0 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.13 CC(C)C1=NC=C(N)C=N1 81917 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 CC(C)C1=NN=C(Br)C=C1 C14147 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC(C)[C@H]1C=CC(=O)CC1 AT12689 [0,0,0,0,0,0|1,0,3]=4 5 B10R1.13 CC1=CC=C(N(C)N)N=N1 20185 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.13 CC1=CN=C(B(O)O)C=C1 F10369 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 CC1=CN=C(B([O-])O)C=C1 AT15741 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 CC1=CN=C(C(=N)N)C=C1 W19131 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.13 CC1=CN=C([C@H](C)N)C=N1 56573 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10886 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 AT10887 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 C90363 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.13 CC1=NC=C([C@H](C)O)C=N1 AT10878 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 CN(C)C1=CN=C(I)C=N1 O11454 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.13 CN(C)C1=NC=C(N)C=C1 D74940 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 N11221 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D81683 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y10703 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 90531 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N16973 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90529 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 91194 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 P12221 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 C[C@H](O)C1=CN=C(F)C=C1 AT10687 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10690 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.13 C[C@H](O)C1=NC=C(O)C=N1 73092 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 C[N+]1=CC=C(B(O)O)C=C1 AT14603 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.13 NC1=NC=C(C(F)F)C=C1 W16938 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.1 CC1=CN=C(CBr)N=C1 95158 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.1 CC1=CN=C(CCl)N=C1 P10954 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [1,0,0,0,0,0|2,0,0]=3 41 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.1 CC1=NC=C(NN)C=C1 P10368 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.1 CNC1=CC=C(C)N=N1 AT18436 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.1 COC1=CN=C(I)C=C1 F17075 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 CSC1=NC=C(C)C=N1 E70474 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.1 NCC1=NC=C(F)C=C1 83593 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.6 CN(C)C1=NC=NC=C1 O12006 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.6 C[C@H](Br)C1=NC=CN=C1 C77147 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,0,0,0,0,0|2,0,0]=3 64 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.6 C[C@H](N)C1=CN=CN=C1 P14618 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.6 C[C@H](N)C1=NC=CC=N1 72045 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93141 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93144 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.6 C[C@H](O)C1=NC=NC=C1 AT18318 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [1,0,0,0,0,0|1,0,2]=4 76 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 D87575 [0,1,0,0,0,0|1,0,1]=3 78 B11R1.3 CC(C)C1=CC=C(CS)C=C1 AT13687 [0,1,0,0,0,0|0,0,0]=1 79 B11R1.3 CC(C)C1=NC=C(CN)C=N1 81408 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 F13708 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 N12206 [0,1,0,0,0,0|1,0,0]=2 82 B11R1.3 CCC1=NC=C(C(C)=O)C=C1 P12273 [0,1,0,0,0,0|2,0,1]=4 83 B11R1.3 CN(C)C1=CN=C(CN)N=C1 72103 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.3 CN(C)C1=NC=C(CN)C=N1 AT18242 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.3 CNC1=CC=C(B(O)O)C=C1 N10060 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.3 COC1=CN=C(C(C)=O)C=C1 P10973 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90819 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90820 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 90831 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 N11219 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D76956 [0,1,0,0,0,0|1,0,0]=2 92 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 N10959 [0,1,0,0,0,0|1,0,0]=2 93 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20981 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20982 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16855 [0,1,0,0,0,0|1,0,1]=3 96 B11R1.3 C[C@H](N)C1=CC=C(CCl)C=C1 96061 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13987 [0,1,0,0,0,0|1,0,1]=3 98 B11R1.3 O=CC1=CC=C(C(F)F)C=C1 C91393 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.3 OCC1=CC=C(C(F)F)C=C1 AT10625 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.3 [2H]C(=O)C1=CC=C(OC)C=C1 D98577 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.19 CC(C)(C)C1=CC=C(N)N=N1 F30952 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.19 CC(C)(C)C1=CN=C(O)C=C1 F13765 [0,1,0,0,0,0|2,0,0]=3 103 B11R1.19 CC(C)(C)C1=NC=C(N)C=N1 F30950 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.19 CC(C)(C)C1=NC=C(O)C=N1 P19546 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.19 CC(C)(C)C1=NNC(=O)C=C1 F51252 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.19 CC(C)(F)C1=NC=C(Br)C=C1 AC2038 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 98110 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 N10815 [0,1,0,0,0,0|1,0,0]=2 109 B11R1.19 CC(C)(N)C1=CN=C(Cl)C=C1 91211 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.19 CC(C)(O)C1=CN=C(Br)C=C1 AB10226 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.19 CC(C)(O)C1=CN=C(Br)C=N1 AT10278 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.19 CC(C)(O)C1=CN=C(Cl)C=C1 AT10277 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.19 CC(C)(O)C1=CN=C(Cl)C=N1 AT16684 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.19 CC(C)(O)C1=CN=C(F)C=C1 88188 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.19 CC(F)(F)C1=NC=C(Br)C=C1 AC3426 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 F13271 [0,1,0,0,0,0|0,0,0]=1 117 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 95895 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 AT17933 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 C14784 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F52062 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 FD1163 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O10169 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W10983 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13714 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W13756 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15718 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15764 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15884 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15911 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W16530 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W16531 [0,1,0,0,0,0|3,0,0]=4 132 B11R1.19 CP(C)(=O)C1=CC=C(F)C=C1 AT21937 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 D77062 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.19 CP(C)(=O)C1=CN=C(Cl)C=C1 AT13621 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.19 C[S@](=N)(=O)C1=CC=C(Br)C=C1 W13286 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.19 C[S@](=N)(=O)C1=CC=C(Cl)C=C1 AT11346 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.19 C[S@](=N)(=O)C1=CC=C(F)C=C1 W16235 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.19 C[Si](C)(C)C1=CC=C(N)C=C1 D71910 [0,1,0,0,0,0|1,1,0]=3 139 B11R1.19 C[Si](C)(C)C1=CC=C(O)C=C1 D76703 [0,1,0,0,0,0|1,1,0]=3 140 B11R1.19 [2H]C([2H])(Cl)C1=CC=C(F)C=C1 