0 B10R1.3 C#CC1=CC=C(CN)C=C1 A50671 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.3 C=CC1=CC=C(C#N)C=C1 D76989 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.3 C=CC1=CN=C(OC)C=C1 P11583 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.3 CCC1=CN=C(C=O)C=C1 C74094 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.3 CCC1=CN=C(CCl)C=C1 94422 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.3 CCC1=CN=C(CO)C=C1 94421 [0,0,0,0,0,0|1,0,2]=3 6 B10R1.3 CCC1=NC=C(CN)C=N1 81406 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.3 CNC1=CC=C(CN)C=C1 A10200 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.3 CNC1=CC=C(SC)C=C1 AT20959 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.3 CNC1=NC=C(C=O)C=N1 I11675 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.3 COC1=CN=C(CBr)C=C1 O10507 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.3 COC1=CN=C(NN)C=C1 W15208 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.3 COC1=NC=C(CBr)C=C1 26302 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.3 COC1=NC=C(SC)C=C1 F50803 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.3 CSC1=NC=C(C=O)C=C1 54709 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.3 N#CC1=NC=C(CN)C=C1 20809 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.3 N#CC1=NC=C(CN)C=C1 AT18624 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.3 N#CC1=NC=C(CO)C=C1 87746 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.3 NCC1=CC=C(C=O)C=C1 N13169 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.3 OCC1=CN=C(CO)C=C1 AC5585 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 AT23890 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.1 C=CC1=CN=C(C)N=C1 P14948 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.1 C=CC1=CN=C(F)C=C1 79557 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.1 CC1=NC=C(NN)C=C1 P10368 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [1,0,0,0,0,0|1,1,0]=3 27 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.1 COC1=CN=C(I)C=C1 F17075 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.1 COC1=NNC(=O)C=C1 AT17771 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [1,0,0,0,0,0|1,1,0]=3 39 B9R1.1 NCC1=NC=C(F)C=C1 83593 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.1 O=CC1=CN=C(Br)N=C1 55465 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.1 O=CC1=CN=C(F)C=N1 P15039 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.1 O=CC1=NC=C(Br)C=N1 38375 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 D87575 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.3 CC(C)C1=CC=C(CS)C=C1 AT13687 [0,1,0,0,0,0|0,1,1]=3 48 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 F13708 [0,1,0,0,0,0|0,1,0]=2 49 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 N12206 [0,1,0,0,0,0|1,0,1]=3 50 B11R1.3 CCC1=NC=C(C(C)=O)C=C1 P12273 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.3 CNC1=CC=C(B(O)O)C=C1 N10060 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.3 CNC1=CN=C(C(=O)O)C=C1 AT13629 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.3 CNC1=NN=C(C(=O)O)C=C1 AC2109 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.3 COC1=CN=C(C(C)=O)C=C1 P10973 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.3 COC1=CN=C(C(N)=O)C=C1 D74451 [0,1,0,0,0,0|2,0,0]=3 56 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90819 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 90820 [0,1,0,0,0,0|3,0,0]=4 58 B11R1.3 COC1=CN=C([N+](=O)[O-])C=C1 N10328 [0,1,0,0,0,0|3,0,0]=4 59 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 90831 [0,1,0,0,0,0|3,0,0]=4 60 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 N11219 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 D76956 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.3 CSC1=CC=C([C@H](C)N)C=C1 N10959 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20981 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.3 CSC1=CC=C([C@H](C)O)C=C1 AT20982 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 F16855 [0,1,0,0,0,0|1,0,1]=3 66 B11R1.3 C[C@H](N)C1=CC=C(CCl)C=C1 96061 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.3 C[C@H](O)C1=CC=C(C#N)C=C1 C13987 [0,1,0,0,0,0|1,0,1]=3 68 B11R1.3 N#[N+]C1=CC=C(C(=O)O)C=C1 A11547 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 10001 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.3 O=CC1=CC=C(C(F)F)C=C1 C91393 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.3 O=CC1=CN=C(B(O)O)C=C1 AT15861 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.3 O=CC1=CN=C(C(=O)O)C=C1 N13056 [0,1,0,0,0,0|2,0,1]=4 73 B11R1.3 O=CC1=NC=C(B(O)O)C=C1 94215 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.3 O=[N+]([O-])C1=CN=C(CBr)C=C1 D72031 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.3 OCC1=CC=C(C(F)F)C=C1 AT10625 [0,1,0,0,0,0|1,0,2]=4 76 B11R1.3 [2H]C(=O)C1=CC=C(OC)C=C1 D98577 [0,1,0,0,0,0|1,0,0]=2 77 B11R1.83 C=CC1=CC=C(CCCl)C=C1 AC7198 [0,1,0,0,0,0|1,0,0]=2 78 B11R1.83 C=CC1=CC=C(CCO)C=C1 AC6179 [0,1,0,0,0,0|1,0,0]=2 79 B11R1.83 CCCC1=CC=C(CBr)C=C1 C13395 [0,1,0,0,0,0|1,0,1]=3 80 B11R1.83 CCNC1=NC=C(C#N)C=C1 88568 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.83 CCOC1=CC=C(CCl)C=C1 60965 [0,1,0,0,0,0|1,0,1]=3 82 B11R1.83 CCOC1=CN=C(CO)C=C1 CL0296 [0,1,0,0,0,0|1,0,2]=4 83 B11R1.83 CCSC1=CC=C(CN)C=C1 AT20991 [0,1,0,0,0,0|1,0,1]=3 84 B11R1.83 CCSC1=CN=C(C#N)C=C1 58222 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.83 COC1=CN=C(CCN)C=C1 C15008 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.83 COC1=NC=C(CCN)C=C1 W10137 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.83 N#CC1=CC=C(\C=N\O)C=C1 W10686 [0,1,0,0,0,0|1,0,2]=4 88 B11R1.83 NCCC1=CC=C(CO)C=C1 20162 [0,1,0,0,0,0|0,0,2]=3 89 B11R1.83 [C-]#[N+]CC1=CC=C(OC)C=C1 AB1475 [0,1,0,0,0,0|2,0,1]=4 90 B11R1.279 C#CC1=C(Br)C=C(OC)C=C1 AT26829 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.279 CC1=C(C#N)C=CC(C=O)=N1 91338 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.279 CCC1=C(O)C=C(OC)C=C1 75531 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.279 CCC1=CC(Br)=C(OC)C=C1 AT26698 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.279 CNC1=C(F)C=C(C#N)C=C1 I11059 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.279 COC1=C(Br)C=C(CN)C=C1 AC5724 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.279 COC1=C(C)C=C(CCl)C=C1 F14712 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.279 COC1=C(N)C=C(C=O)C=C1 26715 [0,1,0,0,0,0|1,0,0]=2 98 B11R1.279 COC1=CC(C)=C(NN)C=C1 D87953 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.279 COC1=CC(O)=C(CO)C=C1 AC7760 [0,1,0,0,0,0|1,0,2]=4 100 B11R1.279 COC1=NC(N)=C(C=O)C=C1 66190 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.279 CSC1=C(C)C=C(CN)C=C1 AT20988 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.279 CSC1=C(Cl)C=C(C=O)C=C1 AT16394 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.279 N#CC1=C(Br)C=C(CN)C=C1 51993 [0,1,0,0,0,0|2,0,1]=4 104 B11R1.279 N#CC1=C(F)C=C(CN)C=C1 AB2617 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.279 O=CC1=CC(Br)=C(C=O)C=C1 AB10136 [0,1,0,0,0,0|1,0,1]=3 106 B9R1.21 C=CC1=NN(CC)C=C1 C92834 [0,0,0,0,1,0|3,0,0]=4 107 B9R1.21 