4 137 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 1609AJ [1,1,0,0,0,0|2,0,0]=4 138 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [1,1,0,0,0,0|1,0,0]=3 139 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 7969AD [1,1,0,0,0,0|1,0,1]=4 140 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [1,1,0,0,0,0|1,0,0]=3 141 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [1,1,0,0,0,0|1,0,0]=3 142 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 W5164 [1,1,0,0,0,0|2,0,0]=4 143 B11R1.19 CC(C)(O)C1=NC=C(Cl)C=C1 5454AB [1,1,0,0,0,0|2,0,0]=4 144 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [1,1,0,0,0,0|2,0,0]=4 145 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 1626AL [1,1,0,0,0,0|1,1,0]=4 146 B11R1.21 CC(C)C1=CC(Br)=C(O)C=C1 6556AD [1,1,0,0,0,0|0,0,1]=3 147 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 7727AC [1,1,0,0,0,0|1,0,1]=4 148 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 V8866 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [1,1,0,0,0,0|2,0,0]=4 150 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [1,1,0,0,0,0|1,0,1]=4 151 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [1,1,0,0,0,0|2,0,0]=4 152 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3798AA [1,1,0,0,0,0|2,0,0]=4 153 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3799AA [1,1,0,0,0,0|2,0,0]=4 154 B11R1.21 CC1=CC(N(C)C)=CC=C1N 1607AB [1,1,0,0,0,0|2,0,0]=4 155 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [1,1,0,0,0,0|0,0,1]=3 156 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [1,1,0,0,0,0|1,0,1]=4 157 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [1,1,0,0,0,0|2,0,0]=4 158 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 1180AL [1,1,0,0,0,0|2,0,0]=4 159 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 4775AA [1,1,0,0,0,0|2,0,0]=4 160 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 X9639 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 W5394 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 7502AA [1,1,0,0,0,0|2,0,0]=4 163 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 2069AA [1,1,0,0,0,0|2,0,0]=4 164 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [1,1,0,0,0,0|1,0,1]=4 167 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [1,1,0,0,0,0|1,0,1]=4 168 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [1,1,0,0,0,0|1,0,1]=4 169 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [1,1,0,0,0,0|2,0,0]=4 170 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [1,1,0,0,0,0|1,0,1]=4 171 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [1,1,0,0,0,0|2,0,0]=4 