D98641 [0,1,0,0,0,0|3,0,0]=4 141 B11R1.19 [2H]C([2H])([2H])C1=CC=C(Br)C=C1 41381 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.19 [2H]C([2H])([2H])C1=CC=C(F)C=C1 D99459 [0,1,0,0,0,0|3,0,0]=4 143 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 69909 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.21 CC(C)C1=CC(Br)=C(I)C=C1 H11162 [0,1,0,0,0,0|1,0,0]=2 145 B11R1.21 CC1=C(Br)C=C(B(O)O)C=C1 D71574 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.21 CC1=C(Br)C=CC([C@H](C)N)=N1 N14943 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.21 CC1=C(Br)C=NC([C@H](C)N)=C1 D79973 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.21 CC1=C(Br)C=NC([C@H](C)O)=C1 D79321 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.21 CC1=C(Br)C=NC([C@H](C)O)=C1 D79322 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.21 CC1=C(C)C=C([C@H](C)O)C=C1 44393 [0,1,0,0,0,0|1,0,0]=2 151 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 Y11249 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.21 CC1=C(O)C=C([C@H](C)N)C=C1 N14772 [0,1,0,0,0,0|1,0,0]=2 153 B11R1.21 CC1=C(O)C=CC([C@H](C)N)=C1 N14776 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.21 CN(C)C1=CC(N)=C(N)C=C1 F53085 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 Y11087 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 Y11614 [0,1,0,0,0,0|2,0,0]=3 157 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14349 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.21 C[C@H](N)C1=CC(O)=C(F)C=C1 N14734 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11379 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 AT11380 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.21 FC(F)C1=CC(I)=C(Br)C=C1 AT23716 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.22 C#C[C@@H](O)C1=CC=C(Br)C=C1 AC6934 [0,1,0,0,0,0|2,0,1]=4 163 B11R1.22 C#C[C@@H](O)C1=CC=C(C)C=C1 AC6704 [0,1,0,0,0,0|1,0,1]=3 164 B11R1.22 C#C[C@@H](O)C1=CC=C(Cl)C=C1 AC5833 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15257 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.22 C=C[C@H](N)C1=CC=C(Br)C=C1 N15258 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15265 [0,1,0,0,0,0|1,0,1]=3 168 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15266 [0,1,0,0,0,0|1,0,1]=3 169 B11R1.22 C=C[C@H](N)C1=CC=C(C)C=C1 N15267 [0,1,0,0,0,0|1,0,1]=3 170 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 E72771 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15246 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15247 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.22 C=C[C@H](N)C1=CC=C(Cl)C=C1 N15248 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15237 [0,1,0,0,0,0|2,0,1]=4 175 B11R1.22 C=C[C@H](N)C1=CC=C(F)C=C1 N15238 [0,1,0,0,0,0|2,0,1]=4 176 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15298 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15299 [0,1,0,0,0,0|2,0,1]=4 178 B11R1.22 C=C[C@H](N)C1=CC=C(O)C=C1 N15300 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 C75563 [0,1,0,0,0,0|1,0,1]=3 180 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 AC6089 [0,1,0,0,0,0|1,0,1]=3 181 B11R1.22 CC1=CC=C(C(=S)NN)C=C1 W10974 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13432 [0,1,0,0,0,0|1,0,0]=2 183 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13433 [0,1,0,0,0,0|1,0,0]=2 184 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13434 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13455 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13456 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.22 CC1=CC=C([C@@H](N)CN)C=C1 N13457 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.22 CC1=CC=C([C@@H](O)CN)C=C1 C78285 [0,1,0,0,0,0|1,0,0]=2 189 B11R1.22 CC1=CC=C(\C(Cl)=N\O)C=C1 65912 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.22 CC1=CN=C(\C(C)=N\O)C=C1 AB10298 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11154 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.22 CC1=NC=C([C@@H](N)CO)C=C1 N11155 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.22 CCC(=O)C1=CN=C(C)C=C1 N14278 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 O10385 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.22 CC[C@H](N)C1=CC=C(C)C=C1 N12295 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11091 [0,1,0,0,0,0|1,0,0]=2 197 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 Y11092 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.22 COC(=N)C1=CC=C(Br)C=C1 AC7283 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.22 CO[C@@H](C)C1=CC=C(Br)C=C1 N11516 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.22 CO[S@@](=O)C1=CC=C(C)C=C1 D92807 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.22 C[C@@H](CN)C1=CC=C(Cl)C=C1 F20636 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 70995 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.22 C[C@H](C#N)C1=CC=C(F)C=C1 AT19993 [0,1,0,0,0,0|1,0,1]=3 204 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 24831 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 F14651 [0,1,0,0,0,0|2,0,1]=4 206 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13423 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13424 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13425 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13446 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13447 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.22 NC[C@H](N)C1=CC=C(Br)C=C1 N13448 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N12560 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13414 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13415 [0,1,0,0,0,0|2,0,0]=3 215 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13416 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13438 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.22 NC[C@H](N)C1=CC=C(Cl)C=C1 N13439 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13400 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13401 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13402 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13406 [0,1,0,0,0,0|2,0,0]=3 222 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13407 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.22 NC[C@H](N)C1=CC=C(F)C=C1 N13408 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.22 NC[C@H](N)C1=CN=C(Br)C=C1 N14910 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.22 NC[C@H](N)C1=NC=C(Br)C=C1 N14909 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.22 NC[C@H](O)C1=CC=C(Br)C=C1 58433 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.22 NC[C@H](O)C1=CC=C(F)C=C1 C78230 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.22 N[C@@H](CF)C1=CC=C(Br)C=C1 N14615 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.22 N[C@@H](CF)C1=CC=C(F)C=C1 N14614 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 N11131 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16864 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 F16884 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 N10530 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.22 N[C@@H](CO)C1=CN=C(Br)C=C1 N11111 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.22 N[C@@H](CO)C1=NC=C(Br)C=C1 Y11193 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.22 O=C(CF)C1=CC=C(Br)C=C1 W17424 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 D87702 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.22 O=C([13CH2]Br)C1=CC=C(Br)C=C1 D97990 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 FD1217 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.22 O[C@@H](CCl)C1=CC=C(Br)C=C1 58431 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,1,0,0,0,0|1,0,1]=3 242 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.166 CC(C)C1=C(Br)C=C(Cl)C=C1 F21471 [0,1,0,0,0,0|1,0,0]=2 244 B11R1.166 