0 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [0,0,0,0,0,0|1,0,0]=1 6 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.61 CC(=O)C1=NC=CN=C1N P10974 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 CC(=O)C1=NC=NC=C1C O10307 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.61 CC1=C(P(Cl)Cl)C=CC=C1 AC9855 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.61 C[C@H](N)C1=C(Cl)C=NC=C1 N14402 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [0,0,0,0,0,0|1,0,2]=3 21 B10R1.61 N=C(N)C1=C(Br)C=CC=N1 W18185 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.61 N=C(N)C1=C(F)C=CC=C1 W10322 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.61 N=C(N)C1=C(F)C=CC=N1 F51910 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.61 N=C(N)C1=[N+]([O-])C=CC=C1 O10709 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.61 NC(=O)C1=C(F)C=NC=C1 55531 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.61 NC(=O)C1=C(O)N=CC=C1 D74336 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.61 NC(=S)C1=CC=CN=C1Cl 31340 [0,0,0,0,0,0|3,1,0]=4 28 B10R1.61 NC(=S)C1=NC=CC=C1N F13535 [0,0,0,0,0,0|2,1,0]=3 29 B10R1.61 NC1=C(B(O)O)C=NC=C1 AT12798 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 78917 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.61 O=C(O)C1=CN=CN=C1Cl F10440 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.61 O=[N+]([O-])C1=CC=CN=C1I AB10380 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.61 O=[N+]([O-])C1=CC=CN=C1S T72399 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,0,0,0,0,0|2,0,1]=4 39 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,0,0,0,0,0|2,0,1]=4 40 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.6 NC(=O)C1=NC=CC=N1 C11052 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.6 O=C([O-])C1=NC=CC=C1 T71798 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [1,0,0,0,0,0|1,0,1]=3 46 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.15 C#CC1=C(N)C=NC=C1 D83940 [1,0,0,0,0,0|1,0,2]=4 48 B9R1.15 C#CC1=CC=CN=C1N 72370 [1,0,0,0,0,0|1,0,2]=4 49 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,0,0,0,0,0|1,0,1]=3 50 B9R1.15 C=CC1=C(C)C=CN=C1 P11580 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.15 C=CC1=CC=CN=C1F P13082 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.15 CCC1=CC=CN=C1C 75814 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.15 COC1=C(Br)C=CN=C1 F10479 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.15 COC1=C(C)C=NC=C1 D74380 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [1,0,0,0,0,0|1,0,0]=2 60 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.15 O=CC1=CNC=CC1=O O11278 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [1,0,0,0,0,0|2,0,1]=4 66 B11R1.53 C=C(Br)C1=C(OC)C=CC=C1 F18312 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 O10854 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.53 CC(C)C1=C(CCl)C=CC=C1 E72192 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.53 CCC1=C(C(C)=O)C=CN=C1 CL0371 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.53 CCC1=C(C(N)=S)C=CC=C1 F13433 [0,1,0,0,0,0|2,1,0]=4 71 B11R1.53 COC1=C(C(N)=O)C=CC=N1 D87306 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.53 COC1=CC=CN=C1C(N)=O D87880 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.53 CSC1=C(C(=O)O)N=CC=C1 AT16224 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12983 [0,1,0,0,0,0|1,0,2]=4 75 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y13010 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 C73535 [0,1,0,0,0,0|0,0,3]=4 77 B11R1.53 N#CC1=C(C(=N)N)C=CC=C1 AC1590 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.53 N#CC1=C(C(=O)Cl)C=CC=C1 D87858 [0,1,0,0,0,0|1,0,1]=3 79 B11R1.53 N#CC1=C(C(N)=O)C=CC=C1 T70416 [0,1,0,0,0,0|1,0,1]=3 80 B11R1.53 NCC1=C([N+](=O)[O-])C=CC=N1 W13447 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.53 O=C(O)C1=NC=CC=C1CO D77137 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.53 O=C([O-])C1=NC=CC=C1CO AT20000 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.53 O=CC1=C(C(=O)O)C=CC=N1 O10788 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.53 O=CC1=CC=CN=C1C(=O)O D87924 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.87 CC(C)(N)C1=C(F)C=CC=C1 C78437 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.87 CC(F)(F)C1=C(N)C=CC=C1 AT20037 [0,1,0,0,0,0|1,0,1]=3 87 B11R1.87 CS(=O)(=O)C1=C(N)C=NC=C1 AT12794 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.87 C[S@](=N)(=O)C1=C(Br)C=CC=C1 AT11347 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.87 C[S@](=N)(=O)C1=C(Cl)C=CC=C1 AT11351 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.87 C[S@](=N)(=O)C1=C(F)C=CC=C1 AT11350 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.87 NC1=C(S(=O)(=O)Cl)C=CC=C1 C72646 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.87 [2H]C([2H])([2H])C1=C(N)C=CC=C1 D99263 [0,1,0,0,0,0|2,0,1]=4 93 B11R1.156 CC(=O)C1=C(Br)C=CC=C1N C75622 [0,1,0,0,0,0|0,0,0]=1 94 B11R1.156 CC(=O)C1=C(Br)C=CN=C1Cl 55294 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.156 CC1=CC=CC(Br)=C1C(N)=O F13400 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N AT12995 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.156 CC1=CC=CC(Cl)=C1C(=N)N F13421 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.156 CC1=CC=CC(I)=C1C(=O)O 81915 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.156 CC1=CN=CC(Br)=C1C(=O)O 51801 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.156 CC1=CN=CC(N)=C1C(=O)O W11192 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.156 CC1=NC=CC(Cl)=C1C(=O)O C16695 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1F C91102 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11387 [0,1,0,0,0,0|1,0,2]=4 104 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11388 [0,1,0,0,0,0|1,0,2]=4 105 B11R1.156 N=C(N)C1=C(Cl)C=CC=C1Cl F12419 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.156 NC(=O)C1=C(Br)C=CC=C1N AC2939 [0,1,0,0,0,0|1,0,0]=2 107 B11R1.156 NC(=O)C1=C(F)C=CC=C1O C13392 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.156 NC1=CC=CC(O)=C1C(=O)O 26442 [0,1,0,0,0,0|1,0,0]=2 109 B11R1.156 NC1=CC=NC(O)=C1[N+](=O)[O-] F17483 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.156 O=C(Cl)C1=C(I)C=CC=C1Cl F20996 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.159 C=C(C)C1=C(N)C(C)=CC=C1 F18673 [0,1,0,0,0,0|1,0,0]=2 112 B11R1.159 CC(=O)C1=C(C)C(N)=CC=C1 O10268 [0,1,0,0,0,0|1,0,0]=2 113 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 C76227 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=C1 AT26683 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.159 CC(=O)C1=C(F)C(Cl)=NC=N1 91061 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1I 94553 [0,1,0,0,0,0|1,0,0]=2 117 B11R1.159 CC(=O)C1=CC=CC(O)=C1F AT11003 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.159 CC(C)C1=CC=CC(Br)=C1O C91212 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.159 CC(C)C1=CC=CC(N)=C1N D85847 [0,1,0,0,0,0|1,0,1]=3 120 B11R1.159 CC1=C(C(N)=O)C=CC=C1N 93043 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.159 CC1=C(O)C=CN=C1C(=O)O C11063 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.159 CC1=CC=CC(C(N)=O)=C1Cl D87582 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.159 CC1=CC=CC(C(N)=O)=C1O AC4144 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C N12727 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.159 CC1=CN=CC(C(=O)O)=C1O AT13143 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.159 CC1=NC=CC(C(=O)O)=C1C D87767 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl Y11085 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 F12396 [0,1,0,0,0,0|1,0,0]=2 129 B11R1.159 NC(=O)C1=CC=CC(S)=C1Cl 92372 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.159 NC1=C(C(=O)O)C=CC=C1O T72518 [0,1,0,0,0,0|1,0,0]=2 131 B11R1.159 NC1=C(C(=O)O)C=CN=C1Br C11136 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.159 NC1=C([N+](=O)[O-])C=CN=C1Cl CS1533 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.159 O=C(O)C1=CC=CC(I)=C1O AT10718 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=N1 BL010230 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=N1 D79871 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,1,0,0,0,0|1,0,0]=2 137 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.166 CC(=O)C1=CN=C(Br)C=C1C D80175 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.166 