0 B10R1.61 BrC1=C(C(Br)Br)C=CN=C1 W10378 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [0,0,0,0,0,0|1,1,1]=3 7 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [0,0,0,0,0,0|2,0,2]=4 8 B10R1.61 CC(C)C1=CN=CN=C1Cl H10240 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 CC(C)C1=NC=CN=C1Cl AT24532 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.61 CC(C)C1=NC=CN=C1N 60031 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.61 CC(C)C1=NC=CN=C1N W15952 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.61 CC1=C(P(Cl)Cl)C=CC=C1 AC9855 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70081 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.61 C[C@H](N)C1=C(Cl)C=NC=C1 N14402 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.61 C[C@H](N)C1=C(O)C=CC=N1 N14916 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.61 C[C@H](N)C1=CC=CN=C1N P19332 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 C10363 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 FC(F)C1=C(Br)C=NC=C1 AT12861 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.61 FC(F)C1=C(Br)C=NC=C1 D76051 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.61 FC(F)C1=CC=CN=C1Br 79327 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.61 N=C(N)C1=C(F)C=CC=C1 W10322 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.61 NC(=O)C1=C(O)N=CC=C1 D74336 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.61 O=C1C=CC=CN1C(F)F AT12838 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.6 CN(C)C1=NC=NC=C1 O12006 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.6 C[C@H](Br)C1=NC=CN=C1 C77147 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.6 C[C@H](N)C1=CN=CN=C1 P14618 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.6 C[C@H](N)C1=NC=CC=N1 72045 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93141 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.6 C[C@H](N)C1=NC=CN=C1 C93144 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.6 C[C@H](N)C1=NC=NC=C1 N10689 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.6 C[C@H](N)C1=NC=NC=C1 P10880 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.6 C[C@H](O)C1=NC=NC=C1 AT18318 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [1,0,0,0,0,0|1,0,2]=4 45 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [1,0,0,0,0,0|1,0,2]=4 47 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.15 CC1=CC=CN=C1CBr D97530 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.15 CCC1=C(N)N=NC=C1 S11451 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.15 CCC1=CC=CN=C1C 75814 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.15 CCC1=CN=CN=C1O C15413 [1,0,0,0,0,0|2,0,0]=3 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 ClC1=CC=CN=C1CBr 79180 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.15 ClC1=CC=CN=C1CBr 86640 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.15 ClCC1=CC=CN=C1Br 55187 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 N#CC1=C(O)C=NC=C1 AT12828 [1,0,0,0,0,0|2,0,1]=4 63 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [1,0,0,0,0,0|1,1,1]=4 64 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.15 NCC1=CC=CN=C1Cl 37571 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 NCC1=CC=CN=C1N CL0345 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [1,0,0,0,0,0|2,0,1]=4 77 B11R1.53 C=C(Br)C1=C(OC)C=CC=C1 F18312 [0,1,0,0,0,0|1,0,2]=4 78 B11R1.53 CC(C)C1=C(CCl)C=CC=C1 E72192 [0,1,0,0,0,0|1,0,0]=2 79 B11R1.53 COC1=C([C@H](C)N)C=NC=C1 Y12493 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.53 COC1=C([C@H](C)N)N=CC=C1 90521 [0,1,0,0,0,0|2,0,0]=3 81 B11R1.53 CSC1=NC=CN=C1C(C)C F18029 [0,1,0,0,0,0|2,1,0]=4 82 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=C1 Y12983 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y13010 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 C73535 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.53 FC(F)C1=C(CBr)C=CC=C1 AT24780 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 O10520 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.53 OCC1=C(C(F)F)C=CC=C1 AT10623 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.87 CC(C)(C)C1=C(O)C=CC=N1 W16228 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.87 CC(C)(C)C1=NC=CN=C1Cl AT11134 [0,1,0,0,0,0|3,0,0]=4 90 B11R1.87 CC(C)(N)C1=C(F)C=CC=C1 C78437 [0,1,0,0,0,0|1,0,0]=2 91 B11R1.87 CC(C)(N)C1=C(F)C=NC=C1 D81239 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.87 CC(C)(O)C1=C(Br)C=CC=N1 N10027 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.87 CC(C)(O)C1=C(Cl)C=NC=C1 N12769 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.87 CC(C)(O)C1=CC=CN=C1F VT1237 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.87 CC(F)(F)C1=C(Br)C=NC=C1 AT13789 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.87 CC(F)(F)C1=C(N)C=CC=C1 AT20037 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.87 C[S@](=N)(=O)C1=C(Br)C=CC=C1 AT11347 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.87 C[S@](=N)(=O)C1=C(Cl)C=CC=C1 AT11351 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.87 C[S@](=N)(=O)C1=C(F)C=CC=C1 AT11350 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.87 [2H]C([2H])([2H])C1=C(F)C=CC=C1 D98484 [0,1,0,0,0,0|3,0,0]=4 101 B11R1.87 [2H]C([2H])([2H])C1=C(N)C=CC=C1 D99263 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.156 CC(=O)C1=C(Br)C=CC=C1N C75622 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N AT12995 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1F C91102 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11387 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F AT11388 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.156 C[C@H](O)C1=C(I)C=CN=C1F AT16504 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.156 FC(F)C1=C(Br)C=CC=C1Br AT20038 [0,1,0,0,0,0|3,0,0]=4 109 B11R1.156 NC(=O)C1=C(F)C=CC=C1O C13392 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.156 NC1=CC=CC(O)=C1C(=O)O 26442 [0,1,0,0,0,0|2,0,1]=4 111 B11R1.159 C=C(C)C1=C(N)C(C)=CC=C1 F18673 [0,1,0,0,0,0|1,0,2]=4 112 B11R1.159 CC(=O)C1=C(C)C(N)=CC=C1 O10268 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 C76227 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1I 94553 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.159 CC(=O)C1=CC=CC(O)=C1F AT11003 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.159 CC(C)C1=CC=CC(Br)=C1O C91212 [0,1,0,0,0,0|0,0,0]=1 117 B11R1.159 CC(C)C1=CC=CC(N)=C1N D85847 [0,1,0,0,0,0|1,0,0]=2 118 B11R1.159 CC(C)N1C=CC=C(N)C1=O AT19244 [0,1,0,0,0,0|1,0,1]=3 119 B11R1.159 CC1=C(Br)C=CC=C1C(F)F D96307 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.159 CC1=C(O)C(B(O)O)=CC=C1 D71388 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.159 CC1=CC=CC(C(F)F)=C1C C90878 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.159 CC1=CC=CC(C(N)=O)=C1O AC4144 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.159 CC1=CC=CC([C@H](C)N)=C1C N12727 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl Y11085 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.159 FC1=C(Br)C(C(F)F)=CC=C1 C91613 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.159 FC1=C(Br)C=CC=C1C(F)F F17091 [0,1,0,0,0,0|3,0,0]=4 127 B11R1.159 NC1=C(Cl)C(C(F)F)=CC=C1 AC1561 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.159 O=C(O)C1=CC=CC(I)=C1O AT10718 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.166 CC(=O)C1=C(Cl)C=C(C)C=C1 AT15339 [0,1,0,0,0,0|2,0,1]=4 130 B11R1.166 CC(=O)C1=C(O)C=C(I)C=C1 62926 [0,1,0,0,0,0|1,0,1]=3 131 B11R1.166 CC(C)C1=C(Br)C=C(Cl)C=C1 F21471 [0,1,0,0,0,0|1,0,0]=2 132 B11R1.166 CC(C)C1=C(F)C=C(Br)C=C1 F52298 [0,1,0,0,0,0|1,0,0]=2 133 B11R1.166 CC1=CC(Br)=C(C(C)C)C=C1 AT26576 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14911 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14912 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.166 CC1=CC(Br)=CN=C1[C@H](C)N N14913 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 N12239 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81539 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D81617 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.166 CC1=CC(F)=C([C@H](C)O)C=C1 AT15336 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.166 CC1=CC=C(C(C)C)C(N)=N1 AT11138 