CCC1=CC(CN)=CS1 54989 [0,0,0,0,1,0|2,0,1]=4 108 B9R1.21 CCC1=NC(C=O)=CS1 AT15240 [0,0,0,0,1,0|2,0,0]=3 109 B9R1.21 CCC1=NN=C(C=O)S1 AT18981 [0,0,0,0,1,0|3,0,0]=4 110 B9R1.21 CCN1C=CC(C=O)=C1 AT16331 [0,0,0,0,1,0|1,0,0]=2 111 B9R1.21 CCN1C=CC(C=O)=N1 F14621 [0,0,0,0,1,0|2,0,0]=3 112 B9R1.21 COC1=CC=C(C=O)O1 AT17092 [0,0,0,0,1,0|2,0,0]=3 113 B9R1.21 COC1=CC=C(C=O)S1 F53534 [0,0,0,0,1,0|2,0,0]=3 114 B9R1.21 COC1=NC(C=O)=CS1 AT15252 [0,0,0,0,1,0|3,0,0]=4 115 B9R1.21 COC1=NSC(C=O)=C1 AT11785 [0,0,0,0,1,0|3,0,0]=4 116 B9R1.21 CSC1=CC=C(C=O)O1 AT17272 [0,0,0,0,1,0|2,0,0]=3 117 B9R1.21 CSC1=CC=C(C=O)S1 T72147 [0,0,0,0,1,0|2,0,0]=3 118 B9R1.21 CSC1=NC=C(C=O)S1 AT15087 [0,0,0,0,1,0|3,0,0]=4 119 B9R1.21 N#CC1=CC(C=O)=CS1 AT17083 [0,0,0,0,1,0|2,0,1]=4 120 B9R1.21 N#CC1=CNC(C=O)=C1 AT16180 [0,0,0,0,1,0|2,0,1]=4 121 B9R1.21 O=CC1=CC(CCl)=CS1 AT17066 [0,0,0,0,1,0|2,0,0]=3 122 B9R1.21 O=CC1=CC=C(CCl)O1 F11818 [0,0,0,0,1,0|2,0,0]=3 123 B9R1.21 O=CC1=NC(CO)=CS1 AT14686 [0,0,0,0,1,0|3,0,0]=4 124 B8R1.2 C=CC1=CC=CN=C1 71366 [2,0,0,0,0,0|2,0,0]=4 125 B8R1.2 NCC1=CC=CC=C1 T70846 [2,0,0,0,0,0|1,0,0]=3 126 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [2,0,0,0,0,0|2,0,0]=4 127 B8R1.3 [2H]C1=CC=C(Cl)C=C1 D98354 [2,0,0,0,0,0|2,0,0]=4 128 B8R1.3 [2H]C1=CC=C([2H])C=C1 D99669 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.1 CC1=CC=C(C#CBr)C=C1 94424 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [1,1,0,0,0,0|1,0,1]=4 131 B10R1.1 CC1=CC=C(\C=N\O)C=C1 AC8737 [1,1,0,0,0,0|0,0,1]=3 132 B10R1.1 CC1=NC=C(\C=C\Br)C=C1 F50214 [1,1,0,0,0,0|2,0,0]=4 133 B10R1.1 CCOC1=NC=C(O)C=C1 D75011 [1,1,0,0,0,0|1,0,1]=4 134 B10R1.1 CNCC1=NC=C(Cl)C=C1 AT26664 [1,1,0,0,0,0|2,0,0]=4 135 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [1,1,0,0,0,0|0,1,0]=3 136 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [1,1,0,0,0,0|1,0,0]=3 139 B10R1.1 NCCC1=NC=C(Br)C=C1 P10593 [1,1,0,0,0,0|2,0,0]=4 140 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.1 N\N=C\C1=CC=C(O)C=C1 F15571 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.1 O=C1N=CC(CCO)=CN1 AT18210 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.1 O=CNC1=CC=C(F)C=C1 F21300 [1,1,0,0,0,0|1,0,0]=3 145 B10R1.1 OCCC1=CN=C(Br)C=C1 AC9473 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.1 OCCC1=CN=C(F)C=C1 AC9525 [1,1,0,0,0,0|2,0,0]=4 147 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [1,1,0,0,0,0|2,0,0]=4 148 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [1,1,0,0,0,0|2,0,0]=4 149 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [1,1,0,0,0,0|1,0,0]=3 150 B10R1.13 CC1=CN=C(C(=N)N)C=C1 W19131 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 Y10705 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [1,1,0,0,0,0|1,0,0]=3 153 B10R1.13 CC1=NC=C(C(N)=O)C=N1 81927 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56564 [1,1,0,0,0,0|1,0,1]=4 155 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 56569 [1,1,0,0,0,0|1,0,1]=4 156 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [1,1,0,0,0,0|1,1,0]=4 157 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [1,1,0,0,0,0|0,0,1]=3 158 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [1,1,0,0,0,0|0,0,1]=3 159 B10R1.13 C[C@H](N)C1=CN=C(Br)C=C1 N11221 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 D81683 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 Y10703 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 90531 [1,1,0,0,0,0|2,0,0]=4 163 B10R1.13 C[C@H](N)C1=NC=C(Cl)C=C1 N16973 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 90529 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.13 