0 B12R1.5 C#CC1=CC=C(C(=O)NC)C=C1 M22822 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.5 C#CC1=CN=C(C(=O)OC)C=C1 O30938 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 P35874 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.5 CCC(O)C1=CC=C(OC)C=C1 P37583 [0,0,0,0,0,0|1,0,2]=3 4 B12R1.5 CCC1=CC=C(C(=O)NN)C=C1 O30882 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 Q68222 [0,0,0,0,0,0|1,0,0]=1 6 B12R1.5 CNC(=O)C1=CC=C(C#N)C=C1 P38527 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.5 CNC(=O)C1=CC=C(C=O)C=C1 O31510 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 O28734 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.5 COC(=O)C1=CC=C(C#N)N=C1 I-9400 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.5 COC(=O)C1=CC=C(CN)N=C1 10790 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.5 COC(=O)C1=CC=C(OC)C=N1 Q56358 [0,0,0,0,0,0|1,0,0]=1 12 B12R1.5 COC(=O)C1=CN=C(C#N)N=C1 L13250 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 M23178 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.5 COC(=O)C1=CN=C(CCl)C=C1 M15191 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 L14676 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.5 COC(=O)C1=CN=C(CN)N=C1 L13305 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.5 COC(=O)C1=CN=C(CN)N=C1 Q53696 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 Q57226 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.5 COC(=O)C1=CN=C(OC)N=C1 Q67509 [0,0,0,0,0,0|2,0,0]=2 20 B12R1.5 COC(=O)C1=CN=C(SC)C=C1 O29122 [0,0,0,0,0,0|1,1,0]=2 21 B12R1.5 COC(=O)C1=CN=C(SC)N=C1 O31159 [0,0,0,0,0,0|2,1,0]=3 22 B12R1.5 COC(=O)C1=NC=C(C#N)C=C1 Q62332 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.5 COC(=O)C1=NC=C(C=O)C=C1 O30091 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.5 COC(=O)C1=NC=C(CBr)C=C1 P37418 [0,0,0,0,0,0|3,0,0]=3 25 B12R1.5 COC(=O)C1=NC=C(OC)C=N1 P48338 [0,0,0,0,0,0|2,0,0]=2 26 B12R1.5 COC(=O)C1=NN=C(C#N)C=C1 G-7675 [0,0,0,0,0,0|4,0,0]=4 27 B12R1.5 COC(=O)C1=NN=C(NN)C=C1 C-2377 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.5 COC(=O)C1=NN=C(NN)C=C1 G-5381 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.5 COC1=CC=C(C(=N)NO)C=N1 O29481 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 P40807 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.5 COC1=CC=C(C(N)CO)C=C1 P41432 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.5 COC1=CC=C(C(O)CN)C=C1 P37470 [0,0,0,0,0,0|2,0,2]=4 33 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 P43091 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 P40188 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 O28118 [1,0,0,0,0,0|1,0,1]=3 36 B11R1.3 C#CC1=CC=C(C(=O)O)C=N1 Q53214 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [1,0,0,0,0,0|1,0,1]=3 38 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [1,0,0,0,0,0|1,0,2]=4 43 B11R1.3 CCC1=CN=C(C(=O)O)C=N1 P43454 [1,0,0,0,0,0|3,0,0]=4 44 B11R1.3 CCC1=NC=C(C(=O)O)C=C1 Q60524 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.3 CNC1=CC=C(N(C)C)C=C1 P37575 [1,0,0,0,0,0|3,0,0]=4 46 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 P50006 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.3 COC1=CC=C(C(N)=S)C=N1 O31104 [1,0,0,0,0,0|2,1,0]=4 48 B11R1.3 COC1=CN=C(B(O)O)C=C1 Q52650 [1,0,0,0,0,0|2,0,1]=4 49 B11R1.3 COC1=CN=C(C(=O)O)C=C1 Q68348 [1,0,0,0,0,0|1,0,0]=2 50 B11R1.3 COC1=CN=C(C(=O)O)C=N1 O31701 [1,0,0,0,0,0|2,0,0]=3 51 B11R1.3 COC1=CN=C(C(=O)O)N=C1 Q52332 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.3 COC1=CN=C([C@@H](C)N)C=C1 Q62470 [1,0,0,0,0,0|2,0,1]=4 53 B11R1.3 COC1=NC=C(C(=O)O)C=N1 Q67508 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.3 COC1=NN=C(C(=O)O)C=C1 L22364 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 N24630 [1,0,0,0,0,0|1,1,0]=3 56 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 P43237 [1,0,0,0,0,0|3,0,0]=4 57 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 P38941 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 P43253 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 E-3027 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 P37128 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 O28757 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 G-5405 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 A-701 [1,0,0,0,0,0|2,0,1]=4 64 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 P44354 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [1,0,0,0,0,0|2,0,0]=3 66 B11R1.3 O=CC1=CC=C(C(=O)O)C=N1 Q62284 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.3 O=CC1=CN=C(C(=O)O)C=C1 Q60215 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.22 C#CC(=O)C1=CC=C(Cl)C=C1 P39524 [1,0,0,0,0,0|2,0,1]=4 69 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 P40808 [1,0,0,0,0,0|2,0,0]=3 70 