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.166 C[C@H](Br)C1=C(F)C=C(F)C=C1 C77556 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.166 C[C@H](Cl)C1=NC=C(Cl)C=C1F P14811 [0,1,0,0,0,0|3,0,0]=4 144 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14923 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Cl)C=N1 N14924 [0,1,0,0,0,0|3,0,0]=4 146 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N12749 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.166 C[C@H](N)C1=C(Cl)C=C(F)C=C1 N13113 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 F16902 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14393 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14394 [0,1,0,0,0,0|3,0,0]=4 151 B11R1.166 C[C@H](N)C1=NC=C(Br)C=C1F N14395 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.166 C[C@H](N)C1=NC=C(Cl)C=C1F 79549 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11374 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.166 C[C@H](O)C1=C(F)C=C(F)C=C1 AT11378 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D75887 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.166 C[C@H](O)C1=NC=C(Br)C=C1F S10055 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.166 FC(F)C1=C(Br)C=C(I)C=C1 E70168 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.166 OB(O)C1=C(O)C=C(Br)C=C1 D71659 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.166 OC1=C(C(F)F)C=CC(F)=C1 79331 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 F52542 [0,1,0,0,0,0|2,0,1]=4 161 B11R1.167 CC(=O)C1=C(N)C=CC(O)=C1 32344 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.167 CC(C)C1=C(Br)C=CC(O)=C1 57997 [0,1,0,0,0,0|1,0,0]=2 163 B11R1.167 CC(C)C1=C(Br)C=NC(N)=N1 92049 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.167 CC(C)C1=C(N)C=CC(Br)=C1 N12218 [0,1,0,0,0,0|1,0,0]=2 165 B11R1.167 CC(C)C1=C(O)C=CC(N)=C1 F31161 [0,1,0,0,0,0|0,0,0]=1 166 B11R1.167 CC(C)C1=CC(N)=NN=C1Cl E71770 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.167 CC(C)C1=CC(O)=NN=C1O P20475 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.167 CC1=CC(C(C)C)=C(O)C=C1 30812 [0,1,0,0,0,0|0,0,0]=1 169 B11R1.167 CC1=CC([C@H](C)N)=C(C)C=C1 N12153 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.167 CC1=CN=C(F)C([C@H](C)O)=C1 N13304 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91100 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.167 C[C@H](N)C1=C(Br)C=CC(F)=C1 C91101 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13035 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13127 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24141 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 D85891 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.167 C[C@H](N)C1=C(O)C=CC(F)=C1 D81270 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11385 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.167 C[C@H](O)C1=C(F)C=CC(F)=C1 AT11386 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.222 C#C[C@@H](O)C1=C(Br)C=CC=C1 AC5641 [0,1,0,0,0,0|2,0,1]=4 181 B11R1.222 C#C[C@@H](O)C1=C(C)C=CC=C1 AC4137 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.222 C#C[C@@H](O)C1=C(Cl)C=CC=C1 AC5063 [0,1,0,0,0,0|2,0,1]=4 183 B11R1.222 C#C[C@@H](O)C1=C(F)C=CC=C1 AC5690 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.222 C#C[C@@H](O)C1=C(O)C=CC=C1 AC5065 [0,1,0,0,0,0|1,0,1]=3 185 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15249 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15250 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.222 C=C[C@H](N)C1=C(Br)C=CC=C1 N15251 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15259 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15260 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.222 C=C[C@H](N)C1=C(C)C=CC=C1 N15261 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15239 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15240 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.222 C=C[C@H](N)C1=C(Cl)C=CC=C1 N15241 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15232 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15233 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.222 C=C[C@H](N)C1=C(F)C=CC=C1 N15234 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15292 [0,1,0,0,0,0|1,0,1]=3 198 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15293 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.222 C=C[C@H](N)C1=C(O)C=CC=C1 N15294 [0,1,0,0,0,0|1,0,1]=3 200 B11R1.222 CC1=C(C(=O)CO)C=CC=C1 AC4310 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.222 CC1=C([C@@H](N)CF)C=CC=C1 N14610 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13426 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13427 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13428 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13449 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13450 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.222 CC1=C([C@@H](N)CN)C=CC=C1 N13451 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.222 CC1=C([C@@H](N)CO)C=CC=C1 N15069 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.222 CC1=CC=CN=C1[C@@H](N)CN N14901 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 72058 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 35361 [0,1,0,0,0,0|1,0,0]=2 212 B11R1.222 CC[C@H](N)C1=C(Br)C=CC=C1 N13015 [0,1,0,0,0,0|2,0,0]=3 213 B11R1.222 CC[C@H](N)C1=C(Cl)C=NC=C1 N14403 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13856 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13857 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13858 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.222 CC[C@H](N)C1=NC=CC=C1C N13859 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.222 CC[C@H](O)C1=C(Br)C=CC=C1 N12628 [0,1,0,0,0,0|2,0,0]=3 219 B11R1.222 CC[C@H](O)C1=C(C)C=CC=C1 N14414 [0,1,0,0,0,0|2,0,0]=3 220 B11R1.222 CC[C@H](O)C1=C(Cl)C=CC=C1 N14413 [0,1,0,0,0,0|2,0,0]=3 221 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 E72599 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.222 CNC(=O)C1=NC=CC=C1O C71661 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.222 CN[C@@H](C)C1=C(Br)C=CC=C1 N12718 [0,1,0,0,0,0|1,0,0]=2 224 B11R1.222 CN[C@@H](C)C1=C(C)C=CC=C1 N12531 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.222 CN[C@@H](C)C1=C(O)C=CC=C1 N12719 [0,1,0,0,0,0|0,0,0]=1 226 B11R1.222 COC(=N)C1=C(Br)C=CC=C1 AC5256 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W12757 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.222 N#C[C@@H](N)C1=C(F)C=CC=C1 AT10485 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.222 NC1=C(C(=O)CCl)C=CC=C1 72272 [0,1,0,0,0,0|2,0,1]=4 230 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 W17616 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13418 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13419 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13441 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13442 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13403 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13409 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.222 NC[C@H](N)C1=C(Cl)C=CC=C1 N13410 [0,1,0,0,0,0|2,0,0]=3 238 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13390 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13391 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13392 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13393 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13394 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.222 NC[C@H](N)C1=C(F)C=CC=C1 N13395 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.222 NC[C@H](O)C1=C(Br)C=CC=C1 71742 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.222 NC[C@H](O)C1=C(F)C=CC=C1 C78140 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.222 NC[C@H](O)C1=C(I)C=CC=C1 O10641 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.222 N[C@@H](CF)C1=C(F)C=CC=C1 N14609 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.222 N[C@@H](CO)C1=C(Br)C=CC=C1 C77783 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 N14404 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15244 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=C1 N15255 [0,1,0,0,0,0|1,0,0]=2 252 B11R1.222 N[C@@H](CO)C1=C(O)C=CC=N1 N14918 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.222 