0 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 O27991 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 O27944 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.3 CC(N)C1=CC=C(C#N)C=C1 P35710 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.3 CC(N)C1=CC=C(CO)C=C1 P38103 [0,0,0,0,0,0|1,0,0]=1 6 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 P37663 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.3 CCC1=CC=C(C(C)=O)C=N1 Q53712 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [0,0,0,0,0,0|2,0,0]=2 9 B11R1.3 CCC1=CC=C(C(C)O)C=C1 M22873 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.3 CN(C)C1=CC=C(CN)C=C1 P40156 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.3 CN(C)C1=CC=C(CO)C=C1 O28119 [0,0,0,0,0,0|1,0,0]=1 12 B11R1.3 CN(C)C1=CN=C(C=O)C=C1 O29290 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.3 CN(C)C1=CN=C(CN)N=C1 Q56481 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.3 CN(C)C1=NC=C(C=O)C=C1 N24653 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.3 CN(C)C1=NC=C(CCl)C=C1 L19285 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.3 CN(C)C1=NC=C(CN)C=N1 Q58767 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.3 CN(C)C1=NC=C(CO)C=C1 Q67746 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.3 CN(C)C1=NC=C(CO)C=N1 Q68446 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.3 CNC1=CC=C(N(C)C)C=C1 P37575 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.3 COC1=CN=C([C@@H](C)N)C=C1 Q62470 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.3 NCC1=CC=C(B(O)O)C=C1 O30152 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.3 NCC1=CC=C(C(F)F)C=N1 Q54431 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 O28757 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 P50970 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 P44354 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [0,0,0,0,0,0|2,1,1]=4 27 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 G-6969 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.3 OCC1=CC=C(C(F)F)N=C1 P44756 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.3 OCC1=NC=C(B(O)O)C=C1 N25937 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.3 C#CC1=CC=C(CN)C=C1 O28144 [1,0,0,0,0,0|1,0,2]=4 31 B10R1.3 C#CC1=CC=C(CO)C=C1 O28046 [1,0,0,0,0,0|0,0,2]=3 32 B10R1.3 C#CC1=CC=C(NC)C=C1 M22819 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.3 CCC1=CC=C(CO)C=C1 Q68223 [1,0,0,0,0,0|0,0,0]=1 34 B10R1.3 CCC1=CN=C(CN)N=C1 Q52379 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.3 CCC1=NC=C(C=O)C=C1 Q60469 [1,0,0,0,0,0|1,0,2]=4 36 B10R1.3 CCC1=NC=C(CN)C=N1 Q58768 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.3 CNC1=CC=C(CO)C=C1 P40364 [1,0,0,0,0,0|1,0,0]=2 38 B10R1.3 COC1=CC=C(CBr)C=C1 Q67503 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.3 COC1=CC=C(CBr)C=N1 N25219 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.3 COC1=CC=C(CN)N=C1 Q52335 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.3 COC1=CC=C(NN)C=C1 P43291 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.3 COC1=CN=C(CCl)C=C1 L13052 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.3 COC1=CN=C(CO)C=C1 I-9706 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.3 COC1=NC=C(CN)C=C1 C-3721 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.3 COC1=NC=C(CN)C=C1 G-6806 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.3 COC1=NC=C(CO)C=C1 C-3532 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.3 COC1=NC=C(CO)C=N1 L14377 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.3 CSC1=CC=C(NN)C=C1 O30693 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.3 CSC1=NC=C(CO)C=C1 N25545 