0 B11R1.166 CC(=O)C1=C(F)C=C(N)C=C1 AT16600 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.166 CC(=O)C1=C(O)N=C(Cl)C=C1 AT20297 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1N AC9826 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.166 CC(=O)C1=NC=C(Br)C=C1O AT21120 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.166 CC(C)C1=C(F)C=C(N)C=C1 AT16598 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.166 CC1=C(C(=O)O)N=CC(Cl)=N1 AT24109 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.166 CC1=CC(Br)=C([C@H](C)N)C=C1 C92023 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.166 CC1=CC(Br)=C([C@H](C)N)C=C1 C92046 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.166 CC1=CC(C)=C(B(O)O)C=N1 C90593 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 CC1=CC(Cl)=C([C@H](C)Br)C=C1 AT15344 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D96376 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=N1 P12234 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.166 C[C@H](N)C1=C(Br)C=C(Cl)C=C1 C91974 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.166 C[C@H](N)C1=C(Br)C=C(Cl)C=C1 C91977 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 C92027 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 C92048 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Br)C=C1 D96375 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.166 NC(=O)C1=NC=C(F)C=C1N AT14793 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.166 NC1=CC(S)=C(C(=O)O)C=C1 AT21193 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.166 O=C(O)C1=C(I)C=C(Br)N=C1 AT12762 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.166 O=C(O)C1=C(I)C=C(Cl)N=C1 P12286 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.166 O=C(O)C1=C(O)N=C(Br)C=C1 AC4834 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.166 [2H]C1=C(N(C)C)C=CC(Cl)=C1 AC5651 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.166 [2H]C1=C(N(C)C)C=CC(F)=C1 AC5650 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.13 CC(=O)C1=CN=C(N)N=C1 O10258 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.13 CC(=O)C1=NC=C(O)C=N1 AT23878 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 C91123 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 C92102 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 D96383 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 F50249 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 F50317 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.13 C[S@](=O)C1=CN=C(Br)C=C1 22983 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.13 O=C(F)C1=CC=C(F)C=C1 AT22483 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.25 CC1=CC(Cl)=C(C=O)C=N1 AT24663 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.25 CC1=CC(F)=CN=C1C=O P19560 