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.22 CC1=CC=C(C(=O)NN)C=N1 P40085 [1,0,0,0,0,0|3,0,0]=4 72 B11R1.22 CC1=NC=C(C(=O)CBr)C=C1 Q52597 [1,0,0,0,0,0|3,0,0]=4 73 B11R1.22 CCC(=O)C1=NC=C(C)C=N1 O29473 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.22 CNC(=O)C1=CC=C(Br)N=C1 P35629 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.22 CNC(=O)C1=CC=C(N)N=C1 S72671 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 P50985 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.22 CNC(=O)C1=NC=C(O)C=C1 O30530 [1,0,0,0,0,0|2,0,0]=3 78 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 C-3212 [1,0,0,0,0,0|2,0,0]=3 79 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 C-3291 [1,0,0,0,0,0|3,0,0]=4 80 B11R1.22 COC(=O)C1=CC=C(N)C=N1 C-2286 [1,0,0,0,0,0|2,0,0]=3 81 B11R1.22 COC(=O)C1=CC=C(O)N=N1 C-2379 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.22 COC(=O)C1=CC=C(S)N=C1 H-8392 [1,0,0,0,0,0|1,1,0]=3 83 B11R1.22 COC(=O)C1=CN=C(Br)N=C1 Q64835 [1,0,0,0,0,0|3,0,0]=4 84 B11R1.22 COC(=O)C1=CN=C(C)N=C1 L13555 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 C-2772 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.22 COC(=O)C1=CN=C(F)C=C1 Q66489 [1,0,0,0,0,0|2,0,0]=3 87 B11R1.22 COC(=O)C1=CN=C(N)C=N1 C-3306 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.22 COC(=O)C1=CN=C(O)C=C1 G-5577 [1,0,0,0,0,0|1,0,0]=2 89 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 O30862 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.22 COC(=O)C1=NC=C(C)C=N1 G-5731 [1,0,0,0,0,0|2,0,0]=3 91 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 G-5538 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.22 COC(=O)C1=NC=C(F)C=C1 Q54927 [1,0,0,0,0,0|2,0,0]=3 93 B11R1.22 COC(=O)C1=NC=C(F)C=N1 O34307 [1,0,0,0,0,0|3,0,0]=4 94 B11R1.22 COC(=O)C1=NC=C(N)C=N1 C-2775 [1,0,0,0,0,0|3,0,0]=4 95 B11R1.22 COC(=O)C1=NC=C(N)C=N1 G-5008 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.22 COC(=O)C1=NC=C(N)N=C1 O31116 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.22 COC(=O)C1=NC=C(O)C=C1 G-5601 [1,0,0,0,0,0|1,0,0]=2 98 B11R1.22 COC(=O)C1=NC=C(O)C=N1 Q55461 [1,0,0,0,0,0|2,0,0]=3 99 B11R1.22 COC(=O)C1=NN=C(N)C=C1 G-5477 [1,0,0,0,0,0|3,0,0]=4 100 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [1,0,0,0,0,0|2,0,0]=3 101 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 O31201 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 P35986 [1,0,0,0,0,0|3,0,0]=4 103 B11R1.83 CCC1=CC=C(CNC)C=C1 P37356 [1,0,0,0,0,0|2,0,1]=4 104 B11R1.83 CCCC1=CN=C(OC)C=C1 N26472 [1,0,0,0,0,0|2,0,1]=4 105 B11R1.83 CCNC1=CC=C(CC)C=C1 P37885 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.83 CCNC1=CC=C(OC)C=C1 P42858 [1,0,0,0,0,0|2,0,0]=3 107 B11R1.83 CNCC1=CN=C(OC)C=C1 L19846 [1,0,0,0,0,0|2,0,1]=4 108 B11R1.83 COC1=CC=C(CCBr)C=C1 P41235 [1,0,0,0,0,0|2,0,1]=4 109 B11R1.83 COC1=CC=C(CNN)C=C1 C-3256 [1,0,0,0,0,0|2,0,1]=4 110 B11R1.83 COCC1=CC=C(C=O)C=C1 N25868 [1,0,0,0,0,0|2,0,1]=4 111 B11R1.83 COCC1=CC=C(CO)C=C1 M23214 [1,0,0,0,0,0|2,0,1]=4 112 B13R1.36 CCC1=CC=C(C(=O)C(=O)O)C=C1 P36489 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.36 CN(C)C(=O)C1=CC=C(C=O)C=C1 O32494 [0,1,0,0,0,0|3,0,0]=4 114 B13R1.36 CN(C)C(=O)C1=CC=C(CN)C=C1 O28729 [0,1,0,0,0,0|3,0,0]=4 115 B13R1.36 COC1=CC=C(C(=O)C(=O)O)C=C1 P36487 [0,1,0,0,0,0|2,0,0]=3 116 B13R1.39 CCC(CN)C1=CC=C(OC)C=C1 P37709 [0,1,0,0,0,0|2,0,1]=4 117 B13R1.95 COC(=O)C1=C(Br)C=C(C#N)C=C1 P44694 [0,1,0,0,0,0|2,0,0]=3 118 B13R1.95 COC(=O)C1=C(N)N=C(OC)C=C1 Q70145 [0,1,0,0,0,0|1,0,0]=2 119 B13R1.95 COC(=O)C1=CC=C(C#N)N=C1Cl Q62564 [0,1,0,0,0,0|3,0,0]=4 120 B13R1.95 COC(=O)C1=CC=C(C=O)C=C1Br P43181 [0,1,0,0,0,0|2,0,0]=3 121 B13R1.95 COC(=O)C1=CC=C(C=O)C=C1C O29364 [0,1,0,0,0,0|2,0,0]=3 122 B13R1.95 COC(=O)C1=CC=C(CBr)C=C1Cl M23013 [0,1,0,0,0,0|2,0,0]=3 123 B13R1.95 COC(=O)C1=CC=C(CBr)C=C1F M23030 [0,1,0,0,0,0|2,0,0]=3 124 B13R1.95 COC(=O)C1=CC=C(CO)C=C1C O29550 [0,1,0,0,0,0|2,0,0]=3 125 B13R1.95 COC(=O)C1=CC=C(OC)C=C1Br Q68105 [0,1,0,0,0,0|0,0,0]=1 126 B13R1.95 COC(=O)C1=CC=C(OC)C=C1N O32310 [0,1,0,0,0,0|0,0,0]=1 127 B13R1.95 COC(=O)C1=CC=C(OC)N=C1C N26175 [0,1,0,0,0,0|1,0,0]=2 128 B13R1.95 COC(=O)C1=CC=C(OC)N=C1Cl N24774 [0,1,0,0,0,0|1,0,0]=2 129 B13R1.95 COC(=O)C1=CC=C(SC)C=C1C Q68677 [0,1,0,0,0,0|0,1,0]=2 130 B13R1.95 COC(=O)C1=NC=C(C#N)C=C1F O30995 [0,1,0,0,0,0|3,0,0]=4 131 B13R1.139 CCOC1=CC=C(C(=O)CN)C=C1 P39440 [0,1,0,0,0,0|2,0,0]=3 132 B13R1.139 CNCC1=CC=C(C(=O)OC)C=C1 P40853 [0,1,0,0,0,0|1,0,0]=2 133 B13R1.139 COC(=O)C1=CC=C(CC#N)C=C1 P36190 [0,1,0,0,0,0|1,0,1]=3 134 B13R1.139 COC(=O)C1=CC=C(CCN)C=C1 P37407 [0,1,0,0,0,0|1,0,0]=2 135 B13R1.139 COC(=O)C1=CC=C(CCO)C=C1 O29781 [0,1,0,0,0,0|1,0,0]=2 136 B13R1.187 COS(=O)(=O)C1=CC=C(CBr)C=C1 L21192 [0,1,0,0,0,0|3,0,0]=4 137 B13R1.452 C#CC1=CC=C(C(=O)OCC)C=C1 O27990 [0,1,0,0,0,0|1,0,1]=3 138 