CC(C)C1=C(F)C=C(Br)C=C1 F52298 [0,1,0,0,0,0|1,0,0]=2 245 B11R1.166 CC1=CC(Br)=C(C(C)C)C=C1 AT26576 [0,1,0,0,0,0|0,0,0]=1 246 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14911 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14912 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14913 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 N12239 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81539 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81617 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.166 CC1=CC(F)=C([C@H](C)O)C=C1 AT15336 [0,1,0,0,0,0|1,0,0]=2 253 B11R1.166 CC1=CC=C(C(C)C)C(N)=N1 AT11138 [0,1,0,0,0,0|1,0,0]=2 254 B11R1.166 C[C@H](Br)C1=C(F)C=C(F)C=C1 C77556 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.166 C[C@H](Cl)C1=NC=C(Cl)C=C1F P14811 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14923 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14924 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N12749 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N13113 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 F16902 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14393 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14394 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14395 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1F 79549 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11374 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11378 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D75887 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.166 C[C@H](O)C1=NC=C(Br)C=C1F S10055 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.166 FC(F)C1=C(Br)C=C(I)C=C1 E70168 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.166 OC1=C(C(F)F)C=CC(F)=C1 79331 [0,1,0,0,0,0|3,0,0]=4 271 B11R2.34 BrC1=NN=C(C2CC2)C=C1 F13549 [0,0,0,1,0,0|3,0,0]=4 272 B11R2.34 CC1=CC=C(C2CC2)C=C1 AC9737 [0,0,0,1,0,0|0,0,0]=1 273 B11R2.34 ClC1=CC=C(C2CC2)C=C1 AC9567 [0,0,0,1,0,0|1,0,0]=2 274 B11R2.34 NC1=CC=C(C2CC2)N=N1 AT11528 [0,0,0,1,0,0|3,0,0]=4 275 B9R1.35 CC(C)C1=CC(N)=NO1 AT19779 [0,0,0,0,1,0|3,0,0]=4 276 B9R1.35 CC(C)C1=CN=C(Br)O1 AT18460 [0,0,0,0,1,0|3,0,0]=4 277 B9R1.35 CC(C)C1=CN=C(Cl)O1 AT18556 [0,0,0,0,1,0|3,0,0]=4 278 B9R1.35 CC(C)C1=CN=C(N)O1 AT18720 [0,0,0,0,1,0|3,0,0]=4 279 B9R1.35 CC(C)C1=CSC(Br)=N1 C71112 [0,0,0,0,1,0|3,0,0]=4 280 B9R1.35 CC(C)C1=NC=C(Br)N1 AT15320 [0,0,0,0,1,0|3,0,0]=4 281 B9R1.35 CC(C)C1=NC=C(Br)O1 AT18554 [0,0,0,0,1,0|3,0,0]=4 282 B9R1.35 CC(C)N1C=CC(I)=N1 C91460 [0,0,0,0,1,0|3,0,0]=4 283 B9R1.35 CC1=CC(C(C)C)=NN1 89085 [0,0,0,0,1,0|2,0,0]=3 284 B9R1.35 CC1=CC([C@H](C)O)=NO1 AT19830 [0,0,0,0,1,0|3,0,0]=4 285 B9R1.35 CC1=CC([C@H](C)O)=NO1 AT19832 [0,0,0,0,1,0|3,0,0]=4 286 B9R1.35 CC1=CC=C([C@H](C)N)O1 N12562 [0,0,0,0,1,0|2,0,0]=3 287 B9R1.35 CC1=CC=C([C@H](C)N)O1 Y12182 [0,0,0,0,1,0|2,0,0]=3 288 B9R1.35 CC1=CN=C([C@H](C)N)O1 F53855 [0,0,0,0,1,0|3,0,0]=4 289 B9R1.35 CC1=NC([C@H](C)N)=CS1 N14678 [0,0,0,0,1,0|3,0,0]=4 290 B9R1.35 CC1=NN(C(C)C)C=N1 92722 [0,0,0,0,1,0|3,0,0]=4 291 B9R1.35 C[C@H](Cl)C1=CC=C(Cl)O1 55261 [0,0,0,0,1,0|3,0,0]=4 292 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y12846 [0,0,0,0,1,0|3,0,0]=4 293 B9R1.35 C[C@H](N)C1=CC=C(Cl)S1 30561 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.35 C[C@H](N)C1=CN(C)C=N1 AT22193 [0,0,0,0,1,0|3,0,0]=4 295 B9R1.35 C[C@H](N)C1=CSC(Cl)=C1 P13206 [0,0,0,0,1,0|3,0,0]=4 296 B9R1.35 C[C@H](N)C1=NN(C)C=C1 AT14351 [0,0,0,0,1,0|3,0,0]=4 297 B9R1.35 C[C@H](N)C1=NN(C)C=C1 D96322 [0,0,0,0,1,0|3,0,0]=4 298 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 39106 [0,0,0,0,1,0|3,0,0]=4 299 B9R1.35 C[C@H](O)C1=CC(Br)=CS1 P19372 [0,0,0,0,1,0|3,0,0]=4 300 B9R1.35 C[C@H](O)C1=CC=C(Cl)O1 55260 [0,0,0,0,1,0|3,0,0]=4 301 B9R1.35 C[C@H](O)C1=CN(C)N=C1 AT14442 [0,0,0,0,1,0|3,0,0]=4 302 B9R1.35 C[C@H](O)C1=CN(C)N=C1 AT14448 [0,0,0,0,1,0|3,0,0]=4 303 B9R1.35 C[C@H](O)C1=CN(C)N=C1 P10637 [0,0,0,0,1,0|3,0,0]=4 304 B9R1.35 C[C@H](O)C1=NN(C)C=C1 AT14463 [0,0,0,0,1,0|3,0,0]=4 305 B11R1.20 CC(C)OC1=CN=C(Cl)N=C1 AT18453 [0,0,0,0,0,1|3,0,0]=4 306 B11R1.20 CC(C)OC1=NC=C(N)C=N1 AT18233 [0,0,0,0,0,1|3,0,0]=4 307 B11R1.20 CC1=CC=C(CB(O)O)C=C1 F20813 [0,0,0,0,0,1|3,0,0]=4 308 B11R1.20 CC1=CC=C(C[C@H](C)N)C=C1 N14354 [0,0,0,0,0,1|1,0,0]=2 309 B11R1.20 CN(C)CC1=CN=C(Cl)C=C1 D76265 [0,0,0,0,0,1|3,0,0]=4 310 B11R1.20 CN(C)CC1=CN=C(N)C=C1 N12638 [0,0,0,0,0,1|3,0,0]=4 311 B11R1.20 C[C@H](N)CC1=CC=C(Br)C=C1 Y11268 [0,0,0,0,0,1|2,0,0]=3 312 B11R1.20 C[C@H](N)CC1=CC=C(Cl)C=C1 N10873 [0,0,0,0,0,1|2,0,0]=3 313 B11R1.20 C[C@H](N)CC1=CC=C(O)C=C1 85180 [0,0,0,0,0,1|2,0,0]=3 314 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 AT20957 [0,0,0,0,0,1|3,0,0]=4 315 B11R1.20 FC1=CC=C(OC(F)F)C=C1 F17627 [0,0,0,0,0,1|3,0,0]=4 316 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20968 [0,0,0,0,0,1|3,0,0]=4 317 B11R1.20 NC1=CC=C(SC(F)F)C=C1 AT20978 [0,0,0,0,0,1|3,0,0]=4 318 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|1,0,0]=3 319 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.3 CC1=CN=C(C)N=C1 C15366 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.3 [2H]C1=CC=C(Cl)C=C1 D98354 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.3 [2H]C1=CC=C([2H])C=C1 D99669 [2,0,0,0,0,0|2,0,0]=4 323 B10R1.1 CC1=CC=C(C#CBr)C=C1 94424 [1,1,0,0,0,0|0,0,2]=4 324 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.1 CC1=CC=C(\C=N\O)C=C1 AC8737 [1,1,0,0,0,0|1,0,1]=4 326 B10R1.1 CC1=CN=C(CCN)N=C1 AT18271 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.1 CC1=NC=C(CC#N)C=C1 54748 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.1 CC1=NC=C(CNN)C=C1 F15210 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.1 CCNC1=CC=C(C)N=N1 AT18438 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.1 CCOC1=NC=C(O)C=C1 D75011 [1,1,0,0,0,0|2,0,0]=4 331 B10R1.1 CNCC1=NC=C(Cl)C=C1 AT26664 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.1 NCCC1=NC=C(Br)C=C1 P10593 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.1 OCCC1=CN=C(Br)C=C1 AC9473 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.1 OCCC1=CN=C(F)C=C1 AC9525 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.3 C#CC1=CC=C(CN)C=C1 A50671 [1,1,0,0,0,0|0,0,2]=4 342 B10R1.3 CCC1=CN=C(C=O)C=C1 C74094 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.3 CCC1=CN=C(CCl)C=C1 94422 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.3 CCC1=CN=C(CO)C=C1 94421 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.3 CCC1=NC=C(CN)C=N1 81406 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.3 CNC1=CC=C(CN)C=C1 A10200 [1,1,0,0,0,0|1,0,0]=3 347 B10R1.3 CNC1=CC=C(SC)C=C1 AT20959 [1,1,0,0,0,0|1,0,0]=3 348 B10R1.3 COC1=CN=C(CBr)C=C1 O10507 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.3 COC1=NC=C(CBr)C=C1 26302 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.3 COC1=NC=C(SC)C=C1 F50803 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.3 NCC1=CC=C(C=O)C=C1 N13169 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.3 OCC1=CN=C(CO)C=C1 AC5585 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 AT23890 [1,1,0,0,0,0|1,0,1]=4 354 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [1,1,0,0,0,0|2,0,0]=4 356 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [1,1,0,0,0,0|2,0,0]=4 357 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [1,1,0,0,0,0|2,0,0]=4 358 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.25 CC1=CC(C)=NC=C1CN W16199 [1,1,0,0,0,0|2,0,0]=4 360 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [1,1,0,0,0,0|1,0,0]=3 361 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [1,1,0,0,0,0|1,0,0]=3 362 B10R1.25 CC1=CC(F)=C(NN)C=C1 A12578 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [1,1,0,0,0,0|1,0,1]=4 364 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [1,1,0,0,0,0|1,0,0]=3 365 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [1,1,0,0,0,0|1,0,0]=3 366 