172 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [1,1,0,0,0,0|2,0,0]=4 173 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [1,1,0,0,0,0|2,0,0]=4 174 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [1,1,0,0,0,0|1,0,1]=4 175 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [1,1,0,0,0,0|2,0,0]=4 177 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [1,1,0,0,0,0|1,0,0]=3 178 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [1,1,0,0,0,0|1,0,0]=3 179 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [1,1,0,0,0,0|2,0,0]=4 180 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [1,1,0,0,0,0|2,0,0]=4 181 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [1,1,0,0,0,0|2,0,0]=4 182 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [1,1,0,0,0,0|2,0,0]=4 183 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [1,1,0,0,0,0|2,0,0]=4 184 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [1,1,0,0,0,0|2,0,0]=4 185 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.166 CC1=C(N(C)C)C=CC(N)=C1 9005AD [1,1,0,0,0,0|2,0,0]=4 187 B11R1.166 CC1=CC(Br)=CC=C1N(C)C V6277 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.166 CC1=CC(N)=C(N(C)C)C=C1 6144AD [1,1,0,0,0,0|1,0,1]=4 189 B11R1.166 CN(C)C1=C(F)C=C(N)C=C1 2086AE [1,1,0,0,0,0|2,0,0]=4 190 B11R1.166 CN(C)C1=C(N)C=C(F)C=C1 6145AD [1,1,0,0,0,0|2,0,0]=4 191 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl 6600AE [1,1,0,0,0,0|2,0,0]=4 192 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 1178AL [1,1,0,0,0,0|2,0,0]=4 193 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 2379AC [1,1,0,0,0,0|2,0,0]=4 194 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8708 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8720 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.45 CC(C)(C)N1C=CC(C=O)=C1 9512AD [0,1,0,0,1,0|1,0,0]=3 197 B11R1.175 CC(C)C1=CN=C(C(=O)O)S1 2930AA [0,1,0,0,1,0|2,0,0]=4 198 B11R1.175 CC(C)C1=CSC(C(=O)O)=N1 3118AB [0,1,0,0,1,0|2,0,0]=4 199 B11R1.175 CC(C)C1=NC(C(=O)O)=CO1 7686AA [0,1,0,0,1,0|2,0,0]=4 200 B11R1.175 CC(C)C1=NC(C(N)=O)=CS1 5074AB [0,1,0,0,1,0|2,0,0]=4 201 B11R1.175 CC(C)C1=NOC(C(=O)O)=C1 4454AD [0,1,0,0,1,0|2,0,0]=4 202 B13R1.4 CC(C)(C)OC1=CC=C(CN)C=C1 3022AC [0,1,0,0,0,1|1,0,1]=4 203 B13R1.4 CC(C)(C)SC1=CC=C(C=O)C=C1 1747AF [0,1,0,0,0,1|0,0,0]=2 204 B13R1.5 CCC(=O)OC1=CC=C(C=O)C=C1 4366AE [0,1,0,0,0,1|1,0,1]=4 205 B13R1.5 COC1=CC=C(OC(C)CN)C=C1 5943AC [0,1,0,0,0,1|2,0,0]=4 206 B13R1.35 CC(C)OC1=CC=C(C=O)C(Cl)=C1 Z0024 [0,1,0,0,0,1|0,0,0]=2 207 B13R1.585 CC(=O)C1=CC=C(OC(C)C)C=C1 5542AB [0,1,0,0,0,1|0,0,0]=2 208 B13R1.585 