CC(=O)C1=CNC(=O)N=C1C S10254 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F 83702 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.166 CC(=O)C1=NC=C(Cl)N=C1Cl 58574 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.166 CC(C)C1=C(Br)C=C(Cl)C=C1 F21471 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.166 CC(C)C1=C(F)C=C(Br)C=C1 F52298 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.166 CC1=C(C(=N)N)C=CC(Br)=C1 56645 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.166 CC1=C(C(N)=O)C=CC(Br)=C1 F13688 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.166 CC1=CC(Br)=C(C(C)C)C=C1 AT26576 [0,1,0,0,0,0|2,0,1]=4 147 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 N12239 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81539 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81617 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.166 CC1=CC(Cl)=NC=C1C(N)=O D85781 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 N17088 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.166 CC1=CC(F)=C([C@H](C)O)C=C1 AT15336 [0,1,0,0,0,0|1,0,2]=4 153 B11R1.166 CC1=CC(F)=CN=C1C(=O)O 55148 [0,1,0,0,0,0|3,0,0]=4 154 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 25712 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.166 CC1=CC(N)=C([N+](=O)[O-])C=N1 P19552 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 N12689 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.166 CC1=CC=C(C(C)C)C(N)=N1 AT11138 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.166 CC1=CN=C(C(=O)O)C(N)=N1 70364 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.166 C[C@H](Br)C1=C(F)C=C(F)C=C1 C77556 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N12749 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N13113 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 F16902 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11374 [0,1,0,0,0,0|1,0,2]=4 164 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11378 [0,1,0,0,0,0|1,0,2]=4 165 B11R1.166 N=C(N)C1=C(Cl)C=C(Br)C=C1 D86997 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 92721 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 C14169 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.166 N=C(N)C1=C(F)C=C(O)C=C1 D87625 [0,1,0,0,0,0|3,0,0]=4 169 B11R1.166 NC(=O)C1=C(N)N=C(F)C=C1 F20285 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.166 NC(=O)C1=C(O)C=C(O)N=C1 F12454 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.166 NC(=O)C1=CN=C(Cl)C=C1N AT11356 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.166 NC(=O)C1=NC=C(Br)C=C1Cl AC3839 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.166 NC1=C(B(O)O)C=CC(Cl)=C1 W16867 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.166 NC1=C(C(=O)O)C=NC(O)=C1 35476 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.166 NC1=C([N+](=O)[O-])C=CC(I)=N1 H11906 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O 37099 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.166 NC1=CC(Cl)=C(C(=O)O)N=C1 BL010122 [0,1,0,0,0,0|3,0,0]=4 178 B11R1.166 NC1=CC(I)=C(C(=O)O)C=C1 D87628 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.166 NC1=NC(N)=C(C(=O)O)C=C1 AC4722 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.166 O=C(Cl)C1=C(Br)C=C(F)C=C1 F17471 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=N1 BL010139 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.166 O=C(O)C1=C(S)C=C(Br)C=C1 AT20781 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.166 O=C(O)C1=C(S)C=C(F)C=C1 AT20779 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 F52542 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.167 CC(=O)C1=C(N)C=CC(O)=C1 32344 [0,1,0,0,0,0|0,0,0]=1 186 B11R1.167 CC(=O)C1=CC(Br)=NN=C1Br 81572 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.167 CC(=O)C1=CC(C)=CN=C1F N13305 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1F AT18807 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.167 CC(=O)C1=CC(Cl)=NC=C1N 92761 [0,1,0,0,0,0|1,0,0]=2 190 B11R1.167 CC(C)C1=C(Br)C=CC(O)=C1 57997 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N12218 [0,1,0,0,0,0|1,0,1]=3 192 B11R1.167 CC(C)C1=C(O)C=CC(N)=C1 F31161 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.167 CC1=C(C(=N)N)C=C(F)C=C1 S11570 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.167 CC1=C(C(=O)Cl)C=C(Br)C=C1 C15328 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.167 CC1=C(C(=O)Cl)C=C(Cl)C=C1 F52326 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.167 CC1=C(C(N)=O)C=C(Cl)C=C1 F52323 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.167 CC1=CC(C(C)C)=C(O)C=C1 30812 [0,1,0,0,0,0|2,0,1]=4 198 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N12153 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.167 CC1=CN=C(Br)C(C(=O)O)=C1 C16185 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.167 CC1=NC(C(=O)O)=C(F)C=C1 FD10677 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91100 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91101 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13035 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13127 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24141 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 D85891 [0,1,0,0,0,0|2,0,1]=4 207 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 D81270 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11385 [0,1,0,0,0,0|1,0,2]=4 209 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11386 [0,1,0,0,0,0|1,0,2]=4 210 B11R1.167 NC(=O)C1=C(Br)C=CC(Cl)=N1 80076 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.167 NC(=O)C1=C(Br)C=NC(Cl)=C1 AT22391 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.167 NC(=O)C1=C(Cl)C=CC(Cl)=N1 I10219 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl F12412 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.167 NC(=O)C1=CC(F)=CN=C1Cl 81871 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.167 NC1=C([N+](=O)[O-])N=C(F)C=C1 E71690 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.167 NC1=CC(C(=O)O)=C(F)C=N1 97786 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.167 NC1=CN=C(F)C=C1C(=O)O W19653 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.167 O=C(Cl)C1=C(F)C=CC(Br)=C1 F17494 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.167 O=C(Cl)C1=C(I)C=CC(Br)=C1 AC5820 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.167 O=C(O)C1=C(S)C=CC(Br)=C1 S10260 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.167 O=C(O)C1=C(S)C=CC(Cl)=C1 AT20778 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.167 O=C(O)C1=CC(I)=CN=C1F 98093 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.222 CCC(=O)C1=C(Br)C=NC=C1 N14286 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.222 CCC(=O)C1=C(Cl)C=CN=C1 N14267 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.222 CCC(=O)C1=C(F)C=CC=N1 N14248 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.222 CCC(=O)C1=C(F)C=NC=C1 N14283 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.222 CCC(=O)C1=CC=CN=C1Br N14264 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.222 CCC(=O)C1=CC=CN=C1Cl N14262 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.222 CCC(=O)C1=CC=CN=C1F N14261 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.222 CCC(=O)C1=NC=CC=C1C N12289 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,1,0,0,0,0|1,0,1]=3 242 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,1,0,0,0,0|1,0,2]=4 244 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,1,0,0,0,0|1,0,2]=4 245 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,1,0,0,0,0|1,0,2]=4 246 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.222 CNC(=O)C1=NC=CC=C1O C71661 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,1,0,0,0,0|2,0,1]=4 249 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,1,0,0,0,0|2,0,1]=4 250 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.222 COC(=N)C1=C(Br)C=CC=C1 AC5256 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.222 COC(=O)C1=C(C)C=NC=C1 CS1425 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.222 COC(=O)C1=C(Cl)C=NC=N1 67177 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.222 COC(=O)C1=CN=CN=C1Cl 31492 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.222 COC(=O)C1=NC=NC=C1C F53212 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W12757 [0,1,0,0,0,0|1,0,1]=3 257 B11R1.222 NC1=C(C(=O)CCl)C=CC=C1 