B10R1.25 CC1=CN=C(CBr)C(C)=C1 O10504 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.25 CC1=CN=C(CN)C(C)=C1 D73748 [1,1,0,0,0,0|2,0,0]=4 368 B10R1.25 CCC1=C(Br)C=C(Br)C=N1 F14393 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [1,1,0,0,0,0|1,0,0]=3 370 B10R1.25 CCN1C=CC(N)=CC1=O P12616 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.25 CNC1=NC=C(C)C=C1N D75084 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.25 COC1=C(I)C=C(C)N=C1 96426 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.25 COC1=NC=C(C)C=C1N D74381 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [1,1,0,0,0,0|2,0,0]=4 378 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [1,1,0,0,0,0|2,0,0]=4 381 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [1,1,0,0,0,0|2,0,0]=4 387 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.176 BrCC1=CC(Br)=C(I)C=C1 AT26690 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.176 BrCC1=CC(I)=C(Br)C=C1 97476 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.176 CC1=C(Br)C=C(CO)N=C1 81452 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.176 CC1=C(Br)C=CC(CCl)=C1 D87322 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.176 CC1=C(F)C=C(CO)C=N1 C77142 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.176 CC1=C(I)C=C(CO)C=C1 D75885 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.176 CC1=C(N)C=CC(CO)=C1 F15978 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14330 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.176 CC1=CC(CO)=CN=C1C F53420 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.176 CCC1=CC(N)=C(Br)C=N1 C14681 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.176 CCC1=CC(N)=C(C)C=C1 F21363 [1,1,0,0,0,0|0,0,0]=2 403 B10R1.176 CCC1=CC(O)=C(F)C=C1 F30470 [1,1,0,0,0,0|1,0,0]=3 404 B10R1.176 CCC1=CC(O)=C(O)C=C1 70407 [1,1,0,0,0,0|1,0,0]=3 405 B10R1.176 CCC1=NC(C)=C(O)C=C1 76361 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.176 CN1C=CC(CCl)=CC1=O AT19302 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.176 CNC1=CC(Cl)=C(Br)C=C1 AC3296 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 C77674 [1,1,0,0,0,0|1,0,0]=3 409 B10R1.176 CNC1=CC(F)=C(Br)C=C1 S10823 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.176 COC1=CC(I)=C(C)C=N1 AT12881 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.176 COC1=CC(N)=C(I)C=C1 O10806 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19646 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19647 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.176 COC1=CC(S)=C(N)C=C1 C90511 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.176 CSC1=CC(C)=C(Br)C=C1 AT14181 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.176 CSC1=CC(C)=C(O)C=C1 AT20904 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.176 CSC1=CC(N)=C(C)C=C1 AT20856 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 W16546 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.176 FC1=C(Br)C=CC(CCl)=C1 96328 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 CK1006 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.176 NCC1=CC(O)=C(N)C=C1 F13360 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.176 OCC1=CC(I)=C(Br)C=C1 97475 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [1,1,0,0,0,0|0,0,2]=4 424 B10R1.15 CCN(C)C1=NC=CC=C1 T72928 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [1,1,0,0,0,0|0,0,0]=2 428 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [1,1,0,0,0,0|1,0,1]=4 429 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [1,1,0,0,0,0|0,0,1]=3 430 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [1,1,0,0,0,0|0,0,1]=3 431 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.28 CC(C)(C)C1=NC=CC=C1 C75774 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.28 CC(C)(C)C1=NC=CN=C1 T70779 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.28 CC(C)(N)C1=NC=CC=N1 AT12626 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.28 CC(C)(N)C1=NC=CC=N1 D75134 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.28 CC(C)(O)C1=NC=CC=N1 AT18243 [1,1,0,0,0,0|2,0,0]=4 449 B10R1.28 FC(F)(Cl)C1=CC=CC=C1 36909 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [1,1,0,0,0,0|0,0,0]=2 451 B10R1.28 [2H]C([2H])(Br)C1=CC=CC=C1 D99472 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.28 [2H]C([2H])(O)C1=CC=CC=C1 AT24168 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [1,1,0,0,0,0|0,0,2]=4 456 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [1,1,0,0,0,0|1,0,1]=4 457 B10R1.61 CC(C)C1=CN=CN=C1Cl H10240 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.61 CC(C)C1=NC=CN=C1Cl AT24532 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [1,1,0,0,0,0|0,0,0]=2 462 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [1,1,0,0,0,0|1,0,0]=3 463 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [1,1,0,0,0,0|1,0,0]=3 464 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.61 C[C@H](N)C1=C(Cl)C=NC=C1 N14402 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [1,1,0,0,0,0|0,0,2]=4 470 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 D71924 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.113 CC(C)C1=NC=CC(Cl)=N1 W12563 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [1,1,0,0,0,0|0,0,0]=2 473 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.113 CC1=NC=CC(C(C)C)=N1 O11252 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N10343 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.113 CN(C)C1=CC=CC(F)=N1 AT20362 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 C16301 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=N1 55243 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 90822 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 AC3205 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 90825 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N10537 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N13087 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90539 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90540 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D81409 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.113 C[C@H](N)C1=NC=CC(Br)=C1 90526 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14934 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14935 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.113 C[C@H](O)C1=CC(F)=CN=C1 AT10686 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.113 C[C@H](O)C1=CC(N)=NC=C1 CS1317 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.113 C[C@H](O)C1=CC=CC(F)=N1 AT10689 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.113 C[C@H](O)C1=NC=CC(F)=C1 AT10691 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [1,1,0,0,0,0|2,0,0]=4 506 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16761 [0,1,0,0,1,0|2,0,0]=4 507 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16762 [0,1,0,0,1,0|2,0,0]=4 508 B10R1.14 CC1=CC=C([C@@H](N)CO)O1 N16763 [0,1,0,0,1,0|2,0,0]=4 509 B10R1.31 CC(C)C1=CC(CCl)=NN1 AT15955 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.31 CC(C)C1=CC(CN)=NO1 C14917 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.31 CC(C)C1=CC=C(C=O)O1 F53542 [0,1,0,0,1,0|1,0,1]=4 512 B10R1.31 CC(C)C1=CN=C(CBr)O1 AT18561 [0,1,0,0,1,0|2,0,0]=4 513 B10R1.31 CC(C)C1=CN=C(CCl)O1 AT18580 [0,1,0,0,1,0|2,0,0]=4 514 B10R1.31 CC(C)C1=NC(CCl)=CO1 AT18627 [0,1,0,0,1,0|2,0,0]=4 515 B10R1.31 CC(C)C1=NC(CO)=CO1 AT18550 [0,1,0,0,1,0|2,0,0]=4 516 B10R1.31 CC(C)C1=NC=C(CN)S1 F20287 [0,1,0,0,1,0|2,0,0]=4 517 B10R1.31 CC(C)N1C=CC(CCl)=N1 AT15936 [0,1,0,0,1,0|2,0,0]=4 518 B10R1.31 CC(C)N1C=CC(CN)=N1 AT14353 [0,1,0,0,1,0|2,0,0]=4 519 B10R1.31 CC(C)N1C=CC(CO)=N1 AT14467 [0,1,0,0,1,0|2,0,0]=4 520 B10R1.31 CC(C)N1C=NC(CO)=C1 AT15347 [0,1,0,0,1,0|2,0,0]=4 521 B10R1.31 CCC1=NN(C(C)C)C=C1 C92839 [0,1,0,0,1,0|2,0,0]=4 522 B10R1.55 CC(C)(C)C1=CC=C(Br)S1 AC7345 [0,1,0,0,1,0|2,0,0]=4 523 B10R1.55 CN1C=NC(C(C)(C)C)=C1 F52033 [0,1,0,0,1,0|2,0,0]=4 524 B10R1.194 CC1=C(N)N(C(C)C)N=C1 AT11115 [0,1,0,0,1,0|2,0,0]=4 525 B12R1.4 CC(C)SC1=CC=C(CCl)C=C1 AT20997 [0,1,0,0,0,1|0,0,0]=2 526 B12R1.4 CC(C)SC1=CC=C(CO)C=C1 AT20984 [0,1,0,0,0,1|0,0,0]=2 527 B12R1.4 COC1=CC=C(C[C@H](C)N)C=C1 F13082 [0,1,0,0,0,1|1,0,0]=3 528 B12R1.4 COC1=CC=C(NC(C)C)C=C1 C77952 [0,1,0,0,0,1|0,0,0]=2 529 B12R1.4 CSC1=CC=C(OC(F)F)C=C1 W16571 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.4 FC(F)SC1=CC=C(CCl)C=C1 AT20999 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.19 CC(=O)NC1=CC(F)=C(C)C=C1 E72199 [0,1,0,0,0,1|1,0,1]=4 532 B12R1.19 CC(=O)NC1=CC(I)=C(C)C=C1 AC7468 [0,1,0,0,0,1|1,0,1]=4 533 B12R1.19 CC(C)CC1=CC(Br)=C(N)N=C1 N10717 [0,1,0,0,0,1|2,0,0]=4 534 B12R1.19 CC(C)NC1=CC(I)=C(Cl)C=N1 F51211 [0,1,0,0,0,1|2,0,0]=4 535 B12R1.19 CC1=C(N)C=CC(OC(C)C)=N1 89631 [0,1,0,0,0,1|2,0,0]=4 536 B12R1.19 C[C@H](N)CC1=CC(Cl)=C(Cl)C=C1 N10880 [0,1,0,0,0,1|2,0,0]=4 537 B12R1.19 C[C@H](N)CC1=CC(F)=C(F)C=C1 N11068 [0,1,0,0,0,1|2,0,0]=4 538 B12R1.19 C[C@H](N)CC1=CC(F)=C(F)C=C1 N14355 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.20 CC(=O)C(=O)C1=CC=C(C)C=C1 H11218 [0,1,0,0,0,1|1,0,1]=4 540 B12R1.20 CC(=O)[C@H](N)C1=CC=C(C)C=C1 N15700 [0,1,0,0,0,1|1,0,1]=4 541 B12R1.20 CC(C)C(=O)C1=CN=C(Cl)C=C1 N14276 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.20 CC(C)C(=O)C1=NC=C(Br)C=C1 N14257 [0,1,0,0,0,1|2,0,0]=4 543 B12R1.20 CC(C)C(=O)C1=NC=C(Cl)C=C1 N14253 [0,1,0,0,0,1|2,0,0]=4 544 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 N12796 [0,1,0,0,0,1|1,0,0]=3 545 B12R1.20 CC(C)[C@H](N)C1=CC=C(Br)C=C1 N12886 [0,1,0,0,0,1|1,0,0]=3 546 B12R1.20 CC(C)[C@H](N)C1=CC=C(Cl)C=C1 C78465 [0,1,0,0,0,1|1,0,0]=3 547 B12R1.20 CC(C)[C@H](N)C1=CC=C(Cl)C=C1 F31298 [0,1,0,0,0,1|1,0,0]=3 548 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 N12546 [0,1,0,0,0,1|1,0,0]=3 549 B12R1.20 CC(C)[C@H](N)C1=CC=C(F)C=C1 N12875 [0,1,0,0,0,1|1,0,0]=3 550 B12R1.20 CC(N)C(O)C1=CC=C(Cl)C=C1 26032 [0,1,0,0,0,1|2,0,0]=4 551 B12R1.20 CC(O)C(N)C1=CC=C(Br)C=C1 N15665 [0,1,0,0,0,1|2,0,0]=4 552 B12R1.20 CC(O)C(N)C1=CC=C(Cl)C=C1 N15654 [0,1,0,0,0,1|2,0,0]=4 553 B12R1.20 CC(O)C(N)C1=CC=C(F)C=C1 N15651 [0,1,0,0,0,1|2,0,0]=4 554 B12R1.20 CC(O)C(N)C1=CC=C(N)C=C1 N16144 [0,1,0,0,0,1|2,0,0]=4 555 B12R1.20 CC(O)C(N)C1=CC=C(O)C=C1 N15674 [0,1,0,0,0,1|2,0,0]=4 556 B12R1.20 CC(O)[C@H](N)C1=CC=C(Br)C=C1 N15664 [0,1,0,0,0,1|2,0,0]=4 557 B12R1.20 CC(O)[C@H](N)C1=CC=C(Cl)C=C1 N15655 [0,1,0,0,0,1|2,0,0]=4 558 B12R1.20 CC(O)[C@H](N)C1=CC=C(F)C=C1 N15650 [0,1,0,0,0,1|2,0,0]=4 559 B12R1.20 CC(O)[C@H](N)C1=CC=C(O)C=C1 N15675 [0,1,0,0,0,1|2,0,0]=4 560 B12R1.20 CC1=CC=C(C(N)C(C)O)C=C1 N15701 [0,1,0,0,0,1|1,0,0]=3 561 B12R1.20 CC1=CC=C([C@@H](N)C(C)O)C=C1 N15702 [0,1,0,0,0,1|1,0,0]=3 562 B12R1.20 CC1=CC=C([C@@H](N)[C@@H](C)O)C=C1 N15703 [0,1,0,0,0,1|1,0,0]=3 563 B12R1.20 CC1=CC=C([C@@H](N)[C@@H](C)O)C=C1 N15705 [0,1,0,0,0,1|1,0,0]=3 564 B12R1.20 CC1=CC=C([C@@H](N)[C@H](C)O)C=C1 N15704 [0,1,0,0,0,1|1,0,0]=3 565 B12R1.20 C[C@@H](C1=CC=C(Br)C=C1)N(C)C N11474 [0,1,0,0,0,1|2,0,0]=4 566 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(Br)C=C1 N15660 [0,1,0,0,0,1|2,0,0]=4 567 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(Br)C=C1 N15662 [0,1,0,0,0,1|2,0,0]=4 568 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(Cl)C=C1 N15657 [0,1,0,0,0,1|2,0,0]=4 569 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(Cl)C=C1 N15659 [0,1,0,0,0,1|2,0,0]=4 570 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(F)C=C1 N15647 [0,1,0,0,0,1|2,0,0]=4 571 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(F)C=C1 N15649 [0,1,0,0,0,1|2,0,0]=4 572 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(N)C=C1 N16141 [0,1,0,0,0,1|2,0,0]=4 573 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(N)C=C1 N16143 [0,1,0,0,0,1|2,0,0]=4 574 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(O)C=C1 N15676 [0,1,0,0,0,1|2,0,0]=4 575 B12R1.20 C[C@@H](O)[C@H](N)C1=CC=C(O)C=C1 N15678 [0,1,0,0,0,1|2,0,0]=4 576 B12R1.20 C[C@H](Cl)C(=O)C1=CC=C(F)C=C1 C16405 [0,1,0,0,0,1|2,0,0]=4 577 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(Br)C=C1 N15661 [0,1,0,0,0,1|2,0,0]=4 578 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(Cl)C=C1 N15656 [0,1,0,0,0,1|2,0,0]=4 579 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(F)C=C1 N15648 [0,1,0,0,0,1|2,0,0]=4 580 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(N)C=C1 N16142 [0,1,0,0,0,1|2,0,0]=4 581 B12R1.20 C[C@H](O)[C@H](N)C1=CC=C(O)C=C1 N15677 [0,1,0,0,0,1|2,0,0]=4 582 B12R1.49 CC1=CC=C(C[C@H](N)CO)C=C1 C78159 [0,1,0,0,0,1|1,0,0]=3 583 B12R1.49 CC1=CC=C(C[C@H](N)CO)C=C1 C78527 [0,1,0,0,0,1|1,0,0]=3 584 B12R1.49 CC[C@H](N)CC1=CC=C(C)C=C1 N12825 [0,1,0,0,0,1|1,0,0]=3 585 B12R1.49 CC[C@H](N)CC1=CC=C(Cl)C=C1 N14547 [0,1,0,0,0,1|2,0,0]=4 586 B12R1.49 CC[C@H](N)CC1=CC=C(F)C=C1 N14543 [0,1,0,0,0,1|2,0,0]=4 587 B12R1.49 CC[C@H](N)CC1=CC=C(I)C=C1 85182 [0,1,0,0,0,1|2,0,0]=4 588 B12R1.49 CN[C@@H](C)CC1=CC=C(F)C=C1 N12809 [0,1,0,0,0,1|1,0,0]=3 589 B12R1.49 C[C@@H](CN)OC1=CC=C(Cl)C=C1 C77969 [0,1,0,0,0,1|1,0,0]=3 590 B12R1.49 C[C@H](C=O)CC1=CC=C(Cl)C=C1 C76805 [0,1,0,0,0,1|1,0,1]=4 591 B12R1.49 C\C(=C/C1=CC=C(F)C=C1)CO F53074 [0,1,0,0,0,1|1,0,1]=4 592 B12R1.49 NC1=CC=C(C[C@H](N)CO)C=C1 Y11240 [0,1,0,0,0,1|2,0,0]=4 593 B12R1.49 N[C@H](CO)CC1=CC=C(Br)C=C1 C78517 [0,1,0,0,0,1|2,0,0]=4 594 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 AT10694 [0,1,0,0,0,1|2,0,0]=4 595 B12R1.49 N[C@H](CO)CC1=CC=C(F)C=C1 C78160 [0,1,0,0,0,1|2,0,0]=4 596 B12R1.49 N[C@H](CO)CC1=CC=C(I)C=C1 85183 [0,1,0,0,0,1|2,0,0]=4 597 B12R1.49 N[C@H](CO)CC1=CC=C(O)C=C1 C78266 [0,1,0,0,0,1|2,0,0]=4 598 B12R1.106 CC(C)(C)OC1=NC=C(Br)C=C1 F19673 [0,1,0,0,0,1|2,0,0]=4 599 B12R1.106 CC(C)(C)SC1=CC=C(N)C=C1 AT20975 [0,1,0,0,0,1|1,0,0]=3 600 B12R1.106 CC(C)(N)CC1=CC=C(O)C=C1 F30911 [0,1,0,0,0,1|1,0,0]=3 601 B12R1.106 CC(C)(O)CC1=CC=C(Br)C=C1 AT24485 [0,1,0,0,0,1|1,0,0]=3 602 B12R1.106 CC1=CC=C(C[S@@](C)(=N)=O)C=C1 E72404 [0,1,0,0,0,1|2,0,0]=4 603 B12R1.106 CS(C)(=O)=NC1=CC=C(O)C=C1 AT18480 [0,1,0,0,0,1|2,0,0]=4 604 B12R1.233 CC(C)OC1=C(Br)C=C(Cl)C=C1 C91609 [0,1,0,0,0,1|1,0,0]=3 605 B12R1.233 CC(C)OC1=NC=C(Br)C=C1Cl W12587 [0,1,0,0,0,1|2,0,0]=4 606 B12R1.233 CC(C)OC1=NC=C(Cl)C=C1F W12585 [0,1,0,0,0,1|2,0,0]=4 607 B12R1.233 CC1=CC(Br)=C(OC(F)F)C=C1 AT15191 [0,1,0,0,0,1|2,0,0]=4 608 B12R1.233 CC1=CC(N)=C(OC(F)F)C=C1 AT12965 [0,1,0,0,0,1|2,0,0]=4 609 B12R1.233 CN(C)CC1=C(F)C=C(Br)C=C1 N11554 [0,1,0,0,0,1|2,0,0]=4 610 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(Cl)C=C1 N11064 [0,1,0,0,0,1|2,0,0]=4 611 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(F)C=C1 N11062 [0,1,0,0,0,1|2,0,0]=4 612 B12R1.5 C#C[C@@H](O)C1=CC=C(OC)C=C1 AC5064 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15274 [0,2,0,0,0,0|1,0,1]=4 614 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15275 [0,2,0,0,0,0|1,0,1]=4 615 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15276 [0,2,0,0,0,0|1,0,1]=4 616 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15289 [0,2,0,0,0,0|1,0,1]=4 617 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15290 [0,2,0,0,0,0|1,0,1]=4 618 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15291 [0,2,0,0,0,0|1,0,1]=4 619 B12R1.5 CCC1=CC=C(C(=O)CO)C=C1 AC2757 [0,2,0,0,0,0|1,0,1]=4 620 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13461 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13462 [0,2,0,0,0,0|1,0,0]=3 622 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13463 [0,2,0,0,0,0|1,0,0]=3 623 B12R1.5 CC[C@H](Cl)C1=CN=C(OC)C=C1 91403 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 97264 [0,2,0,0,0,0|1,0,0]=3 625 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 N10941 [0,2,0,0,0,0|1,0,0]=3 626 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 N12242 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.5 