0 B9R1.3 BrC1=CC=CC(=C1I)Br S110086 [0,0,0,0,0,0|2,1,0]=3 1 B9R1.3 CC1=C(C(=CC=C1)Cl)S R262153 [0,0,0,0,0,0|2,1,0]=3 2 B9R1.3 CC1=C(C(=NC=N1)O)C CBR02089 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.3 CC1=C(C=CC=C1Br)F CDS003017 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.3 CC1=C(C=CC=C1O)Cl CDS003050 [0,0,0,0,0,0|1,1,0]=2 5 B9R1.3 CC1=C(C=NC=C1Br)N CDS022526 [0,0,0,0,0,0|1,1,0]=2 6 B9R1.3 CC1=C([N+](=CC=C1)C)C S619205 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.3 CC1=CC=CC(=C1Br)Cl CDS003391 [0,0,0,0,0,0|2,1,0]=3 8 B9R1.3 CC1=CC=CC(=O)N1C T294608 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.3 CC1=CC=CC(=[N+]1C)C R255319 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.3 CC1=CC=CC(=[N+]1C)C S874248 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.3 CC1=COC=C(C1=O)C T162310 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.3 ClC1=C(C=NC=C1Br)Br ADE001379 [0,0,0,0,0,0|3,1,0]=4 13 B9R1.3 FC1=CC=NC(=C1I)F MNO000157 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.3 FC1=CN=CC(=C1Br)F SYX00175 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.3 NC1=C(C(=CN=C1)Br)O ADE000768 [0,0,0,0,0,0|2,1,0]=3 16 B9R1.3 NC1=C(C(=NC=C1)Cl)I ADE000415 [0,0,0,0,0,0|2,1,0]=3 17 B9R1.3 NC1=C(C(=NC=C1)F)Br PHB00158 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.3 NC1=C(C(=NC=C1)I)O ADE000631 [0,0,0,0,0,0|2,1,0]=3 19 B9R1.3 NC1=C(C=CC=C1Cl)I KOB0053 [0,0,0,0,0,0|2,1,0]=3 20 B9R1.3 NC1=C(C=CC=C1I)O CDS007998 [0,0,0,0,0,0|2,1,0]=3 21 B9R1.3 NC1=C(C=CC=C1O)O CDS003448 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.3 NC1=C(C=CC=C1O)O PH009922 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.3 NC1=C(C=NC=C1I)I VBP00076 [0,0,0,0,0,0|3,1,0]=4 24 B9R1.3 NC1=CC=CC(=C1Br)Cl CDS023345 [0,0,0,0,0,0|1,1,0]=2 25 B9R1.3 NC1=CC=CC(=C1Br)F CDS004255 [0,0,0,0,0,0|1,0,0]=1 26 B9R1.3 NC1=CC=CC(=C1F)Br CDS023142 [0,0,0,0,0,0|1,1,0]=2 27 B9R1.3 NC1=CC=CC(=C1N)Br CDS020072 [0,0,0,0,0,0|1,1,0]=2 28 B9R1.3 NC1=CC=CC(=C1N)F CDS011409 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.3 NC1=CC=CC(=C1N)N S915041 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.3 NC1=CC=CC(=C1O)Br CDS020010 [0,0,0,0,0,0|1,1,0]=2 31 B9R1.3 NC1=CC=CC(=C1O)Cl TMT00393 [0,0,0,0,0,0|1,1,0]=2 32 B9R1.3 NC1=NC=CC(=C1I)Cl ADE000408 [0,0,0,0,0,0|2,1,0]=3 33 B9R1.3 NC1=NC=NC(=C1Cl)Cl CDS009579 [0,0,0,0,0,0|3,1,0]=4 34 B9R1.3 OC1=C(C(=CC=C1)Cl)F CDS003101 [0,0,0,0,0,0|2,1,0]=3 35 B9R1.3 OC1=C(C=CN=C1I)Cl ADE000653 [0,0,0,0,0,0|3,1,0]=4 36 B9R1.3 SC1=CC=CC(=C1Cl)Cl R239429 [0,0,0,0,0,0|2,1,0]=3 37 B8R1.4 CC1=CC(=O)NC=C1 T162655 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.4 CC1=CC=CC(=C1)N R647047 [1,0,0,0,0,0|1,0,0]=2 39 B8R1.4 CC1=CC=CC(=O)N1 S766364 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.4 CC1=C[N+](=CC=C1)C S619396 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.4 CC1=NC(=CC=N1)N CDS014871 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.4 ClC1=CC(=CN=C1)I ADE000367 [1,0,0,0,0,0|2,1,0]=4 43 B8R1.4 ClC1=NC(=CC=C1)I ADE000334 [1,0,0,0,0,0|2,1,0]=4 44 B8R1.4 FC1=CC(=NC=N1)F CDS002862 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.4 FC1=CC=CC(=N1)Br CDS002875 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.4 NC1=CC(=CN=C1)Cl ANV00078 [1,0,0,0,0,0|1,1,0]=3 47 B8R1.4 NC1=CC(=CN=C1)I ADE000379 [1,0,0,0,0,0|1,1,0]=3 48 B8R1.4 NC1=CC(=O)N=CN1 ANV00026 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.4 NC1=CC=CC(=C1)Cl S642665 [1,0,0,0,0,0|0,1,0]=2 50 B8R1.4 NC1=CC=CC(=N1)O CDS008897 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.4 NC1=CC=NC(=C1)O CDS020248 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.4 NC1=NC(=CC=C1)I