72272 [0,1,0,0,0,0|0,0,0]=1 258 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [0,1,0,0,0,0|1,0,0]=2 259 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [0,1,0,0,0,0|2,0,1]=4 266 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [0,1,0,0,0,0|2,0,1]=4 267 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [0,1,0,0,0,0|2,0,1]=4 268 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [0,1,0,0,0,0|2,0,1]=4 270 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [0,1,0,0,0,0|2,0,1]=4 271 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [0,1,0,0,0,0|1,0,2]=4 273 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [0,1,0,0,0,0|1,0,2]=4 274 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [0,1,0,0,0,0|1,0,2]=4 275 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.222 O=C(CBr)C1=C(Cl)C=NC=C1 D88108 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.222 O=C(CBr)C1=NC=CC=C1F F13389 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [0,1,0,0,0,0|1,0,0]=2 282 B11R1.222 O=C(CF)C1=CC=CN=C1F AT10155 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.222 O=C(CO)C1=C(Br)C=CC=C1 AC7495 [0,1,0,0,0,0|1,0,0]=2 284 B11R1.222 O=C(CO)C1=C(F)C=CC=C1 AC5617 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.222 O=C(CO)C1=C(I)C=CC=C1 AC7053 [0,1,0,0,0,0|1,0,0]=2 286 B11R2.1 BrC1=CCC2=C1C=CC=C2 D78625 [0,0,0,1,0,0|2,0,1]=4 287 B11R2.1 CC1=C2C=CC=CC2=NO1 AC6101 [0,0,0,1,0,0|0,0,2]=3 288 B11R2.1 CC1=CNC2=NC=NC=C12 P14369 [0,0,0,1,0,0|3,0,0]=4 289 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,0,0,1,0,0|1,0,1]=3 290 B11R2.1 ClC1=CNC2=C1C=NC=C2 I11117 [0,0,0,1,0,0|2,0,1]=4 291 B11R2.1 NC1=CNC2=NC=CC=C12 C15185 [0,0,0,1,0,0|2,0,1]=4 292 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,0,0,1,0,0|2,0,1]=4 293 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,0,0,1,0,0|2,0,1]=4 294 B11R2.1 O=C1COC2=C1C=CC=N2 O11821 [0,0,0,1,0,0|2,0,0]=3 295 B11R2.1 OC1=CNC2=C1C=CC=C2 F18139 [0,0,0,1,0,0|0,0,2]=3 296 B11R2.1 OC1=CSC2=C1C=CC=C2 C15915 [0,0,0,1,0,0|1,0,2]=4 297 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,0,0,1,0,0|1,0,2]=4 298 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [0,0,0,1,0,0|2,0,1]=4 299 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [0,0,0,1,0,0|1,0,2]=4 300 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [0,0,0,1,0,0|1,0,2]=4 301 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [0,0,0,1,0,0|1,0,1]=3 302 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [0,0,0,1,0,0|2,0,1]=4 303 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [0,0,0,1,0,0|2,0,1]=4 304 B9R1.41 CC(=O)C1=C(Br)C=CO1 AT17466 [0,0,0,0,1,0|2,0,0]=3 305 B9R1.41 CC(=O)C1=C(O)C=CS1 AT16388 [0,0,0,0,1,0|2,0,0]=3 306 B9R1.41 CC(=O)N1C=COC1=O C16070 [0,0,0,0,1,0|3,0,0]=4 307 B9R1.41 CC1=CNC=C1C(=O)O 71038 [0,0,0,0,1,0|3,0,0]=4 308 B9R1.41 CC1=COC=C1C(=O)O 72440 [0,0,0,0,1,0|3,0,0]=4 309 B9R1.41 CC1=CSC=C1C(=O)Cl AT17065 [0,0,0,0,1,0|3,0,0]=4 310 B9R1.41 NC(=O)C1=C(F)C=CS1 92876 [0,0,0,0,1,0|3,0,0]=4 311 B9R1.41 NC(=O)C1=C(N)C=CO1 AC5297 [0,0,0,0,1,0|2,0,0]=3 312 B9R1.41 NC(=O)C1=C(O)C=CS1 75845 [0,0,0,0,1,0|3,0,0]=4 313 B9R1.41 NC1=C(C(=O)O)N=CN1 C90485 [0,0,0,0,1,0|3,0,0]=4 314 B9R1.41 NC1=CSN=C1C(=O)O AT21158 [0,0,0,0,1,0|3,0,0]=4 315 B9R1.41 O=C(O)C1=C(Br)OC=C1 AT17113 [0,0,0,0,1,0|3,0,0]=4 316 B9R1.41 O=C(O)C1=CNC=C1Br AT16233 [0,0,0,0,1,0|3,0,0]=4 317 B9R1.41 O=C(O)C1=CSC=C1Cl AT14983 [0,0,0,0,1,0|3,0,0]=4 318 B11R1.86 CC(=O)NC1=C(Br)C=CC=N1 F18386 [0,0,0,0,0,1|2,0,0]=3 319 B11R1.86 CC(=O)NC1=C(C)N=CC=C1 F14250 [0,0,0,0,0,1|2,0,0]=3 320 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 D71943 [0,0,0,0,0,1|2,0,0]=3 321 B11R1.86 CC(=O)NC1=C(N)C=CN=C1 C16214 [0,0,0,0,0,1|1,0,0]=2 322 B11R1.86 CC(=O)NC1=NN=CC=C1C AC7622 [0,0,0,0,0,1|3,0,0]=4 323 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 F13222 [0,0,0,0,0,1|1,0,0]=2 324 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 81280 [0,0,0,0,0,1|1,1,0]=3 325 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [0,0,0,0,0,1|2,0,1]=4 326 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [0,0,0,0,0,1|2,0,1]=4 327 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [0,0,0,0,0,1|2,0,1]=4 328 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [0,0,0,0,0,1|2,0,1]=4 329 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [0,0,0,0,0,1|2,0,1]=4 330 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,0,0,0,0,1|2,0,1]=4 331 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,0,0,0,0,1|2,0,1]=4 332 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,0,0,0,0,1|2,0,1]=4 333 B11R1.86 NC(=O)CC1=NC=CC=C1O D87092 [0,0,0,0,0,1|3,0,0]=4 334 B8R1.2 C=CC1=CC=CN=C1 71366 [2,0,0,0,0,0|1,0,1]=4 335 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|1,0,1]=4 336 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.5 NC1=C(S)C=NC=C1 P11896 [2,0,0,0,0,0|1,1,0]=4 339 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [2,0,0,0,0,0|1,0,1]=4 340 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [2,0,0,0,0,0|2,0,0]=4 341 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [1,1,0,0,0,0|1,0,1]=4 347 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [1,1,0,0,0,0|1,0,1]=4 348 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [1,1,0,0,0,0|1,0,0]=3 349 B10R1.15 CCC(=O)C1=CC=NC=C1 N12310 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.15 CCC(=O)C1=NC=CC=N1 D72036 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [1,1,0,0,0,0|1,0,1]=4 353 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.15 COC(=N)C1=CC=NC=C1 D87808 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.15 COC(=O)N1C=CC=CC1 F21432 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [1,1,0,0,0,0|0,0,1]=3 357 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [1,1,0,0,0,0|0,0,1]=3 358 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [1,1,0,0,0,0|0,0,2]=4 359 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [1,1,0,0,0,0|0,0,2]=4 360 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [1,1,0,0,0,0|0,0,2]=4 361 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [1,1,0,0,0,0|0,0,2]=4 362 B10R1.15 NCC(=O)C1=CN=CC=C1 D87739 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.15 NCC(=O)C1=CN=CC=C1 F13353 [1,1,0,0,0,0|1,0,0]=3 364 B10R1.15 N\C(=N/O)C1=CC=CC=C1 L10027 [1,1,0,0,0,0|1,0,1]=4 365 B10R1.15 O=C(CBr)C1=NC=CC=N1 F19759 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.15 O=C(CBr)C1=NC=NC=C1 FD10496 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.15 O=C(CO)C1=CC=NC=C1 AC5781 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.15 O=C(CO)C1=CN=CC=C1 AC2803 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 I11569 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [1,1,0,0,0,0|1,0,1]=4 371 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [1,1,0,0,0,0|0,0,2]=4 373 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [1,1,0,0,0,0|1,0,0]=3 374 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [1,1,0,0,0,0|1,0,0]=3 375 B10R1.113 CC(=O)C1=CC(Cl)=NC=N1 91059 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.113 CC(=O)C1=CN=NC(C)=C1 E71800 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [1,1,0,0,0,0|1,0,1]=4 381 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [1,1,0,0,0,0|1,0,1]=4 383 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [1,1,0,0,0,0|0,0,2]=4 385 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [1,1,0,0,0,0|0,0,2]=4 386 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [1,1,0,0,0,0|1,1,0]=4 389 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 D84548 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AC3399 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [1,1,0,0,0,0|1,0,0]=3 392 B10R1.113 O=[N+]([O-])C1=CC=CC(S)=C1 AT20860 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.2 C=CC1=CC=CC(Br)=C1F H11842 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [1,1,0,0,0,0|1,0,1]=4 395 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [1,1,0,0,0,0|0,0,1]=3 396 B10R1.2 CN1C=CC=C(C=O)C1=O 55279 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.2 CNC1=CC=CC(F)=C1N AC7422 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.2 CNC1=NC=CC(Cl)=C1N C92709 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.2 COC1=C(N)C(N)=CC=C1 F52601 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.2 COC1=C(O)C(N)=CC=C1 O10655 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.2 