CC[C@H](N)C1=CC=C(SC)C=C1 N11382 [0,2,0,0,0,0|1,0,0]=3 628 B12R1.5 CC[C@H](N)C1=CN=C(OC)C=C1 N11202 [0,2,0,0,0,0|2,0,0]=4 629 B12R1.5 CC[C@H](N)C1=CN=C(OC)C=C1 N11365 [0,2,0,0,0,0|2,0,0]=4 630 B12R1.5 CNC(=O)C1=CC=C(CBr)C=C1 D97640 [0,2,0,0,0,0|1,0,1]=4 631 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 97528 [0,2,0,0,0,0|1,0,1]=4 632 B12R1.5 CN[C@@H](C)C1=CC=C(OC)C=C1 N12207 [0,2,0,0,0,0|0,0,0]=2 633 B12R1.5 COC1=CC=C(C(=O)CO)C=C1 AC6103 [0,2,0,0,0,0|1,0,1]=4 634 B12R1.5 COC1=CC=C([C@@H](N)CF)C=C1 N14616 [0,2,0,0,0,0|1,0,0]=3 635 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13480 [0,2,0,0,0,0|1,0,0]=3 636 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13481 [0,2,0,0,0,0|1,0,0]=3 637 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13482 [0,2,0,0,0,0|1,0,0]=3 638 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13488 [0,2,0,0,0,0|1,0,0]=3 639 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13489 [0,2,0,0,0,0|1,0,0]=3 640 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13490 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.5 COC1=CC=C([C@@H](O)CN)C=C1 C78301 [0,2,0,0,0,0|1,0,0]=3 642 B12R1.5 COC1=NC=C([C@@H](N)CO)C=C1 F16997 [0,2,0,0,0,0|2,0,0]=4 643 B12R1.5 COC1=NC=C([C@@H](N)CO)C=C1 Y11425 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.5 CSC1=CC=C(C(=O)CBr)C=C1 H10559 [0,2,0,0,0,0|1,0,1]=4 645 B12R1.5 CSC1=CC=C([C@@H](N)CO)C=C1 H10359 [0,2,0,0,0,0|1,0,0]=3 646 B12R1.6 CC(C)(C)C1=NC=C(CBr)C=N1 AT18267 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.6 CC(C)(C)C1=NC=C(CN)C=N1 81403 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.6 CC(C)(C)C1=NC=C(CO)C=N1 AT18263 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.6 CC(F)(F)C1=CC=C(C#N)C=C1 F53152 [0,2,0,0,0,0|1,0,1]=4 650 B12R1.6 COC1=CC=C([S@@](C)(=N)=O)C=C1 W18264 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.6 [2H]C([2H])([2H])C1=CC=C(OC)C=C1 D98297 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.48 CC(=O)C1=CC(Br)=C(CBr)C=C1 W17125 [0,2,0,0,0,0|1,0,1]=4 653 B12R1.48 CC(C)C1=CC=C(C#N)C(Cl)=N1 94433 [0,2,0,0,0,0|1,0,1]=4 654 B12R1.48 CC(C)C1=CC=C(C#N)C(S)=N1 94434 [0,2,0,0,0,0|1,0,1]=4 655 B12R1.48 CCC1=C(Br)C=C(C(C)=O)C=C1 F17056 [0,2,0,0,0,0|1,0,1]=4 656 B12R1.48 CN(C)C1=CC(O)=C(N=O)C=C1 T72444 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.48 COC1=C(F)C=C([C@H](C)Br)C=C1 96595 [0,2,0,0,0,0|1,0,0]=3 658 B12R1.48 COC1=C(F)C=C([C@H](C)Cl)C=C1 97968 [0,2,0,0,0,0|1,0,0]=3 659 B12R1.48 COC1=C(F)C=C([C@H](C)O)C=C1 96594 [0,2,0,0,0,0|1,0,0]=3 660 B12R1.48 C[C@H](N)C1=CC(F)=C(CO)C=C1 N14392 [0,2,0,0,0,0|1,0,0]=3 661 B12R1.113 CC(C)C1=CC=C(CCN)C=C1 C13364 [0,2,0,0,0,0|0,0,0]=2 662 B12R1.113 CCOC1=CC=C([C@@H](N)O)C=C1 E72788 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.113 CCOC1=CC=C([C@H](C)N)C=C1 C77727 [0,2,0,0,0,0|1,0,0]=3 664 B12R1.113 CN(C)C1=NC=C(CC#N)C=C1 C90355 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.113 CNCC1=CN=C(C(C)C)N=C1 AT18268 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.256 CC(=O)C1=CC=C(C(F)F)C=C1 O10282 [0,2,0,0,0,0|1,0,1]=4 667 B12R1.256 CC(C)C1=CC=C([C@H](C)N)C=C1 AT12994 [0,2,0,0,0,0|0,0,0]=2 668 B12R1.256 CC(C)C1=CC=C([C@H](C)N)C=C1 AT12996 [0,2,0,0,0,0|0,0,0]=2 669 B12R1.256 CC(C)C1=CN=C(C(C)C)C=N1 79604 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.256 CC(C)C1=NC=C([N+](=O)[O-])C=C1 P11098 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.256 C[C@H](N)C1=CC=C(B(O)O)C=C1 I12564 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 A50524 [0,2,0,0,0,0|1,0,1]=4 673 B12R1.256 C[C@H](N)C1=CC=C(C(F)F)C=C1 N14665 [0,2,0,0,0,0|1,0,0]=3 674 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 I10900 [0,2,0,0,0,0|1,0,0]=3 675 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 N12577 [0,2,0,0,0,0|1,0,0]=3 676 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 Y11471 [0,2,0,0,0,0|1,0,0]=3 677 B12R1.256 C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1 F53386 [0,2,0,0,0,0|2,0,0]=4 678 B12R1.452 CN(C)C1=C(Cl)C=C(C=O)C=C1 AT16362 [0,2,0,0,0,0|1,0,1]=4 679 B12R1.452 COC1=CC(Br)=C(C(C)C)C=C1 E71918 [0,2,0,0,0,0|0,0,0]=2 680 B12R1.452 COC1=CC(F)=C(C(C)C)C=C1 P10295 [0,2,0,0,0,0|0,0,0]=2 681 B12R1.452 C[C@H](N)C1=C(F)C=C(CO)C=C1 N14658 [0,2,0,0,0,0|1,0,0]=3 682 B12R1.9 CC(C)(C#N)C1=CC=C(Cl)C=C1 74866 [0,2,0,0,0,0|1,0,0]=3 683 B12R1.9 CC(C)(CN)C1=CC=C(Br)C=C1 F13316 [0,2,0,0,0,0|1,0,0]=3 684 B12R1.9 CC(C)(CO)C1=CC=C(Br)C=C1 D85755 [0,2,0,0,0,0|1,0,0]=3 685 B12R1.9 CC[C@](C)(N)C1=CC=C(Cl)C=C1 F52078 [0,2,0,0,0,0|1,0,0]=3 686 B12R1.9 C[C@](N)(CO)C1=CC=C(Br)C=C1 96069 [0,2,0,0,0,0|1,0,0]=3 687 B12R1.9 C[C@](N)(CO)C1=CC=C(Cl)C=C1 96093 [0,2,0,0,0,0|1,0,0]=3 688 B12R1.9 C[C@](N)(CO)C1=CC=C(Cl)C=C1 96095 [0,2,0,0,0,0|1,0,0]=3 689 B12R1.23 CC(C)(N)C1=CC(Cl)=C(Cl)C=C1 N12826 [0,2,0,0,0,0|1,0,0]=3 690 B12R1.23 CC(C)(N)C1=CC(F)=C(F)C=C1 N11226 [0,2,0,0,0,0|1,0,0]=3 691 B12R1.23 CC1=C(C)C=C(S(C)(=O)=O)C=C1 AT24021 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.23 CC1=C(F)C=C(C(C)(C)O)C=C1 AT22341 [0,2,0,0,0,0|0,0,0]=2 693 B12R1.23 CC1=C(F)C=CC(C(C)(C)O)=C1 AT22339 [0,2,0,0,0,0|1,0,0]=3 694 B12R1.23 CC1=C(N)C=C(C(C)(C)C)C=C1 88007 [0,2,0,0,0,0|0,0,0]=2 695 B12R1.23 CC1=C(O)C=C(C(F)(F)F)C=C1 AC9063 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.23 CP(C)(=O)C1=CC(N)=C(N)C=C1 AT21935 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.23 C[Si](C)(C)C1=CC(F)=C(N)C=C1 E71921 [0,2,0,0,0,0|1,1,0]=4 698 B12R1.126 CC(C)(C)C1=C(O)C=C(O)C=C1 E10076 [0,2,0,0,0,0|1,0,0]=3 699 B12R1.126 CC(C)(O)C1=C(F)C=C(Br)C=C1 F52342 [0,2,0,0,0,0|1,0,0]=3 700 B12R1.126 CC1=CC(N)=C(C(F)(F)F)C=C1 C71268 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.56 CC(C)C1=CC(CN)=C(O)C=C1 F50674 [0,2,0,0,0,0|1,0,0]=3 702 B12R1.56 COC1=C(Br)C=CC(C(C)C)=C1 D87066 [0,2,0,0,0,0|1,0,0]=3 703 B12R1.56 COC1=C(O)C=CC([C@H](C)N)=C1 N14804 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.56 COC1=C(O)C=CC([C@H](C)N)=C1 N14805 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94484 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94485 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15442 [0,2,0,0,0,0|1,0,1]=4 708 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15443 [0,2,0,0,0,0|1,0,1]=4 709 B12R1.367 C=C[C@H](N)C1=CC(C)=C(C)C=C1 N15444 [0,2,0,0,0,0|1,0,1]=4 710 B12R1.367 C=C[C@H](N)C1=CC(Cl)=C(C)C=C1 N15414 [0,2,0,0,0,0|1,0,1]=4 711 B12R1.367 C=C[C@H](N)C1=CC(Cl)=C(C)C=C1 N15415 [0,2,0,0,0,0|1,0,1]=4 712 B12R1.367 C=C[C@H](N)C1=CC(Cl)=C(C)C=C1 N15416 [0,2,0,0,0,0|1,0,1]=4 713 B12R1.367 C=C[C@H](N)C1=CC(F)=C(C)C=C1 N15375 [0,2,0,0,0,0|1,0,1]=4 714 B12R1.367 C=C[C@H](N)C1=CC(F)=C(C)C=C1 N15377 [0,2,0,0,0,0|1,0,1]=4 715 B12R1.367 C=C[C@H](N)C1=CC(F)=C(C)C=C1 N15378 [0,2,0,0,0,0|1,0,1]=4 716 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13729 [0,2,0,0,0,0|1,0,0]=3 717 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13730 [0,2,0,0,0,0|1,0,0]=3 718 B12R1.367 CC1=C(Br)C=C([C@@H](N)CN)C=C1 N13731 [0,2,0,0,0,0|1,0,0]=3 719 B12R1.367 CC1=C(C)C=C([C@@H](N)CO)C=C1 N11079 [0,2,0,0,0,0|1,0,0]=3 720 B12R1.367 CC1=C(C)C=C([C@@H](O)CN)C=C1 C78470 [0,2,0,0,0,0|1,0,0]=3 721 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13720 [0,2,0,0,0,0|1,0,0]=3 722 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13721 [0,2,0,0,0,0|1,0,0]=3 723 B12R1.367 CC1=C(Cl)C=C([C@@H](N)CN)C=C1 N13722 [0,2,0,0,0,0|1,0,0]=3 724 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13664 [0,2,0,0,0,0|1,0,0]=3 725 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13665 [0,2,0,0,0,0|1,0,0]=3 726 B12R1.367 CC1=C(F)C=C([C@@H](N)CN)C=C1 N13666 [0,2,0,0,0,0|1,0,0]=3 727 B12R1.367 CCC(=O)C1=CC(Cl)=C(C)C=C1 N14084 [0,2,0,0,0,0|1,0,1]=4 728 B12R1.367 CC[C@H](N)C1=CC(C)=C(C)C=C1 N12085 [0,2,0,0,0,0|1,0,0]=3 729 B12R1.367 CC[C@H](N)C1=CC(C)=C(F)C=C1 N11147 [0,2,0,0,0,0|2,0,0]=4 730 B12R1.367 CC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N10954 