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.25 CC1=NC(C)=C(CCl)C=C1 93160 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.25 COC1=C(I)C=C(C)C=N1 D74393 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.25 COC1=NC=C(C)C=C1O D74379 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.25 CSC1=C(Br)C=C(N)C=C1 D87910 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.25 O=CC1=CN=C(Cl)C=C1O AC9110 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.25 O=CC1=NC=C(Br)C=C1O AT21333 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.61 CN(C)C1=C(O)C=CC=C1 AT26775 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 D75506 [1,0,0,0,0,0|1,0,2]=4 43 B10R1.61 O=C(O)C1=C(S)C=CN=C1 AT16203 [1,0,0,0,0,0|3,0,0]=4 44 B12R1.57 COC1=C(C(=O)O)C=CC(F)=N1 AC9249 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.57 COC1=CC(Br)=NC=C1C(=O)O C91420 [0,1,0,0,0,0|3,0,0]=4 46 B12R1.126 CC1=CC(Br)=CN=C1S(C)(=O)=O AT14134 [0,1,0,0,0,0|3,0,0]=4 47 B12R1.126 CC1=CC(I)=C(S(=O)(=O)Cl)C=C1 AT11639 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.232 CC1=C(Cl)C=C(C(=O)O)C(Cl)=N1 AT21679 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.232 CC1=C(Cl)C=C(O)C(C(=O)O)=C1 AC7035 [0,1,0,0,0,0|3,0,0]=4 50 B12R1.232 CC1=CC(F)=C(I)C=C1C(=O)O AT25998 [0,1,0,0,0,0|2,0,0]=3 51 B12R1.232 O=C(O)C1=C(Br)C=C(O)C(F)=C1 AT17981 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1O D76073 [0,1,0,0,0,0|3,0,0]=4 53 B12R1.232 O=C(O)C1=CC(O)=C(Br)C=C1F AT11232 [0,1,0,0,0,0|3,0,0]=4 54 B12R1.232 O=C(O)C1=CC(O)=C(Cl)C=C1Cl D76122 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.452 CC1=C(C(=O)O)C=NC(CO)=N1 AT18297 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.452 COC1=CC(Br)=C([C@H](C)N)C=C1 C92025 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.452 COC1=CC(Br)=C([C@H](C)N)C=C1 C92056 [0,1,0,0,0,0|2,0,1]=4 58 B12R1.452 COC1=CC(Cl)=C([C@H](C)N)C=C1 E72732 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.452 NCC1=CC(F)=C([N+](=O)[O-])C=C1 F53652 [0,1,0,0,0,0|3,0,0]=4 60 B12R1.452 NCC1=CC(F)=C([N+](=O)[O-])C=C1 O10084 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.452 O=CC1=CC(O)=C(C(=O)O)C=C1 O11231 [0,1,0,0,0,0|2,0,1]=4 62 B12R1.893 CC1=C(C(=O)O)C=CC(F)=C1Br AT21197 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.893 CN1C=CC(C(=O)O)=C(O)C1=O AT19249 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.1000 CC1=CC(Br)=CC(Br)=C1C(=O)O AC8815 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.1000 CC1=CC(Br)=CC(C)=C1C(N)=O AT22851 [0,1,0,0,0,0|2,0,0]=3 66 B12R1.1000 O=C(O)C1=C(I)C=C(Br)C=C1I AT18566 [0,1,0,0,0,0|3,0,0]=4 67 B12R1.1000 O=C(O)C1=C(I)C=C(F)C=C1I AT18563 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Br)=C1 E72734 [0,1,0,0,0,0|2,0,1]=4 69 B12R1.1703 CC1=C([C@@H](N)CO)C=CC(Cl)=C1 AC8393 [0,1,0,0,0,0|2,0,1]=4 70 B12R1.1703 