B13R1.452 CCC1=CC=C(C(=O)CC#N)C=C1 P34797 [0,1,0,0,0,0|2,0,1]=4 139 B13R1.452 CCOC(=O)C1=CC=C(C=O)C=C1 P36963 [0,1,0,0,0,0|2,0,0]=3 140 B13R1.452 CCOC(=O)C1=CC=C(CC)C=C1 N24480 [0,1,0,0,0,0|1,0,0]=2 141 B13R1.452 CCOC(=O)C1=CC=C(SC)N=C1 O29113 [0,1,0,0,0,0|1,1,0]=3 142 B13R1.452 CCOC(=O)C1=CN=C(OC)N=C1 N27717 [0,1,0,0,0,0|2,0,0]=3 143 B13R1.452 CCOC(=O)C1=CN=C(SC)N=C1 A-660 [0,1,0,0,0,0|2,1,0]=4 144 B13R1.452 CCOC(=O)C1=NC=C(C#N)C=C1 Q62331 [0,1,0,0,0,0|3,0,0]=4 145 B13R1.452 CNCC(=O)C1=CC=C(OC)C=C1 O32427 [0,1,0,0,0,0|1,0,0]=2 146 B13R1.452 COC1=CC=C(C(N)CCO)C=C1 P36617 [0,1,0,0,0,0|2,0,1]=4 147 B13R1.452 COC1=CC=C([C@@H](N)CCO)C=C1 P35434 [0,1,0,0,0,0|2,0,1]=4 148 B13R1.452 COC1=CC=C([C@H](N)CCO)C=C1 P42756 [0,1,0,0,0,0|2,0,1]=4 149 B13R1.537 CN(C)C1=CC=C(C(=O)CN)C=C1 P38045 [0,1,0,0,0,0|3,0,0]=4 150 B13R1.537 COC(=O)C1=CC=C(C(=N)N)C=C1 O32544 [0,1,0,0,0,0|2,0,0]=3 151 B13R1.537 COC(=O)C1=CC=C(C(C)Br)C=C1 P51501 [0,1,0,0,0,0|1,0,0]=2 152 B13R1.537 COC(=O)C1=CC=C(C(C)C)C=N1 H-8736 [0,1,0,0,0,0|2,0,0]=3 153 B13R1.537 COC(=O)C1=CC=C(C(C)N)C=C1 M23192 [0,1,0,0,0,0|1,0,0]=2 154 B13R1.537 COC(=O)C1=CC=C(C(C)O)C=C1 P35826 [0,1,0,0,0,0|1,0,0]=2 155 B13R1.537 COC(=O)C1=CC=C(N(C)C)N=C1 Q67751 [0,1,0,0,0,0|2,0,0]=3 156 B13R1.537 COC(=O)C1=CN=C(B(O)O)C=C1 Q53738 [0,1,0,0,0,0|3,0,0]=4 157 B13R1.537 COC(=O)C1=CN=C(N(C)C)N=C1 Q68447 [0,1,0,0,0,0|3,0,0]=4 158 B13R1.537 COC(=O)C1=NC=C(B(O)O)C=C1 N24402 [0,1,0,0,0,0|3,0,0]=4 159 B13R1.537 NOC(=O)C1=CC=C([N+](=O)[O-])C=C1 H-8349 [0,1,0,0,0,0|3,0,0]=4 160 B13R1.3088 COC(=O)C1=CC(Cl)=C(SC)C=C1 N27614 [0,1,0,0,0,0|0,1,0]=2 161 B13R1.3088 COC(=O)C1=CC=C(C#N)C(O)=C1 O30946 [0,1,0,0,0,0|2,0,0]=3 162 B13R1.3088 COC(=O)C1=CC=C(C=O)C(Br)=C1 P43180 [0,1,0,0,0,0|2,0,0]=3 163 B13R1.3088 COC(=O)C1=CC=C(C=O)C(F)=C1 O30814 [0,1,0,0,0,0|2,0,0]=3 164 B13R1.3088 COC(=O)C1=CC=C(CBr)C(Br)=C1 M23029 [0,1,0,0,0,0|2,0,0]=3 165 B13R1.3088 COC(=O)C1=CC=C(CBr)C(Cl)=C1 P36300 [0,1,0,0,0,0|2,0,0]=3 166 B13R1.3088 COC(=O)C1=CC=C(CBr)C(F)=C1 O27993 [0,1,0,0,0,0|2,0,0]=3 167 B13R1.3088 COC(=O)C1=CC=C(CO)C(Br)=C1 F-4620 [0,1,0,0,0,0|2,0,0]=3 168 B13R1.3088 COC(=O)C1=CC=C(CO)C(Cl)=C1 K13431 [0,1,0,0,0,0|2,0,0]=3 169 B13R1.3088 COC(=O)C1=CC=C(OC)C(Br)=C1 O29244 [0,1,0,0,0,0|0,0,0]=1 170 B13R1.3088 COC(=O)C1=CC=C(OC)C(O)=C1 G-7853 [0,1,0,0,0,0|0,0,0]=1 171 B13R1.3088 COC(=O)C1=CN=C(C=O)C(Cl)=C1 Q57296 [0,1,0,0,0,0|3,0,0]=4 172 B13R1.3088 COC(=O)C1=CN=C(OC)C(Cl)=C1 N24649 [0,1,0,0,0,0|1,0,0]=2 173 B13R1.3088 COC(=O)C1=CN=C(SC)C(C)=C1 O29044 [0,1,0,0,0,0|1,1,0]=3 174 B13R1.3088 COC(=O)C1=NC=C(OC)C(Cl)=C1 L14555 [0,1,0,0,0,0|1,0,0]=2 175 B13R2.186 COC1=CC=C(C2(N)CC2)C=C1 P36387 [0,0,0,1,0,0|2,0,1]=4 176 B13R2.2130 COC1=CC2=C(C=C1)C(=O)NC2 P51419 [0,0,0,1,0,0|1,0,0]=2 177 B13R2.2130 COC1=CC2=C(C=C1)C(C)=NN2 O30443 [0,0,0,1,0,0|3,0,0]=4 178 B13R2.2130 COC1=CC2=C(C=C1)C(N)=NN2 M15110 [0,0,0,1,0,0|3,0,0]=4 179 B13R2.2130 COC1=CC2=C(C=C1)C(O)=NN2 10539 [0,0,0,1,0,0|2,0,1]=4 180 B13R2.2130 COC1=CC=C2C(=C1)NN=C2I M15030 [0,0,0,1,0,0|3,0,0]=4 181 B13R2.2130 N#CC1=CC2=C(C=C1)C(=O)CC2 O30489 [0,0,0,1,0,0|3,0,0]=4 182 B13R2.2130 N#CC1=CC2=C(C=C1)C(=O)NC2 P51183 [0,0,0,1,0,0|3,0,0]=4 183 B13R2.2130 O=CC1=CC2=C(C=C1)C(=O)NC2 P51290 [0,0,0,1,0,0|3,0,0]=4 184 B11R1.44 CCN1C=CC(C(=O)OC)=N1 O30188 [0,0,0,0,1,0|3,0,0]=4 185 B13R1.5 C#CC1=CC=C(CC(=O)OC)C=C1 M22867 [0,0,0,0,0,1|1,0,1]=3 186 B13R1.5 C#CC1=CC=C(CC(=O)OC)C=N1 Q62379 [0,0,0,0,0,1|2,0,1]=4 187 B13R1.5 CCC(=O)CC1=CC=C(OC)C=C1 P37560 [0,0,0,0,0,1|1,0,0]=2 188 B13R1.5 CNC(=O)CC1=CC=C(C#N)C=C1 P36034 [0,0,0,0,0,1|3,0,0]=4 189 B13R1.5 COC(=O)CC1=CC=C(CCl)C=C1 O28002 [0,0,0,0,0,1|2,0,0]=3 190 B10R1.3 C#CC1=CC=C(C=O)C=C1 P36909 [2,0,0,0,0,0|1,0,1]=4 191 B10R1.3 CCC1=CC=C(CO)C=C1 Q68223 [2,0,0,0,0,0|1,0,1]=4 192 B10R1.3 CCC1=NC=C(C=O)C=C1 Q60469 [2,0,0,0,0,0|2,0,0]=4 193 B10R1.3 CNC1=CC=C(CO)C=C1 P40364 [2,0,0,0,0,0|1,0,1]=4 194 B10R1.3 CNC1=NC=C(C=O)C=C1 Q55452 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.3 COC1=CC=C(CBr)C=C1 Q67503 [2,0,0,0,0,0|1,0,1]=4 196 B10R1.3 COC1=CC=C(NN)C=C1 P43291 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.3 COC1=CN=C(C=O)C=C1 N24757 [2,0,0,0,0,0|1,0,0]=3 198 B10R1.3 COC1=CN=C(C=O)C=N1 O29829 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.3 COC1=CN=C(C=O)N=C1 I-9829 [2,0,0,0,0,0|2,0,0]=4 200 B10R1.3 COC1=CN=C(CO)C=C1 I-9706 [2,0,0,0,0,0|1,0,1]=4 201 B10R1.3 COC1=CN=C(OC)C=C1 Q67646 [2,0,0,0,0,0|1,0,0]=3 202 B10R1.3 COC1=NC=C(C=O)C=N1 Q67228 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.3 COC1=NC=C(CO)C=C1 C-3532 [2,0,0,0,0,0|1,0,1]=4 204 B10R1.3 COC1=NN=C(OC)C=C1 Q67359 [2,0,0,0,0,0|2,0,0]=4 205 B10R1.3 CSC1=NC=C(C=O)C=C1 N24581 [2,0,0,0,0,0|1,1,0]=4 206 B10R1.3 O=CC1=CC=C(CCl)C=C1 P45270 [2,0,0,0,0,0|2,0,0]=4 207 B10R1.3 O=CC1=CC=C(CO)C=C1 P37667 [2,0,0,0,0,0|2,0,0]=4 208 B10R1.13 