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.367 CC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N11080 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.367 CC[C@H](N)C1=CC(F)=C(C)C=C1 N11196 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.367 CC[C@H](N)C1=CC(F)=C(C)C=C1 N12917 [0,2,0,0,0,0|1,0,0]=3 734 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 N11160 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.367 CC[C@H](O)C1=CC(C)=C(C)C=C1 N14428 [0,2,0,0,0,0|1,0,0]=3 736 B12R1.367 CC[C@H](O)C1=CC(Cl)=C(Br)C=C1 97338 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.367 CC[C@H](O)C1=CC(Cl)=C(Cl)C=C1 N14421 [0,2,0,0,0,0|2,0,0]=4 738 B12R1.367 CC[C@H](O)C1=CC(F)=C(F)C=C1 N14423 [0,2,0,0,0,0|2,0,0]=4 739 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Br)C=C1 N13717 [0,2,0,0,0,0|2,0,0]=4 740 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Br)C=C1 N13719 [0,2,0,0,0,0|2,0,0]=4 741 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13714 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13715 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.367 NC[C@H](N)C1=CC(Cl)=C(Cl)C=C1 N13716 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13661 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13662 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.367 NC[C@H](N)C1=CC(F)=C(Br)C=C1 N13663 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13656 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13657 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13658 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13659 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.367 NC[C@H](N)C1=CC(F)=C(Cl)C=C1 N13660 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13652 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13653 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13654 [0,2,0,0,0,0|2,0,0]=4 755 B12R1.367 NC[C@H](N)C1=CC(F)=C(F)C=C1 N13655 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.367 NC[C@H](O)C1=CC(Cl)=C(Cl)C=C1 F50725 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 D97793 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.367 N[C@@H](CO)C1=CC(Cl)=C(F)C=C1 96795 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.367 N[C@@H](CO)C1=CC(Cl)=C(F)C=C1 N15879 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.367 N[C@@H](CO)C1=CC(F)=C(Br)C=C1 N13090 [0,2,0,0,0,0|2,0,0]=4 761 B12R1.367 N[C@@H](CO)C1=CC(F)=C(F)C=C1 N11097 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.367 N[C@@H](CO)C1=CC(F)=C(F)C=C1 N11182 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 89818 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.1005 CC(C)C1=CC(I)=C(N)C(Br)=C1 91891 [0,2,0,0,0,0|1,0,0]=3 765 B12R1.1005 C[C@H](O)C1=CC(F)=C(F)C(F)=C1 AT11391 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.1005 C[C@H](O)C1=CC(F)=C(F)C(F)=C1 AT11392 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.12 CCC(=C=O)C1=CC=C(C)C=C1 F50686 [0,2,0,0,0,0|0,0,2]=4 768 B12R1.12 CC[C@H](C#N)C1=CC=C(Br)C=C1 92209 [0,2,0,0,0,0|1,0,1]=4 769 B12R1.12 CN[C@@H](CO)C1=CC=C(Cl)C=C1 N12948 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.12 COC(OC)C1=CC=C(C)C=C1 D76271 [0,2,0,0,0,0|0,0,0]=2 771 B12R1.12 COC(OC)C1=NC=C(Br)C=C1 AT22889 [0,2,0,0,0,0|2,0,0]=4 772 B12R1.16 CCC[C@H](N)C1=CC=C(F)C=C1 F21118 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.16 CN(CCO)C1=CC=C(N)C=C1 32810 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.16 COC[C@H](N)C1=CC=C(Br)C=C1 N11361 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.16 COC[C@H](N)C1=CC=C(Cl)C=C1 N13032 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.16 COC[C@H](N)C1=CC=C(F)C=C1 N13057 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.16 COC[C@H](N)C1=CC=C(F)C=C1 N13150 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.16 COC[C@H](N)C1=CC=C(F)C=C1 N16979 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.16 NC1=CC=C([C@@H](N)CCO)C=C1 51805 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.16 NCC[C@H](O)C1=CC=C(Cl)C=C1 74612 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 58177 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.16 N[C@@H](CCO)C1=CC=C(F)C=C1 60079 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.16 OCC[C@H](O)C1=CC=C(Br)C=C1 AT23932 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15339 [0,2,0,0,0,0|1,0,1]=4 785 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15340 [0,2,0,0,0,0|1,0,1]=4 786 B12R1.1703 C=C[C@H](N)C1=C(F)C=C(C)C=C1 N15341 [0,2,0,0,0,0|1,0,1]=4 787 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13753 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13754 [0,2,0,0,0,0|1,0,0]=3 789 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13755 [0,2,0,0,0,0|1,0,0]=3 790 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13768 [0,2,0,0,0,0|1,0,0]=3 791 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13769 [0,2,0,0,0,0|1,0,0]=3 792 B12R1.1703 CC1=CC(C)=C([C@@H](O)CN)C=C1 C77862 [0,2,0,0,0,0|1,0,0]=3 793 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13631 [0,2,0,0,0,0|1,0,0]=3 794 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13632 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13633 [0,2,0,0,0,0|1,0,0]=3 796 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13557 [0,2,0,0,0,0|1,0,0]=3 797 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13558 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13559 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.1703 CCC(=O)C1=C(C)C=C(C)C=C1 N12084 [0,2,0,0,0,0|1,0,1]=4 800 B12R1.1703 CCC(=O)C1=C(Cl)C=C(C)C=C1 N14082 [0,2,0,0,0,0|1,0,1]=4 801 B12R1.1703 CCC(=O)C1=C(F)C=C(C)C=C1 N14029 [0,2,0,0,0,0|1,0,1]=4 802 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 N12160 [0,2,0,0,0,0|1,0,0]=3 803 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N10945 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N11162 [0,2,0,0,0,0|2,0,0]=4 805 B12R1.1703 CC[C@H](O)C1=C(C)C=C(C)C=C1 N14425 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.1703 CC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 N14422 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.1703 CC[C@H](O)C1=C(F)C=C(Br)C=C1 97337 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.1703 CC[C@H](O)C1=C(F)C=C(F)C=C1 N12683 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14215 [0,2,0,0,0,0|1,0,0]=3 810 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14216 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13628 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13629 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13630 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13577 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13578 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13579 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13580 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13581 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13582 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13583 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13585 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13586 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13552 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13553 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13554 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13555 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13556 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13549 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13550 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13551 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13546 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13547 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13548 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.1703 