0 B12R1.6 C#CC1=CC=C(S(C)(=O)=O)C=C1 P38704 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.6 COC1=CC=C(S(=O)(=O)Cl)C=N1 O30493 [0,0,0,0,0,0|4,0,0]=4 2 B12R1.6 COC1=CN=C(S(=O)(=O)Cl)C=C1 Q53703 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.6 CS(=O)(=O)C1=CC=C(CBr)C=C1 O34513 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 P38076 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.6 CS(=O)(=O)C1=CC=C(CN)N=C1 Q62824 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.6 CS(=O)(=O)C1=CN=C(CN)C=C1 Q52679 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.6 CS(=O)(=O)C1=NC=C(C=O)C=C1 Q60230 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.6 N#CC1=CC=C(S(N)(=O)=O)C=N1 Q58417 [0,0,0,0,0,0|1,0,2]=3 9 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 P41439 [0,0,0,0,0,0|0,0,0]=0 10 B12R1.6 O=CC1=CC=C(S(=O)(=O)O)C=C1 O31040 [0,0,0,0,0,0|2,0,1]=3 11 B12R1.6 O=S(=O)([O-])C1=CC=C(CBr)C=C1 A-991 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 L20737 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 P36753 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.3 CC(N)C1=CC=C(CO)C=C1 P38103 [1,0,0,0,0,0|3,0,0]=4 15 B11R1.3 CCC1=CC=C(C(C)N)C=C1 P41160 [1,0,0,0,0,0|3,0,0]=4 16 B11R1.3 CN(C)C1=CC=C(CN)C=C1 P40156 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.3 N#CC1=CC=C(C(N)=O)C=C1 P38941 [1,0,0,0,0,0|1,0,2]=4 18 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 P37128 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.3 NCC1=CC=C(B(O)O)C=C1 O30152 [1,0,0,0,0,0|1,0,2]=4 20 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 O28757 [1,0,0,0,0,0|1,0,0]=2 21 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 P50970 [1,0,0,0,0,0|1,0,1]=3 22 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 A-701 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.3 O=C(O)C1=CC=C(CS)C=C1 P38363 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 P36818 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=N1 Q54175 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1765 [1,0,0,0,0,0|1,0,0]=2 27 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 B-1766 [1,0,0,0,0,0|1,0,0]=2 28 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 G-6636-1 [1,0,0,0,0,0|1,0,0]=2 29 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H-8848 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 L14045 [1,0,0,0,0,0|1,0,0]=2 31 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O32785 [1,0,0,0,0,0|1,0,0]=2 32 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P45972 [1,0,0,0,0,0|1,0,0]=2 33 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P48341 [1,0,0,0,0,0|1,0,0]=2 34 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P50560 [1,0,0,0,0,0|1,0,0]=2 35 