C[C@H](O)C1=CN=C(F)C=C1 AT10687 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10690 [1,1,0,0,0,0|2,0,0]=4 167 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [1,1,0,0,0,0|2,0,0]=4 168 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.25 C=CC1=C(F)C=C(Cl)C=C1 AC6667 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [1,1,0,0,0,0|2,0,0]=4 173 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [1,1,0,0,0,0|1,0,1]=4 174 B10R1.25 CC1=CC(Br)=C(C=O)C=N1 C14106 [1,1,0,0,0,0|1,0,0]=3 175 B10R1.25 CC1=CC(Br)=C(C=O)N=C1 53823 [1,1,0,0,0,0|1,0,0]=3 176 B10R1.25 CC1=CC(Cl)=CN=C1C=O 97693 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [1,1,0,0,0,0|1,0,1]=4 178 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [1,1,0,0,0,0|0,0,2]=4 179 B10R1.25 CC1=CC(F)=C(NN)C=C1 A12578 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [1,1,0,0,0,0|0,0,0]=2 181 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [1,1,0,0,0,0|0,0,2]=4 182 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [1,1,0,0,0,0|0,0,2]=4 183 B10R1.25 CC1=NC(C)=C(C=O)C=C1 F12423 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.25 CC1=NC(C)=C(C=O)C=N1 D97637 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.25 CCC1=C(Br)C=C(Br)C=N1 F14393 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [1,1,0,0,0,0|1,0,0]=3 187 B10R1.25 CCN1C=CC(=O)NC1=O AT19350 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.25 CCN1C=CC(N)=CC1=O P12616 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.25 NC1=C(C=O)C=CC(Br)=N1 97231 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 66186 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [1,1,0,0,0,0|1,0,1]=4 202 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.25 O=CC1=C(Cl)C=C(F)C=N1 BL010213 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 C90858 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.25 O=CC1=CC=C(F)N=C1Br AT22753 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.176 BrCC1=CC(Br)=C(I)C=C1 AT26690 [1,1,0,0,0,0|2,0,0]=4 213 B10R1.176 BrCC1=CC(I)=C(Br)C=C1 97476 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 C14264 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.176 CC1=C(Br)C=CC(CCl)=C1 D87322 [1,1,0,0,0,0|2,0,0]=4 216 B10R1.176 CC1=C(I)C=C(CO)C=C1 D75885 [1,1,0,0,0,0|0,0,2]=4 217 B10R1.176 CC1=C(N)C=CC(CO)=C1 F15978 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14330 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.176 CCC1=CC(N)=C(Br)C=N1 C14681 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.176 CCC1=CC(N)=C(C)C=C1 F21363 [1,1,0,0,0,0|0,0,1]=3 221 B10R1.176 CCC1=CC(O)=C(F)C=C1 F30470 [1,1,0,0,0,0|1,0,0]=3 222 B10R1.176 CCC1=CC(O)=C(O)C=C1 70407 [1,1,0,0,0,0|0,0,1]=3 223 B10R1.176 CCC1=NC(C)=C(O)C=C1 76361 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.176 CN1C=C(CN)C=CC1=O P11875 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.176 CNC1=CC(Cl)=C(Br)C=C1 AC3296 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 C77674 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.176 CNC1=CC(F)=C(Br)C=C1 S10823 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.176 COC1=CC(N)=C(I)C=C1 O10806 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19646 [1,1,0,0,0,0|1,1,0]=4 230 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19647 [1,1,0,0,0,0|1,1,0]=4 231 B10R1.176 COC1=CC(S)=C(N)C=C1 C90511 [1,1,0,0,0,0|2,0,0]=4 232 B10R1.176 CSC1=CC(C)=C(Br)C=C1 AT14181 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.176 CSC1=CC(C)=C(O)C=C1 AT20904 [1,1,0,0,0,0|1,0,1]=4 234 B10R1.176 CSC1=CC(N)=C(C)C=C1 