COC(=O)C1=C(C)N=C(Cl)C=N1 55087 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.1703 COC(=O)C1=C(I)C=C(Br)C=N1 AT22218 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.1703 COC(=O)C1=C(I)C=C(Cl)N=C1 AT19633 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.1703 COC(=O)C1=NC=C(O)C=C1C AC8222 [0,1,0,0,0,0|2,0,0]=3 74 B12R1.1703 COC(=O)C1=NN=C(Br)C=C1C F30299 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.612 CC1=CC2=C(C=C1)B(O)OC2 D73935 [0,0,0,1,0,0|2,0,1]=4 76 B12R2.612 CC1=CC2=C(C=C1)C(Cl)=NO2 O10990 [0,0,0,1,0,0|3,0,0]=4 77 B12R2.612 C[C@@H]1NCC2=C1C=CC(Br)=C2 C90683 [0,0,0,1,0,0|2,0,1]=4 78 B12R2.612 C[C@@H]1NCC2=C1C=CC(Br)=C2 F13796 [0,0,0,1,0,0|2,0,1]=4 79 B12R2.612 NC1=CC2=C(C=C1)C(=O)CO2 D76407 [0,0,0,1,0,0|2,0,0]=3 80 B12R2.612 NC1=CN=C2C(=O)OCC2=C1 AT26563 [0,0,0,1,0,0|3,0,0]=4 81 B12R2.612 O=C1CCC2=C1C=CC(Br)=N2 D72218 [0,0,0,1,0,0|2,0,0]=3 82 B12R2.612 O=C1CCC2=CC(Cl)=NC=C12 AT11786 [0,0,0,1,0,0|2,0,0]=3 83 B12R2.612 O=C1CSC2=C1C=CC(Br)=C2 D76235 [0,0,0,1,0,0|2,0,0]=3 84 B10R1.59 CC1=CN(N)C(C(N)=O)=C1 P11521 [0,0,0,0,1,0|3,0,0]=4 85 B10R1.194 CC(=O)C1=C(F)N(C)N=C1 E73005 [0,0,0,0,1,0|3,0,0]=4 86 B10R1.194 CC1=CN=C(C(=O)O)N1C AT22510 [0,0,0,0,1,0|3,0,0]=4 87 B10R1.194 CC1=CSC(C(=O)O)=C1N 35392 [0,0,0,0,1,0|3,0,0]=4 88 B12R1.233 CC1=C(CC(=O)O)C=CC(Br)=N1 AT12896 [0,0,0,0,0,1|3,0,0]=4 89 B12R1.233 CC1=CC=C(CC(=O)O)C(Cl)=N1 AT21641 [0,0,0,0,0,1|3,0,0]=4 90 B12R1.233 O=C(O)CC1=C(I)C=C(Br)C=C1 D85730 [0,0,0,0,0,1|3,0,0]=4 91 B12R1.233 O=C(O)CC1=C(I)C=C(Cl)C=C1 D85731 [0,0,0,0,0,1|3,0,0]=4 92 B12R1.233 O=C(O)CC1=C(I)C=C(F)C=C1 AT25194 [0,0,0,0,0,1|3,0,0]=4 93 B9R1.6 C=C(F)C1=CC=CC=C1 CS3204 [2,0,0,0,0,0|1,0,1]=4 94 B9R1.6 C[P@H](=O)C1=CC=CC=C1 O11981 [2,0,0,0,0,0|1,0,0]=3 95 B9R1.15 CC1=C(C=O)C=NN=C1 AT10311 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.15 CC1=CC=NN=C1C=O AT10310 [2,0,0,0,0,0|2,0,0]=4 97 B9R1.15 CC1=[13C](C=O)C=CC=C1 D98794 [2,0,0,0,0,0|0,0,0]=2 98 B9R1.15 O=CC1=C(F)C=CN=C1 P10446 [2,0,0,0,0,0|2,0,0]=4 99 B9R1.69 CC1=CN=C(Br)C=C1C AC6563 [2,0,0,0,0,0|2,0,0]=4 100 B11R1.3 NCC1=NC=C(C(N)=O)C=C1 O11498 [1,1,0,0,0,0|2,0,0]=4 101 B11R1.3 O=C(O)C1=CC=C(CF)C=C1 E72963 [1,1,0,0,0,0|1,0,0]=3 102 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 AT11670 [1,1,0,0,0,0|2,0,0]=4 103 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15910 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 D73584 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.19 C[S@](=N)(=O)C1=CC=C(N)C=C1 AT25737 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.19 [2H]C1=CC=C(S(C)(=O)=O)C=C1 AC5556 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.21 CC1=C(S)C=C(C(=O)O)C=C1 D74668 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.21 [BH3-]C1=C(C)C=CC(C(N)=O)=C1 AC8800 [1,1,0,0,0,0|1,0,0]=3 109 B11R1.22 CNC(=S)C1=CC=C(Br)C=C1 AC9075 [1,1,0,0,0,0|1,1,0]=4 110 B11R1.22 O=C(CO)C1=CN=C(Cl)C=C1 C91057 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.37 COC1=CC(Br)=NC=C1C=O D76576 [1,1,0,0,0,0|2,0,0]=4 112 B11R1.277 O=CC1=CC(F)=C(Br)C=C1O D74883 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.278 CC1=C(C=O)C=CC(Br)=C1F 97128 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.278 CC1=C(C=O)C=CC(O)=C1Cl D96245 [1,1,0,0,0,0|1,0,0]=3 115 B11R1.278 COC1=C(C)C(N)=C(N)C=C1 F51130 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.279 COC1=CC(F)=C(C=O)C=N1 97686 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.464 CC1=CC(Br)=C(C=O)C(F)=N1 AT21699 [1,1,0,0,0,0|2,0,0]=4 118 B11R1.464 CC1=CC(Br)=CC(Br)=C1C=O AC9739 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.464 CC1=CC(Cl)=C(C=O)C(F)=C1 51626 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.464 COC1=C(C)C=C(O)C=C1C AT19450 [1,1,0,0,0,0|2,0,0]=4 121 B11R1.464 COC1=C(O)C=C(I)C=C1C AT22246 [1,1,0,0,0,0|2,0,0]=4 122 B11R1.464 O=CC1=C(I)C=C(Br)C=C1I AT18564 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.464 O=CC1=C(I)C=C(F)C=C1I AT18552 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 N14391 [1,1,0,0,0,0|1,0,1]=4 125 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y12531 [1,1,0,0,0,0|1,0,1]=4 126 B11R1.53 NCC1=C(C(=O)O)C=CC=N1 AT25913 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.53 O=C(O)C1=C(CO)N=CC=C1 D77099 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.87 CP(C)(=O)C1=C(I)C=CC=C1 AT11111 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.156 CC(=O)C1=C(I)C=CN=C1F AT16505 [1,1,0,0,0,0|2,0,0]=4 130 B11R1.156 CC1=CN=CC(Cl)=C1C(=O)O AT24332 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.159 CC1=CN=CC(C(=O)O)=C1C AT13149 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.167 CC(=O)C1=C(Br)C=CC(N)=C1 O10299 [1,1,0,0,0,0|1,0,0]=3 133 B11R1.167 CC(=O)C1=C(C)N=CC(N)=C1 O10300 [1,1,0,0,0,0|1,0,0]=3 134 B11R1.167 CC(=O)C1=CC(Br)=CN=C1O AT20305 [1,1,0,0,0,0|2,0,0]=4 135 B11R1.167 CC(=O)C1=CC(Cl)=CN=C1O AT20998 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.167 CC(=O)C1=CC(F)=CN=C1O AT21104 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.167 CC1=C(C(=O)O)C=C(N)N=C1 AT18131 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.167 CC1=CN=C(Cl)C=C1C(=O)O AT21681 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.222 C=CC(=O)C1=C(F)C=CC=C1 F13144 [1,1,0,0,0,0|1,0,1]=4 140 B11R1.222 CC1=C(C(=S)NN)C=CC=C1 W10975 [1,1,0,0,0,0|1,1,0]=4 141 B11R1.222 COC(=O)C1=NN=CC=C1C F51619 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.222 O=C(CCl)C1=NC=CC=C1F 78963 [1,1,0,0,0,0|2,0,0]=4 143 B11R1.222 O=C(NO)C1=C(Br)C=CC=C1 D76830 [1,1,0,0,0,0|2,0,0]=4 144 B11R1.225 COC(=O)C1=C(Br)OC(C)=C1 D76216 [0,1,0,0,1,0|2,0,0]=4 145 B11R1.673 CC(=O)C1=C(Cl)N(C)N=C1C AT26240 [0,1,0,0,1,0|2,0,0]=4 