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q54491 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56087 [1,0,0,0,0,0|1,0,0]=2 37 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q56091 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 Q69557 [1,0,0,0,0,0|1,0,0]=2 39 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 G-7786 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.19 CC1=CC=C(S(N)(=O)=O)C=N1 Q58484 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.19 CS(=N)(=O)C1=CC=C(Cl)C=C1 F-4632 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=C1 S72495 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.19 NC1=NC=C(S(N)(=O)=O)C=N1 O30368 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.19 NS(=O)(=O)C1=CC=C(F)C=N1 Q58364 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.19 NS(=O)(=O)C1=CN=C(Br)C=C1 Q62402 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.19 NS(=O)(=O)C1=NC=C(Br)C=C1 P51679 [1,0,0,0,0,0|2,0,0]=3 47 B11R1.19 O=C1C=CC(S(=O)(=O)Cl)=CN1 L21989 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.19 O=S(=O)(Cl)C1=CN=C(Br)C=C1 Q54488 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.19 O=S(=O)(Cl)C1=NC=C(Br)C=C1 P51672 [1,0,0,0,0,0|3,0,0]=4 50 B11R1.19 O=S(=O)(Cl)C1=NC=C(Cl)C=C1 P51674 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.19 O=S(=O)(O)C1=CC=C(S)C=C1 M15585 [1,0,0,0,0,0|2,0,0]=3 52 B13R1.140 CS(=O)(=O)C1=CC=C(CCN)C=C1 P40998 [0,1,0,0,0,0|1,0,0]=2 53 B13R1.140 O=S(=O)([O-])C1=CC=C(N=C=S)C=C1 L21191 [0,1,0,0,0,0|2,0,1]=4 54 B13R1.187 COS(=O)(=O)C1=CC=C(CBr)C=C1 L21192 [0,1,0,0,0,0|2,0,0]=3 55 B13R1.338 CC(C)C1=CN=C(S(N)(=O)=O)C=C1 Q62399 [0,1,0,0,0,0|2,0,0]=3 56 B13R1.338 CC(N)C1=CC=C(S(C)(=O)=O)C=C1 M22999 [0,1,0,0,0,0|1,0,0]=2 57 B13R1.338 CN(C)C1=CC=C(S(N)(=O)=O)C=C1 O30905 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.45 CCN1C=C(S(N)(=O)=O)C=N1 L19205 [0,0,0,0,1,0|3,0,0]=4 59 B13R1.4 COC1=CC=C(CS(N)(=O)=O)C=C1 H-8154 [0,0,0,0,0,1|2,0,0]=3 60 B13R1.4 CS(=O)(=O)CC1=NC=C(CN)C=N1 Q58697 [0,0,0,0,0,1|3,0,0]=4 61 B10R1.3 C#CC1=CC=C(CN)C=C1 O28144 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.3 N#CC1=CC=C(CN)C=C1 P42878 [2,0,0,0,0,0|1,0,1]=4 63 B10R1.3 NCC1=CC=C(CBr)C=C1 P38676 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.3 NCC1=CC=C(CO)C=C1 P38312 [2,0,0,0,0,0|1,0,1]=4 65 B10R1.3 O=CC1=CC=C(CCl)C=C1 P45270 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.3 O=CC1=CC=C(CO)C=C1 P37667 [2,0,0,0,0,0|2,0,0]=4 67 B10R1.13 NC(=O)C1=NC=C(N)C=C1 O30308 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.28 NP(N)(=O)C1=CC=CC=C1 L19832 [2,0,0,0,0,0|2,0,0]=4 69 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 C-3245 [2,0,0,0,0,0|1,0,0]=3 70 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 