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.3 N#CC1=CC=C(CN)C=C1 P42878 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.3 N#CC1=CC=C(CO)C=C1 P35569 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.3 N#CC1=NC=C(CO)C=C1 P43240 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.3 NCC1=CC=C(CBr)C=C1 P38676 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.3 NCC1=CC=C(CO)C=C1 P38312 [1,0,0,0,0,0|1,0,0]=2 55 B10R1.3 O=CC1=CC=C(CCl)C=C1 P45270 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.3 O=CC1=CC=C(CO)C=C1 P37667 [1,0,0,0,0,0|1,0,1]=3 57 B10R1.3 OCC1=CC=C(CBr)C=C1 O28910 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.3 OCC1=CC=C(CCl)C=C1 P40748 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.13 CC(=O)C1=CN=C(C)C=C1 M15462 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.13 CC(=O)C1=NC=C(C)C=C1 O31151 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 P51612 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 CC(Br)C1=CC=C(Cl)C=C1 M23061 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.13 CC(C)C1=CN=C(N)C=C1 O34069 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.13 CC(C)C1=CN=C(N)N=C1 Q52535 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.13 CC(C)C1=NC=C(Br)C=N1 L21812 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.13 CC(C)C1=NC=C(N)C=C1 G-7522 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.13 CC(C)C1=NN=C(Br)C=C1 P51559 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 P36954 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.13 CC(N)C1=NC=C(F)C=C1 C-3369 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.13 CC(O)C1=CC=C(Cl)N=C1 P39514 [1,0,0,0,0,0|3,0,0]=4 71 B10R1.13 CC(O)C1=CC=C(N)C=C1 P41199 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.13 CC(O)C1=CC=C(O)C=C1 P39467 [1,0,0,0,0,0|1,0,0]=2 73 B10R1.13 CC(O)C1=CN=C(Br)C=C1 N26195 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.13 CC1=CC=C(C(C)Br)C=C1 M23020 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.13 CC1=CC=C(C(C)O)C=N1 P43130 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.13 CN(C)C1=CC=C(Br)N=C1 O30431 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.13 CN(C)C1=NC=C(Br)C=C1 P39265 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.13 CN(C)C1=NC=C(I)C=C1 N26187 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.13 CN(C)C1=NC=C(N)C=C1 I-9568 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.13 C[C@@H](O)C1=CC=C(Br)N=C1 Q64116 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.13 C[C@@H](O)C1=NC=C(Br)C=C1 Q62335 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 O32464 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.13 C[C@H](O)C1=CC=C(Br)N=C1 Q64115 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.13 C[C@H](O)C1=NC=C(Br)C=C1 Q62334 [1,0,0,0,0,0|3,0,0]=4 85 B10R1.13 FC(F)C1=CC=C(Br)C=C1 P37690 [1,0,0,0,0,0|3,0,0]=4 86 B10R1.13 NC1=CC=C(C(F)F)C=C1 M23361 [1,0,0,0,0,0|3,0,0]=4 87 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 P35874 [0,1,0,0,0,0|3,0,0]=4 88 B12R1.5 CCC(O)C1=CC=C(OC)C=C1 P37583 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 Q68222 [0,1,0,0,0,0|2,0,1]=4 90 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 O28734 [0,1,0,0,0,0|2,0,1]=4 91 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 Q57226 [0,1,0,0,0,0|2,0,1]=4 92 B12R1.5 COC1=CC=C(C(N)CO)C=C1 P41432 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.5 COC1=CC=C(C(O)CN)C=C1 P37470 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 P43091 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 P40188 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.6 C#CC1=CC=C(C(C)(C)C)C=C1 P36137 [0,1,0,0,0,0|1,0,1]=3 