CC(=O)C1=CC=C(F)N=C1 P35858 [2,0,0,0,0,0|2,0,0]=4 209 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 Q67245 [2,0,0,0,0,0|2,0,0]=4 210 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [2,0,0,0,0,0|1,0,0]=3 211 B10R1.13 CC(=O)C1=CN=C(C)N=C1 H-8030 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.13 CC(=O)C1=CN=C(N)C=C1 Q55451 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 O30755 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.13 CC(=O)C1=NC=C(C)C=N1 O31005 [2,0,0,0,0,0|2,0,0]=4 216 B10R1.13 CC(=O)C1=NC=C(C)N=C1 F-4678 [2,0,0,0,0,0|2,0,0]=4 217 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 P34872 [2,0,0,0,0,0|2,0,0]=4 218 B10R1.13 CC(=O)C1=NC=C(F)C=C1 O30491 [2,0,0,0,0,0|2,0,0]=4 219 B10R1.13 CC(=O)C1=NN=C(O)C=C1 P51623 [2,0,0,0,0,0|2,0,0]=4 220 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [2,0,0,0,0,0|0,0,2]=4 221 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [2,0,0,0,0,0|1,0,1]=4 222 B10R1.13 CC1=CN=C(C(=O)O)C=N1 G-7280 [2,0,0,0,0,0|2,0,0]=4 223 B10R1.13 CC1=CN=C(C(=O)O)N=C1 G-6321 [2,0,0,0,0,0|2,0,0]=4 224 B10R1.13 CC1=NC=C(C(=O)O)C=N1 P44549 [2,0,0,0,0,0|2,0,0]=4 225 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P44353 [2,0,0,0,0,0|2,0,0]=4 226 B10R1.13 NC1=CN=C(C(=O)O)C=C1 E-3036 [2,0,0,0,0,0|2,0,0]=4 227 B10R1.13 NC1=NC=C(C(=O)O)C=C1 C-3709 [2,0,0,0,0,0|2,0,0]=4 228 B10R1.13 O=C(O)C1=CC=C(F)N=C1 E-3040 [2,0,0,0,0,0|2,0,0]=4 229 B10R1.13 O=C(O)C1=CC=C(O)N=N1 C-2295 [2,0,0,0,0,0|2,0,0]=4 230 B10R1.13 O=C(O)C1=CN=C(O)N=C1 O31007 [2,0,0,0,0,0|2,0,0]=4 231 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 G-6770 [2,0,0,0,0,0|2,0,0]=4 232 B10R1.13 O=C(O)C1=NC=C(F)C=C1 P42746 [2,0,0,0,0,0|2,0,0]=4 233 B10R1.13 O=C(O)C1=NC=C(O)C=C1 G-6588 [2,0,0,0,0,0|1,0,0]=3 234 B10R1.1 CNCC1=CC=C(O)C=C1 P36065 [2,0,0,0,0,0|1,0,1]=4 235 B10R1.1 COCC1=CC=C(Br)C=C1 Q67196 [2,0,0,0,0,0|1,0,1]=4 236 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [2,0,0,0,0,0|1,0,1]=4 237 B10R1.15 CCC(=O)C1=CC=CN=C1 P40926 [2,0,0,0,0,0|2,0,0]=4 238 B10R1.15 CCC(=O)C1=CC=NC=C1 P40626 [2,0,0,0,0,0|2,0,0]=4 239 B10R1.15 CCC(=O)C1=NC=CC=C1 P38825 [2,0,0,0,0,0|2,0,0]=4 240 B10R1.15 COC(=O)C1=CC=CN=N1 C-2267 [2,0,0,0,0,0|2,0,0]=4 241 B10R1.15 COC(=O)C1=CC=NC=N1 C-2227 [2,0,0,0,0,0|2,0,0]=4 242 B10R1.15 COC(=O)C1=CN=CN=C1 G-7535 [2,0,0,0,0,0|2,0,0]=4 243 B10R1.15 COC(=O)C1=NC=CC=N1 C-3283 [2,0,0,0,0,0|2,0,0]=4 244 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 P42415 [1,1,0,0,0,0|1,0,1]=4 245 B12R1.48 CC1=C(C=O)C=CC(C(=O)O)=C1 N24734 [1,1,0,0,0,0|2,0,0]=4 246 B12R1.48 CCC1=CN=C(C(=O)O)C=C1C S72490 [1,1,0,0,0,0|2,0,0]=4 247 B12R1.48 CNC1=CC=C(C(C)=O)C=C1N O31571 [1,1,0,0,0,0|1,0,0]=3 248 B12R1.48 COC1=C(Br)C=C(B(O)O)C=C1 N26872 [1,1,0,0,0,0|1,0,1]=4 249 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 P44401 [1,1,0,0,0,0|1,0,0]=3 250 B12R1.48 COC1=C(Br)N=C(C(=O)O)C=C1 A-739 [1,1,0,0,0,0|1,0,0]=3 251 B12R1.48 COC1=C(F)C=C(C(=O)O)C=N1 S72635 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.48 COC1=C(O)C=C(B(O)O)C=C1 N26398 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.48 COC1=C(O)C=C(C(=O)O)C=N1 Q60788 [1,1,0,0,0,0|1,0,0]=3 254 B12R1.48 COC1=CC=C(C(C)=O)C=C1C Q67903 [1,1,0,0,0,0|0,0,0]=2 255 B12R1.48 COC1=CC=C(C(C)C)C=C1Br Q67537 [1,1,0,0,0,0|1,0,1]=4 256 B12R1.48 COC1=CN=C(C(=O)O)C=C1Cl L21805 [1,1,0,0,0,0|1,0,0]=3 257 B12R1.48 COC1=NC=C(C(=O)O)C=C1C N26013 [1,1,0,0,0,0|1,0,0]=3 258 B12R1.48 CSC1=C(Cl)C=C(C(=O)O)C=C1 N25372 [1,1,0,0,0,0|0,1,0]=3 259 B12R1.48 CSC1=NC=C(C(=O)O)C=C1C N25880 [1,1,0,0,0,0|1,1,0]=4 260 B12R1.48 NCC1=CC=C(C(=O)O)C=C1Cl P40738 [1,1,0,0,0,0|2,0,0]=4 261 B12R1.48 O=CC1=C(Cl)C=C(C(=O)O)C=C1 N26294 [1,1,0,0,0,0|2,0,0]=4 262 B12R1.48 O=CC1=CC=C(C(=O)O)C=C1O P37037 [1,1,0,0,0,0|2,0,0]=4 263 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 P42866 [1,1,0,0,0,0|1,0,1]=4 264 B12R1.113 CCOC1=NC=C(C(=O)O)C=C1 P34777 [1,1,0,0,0,0|1,0,0]=3 265 B12R1.113 CCOC1=NC=C(C(=O)O)C=N1 Q60833 [1,1,0,0,0,0|2,0,0]=4 266 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 P34800 [1,1,0,0,0,0|1,0,0]=3 267 B12R1.113 CNCC1=CC=C(C(N)=O)C=C1 P42469 [1,1,0,0,0,0|2,0,0]=4 268 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 P36718 [1,1,0,0,0,0|0,0,0]=2 269 B12R1.113 NCCC1=CC=C(C(=O)O)C=C1 P37127 [1,1,0,0,0,0|1,0,0]=3 270 B12R1.256 C=C(C)C1=CN=C(C(=O)O)C=C1 K12258 [1,1,0,0,0,0|2,0,0]=4 271 B12R1.256 CC(=O)C1=CC=C(C(N)=O)C=C1 P36717 [1,1,0,0,0,0|2,0,0]=4 272 B12R1.256 CC(=O)C1=CN=C(C(=O)O)C=C1 O29701 [1,1,0,0,0,0|2,0,0]=4 273 B12R1.256 CC(=O)C1=CN=C(C(C)C)C=C1 H-8735 [1,1,0,0,0,0|2,0,0]=4 274 B12R1.256 CC(C)C1=CN=C(C(=O)O)C=C1 K12257 [1,1,0,0,0,0|2,0,0]=4 275 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 O28758 [1,1,0,0,0,0|1,0,0]=3 276 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=N1 P35906 [1,1,0,0,0,0|2,0,0]=4 277 B12R1.256 