O=C(CCl)C1=C(Cl)C=CC=C1 D71120 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.222 O=C(CO)C1=C(Br)C=CC=C1 AC7495 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.222 O=C(CO)C1=C(F)C=CC=C1 AC5617 [0,1,0,0,0,0|2,0,1]=4 256 B11R1.222 O=C(CO)C1=C(I)C=CC=C1 AC7053 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.222 O[C@@H](CF)C1=CC=CN=C1F AT10158 [0,1,0,0,0,0|3,0,0]=4 258 B11R2.1 CC1=C2C=CC=CC2=NO1 AC6101 [0,0,0,1,0,0|2,0,1]=4 259 B11R2.1 C[C@@H]1N=NC2=NC=CC=C21 F17908 [0,0,0,1,0,0|3,0,0]=4 260 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 W18948 [0,0,0,1,0,0|1,0,0]=2 261 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 41003 [0,0,0,1,0,0|2,0,0]=3 262 B11R2.1 N[C@H]1CCC2=CC=CN=C21 D81362 [0,0,0,1,0,0|3,0,0]=4 263 B11R2.1 N[C@H]1CCC2=NC=CC=C21 D79496 [0,0,0,1,0,0|3,0,0]=4 264 B11R2.1 N[C@H]1COC2=C1C=CC=C2 I11926 [0,0,0,1,0,0|1,0,0]=2 265 B11R2.1 O=C1COC2=C1C=CC=N2 O11821 [0,0,0,1,0,0|2,0,1]=4 266 B11R2.1 O[C@H]1COC2=C1C=CC=C2 AT19563 [0,0,0,1,0,0|1,0,0]=2 267 B11R2.55 BrC1=C(C2CC2)C=CN=C1 AT12865 [0,0,0,1,0,0|2,0,0]=3 268 B11R2.55 CC1=C(C2CC2)C=CC=C1 AC9736 [0,0,0,1,0,0|1,0,0]=2 269 B11R2.55 CC1=CC=CN=C1C2CC2 AC9685 [0,0,0,1,0,0|2,0,0]=3 270 B11R2.55 CC1=NC=CC=C1C2CC2 F13571 [0,0,0,1,0,0|2,0,0]=3 271 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 AT10463 [0,0,0,1,0,0|2,0,0]=3 272 B11R2.55 ClC1=C([C@@H]2CO2)C=CC=C1 CK2535 [0,0,0,1,0,0|2,0,0]=3 273 B11R2.55 NC1=C(C2CC2)C=CC=C1 A10978 [0,0,0,1,0,0|1,0,0]=2 274 B11R2.55 NC1=C(C2CC2)C=CN=C1 AT16333 [0,0,0,1,0,0|2,0,0]=3 275 B11R2.55 OC1=C(C2CC2)C=CC=C1 91444 [0,0,0,1,0,0|0,0,0]=1 276 B9R1.41 CC(=O)C1=C(O)C=CS1 AT16388 [0,0,0,0,1,0|2,0,1]=4 277 B9R1.41 CC(C)C1=C(Br)SC=N1 AC2048 [0,0,0,0,1,0|3,0,0]=4 278 B9R1.41 CC(C)C1=C(N)C=NO1 AT19808 [0,0,0,0,1,0|3,0,0]=4 279 B9R1.41 CC(C)C1=C(N)NC=N1 F52613 [0,0,0,0,1,0|3,0,0]=4 280 B9R1.41 CC(C)C1=C(N)SC=N1 W15851 [0,0,0,0,1,0|3,0,0]=4 281 B9R1.41 CC(C)C1=CON=C1N AT19789 [0,0,0,0,1,0|3,0,0]=4 282 B9R1.41 CC(C)C1=NC=CN1C 63235 [0,0,0,0,1,0|3,0,0]=4 283 B9R1.41 CC(C)N1C=CN=C1S AT15639 [0,0,0,0,1,0|2,1,0]=4 284 B9R1.41 CC(C)N1C=NC=C1Br AT15318 [0,0,0,0,1,0|3,0,0]=4 285 B9R1.41 CC(C)N1N=CC=C1O P20906 [0,0,0,0,1,0|2,0,0]=3 286 B11R1.86 CC(=O)OC1=C(Br)C=CC=C1 F13222 [0,0,0,0,0,1|2,0,1]=4 287 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 81280 [0,0,0,0,0,1|2,0,1]=4 288 B11R1.86 CC(C)CC1=NC=CN=C1O 43967 [0,0,0,0,0,1|2,0,0]=3 289 B11R1.86 CC(C)NC1=C(Br)C=CC=C1 C77931 [0,0,0,0,0,1|1,0,0]=2 290 B11R1.86 CC(C)NC1=C(Cl)C=CC=C1 C78464 [0,0,0,0,0,1|1,0,0]=2 291 B11R1.86 CC(C)NC1=C(F)C=CC=C1 C77765 [0,0,0,0,0,1|1,0,0]=2 292 B11R1.86 CC(C)NC1=C(S)C=CC=C1 AC8476 [0,0,0,0,0,1|0,1,0]=2 293 B11R1.86 CC(C)OC1=C(I)C=CC=N1 76901 [0,0,0,0,0,1|2,0,0]=3 294 B11R1.86 CC(C)OC1=C(N)C=CN=C1 AT18128 [0,0,0,0,0,1|2,0,0]=3 295 B11R1.86 CC1=C(C[C@H](C)N)C=CC=C1 N10867 [0,0,0,0,0,1|2,0,0]=3 296 B11R1.86 C[C@H](N)CC1=C(Br)C=CC=C1 N11144 [0,0,0,0,0,1|2,0,0]=3 297 B11R1.86 C[C@H](N)CC1=C(Cl)C=CC=C1 N11063 [0,0,0,0,0,1|2,0,0]=3 298 B11R1.86 C[C@H](O)CC1=C(Br)C=NC=C1 AT12941 [0,0,0,0,0,1|3,0,0]=4 299 B11R1.86 FC(F)OC1=C(Cl)C=CC=C1 F19093 [0,0,0,0,0,1|3,0,0]=4 300 B11R1.86 FC1=C(OC(F)F)C=CC=C1 F18842 [0,0,0,0,0,1|3,0,0]=4 301 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|1,0,0]=3 302 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|2,0,0]=4 303 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [2,0,0,0,0,0|2,0,0]=4 304 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [2,0,0,0,0,0|1,0,0]=3 305 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [2,0,0,0,0,0|2,0,0]=4 306 B10R1.13 CC(C)C1=NC=C(N)C=N1 81917 [1,1,0,0,0,0|2,0,0]=4 307 B10R1.13 CC(C)C1=NN=C(Br)C=C1 C14147 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [1,1,0,0,0,0|2,0,0]=4 309 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.13 CN(C)C1=NC=C(N)C=C1 D74940 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 N11221 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D81683 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y10703 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 90531 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N16973 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90529 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.13 C[C@H](O)C1=CN=C(F)C=C1 AT10687 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10690 [1,1,0,0,0,0|2,0,0]=4 323 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [1,1,0,0,0,0|0,0,2]=4 325 B10R1.15 CCN(C)C1=NC=CC=C1 T72928 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.15 CC[C@H](N)C1=NC=CC=C1 N10611 [1,1,0,0,0,0|2,0,0]=4 328 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [1,1,0,0,0,0|0,0,0]=2 329 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [1,1,0,0,0,0|1,0,1]=4 330 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [1,1,0,0,0,0|0,0,1]=3 331 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [1,1,0,0,0,0|0,0,1]=3 332 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [1,1,0,0,0,0|1,0,0]=3 335 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.15 NC[C@H](O)C1=CC=NC=C1 C78562 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.15 NC[C@H](O)C1=CN=CC=C1 33361 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y11546 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.15 N[C@@H](CO)C1=CC=NC=C1 Y12429 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.15 N[C@@H](CO)C1=CN=CC=C1 Y12120 [1,1,0,0,0,0|2,0,0]=4 341 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12118 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12119 [1,1,0,0,0,0|2,0,0]=4 343 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 Y12430 [1,1,0,0,0,0|2,0,0]=4 344 B10R1.15 O[C@@H](CCl)C1=CN=CC=C1 Y10944 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.28 CC(C)(C)C1=NC=CC=C1 C75774 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.28 CC(C)(C)C1=NC=CN=C1 T70779 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.28 CC(C)(N)C1=NC=CC=N1 AT12626 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.28 CC(C)(N)C1=NC=CC=N1 D75134 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.28 CC(C)(O)C1=NC=CC=N1 AT18243 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.28 FC(F)(Cl)C1=CC=CC=C1 36909 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [1,1,0,0,0,0|0,0,0]=2 352 B10R1.28 [2H]C([2H])(Br)C1=CC=CC=C1 D99472 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [1,1,0,0,0,0|1,0,0]=3 354 B10R1.28 [2H]C([2H])(O)C1=CC=CC=C1 AT24168 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [1,1,0,0,0,0|0,0,2]=4 357 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 D71924 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.113 CC(C)C1=NC=CC(Cl)=N1 W12563 [1,1,0,0,0,0|2,0,0]=4 359 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [1,1,0,0,0,0|0,0,0]=2 360 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [1,1,0,0,0,0|2,0,0]=4 362 B10R1.113 CC1=NC=CC(C(C)C)=N1 O11252 [1,1,0,0,0,0|2,0,0]=4 363 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N10343 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.113 CN(C)C1=CC=CC(F)=N1 AT20362 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 C16301 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [1,1,0,0,0,0|1,0,0]=3 369 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=N1 55243 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 90822 [1,1,0,0,0,0|2,0,0]=4 371 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 AC3205 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 90825 [1,1,0,0,0,0|2,0,0]=4 373 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N10537 [1,1,0,0,0,0|2,0,0]=4 374 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N13087 [1,1,0,0,0,0|2,0,0]=4 375 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90539 [1,1,0,0,0,0|2,0,0]=4 376 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90540 [1,1,0,0,0,0|2,0,0]=4 377 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [1,1,0,0,0,0|1,0,0]=3 378 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [1,1,0,0,0,0|1,0,0]=3 379 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D81409 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.113 C[C@H](N)C1=NC=CC(Br)=C1 90526 [1,1,0,0,0,0|2,0,0]=4 382 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14934 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14935 [1,1,0,0,0,0|2,0,0]=4 384 B10R1.113 C[C@H](O)C1=CC(F)=CN=C1 AT10686 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.113 C[C@H](O)C1=CC(N)=NC=C1 CS1317 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.113 C[C@H](O)C1=CC=CC(F)=N1 AT10689 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [1,1,0,0,0,0|1,0,0]=3 389 B10R1.113 C[C@H](O)C1=NC=CC(F)=C1 AT10691 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.2 CC1=C(F)C=CC=C1CN N12172 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.2 CC1=C(O)C=CC=C1CO 56654 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.2 CC1=CC=CC(CN)=C1O N10504 [1,1,0,0,0,0|1,0,0]=3 396 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [1,1,0,0,0,0|1,0,0]=3 397 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [1,1,0,0,0,0|1,0,0]=3 398 B10R1.2 CCN1C=CC=C(N)C1=O AT19274 [1,1,0,0,0,0|1,0,1]=4 399 B10R1.2 CNC1=CC=CC(F)=C1N AC7422 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.2 COC1=C(N)C(N)=CC=C1 F52601 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.2 COC1=C(O)C(N)=CC=C1 O10655 [1,1,0,0,0,0|1,0,0]=3 402 B10R1.2 COC1=CC=CC(Cl)=C1N CL9246 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.2 COC1=CC=CC(S)=C1N AT19649 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.2 N#CC1=CC=CC(N)=C1O AT22558 [1,1,0,0,0,0|1,0,1]=4 407 B10R1.2 NCC1=CC=CC(F)=C1O N12979 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.2 NCC1=CC=CC(I)=C1Cl C72087 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.2 OCC1=CC=CC(Cl)=C1F A12360 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.4 CCNC1=CC=CN=C1O F30124 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.4 CCNC1=NC=CC=C1N AC7989 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.4 CCOC1=C(C)C=CN=C1 AC4346 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.4 CCOC1=C(F)C=CC=N1 F53248 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.4 CCOC1=CC=CN=C1Cl W17868 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [1,1,0,0,0,0|0,0,0]=2 421 B10R1.4 CNCC1=C(F)C=CC=N1 P10655 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.4 CNCC1=C(F)C=CC=N1 P20450 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.4 NC1=C(CCF)C=NC=C1 P14647 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.4 NCCN1C=CC=CC1=O F15207 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [1,1,0,0,0,0|2,0,0]=4 427 B10R1.4 O=C1C=CC=CN1CCBr AT19229 [1,1,0,0,0,0|1,0,1]=4 428 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [1,1,0,0,0,0|1,0,1]=4 429 B10R1.20 CCC1=CC=CN=C1C#N 50481 [1,1,0,0,0,0|2,0,0]=4 430 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.20 CNC1=C(OC)C=CC=N1 77471 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.20 CNC1=C(SC)C=CC=C1 AT20832 [1,1,0,0,0,0|1,1,0]=4 433 B10R1.20 COC1=C(CN)C=CN=C1 P16442 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.20 COC1=C(CN)N=CC=C1 O10088 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.20 COC1=C(CO)C=CN=C1 P11879 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.20 COC1=C(NN)C=CC=C1 71208 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.20 COC1=C(SC)C=CC=N1 F50798 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.20 COC1=CC=CN=C1CCl 27916 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.20 COC1=NC=CC=C1CN 36590 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [1,1,0,0,0,0|2,0,0]=4 444 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.25 CCC1=C(Br)C=C(Br)C=N1 F14393 [1,1,0,0,0,0|2,0,0]=4 450 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.25 CCN1C=CC(N)=CC1=O P12616 [1,1,0,0,0,0|1,0,1]=4 452 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [1,1,0,0,0,0|2,0,0]=4 454 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [1,1,0,0,0,0|1,0,0]=3 468 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.30 BrCC1=C(Br)C=CC(Br)=C1 68639 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 CL9154 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 CL9155 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.30 CC1=C(CBr)C=C(Cl)C=C1 73456 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.30 CC1=C(CO)C=C(O)C=C1 AC3540 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.30 CC1=CC(CBr)=C(F)C=C1 98276 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.30 CC1=CC(CO)=C(I)C=C1 H11526 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.30 CCC1=C(Br)C=NC(Cl)=C1 AT13829 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.30 CCC1=CC(Br)=NC=C1N 51679 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.30 CCN1C=C(N)C=CC1=O AT19278 [1,1,0,0,0,0|1,0,1]=4 481 B10R1.30 CNC1=C(F)C=CC(Br)=C1 AC3023 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C76710 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.30 CNC1=C(O)C=CC(C)=C1 C16345 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.30 COC1=C(S)C=CC(N)=C1 D87749 [1,1,0,0,0,0|1,1,0]=4 486 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 C13369 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.30 CSC1=C(N)C=CC(C)=C1 AT20827 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.30 NCC1=C(Br)C=CC(F)=C1 AC7757 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.30 NCC1=C(Br)C=CC(O)=C1 D88088 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.30 NCC1=C(F)C=CC(N)=C1 AC9197 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.30 NCC1=C(I)C=CC(Br)=C1 67324 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.30 NCC1=C(N)C=CC(Br)=C1 O10495 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.30 NCC1=C(N)C=CC(F)=C1 CK2412 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.30 NCC1=C(O)C=CC(Br)=C1 76231 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.30 NCC1=CC(Cl)=CN=C1O 79398 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.245 CC1=CC=CC(Br)=C1CO D96259 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.245 CC1=CC=CC(N)=C1CO AC6550 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.245 COC1=C(I)C=CC=C1Cl C90767 [1,1,0,0,0,0|2,0,0]=4 499 B10R1.245 COC1=C(O)C=CC=C1N AT15764 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.245 COC1=C(O)C=CN=C1F 91686 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.245 OCC1=C(Br)C=CC=C1Cl C91616 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.245 OCC1=C(Br)C=CC=C1O 75753 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.39 CC(C)C1=C(C#N)OC=C1 AT17435 [0,1,0,0,1,0|2,0,0]=4 504 B10R1.39 CC(C)C1=CON=C1CO AT19851 [0,1,0,0,1,0|2,0,0]=4 505 B10R1.65 CC(C)(C)N1N=CC=C1O AT14049 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.192 CC(C)N1C(=O)C=CC1=O S11238 [0,1,0,0,1,0|1,0,1]=4 507 B12R1.75 CC(C)OC1=C(CN)C=CC=C1 S10925 [0,1,0,0,0,1|1,0,0]=3 508 B12R1.75 CN(C)CC1=C(CN)C=CC=C1 C90142 [0,1,0,0,0,1|2,0,0]=4 509 B12R1.75 COC1=C(C[C@H](C)N)C=CC=C1 N11278 [0,1,0,0,0,1|1,0,0]=3 510 B12R1.75 COC1=C(C[C@H](C)N)C=CC=C1 N11279 [0,1,0,0,0,1|1,0,0]=3 511 B12R1.75 COC1=C(NC(C)=S)C=CC=C1 81285 [0,1,0,0,0,1|1,0,1]=4 512 B12R1.124 CC(C)C(=O)C1=C(Br)C=CC=C1 N13960 [0,1,0,0,0,1|1,0,0]=3 513 B12R1.124 CC(C)C(=O)C1=C(F)C=NC=C1 N14284 [0,1,0,0,0,1|2,0,0]=4 514 B12R1.124 CC(C)C(=O)C1=CC=CN=C1Br N14266 [0,1,0,0,0,1|2,0,0]=4 515 B12R1.124 CC(C)[C@H](N)C1=C(F)C=CC=C1 N13028 [0,1,0,0,0,1|1,0,0]=3 516 B12R1.124 CC(C)[C@H](N)C1=C(N)C=CC=C1 N13005 [0,1,0,0,0,1|1,0,0]=3 517 B12R1.124 CC(O)C(N)C1=C(Br)C=CC=C1 N15549 [0,1,0,0,0,1|2,0,0]=4 518 B12R1.124 CC(O)C(N)C1=C(Cl)C=CC=C1 N15543 [0,1,0,0,0,1|2,0,0]=4 519 B12R1.124 CC(O)C(N)C1=C(F)C=CC=C1 N15535 [0,1,0,0,0,1|2,0,0]=4 520 B12R1.124 CC(O)C(N)C1=C(O)C=CC=C1 N15626 [0,1,0,0,0,1|1,0,0]=3 521 B12R1.124 CC(O)[C@H](N)C1=C(Cl)C=CC=C1 N15541 [0,1,0,0,0,1|2,0,0]=4 522 B12R1.124 CC(O)[C@H](N)C1=C(F)C=CC=C1 N15534 [0,1,0,0,0,1|2,0,0]=4 523 B12R1.124 CC(O)[C@H](N)C1=C(O)C=CC=C1 N15627 [0,1,0,0,0,1|1,0,0]=3 524 B12R1.124 CC1=C(C(=O)C(C)C)C=CC=C1 N12569 [0,1,0,0,0,1|1,0,0]=3 525 B12R1.124 CC1=C(C(N)C(C)O)C=CC=C1 N15523 [0,1,0,0,0,1|2,0,0]=4 526 B12R1.124 CC1=C([C@@H](N)C(C)C)C=CC=C1 N12591 [0,1,0,0,0,1|1,0,0]=3 527 B12R1.124 CC1=C([C@@H](N)C(C)O)C=CC=C1 N15525 [0,1,0,0,0,1|2,0,0]=4 528 B12R1.124 CC1=C([C@@H](N)[C@@H](C)O)C=CC=C1 N15527 [0,1,0,0,0,1|2,0,0]=4 529 B12R1.124 CC1=C([C@@H](N)[C@@H](C)O)C=CC=C1 N15529 [0,1,0,0,0,1|2,0,0]=4 530 B12R1.124 CC1=C([C@@H](N)[C@H](C)O)C=CC=C1 N15526 [0,1,0,0,0,1|2,0,0]=4 531 B12R1.124 CC1=CC=CN=C1C(=O)C(C)C N12211 [0,1,0,0,0,1|2,0,0]=4 532 B12R1.124 CC1=CC=CN=C1[C@@H](N)C(C)C