97 B12R1.6 CC(C)(C)C1=CN=C(C=O)C=C1 Q60432 [0,1,0,0,0,0|1,0,2]=4 98 B12R1.6 CC(C)(O)C1=CC=C(C=O)C=C1 O29856 [0,1,0,0,0,0|0,0,2]=3 99 B12R1.6 CC(F)(F)C1=CC=C(C#N)C=C1 P43246 [0,1,0,0,0,0|2,0,1]=4 100 B12R1.6 COC1=CC=C(C(C)(C)N)C=C1 P42415 [0,1,0,0,0,0|2,0,0]=3 101 B12R1.6 CS(=O)(=O)C1=CC=C(CBr)C=C1 O34513 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 P38076 [0,1,0,0,0,0|3,0,0]=4 103 B12R1.48 CC(C)C1=CC=C(C=O)C(Br)=C1 N25017 [0,1,0,0,0,0|0,0,2]=3 104 B12R1.48 CC(C)C1=CC=C(C=O)C(Cl)=N1 N26173 [0,1,0,0,0,0|1,0,2]=4 105 B12R1.48 CC(C)C1=NC(=N)C(CN)=CN1 Q58549 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.48 CC1=CC(B(O)O)=CC=C1CO Q66686 [0,1,0,0,0,0|3,0,0]=4 107 B12R1.48 CC1=CC([N+](=O)[O-])=CC=C1CO P39598 [0,1,0,0,0,0|3,0,0]=4 108 B12R1.48 CN(C)C1=CC=C(C=O)C(O)=C1 M15561 [0,1,0,0,0,0|1,0,2]=4 109 B12R1.48 COC1=CC=C(C(C)C)C=C1Br Q67537 [0,1,0,0,0,0|2,0,0]=3 110 B12R1.48 NC1=CC([N+](=O)[O-])=CC=C1CO P36068 [0,1,0,0,0,0|3,0,0]=4 111 B12R1.48 O=[N+]([O-])C1=CC=C(CO)C(Cl)=C1 O28090 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.48 OCC1=C(Cl)C=C(B(O)O)C=C1 N25885 [0,1,0,0,0,0|3,0,0]=4 113 B12R1.48 OCC1=C(F)C=C(B(O)O)C=C1 N25203 [0,1,0,0,0,0|3,0,0]=4 114 B12R1.113 CC(C)C1=NC=C(CCN)C=N1 Q58666 [0,1,0,0,0,0|3,0,0]=4 115 B12R1.113 CCOC1=CC=C(C(C)N)C=C1 P42866 [0,1,0,0,0,0|2,0,0]=3 116 B12R1.113 CN(C)C1=CC=C(CCN)C=C1 M23131 [0,1,0,0,0,0|2,0,0]=3 117 B12R1.113 CNCC1=CC=C(N(C)C)C=C1 P35884 [0,1,0,0,0,0|2,0,0]=3 118 B12R1.113 COCC1=CC=C(C(=O)O)C=C1 P36718 [0,1,0,0,0,0|2,0,1]=4 119 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 O30369 [0,1,0,0,0,0|3,0,0]=4 120 B12R1.256 CC(=O)C1=CN=C(C(C)C)C=C1 H-8735 [0,1,0,0,0,0|1,0,2]=4 121 B12R1.256 CC(C)C1=CN=C(C(=O)O)C=C1 K12257 [0,1,0,0,0,0|1,0,1]=3 122 B12R1.256 CC(C)C1=CN=C(C(C)C)C=N1 O32041 [0,1,0,0,0,0|3,0,0]=4 123 B12R1.256 CC(C)C1=NC=C(B(O)O)C=N1 Q52008 [0,1,0,0,0,0|3,0,0]=4 124 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 O28758 [0,1,0,0,0,0|1,0,1]=3 125 B12R1.256 CC(N)C1=CC=C([N+](=O)[O-])C=C1 P38148 [0,1,0,0,0,0|2,0,1]=4 126 B12R1.256 CC(O)C1=CC=C(N(C)C)C=C1 P37588 [0,1,0,0,0,0|1,0,0]=2 127 B12R1.256 CC(O)C1=CC=C([N+](=O)[O-])C=C1 Q65977 [0,1,0,0,0,0|2,0,1]=4 128 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 Q66458 [0,1,0,0,0,0|2,0,0]=3 129 B12R1.256 CN(C)C1=CC=C(B(O)O)C=C1 Q67403 [0,1,0,0,0,0|2,0,0]=3 130 B12R1.256 CN(C)C1=CC=C(C(=O)O)C=N1 P35906 [0,1,0,0,0,0|2,0,1]=4 131 B12R1.256 CN(C)C1=CN=C(C(=O)O)C=C1 Q60887 [0,1,0,0,0,0|2,0,1]=4 132 B12R1.256 CN(C)C1=NC=C(B(O)O)C=C1 N24330 [0,1,0,0,0,0|3,0,0]=4 133 B12R1.256 O=C(O)C1=CC=C(C(F)F)C=C1 P37424 [0,1,0,0,0,0|2,0,1]=4 134 B12R1.452 CC1=CC(CO)=CC=C1B(O)O Q67112 [0,1,0,0,0,0|3,0,0]=4 135 B12R1.452 CN(C)C1=CC=C(C=O)C=C1Br O32775 [0,1,0,0,0,0|1,0,2]=4 136 B12R1.452 COC1=CC=C(C(C)C)C(F)=C1 C-3733 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.452 COC1=CC=C(C(C)O)C(F)=C1 N25311 [0,1,0,0,0,0|3,0,0]=4 138 B12R1.452 NC1=C([N+](=O)[O-])C=CC(CO)=C1 Q53461 [0,1,0,0,0,0|3,0,0]=4 139 B12R1.452 O=[N+]([O-])C1=CC=C(CO)C=C1Cl O28016 [0,1,0,0,0,0|3,0,0]=4 140 B12R1.452 O=[N+]([O-])C1=CC=C(CO)C=C1F O28042 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.452 OCC1=CC=C(B(O)O)C(F)=C1 N24509 [0,1,0,0,0,0|3,0,0]=4 142 B12R2.9 COC1=NC=C(C2CC2)C=C1 N27275 [0,0,0,1,0,0|3,0,0]=4 143 B12R2.9 O=CC1=CC=C(C2CC2)C=C1 O28320 [0,0,0,1,0,0|0,0,2]=3 144 B12R2.9 OCC1=CC=C(C2CC2)C=C1 O28315 [0,0,0,1,0,0|0,0,0]=1 145 B10R1.31 CC(C)C1=NC(CCl)=CS1 O30430 [0,0,0,0,1,0|3,0,0]=4 146 B10R1.31 CC(C)C1=NC(CN)=CS1 O30461 [0,0,0,0,1,0|3,0,0]=4 147 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 P39368 [0,0,0,0,0,1|2,0,1]=4 148 B12R1.4 CC(C)OC1=CC=C(CN)C=C1 O30894 [0,0,0,0,0,1|1,0,0]=2 149 