COC1=CC=CC(Cl)=C1N CL9246 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.2 COC1=CC=CC(S)=C1N AT19649 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.2 COC1=CN=CC(F)=C1N 93259 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.2 COC1=NC=CC(F)=C1N F53634 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.2 N#CC1=CC=CC(O)=C1N C74010 [1,1,0,0,0,0|1,0,1]=4 408 B10R1.2 NC1=C(C=O)C=CN=C1Cl AT14240 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.2 O=CC1=CC=CC(Cl)=C1I 93250 [1,1,0,0,0,0|1,0,0]=3 410 B10R1.2 O=CC1=CN=CC(F)=C1Cl 66141 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.2 O=CC1=NC=CC(Br)=C1Cl F53264 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.2 O=CC1=NC=CC(Cl)=C1F C14479 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [1,1,0,0,0,0|1,0,1]=4 415 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.4 CCNC1=NC=CC=C1N AC7989 [1,1,0,0,0,0|1,0,1]=4 417 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [1,1,0,0,0,0|1,0,1]=4 419 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [1,1,0,0,0,0|0,0,1]=3 420 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [1,1,0,0,0,0|1,0,1]=4 421 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [1,1,0,0,0,0|0,0,2]=4 423 B10R1.20 CNC1=C(OC)C=CC=N1 77471 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.20 CNC1=C(SC)C=CC=C1 AT20832 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.20 COC1=C(CN)C=CN=C1 P16442 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.20 COC1=C(CN)N=CC=C1 O10088 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.20 COC1=C(NN)C=CC=C1 71208 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.20 COC1=NC=CC=C1CN 36590 [1,1,0,0,0,0|2,0,0]=4 429 B10R1.20 N#CC1=C(C=O)C=CC=N1 P10442 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.20 N#CC1=C(C=O)C=NC=C1 P12254 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.20 N#CC1=CC=CN=C1C=O P10836 [1,1,0,0,0,0|1,0,1]=4 432 B10R1.25 C=CC1=C(F)C=C(Cl)C=C1 AC6667 [1,1,0,0,0,0|1,0,1]=4 433 B10R1.25 CC1=CC(Br)=C(C=O)C=N1 C14106 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.25 CC1=CC(Br)=C(C=O)N=C1 53823 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.25 CC1=CC(Cl)=CN=C1C=O 97693 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [1,1,0,0,0,0|0,0,0]=2 437 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [1,1,0,0,0,0|0,0,2]=4 438 B10R1.25 CC1=NC(C)=C(C=O)C=C1 F12423 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [1,1,0,0,0,0|0,0,1]=3 440 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.25 CNC1=CN=C(Br)C=C1N 53659 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.25 CNC1=NC=C(C)C=C1N D75084 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.25 COC1=NC=C(C)C=C1N D74381 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.25 NC1=C(C=O)C=CC(Br)=N1 97231 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 66186 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [1,1,0,0,0,0|0,0,2]=4 451 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [1,1,0,0,0,0|1,0,1]=4 452 B10R1.25 O=CC1=C(Cl)C=C(F)C=N1 BL010213 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 C90858 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.25 O=CC1=CC=C(F)N=C1Br AT22753 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.30 C#CC1=C(N)C=CC(F)=C1 AC7120 [1,1,0,0,0,0|0,0,2]=4 456 B10R1.30 C=CC1=C(Cl)C=CC(Cl)=C1 CK2537 [1,1,0,0,0,0|1,0,1]=4 457 B10R1.30 C=CC1=C(F)C=CC(F)=C1 CK2551 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.30 CC1=CC(C=O)=C(Br)C=N1 D72245 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.30 CC1=CN=C(F)C=C1C=O AT26672 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.30 CC1=NC=C(F)C=C1C=O C16838 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [1,1,0,0,0,0|1,0,1]=4 462 B10R1.30 CCC1=CC(Br)=NC=C1N 51679 [1,1,0,0,0,0|1,0,1]=4 463 B10R1.30 CNC1=C(F)C=CC(Br)=C1 AC3023 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C76710 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.30 CNC1=C(O)C=CC(C)=C1 C16345 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.30 CNC1=NC(C)=CC=C1N S10557 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.30 COC1=C(S)C=CC(N)=C1 D87749 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 C13369 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.30 CSC1=C(N)C=CC(C)=C1 AT20827 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.30 NC1=C(C=O)C=C(I)C=C1 F15851 [1,1,0,0,0,0|0,0,0]=2 472 B10R1.30 NC1=C(C=O)N=C(Cl)C=C1 O10939 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.30 NC1=NC=C(Br)C=C1C=O N10755 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.30 NCC1=C(N)C=CC(Br)=C1 O10495 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.30 NCC1=C(N)C=CC(F)=C1 CK2412 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.30 O=CC1=CC(Br)=CN=C1Br FD10640 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.30 O=CC1=CC(Br)=NC=C1Br 80248 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.30 O=CC1=CC(Br)=NC=C1Cl 88069 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.30 O=CC1=CC(Br)=NC=C1O D70761 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.30 O=CC1=CC(Cl)=CNC1=O AT24459 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.30 O=CC1=CC(F)=CN=C1F AT10064 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.245 CC1=C(C=O)C(F)=NC=C1 AT13974 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.245 CC1=CC=CC(N)=C1C=O F15844 [1,1,0,0,0,0|0,0,0]=2 484 B10R1.245 CC1=CC=CC(N)=C1CO AC6550 [1,1,0,0,0,0|0,0,2]=4 485 B10R1.245 CC1=CN=CC(Br)=C1C=O 51803 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.245 CC1=CN=CC(C)=C1C=O 51703 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.245 CNC1=C(Br)C=NC=C1N 82297 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.245 COC1=C(I)C=CC=C1Cl C90767 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.245 COC1=C(O)C=CC=C1N AT15764 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.245 NC1=C(C=O)C(F)=NC=C1 O11152 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.245 O=CC1=C(Cl)C=NC=C1F 90327 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.245 O=CC1=C(F)C=CN=C1F 74527 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.59 CC(=O)C1=CC(N)=CN1C 97921 [0,1,0,0,1,0|2,0,0]=4 494 B10R1.59 CC(=O)C1=NN(C)C=C1N W12223 [0,1,0,0,1,0|2,0,0]=4 495 B10R1.59 NC(=O)C1=CC(Br)=CN1N P13138 [0,1,0,0,1,0|2,0,0]=4 496 B10R1.59 NC1=C(C(=O)O)SC(Br)=C1 58229 [0,1,0,0,1,0|2,0,0]=4 497 B10R1.149 COC(=O)C1=C(F)C=CN1 91532 [0,1,0,0,1,0|2,0,0]=4 498 B10R1.149 COC(=O)C1=C(N)C=CN1 D86691 [0,1,0,0,1,0|1,0,0]=3 499 B10R1.149 COC(=O)C1=CSC=C1C 57777 [0,1,0,0,1,0|2,0,0]=4 500 B10R1.149 COC(=O)C1=NSC=C1N AT21157 [0,1,0,0,1,0|2,0,0]=4 501 B10R1.149 NCC(=O)C1=C(N)NC=N1 P12482 [0,1,0,0,1,0|2,0,0]=4 502 B10R1.192 CC1=CSC(N)=C1C(=O)O 97717 [0,1,0,0,1,0|2,0,0]=4 503 B10R1.194 NC1=C(C(=O)O)SC=C1Br N16943 [0,1,0,0,1,0|2,0,0]=4 504 B12R1.75 CC(C)OC1=C(CN)C=CC=C1 S10925 [0,1,0,0,0,1|1,0,1]=4 505 B12R1.75 CN(C)CC1=C(CN)C=CC=C1 C90142 [0,1,0,0,0,1|2,0,0]=4 506 B12R1.75 COC1=C(CC(=O)Cl)C=CC=C1 F11411 [0,1,0,0,0,1|2,0,0]=4 507 B12R1.75 COC1=C(NC(C)=S)C=CC=C1 81285 [0,1,0,0,0,1|1,1,0]=4 508 B12R1.75 COC1=CC=CN=C1CC(C)=O F31310 [0,1,0,0,0,1|2,0,0]=4 509 B12R1.124 CC(=O)N(C)C1=C(Br)C=CC=C1 F53216 [0,1,0,0,0,1|1,0,0]=3 510 B12R1.124 CC(=O)[C@H](N)C1=C(Br)C=CC=C1 N15545 [0,1,0,0,0,1|1,0,0]=3 511 B12R1.124 CC(=O)[C@H](N)C1=C(C)C=CC=C1 N15524 [0,1,0,0,0,1|1,0,0]=3 512 B12R1.124 CC(=O)[C@H](N)C1=C(Cl)C=CC=C1 N15542 [0,1,0,0,0,1|1,0,0]=3 513 B12R1.124 CC(=O)[C@H](N)C1=C(F)C=CC=C1 N15536 [0,1,0,0,0,1|1,0,0]=3 514 B12R1.124 CC(C)[C@H](N)C1=C(N)C=CC=C1 N13005 [0,1,0,0,0,1|1,0,1]=4 515 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 N12290 [0,1,0,0,0,1|2,0,0]=4 516 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 N12294 [0,1,0,0,0,1|2,0,0]=4 517 B12R1.124 C[C@@H](O)[C@H](N)C1=C(N)C=CC=C1 N16152 [0,1,0,0,0,1|0,0,2]=4 518 B12R1.124 C[C@@H](O)[C@H](N)C1=C(N)C=CC=C1 N16154 [0,1,0,0,0,1|0,0,2]=4 519 B12R1.124 C[C@H](O)[C@H](N)C1=C(N)C=CC=C1 N16153 [0,1,0,0,0,1|0,0,2]=4 520 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 A50300 [0,1,0,0,0,1|2,0,0]=4 521 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 D84116 [0,1,0,0,0,1|2,0,0]=4 522 B12R1.124 O=C(O)[C@H](F)C1=C(F)C=CC=C1 98563 [0,1,0,0,0,1|2,0,0]=4 523 B12R1.127 CC(=O)NC1=C(Br)C=CC(C)=C1 75470 [0,1,0,0,0,1|1,0,0]=3 524 B12R1.127 CC(C)NC1=C(N)C=CC(Br)=C1 AC2781 [0,1,0,0,0,1|1,0,1]=4 525 B12R1.127 