AT20856 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 W16546 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.176 FC1=C(Br)C=CC(CCl)=C1 96328 [1,1,0,0,0,0|2,0,0]=4 237 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 CK1006 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.176 NCC1=CC(O)=C(N)C=C1 F13360 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.176 O=CC1=CC(Br)=C(I)C=C1 AT26050 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 AT23715 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.176 OCC1=CC(I)=C(Br)C=C1 97475 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.31 CC(C)C1=CC=C(C=O)O1 F53542 [0,1,0,0,1,0|1,0,0]=3 243 B10R1.31 CC(C)C1=CSC(C=O)=N1 F14711 [0,1,0,0,1,0|2,0,0]=4 244 B10R1.31 CC(C)C1=NNC(C=O)=C1 AT15964 [0,1,0,0,1,0|2,0,0]=4 245 B10R1.31 CCC1=CC=C(C(=O)O)O1 AT17158 [0,1,0,0,1,0|1,0,0]=3 246 B10R1.31 CCC1=CSC(C(=O)O)=N1 C71580 [0,1,0,0,1,0|2,0,0]=4 247 B10R1.31 CCC1=NNC(C(=O)O)=C1 W16046 [0,1,0,0,1,0|2,0,0]=4 248 B10R1.31 CCN1C=NC(C(=O)O)=C1 79486 [0,1,0,0,1,0|2,0,0]=4 249 B10R1.31 COC1=CC=C(C(=O)O)O1 AT17094 [0,1,0,0,1,0|2,0,0]=4 250 B10R1.31 CSC1=CC(C(=O)O)=CO1 AT17277 [0,1,0,0,1,0|2,0,0]=4 251 B10R1.31 CSC1=CC=C(C(=O)O)O1 AT17280 [0,1,0,0,1,0|2,0,0]=4 252 B10R1.31 NCC1=CC=C(C(=O)O)O1 AT17184 [0,1,0,0,1,0|2,0,0]=4 253 B10R1.31 NCC1=CC=C(C(=O)O)S1 AT24853 [0,1,0,0,1,0|2,0,0]=4 254 B10R1.31 O=C(O)C1=COC(CO)=C1 AT17501 [0,1,0,0,1,0|2,0,0]=4 255 B10R1.31 O=CC1=CC(C(F)F)=CS1 AT16852 [0,1,0,0,1,0|2,0,0]=4 256 B10R1.31 O=CC1=CC=C(C(F)F)O1 AT17239 [0,1,0,0,1,0|2,0,0]=4 257 B10R1.35 CCN1C=C(Br)C(C=O)=N1 AT14238 [0,1,0,0,1,0|2,0,0]=4 258 B10R1.35 CCN1C=C(C=O)C(C)=N1 D85904 [0,1,0,0,1,0|2,0,0]=4 259 B10R1.96 CCCN1C=CC(C=O)=N1 AT14222 [0,1,0,0,1,0|2,0,0]=4 260 B10R1.96 CCOC1=CC=C(C=O)O1 AT17093 [0,1,0,0,1,0|1,0,0]=3 261 B10R1.96 COCC1=CC=C(C=O)S1 AT26622 [0,1,0,0,1,0|1,0,0]=3 262 B10R1.96 COCC1=NC(C=O)=CS1 AT15255 [0,1,0,0,1,0|2,0,0]=4 263 B10R1.96 O=CC1=CC=C(CCO)S1 F19778 [0,1,0,0,1,0|1,0,0]=3 264 B10R1.96 O=CC1=CN(CCF)N=C1 AT13594 [0,1,0,0,1,0|2,0,0]=4 265 B10R1.96 O=CC1=CN(CCO)C=N1 AT15371 [0,1,0,0,1,0|2,0,0]=4 266 B10R1.96 O=CC1=CN(CCO)N=C1 AT13593 [0,1,0,0,1,0|2,0,0]=4 267 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15274 [0,2,0,0,0,0|1,0,0]=3 268 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15275 [0,2,0,0,0,0|1,0,0]=3 269 B12R1.5 C=C[C@H](N)C1=CC=C(CC)C=C1 N15276 [0,2,0,0,0,0|1,0,0]=3 270 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15289 [0,2,0,0,0,0|2,0,0]=4 271 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15290 [0,2,0,0,0,0|2,0,0]=4 272 B12R1.5 C=C[C@H](N)C1=CC=C(OC)C=C1 N15291 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 23929 [0,2,0,0,0,0|0,0,0]=2 274 B12R1.5 CCC1=CC=C(C(=O)CO)C=C1 AC2757 [0,2,0,0,0,0|0,0,0]=2 275 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13461 [0,2,0,0,0,0|1,0,1]=4 276 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13462 [0,2,0,0,0,0|1,0,1]=4 277 B12R1.5 CCC1=CC=C([C@@H](N)CN)C=C1 N13463 [0,2,0,0,0,0|1,0,1]=4 278 B12R1.5 CCC1=NC=C(C(=O)OC)C=C1 92554 [0,2,0,0,0,0|1,0,0]=3 279 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 97264 [0,2,0,0,0,0|2,0,0]=4 280 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 N10941 [0,2,0,0,0,0|2,0,0]=4 281 B12R1.5 CC[C@H](N)C1=CC=C(OC)C=C1 N12242 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.5 CC[C@H](N)C1=CC=C(SC)C=C1 N11382 [0,2,0,0,0,0|2,0,0]=4 283 B12R1.5 CNC(=O)C1=CC=C(CBr)C=C1 D97640 [0,2,0,0,0,0|1,0,0]=3 284 B12R1.5 CNC(=O)C1=CC=C(CN)C=C1 97528 [0,2,0,0,0,0|1,0,0]=3 285 B12R1.5 CN[C@@H](C)C1=CC=C(OC)C=C1 