B12R1.4 CC(C)OC1=CN=C(C=O)C=C1 Q60411 [0,0,0,0,0,1|1,0,2]=4 150 B12R1.4 CC(C)OC1=NC=C(C=O)C=C1 N24814 [0,0,0,0,0,1|1,0,2]=4 151 B12R1.4 CC(C)OC1=NC=C(CCl)C=C1 L18936 [0,0,0,0,0,1|2,0,0]=3 152 B12R1.4 CC(C)OC1=NC=C(CCl)C=C1 O30910 [0,0,0,0,0,1|2,0,0]=3 153 B12R1.4 CN(C)CC1=CC=C(C=O)C=C1 M23206 [0,0,0,0,0,1|1,0,2]=4 154 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 P38663 [0,0,0,0,0,1|2,0,0]=3 155 B12R1.4 COC1=CC=C(NC(C)C)C=C1 P40746 [0,0,0,0,0,1|2,0,0]=3 156 B9R1.1 CC1=CC=C(CN)C=N1 C-3518 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.1 CC1=CC=C(CO)C=N1 H-8186 [2,0,0,0,0,0|1,0,0]=3 158 B9R1.1 CC1=CN=C(CO)C=C1 N24952 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.1 CC1=CN=C(CO)N=C1 G-6318 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.1 CC1=NC=C(CO)C=N1 A-728 [2,0,0,0,0,0|2,0,0]=4 161 B9R1.1 CCC1=CC=C(Br)N=C1 Q57112 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.1 CCC1=CC=C(Cl)N=C1 Q57111 [2,0,0,0,0,0|2,0,0]=4 163 B9R1.1 CCC1=CC=C(N)C=N1 A-656 [2,0,0,0,0,0|2,0,0]=4 164 B9R1.1 CCC1=NC=C(Br)C=C1 G-6695 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.1 CNC1=CC=C(I)C=C1 P37124 [2,0,0,0,0,0|2,0,0]=4 166 B9R1.1 CNC1=CC=C(N)C=C1 P37009 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.1 CNC1=CC=C(O)C=C1 P41056 [2,0,0,0,0,0|1,0,0]=3 168 B9R1.1 COC1=NC=C(C)C=C1 Q67071 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.1 COC1=NC=C(O)C=C1 Q67584 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.1 CSC1=NC=C(C)C=C1 N24295 [2,0,0,0,0,0|2,0,0]=4 171 B9R1.1 NC1=NC=C(CO)C=C1 E-3098 [2,0,0,0,0,0|2,0,0]=4 172 B9R1.1 NCC1=CC=C(I)C=C1 P38306 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.1 NCC1=CC=C(O)C=N1 O29328 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.1 NCC1=CC=C(O)C=N1 O31467 [2,0,0,0,0,0|2,0,0]=4 175 B9R1.1 OCC1=CC=C(Br)N=C1 O34239 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.1 OCC1=CC=C(F)N=C1 O30867 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.1 OCC1=CC=C(S)C=C1 O32480 [2,0,0,0,0,0|1,0,0]=3 178 B9R1.1 OCC1=NC=C(Cl)C=C1 N24430 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.1 OCC1=NC=C(F)C=C1 C-3467 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.6 CC(C)C1=NC=CC=C1 C-3354 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.6 CC(N)C1=CC=NC=C1 P37797 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.6 CC(N)C1=NC=CC=C1 P38151 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Q53046 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.6 C[C@@H](N)C1=CN=CC=C1 Q54675 [2,0,0,0,0,0|2,0,0]=4 185 B11R1.83 CCC1=CC=C(CCN)C=C1 P36862 [1,1,0,0,0,0|1,0,0]=3 186 B11R1.83 CCC1=CC=C(CNC)C=C1 P37356 [1,1,0,0,0,0|1,0,0]=3 187 B11R1.83 CCNC1=CC=C(CC)C=C1 P37885 [1,1,0,0,0,0|1,0,0]=3 188 B11R1.83 CCNC1=CC=C(OC)C=C1 P42858 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.83 CCOC1=CC=C(CBr)C=C1 P39282 [1,1,0,0,0,0|1,0,0]=3 190 B11R1.83 CCOC1=CN=C(CBr)C=C1 Q62401 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.83 CCOC1=CN=C(CCl)C=C1 Q62400 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.83 CNCC1=CC=C(C#N)C=C1 P38675 [1,1,0,0,0,0|1,0,1]=4 193 B11R1.83 CNCC1=CC=C(CN)C=C1 P38885 [1,1,0,0,0,0|1,0,0]=3 194 B11R1.83 COC1=CC=C(CCBr)C=C1 P41235 [1,1,0,0,0,0|2,0,0]=4 195 B11R1.83 COC1=CC=C(CNN)C=C1 C-3256 [1,1,0,0,0,0|2,0,0]=4 196 B11R1.83 COCC1=CC=C(C=O)C=C1 N25868 [1,1,0,0,0,0|0,0,2]=4 197 B11R1.83 COCC1=CC=C(CO)C=C1 M23214 [1,1,0,0,0,0|0,0,0]=2 198 B11R1.279 BrCC1=CC=C(CBr)C(I)=C1 Q69582 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.279 CCC1=CC=C(OC)C=C1N O30194 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.279 COC1=C(Cl)C=C(CO)C=N1 Q67576 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.279 