CC(C)OC1=C(N)C=CC(Br)=C1 53627 [0,1,0,0,0,1|1,0,1]=4 526 B12R1.127 CC(C)OC1=C(N)C=CC(Cl)=C1 95905 [0,1,0,0,0,1|1,0,1]=4 527 B12R1.127 CC1=CC(CC(=O)O)=C(Cl)C=C1 D96279 [0,1,0,0,0,1|2,0,0]=4 528 B12R1.127 NC(=O)CC1=C(Br)C=CC(Cl)=C1 AT11065 [0,1,0,0,0,1|2,0,0]=4 529 B12R1.127 NC(=O)CC1=C(F)C=CC(Br)=C1 92705 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.127 NC1=CC(CC(=O)O)=C(Cl)C=C1 C90866 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.127 O=C(O)CC1=C(O)C=CC(O)=C1 T70932 [0,1,0,0,0,1|2,0,0]=4 532 B12R1.151 C[S@](=N)(=O)CC1=C(F)C=CC=C1 E71970 [0,1,0,0,0,1|2,0,0]=4 533 B12R1.224 CC(=O)NC1=C(C)C(C)=CC=C1 F12500 [0,1,0,0,0,1|1,0,0]=3 534 B12R1.224 CC(=O)NC1=CC=CC(Br)=C1C F18030 [0,1,0,0,0,1|1,0,0]=3 535 B12R1.224 CC(=O)OC1=CN=CC(F)=C1C AC4174 [0,1,0,0,0,1|2,0,0]=4 536 B12R1.224 CC1=C(Br)C=CC=C1CC(=O)O CL9370 [0,1,0,0,0,1|2,0,0]=4 537 B12R1.224 CC1=C(Cl)C=CC=C1CC(=O)O C90794 [0,1,0,0,0,1|2,0,0]=4 538 B12R1.224 NC(=O)CC1=CC=CC(Br)=C1F 92646 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.224 O=C(O)CC1=C(O)C(O)=CC=C1 C78025 [0,1,0,0,0,1|2,0,0]=4 540 B12R1.224 O=C(O)CC1=CC=CC(Br)=C1O 97767 [0,1,0,0,0,1|2,0,0]=4 541 B12R1.233 C=C(C)OC1=C(C)C=C(Cl)C=C1 H11070 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.233 CC(=O)CC1=C(Cl)C=C(F)C=C1 F30166 [0,1,0,0,0,1|1,0,0]=3 543 B12R1.233 CC(=O)CC1=C(F)C=C(Cl)C=C1 96498 [0,1,0,0,0,1|1,0,0]=3 544 B12R1.233 CC(=O)NC1=C(C)C=C(Br)C=C1 C13349 [0,1,0,0,0,1|1,0,0]=3 545 B12R1.233 CC(=O)NC1=C(C)C=C(C)N=C1 F17997 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.233 CC(=O)NC1=C(I)C=C(F)C=C1 AT19905 [0,1,0,0,0,1|1,0,0]=3 547 B12R1.233 CC(=O)NC1=CC=C(Cl)N=C1I F51674 [0,1,0,0,0,1|2,0,0]=4 548 B12R1.233 CC(=O)NC1=CN=C(Br)C=C1C F18384 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.233 CC(=O)NC1=CN=C(Cl)C=C1C D87663 [0,1,0,0,0,1|2,0,0]=4 550 B12R1.233 CC(=O)OC1=C(F)C=C(Br)C=C1 AT14688 [0,1,0,0,0,1|1,0,0]=3 551 B12R1.371 C=CC(=O)NC1=C(Cl)C=CC=C1 N11716 [0,1,0,0,0,1|1,0,1]=4 552 B12R1.371 CCC(=O)CC1=C(Br)C=CC=C1 N12602 [0,1,0,0,0,1|1,0,0]=3 553 B12R1.371 CCC(=O)CC1=C(C)C=CC=C1 N14163 [0,1,0,0,0,1|1,0,0]=3 554 B12R1.371 CCC(=O)CC1=C(Cl)C=CC=C1 N14147 [0,1,0,0,0,1|1,0,0]=3 555 B12R1.371 COC(=O)CC1=C(N)C=NC=C1 F17906 [0,1,0,0,0,1|1,0,0]=3 556 B12R1.1009 CC(=O)CC1=C(Cl)C=CC=C1Cl T71476 [0,1,0,0,0,1|1,0,0]=3 557 B12R1.46 CNC1=C(C(=O)O)C=C(C)C=C1 69952 [0,2,0,0,0,0|1,0,0]=3 558 B12R1.46 CSC1=C(C(=O)O)C=C(Br)C=C1 95569 [0,2,0,0,0,0|2,0,0]=4 559 B12R1.46 CSC1=C(C(=O)O)C=C(Cl)C=C1 AT16919 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.46 N#CC1=C(C(=O)O)C=C(F)C=C1 CK2182 [0,2,0,0,0,0|1,0,1]=4 561 B12R1.46 N#CC1=C(C(=O)O)C=C(N)C=C1 D96199 [0,2,0,0,0,0|1,0,1]=4 562 B12R1.46 NCC1=C([N+](=O)[O-])C=C(Cl)C=C1 AT26647 [0,2,0,0,0,0|2,0,0]=4 563 B12R1.57 CC(=O)C1=C(C#N)C=C(F)C=C1 F13350 [0,2,0,0,0,0|0,0,1]=3 564 B12R1.57 CCC1=C(C(C)=O)C=CC(O)=C1 D88175 [0,2,0,0,0,0|1,0,0]=3 565 B12R1.57 CNC1=C(C(=O)O)C=CC(Br)=C1 D87579 [0,2,0,0,0,0|1,0,0]=3 566 B12R1.57 CNC1=C(C(=O)O)C=CC(Cl)=C1 C15968 [0,2,0,0,0,0|1,0,0]=3 567 B12R1.57 CNC1=C(C(=O)O)C=CC(F)=C1 S11455 [0,2,0,0,0,0|1,0,0]=3 568 B12R1.57 CNC1=CC(Cl)=NC=C1C(=O)O AT15547 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.57 COC1=C(C(=O)O)C=CC(O)=C1 AT19378 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=N1 N13947 [0,2,0,0,0,0|2,0,0]=4 571 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 W17789 [0,2,0,0,0,0|1,0,0]=3 572 B12R1.57 COC1=C(C(N)=O)C=CC(N)=C1 92906 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.57 CSC1=C(C(=O)O)C=CC(Br)=C1 AT10168 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.57 NCC1=C([N+](=O)[O-])C=CC(Cl)=C1 N13016 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.57 NCC1=C([N+](=O)[O-])C=CC(F)=C1 N12921 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.76 CC(F)(F)C1=C(CN)C=CC=C1 AC4635 [0,2,0,0,0,0|1,0,1]=4 577 B12R1.76 NNC1=C(S(=O)(=O)O)C=CC=C1 N10041 [0,2,0,0,0,0|2,0,0]=4 578 B12R1.77 COC(=O)C1=C(C#N)C=CN=C1 D87572 [0,2,0,0,0,0|1,0,1]=4 579 B12R1.77 COC(=O)C1=C(C=O)C=CN=C1 W18508 [0,2,0,0,0,0|2,0,0]=4 580 B12R1.77 COC(=O)C1=C(CBr)C=CN=C1 D80980 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.77 COC(=O)C1=C(CCl)C=NC=C1 90031 [0,2,0,0,0,0|2,0,0]=4 582 B12R1.77 COC(=O)C1=C(CN)N=CC=C1 D87629 [0,2,0,0,0,0|1,0,0]=3 583 B12R1.77 COC(=O)C1=C(OC)C=NC=C1 S10378 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.77 COC(=O)C1=CC=CN=C1CBr 90029 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.77 COC1=C(C(=O)CN)C=CC=C1 C74781 [0,2,0,0,0,0|1,0,0]=3 586 B12R1.77 COC1=C(C(=O)CO)C=CC=C1 AC5663 [0,2,0,0,0,0|1,0,0]=3 587 B12R1.77 N#CC1=C(C(=O)NN)C=CC=C1 O10762 [0,2,0,0,0,0|1,0,1]=4 588 B12R1.87 CSC1=C(Cl)C=CC=C1C(=O)O D85880 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.87 N#CC1=C(F)C=CC=C1C(=O)O 98175 [0,2,0,0,0,0|1,0,1]=4 590 B12R1.87 O=CC1=C(C(=O)O)C=CC=C1O AT18072 [0,2,0,0,0,0|2,0,0]=4 591 B12R1.261 CC(=O)C1=C(C(=O)O)C=CC=N1 O10637 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.261 CC(C)C1=C([C@H](C)N)C=CC=C1 N14848 [0,2,0,0,0,0|1,0,1]=4 593 B12R1.261 CN(C)C1=C(C(=O)O)C=NC=C1 D72071 [0,2,0,0,0,0|2,0,0]=4 594 B12R1.261 CN(C)C1=C(N(C)C)C=CC=C1 S11716 [0,2,0,0,0,0|2,0,0]=4 595 B12R1.283 C=CCC1=C(C(N)=O)C=CC=C1 AC6473 [0,2,0,0,0,0|2,0,0]=4 596 B12R1.283 N#CCC1=C(C(=O)O)C=CC=C1 BL003377 [0,2,0,0,0,0|1,0,1]=4 597 B12R1.283 NNCC1=C([N+](=O)[O-])C=CC=C1 W16013 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.437 CNC1=CC=CC(Cl)=C1[N+](=O)[O-] E72160 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.437 CNC1=CC=CC(F)=C1[N+](=O)[O-] AC8909 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.437 COC1=CC=CC(F)=C1C(N)=O C78284 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.437 COC1=CC=NC(N)=C1C(=O)O N12993 [0,2,0,0,0,0|2,0,0]=4 602 B12R1.126 CS(=O)(=O)C1=C(F)C=C(O)C=C1 94986 [0,2,0,0,0,0|2,0,0]=4 603 B12R1.126 NC1=C(S(N)(=O)=O)C=CC(Br)=C1 AT23129 [0,2,0,0,0,0|2,0,0]=4 604 B12R1.126 NC1=C(S(N)(=O)=O)C=CC(F)=C1 AT23131 [0,2,0,0,0,0|2,0,0]=4 605 B12R1.128 CC(C)(C)C1=C(N)C=CC(I)=C1 F50691 [0,2,0,0,0,0|1,0,1]=4 606 B12R1.228 CC1=C(Br)C=CC=C1S(C)(=O)=O AC7031 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.228 NC1=C(S(N)(=O)=O)C=CC=C1F AT23132 [0,2,0,0,0,0|2,0,0]=4 608 B12R1.1010 NC1=CC=CC(F)=C1S(N)(=O)=O AT23130 [0,2,0,0,0,0|2,0,0]=4 609 B12R1.894 CC(=O)C1=C(Br)C(C)=CC=C1F 51613 [0,2,0,0,0,0|1,0,0]=3 610 B12R1.894 CC(=O)C1=C(Br)C(F)=CC=C1F 51587 [0,2,0,0,0,0|1,0,0]=3 611 B12R1.894 CC(=O)C1=C(Br)C=CC(Cl)=C1F F50476 [0,2,0,0,0,0|1,0,0]=3 612 B12R1.894 CC(=O)C1=C(Br)C=CC(F)=C1F 51599 [0,2,0,0,0,0|1,0,0]=3 613 B12R1.894 CC(=O)C1=C(Cl)C(Cl)=CC=C1F D96252 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.894 CC(=O)C1=C(Cl)C(F)=CC=C1F 51644 [0,2,0,0,0,0|1,0,0]=3 615 B12R1.894 CC(=O)C1=C(O)C=CC(Cl)=C1O D75713 [0,2,0,0,0,0|1,0,0]=3 616 B12R1.894 CC1=C(C)C(C(=O)O)=C(Cl)C=C1 F11860 [0,2,0,0,0,0|2,0,0]=4 617 B12R1.894 CC1=C(Cl)C=CC(Cl)=C1C(=O)O AT10805 [0,2,0,0,0,0|2,0,0]=4 618 B12R1.894 CC1=C(F)C(C(=O)O)=C(Br)C=C1 89207 [0,2,0,0,0,0|2,0,0]=4 619 B12R1.894 CC1=C(F)C=CC(I)=C1C(=O)O 55378 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.894 CC1=C(F)C=CC(N)=C1C(=O)O D76770 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.894 CC1=C(I)C=CC(F)=C1C(=O)O 55394 [0,2,0,0,0,0|2,0,0]=4 622 B12R1.894 CC1=C(N)C(C(=O)O)=C(Cl)C=C1 AC7668 [0,2,0,0,0,0|1,0,0]=3 623 B12R1.894 CC1=C(N)C([N+](=O)[O-])=C(Cl)C=C1 82882 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.894 CC1=C(N)C=CC(F)=C1C(=O)O 55396 [0,2,0,0,0,0|2,0,0]=4 625 B12R1.894 CC1=CC=C(F)C(I)=C1C(=O)O 55370 [0,2,0,0,0,0|2,0,0]=4 626 B12R1.894 CC1=CC=C(N)C(C(=O)O)=C1F AT14753 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.894 N=C(N)C1=C(F)C=CC(F)=C1N V10263 [0,2,0,0,0,0|2,0,0]=4 628 B12R1.894 NC1=C(Br)C=CC(Cl)=C1C(=O)O 91441 [0,2,0,0,0,0|1,0,0]=3 629 B12R1.894 NC1=C(Br)C=CC(F)=C1C(=O)O D80108 [0,2,0,0,0,0|1,0,0]=3 630 B12R1.894 NC1=C(Br)C=CC(F)=C1[N+](=O)[O-] AC4829 [0,2,0,0,0,0|2,0,0]=4 631 B12R1.894 NC1=C(Cl)C=CC(F)=C1C(=O)O AC9267 [0,2,0,0,0,0|1,0,0]=3 632 B12R1.894 NC1=CC=C(Cl)C(C(=O)O)=C1Cl 81958 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.894 O=C(O)C1=C(Br)C(F)=CC=C1Br S10121 [0,2,0,0,0,0|2,0,0]=4 634 B12R1.894 O=C(O)C1=C(Br)C(F)=CC=C1F 34973 [0,2,0,0,0,0|2,0,0]=4 635 B12R1.894 O=C(O)C1=C(Br)C=CC(Cl)=C1F AT23381 [0,2,0,0,0,0|2,0,0]=4 636 B12R1.894 O=C(O)C1=C(Br)C=CC(F)=C1Cl C91624 [0,2,0,0,0,0|2,0,0]=4 637 B12R1.894 O=C(O)C1=C(Br)C=CC(O)=C1F AT21281 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.894 