N12207 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 57141 [0,2,0,0,0,0|2,0,0]=4 287 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 P16732 [0,2,0,0,0,0|2,0,0]=4 288 B12R1.5 COC1=CC=C(C(=O)C=O)C=C1 76157 [0,2,0,0,0,0|1,0,0]=3 289 B12R1.5 COC1=CC=C(C(=O)CO)C=C1 AC6103 [0,2,0,0,0,0|1,0,0]=3 290 B12R1.5 COC1=CC=C([C@@H](N)CF)C=C1 N14616 [0,2,0,0,0,0|2,0,0]=4 291 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13480 [0,2,0,0,0,0|2,0,0]=4 292 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13481 [0,2,0,0,0,0|2,0,0]=4 293 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13482 [0,2,0,0,0,0|2,0,0]=4 294 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13488 [0,2,0,0,0,0|2,0,0]=4 295 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13489 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.5 COC1=CC=C([C@@H](N)CN)C=C1 N13490 [0,2,0,0,0,0|2,0,0]=4 297 B12R1.5 COC1=CC=C([C@@H](O)CN)C=C1 C78301 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.5 COC1=NC=C(C(=O)CCl)C=C1 D77905 [0,2,0,0,0,0|2,0,0]=4 299 B12R1.5 COC1=NC=C(C(=O)NN)C=C1 W19083 [0,2,0,0,0,0|2,0,0]=4 300 B12R1.5 CSC1=CC=C(C(=O)CBr)C=C1 H10559 [0,2,0,0,0,0|1,0,0]=3 301 B12R1.5 CSC1=CC=C([C@@H](N)CO)C=C1 H10359 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.6 CC(C)(C)C1=CN=C(C=O)C=N1 94362 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.6 CC(F)(F)C1=CC=C(C#N)C=C1 F53152 [0,2,0,0,0,0|1,0,1]=4 304 B12R1.6 CCC1=CC=C([B-](F)(F)F)C=C1 N12090 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.6 COC1=CC=C([S@@](C)(=N)=O)C=C1 W18264 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.6 NCC1=CC=C(S(=O)(=O)O)C=C1 AC7999 [0,2,0,0,0,0|2,0,0]=4 307 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 C14685 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.6 O=CC1=CC=C(S(=O)(=O)F)C=C1 AT12034 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.48 C#CC1=C(F)C=C(C(=O)O)C=C1 C73577 [0,2,0,0,0,0|0,0,2]=4 310 B12R1.48 CC(=O)C1=CC(Br)=C(C#N)C=C1 35226 [0,2,0,0,0,0|1,0,1]=4 311 B12R1.48 CC(=O)C1=CC(Br)=C(CBr)C=C1 W17125 [0,2,0,0,0,0|1,0,0]=3 312 B12R1.48 CC(=O)C1=CC(Cl)=C(C#N)C=C1 95965 [0,2,0,0,0,0|1,0,1]=4 313 B12R1.48 CC1=C(C=O)C=CC(B(O)O)=C1 N12929 [0,2,0,0,0,0|2,0,0]=4 314 B12R1.48 CCC1=C(Br)C=C(C(C)=O)C=C1 F17056 [0,2,0,0,0,0|0,0,0]=2 315 B12R1.48 CCC1=C(I)C=C(C(=O)O)C=C1 I11380 [0,2,0,0,0,0|0,0,0]=2 316 B12R1.48 CN(C)C1=CC(O)=C(N=O)C=C1 T72444 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.48 CNC1=C(Br)C=C(C(=O)O)C=C1 O10956 [0,2,0,0,0,0|1,0,0]=3 318 B12R1.48 COC1=C(F)C=C([C@H](C)Br)C=C1 96595 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.48 COC1=C(F)C=C([C@H](C)Cl)C=C1 97968 [0,2,0,0,0,0|2,0,0]=4 320 B12R1.48 COC1=C(F)C=C([C@H](C)O)C=C1 96594 [0,2,0,0,0,0|2,0,0]=4 321 B12R1.48 COC1=CN=C(C(=O)O)C=C1O 96427 [0,2,0,0,0,0|2,0,0]=4 322 B12R1.48 CSC1=C(Br)C=C([N+](=O)[O-])C=C1 D87916 [0,2,0,0,0,0|2,0,0]=4 323 B12R1.48 CSC1=C(F)C=C([N+](=O)[O-])C=C1 94983 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.48 C[C@H](N)C1=CC(F)=C(CO)C=C1 N14392 [0,2,0,0,0,0|0,0,2]=4 325 B12R1.48 N#CC1=C(I)C=C(C(=O)O)C=C1 AB6921 [0,2,0,0,0,0|1,0,1]=4 326 B12R1.48 NCC1=C(Cl)C=C([N+](=O)[O-])C=C1 F53507 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.48 O=[N+]([O-])C1=CC(F)=C(CBr)C=C1 F13177 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.113 C=CCC1=CC=C(C(N)=O)C=C1 AC2805 [0,2,0,0,0,0|0,0,1]=3 329 B12R1.113 CC(C)C1=CC=C(CCN)C=C1 C13364 [0,2,0,0,0,0|1,0,1]=4 330 B12R1.113 CCNC1=NN=C(C(=O)O)C=C1 AC3103 [0,2,0,0,0,0|2,0,0]=4 331 B12R1.113 CCOC1=CC=C([C@@H](N)O)C=C1 E72788 [0,2,0,0,0,0|0,0,2]=4 