N13862 [0,1,0,0,0,1|2,0,0]=4 533 B12R1.124 CC1=CC=CN=C1[C@@H](N)C(C)C N13863 [0,1,0,0,0,1|2,0,0]=4 534 B12R1.124 CC1=CC=CN=C1[C@@H](N)C(C)C N13867 [0,1,0,0,0,1|2,0,0]=4 535 B12R1.124 CC1=CC=CN=C1[C@@H](N)C(C)C N13868 [0,1,0,0,0,1|2,0,0]=4 536 B12R1.124 CC1=CC=CN=C1[C@@H](N)C(C)C N13869 [0,1,0,0,0,1|2,0,0]=4 537 B12R1.124 CN(C)C(=O)C1=C(S)C=CC=C1 AC9832 [0,1,0,0,0,1|1,1,0]=4 538 B12R1.124 C[C@@H](O)[C@H](N)C1=C(Br)C=CC=C1 N15544 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.124 C[C@@H](O)[C@H](N)C1=C(Br)C=CC=C1 N15546 [0,1,0,0,0,1|2,0,0]=4 540 B12R1.124 C[C@@H](O)[C@H](N)C1=C(Cl)C=CC=C1 N15537 [0,1,0,0,0,1|2,0,0]=4 541 B12R1.124 C[C@@H](O)[C@H](N)C1=C(Cl)C=CC=C1 N15539 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.124 C[C@@H](O)[C@H](N)C1=C(F)C=CC=C1 N15530 [0,1,0,0,0,1|2,0,0]=4 543 B12R1.124 C[C@@H](O)[C@H](N)C1=C(F)C=CC=C1 N15532 [0,1,0,0,0,1|2,0,0]=4 544 B12R1.124 C[C@@H](O)[C@H](N)C1=C(N)C=CC=C1 N16152 [0,1,0,0,0,1|2,0,0]=4 545 B12R1.124 C[C@@H](O)[C@H](N)C1=C(N)C=CC=C1 N16154 [0,1,0,0,0,1|2,0,0]=4 546 B12R1.124 C[C@@H](O)[C@H](N)C1=C(O)C=CC=C1 N15629 [0,1,0,0,0,1|1,0,0]=3 547 B12R1.124 C[C@@H](O)[C@H](N)C1=C(O)C=CC=C1 N15631 [0,1,0,0,0,1|1,0,0]=3 548 B12R1.124 C[C@H](O)[C@H](N)C1=C(Br)C=CC=C1 N15548 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.124 C[C@H](O)[C@H](N)C1=C(Cl)C=CC=C1 N15538 [0,1,0,0,0,1|2,0,0]=4 550 B12R1.124 C[C@H](O)[C@H](N)C1=C(F)C=CC=C1 N15531 [0,1,0,0,0,1|2,0,0]=4 551 B12R1.124 C[C@H](O)[C@H](N)C1=C(N)C=CC=C1 N16153 [0,1,0,0,0,1|2,0,0]=4 552 B12R1.124 C[C@H](O)[C@H](N)C1=C(O)C=CC=C1 N15628 [0,1,0,0,0,1|1,0,0]=3 553 B12R1.127 CC(C)NC1=C(N)C=CC(Br)=C1 AC2781 [0,1,0,0,0,1|1,0,0]=3 554 B12R1.127 CC(C)OC1=C(N)C=CC(Br)=C1 53627 [0,1,0,0,0,1|1,0,0]=3 555 B12R1.127 CC(C)OC1=C(N)C=CC(Cl)=C1 95905 [0,1,0,0,0,1|1,0,0]=3 556 B12R1.127 CC1=CC=C(N)C(OC(C)C)=N1 AT20966 [0,1,0,0,0,1|2,0,0]=4 557 B12R1.127 CN(C)CC1=C(Cl)C=CC(Br)=C1 N11590 [0,1,0,0,0,1|2,0,0]=4 558 B12R1.127 CN(C)CC1=C(Cl)C=CC(N)=C1 AT11207 [0,1,0,0,0,1|2,0,0]=4 559 B12R1.127 CN(C)CC1=C(F)C=CC(Br)=C1 N10241 [0,1,0,0,0,1|2,0,0]=4 560 B12R1.127 C[C@H](N)CC1=C(F)C=CC(F)=C1 N11067 [0,1,0,0,0,1|2,0,0]=4 561 B12R1.151 CC(C)(C)SC1=C(N)N=CC=C1 38171 [0,1,0,0,0,1|2,0,0]=4 562 B12R1.151 CC(C)(O)CC1=C(Br)C=NC=C1 AT12939 [0,1,0,0,0,1|2,0,0]=4 563 B12R1.151 CC1=CC=CN=C1NC(C)(C)C 78293 [0,1,0,0,0,1|2,0,0]=4 564 B12R1.151 OC1=C(SC(F)(F)F)C=CC=C1 D76715 [0,1,0,0,0,1|2,0,0]=4 565 B12R1.151 [2H]C([2H])([2H])OC1=C(O)C=CC=C1 D99247 [0,1,0,0,0,1|2,0,0]=4 566 B12R1.224 CC(C)OC1=C(F)C(O)=CC=C1 AT21292 [0,1,0,0,0,1|1,0,0]=3 567 B12R1.224 CC1=C(Br)C=CC=C1NC(C)C 96869 [0,1,0,0,0,1|1,0,0]=3 568 B12R1.224 CC1=C(I)C=CN=C1OC(C)C 96429 [0,1,0,0,0,1|2,0,0]=4 569 B12R1.224 C[C@H](N)CC1=CC=CC(Cl)=C1Cl N11069 [0,1,0,0,0,1|2,0,0]=4 570 B12R1.233 CC(C)OC1=C(Br)C=C(Cl)C=C1 C91609 [0,1,0,0,0,1|1,0,0]=3 571 B12R1.233 CC(C)OC1=NC=C(Br)C=C1Cl W12587 [0,1,0,0,0,1|2,0,0]=4 572 B12R1.233 CC(C)OC1=NC=C(Cl)C=C1F W12585 [0,1,0,0,0,1|2,0,0]=4 573 B12R1.233 CN(C)CC1=C(F)C=C(Br)C=C1 N11554 [0,1,0,0,0,1|2,0,0]=4 574 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(Cl)C=C1 N11064 [0,1,0,0,0,1|2,0,0]=4 575 B12R1.233 C[C@H](N)CC1=C(Cl)C=C(F)C=C1 N11062 [0,1,0,0,0,1|2,0,0]=4 576 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 C78603 [0,1,0,0,0,1|2,0,0]=4 577 B12R1.371 CC1=C(C[C@H](N)CO)C=CC=C1 N11149 [0,1,0,0,0,1|2,0,0]=4 578 B12R1.371 CC1=C(O[C@@H](C)CN)C=CC=C1 F50684 [0,1,0,0,0,1|1,0,0]=3 579 B12R1.371 CC[C@H](N)CC1=C(Br)C=CC=C1 N14510 [0,1,0,0,0,1|2,0,0]=4 580 B12R1.371 CC[C@H](N)CC1=C(C)C=CC=C1 N14512 [0,1,0,0,0,1|2,0,0]=4 581 B12R1.371 CC[C@H](N)CC1=C(Cl)C=CC=C1 N14502 [0,1,0,0,0,1|2,0,0]=4 582 B12R1.371 CC[C@H](N)CC1=C(F)C=CC=C1 N14507 [0,1,0,0,0,1|2,0,0]=4 583 B12R1.371 NC[C@@H](N)CC1=C(F)C=CC=C1 N14640 [0,1,0,0,0,1|2,0,0]=4 584 B12R1.371 N[C@H](CO)CC1=C(Br)C=CC=C1 C77829 [0,1,0,0,0,1|2,0,0]=4 585 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11299 [0,1,0,0,0,1|2,0,0]=4 586 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 N11304 [0,1,0,0,0,1|2,0,0]=4 587 B12R1.371 N[C@H](CO)CC1=C(F)C=CC=C1 N11418 [0,1,0,0,0,1|2,0,0]=4 588 B12R1.1009 C[C@H](N)CC1=C(Cl)C=CC=C1Cl N11065 [0,1,0,0,0,1|2,0,0]=4 589 B12R1.46 CC(C)C1=C(C=O)C=CC(Br)=C1 97133 [0,2,0,0,0,0|0,0,1]=3 590 B12R1.46 COC1=C([C@H](C)N)C=C(C)C=C1 N12589 [0,2,0,0,0,0|1,0,0]=3 591 B12R1.46 COC1=C([C@H](C)O)C=C(Br)C=C1 W19098 [0,2,0,0,0,0|1,0,0]=3 592 B12R1.46 COC1=C([C@H](C)O)C=C(F)C=C1 70727 [0,2,0,0,0,0|1,0,0]=3 593 B12R1.46 COC1=NC=C(F)C=C1[C@H](C)N Y13430 [0,2,0,0,0,0|2,0,0]=4 594 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 W17789 [0,2,0,0,0,0|1,0,1]=4 595 B12R1.57 COC1=C(C(F)F)C=CC(Br)=C1 AC3396 [0,2,0,0,0,0|2,0,0]=4 596 B12R1.57 COC1=C([C@H](C)N)C=CC(F)=C1 N13112 [0,2,0,0,0,0|1,0,0]=3 597 B12R1.76 CC(C)(C)C1=C(C#N)C=NC=C1 AT18145 [0,2,0,0,0,0|2,0,0]=4 598 B12R1.76 CC(C)(C)C1=C(CN)C=NC=C1 AT18147 [0,2,0,0,0,0|2,0,0]=4 599 B12R1.76 CC(F)(F)C1=C(CN)C=CC=C1 AC4635 [0,2,0,0,0,0|2,0,0]=4 600 B12R1.76 [2H]C([2H])([2H])C1=C(OC)C=CC=C1 D99641 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.77 C#C[C@@H](O)C1=C(OC)C=CC=C1 AC4743 [0,2,0,0,0,0|1,0,1]=4 602 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15283 [0,2,0,0,0,0|1,0,1]=4 603 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15284 [0,2,0,0,0,0|1,0,1]=4 604 B12R1.77 C=C[C@H](N)C1=C(OC)C=CC=C1 N15285 [0,2,0,0,0,0|1,0,1]=4 605 B12R1.77 CCC1=C([C@@H](N)CN)C=CC=C1 N13458 [0,2,0,0,0,0|2,0,0]=4 606 B12R1.77 CCC1=C([C@@H](N)CN)C=CC=C1 N13459 [0,2,0,0,0,0|2,0,0]=4 607 B12R1.77 CCC1=C([C@@H](N)CN)C=CC=C1 N13460 [0,2,0,0,0,0|2,0,0]=4 608 B12R1.77 CC[C@H](N)C1=C(CO)C=CC=C1 Y13011 [0,2,0,0,0,0|1,0,0]=3 609 B12R1.77 CC[C@H](N)C1=C(OC)C=CC=N1 N14894 [0,2,0,0,0,0|2,0,0]=4 610 B12R1.77 CC[C@H](O)C1=C(OC)C=CC=C1 N14415 [0,2,0,0,0,0|1,0,0]=3 611 B12R1.77 COC1=C(C(=O)CN)C=CC=C1 C74781 [0,2,0,0,0,0|1,0,1]=4 612 B12R1.77 COC1=C(C(=O)CO)C=CC=C1 AC5663 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N12819 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13475 [0,2,0,0,0,0|1,0,0]=3 615 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13476 [0,2,0,0,0,0|1,0,0]=3 616 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13483 [0,2,0,0,0,0|1,0,0]=3 617 B12R1.77 COC1=C([C@@H](N)CN)C=CC=C1 N13484 [0,2,0,0,0,0|1,0,0]=3 618 B12R1.77 COC1=C([C@@H](N)CO)C=CC=C1 D81510 [0,2,0,0,0,0|1,0,0]=3 619 B12R1.77 COC1=C([C@@H](N)CO)N=CC=C1 N14895 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.77 COC1=C([C@@H](O)CO)C=CC=C1 W15251 [0,2,0,0,0,0|1,0,0]=3 621 B12R1.87 COC1=C(Br)C=CC=C1[C@H](C)O F50434 [0,2,0,0,0,0|1,0,0]=3 622 B12R1.261 CC(C)C1=C([C@H](C)N)C=CC=C1 N14848 [0,2,0,0,0,0|1,0,0]=3 623 B12R1.261 CN(C)C1=C(C(=O)O)C=NC=C1 D72071 [0,2,0,0,0,0|2,0,0]=4 624 B12R1.261 CN(C)C1=C(N(C)C)C=CC=C1 S11716 [0,2,0,0,0,0|2,0,0]=4 625 B12R1.261 C[C@H](O)C1=C(C(F)F)C=CC=C1 D77546 [0,2,0,0,0,0|2,0,0]=4 626 B12R1.283 CCOC1=C([C@H](C)N)C=CC=C1 N13079 [0,2,0,0,0,0|1,0,0]=3 627 B12R1.437 COC1=CC=CC(F)=C1[C@H](C)N D81661 [0,2,0,0,0,0|1,0,0]=3 628 B12R1.126 CC(C)(C)C1=C(O)C=C(O)C=C1 E10076 [0,2,0,0,0,0|0,0,0]=2 629 B12R1.126 CC(C)(O)C1=C(F)C=C(Br)C=C1 F52342 [0,2,0,0,0,0|1,0,0]=3 630 B12R1.128 CC(C)(C)C1=C(N)C=CC(I)=C1 F50691 [0,2,0,0,0,0|1,0,0]=3 631 B12R1.128 CC(C)(C)C1=C(O)C=CC(F)=C1 C91646 [0,2,0,0,0,0|0,0,0]=2 632 B12R1.128 CC(C)(C)C1=C(O)C=CC(I)=C1 AT24311 [0,2,0,0,0,0|0,0,0]=2 633 B12R1.128 CC(C)(O)C1=C(F)C=CC(Br)=C1 AT24369 [0,2,0,0,0,0|1,0,0]=3 634 B12R1.128 C[Si](C)(C)C1=CC(Br)=CN=C1O E71649 [0,2,0,0,0,0|1,1,0]=4 635 B12R1.195 CC1=C(C(C)(C)C#N)C=CC=C1 74577 [0,2,0,0,0,0|1,0,0]=3 636 B12R1.195 C[C@](N)(CO)C1=C(Cl)C=CC=C1 96073 [0,2,0,0,0,0|1,0,0]=3 637 B12R1.195 OCC(F)(F)C1=C(F)C=CC=C1 AC4058 [0,2,0,0,0,0|2,0,0]=4 638 B12R1.228 CC(C)(C)C1=CC=CC(O)=C1O W17828 [0,2,0,0,0,0|0,0,0]=2 639 B12R1.228 CC(C)(C)N1C=CC=C(N)C1=O AT19245 [0,2,0,0,0,0|1,0,1]=4 640 B12R1.1010 C[Si](C)(C)C1=C(Br)C=CC=C1F F18056 [0,2,0,0,0,0|1,1,0]=4 641 B12R1.1010 C[Si](C)(C)C1=C(Cl)C=CC=C1F F18485 [0,2,0,0,0,0|1,1,0]=4 642 B12R1.1010 C[Si](C)(C)C1=C(F)C=CC=C1F F18484 [0,2,0,0,0,0|1,1,0]=4 643 B12R1.1010 OC1=CC=CC(F)=C1C(F)(F)F C90758 [0,2,0,0,0,0|2,0,0]=4 644 B12R1.894 CC(=O)C1=C(O)C=CC(Cl)=C1O D75713 [0,2,0,0,0,0|1,0,1]=4 645 B12R1.1000 CC(=O)C1=C(Br)C=C(Br)C=C1O 93704 [0,2,0,0,0,0|1,0,1]=4 646 B12R1.1000 CC1=CC(Br)=CC(C)=C1N(C)C 76906 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.1000 