C-3246 [2,0,0,0,0,0|1,0,0]=3 71 B10R1.28 NS(=O)(=O)C1=NC=CC=N1 Q58544 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.28 O=S(=O)(Cl)C1=CC=NC=C1 F-4410 [2,0,0,0,0,0|2,0,0]=4 73 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 C-3244 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.28 O=S(=O)(Cl)C1=NC=CC=C1 P45341 [2,0,0,0,0,0|2,0,0]=4 75 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 P51550 [2,0,0,0,0,0|2,0,0]=4 76 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 M15399 [2,0,0,0,0,0|2,0,0]=4 77 B12R1.5 CCC1=CC=C(C(=O)NN)C=C1 O30882 [1,1,0,0,0,0|2,0,0]=4 78 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 O28734 [1,1,0,0,0,0|1,0,0]=3 79 B12R1.48 NCC1=CC=C(C(=O)O)C=C1Cl P40738 [1,1,0,0,0,0|1,0,1]=4 80 B12R1.113 CNCC1=CC=C(C(=O)O)C=C1 P34800 [1,1,0,0,0,0|1,0,1]=4 81 B12R1.113 CNCC1=CC=C(C(N)=O)C=C1 P42469 [1,1,0,0,0,0|1,0,0]=3 82 B12R1.113 NCCC1=CC=C(C(=O)O)C=C1 P37127 [1,1,0,0,0,0|1,0,1]=4 83 B12R1.256 CC(N)C1=CC=C(C(=O)O)C=C1 O28758 [1,1,0,0,0,0|1,0,1]=4 84 B12R1.256 CC(N)C1=CC=C([N+](=O)[O-])C=C1 P38148 [1,1,0,0,0,0|1,0,1]=4 85 B12R1.452 NCC1=CC=C(C(=O)O)C(Cl)=C1 P42290 [1,1,0,0,0,0|1,0,1]=4 86 B12R1.9 CNS(=O)(=O)C1=CC=C(N)N=C1 S72672 [1,1,0,0,0,0|1,0,0]=3 87 B12R1.23 CC1=C(Cl)C=CC(S(=O)(=O)Cl)=C1 C-3243 [1,1,0,0,0,0|2,0,0]=4 88 B12R1.23 CC1=CC(S(N)(=O)=O)=CC=C1N M15814 [1,1,0,0,0,0|0,0,0]=2 89 B12R1.23 CC1=NC(S(C)(=O)=O)=CC=C1N A-678 [1,1,0,0,0,0|2,0,0]=4 90 B12R1.23 CS(=O)(=O)C1=CC=C(F)C(Br)=C1 O30028 [1,1,0,0,0,0|2,0,0]=4 91 B12R1.23 NS(=O)(=O)C1=CC(Cl)=C(Cl)N=C1 Q54685 [1,1,0,0,0,0|2,0,0]=4 92 B14R1.66 CS(=O)(=O)C1=CC=C(CCCN)C=C1 L19884 [0,2,0,0,0,0|1,0,0]=3 93 B14R1.719 CS(=O)(=O)C1=CC=C(C(=O)CN)C=C1 P42951 [0,2,0,0,0,0|1,0,0]=3 94 B14R1.806 O=C(O)CC1=CC=C(S(=O)(=O)Cl)C=C1 F-4195 [0,2,0,0,0,0|2,0,0]=4 95 B14R1.3332 NS(=O)(=O)C1=NC=C(C(F)(F)F)C=C1 O29648 [0,2,0,0,0,0|2,0,0]=4 96 B14R2.3125 NS(=O)(=O)C1=CC2=C(C=C1)NC=C2 Q54207 [0,1,0,1,0,0|1,0,1]=4 97 B10R1.55 CN1C=CC(S(N)(=O)=O)=N1 Q62097 [1,0,0,0,1,0|2,0,0]=4 98 B10R1.55 NC1=NC=C(S(N)(=O)=O)S1 M15738 [1,0,0,0,1,0|2,0,0]=4 99 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 P39368 [1,0,0,0,0,1|2,0,0]=4 100 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 P42337 [1,0,0,0,0,1|1,0,1]=4 101 B12R1.106 CC1=CC=C(CS(=O)(=O)Cl)C=C1 P37721 [1,0,0,0,0,1|1,0,0]=3 102 B12R1.106 CC1=CC=C(CS(N)(=O)=O)C=C1 L20915 [1,0,0,0,0,1|0,0,0]=2 103 B12R1.106 CC1=CC=C(NS(C)(=O)=O)C=C1 L21041 [1,0,0,0,0,1|1,0,0]=3 104 B12R1.106 CS(=O)(=O)NC1=CC=C(Br)C=C1 P38115 [1,0,0,0,0,1|2,0,0]=4 105 B12R1.106 CS(=O)(=O)NC1=CC=C(N)C=C1 P37596 [1,0,0,0,0,1|1,0,0]=3 106 B12R1.106 NS(=O)(=O)CC1=CC=C(Cl)C=C1 P36442 [1,0,0,0,0,1|1,0,0]=3 107 B12R1.436 C#CC1=CC(S(N)(=O)=O)=CC=C1 O29315 [0,0,0,0,1,1|1,0,1]=4