146 B11R1.865 COC(=O)C1=C(Br)C(C)=CS1 AT11764 [0,1,0,0,1,0|2,0,0]=4 147 B11R1.865 COC(=O)C1=CSC(N)=C1C 57783 [0,1,0,0,1,0|2,0,0]=4 148 B13R1.163 CC1=CC(C)=C([C@@H](N)C(=O)O)C=C1 N11230 [0,1,0,0,0,1|1,0,0]=3 149 B13R1.163 CC1=CC(C)=C([C@@H](N)[C@H](C)O)C=C1 N15998 [0,1,0,0,0,1|0,0,2]=4 150 B13R1.653 COC1=CC(I)=C(CC(=O)O)C=C1 AT25195 [0,1,0,0,0,1|2,0,0]=4 151 B13R1.2679 COC(=O)CC1=C(N)C=C(Br)C=C1 AT20854 [0,1,0,0,0,1|2,0,0]=4 152 B13R1.2679 O=C(CBr)CC1=C(Cl)C=C(Cl)C=C1 78585 [0,1,0,0,0,1|2,0,0]=4 153 B13R1.2808 CC1=CC(Br)=CC(C)=C1CC(=O)O AC4981 [0,1,0,0,0,1|2,0,0]=4 154 B13R1.2808 CC1=CC(Cl)=CC(C)=C1CC(=O)O D74857 [0,1,0,0,0,1|2,0,0]=4 155 B13R1.53 CS(=O)(=O)C1=C(CN)C=C(Cl)C=C1 AT16939 [0,2,0,0,0,0|2,0,0]=4 156 B13R1.53 CS(=O)(=O)C1=C(CN)C=C(Cl)C=C1 AT16977 [0,2,0,0,0,0|2,0,0]=4 157 B13R1.53 CS(=O)(=O)C1=C(CO)C=C(Cl)C=C1 AT16921 [0,2,0,0,0,0|2,0,0]=4 158 B13R1.2398 COC1=CC(C)=C(Cl)C=C1C(=O)O AT26669 [0,2,0,0,0,0|1,0,0]=3 159 B13R1.2398 COC1=CC(N)=C(Cl)C=C1C(C)=O C91313 [0,2,0,0,0,0|1,0,0]=3 160 B13R1.3158 COC1=C(C(=O)O)C=CN(C)C1=O AT24871 [0,2,0,0,0,0|2,0,0]=4 161 B13R1.2809 CC1=CC(F)=C(S(=O)(=O)Cl)C(C)=C1 AT11543 [0,2,0,0,0,0|2,0,0]=4 162 B13R1.651 CC(=O)C1=CC(C#N)=C(Cl)C=C1O Y14607 [0,2,0,0,0,0|2,0,0]=4 163 B13R1.1807 COC(=O)C1=C(Br)C=C(O)C(F)=C1 AT17974 [0,2,0,0,0,0|2,0,0]=4 164 B13R1.1807 COC(=O)C1=C(F)C=C(N)C(C)=C1 97573 [0,2,0,0,0,0|2,0,0]=4 165 B13R1.1807 COC(=O)C1=C(I)C=C(Br)C(F)=C1 AT21205 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.1807 COC(=O)C1=CC(Cl)=C(C)C=C1F 87455 [0,2,0,0,0,0|1,0,0]=3 167 B13R1.1807 COC(=O)C1=CC(F)=C(C)N=C1Cl 92220 [0,2,0,0,0,0|2,0,0]=4 168 B13R1.1807 COC(=O)C1=CC(I)=C(N)C=C1F D88076 [0,2,0,0,0,0|2,0,0]=4 169 B13R1.1807 COC(=O)C1=CC(N)=C(F)C=C1C AT14706 [0,2,0,0,0,0|1,0,0]=3 170 B13R1.1807 COC(=O)C1=CC(O)=C(Br)C=C1F AT11221 [0,2,0,0,0,0|2,0,0]=4 171 B13R1.2811 CC(=O)C1=C(O)C(I)=C(F)C(Cl)=C1 AT14669 [0,2,0,0,0,0|2,0,0]=4 172 B13R1.95 C=CC1=CC(Cl)=C(C(=O)OC)C=C1 D75600 [0,2,0,0,0,0|1,0,1]=4 173 B13R1.95 COC(=O)C1=C(C)C=C(CO)C=C1 79095 [0,2,0,0,0,0|0,0,0]=2 174 B13R1.95 COC(=O)C1=NC=C(C#N)C=C1C D80160 [0,2,0,0,0,0|1,0,1]=4 175 B13R1.120 CC(=O)C1=CC(F)=C(C(=O)O)C=C1 F52498 [0,2,0,0,0,0|2,0,0]=4 176 B13R1.120 CC(C)C1=CC(N)=C(C(=O)O)C=C1 AC6797 [0,2,0,0,0,0|2,0,0]=4 177 B13R1.120 C[C@H](N)C1=CC(F)=C(C(=O)O)C=C1 AT24144 [0,2,0,0,0,0|2,0,0]=4 178 B13R1.120 C[C@H](N)C1=CC(F)=C(C(=O)O)C=C1 F16964 [0,2,0,0,0,0|2,0,0]=4 179 B13R1.428 COC1=CC(F)=C(C(=O)O)C(C)=C1 AT25792 [0,2,0,0,0,0|1,0,0]=3 180 B13R1.428 COC1=CC(I)=C(C(=O)O)C(I)=C1 AT18568 [0,2,0,0,0,0|2,0,0]=4 181 B13R1.1808 COC(=O)C1=C(Br)C(C)=C(F)C=C1 D76220 [0,2,0,0,0,0|2,0,0]=4 182 B13R1.1808 COC(=O)C1=C(Cl)C(O)=C(I)C=C1 AT12427 [0,2,0,0,0,0|2,0,0]=4 183 B13R1.1808 COC(=O)C1=CC=C(C)C(F)=C1Br D76219 [0,2,0,0,0,0|1,0,0]=3 184 B13R1.1808 COC(=O)C1=CC=C(F)C(O)=C1Br