332 B12R1.113 CCOC1=CC=C([C@H](C)N)C=C1 C77727 [0,2,0,0,0,0|1,0,1]=4 333 B12R1.113 CCSC1=NC=C([N+](=O)[O-])C=C1 F11621 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.113 CNCC1=CC=C(B(O)O)C=C1 C15909 [0,2,0,0,0,0|1,0,1]=4 335 B12R1.113 N=C(N)C1=CC=C(CCN)C=C1 F51015 [0,2,0,0,0,0|1,0,0]=3 336 B12R1.113 N=C(N)C1=CC=C(CCN)C=C1 F52005 [0,2,0,0,0,0|1,0,0]=3 337 B12R1.113 NNCC1=CC=C([N+](=O)[O-])C=C1 AC5363 [0,2,0,0,0,0|2,0,0]=4 338 B12R1.113 NOCC1=CC=C(C(=O)O)C=C1 AT14532 [0,2,0,0,0,0|1,0,0]=3 339 B12R1.113 O=[N+]([O-])C1=CN=C(CCBr)C=C1 D80483 [0,2,0,0,0,0|2,0,0]=4 340 B12R1.256 CC(=O)C1=CC=C(C(F)F)C=C1 O10282 [0,2,0,0,0,0|1,0,0]=3 341 B12R1.256 CC(C)C1=CC=C([C@H](C)N)C=C1 AT12994 [0,2,0,0,0,0|1,0,1]=4 342 B12R1.256 CC(C)C1=CC=C([C@H](C)N)C=C1 AT12996 [0,2,0,0,0,0|1,0,1]=4 343 B12R1.256 CC(C)C1=NC=C([N+](=O)[O-])C=C1 P11098 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.256 C[C@H](N)C1=CC=C(B(O)O)C=C1 I12564 [0,2,0,0,0,0|1,0,1]=4 345 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 A50524 [0,2,0,0,0,0|0,0,0]=2 346 B12R1.256 C[C@H](N)C1=CC=C(C(F)F)C=C1 N14665 [0,2,0,0,0,0|1,0,1]=4 347 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 I10900 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 N12577 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 Y11471 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.256 C[C@H](N)C1=CC=C([N+](=O)[O-])C=C1 F53386 [0,2,0,0,0,0|1,0,0]=3 351 B12R1.256 C[S@](=O)C1=CC=C(C(=O)O)C=C1 AT22899 [0,2,0,0,0,0|1,0,0]=3 352 B12R1.452 CC(=O)C1=C(Cl)C=C(C#N)C=C1 52167 [0,2,0,0,0,0|1,0,1]=4 353 B12R1.452 CCC1=CC(C)=C([N+](=O)[O-])C=C1 W19433 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.452 CCC1=CC(O)=C([N+](=O)[O-])C=C1 F13833 [0,2,0,0,0,0|1,0,0]=3 355 B12R1.452 CN(C)C1=C(Cl)C=C(C=O)C=C1 AT16362 [0,2,0,0,0,0|1,0,0]=3 356 B12R1.452 COC1=CC(Br)=C(C(C)C)C=C1 E71918 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.452 COC1=CC(F)=C(C(=O)O)C=N1 N17087 [0,2,0,0,0,0|2,0,0]=4 358 B12R1.452 COC1=CC(F)=C(C(C)C)C=C1 P10295 [0,2,0,0,0,0|2,0,0]=4 359 B12R1.452 COC1=CC(N)=C(C(N)=O)C=C1 F15890 [0,2,0,0,0,0|1,0,0]=3 360 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 Y10543 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.452 C[C@H](N)C1=C(F)C=C(CO)C=C1 N14658 [0,2,0,0,0,0|0,0,2]=4 362 B12R1.452 N#CC1=CC(F)=C(C(=O)Cl)C=C1 58517 [0,2,0,0,0,0|1,0,1]=4 363 B12R1.452 NCC1=CC(Br)=C([N+](=O)[O-])C=C1 O10076 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.452 O=C(O)C1=C(F)C=C(CBr)C=C1 D95479 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.452 O=CC1=CC(Br)=C(C(=O)O)C=C1 R10022 [0,2,0,0,0,0|1,0,1]=4 366 B12R1.452 O=[N+]([O-])C1=C(Cl)C=C(CO)C=C1 A50673 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.4 CC(C)SC1=CC=C(CCl)C=C1 AT20997 [0,2,0,0,0,0|1,0,1]=4 368 B12R1.4 CC(C)SC1=CC=C(CO)C=C1 AT20984 [0,2,0,0,0,0|0,0,2]=4 369 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 S12245 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.4 COC1=CC=C(C[C@H](C)N)C=C1 F13082 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.4 COC1=CC=C(NC(C)C)C=C1 C77952 [0,2,0,0,0,0|2,0,0]=4 372 B12R1.4 NNC1=CC=C(CC(N)=O)C=C1 F30826 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.71 C=CCCC1=CC=C(OC)C=C1 AC5393 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.71 C=CCOC1=CC=C(OC)C=C1 W18721 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.71 CCC1=CC=C(CCCO)C=C1 C77990 [0,2,0,0,0,0|0,0,2]=4 376 B12R1.71 COC1=CC=C(CCC=O)C=C1 C15265 [0,2,0,0,0,0|1,0,0]=3 377 B12R1.71 COC1=CC=C(CCCI)C=C1 C77768 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.71 