O=C(O)C1=C(Cl)C(Cl)=CC=C1Cl C75351 [0,2,0,0,0,0|2,0,0]=4 639 B12R1.1000 CC(=O)C1=C(Br)C=C(Br)C=C1O 93704 [0,2,0,0,0,0|1,0,0]=3 640 B12R1.1000 CC(=O)C1=C(Br)C=C(F)C=C1Br 94049 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.1000 CC(=O)C1=C(Cl)C=C(Br)C=C1F 88210 [0,2,0,0,0,0|1,0,0]=3 642 B12R1.1000 CC(=O)C1=C(Cl)C=C(Cl)N=C1Cl F13137 [0,2,0,0,0,0|2,0,0]=4 643 B12R1.1000 CC(=O)C1=C(F)C=C(I)C=C1F 93672 [0,2,0,0,0,0|1,0,0]=3 644 B12R1.1000 CC(=O)C1=C(F)C=C(O)C=C1F AC4047 [0,2,0,0,0,0|1,0,0]=3 645 B12R1.1000 CC1=CC(C)=C(C(=O)[O-])C(C)=C1 D89560 [0,2,0,0,0,0|2,0,0]=4 646 B12R1.1000 CC1=CC(C)=NC(N)=C1C(N)=O AT23977 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.1000 CC1=CC(Cl)=C(C(=O)O)C(Cl)=C1 93339 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.1000 CC1=CC(Cl)=CC(I)=C1C(=O)O 55380 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.1000 CC1=CC(F)=CC(F)=C1C(=O)O 97410 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.1000 CC1=CC(F)=CC(I)=C1C(=O)O 55384 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 95585 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.1000 NC(=O)C1=C(Br)C=C(Br)C=C1F F17851 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.1000 NC(=O)C1=C(F)C=C(N)C=C1F 92903 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.1000 NC(=O)C1=C(F)C=C(N)C=C1F 92904 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.1000 NC1=C(C(=O)O)C(Cl)=NC(Cl)=C1 E71761 [0,2,0,0,0,0|2,0,0]=4 656 B12R1.1000 NC1=CC(Cl)=C(C(=O)O)C(Cl)=C1 51298 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.1000 NC1=CC(F)=CC(Cl)=C1C(=O)O E72075 [0,2,0,0,0,0|1,0,0]=3 658 B12R1.1000 O=C(O)C1=C(Br)C=C(Br)C=C1F F18335 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.1000 O=C(O)C1=C(Br)C=C(Cl)C=C1F AT10675 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.1000 O=C(O)C1=C(Br)C=C(F)C=C1Cl AT10674 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.1000 O=C(O)C1=C(Cl)C=C(I)C=C1Cl CS2697 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.1000 O=C(O)C1=C(F)C=C(I)C=C1F 93673 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.3441 CCC(=O)C1=C(Br)C=CC=C1F N14041 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.3441 CCC(=O)C1=C(C)C=CC=C1C N14109 [0,2,0,0,0,0|1,0,0]=3 665 B12R1.3441 CCC(=O)C1=C(Cl)C=CC=C1Cl N12942 [0,2,0,0,0,0|1,0,0]=3 666 B12R1.3441 CCC(=O)C1=C(Cl)C=CC=C1F N12941 [0,2,0,0,0,0|1,0,0]=3 667 B12R1.3441 CCC(=O)C1=C(F)C=CC=C1C N14043 [0,2,0,0,0,0|1,0,0]=3 668 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1Br N11752 [0,2,0,0,0,0|1,0,0]=3 669 B12R1.3441 COC(=O)C1=C(Br)C=CN=C1Cl 55293 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.3441 COC(=O)C1=C(Br)C=NC=C1F AT10438 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.3441 COC(=O)C1=C(C)C=CN=C1Br 90162 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.3441 COC(=O)C1=C(C)C=CN=C1Cl 82626 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1N 51169 [0,2,0,0,0,0|0,0,0]=2 674 B12R1.3441 COC(=O)C1=C(O)N=CC=C1C 82630 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.3441 O=C(CO)C1=C(Cl)C=CC=C1Cl AC6627 [0,2,0,0,0,0|1,0,0]=3 676 B12R1.3441 O=C(CO)C1=C(Cl)C=CC=C1F AC4000 [0,2,0,0,0,0|1,0,0]=3 677 B12R1.24 CC1=CC=CC(C(=O)CCl)=C1O AC6764 [0,2,0,0,0,0|1,0,0]=3 678 B12R1.24 CCC(=O)C1=C(C)C(C)=CC=C1 N14095 [0,2,0,0,0,0|1,0,0]=3 679 B12R1.24 CCC(=O)C1=C(Cl)C(C)=CC=C1 N14078 [0,2,0,0,0,0|1,0,0]=3 680 B12R1.24 CCC(=O)C1=C(F)C(C)=CC=C1 N14020 [0,2,0,0,0,0|1,0,0]=3 681 B12R1.24 CCC(=O)C1=CC=CC(Br)=C1F N14019 [0,2,0,0,0,0|1,0,0]=3 682 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1Cl N14074 [0,2,0,0,0,0|1,0,0]=3 683 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1F 97466 [0,2,0,0,0,0|1,0,0]=3 684 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O P17540 [0,2,0,0,0,0|1,0,0]=3 685 B12R1.24 CNC(=O)C1=C(O)C(N)=CC=C1 F19753 [0,2,0,0,0,0|1,0,0]=3 686 B12R1.24 CNC(=O)C1=CC=CC(Br)=C1F AT22330 [0,2,0,0,0,0|1,0,0]=3 687 B12R1.24 CNC(=O)C1=CC=CC(Br)=C1N F15703 [0,2,0,0,0,0|0,0,0]=2 688 B12R1.24 COC(=O)C1=C(S)C(C)=CC=C1 AT20789 [0,2,0,0,0,0|1,0,0]=3 689 B12R1.24 COC(=O)C1=CC=CC(F)=C1Br D75737 [0,2,0,0,0,0|1,0,0]=3 690 B12R1.24 COC(=O)C1=CC=CC(O)=C1I 89862 [0,2,0,0,0,0|1,0,0]=3 691 B12R1.24 COC(=O)C1=CN=CC([O-])=C1Cl D81651 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1F 93034 [0,2,0,0,0,0|2,0,0]=4 693 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1F 93035 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.24 O=C(CBr)C1=C(O)C(F)=CC=C1 F13388 [0,2,0,0,0,0|1,0,0]=3 695 B12R1.440 CC(C)C1=CC=CC(C=O)=C1N C72170 [0,2,0,0,0,0|1,0,1]=4 696 B12R1.440 CC1=C(C(=O)O)C=CC=C1C#N AT21035 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.440 CNC1=CC=CC(C(=O)O)=C1O W11124 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.440 COC1=C(F)C(C(C)=O)=CC=C1 57987 [0,2,0,0,0,0|1,0,0]=3 699 B12R1.511 CC(=O)C1=CC(Br)=CC(F)=C1O AT14690 [0,2,0,0,0,0|1,0,0]=3 700 B12R1.511 CC(=O)C1=CC(C)=CC(Br)=C1O F50433 [0,2,0,0,0,0|1,0,0]=3 701 B12R1.511 CC(=O)C1=CC(Cl)=CC(Cl)=C1F 34134 [0,2,0,0,0,0|1,0,0]=3 702 B12R1.511 CC1=C(Br)C=C(I)C=C1C(=O)O AT12543 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.511 CC1=C(Cl)C=C(I)C=C1C(=O)O AT12521 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.511 CC1=C(F)C=C(Cl)C=C1C(=O)O AT24794 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.511 CC1=CC(Br)=C(C)C(C(=O)O)=C1 AT21289 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.511 CC1=CC(Br)=C(O)C(C(=O)O)=C1 AT22682 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.511 CC1=CC(Br)=CC([N+](=O)[O-])=C1N W15816 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.511 CC1=CC(Cl)=C(N)C(C(=O)O)=C1 TD1011 [0,2,0,0,0,0|1,0,0]=3 709 B12R1.511 CC1=CC(F)=C(N)C(C(=O)O)=C1 TD1012 [0,2,0,0,0,0|1,0,0]=3 710 B12R1.511 CC1=CC(F)=CC(C(=O)O)=C1F 22694 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.511 CC1=CC(I)=C(O)C(C(=O)O)=C1 AT22678 [0,2,0,0,0,0|2,0,0]=4 712 B12R1.511 CC1=CC(I)=CC(C(C)C)=C1N AT11104 [0,2,0,0,0,0|1,0,1]=4 713 B12R1.511 NC(=O)C1=C(N)C(Cl)=NC(Cl)=C1 W18198 [0,2,0,0,0,0|2,0,0]=4 714 B12R1.511 NC(=O)C1=CC(Cl)=CC(F)=C1Cl F20975 [0,2,0,0,0,0|2,0,0]=4 715 B12R1.511 NC1=C(Cl)C=C(Br)C=C1C(=O)O 79862 [0,2,0,0,0,0|1,0,0]=3 716 B12R1.511 NC1=C(I)C=C(Br)C=C1C(=O)O 94229 [0,2,0,0,0,0|1,0,0]=3 717 B12R1.511 O=C(O)C1=CC(Cl)=CC(Cl)=C1F 35054 [0,2,0,0,0,0|2,0,0]=4 718 B12R1.511 O=C(O)C1=CC(F)=CC(Br)=C1O AT11233 [0,2,0,0,0,0|2,0,0]=4 719 B12R1.511 O=C(O)C1=CC(I)=CC(F)=C1F AT12524 [0,2,0,0,0,0|2,0,0]=4 720 B12R1.511 O=C(O)C1=CC(O)=CC(F)=C1F 94775 [0,2,0,0,0,0|2,0,0]=4 721 B12R1.511 O=C([O-])C1=CC(I)=CC(I)=C1O D89910 [0,2,0,0,0,0|2,0,0]=4 722 B12R1.511 [2H]C1=CC([N+](=O)[O-])=C(N)C([2H])=C1 D98557 [0,2,0,0,0,0|2,0,0]=4 723 B12R1.893 CC(=O)C1=C(C)C(C)=C(O)C=C1 95925 [0,2,0,0,0,0|1,0,0]=3 724 B12R1.893 CC(=O)C1=C(Cl)C(C)=C(F)C=C1 AT15825 [0,2,0,0,0,0|1,0,0]=3 725 B12R1.893 CC1=C(C(=O)O)C=CC(Br)=C1F AT11325 [0,2,0,0,0,0|2,0,0]=4 726 B12R1.893 CC1=CC=C(C(=O)O)C(C)=C1Cl D86545 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.893 CC1=CC=C(C(=O)O)C(N)=C1F 97753 [0,2,0,0,0,0|1,0,0]=3 728 B12R1.893 NC(=O)C1=CN=C(Cl)C(F)=C1N E72119 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.893 NC1=C(C(=O)O)C=CC(Cl)=C1F 53899 [0,2,0,0,0,0|1,0,0]=3 730 B12R1.893 NC1=C(F)C(O)=CC=C1[N+](=O)[O-] AT11815 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.893 NC1=C([N+](=O)[O-])C=CC(Br)=C1Cl C90813 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.893 O=C(O)C1=C(F)C(O)=C(Br)C=C1 AT11234 [0,2,0,0,0,0|2,0,0]=4 733 B12R1.893 O=C(O)C1=CC=C(Cl)C(Cl)=C1F D86538 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1Br 93548 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.893 O=C(O)C1=CC=C(F)C(O)=C1Br AT11238 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.893 O=C([O-])C1=CC=C(F)C(F)=C1F CK2200 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.232 CC(=O)C1=CC(Cl)=C(Br)C=C1F AT21947 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1O P18161 [0,2,0,0,0,0|1,0,0]=3 739 B12R1.232 CC(=O)C1=CC(Cl)=C(O)C=C1O AT18320 [0,2,0,0,0,0|1,0,0]=3 740 B12R1.232 CC(=O)C1=CC(F)=C(Br)C=C1F 34098 [0,2,0,0,0,0|1,0,0]=3 741 B12R1.232 CC(=O)C1=CC(F)=C(O)C=C1O AT18317 [0,2,0,0,0,0|1,0,0]=3 742 B12R1.232 CC1=C(Br)C=C(N)C(C(=O)O)=C1 AT14637 [0,2,0,0,0,0|1,0,0]=3 743 B12R1.232 CC1=C(F)C=C(N)C(C(=O)O)=C1 Y11640 [0,2,0,0,0,0|1,0,0]=3 744 B12R1.232 CC1=C(F)C=C([N+](=O)[O-])C(N)=C1 22784 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.232 CC1=CC(Br)=C(C(=O)O)C=C1Br