AT11219 [0,2,0,0,0,0|2,0,0]=4 185 B13R1.4656 CC1=CC(C)=C([C@@H](N)CO)C(C)=C1 D96369 [0,2,0,0,0,0|1,0,1]=4 186 B13R1.4656 COC(=O)C1=C(Cl)C=C(O)C=C1Cl AT23006 [0,2,0,0,0,0|2,0,0]=4 187 B13R1.4656 O=C(CBr)C1=C(F)C=C(O)C=C1F AC4053 [0,2,0,0,0,0|2,0,0]=4 188 B13R1.1511 NC1=C(C(=O)CCCl)C=CC(Br)=C1 80091 [0,2,0,0,0,0|2,0,0]=4 189 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E73009 [1,0,0,1,0,0|1,0,1]=4 190 B11R2.468 O=C1CC2=CC=CC(Br)=C12 AT20401 [1,0,0,1,0,0|1,0,0]=3 191 B11R2.60 CN1N=CC2=C1CCC2=O AT24582 [0,0,0,1,1,0|2,0,0]=4 192 B13R2.3683 NC1=CC2=C(C=C1)CC(=O)NC2 AT21752 [0,0,0,1,0,1|2,0,0]=4 193 B13R2.3683 O=C1CCC2=C(C=CC(Br)=N2)N1 AT10256 [0,0,0,1,0,1|2,0,0]=4 194 B13R2.3683 O=C1CCC2=C(C=CC(Cl)=N2)N1 AT10269 [0,0,0,1,0,1|2,0,0]=4 195 B13R2.3683 O=C1COC2=C(C=CC(O)=C2)N1 AT20434 [0,0,0,1,0,1|2,0,0]=4 196 B13R2.5397 CC1=CC(C)=NC2=C1NC(=O)N2 D75132 [0,0,0,1,0,1|2,0,0]=4 197 B13R2.5397 [BH3-]C1=CC(Cl)=C2NC(=O)CC2=C1 AC8887 [0,0,0,1,0,1|2,0,0]=4 198 B13R2.5397 [BH3-]C1=CC2=C(NC(=O)C2)C(C)=C1 AC8478 [0,0,0,1,0,1|1,0,0]=3 199 B13R2.5179 C=C1COCC2=C1C=CC(Br)=C2 AT16087 [0,1,0,1,0,0|2,0,0]=4 200 B13R2.5179 CC1=CC2=C(C=C1)[C@H](C)NCC2 AT22657 [0,1,0,1,0,0|1,0,1]=4 201 B13R2.5179 O=C1C=C2CCCC(=O)C2=CN1 AC7991 [0,1,0,1,0,0|2,0,0]=4 202 B13R2.5179 O=C1CCOC2=C1C=CC(Cl)=N2 AT13337 [0,1,0,1,0,0|2,0,0]=4 203 B13R2.5179 O=C1CCOC2=CC(Br)=CN=C12 AT21121 [0,1,0,1,0,0|2,0,0]=4 204 B13R2.5179 O=C1CCOC2=CC(F)=CN=C12 AT21110 [0,1,0,1,0,0|2,0,0]=4 205 B13R2.5179 O=C1CCSC2=C1C=CC(F)=C2 74748 [0,1,0,1,0,0|1,0,0]=3 206 B13R2.5179 O=C1CNCC2=C1C=CC(Br)=C2 AT26200 [0,1,0,1,0,0|1,0,0]=3 207 B13R2.5179 O=C1COCC2=C1C=CC(Cl)=C2 AT26633 [0,1,0,1,0,0|1,0,0]=3 208 B13R2.5179 O=C1NCCC2=C1C=CC(O)=N2 89004 [0,1,0,1,0,0|2,0,0]=4 209 B13R2.5187 C[C@@H]1NC(=O)C2=C1C=C(Cl)C=C2 D72989 [0,1,0,1,0,0|2,0,0]=4 210 B13R2.11634 NC1=C(Cl)C=C2C(=O)NCC2=C1 F18458 [0,1,0,1,0,0|2,0,0]=4 211 B13R2.11634 O=C1NCC2=CC(F)=C(Br)C=C12 D72269 [0,1,0,1,0,0|2,0,0]=4 212 B13R2.2130 NCC1=CC2=C(C=C1)C(=O)NC2 P13621 [0,1,0,1,0,0|1,0,0]=3 213 B13R2.5180 CC1=C(N)C=CC2=C1CCC2=O K10266 [0,1,0,1,0,0|1,0,0]=3 214 B13R2.5180 CC1=C(N)C=CC2=C1CCC2=O K10298 [0,1,0,1,0,0|1,0,0]=3 215 B13R2.11642 CC1=CC(Cl)=NC2=C1C(=O)NC2 AT20304 [0,1,0,1,0,0|2,0,0]=4 216 B13R2.11642 O=C1NCC2=CC(Br)=CC(Br)=C12 E70124 [0,1,0,1,0,0|2,0,0]=4 217 B13R2.13518 CC1=CC(C)=C(C2CNC2)C=C1 AT15447 [0,1,0,1,0,0|1,0,1]=4 218 B9R1.35 CC(=O)C1=CC(Br)=CO1 AT15600 [1,0,0,0,1,0|2,0,0]=4 219 B9R1.35 CC(=O)C1=CNC(Br)=C1 AC9410 [1,0,0,0,1,0|2,0,0]=4 220 B9R1.35 CC1=CC(C(=O)O)=CO1 AT17486 [1,0,0,0,1,0|2,0,0]=4 221 B9R1.35 CC1=COC(C(=O)O)=C1 P12603 [1,0,0,0,1,0|2,0,0]=4 222 B9R1.22 CC1=CN(C)N=C1C=O AT14213 [1,0,0,0,1,0|2,0,0]=4 223 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 D74339 [1,0,0,0,0,1|2,0,0]=4 224 B11R1.86 CC(=O)NC1=CC=CNC1=O D74338 [1,0,0,0,0,1|2,0,0]=4