COC1=CC(C)=C(CO)C=N1 N26452 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.279 COC1=CC=C(CBr)C=C1Br N25169 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.279 COC1=CC=C(CO)C(Br)=C1 N24390 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.279 COC1=CC=C(CO)C(C)=C1 N24982 [1,1,0,0,0,0|1,0,0]=3 205 B11R1.279 COC1=CC=C(CO)C(C)=N1 Q67841 [1,1,0,0,0,0|2,0,0]=4 206 B11R1.279 COC1=CC=C(CO)C(Cl)=C1 N25365 [1,1,0,0,0,0|1,0,0]=3 207 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 N26191 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.279 COC1=CC=C(CO)C(F)=C1 P38219 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.279 COC1=CC=C(CO)C(O)=C1 N24302 [1,1,0,0,0,0|1,0,0]=3 210 B11R1.279 COC1=CC=C(CO)C=C1Br Q67814 [1,1,0,0,0,0|1,0,0]=3 211 B11R1.279 COC1=CC=C(CO)C=C1C Q67936 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.279 COC1=CC=C(CO)C=C1Cl Q67888 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.279 COC1=CC=C(CO)C=C1F Q65952 [1,1,0,0,0,0|1,0,0]=3 214 B11R1.279 COC1=CN=C(CO)C=C1O O31707 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.279 COC1=NC=C(CO)C=C1Br N25984 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.279 COC1=NC=C(CO)C=C1C N26256 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.279 CSC1=C(F)C=C(CO)C=C1 N25670 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.279 CSC1=NC=C(CO)C=C1C N26334 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.279 ClCC1=CC=C(CCl)C(I)=C1 Q69779 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.279 FC1=CC(CCl)=CC=C1CCl Q69781 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.279 N#CC1=CC=C(CO)C=C1F Q67913 [1,1,0,0,0,0|1,0,1]=4 222 B11R1.279 OCC1=CC=C(CO)C(I)=C1 Q69581 [1,1,0,0,0,0|1,0,0]=3 223 B11R1.19 CC(C)(C)C1=CC=C(Br)N=C1 P49742 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.19 CC(C)(C)C1=CC=C(N)N=C1 Q52925 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.19 CC(C)(C)C1=CN=C(Cl)C=C1 P49958 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.19 CC(C)(C)C1=CNC(=O)C=C1 Q52705 [1,1,0,0,0,0|1,0,1]=4 227 B11R1.19 CC(C)(C)C1=NC=C(O)C=N1 Q62954 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P40451 [1,1,0,0,0,0|1,0,0]=3 229 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 P42464 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 P40452 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 O30550 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 P42234 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.19 CC(C)(N)C1=NC=C(F)C=C1 Q69598 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 P39871 [1,1,0,0,0,0|1,0,0]=3 235 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 Q53407 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.19 CC(C)(O)C1=NC=C(O)C=N1 Q62952 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 P36818 [1,1,0,0,0,0|0,0,0]=2 238 B11R1.19 CC1=CC=C(C(C)(C)N)C=N1 Q58436 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.19 CC1=CC=C(C(C)(C)O)C=N1 O33635 [1,1,0,0,0,0|1,0,0]=3 240 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 N25776 [1,1,0,0,0,0|1,0,0]=3 241 B11R1.21 CC(C)C1=CC=C(Br)C(N)=N1 Q53515 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.21 CC(C)C1=CC=C(Cl)C(Br)=C1 Q67346 [1,1,0,0,0,0|1,0,0]=3 243 B11R1.21 CC(C)C1=CC=C(Cl)C(O)=C1 Q67377 [1,1,0,0,0,0|1,0,0]=3 244 B11R1.21 CC(C)C1=CC=C(I)C(Br)=C1 Q67564 [1,1,0,0,0,0|1,0,0]=3 245 B11R1.21 CC(C)C1=CC=C(O)C(Br)=C1 Q67536 [1,1,0,0,0,0|0,0,0]=2 246 B11R1.21 CC(C)C1=CC=C(O)C(Cl)=N1 Q68845 [1,1,0,0,0,0|1,0,0]=3 247 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 P36289 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.21 CC(N)C1=CC=C(Cl)C(F)=C1 P36050 [1,1,0,0,0,0|2,0,0]=4 249 B11R1.21 