E10199 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1N 97574 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1N 53489 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.232 CC1=CC(Cl)=C(Br)C=C1C(=O)O W19669 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.232 CC1=CC(Cl)=C(C(=O)O)C=C1O O10736 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.232 CC1=CC(Cl)=C(I)C=C1C(=O)O AT12520 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.232 NC(=O)C1=CC(F)=C(Cl)C=C1F E72180 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.232 NC(=O)C1=CC(F)=C(F)C=C1F C78638 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.232 NC1=C(Cl)C=C(C(=O)O)C(O)=C1 AC5568 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.232 NC1=CC(F)=C(O)C=C1C(=O)O 83942 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.232 O=C(O)C1=C(I)C=C(Br)C(Cl)=C1 70146 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.232 O=C(O)C1=CC(Br)=C(Br)C=C1Br 70145 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1Cl F53436 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1O AT11228 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1O AT11227 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.452 CC(=O)C1=C(Cl)C=C(C#N)C=C1 52167 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.452 COC1=CC(N)=C(C(N)=O)C=C1 F15890 [0,2,0,0,0,0|1,0,0]=3 762 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 Y10543 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.452 N#CC1=CC(F)=C(C(=O)Cl)C=C1 58517 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.452 O=C(O)C1=C(F)C=C(CBr)C=C1 D95479 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.452 O=CC1=CC(Br)=C(C(=O)O)C=C1 R10022 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.1703 CCC(=O)C1=C(Br)C=C(Br)C=C1 N14094 [0,2,0,0,0,0|1,0,0]=3 767 B12R1.1703 CCC(=O)C1=C(C)C=C(C)C=C1 N12084 [0,2,0,0,0,0|1,0,0]=3 768 B12R1.1703 CCC(=O)C1=C(C)C=C(O)C=C1 91379 [0,2,0,0,0,0|1,0,0]=3 769 B12R1.1703 CCC(=O)C1=C(Cl)C=C(Br)C=C1 98264 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.1703 CCC(=O)C1=C(Cl)C=C(C)C=C1 N14082 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.1703 CCC(=O)C1=C(F)C=C(C)C=C1 N14029 [0,2,0,0,0,0|1,0,0]=3 772 B12R1.1703 CCC(=O)C1=C(O)C=C(Cl)C=C1 98266 [0,2,0,0,0,0|1,0,0]=3 773 B12R1.1703 CNC(=O)C1=C(Cl)C=C(N)C=C1 92895 [0,2,0,0,0,0|1,0,0]=3 774 B12R1.1703 COC(=O)C1=C(C)OC(=O)C=C1 C16199 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.1703 COC(=O)C1=C(Cl)N=C(Br)C=C1 D74278 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.1703 COC(=O)C1=C(N)N=C(N)N=C1 F30784 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.1703 COC(=O)C1=C(S)C=C(Cl)C=C1 AT20785 [0,2,0,0,0,0|1,0,0]=3 778 B12R1.1703 COC(=O)C1=CN=C(Br)C=C1Br F17566 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.1703 C\C(=N/O)C1=C([Pd+])C=C(O)C=C1 T70903 [0,2,0,0,0,0|1,0,1]=4 780 B12R1.1703 O=C(CBr)C1=C(Br)C=C(Cl)C=C1 96292 [0,2,0,0,0,0|1,0,0]=3 781 B12R1.1703 O=C(CBr)C1=NC=C(Cl)C=C1Cl A10726 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.1703 O=C(CCl)C1=C(Cl)C=C(F)C=N1 BL010220 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.1703 O=C(CCl)C1=C(O)C=C(F)C=C1 AC4164 [0,2,0,0,0,0|1,0,0]=3 784 B12R1.1703 O=C(CO)C1=C(Cl)C=C(Br)C=C1 AC4519 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.1703 O=C(CO)C1=C(F)C=C(Br)C=C1 AC4523 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.1703 O=C(CO)C1=C(F)C=C(F)C=C1 AC4317 [0,2,0,0,0,0|1,0,0]=3 787 B12R1.1703 O=C(NO)C1=C(Br)C=C(Cl)C=C1 96293 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.1703 O=CC(=O)C1=C(F)C=C(F)C=C1 75347 [0,2,0,0,0,0|1,0,1]=4 789 B12R1.354 CC1=CC(C(=O)NN)=C(C)C=C1 W15991 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.354 CCC(=O)C1=C(Br)C=CC(Br)=C1 N14118 [0,2,0,0,0,0|1,0,0]=3 791 B12R1.354 CCC(=O)C1=C(Cl)C=CC(Cl)=C1 N14112 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.354 CCC(=O)C1=C(F)C=CC(C)=C1 N14035 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.354 CCC(=O)C1=C(F)C=CC(Cl)=C1 N14033 [0,2,0,0,0,0|1,0,0]=3 794 B12R1.354 CNC(=O)C1=C(N)C=CC(Br)=N1 F30701 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.354 CNC(=O)C1=CC(Br)=CN=C1Cl AT23099 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.354 COC(=O)C1=C(Br)C=CC(F)=N1 85646 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.354 COC(=O)C1=C(C)N=CC(N)=C1 F14199 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.354 COC(=O)C1=C(I)C=CC(O)=C1 A10040 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.354 COC(=O)C1=C(S)C=CC(Br)=C1 93490 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1Br D76941 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1F 21049 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.354 COC(=O)C1=CC(Cl)=NC=C1C AT21682 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.354 COC(=O)C1=CC(F)=CN=C1N F30089 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.354 NCC(=O)C1=C(F)C=CC(F)=C1 O10640 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.354 O=C(CO)C1=C(Cl)C=CC(Cl)=C1 AC6588 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.354 O=C(CO)C1=C(F)C=CC(Br)=C1 AC4482 [0,2,0,0,0,0|1,0,0]=3 807 B12R1.354 O=C(CO)C1=C(F)C=CC(F)=C1 AC7306 [0,2,0,0,0,0|1,0,0]=3 808 B12R1.453 CC(=O)C1=C(Br)C=CC(C#N)=C1 AC8255 [0,2,0,0,0,0|1,0,0]=3 809 B12R1.453 CC(=O)C1=C(O)C=CC(CCl)=C1 F13165 [0,2,0,0,0,0|1,0,0]=3 810 B12R1.453 CC(=O)C1=C(O)C=CC(CO)=C1 F13145 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.453 CC(C)C1=C(N)C=CC(C#N)=C1 C90774 [0,2,0,0,0,0|1,0,1]=4 812 B12R1.453 CC1=C(C(=O)O)C=C(CN)C=C1 F13782 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.453 COC1=CC(C(C)=O)=C(F)C=N1 54893 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.453 COC1=CC(C(C)=O)=C(O)N=C1 P20934 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.453 CSC1=CC(C(=O)O)=C(C)C=C1 AT20791 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.453 CSC1=CC(C(=O)O)=C(O)C=C1 AT20799 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.453 N#CC1=CC(C(=O)Cl)=C(Cl)C=C1 AB8868 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.453 O=C(O)C1=C(Br)C=CC(CBr)=C1 W11383 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.453 O=C(O)C1=C(F)C=CC(CBr)=C1 F21176 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.308 C=COC(=O)C1=C(Cl)C=CC=C1 T70344 [0,2,0,0,0,0|1,0,1]=4 821 B12R1.308 CCCC(=O)C1=C(Br)C=CC=C1 N13959 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.308 CCCC(=O)C1=C(C)C=CC=C1 N13966 [0,2,0,0,0,0|1,0,0]=3 823 B12R1.308 CCCC(=O)C1=C(Cl)C=CC=C1 N12776 [0,2,0,0,0,0|1,0,0]=3 824 B12R1.308 CCCC(=O)C1=C(Cl)C=CN=C1 N14268 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.308 CCCC(=O)C1=C(F)C=CC=C1 N13948 [0,2,0,0,0,0|1,0,0]=3 826 B12R1.308 CCCC(=O)C1=CC=CN=C1Br N14265 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.308 CCOC(=N)C1=C(F)C=CC=C1 AC6130 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.308 CCOC(=O)C1=C(C)C=NC=C1 90030 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.308 CCOC(=O)C1=C(Cl)C=CN=C1 25333 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.308 CCOC(=O)C1=CC=CN=C1F 91498 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.308 CCOC(=O)C1=NC=CC=C1O AC5369 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.308 CCOC(=O)C1=NC=NC=C1N F13751 [0,2,0,0,0,0|2,0,0]=4 833 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,0,1,1,0,0|2,0,0]=4 834 B10R1.23 CC(=O)C(=O)C1=CC=CS1 H11148 [0,0,1,1,0,0|2,0,0]=4 835 B10R1.31 C=CC1=CSC(C(C)=O)=C1 A51005 [0,0,1,1,0,0|2,0,0]=4 836 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [1,0,0,1,0,0|1,0,1]=4 837 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [1,0,0,1,0,0|2,0,0]=4 838 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [1,0,0,1,0,0|2,0,0]=4 839 B10R2.7 C1=CC2=C(C=N1)NN=C2 W10136 [1,0,0,1,0,0|2,0,0]=4 840 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [1,0,0,1,0,0|1,0,1]=4 841 B10R2.32 O=C1CCC2=CNC=C12 F12460 [0,0,0,1,1,0|2,0,0]=4 842 B12R2.24 CC1=CC2=C(C=CC=C2)CN1 F12577 [0,0,0,1,0,1|2,0,0]=4 843 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)C1 F50994 [0,0,0,1,0,1|1,0,1]=4 844 B12R2.24 O=C1COC2=C(C=CC=C2)C1 F53084 [0,0,0,1,0,1|1,0,0]=3 845 B12R2.24 O=C1CSC2=C(N=CC=C2)N1 92244 [0,0,0,1,0,1|2,0,0]=4 846 B12R2.24 O=C1N=CC2=C(C=CC=C2)N1 F15801 [0,0,0,1,0,1|2,0,0]=4 847 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 AC3815 [0,0,0,1,0,1|2,0,0]=4 848 B12R2.202 CC1=CC2=C(C=CC=C2C)N1 C14038 [0,0,0,1,0,1|2,0,0]=4 849 B12R2.202 