CC1=CC(C)=C([C@H](C)N)C(C)=C1 E71773 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.1000 C[C@H](N)C1=C(F)C=C(F)C=C1F N13233 [0,2,0,0,0,0|2,0,0]=4 649 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CN N13772 [0,2,0,0,0,0|2,0,0]=4 650 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CN N13773 [0,2,0,0,0,0|2,0,0]=4 651 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CN N13774 [0,2,0,0,0,0|2,0,0]=4 652 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CN N13775 [0,2,0,0,0,0|2,0,0]=4 653 B12R1.3441 CC1=CC=CC(C)=C1[C@@H](N)CN N13776 [0,2,0,0,0,0|2,0,0]=4 654 B12R1.3441 CC1=CC=CC(F)=C1[C@@H](N)CN N13617 [0,2,0,0,0,0|2,0,0]=4 655 B12R1.3441 CC1=CC=CC(F)=C1[C@@H](N)CN N13618 [0,2,0,0,0,0|2,0,0]=4 656 B12R1.3441 CC1=CC=CC(F)=C1[C@@H](N)CN N13619 [0,2,0,0,0,0|2,0,0]=4 657 B12R1.3441 CC[C@H](N)C1=C(F)C=CC=C1F E71897 [0,2,0,0,0,0|2,0,0]=4 658 B12R1.3441 CC[C@H](O)C1=C(C)C=CC=C1C N14427 [0,2,0,0,0,0|2,0,0]=4 659 B12R1.3441 CC[C@H](O)C1=C(Cl)C=CC=C1Cl N12880 [0,2,0,0,0,0|2,0,0]=4 660 B12R1.3441 CC[C@H](O)C1=C(F)C=CC=C1F N14419 [0,2,0,0,0,0|2,0,0]=4 661 B12R1.3441 NC[C@H](N)C1=C(Br)C=CC=C1F N13614 [0,2,0,0,0,0|2,0,0]=4 662 B12R1.3441 NC[C@H](N)C1=C(Br)C=CC=C1F N13615 [0,2,0,0,0,0|2,0,0]=4 663 B12R1.3441 NC[C@H](N)C1=C(Br)C=CC=C1F N13616 [0,2,0,0,0,0|2,0,0]=4 664 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1Cl N13647 [0,2,0,0,0,0|2,0,0]=4 665 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1Cl N13649 [0,2,0,0,0,0|2,0,0]=4 666 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1Cl N13650 [0,2,0,0,0,0|2,0,0]=4 667 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1Cl N13651 [0,2,0,0,0,0|2,0,0]=4 668 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1F N13609 [0,2,0,0,0,0|2,0,0]=4 669 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1F N13610 [0,2,0,0,0,0|2,0,0]=4 670 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1F N13611 [0,2,0,0,0,0|2,0,0]=4 671 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1F N13612 [0,2,0,0,0,0|2,0,0]=4 672 B12R1.3441 NC[C@H](N)C1=C(Cl)C=CC=C1F N13613 [0,2,0,0,0,0|2,0,0]=4 673 B12R1.3441 NC[C@H](N)C1=C(F)C=CC=C1F N12940 [0,2,0,0,0,0|2,0,0]=4 674 B12R1.3441 NC[C@H](N)C1=C(F)C=CC=C1F N13604 [0,2,0,0,0,0|2,0,0]=4 675 B12R1.3441 NC[C@H](N)C1=C(F)C=CC=C1F N13607 [0,2,0,0,0,0|2,0,0]=4 676 B12R1.3441 NC[C@H](N)C1=C(F)C=CC=C1F N13608 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.24 CC1=CC=CC(C(=O)CCl)=C1O AC6764 [0,2,0,0,0,0|1,0,1]=4 678 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13711 [0,2,0,0,0,0|2,0,0]=4 679 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13712 [0,2,0,0,0,0|2,0,0]=4 680 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Br N13713 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13748 [0,2,0,0,0,0|2,0,0]=4 682 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13749 [0,2,0,0,0,0|2,0,0]=4 683 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13750 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13751 [0,2,0,0,0,0|2,0,0]=4 685 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1C N13752 [0,2,0,0,0,0|2,0,0]=4 686 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13574 [0,2,0,0,0,0|2,0,0]=4 687 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13575 [0,2,0,0,0,0|2,0,0]=4 688 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1Cl N13576 [0,2,0,0,0,0|2,0,0]=4 689 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13535 [0,2,0,0,0,0|2,0,0]=4 690 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13536 [0,2,0,0,0,0|2,0,0]=4 691 B12R1.24 CC1=CC=CC([C@@H](N)CN)=C1F N13537 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.24 CCC(=O)C1=CC=CC(Cl)=C1O P17540 [0,2,0,0,0,0|1,0,1]=4 693 B12R1.24 CC[C@H](N)C1=C(C)C(C)=CC=C1 N11288 [0,2,0,0,0,0|2,0,0]=4 694 B12R1.24 CC[C@H](N)C1=CC=CC(F)=C1F N11377 [0,2,0,0,0,0|2,0,0]=4 695 B12R1.24 CC[C@H](O)C1=C(C)C(C)=CC=C1 N14424 [0,2,0,0,0,0|2,0,0]=4 696 B12R1.24 CC[C@H](O)C1=CC=CC(Cl)=C1Cl N14420 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.24 CC[C@H](O)C1=CC=CC(F)=C1F N14417 [0,2,0,0,0,0|2,0,0]=4 698 B12R1.24 CNC(=O)C1=C(O)C(N)=CC=C1 F19753 [0,2,0,0,0,0|1,0,1]=4 699 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13532 [0,2,0,0,0,0|2,0,0]=4 700 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13533 [0,2,0,0,0,0|2,0,0]=4 701 B12R1.24 NC[C@H](N)C1=CC=CC(Br)=C1F N13534 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13571 [0,2,0,0,0,0|2,0,0]=4 703 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13572 [0,2,0,0,0,0|2,0,0]=4 704 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1Cl N13573 [0,2,0,0,0,0|2,0,0]=4 705 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13525 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13528 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13529 [0,2,0,0,0,0|2,0,0]=4 708 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13530 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.24 NC[C@H](N)C1=CC=CC(Cl)=C1F N13531 [0,2,0,0,0,0|2,0,0]=4 710 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13568 [0,2,0,0,0,0|2,0,0]=4 711 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13569 [0,2,0,0,0,0|2,0,0]=4 712 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1Cl N13570 [0,2,0,0,0,0|2,0,0]=4 713 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13522 [0,2,0,0,0,0|2,0,0]=4 714 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13523 [0,2,0,0,0,0|2,0,0]=4 715 B12R1.24 NC[C@H](N)C1=CC=CC(F)=C1F N13524 [0,2,0,0,0,0|2,0,0]=4 716 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1Cl N12765 [0,2,0,0,0,0|2,0,0]=4 717 B12R1.24 N[C@@H](CO)C1=CC=CC(Cl)=C1F N13062 [0,2,0,0,0,0|2,0,0]=4 718 B12R1.24 O=C(CBr)C1=C(O)C(F)=CC=C1 F13388 [0,2,0,0,0,0|1,0,1]=4 719 B12R1.440 CC(C)C1=CC=CC(C=O)=C1N C72170 [0,2,0,0,0,0|1,0,0]=3 720 B12R1.440 COC1=C(F)C([C@H](C)O)=CC=C1 57985 [0,2,0,0,0,0|2,0,0]=4 721 B12R1.511 CC(=O)C1=CC(Br)=CC(F)=C1O AT14690 [0,2,0,0,0,0|1,0,1]=4 722 B12R1.511 CC(=O)C1=CC(C)=CC(Br)=C1O F50433 [0,2,0,0,0,0|1,0,1]=4 723 B12R1.511 CC1=CC(Br)=NC(C(C)C)=C1N AT11118 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.511 CC1=CC(C(C)C)=C(C)C(Cl)=N1 D81610 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.511 CC1=CC(I)=CC(C(C)C)=C1N AT11104 [0,2,0,0,0,0|1,0,0]=3 726 B12R1.511 CN(C)C1=CC(Br)=CC(F)=C1F N10333 [0,2,0,0,0,0|2,0,0]=4 727 B12R1.232 CC(=O)C1=CC(Cl)=C(F)C=C1O P18161 [0,2,0,0,0,0|1,0,1]=4 728 B12R1.232 CC(=O)C1=CC(Cl)=C(O)C=C1O AT18320 [0,2,0,0,0,0|1,0,1]=4 729 B12R1.232 CC(=O)C1=CC(F)=C(O)C=C1O AT18317 [0,2,0,0,0,0|1,0,1]=4 730 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94484 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.232 C[C@H](N)C1=CC(Cl)=C(F)C=C1F 94485 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.452 CN(C)C1=C(Cl)C=C(C=O)C=C1 AT16362 [0,2,0,0,0,0|2,0,0]=4 733 B12R1.452 COC1=CC(Br)=C(C(C)C)C=C1 E71918 [0,2,0,0,0,0|1,0,0]=3 734 B12R1.452 COC1=CC(F)=C(C(C)C)C=C1 P10295 [0,2,0,0,0,0|1,0,0]=3 735 B12R1.452 C[C@H](N)C1=C(F)C=C(CO)C=C1 N14658 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13753 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13754 [0,2,0,0,0,0|2,0,0]=4 738 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13755 [0,2,0,0,0,0|2,0,0]=4 739 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13768 [0,2,0,0,0,0|2,0,0]=4 740 B12R1.1703 CC1=CC(C)=C([C@@H](N)CN)C=C1 N13769 [0,2,0,0,0,0|2,0,0]=4 741 B12R1.1703 CC1=CC(C)=C([C@@H](O)CN)C=C1 C77862 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13631 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13632 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.1703 CC1=CC(Cl)=C([C@@H](N)CN)C=C1 N13633 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13557 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13558 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.1703 CC1=CC(F)=C([C@@H](N)CN)C=C1 N13559 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.1703 CCC(=O)C1=C(O)C=C(Cl)C=C1 98266 [0,2,0,0,0,0|1,0,1]=4 749 B12R1.1703 CC[C@H](N)C1=C(C)C=C(C)C=C1 N12160 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N10945 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.1703 CC[C@H](N)C1=C(F)C=C(F)C=C1 N11162 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.1703 CC[C@H](O)C1=C(C)C=C(C)C=C1 N14425 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.1703 