CC(C)NC1=NC=C([N+](=O)[O-])C=C1 V4806 [0,1,0,0,0,1|2,0,0]=4 209 B13R1.585 CC(C)NC1=NN=C(C(=O)O)C=C1 6413AJ [0,1,0,0,0,1|2,0,0]=4 210 B13R1.585 CC(C)OC1=CC=C(C(C)N)C=C1 7858AC [0,1,0,0,0,1|1,0,1]=4 211 B13R1.585 CN(C)CC1=CC=C(C(=O)O)C=C1 6168AD [0,1,0,0,0,1|1,0,0]=3 212 B13R1.653 CC(C)NC1=CC=C(C#N)C=C1N V5453 [0,1,0,0,0,1|1,0,1]=4 213 B13R1.653 CC1=CC(C=O)=CC=C1OC(C)C Z0336 [0,1,0,0,0,1|0,0,0]=2 214 B13R1.39 CCN(CC)C1=CC=C(C=O)C=N1 9552AJ [0,2,0,0,0,0|2,0,0]=4 215 B13R1.139 CCOC1=CC=C(C(C)NC)C=C1 V9168 [0,2,0,0,0,0|1,0,1]=4 216 B13R1.187 CC(C)(C#N)C1=CC=C(CBr)C=C1 3491AA [0,2,0,0,0,0|1,0,1]=4 217 B13R1.187 CNS(=O)(=O)C1=CC=C(C=O)C=C1 3616AD [0,2,0,0,0,0|2,0,0]=4 218 B13R1.187 COC1=CC=C(C(C)(C)CN)C=C1 V6337 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.537 CC(C)C1=CC=C(C(N)CO)C=C1 4969AH [0,2,0,0,0,0|0,0,2]=4 220 B13R1.537 CCC(=O)C1=CC=C(C(=O)O)C=C1 3077AE [0,2,0,0,0,0|1,0,1]=4 221 B13R1.537 CCC(=O)C1=CC=C(C(C)C)C=C1 8977AD [0,2,0,0,0,0|0,0,0]=2 222 B13R1.537 CCC(C)C1=CC=C(B(O)O)C=C1 X2433 [0,2,0,0,0,0|1,0,1]=4 223 B13R1.537 CCC(C)C1=CC=C(C(C)=O)C=C1 9413AE [0,2,0,0,0,0|0,0,0]=2 224 B13R1.537 CCC(C)C1=CC=C(C(C)N)C=C1 6520AE [0,2,0,0,0,0|1,0,1]=4 225 B13R1.537 CCC(C)C1=CC=C([N+](=O)[O-])C=C1 1686AL [0,2,0,0,0,0|1,0,0]=3 226 B13R1.537 CN(C)C1=CC=C(C(=O)CN)C=C1 W3322 [0,2,0,0,0,0|1,0,0]=3 227 B13R1.537 CNC(=O)C1=CC=C(C(=O)O)C=C1 8032AD [0,2,0,0,0,0|1,0,1]=4 228 B13R1.537 COC(=O)C1=CC=C(C(C)N)C=C1 2417AJ [0,2,0,0,0,0|1,0,0]=3 229 B13R1.537 COC(=O)C1=CC=C(C(C)N)C=C1 3829AH [0,2,0,0,0,0|1,0,0]=3 230 B13R1.537 COC(=O)C1=CC=C(C(C)O)C=C1 3553AL [0,2,0,0,0,0|1,0,0]=3 231 B13R1.537 COC(=O)C1=CC=C(N(C)C)N=C1 Z0449 [0,2,0,0,0,0|2,0,0]=4 232 B13R1.537 COC(=O)C1=CC=C([C@@H](C)N)C=C1 9009AH [0,2,0,0,0,0|1,0,0]=3 233 B13R1.537 COC(C)C1=CC=C(B(O)O)C=C1 3982AF [0,2,0,0,0,0|1,0,1]=4 234 B13R1.38 CS(=O)(=O)C1=CC=C(C=O)C(F)=C1 Z8112 [0,2,0,0,0,0|2,0,0]=4 235 B13R1.96 CS(=O)(=O)C1=CC=C(C=O)C=C1Br V4702 [0,2,0,0,0,0|2,0,0]=4 236 B13R1.338 CC(C)(C)C1=CC=C(C(=N)N)C=C1 0529AC [0,2,0,0,0,0|1,0,0]=3 237 B13R1.338 CC(C)(C)C1=NC=C(C(=O)O)N=C1 8184AD [0,2,0,0,0,0|2,0,0]=4 238 B13R1.338 CC(C)C1=CC=C(C(F)(F)F)C=C1 0230AE [0,2,0,0,0,0|1,0,1]=4 239 B13R1.338 CC(F)(F)C1=CC=C([N+](=O)[O-])C=C1 0239AE [0,2,0,0,0,0|2,0,0]=4 240 B13R1.338 CC(N)C1=CC=C(C(C)(C)C)C=C1 V9099 [0,2,0,0,0,0|1,0,1]=4 241 B13R1.338 CS(=O)(=O)C1=CC=C(C(N)=O)C=C1 V5993 [0,2,0,0,0,0|2,0,0]=4 242 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(=O)N1 4620AF [0,2,0,0,0,0|1,0,0]=3 243 B13R1.120 CC(C)C1=CC=C(C(=O)O)C=C1I 6937AC [0,2,0,0,0,0|0,0,0]=2 244 B13R1.120 CC(C)C1=CC=C([N+](=O)[O-])C=C1N Z4090 [0,2,0,0,0,0|1,0,0]=3 245 B13R1.120 CC1=NC(C(C)C)=NC=C1C(=O)O 4302AF [0,2,0,0,0,0|2,0,0]=4 246 B13R1.120 CN(C)C1=C(N)C=C([N+](=O)[O-])C=C1 5161AE [0,2,0,0,0,0|2,0,0]=4 247 B13R1.3380 COC1=C(Br)C=C(C(C)C)C=C1Br Z1090 [0,2,0,0,0,0|2,0,0]=4 248 B13R1.74 CC(C)C1=CC=C(OCCN)C=C1 1414AF [0,2,0,0,0,0|1,0,1]=4 249 B11R1.43 CC(C)CC1=CC=C(C=O)S1 8036AC [0,0,1,1,0,0|1,0,1]=4 250 B11R1.159 CC(C)C1=CC=CC(O)=C1O 0871AB [0,0,1,1,0,0|1,0,1]=4 251 B11R2.190 C=CC1=CC=C2CCC2=C1 6995AC [1,0,0,1,0,0|1,0,0]=3 252 B11R2.190 O=CC1=CC=C2C=CC2=C1 L674 [1,0,0,1,0,0|0,0,2]=4 253 B11R2.190 OCC1=CC=C2C=CC2=C1 L732 [1,0,0,1,0,0|2,0,0]=4 254 B11R2.34 BrC1=CC=C(C2CC2)N=C1 8560AB [1,0,0,1,0,0|2,0,0]=4 255 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [1,0,0,1,0,0|2,0,0]=4 256 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [1,0,0,1,0,0|2,0,0]=4 257 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Y3582 [1,0,0,1,0,0|2,0,0]=4 258 B11R2.34 FC1=CC=C(C2CO2)C=C1 0449AQ [1,0,0,1,0,0|2,0,0]=4 259 B11R2.21 O=CC1=CN=C(C2CC2)S1 Y4445 [0,0,0,1,1,0|2,0,0]=4 260 B11R2.21 O=CC1=NC(C2CC2)=CS1 1902AJ [0,0,0,1,1,0|2,0,0]=4 261 B13R2.2121 CC1=NC2=C(C=C(C=O)C=C2)O1 3531AC [0,0,0,1,0,1|1,0,1]=4 262 B13R2.2121 CC1=NC2=C(C=CC(C=O)=C2)S1 0310AB [0,0,0,1,0,1|1,0,1]=4 263 B13R2.2121 CC1CC2=C(C=CC(C=O)=C2)O1 5085AH [0,0,0,1,0,1|0,0,0]=2 264 B13R2.2121 CC1CC2=C(C=CC(CN)=C2)O1 5605AE [0,0,0,1,0,1|1,0,1]=4 265 B13R2.186 COC1=CC=C(C2(N)CC2)C=C1 V7513 [0,1,0,1,0,0|2,0,0]=4 266 B13R2.2130 CN1C=NC2=CC(C=O)=CC=C21 W5091 [0,1,0,1,0,0|1,0,1]=4 267 B13R2.2130 O=CC1=CC2=C(C=C1)C(=O)NC2 5665AC [0,1,0,1,0,0|1,0,1]=4 268 B13R2.430 CC(C)C1=CC2=C(C=CN2)C=C1 0928AQ [0,1,0,1,0,0|1,0,0]=3 269 B13R2.428 CC(=O)C1=CC=C(C2CC2)C=C1 1431AL [0,1,0,1,0,0|0,0,0]=2 270 B13R2.428 O=C(O)C1=CN=C(C2CC2)C=C1 1791AC [0,1,0,1,0,0|1,0,0]=3 271 B13R2.428 O=C(O)C1=CN=C(C2CC2)N=C1 Z4995 [0,1,0,1,0,0|2,0,0]=4 272 B9R1.21 CCC1=NNC(C=O)=C1 5334AH [1,0,0,0,1,0|2,0,0]=4 273 B9R1.21 CCN1C=CC(C=O)=N1 Y5670 [1,0,0,0,1,0|2,0,0]=4 274 B9R1.21 O=CC1=CC=C(CO)N1 0366AC [1,0,0,0,1,0|2,0,0]=4 275 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [1,0,0,0,0,1|1,0,0]=3 276 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [1,0,0,0,0,1|1,0,0]=3 277 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 Z0473 [1,0,0,0,0,1|2,0,0]=4 278 B11R1.20 CC(C)OC1=NC=C(F)C=C1 Z9507 [1,0,0,0,0,1|2,0,0]=4 279 B11R1.20 CC(C)OC1=NC=C(I)C=C1 Z1054 [1,0,0,0,0,1|2,0,0]=4 280 B11R1.266 CC(C)C1=CC=CC(NN)=C1 2311AJ [0,0,0,0,1,1|2,0,0]=4 281 B11R1.266 CC(C)C1=CC=CC(NN)=C1 8650AH [0,0,0,0,1,1|2,0,0]=4 282 B11R1.266 O=CC1=CC(C(F)F)=CC=C1 3965AF [0,0,0,0,1,1|2,0,0]=4