CN(C)C1=CN=C(C(=O)O)C=C1 Q60887 [1,1,0,0,0,0|2,0,0]=4 278 B12R1.256 O=C(O)C1=CC=C(C(F)F)C=C1 P37424 [1,1,0,0,0,0|2,0,0]=4 279 B12R1.452 CC1=CC(C=O)=CC=C1C(=O)O N26360 [1,1,0,0,0,0|2,0,0]=4 280 B12R1.452 CCC1=CC=C(C(=O)O)C(F)=C1 K12290 [1,1,0,0,0,0|1,0,0]=3 281 B12R1.452 CCC1=CC=C(C(=O)O)C(N)=C1 K12293 [1,1,0,0,0,0|1,0,0]=3 282 B12R1.452 COC1=CC(C)=C(C(=O)O)C=N1 Q67661 [1,1,0,0,0,0|1,0,0]=3 283 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 P44270 [1,1,0,0,0,0|1,0,0]=3 284 B12R1.452 COC1=CC(O)=C(B(O)O)C=C1 N27743 [1,1,0,0,0,0|1,0,1]=4 285 B12R1.452 COC1=CC=C(B(O)O)C(Br)=C1 N26729 [1,1,0,0,0,0|1,0,1]=4 286 B12R1.452 COC1=CC=C(C(=O)O)C(C)=N1 N24695 [1,1,0,0,0,0|1,0,0]=3 287 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 N24433 [1,1,0,0,0,0|1,0,0]=3 288 B12R1.452 COC1=CC=C(C(C)C)C(F)=C1 C-3733 [1,1,0,0,0,0|1,0,1]=4 289 B12R1.452 COC1=CC=C(C(C)O)C(F)=C1 N25311 [1,1,0,0,0,0|0,0,2]=4 290 B12R1.452 COC1=CC=C(C(N)=O)C(N)=C1 M23146 [1,1,0,0,0,0|1,0,0]=3 291 B12R1.452 COC1=CN=C(C(=O)O)C(C)=C1 Q60878 [1,1,0,0,0,0|1,0,0]=3 292 B12R1.452 COC1=CN=C(C(=O)O)C(Cl)=C1 L13826 [1,1,0,0,0,0|1,0,0]=3 293 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 P51606 [1,1,0,0,0,0|1,0,0]=3 294 B12R1.452 COC1=NC=C(C(=O)O)C(C)=C1 Q60522 [1,1,0,0,0,0|1,0,0]=3 295 B12R1.452 CSC1=CC=C(C(=O)O)C(C)=C1 N26500 [1,1,0,0,0,0|0,1,0]=3 296 B12R1.452 CSC1=NC=C(C(=O)O)C(C)=C1 N27762 [1,1,0,0,0,0|1,1,0]=4 297 B12R1.452 N#CC1=CC(Cl)=C(C(=O)O)C=C1 L21511 [1,1,0,0,0,0|2,0,0]=4 298 B12R1.452 NCC1=CC=C(C(=O)O)C(Cl)=C1 P42290 [1,1,0,0,0,0|2,0,0]=4 299 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 Q51912 [1,1,0,0,0,0|1,0,0]=3 300 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 10446 [1,1,0,0,0,0|1,0,0]=3 301 B12R1.16 CCOC(=O)C1=CN=C(Br)C=C1 Q67365 [1,1,0,0,0,0|2,0,0]=4 302 B12R1.16 CCOC(=O)C1=CN=C(C)N=C1 G-5558 [1,1,0,0,0,0|2,0,0]=4 303 B12R1.16 CCOC(=O)C1=CN=C(O)N=C1 S72555 [1,1,0,0,0,0|2,0,0]=4 304 B12R1.16 CCOC(=O)C1=NC=C(Br)C=C1 Q68117 [1,1,0,0,0,0|2,0,0]=4 305 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 Q68855 [1,1,0,0,0,0|1,0,0]=3 306 B12R1.16 CCOC(=O)C1=NN=C(O)C=C1 P43230 [1,1,0,0,0,0|2,0,0]=4 307 B12R1.16 N#CCC(=O)C1=CC=C(O)C=C1 P36522 [1,1,0,0,0,0|1,0,1]=4 308 B12R1.20 CC1=CC=C(C(=O)C(=O)O)C=C1 P36454 [1,1,0,0,0,0|2,0,0]=4 309 B12R1.20 CN(C)C(=O)C1=CC=C(Cl)C=C1 P41366 [1,1,0,0,0,0|2,0,0]=4 310 B12R1.20 CN(C)C(=O)C1=CC=C(N)C=C1 O30714 [1,1,0,0,0,0|2,0,0]=4 311 B12R1.367 CC1=CC=C(C(=O)CBr)C=C1Br M15182 [1,1,0,0,0,0|2,0,0]=4 312 B12R1.367 COC(=O)C1=CC(=O)N(C)C=C1 G-5326 [1,1,0,0,0,0|1,0,0]=3 313 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=N1 Q62410 [1,1,0,0,0,0|1,0,0]=3 314 B12R1.367 COC(=O)C1=CC(Br)=C(F)N=C1 Q52498 [1,1,0,0,0,0|2,0,0]=4 315 B12R1.367 COC(=O)C1=CC(C)=C(O)C=N1 Q55500 [1,1,0,0,0,0|1,0,0]=3 316 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)N=C1 O30060 [1,1,0,0,0,0|2,0,0]=4 317 B12R1.367 COC(=O)C1=CC(Cl)=C(C)C=N1 Q53688 [1,1,0,0,0,0|1,0,0]=3 318 B12R1.367 COC(=O)C1=CC(F)=C(Br)N=C1 O31959 [1,1,0,0,0,0|2,0,0]=4 319 B12R1.367 COC(=O)C1=CC(F)=C(Cl)N=C1 O30110 [1,1,0,0,0,0|2,0,0]=4 320 B12R1.367 COC(=O)C1=CC(I)=C(Cl)N=C1 O30656 [1,1,0,0,0,0|2,0,0]=4 321 B12R1.367 COC(=O)C1=CC(S)=C(N)C=C1 A-872 [1,1,0,0,0,0|1,0,0]=3 322 B12R1.367 COC(=O)C1=CC=C(Br)C(C)=N1 N24924 [1,1,0,0,0,0|2,0,0]=4 323 B12R1.367 COC(=O)C1=CC=C(Br)C(Cl)=C1 Q68563 [1,1,0,0,0,0|1,0,0]=3 324 B12R1.367 COC(=O)C1=CC=C(C)C(F)=C1 Q68321 [1,1,0,0,0,0|0,0,0]=2 325 B12R1.367 COC(=O)C1=CC=C(C)C(O)=C1 Q67777 [1,1,0,0,0,0|0,0,0]=2 326 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=C1 Q68119 [1,1,0,0,0,0|1,0,0]=3 327 B12R1.367 COC(=O)C1=CC=C(Cl)C(F)=C1 Q67920 [1,1,0,0,0,0|1,0,0]=3 328 B12R1.367 COC(=O)C1=CC=C(F)C(Br)=C1 P35910 [1,1,0,0,0,0|1,0,0]=3 329 B12R1.367 COC(=O)C1=CC=C(I)C(Br)=C1 P39374 [1,1,0,0,0,0|1,0,0]=3 330 B12R1.367 COC(=O)C1=CC=C(I)C(O)=C1 O31949 [1,1,0,0,0,0|1,0,0]=3 331 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 O32280 [1,1,0,0,0,0|0,0,0]=2 332 B12R1.367 COC(=O)C1=CC=C(O)C(O)=N1 G-5826 [1,1,0,0,0,0|1,0,0]=3 333 B12R1.367 COC(=O)C1=CC=C(S)C(N)=C1 H-8775 [1,1,0,0,0,0|0,1,0]=3 334 B12R1.367 COC(=O)C1=CC=C(S)C(N)=C1 K16122 [1,1,0,0,0,0|0,1,0]=3 335 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 C-3708 [1,1,0,0,0,0|1,0,1]=4 336 B12R1.367 COC(=O)C1=CN=C(C)C(Br)=C1 O34001 [1,1,0,0,0,0|1,0,0]=3 337 B12R1.367 COC(=O)C1=CN=C(C)C(C)=C1 Q68803 [1,1,0,0,0,0|1,0,0]=3 338 B12R1.367 COC(=O)C1=CN=C(C)C(N)=C1 Q52518 [1,1,0,0,0,0|1,0,0]=3 339 B12R1.367 COC(=O)C1=CN=C(Cl)C(C)=C1 N25901 [1,1,0,0,0,0|2,0,0]=4 340 B12R1.367 COC(=O)C1=CN=C(Cl)C(Cl)=C1 Q68217 [1,1,0,0,0,0|2,0,0]=4 341 B12R1.367 COC(=O)C1=CN=C(F)C(C)=C1 N24133 [1,1,0,0,0,0|2,0,0]=4 342 B12R1.367 COC(=O)C1=CN=C(I)C(O)=C1 P44343 [1,1,0,0,0,0|2,0,0]=4 343 B12R1.367 COC(=O)C1=CN=C(N)C(O)=C1 Q53133 [1,1,0,0,0,0|2,0,0]=4 344 B12R1.367 