CC(N)C1=CC=C(F)C(F)=C1 P39119 [1,1,0,0,0,0|2,0,0]=4 250 B11R1.21 CC(O)C1=CC=C(F)C(Br)=C1 Q67058 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.21 CC1=CC=C(C(C)O)C=C1C M22902 [1,1,0,0,0,0|1,0,0]=3 252 B11R1.21 CC1=CC=C(N(C)C)C=C1Br N25454 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 P38144 [1,1,0,0,0,0|1,0,1]=4 254 B11R1.22 CC(C#N)C1=CC=C(F)C=C1 P37672 [1,1,0,0,0,0|1,0,1]=4 255 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 P39316 [1,1,0,0,0,0|1,0,0]=3 256 B11R1.22 CC(CN)C1=CC=C(F)C=C1 P38013 [1,1,0,0,0,0|1,0,0]=3 257 B11R1.22 CC(NN)C1=CC=C(Br)C=C1 L20939 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 L20940 [1,1,0,0,0,0|2,0,0]=4 259 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 P37504 [1,1,0,0,0,0|1,0,1]=4 260 B11R1.22 CC1=CC=C(C(N)CO)C=C1 P40922 [1,1,0,0,0,0|1,0,0]=3 261 B11R1.22 CC1=CC=C(C(O)CN)C=C1 P37591 [1,1,0,0,0,0|1,0,0]=3 262 B11R1.22 CC1=CC=C([C@@H](N)CO)C=C1 P36899 [1,1,0,0,0,0|1,0,0]=3 263 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 P38803 [1,1,0,0,0,0|1,0,0]=3 264 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 P36287 [1,1,0,0,0,0|2,0,0]=4 265 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 P36295 [1,1,0,0,0,0|2,0,0]=4 266 B11R1.22 CCC(N)C1=CC=C(F)C=C1 P36286 [1,1,0,0,0,0|2,0,0]=4 267 B11R1.22 CCC(O)C1=CC=C(Cl)C=C1 P41437 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.22 CCN(C)C1=CC=C(N)C=C1 P39418 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 P39994 [1,1,0,0,0,0|2,0,0]=4 270 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 P40406 [1,1,0,0,0,0|2,0,0]=4 271 B11R1.22 NC(CO)C1=CC=C(F)C=C1 P41377 [1,1,0,0,0,0|2,0,0]=4 272 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 P40081 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.22 NCC(O)C1=CC=C(Br)C=C1 P38182 [1,1,0,0,0,0|2,0,0]=4 274 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 P38165 [1,1,0,0,0,0|2,0,0]=4 275 B11R1.22 NCC(O)C1=CC=C(F)C=C1 P38012 [1,1,0,0,0,0|2,0,0]=4 276 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 P38585 [1,1,0,0,0,0|2,0,0]=4 277 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 P42773 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 P40509 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 P43288 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 P40187 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 P39567 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.166 CC(=O)C1=CC=C(C)C=C1Br P42929 [1,1,0,0,0,0|1,0,1]=4 283 B11R1.166 CC(C)C1=C(I)C=C(Cl)C=C1 N26662 [1,1,0,0,0,0|1,0,0]=3 284 B11R1.166 CC(C)C1=CC=C(Cl)C=C1N Q68189 [1,1,0,0,0,0|1,0,0]=3 285 B11R1.166 CC(C)C1=CN=C(Cl)C=C1N O32387 [1,1,0,0,0,0|2,0,0]=4 286 B11R1.166 CC(C)N1C=CC(N)=CC1=O L21753 [1,1,0,0,0,0|2,0,0]=4 287 B11R1.166 CC(C)N1C=CC(N)=CC1=O Q52511 [1,1,0,0,0,0|2,0,0]=4 288 B11R1.166 CC(N)C1=CC=C(F)C=C1F P37148 [1,1,0,0,0,0|2,0,0]=4 289 B11R1.166 CC1=CC=C(C(C)N)C(C)=C1 P42949 [1,1,0,0,0,0|1,0,0]=3 290 B11R1.166 CN(C)C1=C(Cl)C=C(Br)C=C1 N26369 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.175 CC(C)C1=CC=C(C(=O)O)O1 M15467 [0,1,0,0,1,0|1,0,1]=4 292 B13R1.35 CC(C)OC1=CC=C(C=O)C(F)=C1 N26364 [0,1,0,0,0,1|0,0,2]=4 293 B13R1.35 CC(C)OC1=CC=C(CO)C(Cl)=C1 N26346 [0,1,0,0,0,1|0,0,0]=2 294 B13R1.35 CC(C)OC1=CC=C(CO)C(F)=C1 O29118 [0,1,0,0,0,1|0,0,0]=2 295 B13R1.35 COC1=C(C)C=C(OC(C)C)C=C1 N26994 [0,1,0,0,0,1|2,0,0]=4 296 B13R1.36 CN(C)C(=O)C1=CC=C(CN)C=C1 O28729 [0,1,0,0,0,1|2,0,0]=4 297 B13R1.585 CC(=O)C1=CC=C(OC(C)C)C=C1 O27960 [0,1,0,0,0,1|0,0,2]=4 298 B13R1.585 CC(C)OC1=NC=C(B(O)O)C=C1 Q67256 [0,1,0,0,0,1|2,0,0]=4 299 B13R1.585 CC(C)OC1=NC=C(C(=O)O)C=C1 N24687 [0,1,0,0,0,1|1,0,1]=4 300 B13R1.585 CN(C)CC1=CC=C(B(O)O)C=C1 G-7838 [0,1,0,0,0,1|2,0,0]=4 301 B13R1.585 CN(C)CC1=CC=C(B(O)O)C=C1 Q67669 [0,1,0,0,0,1|2,0,0]=4 302 B13R1.585 CN(C)CC1=CC=C(C(=O)O)C=C1 O28010 [0,1,0,0,0,1|1,0,1]=4 303 B13R1.653 CC(C)OC1=C(Cl)C=C(C=O)C=C1 N24873 [0,1,0,0,0,1|0,0,2]=4 304 B13R1.653 CC(C)OC1=C(Cl)C=C(CO)C=C1 N25366 [0,1,0,0,0,1|0,0,0]=2 305 B13R1.653 CC(C)OC1=CC=C(C=O)C=C1Br Q67003 [0,1,0,0,0,1|0,0,2]=4 306 B13R1.653 CC(C)OC1=CC=C(CO)C=C1Br N25724 [0,1,0,0,0,1|0,0,0]=2 307 B13R1.653 CC1=C(OC(C)C)C=CC(C=O)=C1 N24604 [0,1,0,0,0,1|0,0,2]=4 308 B13R1.653 CC1=C(OC(C)C)C=CC(CO)=C1 N27003 [0,1,0,0,0,1|0,0,0]=2 309 B13R1.653 OCC1=CC=C(OC(F)F)C(F)=C1 O32176 [0,1,0,0,0,1|2,0,0]=4 310 B13R1.39 CCC(CN)C1=CC=C(OC)C=C1 P37709 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.95 COC(=O)C1=CC=C(CO)C=C1C O29550 [0,2,0,0,0,0|1,0,1]=4 312 B13R1.139 CCOC1=CC=C(C(N)CO)C=C1 P35199 [0,2,0,0,0,0|2,0,0]=4 313 B13R1.139 COC(=O)C1=CC=C(CCO)C=C1 O29781 [0,2,0,0,0,0|1,0,1]=4 314 B13R1.187 CC(C)(C#N)C1=CC=C(C=O)C=C1 O29292 [0,2,0,0,0,0|0,0,2]=4 315 B13R1.537 CC(C)C1=CC=C(C(N)CO)C=C1 P35196 [0,2,0,0,0,0|0,0,0]=2 316 B13R1.537 CN(C)C1=CC=C(C(=O)CN)C=C1 P38045 [0,2,0,0,0,0|2,0,0]=4 317 B13R1.537 CN(C)C1=CC=C(C(O)CN)C=C1 M22896 [0,2,0,0,0,0|1,0,0]=3 318 B13R1.537 COC(=O)C1=CC=C(C(C)Br)C=C1 P51501 [0,2,0,0,0,0|1,0,1]=4 319 B13R1.537 COC(=O)C1=CC=C(C(C)C)C=N1 H-8736 [0,2,0,0,0,0|1,0,1]=4 320 B13R1.537 COC(=O)C1=CC=C(C(C)N)C=C1 M23192 [0,2,0,0,0,0|1,0,1]=4 321 B13R1.537 COC(=O)C1=CC=C(C(C)O)C=C1 P35826 [0,2,0,0,0,0|1,0,1]=4 322 B13R1.3088 COC(=O)C1=CC=C(CO)C(Br)=C1 F-4620 [0,2,0,0,0,0|1,0,1]=4 323 B13R1.3088 COC(=O)C1=CC=C(CO)C(Cl)=C1 K13431 [0,2,0,0,0,0|1,0,1]=4 324 B13R1.38 CC1=CC(C(F)(F)F)=CC=C1CO N25037 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.38 OCC1=C(Br)C=C(C(F)(F)F)C=C1 Q61053 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.38 OCC1=CC=C(C(F)(F)F)C=C1Cl Q67865 [0,2,0,0,0,0|2,0,0]=4 327 B13R1.96 CC(C)(C)C1=CC=C(C=O)C=C1O L19699 [0,2,0,0,0,0|0,0,2]=4 328 B13R1.140 CC(C)(C)C1=CC=C(CCN)C=C1 P35137 [0,2,0,0,0,0|1,0,0]=3 329 B13R1.140 CC(C)(C)C1=CC=C(CCO)C=C1 P37547 [0,2,0,0,0,0|0,0,0]=2 330 B13R1.140 CNCC1=CC=C(C(C)(C)C)C=C1 P36801 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.140 OCCC1=CC=C(C(F)(F)F)C=C1 P38999 [0,2,0,0,0,0|2,0,0]=4 332 B13R1.338 CC(=O)C1=CC=C(C(C)(C)C)C=C1 S86224 [0,2,0,0,0,0|0,0,2]=4 333 B13R1.338 CC(C)(C)C1=CC=C(C(=N)N)C=C1 O32503 [0,2,0,0,0,0|1,0,1]=4 334 B13R1.338 CC(C)(C)C1=CC=C(C(=O)O)C=N1 G-5878 [0,2,0,0,0,0|1,0,1]=4 335 B13R1.338 CC(C)(C)C1=CN=C(C(=O)O)C=C1 Q60794 [0,2,0,0,0,0|1,0,1]=4 336 B13R1.338 CC(C)(C)C1=NC=C(B(O)O)C=C1 Q53784 [0,2,0,0,0,0|2,0,0]=4 337 B13R1.338 CC(C)(C)C1=NC=C(C(=O)O)C=C1 L20801 [0,2,0,0,0,0|1,0,1]=4 338 B13R1.338 CC(C)(O)C1=CN=C(C(=O)O)C=C1 K12256 [0,2,0,0,0,0|1,0,1]=4 339 B13R1.338 CC(N)C1=CC=C(C(F)(F)F)C=C1 P40864 [0,2,0,0,0,0|2,0,0]=4 340 B13R1.120 CC(C)C1=CC=C(B(O)O)C(Br)=C1 Q67876 [0,2,0,0,0,0|1,0,0]=3 341 B13R1.120 CC(C)C1=CC=C(B(O)O)C(Cl)=N1 N24206 [0,2,0,0,0,0|2,0,0]=4 342 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(Br)=C1 N27306 [0,2,0,0,0,0|0,0,1]=3 343 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(Cl)=N1 N26337 [0,2,0,0,0,0|1,0,1]=4 344 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(F)=C1 K12232 [0,2,0,0,0,0|0,0,1]=3 345 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(N)=C1 K12292 [0,2,0,0,0,0|0,0,1]=3 346 B13R1.120 CC(C)C1=CC=C(C(=O)O)C(O)=N1 S72500 [0,2,0,0,0,0|1,0,1]=4 347 B13R1.120 CC(C)N1C=CC(C(=O)O)=CC1=O O33446 [0,2,0,0,0,0|1,0,1]=4 348 B13R1.120 CN(C)C1=CC=C(C(=O)O)C=C1F Q66014 [0,2,0,0,0,0|1,0,1]=4 349 B13R1.652 COC1=C(Br)C=C(C(C)C)C(F)=C1 C-3734 [0,2,0,0,0,0|2,0,0]=4 350 B13R1.3091 CCC1=C(CO)C=CC(C(C)=O)=C1 P48493 [0,2,0,0,0,0|1,0,1]=4 