CC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 N14422 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.1703 CC[C@H](O)C1=C(F)C=C(Br)C=C1 97337 [0,2,0,0,0,0|2,0,0]=4 755 B12R1.1703 CC[C@H](O)C1=C(F)C=C(F)C=C1 N12683 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14215 [0,2,0,0,0,0|1,0,0]=3 757 B12R1.1703 CN[C@@H](C)C1=C(F)C=C(F)C=C1 N14216 [0,2,0,0,0,0|1,0,0]=3 758 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13628 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13629 [0,2,0,0,0,0|2,0,0]=4 760 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Br)C=C1 N13630 [0,2,0,0,0,0|2,0,0]=4 761 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13577 [0,2,0,0,0,0|2,0,0]=4 762 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13578 [0,2,0,0,0,0|2,0,0]=4 763 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13579 [0,2,0,0,0,0|2,0,0]=4 764 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(Cl)C=C1 N13580 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13581 [0,2,0,0,0,0|2,0,0]=4 766 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13582 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13583 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13585 [0,2,0,0,0,0|2,0,0]=4 769 B12R1.1703 NC[C@H](N)C1=C(Cl)C=C(F)C=C1 N13586 [0,2,0,0,0,0|2,0,0]=4 770 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13552 [0,2,0,0,0,0|2,0,0]=4 771 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13553 [0,2,0,0,0,0|2,0,0]=4 772 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13554 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13555 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Br)C=C1 N13556 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13549 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13550 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.1703 NC[C@H](N)C1=C(F)C=C(Cl)C=C1 N13551 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13546 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13547 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.1703 NC[C@H](N)C1=C(F)C=C(F)C=C1 N13548 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.1703 NC[C@H](O)C1=C(Cl)C=C(Cl)C=C1 C78542 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.1703 NC[C@H](O)C1=C(F)C=C(F)C=C1 C78271 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10628 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.1703 N[C@@H](CO)C1=C(Br)C=C(F)C=C1 AT10637 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.1703 O=C(CCl)C1=C(O)C=C(F)C=C1 AC4164 [0,2,0,0,0,0|1,0,1]=4 786 B12R1.1703 O[C@@H](CBr)C1=C(Cl)C=C(Cl)C=C1 11639 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13759 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13760 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13761 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13765 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13766 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.354 CC1=CC([C@@H](N)CN)=C(C)C=C1 N13767 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13640 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13641 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.354 CC1=CC([C@@H](N)CN)=C(Cl)C=C1 N13642 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13595 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13596 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.354 CC1=CC([C@@H](N)CN)=C(F)C=C1 N13597 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 N11165 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 N12908 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.354 CC[C@H](N)C1=C(O)C=CC(C)=C1 N14793 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.354 CC[C@H](O)C1=C(C)C=CC(C)=C1 N14426 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.354 CC[C@H](O)C1=C(F)C=CC(F)=C1 N14418 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.354 CN[C@@H](C)C1=C(O)C=CC(F)=C1 F30064 [0,2,0,0,0,0|0,0,0]=2 805 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13699 [0,2,0,0,0,0|2,0,0]=4 806 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13700 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Br)=C1 N13701 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13696 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13697 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.354 NC[C@H](N)C1=C(Cl)C=CC(Cl)=C1 N13698 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Br)=C1 N13593 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Br)=C1 N13594 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13590 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13591 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.354 NC[C@H](N)C1=C(F)C=CC(Cl)=C1 N13592 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13584 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13587 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13588 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.354 NC[C@H](N)C1=C(F)C=CC(F)=C1 N13589 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.354 NC[C@H](O)C1=C(F)C=CC(F)=C1 C77859 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.354 N[C@@H](CO)C1=C(F)C=CC(F)=C1 N12983 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.453 CC(=O)C1=C(O)C=CC(CCl)=C1 F13165 [0,2,0,0,0,0|1,0,1]=4 823 B12R1.453 CC(=O)C1=C(O)C=CC(CO)=C1 F13145 [0,2,0,0,0,0|1,0,1]=4 824 B12R1.453 CC(C)C1=C(N)C=CC(C#N)=C1 C90774 [0,2,0,0,0,0|1,0,0]=3 825 B12R1.453 COC1=CC([C@H](C)N)=C(F)C=C1 57899 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.453 COC1=CC([C@H](C)N)=C(F)C=C1 57900 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.453 COC1=CC([C@H](C)N)=C(O)C=C1 N12705 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.453 COC1=CC([C@H](C)N)=C(O)C=C1 N14812 [0,2,0,0,0,0|1,0,0]=3 829 B12R1.243 CN[C@@H](CO)C1=C(C)C=CC=C1 N12799 [0,2,0,0,0,0|1,0,0]=3 830 B12R1.308 C=CC[C@H](O)C1=C(Cl)C=CC=C1 F14511 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.308 N[C@@H](CCO)C1=C(Br)C=CC=C1 N13027 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.308 N[C@@H](CCO)C1=C(Cl)C=CC=C1 58181 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.308 N[C@@H](CCO)C1=C(F)C=CC=C1 N10902 [0,2,0,0,0,0|2,0,0]=4 834 B10R1.23 CC(C)[C@H](N)C1=CC=CO1 N16714 [0,0,1,1,0,0|1,0,1]=4 835 B10R2.6 C1=CC(C2CC2)=CC=N1 59829 [1,0,0,1,0,0|1,0,0]=3 836 B10R2.6 C1=CN=C(C2CC2)N=C1 P12514 [1,0,0,1,0,0|2,0,0]=4 837 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [1,0,0,1,0,0|1,0,0]=3 838 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [1,0,0,1,0,0|1,0,0]=3 839 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [1,0,0,1,0,0|1,1,0]=4 840 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [1,0,0,1,0,0|2,0,0]=4 841 B12R2.24 Br[C@H]1CCC2=C(C=CC=C2)C1 F13406 [0,0,0,1,0,1|2,0,0]=4 842 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)C1 F50994 [0,0,0,1,0,1|1,0,0]=3 843 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 12711 [0,0,0,1,0,1|2,0,0]=4 844 B12R2.24 C[C@H]1CC2=C(C=CC=C2)CN1 C74526 [0,0,0,1,0,1|2,0,0]=4 845 B12R2.24 C[C@H]1CNC2=C(C=CN=C2)O1 AT21909 [0,0,0,1,0,1|2,0,0]=4 846 B12R2.24 C[C@H]1CSC2=C(C=CC=C2)N1 W10084 [0,0,0,1,0,1|0,1,0]=3 847 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 F20762 [0,0,0,1,0,1|1,0,0]=3 848 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F13193 [0,0,0,1,0,1|2,0,0]=4 849 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18883 [0,0,0,1,0,1|2,0,0]=4 850 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 F18889 [0,0,0,1,0,1|2,0,0]=4 851 B12R2.24 O=C1COC2=C(C=CC=C2)C1 F53084 [0,0,0,1,0,1|1,0,1]=4 852 B12R2.225 BrC1=C(NC2CC2)C=CC=C1 AT17125 [0,0,0,1,0,1|1,0,0]=3 853 B12R2.225 BrC1=C(SC2CC2)C=CC=C1 AT20841 [0,0,0,1,0,1|1,0,0]=3 854 B12R2.225 FC1=C(OC2CC2)C=CC=C1 AT21296 [0,0,0,1,0,1|1,0,0]=3 855 B12R2.225 IC1=C(OC2CC2)C=CC=C1 F53780 [0,0,0,1,0,1|1,0,0]=3 856 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 71815 [0,1,0,1,0,0|1,0,0]=3 857 B12R2.1081 Cl[C@H]1CCCC2=C1C=CC=C2 A11734 [0,1,0,1,0,0|2,0,0]=4 858 B12R2.1081 N[C@H]1CCOC2=C1N=CC=C2 E71333 [0,1,0,1,0,0|2,0,0]=4 859 B12R2.1081 N[C@H]1CSCC2=C1C=CC=C2 SC2891 [0,1,0,1,0,0|1,1,0]=4 860 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 95583 [0,1,0,1,0,0|2,0,0]=4 861 B12R2.1081 O[C@H]1CNCC2=C1C=CC=C2 F13197 [0,1,0,1,0,0|2,0,0]=4 862 B12R2.2028 