NC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 C78542 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.1703 NC[C@H](O)C1=C(F)C=C(F)C=C1 C78271 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10628 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10637 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.1703 O[C@@H](CBr)C1=C(Cl)C=C(Cl)C=C1 11639 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.57 COC1=C([C@H](C)N)C=CC(F)=C1 N13112 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.1000 CC1=CC(Br)=CC(C)=C1N(C)C 76906 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.1000 CC1=CC(C)=C([C@H](C)N)C(C)=C1 E71773 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.1000 C[C@H](N)C1=C(F)C=C(F)C=C1F N13233 [0,2,0,0,0,0|2,0,0]=4 843 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [1,0,0,1,0,0|1,0,0]=3 844 B10R2.6 C1=CN=C(C2CC2)N=C1 P12514 [1,0,0,1,0,0|2,0,0]=4 845 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [1,0,0,1,0,0|1,0,0]=3 846 B10R2.14 CC1=NC(C2CC2)=CS1 N10117 [0,0,0,1,1,0|2,0,0]=4 847 B10R2.14 CN1C=CC(C2CC2)=N1 F53839 [0,0,0,1,1,0|2,0,0]=4 848 B10R2.14 CN1C=NC(C2CC2)=C1 P13684 [0,0,0,1,1,0|2,0,0]=4 849 B12R2.79 NC1CC1C2=CC=C(F)C=C2 96610 [0,0,0,1,0,1|2,0,0]=4 850 B12R2.79 NC1CC1C2=CC=C(O)C=C2 AT19453 [0,0,0,1,0,1|2,0,0]=4 851 B12R2.79 NC1CC1C2=CC=C(O)C=C2 D88027 [0,0,0,1,0,1|2,0,0]=4 852 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 96593 [0,0,0,1,0,1|2,0,0]=4 853 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 E72639 [0,0,0,1,0,1|2,0,0]=4 854 B12R2.79 N[C@H]1C[C@@H]1C2=CC=C(F)C=C2 FD10509 [0,0,0,1,0,1|2,0,0]=4 855 B12R2.294 BrC1=CC=C(NC2CC2)C=C1 AT13548 [0,0,0,1,0,1|1,0,0]=3 856 B12R2.294 BrC1=CC=C(SC2CC2)C=C1 AT24051 [0,0,0,1,0,1|1,0,0]=3 857 B12R2.294 BrC1=CN=C(OC2CC2)C=C1 D75905 [0,0,0,1,0,1|2,0,0]=4 858 B12R2.294 FC1=CC=C(OC2CC2)C=C1 AT21306 [0,0,0,1,0,1|1,0,0]=3 859 B12R2.294 FC1=CN=C(NC2CC2)C=C1 88580 [0,0,0,1,0,1|2,0,0]=4 860 B12R2.294 NC1=CC=C(OC2CC2)C=C1 AT11984 [0,0,0,1,0,1|1,0,0]=3 861 B12R2.606 CC1=CC2=C(C=C1)N=C(C)O2 AC6304 [0,0,0,1,0,1|1,0,1]=4 862 B12R2.606 NC1=CC2=C(C=C1)C[C@H](O)C2 94670 [0,0,0,1,0,1|2,0,0]=4 863 B12R2.606 N[C@H]1CC2=C(C=C(Cl)C=C2)C1 C16302 [0,0,0,1,0,1|2,0,0]=4 864 B12R2.606 N[C@H]1CC2=C(C=C(F)C=C2)C1 Y10225 [0,0,0,1,0,1|2,0,0]=4 865 B12R2.606 N[C@H]1CC2=C(C=C(I)C=C2)C1 25202 [0,0,0,1,0,1|2,0,0]=4 866 B12R2.606 N[C@H]1CC2=C(C=C(I)C=C2)C1 36607 [0,0,0,1,0,1|2,0,0]=4 867 B12R2.606 OC1=CC2=C(C=C1)C[C@H](O)C2 F53501 [0,0,0,1,0,1|2,0,0]=4 868 B12R2.9 BrCC1=CC=C(C2CC2)C=C1 51969 [0,1,0,1,0,0|0,0,0]=2 869 B12R2.9 BrCC1=CN=C(C2CC2)N=C1 AT18451 [0,1,0,1,0,0|2,0,0]=4 870 B12R2.9 CCC1=CC=C(C2CC2)C=C1 AC8465 [0,1,0,1,0,0|0,0,0]=2 871 B12R2.9 COC1=CC=C(C2CC2)C=C1 F53529 [0,1,0,1,0,0|0,0,0]=2 872 B12R2.9 ClCC1=CC=C(C2CC2)C=C1 P12610 [0,1,0,1,0,0|0,0,0]=2 873 B12R2.9 N#CC1=CN=C(C2CC2)C=C1 AC2752 [0,1,0,1,0,0|1,0,1]=4 874 B12R2.9 NCC1=CC=C(C2CC2)C=C1 33490 [0,1,0,1,0,0|0,0,0]=2 875 B12R2.9 NCC1=CN=C(C2CC2)N=C1 81404 [0,1,0,1,0,0|2,0,0]=4 876 B12R2.9 OCC1=CN=C(C2CC2)N=C1 81405 [0,1,0,1,0,0|2,0,0]=4 877 B12R2.290 NC1(C2=CN=C(Br)C=C2)CC1 95038 [0,1,0,1,0,0|2,0,0]=4 878 B12R2.290 NC1(C2=CN=C(Cl)C=C2)CC1 91212 [0,1,0,1,0,0|2,0,0]=4 879 B12R2.290 NC1(C2=NC=C(F)C=C2)CC1 59914 [0,1,0,1,0,0|2,0,0]=4 880 B12R2.290 NC1(C2=NC=C(F)C=C2)CC1 F18531 [0,1,0,1,0,0|2,0,0]=4 881 B12R2.290 OC1(C2=CC=C(Br)C=C2)CC1 W18259 [0,1,0,1,0,0|1,0,0]=3 882 B12R2.290 OC1(C2=CC=C(Cl)C=C2)CC1 AT23536 [0,1,0,1,0,0|1,0,0]=3 883 B12R2.290 OC1(C2=CC=C(F)C=C2)CC1 AT23535 [0,1,0,1,0,0|1,0,0]=3 884 B12R2.290 OC1(C2=CN=C(Br)C=C2)CC1 AC1236 [0,1,0,1,0,0|2,0,0]=4 885 B12R2.291 CC1=C(Br)C=NC(C2CC2)=C1 AT10174 [0,1,0,1,0,0|2,0,0]=4 886 B12R2.291 CC1=C(Br)C=NC(C2CC2)=C1 C91348 [0,1,0,1,0,0|2,0,0]=4 887 B12R2.291 CC1=C(N)C=C(C2CC2)C=C1 AC9034 [0,1,0,1,0,0|0,0,0]=2 888 B12R2.291 ClC1=C(Cl)C=C(C2CC2)C=C1 AC8617 [0,1,0,1,0,0|1,0,0]=3 889 B12R2.291 FC1=C(Br)C=CC(C2CC2)=C1 96637 [0,1,0,1,0,0|1,0,0]=3 890 B12R2.291 FC1=C(Cl)C=C(C2CC2)C=C1 AC9177 [0,1,0,1,0,0|1,0,0]=3 891 B12R2.291 NC1=C(Br)C=C(C2CC2)C=C1 AT10657 [0,1,0,1,0,0|1,0,0]=3 892 B12R2.291 NC1=C(Br)C=C(C2CC2)C=N1 94374 [0,1,0,1,0,0|2,0,0]=4 893 B12R2.291 NC1=C(F)C=C(C2CC2)C=C1 96634 [0,1,0,1,0,0|1,0,0]=3 894 B12R2.291 NC1=C(N)C=C(C2CC2)C=C1 AC8809 [0,1,0,1,0,0|1,0,0]=3 895 B12R2.612 CC1=CC2=C(C=C1)C(=O)NC2 F21430 [0,1,0,1,0,0|1,0,1]=4 896 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10840 [0,1,0,1,0,0|1,0,0]=3 897 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N11326 [0,1,0,1,0,0|1,0,0]=3 898 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16521 [0,1,0,1,0,0|1,0,0]=3 899 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16523 [0,1,0,1,0,0|1,0,0]=3 900 B12R2.612 ClC1=CC2=C(C=C1)[C@@H](Br)CC2 AT21847 [0,1,0,1,0,0|2,0,0]=4 901 B12R2.612 Cl[C@H]1CCC2=C1C=CC(Br)=C2 O11349 [0,1,0,1,0,0|2,0,0]=4 902 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14630 [0,1,0,1,0,0|2,0,0]=4 903 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14631 [0,1,0,1,0,0|2,0,0]=4 904 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 69968 [0,1,0,1,0,0|2,0,0]=4 905 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F16940 [0,1,0,1,0,0|2,0,0]=4 906 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11252 [0,1,0,1,0,0|2,0,0]=4 907 B12R2.612 N[C@H]1COC2=C1C=CC(Br)=C2 N11256 [0,1,0,1,0,0|2,0,0]=4 908 B12R2.612 O[C@H]1COC2=C1C=CC(Cl)=C2 AT21520 [0,1,0,1,0,0|2,0,0]=4 909 B12R2.2302 BrC1=CC=C([C@@H]2CCN2)C=C1 AT25319 [0,1,0,1,0,0|1,0,0]=3 910 B12R2.2302 FC1=CC=C([C@@H]2CCN2)C=C1 AT25422 [0,1,0,1,0,0|1,0,0]=3 911 B12R2.1317 CC1=CC(C)=C(C2CC2)C=C1 AC9569 [0,1,0,1,0,0|0,0,0]=2 912 B12R2.1317 FC1=CC(F)=C(C2CC2)C=C1 AC9452 [0,1,0,1,0,0|1,0,0]=3 913 B12R2.1317 NC1=C(C2CC2)C=CC(Cl)=C1 AC9037 [0,1,0,1,0,0|1,0,0]=3 914 B8R1.1 CC1=CC(CN)=CO1 AT17525 [1,0,0,0,1,0|2,0,0]=4 915 B8R1.1 CC1=CC(CO)=CO1 AT17479 [1,0,0,0,1,0|2,0,0]=4 916 B8R1.1 CC1=CC(CO)=CS1 AT16765 [1,0,0,0,1,0|2,0,0]=4 917 B8R1.1 CC1=COC(CO)=C1 AT17124 [1,0,0,0,1,0|2,0,0]=4 918 B8R1.1 CCC1=CC=C(S)S1 AT16555 [1,0,0,0,1,0|2,0,0]=4 919 B8R1.1 CCC1=NN(C)C=C1 C91459 [1,0,0,0,1,0|2,0,0]=4 920 B8R1.1 CN1C=CC(CN)=C1 AT16243 [1,0,0,0,1,0|2,0,0]=4 921 B8R1.7 C[C@H](N)C1=CC=CO1 74860 [1,0,0,0,1,0|2,0,0]=4 922 B8R1.7 C[C@H](N)C1=CC=CO1 F16901 [1,0,0,0,1,0|2,0,0]=4 923 B8R1.7 C[C@H](N)C1=CC=CO1 N12744 [1,0,0,0,1,0|2,0,0]=4 924 B8R1.7 C[C@H](N)C1=COC=C1 AT17538 [1,0,0,0,1,0|2,0,0]=4 925 B8R1.7 C[C@H](N)C1=COC=C1 N16718 [1,0,0,0,1,0|2,0,0]=4 926 B8R1.7 C[C@H](N)C1=CSC=C1 27875 [1,0,0,0,1,0|2,0,0]=4 927 B8R1.7 C[C@H](O)C1=CC=CS1 71923 [1,0,0,0,1,0|2,0,0]=4 928 B8R1.7 C[C@H](O)C1=CC=CS1 AT16382 [1,0,0,0,1,0|2,0,0]=4 929 B8R1.7 C[C@H](O)C1=CC=CS1 AT16384 [1,0,0,0,1,0|2,0,0]=4 930 B8R1.7 C[C@H](O)C1=COC=C1 AT17475 [1,0,0,0,1,0|2,0,0]=4 931 B8R1.7 C[C@H](O)C1=COC=C1 AT17477 [1,0,0,0,1,0|2,0,0]=4 932 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [1,0,0,0,0,1|1,0,1]=4 933 B10R1.18 CC(C)CC1=CC=NC=C1 AC2809 [1,0,0,0,0,1|1,0,0]=3 934 B10R1.18 C[C@H](N)CC1=CC=NC=C1 F11581 [1,0,0,0,0,1|2,0,0]=4 935 B10R1.18 C[C@H](N)CC1=NC=CC=C1 F13183 [1,0,0,0,0,1|2,0,0]=4 936 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [1,0,0,0,0,1|1,0,0]=3 937 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [1,0,0,0,0,1|1,0,0]=3 938 B12R1.21 CC(C)NCC1=CC=C(Br)C=C1 C78335 [0,0,0,0,0,2|1,0,0]=3 939 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 C78202 [0,0,0,0,0,2|1,0,0]=3 940 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 C77883 [0,0,0,0,0,2|1,0,0]=3 941 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 C78416 [0,0,0,0,0,2|0,0,0]=2 942 B12R1.21 CC1=CC=C(OC[C@H](C)N)C=C1 C78123 [0,0,0,0,0,2|1,0,0]=3 943 B12R1.21 C[C@H](N)CCC1=CC=C(Br)C=C1 84991 [0,0,0,0,0,2|2,0,0]=4 944 B12R1.21 C[C@H](N)CCC1=CC=C(O)C=C1 N14377 [0,0,0,0,0,2|2,0,0]=4 945 B12R1.21 C[C@H](N)COC1=CC=C(Br)C=C1 C78409 [0,0,0,0,0,2|2,0,0]=4 946 B12R1.21 C[C@H](N)COC1=CC=C(F)C=C1 C77796 [0,0,0,0,0,2|2,0,0]=4