COC(=O)C1=CN=C(O)C(O)=C1 G-7788 [1,1,0,0,0,0|1,0,0]=3 345 B12R1.367 COC(=O)C1=CNC(=O)C(C)=C1 Q54997 [1,1,0,0,0,0|1,0,1]=4 346 B12R1.367 COC(=O)C1=NC(Br)=C(Cl)C=C1 O30031 [1,1,0,0,0,0|2,0,0]=4 347 B12R1.367 COC(=O)C1=NC(Br)=C(F)C=C1 O30005 [1,1,0,0,0,0|2,0,0]=4 348 B12R1.367 COC(=O)C1=NC(C)=C(C)C=C1 Q52559 [1,1,0,0,0,0|1,0,0]=3 349 B12R1.367 COC(=O)C1=NC(C)=C(F)C=C1 L14114 [1,1,0,0,0,0|2,0,0]=4 350 B12R1.367 COC(=O)C1=NC(C)=C(N)C=C1 F-4330 [1,1,0,0,0,0|2,0,0]=4 351 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 O31548 [1,1,0,0,0,0|2,0,0]=4 352 B12R1.367 COC(=O)C1=NC(I)=C(N)C=C1 O30008 [1,1,0,0,0,0|2,0,0]=4 353 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 O34344 [1,1,0,0,0,0|2,0,0]=4 354 B12R1.367 COC(=O)C1=NC(O)=C(C)C=C1 M15463 [1,1,0,0,0,0|1,0,0]=3 355 B12R1.367 COC(=O)C1=NC=C(Br)C(C)=C1 N24813 [1,1,0,0,0,0|2,0,0]=4 356 B12R1.367 COC(=O)C1=NC=C(N)C(C)=C1 G-6494 [1,1,0,0,0,0|2,0,0]=4 357 B12R1.367 COC(=O)C1=NC=C(O)C(O)=C1 G-5827 [1,1,0,0,0,0|1,0,0]=3 358 B12R1.1703 CCC(=O)C1=CC=C(F)C=C1Cl O29563 [1,1,0,0,0,0|2,0,0]=4 359 B12R1.1703 COC(=O)C1=C(Br)N=C(C)C=C1 Q62372 [1,1,0,0,0,0|1,0,0]=3 360 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=N1 Q56679 [1,1,0,0,0,0|2,0,0]=4 361 B12R1.1703 COC(=O)C1=C(Cl)C=C(F)C=C1 C-3675 [1,1,0,0,0,0|1,0,0]=3 362 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 Q57231 [1,1,0,0,0,0|2,0,0]=4 363 B12R1.1703 COC(=O)C1=C(Cl)N=C(Cl)C=C1 Q67449 [1,1,0,0,0,0|2,0,0]=4 364 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 P44959 [1,1,0,0,0,0|1,0,0]=3 365 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1Br N25439 [1,1,0,0,0,0|2,0,0]=4 366 B12R1.1703 COC(=O)C1=CC=C(Br)N=C1C O29091 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.1703 COC(=O)C1=CC=C(C)C=C1Cl Q67996 [1,1,0,0,0,0|0,0,0]=2 368 B12R1.1703 COC(=O)C1=CC=C(C)C=C1F P36301 [1,1,0,0,0,0|0,0,0]=2 369 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl O31910 [1,1,0,0,0,0|1,0,0]=3 370 B12R1.1703 COC(=O)C1=CC=C(Cl)C=C1Br P37321 [1,1,0,0,0,0|1,0,0]=3 371 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1C N25853 [1,1,0,0,0,0|2,0,0]=4 372 B12R1.1703 COC(=O)C1=CC=C(Cl)N=C1N C-2358 [1,1,0,0,0,0|2,0,0]=4 373 B12R1.1703 COC(=O)C1=CC=C(F)N=C1C N26081 [1,1,0,0,0,0|2,0,0]=4 374 B12R1.1703 COC(=O)C1=CC=C(F)N=C1F Q67310 [1,1,0,0,0,0|2,0,0]=4 375 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Br F-4587 [1,1,0,0,0,0|1,0,0]=3 376 B12R1.1703 COC(=O)C1=CC=C(N)N=C1Cl O30146 [1,1,0,0,0,0|2,0,0]=4 377 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Cl N24324 [1,1,0,0,0,0|0,0,0]=2 378 B12R1.1703 COC(=O)C1=CC=C(O)C=C1F O29247 [1,1,0,0,0,0|0,0,0]=2 379 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1C N26797 [1,1,0,0,0,0|2,0,0]=4 380 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C N26194 [1,1,0,0,0,0|2,0,0]=4 381 B12R1.1703 COC(=O)C1=CNC(=O)C=C1C Q57089 [1,1,0,0,0,0|1,0,1]=4 382 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C N24191 [1,1,0,0,0,0|2,0,0]=4 383 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1Cl O31878 [1,1,0,0,0,0|2,0,0]=4 384 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1F G-7655 [1,1,0,0,0,0|2,0,0]=4 385 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1N L13676 [1,1,0,0,0,0|2,0,0]=4 386 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1O P44325 [1,1,0,0,0,0|2,0,0]=4 387 B12R1.1703 COC(=O)C1=NC=C(C)C=C1Br O30162 [1,1,0,0,0,0|1,0,0]=3 388 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Br O31792 [1,1,0,0,0,0|2,0,0]=4 389 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1F O31157 [1,1,0,0,0,0|2,0,0]=4 390 B12R1.1703 COC(=O)C1=NC=C(F)C=C1Br O31049 [1,1,0,0,0,0|2,0,0]=4 391 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C Q54929 [1,1,0,0,0,0|2,0,0]=4 392 B12R1.1703 COC(=O)C1=NC=C(F)C=C1Cl O29980 [1,1,0,0,0,0|2,0,0]=4 393 B12R1.1703 COC(=O)C1=NC=C(F)C=C1F O30901 [1,1,0,0,0,0|2,0,0]=4 394 B12R1.1703 COC(=O)C1=NC=C(F)C=C1N Q52646 [1,1,0,0,0,0|2,0,0]=4 395 B12R1.1703 COC(=O)C1=NC=C(N)C=C1Cl O29989 [1,1,0,0,0,0|2,0,0]=4 396 B12R1.1703 COC(=O)C1=NC=C(N)C=C1F O31421 [1,1,0,0,0,0|2,0,0]=4 397 B12R1.1703 COC(=O)C1=NC=C(O)C=C1Cl O29588 [1,1,0,0,0,0|1,0,0]=3 398 B12R1.1703 COC(=O)C1=NC=C(O)C=C1F L21939 [1,1,0,0,0,0|1,0,0]=3 399 B12R1.1703 COC(=O)C1=NN=C(O)C=C1O K12460 [1,1,0,0,0,0|2,0,0]=4 400 B12R1.4 COC1=CC=C(NC(C)C)C=C1 P40746 [1,1,0,0,0,0|2,0,0]=4 401 B12R1.4 COC1=CC=C(OC(C)=O)C=C1 Q67288 [1,1,0,0,0,0|2,0,0]=4 402 B12R1.71 CNCCC1=CC=C(OC)C=C1 P38192 [1,1,0,0,0,0|1,0,1]=4 403 B12R1.71 COC1=CC=C(C#CCBr)C=C1 L19331 [1,1,0,0,0,0|1,0,1]=4 404 B12R1.71 COC1=CC=C(C#CCO)C=C1 O27972 [1,1,0,0,0,0|1,0,1]=4 405 B12R1.71 COC1=CC=C(CCCBr)C=C1 O28114 [1,1,0,0,0,0|1,0,1]=4 406 B12R1.71 COC1=CC=C(CCCI)C=C1 O28095 [1,1,0,0,0,0|1,0,1]=4 407 B12R1.71 COC1=CC=C(CCCN)C=C1 P38522 [1,1,0,0,0,0|1,0,1]=4 408 B12R1.71 COC1=CC=C(CCCO)C=C1 