O=C1C[C@H](O)C2=C1C=CC=C2 93243 [0,1,0,1,0,0|1,0,1]=4 863 B12R2.2048 COC1=C(C2CC2)C=CC=C1 AC8615 [0,1,0,1,0,0|0,0,0]=2 864 B12R2.2048 N#CC1=C(C2CC2)N=CC=C1 AC8862 [0,1,0,1,0,0|2,0,0]=4 865 B12R2.2048 NCC1=C(C2CC2)C=CC=C1 26242 [0,1,0,1,0,0|1,0,0]=3 866 B12R2.2048 NCC1=NC=CC=C1C2CC2 C91069 [0,1,0,1,0,0|2,0,0]=4 867 B12R2.2048 SCC1=C(C2CC2)C=CC=C1 AT13698 [0,1,0,1,0,0|0,1,0]=3 868 B12R2.2403 CC1(C)CNC2=CC=CN=C21 85485 [0,1,0,1,0,0|2,0,0]=4 869 B12R2.88 C[C@@]1(C2=C(Cl)C=CC=C2)CO1 C11096 [0,1,0,1,0,0|1,0,0]=3 870 B12R2.88 NC1(C2=C(Cl)C=CC=C2)CC1 28118 [0,1,0,1,0,0|1,0,0]=3 871 B12R2.88 NC1(C2=C(Cl)C=CC=C2)CC1 32750 [0,1,0,1,0,0|1,0,0]=3 872 B12R2.88 OC1(C2=C(Br)C=CC=C2)CC1 AT23530 [0,1,0,1,0,0|1,0,0]=3 873 B12R2.203 CC1=COC2=CC=CC(Br)=C12 F30977 [0,1,0,1,0,0|0,0,2]=4 874 B12R2.203 CC1=NNC2=CC=CC(O)=C21 F17559 [0,1,0,1,0,0|1,0,1]=4 875 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 Y12096 [0,1,0,1,0,0|2,0,0]=4 876 B12R2.203 N[C@H]1COC2=CC=CC(Br)=C21 N11252 [0,1,0,1,0,0|1,0,0]=3 877 B12R2.203 N[C@H]1COC2=CC=CC(Br)=C21 N11253 [0,1,0,1,0,0|1,0,0]=3 878 B12R2.203 N[C@H]1COC2=CC=CC(Cl)=C21 N11259 [0,1,0,1,0,0|1,0,0]=3 879 B12R2.203 N[C@H]1COC2=CC=CC(Cl)=C21 N16516 [0,1,0,1,0,0|1,0,0]=3 880 B12R2.203 O=C1COC2=CC=CC(Cl)=C12 AT10336 [0,1,0,1,0,0|1,0,1]=4 881 B12R2.203 O[C@H]1CSC2=CC=CC(Br)=C21 D76237 [0,1,0,1,0,0|1,1,0]=4 882 B12R2.240 CC1=CC=CC(C)=C1C2CC2 AC8319 [0,1,0,1,0,0|1,0,0]=3 883 B12R2.240 ClC1=CC=CC(Cl)=C1C2CC2 AC8509 [0,1,0,1,0,0|1,0,0]=3 884 B12R2.240 FC1=CN=CC(Br)=C1C2CC2 81975 [0,1,0,1,0,0|2,0,0]=4 885 B12R2.81 CC1=C(Br)C=NC=C1C2CC2 81977 [0,1,0,1,0,0|2,0,0]=4 886 B12R2.81 CC1=C(N)C(C2CC2)=NC=C1 60025 [0,1,0,1,0,0|2,0,0]=4 887 B12R2.81 FC1=C(Cl)C=CC=C1C2CC2 AC9620 [0,1,0,1,0,0|1,0,0]=3 888 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N11245 [0,1,0,1,0,0|1,0,0]=3 889 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N16519 [0,1,0,1,0,0|1,0,0]=3 890 B12R2.196 CC1=C2OC[C@H](N)C2=CC=C1 N16520 [0,1,0,1,0,0|1,0,0]=3 891 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10987 [0,1,0,1,0,0|2,0,0]=4 892 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10988 [0,1,0,1,0,0|2,0,0]=4 893 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N10989 [0,1,0,1,0,0|2,0,0]=4 894 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N N12838 [0,1,0,1,0,0|2,0,0]=4 895 B12R2.196 CC1=CC=CC2=C1OCC2=O 32296 [0,1,0,1,0,0|1,0,1]=4 896 B12R2.196 CC1=COC2=C(Br)C=CC=C12 76397 [0,1,0,1,0,0|0,0,2]=4 897 B12R2.196 CN1CCC2=C1C=CC=C2N AC8036 [0,1,0,1,0,0|2,0,0]=4 898 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 Y11667 [0,1,0,1,0,0|2,0,0]=4 899 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 F16929 [0,1,0,1,0,0|2,0,0]=4 900 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 N10489 [0,1,0,1,0,0|2,0,0]=4 901 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 F16955 [0,1,0,1,0,0|1,0,0]=3 902 B12R2.196 N[C@H]1COC2=C(Br)C=CC=C21 F17000 [0,1,0,1,0,0|1,0,0]=3 903 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 59816 [0,1,0,1,0,0|1,0,0]=3 904 B12R2.196 N[C@H]1COC2=C(Cl)C=CC=C21 F16958 [0,1,0,1,0,0|1,0,0]=3 905 B12R2.196 N[C@H]1COC2=C(F)C=CC=C21 D81329 [0,1,0,1,0,0|1,0,0]=3 906 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 N10840 [0,1,0,1,0,0|2,0,0]=4 907 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N11326 [0,1,0,1,0,0|1,0,0]=3 908 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16521 [0,1,0,1,0,0|1,0,0]=3 909 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CO2 N16523 [0,1,0,1,0,0|1,0,0]=3 910 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 V10221 [0,1,0,1,0,0|0,0,2]=4 911 B12R2.612 ClC1=CC2=C(C=C1)[C@@H](Br)CC2 AT21847 [0,1,0,1,0,0|2,0,0]=4 912 B12R2.612 Cl[C@H]1CCC2=C1C=CC(Br)=C2 O11349 [0,1,0,1,0,0|2,0,0]=4 913 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14630 [0,1,0,1,0,0|1,0,0]=3 914 B12R2.612 NC1=CC2=C(C=C1)[C@@H](N)CO2 N14631 [0,1,0,1,0,0|1,0,0]=3 915 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 69968 [0,1,0,1,0,0|2,0,0]=4 916 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F16940 [0,1,0,1,0,0|2,0,0]=4 917 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 Y11252 [0,1,0,1,0,0|2,0,0]=4 918 B12R2.612 N[C@H]1COC2=C1C=CC(Br)=C2 N11256 [0,1,0,1,0,0|1,0,0]=3 919 B12R2.612 O[C@H]1COC2=C1C=CC(Cl)=C2 AT21520 [0,1,0,1,0,0|1,0,0]=3 920 B12R2.1317 CC1=CC(C)=C(C2CC2)C=C1 AC9569 [0,1,0,1,0,0|1,0,0]=3 921 B12R2.1317 FC1=CC(F)=C(C2CC2)C=C1 AC9452 [0,1,0,1,0,0|1,0,0]=3 922 B12R2.1317 NC1=C(C2CC2)C=CC(Cl)=C1 AC9037 [0,1,0,1,0,0|1,0,0]=3 923 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N N10962 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.132 CC1=CC2=C(C=C1)CC[C@@H]2N W12236 [0,1,0,1,0,0|2,0,0]=4 925 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16524 [0,1,0,1,0,0|1,0,0]=3 926 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16525 [0,1,0,1,0,0|1,0,0]=3 927 B12R2.132 CC1=CC2=C(C=C1)OC[C@@H]2N N16526 [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|1,0,1]=4 929 B12R2.132 NC1=CC2=C(C=C1)OC[C@@H]2N N14632 [0,1,0,1,0,0|1,0,0]=3 930 B12R2.132 NC1=CC2=C(C=C1)OC[C@@H]2N N14633 [0,1,0,1,0,0|1,0,0]=3 931 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F16937 [0,1,0,1,0,0|2,0,0]=4 932 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 41007 [0,1,0,1,0,0|2,0,0]=4 933 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 N11239 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.132 N[C@H]1COC2=C1C=C(Br)C=C2 N16518 [0,1,0,1,0,0|1,0,0]=3 935 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 52525 [0,1,0,1,0,0|1,0,0]=3 936 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N16514 [0,1,0,1,0,0|1,0,0]=3 937 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 N16515 [0,1,0,1,0,0|1,0,0]=3 938 B12R2.132 N[C@H]1COC2=C1C=C(F)C=C2 N11261 [0,1,0,1,0,0|1,0,0]=3 939 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 52578 [0,1,0,1,0,0|1,0,1]=4 940 B12R2.132 O[C@H]1COC2=C1C=C(Br)C=C2 AT23850 [0,1,0,1,0,0|1,0,0]=3 941 B12R2.1316 CC1=C(C2CC2)C=C(N)C=C1 AC9568 [0,1,0,1,0,0|1,0,0]=3 942 B12R2.1316 CC1=CC(C2CC2)=C(C)C=C1 AC9678 [0,1,0,1,0,0|1,0,0]=3 943 B12R2.1316 FC1=C(C2CC2)C=C(Cl)C=C1 AC8512 [0,1,0,1,0,0|1,0,0]=3 944 B12R2.1316 NC1=C(C2CC2)C=C(F)C=C1 AC3387 [0,1,0,1,0,0|1,0,0]=3 945 B12R2.1316 O=C1C=CC(Br)=CN1C2CC2 AC3153 [0,1,0,1,0,0|1,0,1]=4 946 B12R2.1316 OC1=C(C2CC2)C=C(Br)C=C1 97770 [0,1,0,1,0,0|0,0,0]=2 947 B12R2.1 CN[C@H]1CCC2=C1C=CC=C2 AT22267 [0,1,0,1,0,0|1,0,0]=3 948 B12R2.1 ClCC1=COC2=C1C=CC=C2 C76142 [0,1,0,1,0,0|0,0,2]=4 949 B12R2.1 N#C[C@H]1CCC2=C1C=CC=C2 81813 [0,1,0,1,0,0|1,0,1]=4 950 B12R2.1 NCC1=COC2=C1C=CC=C2 AC4652 [0,1,0,1,0,0|0,0,2]=4 951 B12R2.1 NC[C@H]1CCC2=C1C=CC=C2 20176 [0,1,0,1,0,0|1,0,0]=3 952 B12R2.1 NC[C@H]1CCC2=CC=CN=C21 C77541 [0,1,0,1,0,0|2,0,0]=4 953 B12R2.1 NC[C@H]1CNC2=C1C=CC=C2 AC7339 [0,1,0,1,0,0|1,0,0]=3 954 B12R2.1 O=C[C@@H]1CCC2=C1C=CC=C2 D78606 [0,1,0,1,0,0|1,0,1]=4 955 B12R2.1 OCC1=COC2=C1C=CC=C2 AC6184 [0,1,0,1,0,0|0,0,2]=4 956 B12R2.1 OC[C@H]1CCC2=C1C=CC=C2 AC3163 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.517 BrC1=C(C2CNC2)C=CC=C1 85614 [0,1,0,1,0,0|1,0,0]=3 958 B12R2.517 BrC1=C([C@@H]2CCO2)C=CN=C1 66051 [0,1,0,1,0,0|2,0,0]=4 959 B12R2.517 FC1=C(C2CNC2)C=CC=C1 85610 [0,1,0,1,0,0|1,0,0]=3 960 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 F51253 [0,0,0,2,0,0|2,0,0]=4 961 B8R1.7 C[C@H](N)C1=CC=CO1 74860 [1,0,0,0,1,0|2,0,0]=4 962 B8R1.7 C[C@H](N)C1=CC=CO1 F16901 [1,0,0,0,1,0|2,0,0]=4 963 B8R1.7 C[C@H](N)C1=CC=CO1 N12744 [1,0,0,0,1,0|2,0,0]=4 964 B8R1.7 C[C@H](N)C1=COC=C1 AT17538 [1,0,0,0,1,0|2,0,0]=4 965 B8R1.7 C[C@H](N)C1=COC=C1 N16718 [1,0,0,0,1,0|2,0,0]=4 966 B8R1.7 C[C@H](N)C1=CSC=C1 27875 [1,0,0,0,1,0|2,0,0]=4 967 B8R1.7 C[C@H](O)C1=CC=CS1 71923 [1,0,0,0,1,0|2,0,0]=4 968 B8R1.7 C[C@H](O)C1=CC=CS1 AT16382 [1,0,0,0,1,0|2,0,0]=4 969 B8R1.7 C[C@H](O)C1=CC=CS1 AT16384 [1,0,0,0,1,0|2,0,0]=4 970 B8R1.7 C[C@H](O)C1=COC=C1 AT17475 [1,0,0,0,1,0|2,0,0]=4 971 B8R1.7 C[C@H](O)C1=COC=C1 AT17477 [1,0,0,0,1,0|2,0,0]=4 972 B8R1.11 CCN1N=CC=C1O AT14056 [1,0,0,0,1,0|2,0,0]=4 973 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 C78572 [0,0,0,0,0,2|1,0,0]=3 974 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 C78237 [0,0,0,0,0,2|1,0,0]=3 975 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 C78588 [0,0,0,0,0,2|1,0,0]=3 976 B12R1.125 CC(C)OCC1=C(Br)C=CC=C1 N10193 [0,0,0,0,0,2|1,0,0]=3