CC1=CC2=C(Cl)C=CC=C2N1 24210 [0,0,0,1,0,1|2,0,0]=4 850 B12R2.202 CC1=CC2=C(N1)C(N)=NC=C2 I10867 [0,0,0,1,0,1|2,0,0]=4 851 B12R2.202 CC1=CC2=CC=CC(Br)=C2N1 AT16060 [0,0,0,1,0,1|2,0,0]=4 852 B12R2.202 CC1=CC2=CC=CC(Br)=C2O1 76396 [0,0,0,1,0,1|2,0,0]=4 853 B12R2.202 CC1=CC2=CC=CC(N)=C2N1 P20352 [0,0,0,1,0,1|1,0,0]=3 854 B12R2.202 CC1=CC=CC2=C1N=C(C)S2 F15163 [0,0,0,1,0,1|1,1,0]=4 855 B12R2.202 CC1=CC=CC2=C1NC(=O)O2 AC6817 [0,0,0,1,0,1|2,0,0]=4 856 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 26000 [0,0,0,1,0,1|2,0,0]=4 857 B12R2.202 CC1=NC2=CC=CC(Cl)=C2O1 AC3595 [0,0,0,1,0,1|2,0,0]=4 858 B12R2.202 CC1=NC2=CC=CC(F)=C2O1 AC3582 [0,0,0,1,0,1|2,0,0]=4 859 B12R2.202 CC1=NN2C=CC=C(N)C2=N1 AT12138 [0,0,0,1,0,1|2,0,0]=4 860 B12R2.202 NC1=CC=CC2=C1CC(=O)C2 53595 [0,0,0,1,0,1|0,0,0]=2 861 B12R2.202 NC1=CC=CC2=C1N=C(N)O2 AC4477 [0,0,0,1,0,1|1,0,1]=4 862 B12R2.202 NC1=CC=CC2=C1N=C(S)O2 AC4524 [0,0,0,1,0,1|1,0,1]=4 863 B12R2.202 NC1=CC=CC2=C1NC(=O)O2 C16414 [0,0,0,1,0,1|1,0,0]=3 864 B12R2.202 NC1=NC=CC2=C1NC(=O)C2 F12565 [0,0,0,1,0,1|1,0,0]=3 865 B12R2.202 O=C1CC2=CC=CC(I)=C2N1 D76870 [0,0,0,1,0,1|1,0,0]=3 866 B12R2.202 O=C1NC2=C(Br)C=CC=C2O1 C92124 [0,0,0,1,0,1|2,0,0]=4 867 B12R2.202 O=C1NC2=CC=CC(Br)=C2N1 AT12815 [0,0,0,1,0,1|2,0,0]=4 868 B12R2.202 O=C1NC2=CC=CC(Cl)=C2O1 AC6894 [0,0,0,1,0,1|2,0,0]=4 869 B12R2.1081 C=C1CCCC2=C1C=CC=C2 D87874 [0,1,0,1,0,0|2,0,0]=4 870 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 71815 [0,1,0,1,0,0|1,0,1]=4 871 B12R2.1081 O=C1C=CNC2=CC=CN=C12 N16989 [0,1,0,1,0,0|1,0,1]=4 872 B12R2.1081 O=C1CNCC2=C1C=CC=C2 F12400 [0,1,0,1,0,0|0,0,0]=2 873 B12R2.1081 O=C1NCCC2=C1C=CN=C2 D84896 [0,1,0,1,0,0|2,0,0]=4 874 B12R2.1081 O=C1OC=NC2=C1C=CC=C2 D72797 [0,1,0,1,0,0|0,0,2]=4 875 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 95583 [0,1,0,1,0,0|0,0,2]=4 876 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 F13197 [0,1,0,1,0,0|0,0,2]=4 877 B12R2.2028 O=C1C[C@H](O)C2=C1C=CC=C2 93243 [0,1,0,1,0,0|1,0,0]=3 878 B12R2.2048 NCC1=C(C2CC2)C=CC=C1 26242 [0,1,0,1,0,0|1,0,1]=4 879 B12R2.203 BrC1=NNC2=CC=CC(I)=C21 C16605 [0,1,0,1,0,0|2,0,0]=4 880 B12R2.203 CC1=C2C(=CC=C1)NN=C2Cl F18554 [0,1,0,1,0,0|2,0,0]=4 881 B12R2.203 CC1=C2C(=CC=C1)NN=C2O F18288 [0,1,0,1,0,0|1,0,1]=4 882 B12R2.203 CC1=C2C(=O)NCC2=CC=C1 O11662 [0,1,0,1,0,0|1,0,0]=3 883 B12R2.203 CC1=C2C(=O)OCC2=CC=C1 I11580 [0,1,0,1,0,0|1,0,0]=3 884 B12R2.203 CC1=CNC2=C1C(N)=CC=C2 P12117 [0,1,0,1,0,0|1,0,0]=3 885 B12R2.203 CC1=CNC2=CC=CC(Cl)=C12 82101 [0,1,0,1,0,0|1,0,0]=3 886 B12R2.203 CC1=CNC2=NC=CC(N)=C12 P13299 [0,1,0,1,0,0|2,0,0]=4 887 B12R2.203 CC1=COC2=CC=CC(Br)=C12 F30977 [0,1,0,1,0,0|1,0,1]=4 888 B12R2.203 CC1=NNC2=CC=CC(O)=C21 F17559 [0,1,0,1,0,0|1,0,0]=3 889 B12R2.203 CC1=NNC2=NC=CC(Cl)=C12 O11214 [0,1,0,1,0,0|2,0,0]=4 890 B12R2.203 CN1C=CC2=CC=CC(N)=C21 N13008 [0,1,0,1,0,0|2,0,0]=4 891 B12R2.203 FC1=CNC2=CC=CC(Br)=C12 AC1901 [0,1,0,1,0,0|1,0,1]=4 892 B12R2.203 IC1=NNC2=CC=CC(I)=C21 C16604 [0,1,0,1,0,0|2,0,0]=4 893 B12R2.203 NC1=CC=CC2=NNC(=O)N12 C92929 [0,1,0,1,0,0|2,0,0]=4 894 B12R2.203 O=C1COC2=CC=CC(Cl)=C12 AT10336 [0,1,0,1,0,0|1,0,0]=3 895 B12R2.203 O=C1NCC2=NC=CC(Cl)=C12 E71331 [0,1,0,1,0,0|2,0,0]=4 896 B12R2.196 BrC1=CC=CC2=C1NC=C2I F17983 [0,1,0,1,0,0|1,0,1]=4 897 B12R2.196 CC1=CC=CC2=C1NN=C2O F18597 [0,1,0,1,0,0|1,0,1]=4 898 B12R2.196 CC1=CC=CC2=C1OCC2=O 32296 [0,1,0,1,0,0|1,0,0]=3 899 B12R2.196 CC1=CNC2=C(N)C=CC=C12 F50995 [0,1,0,1,0,0|1,0,0]=3 900 B12R2.196 CC1=COC2=C(Br)C=CC=C12 76397 [0,1,0,1,0,0|2,0,0]=4 901 B12R2.196 NC1=CC=CC2=C1NC=C2Cl AC8606 [0,1,0,1,0,0|1,0,1]=4 902 B12R2.196 O=C1CCN2C(=O)C=CC=C12 AT19288 [0,1,0,1,0,0|2,0,0]=4 903 B12R2.196 OC1=NNC2=C(F)C=CC=C12 F18746 [0,1,0,1,0,0|1,0,1]=4 904 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 F21430 [0,1,0,1,0,0|2,0,0]=4 905 B12R2.612 CC1=CC2=C(C=C1)C(Br)=NN2 P10511 [0,1,0,1,0,0|2,0,0]=4 906 B12R2.612 CC1=CC2=C(C=C1)C(Cl)=NN2 C16594 [0,1,0,1,0,0|2,0,0]=4 907 B12R2.612 CC1=CC2=C(C=C1)C(N)=NN2 90926 [0,1,0,1,0,0|2,0,0]=4 908 B12R2.612 CC1=CNC2=C1C=CC(N)=N2 P14438 [0,1,0,1,0,0|2,0,0]=4 909 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 V10221 [0,1,0,1,0,0|2,0,0]=4 910 B12R2.612 CC1=NSC2=C1C=CC(Br)=C2 E72372 [0,1,0,1,0,0|2,0,0]=4 911 B12R2.612 CC1=NSC2=C1C=CC(N)=C2 E72373 [0,1,0,1,0,0|2,0,0]=4 912 B12R2.612 ClC1=CNC2=C1C=CC(Br)=C2 W17736 [0,1,0,1,0,0|1,0,1]=4 913 B12R2.612 NC1=CC2=C(C=C1)C(N)=NN2 C16551 [0,1,0,1,0,0|2,0,0]=4 914 B12R2.612 NC1=NNC2=C1C=CC(I)=C2 W13470 [0,1,0,1,0,0|2,0,0]=4 915 B12R2.612 O=C1CCC2=C1C=CC(Cl)=N2 94539 [0,1,0,1,0,0|2,0,0]=4 916 B12R2.612 O=C1CCC2=C1C=CC(S)=C2 79915 [0,1,0,1,0,0|1,0,0]=3 917 B12R2.612 O=C1N=CC2=C1C=CC(F)=C2 W17708 [0,1,0,1,0,0|2,0,0]=4 918 B12R2.612 O=C1ONC2=C1C=CC(Br)=C2 D78660 [0,1,0,1,0,0|1,0,0]=3 919 B12R2.612 OC1=NNC2=C1C=CC(Cl)=C2 S10302 [0,1,0,1,0,0|1,0,1]=4 920 B12R2.1317 NC1=C(C2CC2)C=CC(Cl)=C1 AC9037 [0,1,0,1,0,0|1,0,1]=4 921 B12R2.132 BrC1=CC2=C(C=C1)NC=C2Br C16409 [0,1,0,1,0,0|1,0,1]=4 922 B12R2.132 BrC1=CC2=C(C=C1)NN=C2Br 25334 [0,1,0,1,0,0|2,0,0]=4 923 B12R2.132 CC1=CC2=C(C=C1)COC2=O F13924 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.132 CC1=CC2=C(C=C1)NN=C2Br 71676 [0,1,0,1,0,0|2,0,0]=4 925 B12R2.132 CC1=CC2=C(C=C1)SC=C2C 60584 [0,1,0,1,0,0|2,0,0]=4 926 B12R2.132 CC1=NNC2=C1C=C(Br)C=C2 F13807 [0,1,0,1,0,0|1,0,0]=3 927 B12R2.132 CC1=NNC2=C1C=C(O)C=C2 83020 [0,1,0,1,0,0|1,0,0]=3 928 B12R2.132 CC1=NOC2=C1C=C(Cl)C=C2 D78622 [0,1,0,1,0,0|2,0,0]=4 929 B12R2.132 IC1=CC2=C(C=C1)NN=C2I F18192 [0,1,0,1,0,0|2,0,0]=4 930 B12R2.132 NC1=CC2=C(C=C1)NN=C2O 97386 [0,1,0,1,0,0|1,0,1]=4 931 B12R2.132 NC1=CC2=C(C=C1)NN=C2O I11429 [0,1,0,1,0,0|1,0,1]=4 932 B12R2.132 NC1=CNC2=C1C=C(Br)C=C2 C90107 [0,1,0,1,0,0|1,0,1]=4 933 B12R2.132 NC1=CNC2=C1C=C(Br)C=C2 S10690 [0,1,0,1,0,0|1,0,1]=4 934 B12R2.132 O=C1C=CC2=C1C=C(Br)C=C2 D78663 [0,1,0,1,0,0|1,0,1]=4 935 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 52578 [0,1,0,1,0,0|1,0,0]=3 936 B12R2.132 O=C1NNC2=NC=C(Br)C=C12 C91217 [0,1,0,1,0,0|2,0,0]=4 937 B12R2.132 O=C1ONC2=C1C=C(Br)C=C2 D78661 [0,1,0,1,0,0|1,0,0]=3 938 B12R2.132 OC1=NNC2=C1C=C(F)C=C2 97402 [0,1,0,1,0,0|1,0,1]=4 939 B12R2.132 OC1=NNC2=C1C=C(F)C=C2 I10228 [0,1,0,1,0,0|1,0,1]=4 940 B12R2.1316 NC1=C(C2CC2)C=C(F)C=C1 AC3387 [0,1,0,1,0,0|1,0,1]=4 941 B12R2.1 COC1=NNC2=C1C=CC=C2 P11898 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.1 CSC1=CNC2=C1C=CC=C2 80001 [0,1,0,1,0,0|1,0,0]=3 943 B12R2.1 ClCC1=COC2=C1C=CC=C2 C76142 [0,1,0,1,0,0|2,0,0]=4 944 B12R2.1 NCC1=CNC2=C1C=CC=C2 C80078 [0,1,0,1,0,0|1,0,0]=3 945 B12R2.1 NCC1=CNC2=NC=CC=C12 P11573 [0,1,0,1,0,0|2,0,0]=4 946 B12R2.1 NCC1=COC2=C1C=CC=C2 AC4652 [0,1,0,1,0,0|2,0,0]=4 947 B12R2.1 NCC1=NNC2=NC=CC=C12 P12056 [0,1,0,1,0,0|2,0,0]=4 948 B12R2.1 NC[C@H]1CNC2=C1C=CC=C2 AC7339 [0,1,0,1,0,0|1,0,1]=4 949 B12R2.1 O=CC1=C2C=CC=CC2=NN1 F17858 [0,1,0,1,0,0|1,0,1]=4 950 B12R2.1 O=C[C@@H]1CCC2=C1C=CC=C2 D78606 [0,1,0,1,0,0|1,0,1]=4 951 B12R2.1 OCC1=COC2=C1C=CC=C2 AC6184 [0,1,0,1,0,0|2,0,0]=4 952 B12R2.1 OCC1=NNC2=C1C=CC=N2 F18583 [0,1,0,1,0,0|2,0,0]=4 953 B12R2.18 CN1C(=O)NC2=C1C=CC=N2 D72038 [0,1,0,1,0,0|2,0,0]=4 954 B12R2.18 CN1C(=O)NC2=C1C=NC=C2 D72037 [0,1,0,1,0,0|2,0,0]=4 955 B12R2.18 CN1CC2=C(C=CC=N2)C1=O F18170 [0,1,0,1,0,0|2,0,0]=4 956 B12R2.18 N[C@H]1CC2=C(C=CC=C2)C1=O 66097 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.18 O=C1NC2=C(C=CN=C2)C1=O W17877 [0,1,0,1,0,0|1,0,1]=4 958 B12R2.18 O=C1NC2=C(C=NC=C2)C1=O C15054 [0,1,0,1,0,0|1,0,1]=4 959 B12R2.18 O=C1OC2=C(C=CC=C2)C1=O AC2209 [0,1,0,1,0,0|1,0,1]=4 960 B8R1.7 CC(=O)C1=CN=CO1 F19037 [1,0,0,0,1,0|2,0,0]=4 961 B8R1.7 CC(=O)C1=COC=N1 AT18593 [1,0,0,0,1,0|2,0,0]=4 962 B8R1.7 CC(=O)C1=CSN=C1 AT21129 [1,0,0,0,1,0|2,0,0]=4 963 B8R1.11 CC1=C(C=O)C=CS1 AT16762 [1,0,0,0,1,0|2,0,0]=4 964 B8R1.11 NC1=C(C=O)SC=C1 O10948 [1,0,0,0,1,0|1,0,0]=3 965 B8R1.11 O=CC1=C(I)C=CS1 AT16727 [1,0,0,0,1,0|2,0,0]=4 966 B8R1.11 O=CC1=CNC=C1Br AT16220 [1,0,0,0,1,0|2,0,0]=4 967 B8R1.11 O=CC1=CSC=C1Cl AT16877 [1,0,0,0,1,0|2,0,0]=4 968 B12R1.125 CC(=O)SCC1=C(Cl)C=CC=C1 W11173 [0,0,0,0,0,2|1,0,0]=3 969 B12R1.125 NC1=C(CCC(=O)O)C=CC=C1 F52868 [0,0,0,0,0,2|1,0,0]=3 970 B12R1.125 NC1=C(\C=C\C(=O)O)C=CC=N1 V10202 [0,0,0,0,0,2|2,0,0]=4 971 B12R1.125 O=C(O)CNC1=C(Br)C=CC=C1 CL8802 [0,0,0,0,0,2|2,0,0]=4 972 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 61030 [0,0,0,0,0,2|2,0,0]=4 973 B12R1.125 O=C(O)CSC1=C(Br)C=CC=C1 AT20945 [0,0,0,0,0,2|2,0,0]=4 974 B12R1.125 O=C(O)CSC1=C(O)C=CC=C1 AT20931 [0,0,0,0,0,2|2,0,0]=4