P37549 [1,1,0,0,0,0|1,0,1]=4 409 B12R1.71 COC1=CC=C(NCCN)C=C1 P39417 [1,1,0,0,0,0|2,0,0]=4 410 B12R1.71 COC1=CC=C(OCCN)C=C1 P37768 [1,1,0,0,0,0|2,0,0]=4 411 B12R1.71 COC1=CC=C(OCCO)C=C1 P37559 [1,1,0,0,0,0|2,0,0]=4 412 B12R1.71 COCOC1=CC=C(OC)C=C1 Q68165 [1,1,0,0,0,0|0,0,1]=3 413 B12R1.288 COCC1=CC=C(OC)C(Br)=C1 Q67879 [1,1,0,0,0,0|0,0,1]=3 414 B14R1.3 COC1=CC=C(CC(=O)C(=O)O)C=C1 O28768 [0,1,0,0,0,1|2,0,0]=4 415 B14R1.7 COC(=O)C(=O)C1=CC=C(OC)C=C1 M23245 [0,1,0,0,0,1|0,0,0]=2 416 B14R1.7 COC(=O)C(N)C1=CC=C(OC)C=C1 Q65899 [0,1,0,0,0,1|0,0,0]=2 417 B14R1.7 COC1=CC=C(C(=O)N(C)OC)C=C1 P37617 [0,1,0,0,0,1|2,0,0]=4 418 B14R1.954 C#CC1=CC=C(CC(=O)OCC)C=C1 P35587 [0,1,0,0,0,1|1,0,1]=4 419 B14R1.954 CCOC(=O)CC1=CC=C(CCl)C=C1 P36589 [0,1,0,0,0,1|2,0,0]=4 420 B14R1.954 CCOC(=O)CC1=CC=C(CN)C=C1 O31487 [0,1,0,0,0,1|2,0,0]=4 421 B14R1.954 COC1=CC=C(CC(=O)CC#N)C=C1 P42888 [0,1,0,0,0,1|1,0,1]=4 422 B14R1.954 COC1=CC=C(NC(=O)CC#N)C=C1 P37570 [0,1,0,0,0,1|1,0,1]=4 423 B14R1.2879 COC(=O)CC1=CC=C(C(=O)O)C=C1 H-8847 [0,1,0,0,0,1|2,0,0]=4 424 B14R1.8 CNC(C(=O)O)C1=CC=C(OC)C=C1 Q65842 [0,2,0,0,0,0|1,0,1]=4 425 B14R1.141 CCOC1=CC=C(C(=O)C(=O)O)C=C1 P36545 [0,2,0,0,0,0|2,0,0]=4 426 B14R1.3652 COC1=CC=C(C(=O)N(C)C)C=C1N P34846 [0,2,0,0,0,0|1,0,0]=3 427 B14R1.487 CCOC1=CC=C(C(=O)OC)C(Cl)=C1 N27196 [0,2,0,0,0,0|0,0,0]=2 428 B14R1.487 CCOC1=CC=C(C(=O)OC)C(Cl)=N1 N26714 [0,2,0,0,0,0|1,0,0]=3 429 B14R1.579 COC(=O)C1=C(C)C=C(OC)C=C1C Q68244 [0,2,0,0,0,0|0,0,0]=2 430 B14R1.579 COC(=O)C1=C(Cl)C=C(SC)C=C1Cl Q68510 [0,2,0,0,0,0|0,1,0]=3 431 B14R1.579 COC(=O)C1=C(F)C=C(OC)C=C1F N25644 [0,2,0,0,0,0|0,0,0]=2 432 B14R1.1128 COC(=O)C1=C(C)C=C(B(O)O)C=C1 L21621 [0,2,0,0,0,0|2,0,0]=4 433 B14R1.1128 COC(=O)C1=CC=C(B(O)O)C=C1Cl Q66718 [0,2,0,0,0,0|2,0,0]=4 434 B14R1.1128 COC(=O)C1=CC=C(B(O)O)C=C1F P37786 [0,2,0,0,0,0|2,0,0]=4 435 B14R1.1128 COC(=O)C1=CC=C([N+](=O)[O-])C=C1O O34398 [0,2,0,0,0,0|2,0,0]=4 436 B14R1.2294 COC(=O)C1=CC(Cl)=C(OC)C=C1F N27215 [0,2,0,0,0,0|0,0,0]=2 437 B14R1.2294 COC(=O)C1=CC(F)=C(OC)N=C1Cl C-3370 [0,2,0,0,0,0|1,0,0]=3 438 B14R1.2316 COC(=O)C1=C(F)C(Cl)=C(OC)C=C1 N27596 [0,2,0,0,0,0|0,0,0]=2 439 B14R1.2316 COC(=O)C1=CC=C(OC)C(F)=C1F Q68739 [0,2,0,0,0,0|0,0,0]=2 440 B14R1.2334 COC(=O)C1=CC=C(OC)C=C1OC Q68374 [0,2,0,0,0,0|0,0,0]=2 441 B14R1.2334 COC(=O)C1=CC=C(OC)N=C1OC N24997 [0,2,0,0,0,0|1,0,0]=3 442 B14R1.7234 CCOC(=O)C1=CC=C(OC)C=C1F N24196 [0,2,0,0,0,0|0,0,0]=2 443 B14R1.25 CCOC(=O)C1=CC=C(CCN)C=C1 P36861 [0,2,0,0,0,0|1,0,0]=3 444 B14R1.25 CCOC(=O)C1=CC=C(N=C=S)C=C1 M15765 [0,2,0,0,0,0|1,0,1]=4 445 B14R1.65 CCCOC1=CC=C(C(=O)C=O)C=C1 P34740 [0,2,0,0,0,0|2,0,0]=4 446 B14R1.65 COC(=O)C1=CC=C(CCCN)C=C1 O29273 [0,2,0,0,0,0|1,0,0]=3 447 B14R1.65 COC(=O)C1=CC=C(OCCN)C=C1 Q65843 [0,2,0,0,0,0|0,0,0]=2 448 B14R1.717 COC(=O)C1=CC=C(CC(=O)O)C=C1 M15792 [0,2,0,0,0,0|1,0,1]=4 449 B14R1.718 COC(=O)C1=CC=C(C(=O)CBr)C=C1 O28107 [0,2,0,0,0,0|1,0,0]=3 450 B14R1.718 COC(=O)C1=CN=C(C(=O)OC)N=C1 Q52833 [0,2,0,0,0,0|2,0,0]=4 451 B14R1.2 COC1=CC=C(C(=O)CC(C)=O)C=C1 P38254 [0,2,0,0,0,0|1,0,0]=3 452 B14R1.610 CCOC(=O)C1=CC=C(C(C)=O)C=C1 P38396 [0,2,0,0,0,0|1,0,0]=3 453 B14R1.628 CCOC(=O)C1=CC=C(CBr)C(Cl)=C1 P41638 [0,2,0,0,0,0|2,0,0]=4 454 B14R1.628 CCOC(=O)C1=CC=C(CBr)C(F)=C1 P35709 [0,2,0,0,0,0|2,0,0]=4 455 B14R1.628 CCOC(=O)C1=CC=C(OC)C(Br)=N1 F-4405 [0,2,0,0,0,0|1,0,0]=3 456 B14R1.926 COC1=CC=C(C(=O)NCC#N)C=C1 P39594 [0,2,0,0,0,0|1,0,0]=3 457 B14R1.719 COC(=O)C1=CC=C(C(C)(F)F)C=C1 P43270 [0,2,0,0,0,0|1,0,0]=3 458 B14R1.719 COC(=O)C1=NC=C(S(C)(=O)=O)C=C1 Q69924 [0,2,0,0,0,0|1,1,0]=4 459 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(C)=C1 N25453 [0,2,0,0,0,0|2,0,0]=4 460 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(Cl)=C1 Q66652 [0,2,0,0,0,0|2,0,0]=4 461 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(F)=C1 Q66312 [0,2,0,0,0,0|2,0,0]=4 462 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(N)=C1 Q66340 [0,2,0,0,0,0|2,0,0]=4 463 B14R1.747 COC(=O)C1=CC=C(B(O)O)C(N)=C1 Q69640 [0,2,0,0,0,0|2,0,0]=4 464 B14R1.747 COC(=O)C1=CC=C(C(=O)O)C(N)=C1 M15084 [0,2,0,0,0,0|2,0,0]=4 465 B14R1.1864 COC(=O)C1=CC=C(C#N)C(CBr)=C1 O30428 [0,2,0,0,0,0|2,0,0]=4 466 B14R1.1864 COC(=O)C1=CC=C(CBr)C(OC)=C1 M23304 [0,2,0,0,0,0|2,0,0]=4 467 B14R1.1864 COC(=O)C1=CC=C(CO)C(OC)=C1 H-8085 [0,2,0,0,0,0|2,0,0]=4 468 B14R1.1864 COC1=CC=C(C(=O)CBr)C=C1OC O31184 [0,2,0,0,0,0|2,0,0]=4 469 B14R1.1864 COC1=CC=C(C(=O)CN)C=C1OC P37076 [0,2,0,0,0,0|2,0,0]=4 470 B14R1.12512 COC(=O)C1=CC(Cl)=C(OC)C(Cl)=C1 Q68015 [0,2,0,0,0,0|0,0,0]=2 471 B12R1.24 COC(=O)C1=CC=CN(C)C1=O L14065 [0,0,1,1,0,0|2,0,0]=4 472 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 Q66655 [0,0,1,1,0,0|2,0,0]=4 473 B12R2.612 NC1=CC=C2C(=O)NCC2=C1 C-2439 [1,0,0,1,0,0|2,0,0]=4 474 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 O31598 [1,0,0,1,0,0|2,0,0]=4 475 