351 B13R1.3380 COC1=C(Br)C=C(C(C)C)C=C1Br N26828 [0,2,0,0,0,0|2,0,0]=4 352 B13R1.74 CC(C)C1=CC=C(OCCO)C=C1 P37512 [0,2,0,0,0,0|0,0,0]=2 353 B13R1.385 CN(C)C1=CC=C(CCN)C=C1F O32091 [0,2,0,0,0,0|2,0,0]=4 354 B11R2.34 BrC1=CC=C(C2CC2)C=C1 O30566 [1,0,0,1,0,0|1,0,0]=3 355 B11R2.34 BrC1=CC=C(C2CO2)C=C1 P38852 [1,0,0,1,0,0|2,0,0]=4 356 B11R2.34 CC1=CC=C(C2CN2)C=C1 P36371 [1,0,0,1,0,0|1,0,0]=3 357 B11R2.34 ClC1=CC=C(C2CN2)C=C1 P36104 [1,0,0,1,0,0|2,0,0]=4 358 B11R2.34 ClC1=NC=C(C2CC2)C=C1 Q67831 [1,0,0,1,0,0|2,0,0]=4 359 B11R2.34 FC1=CC=C(C2CO2)C=C1 P40301 [1,0,0,1,0,0|2,0,0]=4 360 B11R2.34 FC1=NC=C(C2CC2)C=C1 N26245 [1,0,0,1,0,0|2,0,0]=4 361 B11R2.34 NC1=CC=C(C2CC2)C=C1 P38877 [1,0,0,1,0,0|1,0,0]=3 362 B11R2.34 NC1=CC=C(C2CC2)N=C1 P42501 [1,0,0,1,0,0|2,0,0]=4 363 B11R2.34 OC1=CC=C(C2CC2)C=C1 P42947 [1,0,0,1,0,0|0,0,0]=2 364 B13R2.2121 CC1=NC2=CC=C(CO)C=C2O1 O34258 [0,0,0,1,0,1|1,0,1]=4 365 B13R2.2121 CN1C=C2C=C(CO)C=CC2=N1 L18477 [0,0,0,1,0,1|1,0,1]=4 366 B13R2.2121 CN1C=C2C=CC(CO)=CC2=N1 L18478 [0,0,0,1,0,1|2,0,0]=4 367 B13R2.2121 O=C1CC2=C(C=CC(CO)=C2)N1 L14680 [0,0,0,1,0,1|1,0,1]=4 368 B13R2.185 O=CC1=CC=C(C2CCC2)C=C1 N26246 [0,1,0,1,0,0|0,0,2]=4 369 B13R2.185 OCC1=CC=C(C2CCC2)C=C1 N27122 [0,1,0,1,0,0|0,0,0]=2 370 B13R2.186 COC1=CC=C(C2(N)CC2)C=C1 P36387 [0,1,0,1,0,0|2,0,0]=4 371 B13R2.186 N#CC1=CC=C(C2(N)CC2)C=C1 M15494 [0,1,0,1,0,0|1,0,1]=4 372 B13R2.186 N#CC1=CC=C(C2(N)CC2)C=C1 O32341 [0,1,0,1,0,0|1,0,1]=4 373 B13R2.2130 CN1N=CC2=C1C=CC(CO)=C2 G-7580 [0,1,0,1,0,0|1,0,1]=4 374 B13R2.430 CC(N)C1=CC=C2OCOC2=C1 P42231 [0,1,0,1,0,0|1,0,0]=3 375 B13R2.60 CCOC1=NC=C(C2CC2)C=C1 N27117 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.428 O=C(O)C1=CC=C(C2CC2)C=C1 O28338 [0,1,0,1,0,0|0,0,1]=3 377 B13R2.428 O=C(O)C1=CC=C(C2CC2)N=C1 P36221 [0,1,0,1,0,0|1,0,1]=4 378 B13R2.428 OB(O)C1=CC=C(C2CC2)C=C1 O29054 [0,1,0,1,0,0|1,0,0]=3 379 B13R2.428 OB(O)C1=CC=C(C2CC2)N=C1 K12335 [0,1,0,1,0,0|2,0,0]=4 380 B13R2.2170 O=CC1=CC=C(C2CC2)C(Cl)=C1 Q68830 [0,1,0,1,0,0|0,0,2]=4 381 B9R1.35 CC(C)N1C=C(O)C=N1 Q61946 [1,0,0,0,1,0|2,0,0]=4 382 B9R1.35 CC(C)N1C=CC(O)=N1 O29759 [1,0,0,0,1,0|2,0,0]=4 383 B9R1.35 CC1=CC=C([C@@H](C)N)O1 P43691 [1,0,0,0,1,0|2,0,0]=4 384 B9R1.35 CC1=CNC(C(C)C)=N1 P51555 [1,0,0,0,1,0|2,0,0]=4 385 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 P42284 [1,0,0,0,0,1|1,0,0]=3 386 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 P36150 [1,0,0,0,0,1|1,0,0]=3 387 B11R1.20 CC(C)NC1=CC=C(F)C=C1 P36529 [1,0,0,0,0,1|1,0,0]=3 388 B11R1.20 CC(C)NC1=NC=C(Br)C=C1 P38063 [1,0,0,0,0,1|2,0,0]=4 389 B11R1.20 CC(C)OC1=CC=C(Br)C=C1 Q66408 [1,0,0,0,0,1|1,0,0]=3 390 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Q67546 [1,0,0,0,0,1|1,0,0]=3 391 B11R1.20 CC(C)OC1=CC=C(N)C=N1 Q53684 [1,0,0,0,0,1|2,0,0]=4 392 B11R1.20 CC(C)OC1=CC=C(O)C=C1 O30893 [1,0,0,0,0,1|0,0,0]=2 393 B11R1.20 CC(C)OC1=CN=C(F)C=C1 N25011 [1,0,0,0,0,1|2,0,0]=4 394 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 Q67257 [1,0,0,0,0,1|2,0,0]=4 395 B11R1.20 CC(C)OC1=NC=C(Cl)C=C1 N24389 [1,0,0,0,0,1|2,0,0]=4 396 B11R1.20 CC(C)OC1=NC=C(I)C=C1 N24494 [1,0,0,0,0,1|2,0,0]=4 397 B11R1.20 CC(C)OC1=NC=C(O)C=C1 N26096 [1,0,0,0,0,1|1,0,0]=3 398 B11R1.20 CC(N)CC1=CC=C(Br)C=C1 P41684 [1,0,0,0,0,1|2,0,0]=4 399 B11R1.20 CN(C)CC1=CC=C(N)C=C1 P36889 [1,0,0,0,0,1|2,0,0]=4 400 B11R1.266 CC(C)C1=CC(C=O)=CC=C1 Q68460 [0,0,0,0,1,1|0,0,2]=4 401 B11R1.266 CC(C)C1=CC(CBr)=CC=C1 I-9079 [0,0,0,0,1,1|1,0,0]=3 402 B11R1.266 CC(C)C1=CC(CO)=CC=C1 Q68461 [0,0,0,0,1,1|0,0,0]=2 403 B11R1.266 COC1=CC=CC(C(C)C)=C1 N26938 [0,0,0,0,1,1|2,0,0]=4 404 B11R1.266 OCC1=CC(C(F)F)=NC=C1 O31282 [0,0,0,0,1,1|2,0,0]=4 405 B13R1.3 COC1=CC=C(CNC(C)C)C=C1 P36504 [0,0,0,0,0,2|2,0,0]=4