COC1=CC=C(NCCN)C=C1 AC5715 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.71 CSC1=CC=C(CCCN)C=C1 N13315 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.114 CCOC1=C(F)C=C(C=O)C=N1 O11588 [0,2,0,0,0,0|1,0,0]=3 381 B12R1.114 CCOC1=C(O)C=C(C=O)C=C1 A51060 [0,2,0,0,0,0|0,0,0]=2 382 B12R1.116 CCOC1=CC=C(CCO)C=C1 C78072 [0,2,0,0,0,0|0,0,2]=4 383 B12R1.116 ClCCC1=CC=C(CCCl)C=C1 T71283 [0,2,0,0,0,0|1,0,1]=4 384 B12R1.288 CCOC1=CC(F)=C(C=O)C=C1 36525 [0,2,0,0,0,0|0,0,0]=2 385 B12R1.288 CCOC1=CC(F)=C(CBr)C=C1 D80283 [0,2,0,0,0,0|1,0,1]=4 386 B12R1.288 CCOC1=CC(F)=C(CN)C=C1 N14202 [0,2,0,0,0,0|1,0,1]=4 387 B12R1.288 COC1=C(F)C=C(CCN)C=C1 D87759 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.78 CCC1=C(C=O)C=CC(C#N)=C1 F30154 [0,2,0,0,0,0|1,0,1]=4 389 B12R1.78 COC1=NC=C(C=O)C=C1C#N 91341 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.301 CSC1=CC(Cl)=C(C=O)C(Cl)=C1 93332 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.301 N#CC1=CC(Cl)=C(C=O)C(Cl)=C1 CS1770 [0,2,0,0,0,0|1,0,1]=4 392 B12R1.450 COC1=C(Br)C=C(C=O)C(F)=C1 D78772 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.450 COC1=C(Br)C=C(C=O)C(N)=C1 F15880 [0,2,0,0,0,0|1,0,0]=3 394 B12R1.450 COC1=C(Cl)C=C(C=O)C(C)=C1 D96249 [0,2,0,0,0,0|1,0,0]=3 395 B12R1.450 COC1=C(Cl)C=C(C=O)C(Cl)=C1 F17589 [0,2,0,0,0,0|1,0,0]=3 396 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [0,0,1,1,0,0|2,0,0]=4 397 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [0,0,1,1,0,0|2,0,0]=4 398 B10R1.2 CN1C=CC=C(C=O)C1=O 55279 [0,0,1,1,0,0|2,0,0]=4 399 B12R2.9 BrCC1=CC=C(C2CC2)C=C1 51969 [0,1,0,1,0,0|1,0,1]=4 400 B12R2.9 CCC1=CC=C(C2CC2)C=C1 AC8465 [0,1,0,1,0,0|1,0,1]=4 401 B12R2.9 COC1=CC=C(C2CC2)C=C1 F53529 [0,1,0,1,0,0|2,0,0]=4 402 B12R2.9 ClCC1=CC=C(C2CC2)C=C1 P12610 [0,1,0,1,0,0|1,0,1]=4 403 B12R2.9 NCC1=CC=C(C2CC2)C=C1 33490 [0,1,0,1,0,0|1,0,1]=4 404 B12R2.44 BrCC1=CC2=C(C=C1)CCC2 71843 [0,1,0,1,0,0|1,0,1]=4 405 B12R2.44 BrCC1=CC2=C(C=C1)N=CS2 C75330 [0,1,0,1,0,0|1,1,0]=4 406 B12R2.44 BrCC1=CC2=C(C=C1)OC=C2 AC5003 [0,1,0,1,0,0|2,0,0]=4 407 B12R2.44 CCC1=CC2=C(C=CN2)C=C1 72108 [0,1,0,1,0,0|1,0,0]=3 408 B12R2.44 CNC1=CC2=C(C=C1)CCC2 F12591 [0,1,0,1,0,0|2,0,0]=4 409 B12R2.44 COC1=CC2=C(C=CC2)C=C1 A10637 [0,1,0,1,0,0|2,0,0]=4 410 B12R2.44 CSC1=CC2=C(C=CN2)C=C1 F17545 [0,1,0,1,0,0|2,0,0]=4 411 B12R2.44 ClCC1=CC2=C(C=C1)CCC2 AT13426 [0,1,0,1,0,0|1,0,1]=4 412 B12R2.44 NCC1=CC2=C(C=C1)CNC2 D87544 [0,1,0,1,0,0|1,0,1]=4 413 B12R2.44 NCC1=CC2=C(C=C1)N=CO2 AC5137 [0,1,0,1,0,0|1,0,1]=4 414 B12R2.44 NCC1=CC2=C(C=C1)OC=C2 F13229 [0,1,0,1,0,0|2,0,0]=4 415 B12R2.44 NCC1=CC2=C(C=C1)OC=C2 F20150 [0,1,0,1,0,0|2,0,0]=4 416 B12R2.44 NCC1=CC2=C(C=C1)OC=N2 AC2206 [0,1,0,1,0,0|2,0,0]=4 417 B12R2.44 NCC1=CC2=C(C=C1)SC=C2 73943 [0,1,0,1,0,0|2,0,0]=4 418 B12R2.44 O=CC1=CN=C2NCCC2=C1 D78593 [0,1,0,1,0,0|1,0,0]=3 419 B12R2.44 OCC1=CC2=C(C=C1)CCC2 AT13427 [0,1,0,1,0,0|0,0,2]=4 420 B8R1.1 CC1=CN=C(C=O)O1 AT17128 [1,0,0,0,1,0|2,0,0]=4 421 B8R1.1 CC1=NNC(C=O)=C1 79805 [1,0,0,0,1,0|2,0,0]=4 422 B8R1.1 CC1=NSC(C=O)=C1 C16590 [1,0,0,0,1,0|2,0,0]=4 423 B8R1.1 CCC1=CC=C(S)S1 AT16555 [1,0,0,0,1,0|1,1,0]=4 424 B8R1.1 O=CC1=CC(Cl)=CO1 50491 [1,0,0,0,1,0|2,0,0]=4 425 B8R1.1 O=CC1=CC(Cl)=CS1 P11080 [1,0,0,0,1,0|2,0,0]=4 426 B8R1.1 O=CC1=COC(Br)=C1 AT17110 [1,0,0,0,1,0|2,0,0]=4 427 B10R1.172 CCC1=CC=CC(CO)=C1 D85939 [0,0,0,0,1,1|0,0,2]=4 428 B10R1.172 CCC1=NC=CC(CN)=C1 57083 [0,0,0,0,1,1|1,0,1]=4 429 B10R1.172 COC1=CC=NC(C=O)=N1 AT18294 [0,0,0,0,1,1|2,0,0]=4 430 B10R1.172 O=CC1=CC(C=O)=NC=C1 CS1671 [0,0,0,0,1,1|1,0,1]=4 431 B10R1.172 O=CC1=NC=CC(CO)=C1 60952 [0,0,0,0,1,1|1,0,0]=3