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 P51039 [1,0,0,1,0,0|2,0,0]=4 476 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 O32491 [1,0,0,1,0,0|2,0,0]=4 477 B12R2.612 O=C1NCC2=C1C=CC(I)=C2 M15861 [1,0,0,1,0,0|2,0,0]=4 478 B12R2.612 O=C1NCC2=CC(Br)=CC=C12 D-2558 [1,0,0,1,0,0|2,0,0]=4 479 B12R2.612 O=C1OCC2=CC(Cl)=NC=C12 L21981 [1,0,0,1,0,0|2,0,0]=4 480 B12R2.612 OB1OCC2=C1C=CC(O)=C2 L14767 [1,0,0,1,0,0|1,0,1]=4 481 B12R2.44 COC1=CC2=C(C=C1)CNC2 M15507 [1,0,0,1,0,0|1,0,1]=4 482 B12R2.44 COC1=CC2=C(C=C1)NCC2 P39671 [1,0,0,1,0,0|2,0,0]=4 483 B12R2.44 COC1=CC=C2C=NNC2=C1 C-2107 [1,0,0,1,0,0|2,0,0]=4 484 B14R2.3274 COC1=CC2=C(C=C1)SC(C)=[N+]2C L20949 [0,0,0,1,0,1|2,0,0]=4 485 B14R2.1815 COC1=CC2=C(C=C1)C(=O)C(=O)N2 P50973 [0,1,0,1,0,0|2,0,0]=4 486 B14R2.152 COC1=CC2=C(C=C1)C(C=O)=NN2 O30014 [0,1,0,1,0,0|2,0,0]=4 487 B14R2.1801 COC1=CC2=C(C=C1)C(=O)N=CN2 O32266 [0,1,0,1,0,0|1,0,1]=4 488 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NC=C2 M15543 [0,1,0,1,0,0|1,0,1]=4 489 B14R2.1801 COC1=CC2=C(C=C1)C(=O)NCC2 O32784 [0,1,0,1,0,0|1,0,0]=3 490 B14R2.966 COC(=O)C1=CC2=C(C=C1)CCN2 P51369 [0,1,0,1,0,0|1,0,0]=3 491 B14R2.966 COC(=O)C1=CC2=C(C=C1)CNC2 O33545 [0,1,0,1,0,0|1,0,0]=3 492 B14R2.966 COC(=O)C1=CC2=C(C=C1)N=CS2 A-867-1 [0,1,0,1,0,0|1,0,1]=4 493 B14R2.966 COC(=O)C1=CC2=C(C=C1)NCC2 O32267 [0,1,0,1,0,0|1,0,0]=3 494 B14R2.966 COC(=O)C1=CC=C2C=COC2=C1 O31362 [0,1,0,1,0,0|1,0,1]=4 495 B14R2.966 COC(=O)C1=CC=C2C=NNC2=C1 C-2023 [0,1,0,1,0,0|2,0,0]=4 496 B14R2.966 COC(=O)C1=CC=C2NC=CC2=C1 C-3317 [0,1,0,1,0,0|1,0,1]=4 497 B14R2.966 COC(=O)C1=CC=C2NN=CC2=C1 C-2010 [0,1,0,1,0,0|1,0,1]=4 498 B14R2.966 COC(=O)C1=CN=C2OC=CC2=C1 Q55627 [0,1,0,1,0,0|1,0,1]=4 499 B14R2.326 COC1=CC=C(C2(N)COC2)C=C1 P48794 [0,1,0,1,0,0|1,0,1]=4 500 B14R2.1812 COC1=CC2=C(C=C1)C(=O)NC2=O M15568 [0,1,0,1,0,0|1,0,1]=4 501 B14R2.5719 O=C(O)C1=CC=C2C(=O)OCC2=C1 L13806 [0,1,0,1,0,0|2,0,0]=4 502 B10R1.31 CCC1=CC=C(C(=O)O)S1 Q68130 [1,0,0,0,1,0|2,0,0]=4 503 B10R1.31 COC1=CSC(C(=O)O)=C1 O30204 [1,0,0,0,1,0|1,0,0]=3 504 B10R1.14 COC(=O)C1=CC(Br)=CS1 G-5587 [1,0,0,0,1,0|2,0,0]=4 505 B10R1.14 COC(=O)C1=CC(Cl)=CN1 Q53057 [1,0,0,0,1,0|2,0,0]=4 506 B10R1.14 COC(=O)C1=CC(Cl)=CS1 L22458 [1,0,0,0,1,0|2,0,0]=4 507 B10R1.14 COC(=O)C1=CC=C(Br)N1 O30342 [1,0,0,0,1,0|2,0,0]=4 508 B10R1.14 COC(=O)C1=CC=C(Br)S1 G-5588 [1,0,0,0,1,0|2,0,0]=4 509 B10R1.14 COC(=O)C1=CC=C(N)O1 G-7080 [1,0,0,0,1,0|2,0,0]=4 510 B10R1.14 COC(=O)C1=CN(C)C=N1 O30861 [1,0,0,0,1,0|2,0,0]=4 511 B10R1.14 COC(=O)C1=CNC(Br)=C1 A-983 [1,0,0,0,1,0|2,0,0]=4 512 B10R1.14 COC(=O)C1=CSC(C)=N1 O34523 [1,0,0,0,1,0|2,0,0]=4 513 B10R1.14 COC(=O)C1=CSC(Cl)=C1 G-6180 [1,0,0,0,1,0|2,0,0]=4 514 B10R1.14 COC(=O)C1=NC=C(C)O1 L13687 [1,0,0,0,1,0|2,0,0]=4 515 B10R1.14 COC(=O)C1=NN(C)C=C1 K12251 [1,0,0,0,1,0|2,0,0]=4 516 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 P40728 [1,0,0,0,0,1|2,0,0]=4 517 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 O31002 [1,0,0,0,0,1|2,0,0]=4 518 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 P37023 [1,0,0,0,0,1|2,0,0]=4 519 B12R1.49 COC(=O)CC1=CC=C(Br)N=C1 Q53249 [1,0,0,0,0,1|2,0,0]=4 520 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 P39469 [1,0,0,0,0,1|0,0,0]=2 521 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 I-9270 [1,0,0,0,0,1|2,0,0]=4 522 B12R1.435 C#CC1=CC(C(=O)OC)=CC=C1 O27992 [0,0,0,0,1,1|1,0,1]=4 523 B12R1.435 CCC1=CC(C(=O)OC)=CC=C1 O29108 [0,0,0,0,1,1|1,0,0]=3 524 B12R1.435 COC(=O)C1=CC(C#N)=CN=C1 O30362 [0,0,0,0,1,1|2,0,0]=4 525 B12R1.435 COC(=O)C1=CC(C=O)=NC=C1 Q62391 [0,0,0,0,1,1|2,0,0]=4 526 B12R1.435 COC(=O)C1=CC(CBr)=CN=C1 O29810 [0,0,0,0,1,1|2,0,0]=4 527 B12R1.435 COC(=O)C1=CC(CN)=CN=C1 Q62201 [0,0,0,0,1,1|2,0,0]=4 528 B12R1.435 COC(=O)C1=CC(CN)=NC=C1 Q52672 [0,0,0,0,1,1|2,0,0]=4 529 B12R1.435 COC(=O)C1=CC(OC)=CN=C1 N24812 [0,0,0,0,1,1|0,0,0]=2 530 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 Q67738 [0,0,0,0,1,1|0,0,0]=2 531 B12R1.435 COC(=O)C1=CC=NC(CN)=C1 Q58189 [0,0,0,0,1,1|2,0,0]=4 532 B12R1.435 COC(=O)C1=CN=CC(C=O)=C1 L18320 [0,0,0,0,1,1|2,0,0]=4 533 B12R1.435 COC(=O)C1=NC(OC)=CC=C1 Q67562 [0,0,0,0,1,1|1,0,0]=3 534 B12R1.435 COC(=O)C1=NC(SC)=NC=C1 O30627 [0,0,0,0,1,1|1,1,0]=4 535 B12R1.435 COC(=O)C1=NC=CC(C#N)=C1 O30017 [0,0,0,0,1,1|2,0,0]=4 536 B12R1.435 COC(=O)C1=NC=CC(C=O)=C1 Q62439 [0,0,0,0,1,1|2,0,0]=4 537 B12R1.435 COC(=O)C1=NC=CC(CCl)=C1 L14626 [0,0,0,0,1,1|2,0,0]=4 538 B12R1.435 COC(=O)C1=NC=CC(CN)=C1 Q62200 [0,0,0,0,1,1|2,0,0]=4 539 B12R1.435 COC(=O)C1=NC=CC(CO)=C1 Q62324 [0,0,0,0,1,1|2,0,0]=4 540 B12R1.435 COC1=CC(C(=O)CBr)=NC=C1 O29941 [0,0,0,0,1,1|2,0,0]=4 541 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 P39449 [0,0,0,0,1,1|2,0,0]=4 542 B14R1.5 COC(=O)COC1=CC=C(C=O)C=C1 P36364 [0,0,0,0,0,2|2,0,0]=4 543 B14R1.5 COC1=CC=C(CNC(=O)CCl)C=C1 P35940 [0,0,0,0,0,2|2,0,0]=4