ADE000340 [1,0,0,0,0,0|1,1,0]=3 53 B8R1.4 NC1=NC(=CN=C1)Cl CDS013619 [1,0,0,0,0,0|2,1,0]=4 54 B8R1.4 O=C1C=C(C=CN1)I KOB0152 [1,0,0,0,0,0|2,1,0]=4 55 B8R1.4 OC1=CC=CC(=N1)O S458678 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.4 OC1=CN=CC(=C1)F CDS006721 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.4 OC1=CN=CC(=C1)I ADE000435 [1,0,0,0,0,0|2,1,0]=4 58 B8R1.5 CC1=C(C=NC=C1)Cl T161152 [1,0,0,0,0,0|1,1,0]=3 59 B8R1.5 CC1=CC=NN=C1Cl PHB00234 [1,0,0,0,0,0|2,1,0]=4 60 B8R1.5 CC1=CN=CC=C1N CDS003217 [1,0,0,0,0,0|1,0,0]=2 61 B8R1.5 CC1=NC=CN=C1Cl CDS013629 [1,0,0,0,0,0|2,1,0]=4 62 B8R1.5 CC1=NC=CN=C1S PH014228 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.5 C[N+]1=CC=CC=C1Cl S765678 [1,0,0,0,0,0|1,1,0]=3 64 B8R1.5 C[N+]1=CC=CN=C1N S142433 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.5 ClC1=CC=NC=C1Br CDS003116 [1,0,0,0,0,0|2,1,0]=4 66 B8R1.5 FC1=CC=CN=C1I ADE000285 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.5 FC1=CN=CN=C1S S217271 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.5 IC1=CC=CN=C1I ADE000256 [1,0,0,0,0,0|2,1,0]=4 69 B8R1.5 NC1=C(C=CC=C1)[S-] L133574 [1,0,0,0,0,0|1,0,0]=2 70 B8R1.5 NC1=C(C=CN=C1)O CDS004728 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.5 NC1=C(C=NC=C1)O ADE000632 [1,0,0,0,0,0|2,0,0]=3 72 B8R1.5 NC1=C(C=NC=N1)Br CDS020752 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.5 NC1=CC=CC=C1O S378569 [1,0,0,0,0,0|1,0,0]=2 74 B8R1.5 NC1=CC=CC=[N+]1[O-] CDS014426 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.5 NC1=CC=CN=C1O CDS007860 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.5 NC1=CC=NC=C1Cl CDS010711 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.5 O=C1C=CC=CN1[K] T160997 [1,0,0,0,0,0|3,0,0]=4 78 B8R1.5 O=C1NC=CC=C1Cl T161063 [1,0,0,0,0,0|2,1,0]=4 79 B8R1.5 OC1=C(C=CN=C1)Cl ADE000654 [1,0,0,0,0,0|2,1,0]=4 80 B8R1.5 OC1=C(C=NC=C1)I ADE000434 [1,0,0,0,0,0|2,1,0]=4 81 B8R1.5 OC1=CN=CC=C1Br CDS021897 [1,0,0,0,0,0|2,1,0]=4 82 B8R1.5 OC1=NC=CC=C1F CDS019950 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.2 CC1=C(C(=CC=C1)C#N)C S445304 [0,1,0,0,0,0|1,0,1]=3 84 B10R1.2 CC1=C(C(=CC=C1)CBr)C CDS022040 [0,1,0,0,0,0|1,1,0]=3 85 B10R1.2 CC1=C(C=CC=C1CO)Cl CDS023048 [0,1,0,0,0,0|1,1,0]=3 86 B10R1.2 CC1=C(C=CC=C1NN)Cl CBR00783 [0,1,0,0,0,0|0,1,0]=2 87 B10R1.2 CC1=C(C=CN=C1CO)Cl T137049 [0,1,0,0,0,0|2,1,0]=4 88 B10R1.2 CC1=CC=CC(=C1C)NN R436321 [0,1,0,0,0,0|1,0,0]=2 89 B10R1.2 COC1=C(C(=CC=C1)C)O L167932 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.2 COC1=C(C(=NC=C1)N)I ADE000406 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.2 COC1=C(C(=NC=C1)N)N PH019206 [0,1,0,0,0,0|3,0,0]=4 92 B10R1.2 COC1=CC=CC(=C1Cl)O CDS004291 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.2 COC1=CC=CC(=C1N)Br CDS022850 [0,1,0,0,0,0|2,1,0]=4 94 B10R1.2 COC1=CN=CC(=C1C)N ADE000538 [0,1,0,0,0,0|2,0,0]=3 95 B10R1.2 COC1=CN=CC(=C1Cl)N ADE000480 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.2 COC1=CN=CC(=C1I)N ADE000461 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.2 ClC1=C(C(=CC=C1)CBr)Cl CDS003275 [0,1,0,0,0,0|2,1,0]=4 98 B10R1.2 ClCC1=CC=CC(=C1Cl)Cl CDS013551 [0,1,0,0,0,0|2,1,0]=4 99 B10R1.2 FC1=C(C=CC=C1CBr)Cl CDS003049 [0,1,0,0,0,0|2,1,0]=4 100 B10R1.2 NNC1=CC=CC(=C1Cl)Cl S455369 [0,1,0,0,0,0|1,1,0]=3 101 B10R1.2 O=CC1=C(C(=CC=C1)O)Br CDS004521 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.2 O=CC1=CC=CC(=C1F)Br CDS017326 [0,1,0,0,0,0|2,1,0]=4 103 B10R1.2 O=CC1=CC=CC(=C1F)O PH015405 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.2 OCC1=C(C(=CC=C1)Cl)F CDS021698 [0,1,0,0,0,0|2,1,0]=4 105 B10R1.2 OCC1=CC=CC(=C1F)Br CDS016758 [0,1,0,0,0,0|2,1,0]=4 106 B10R1.22 BrC1=CC(=C(C(=C1)Br)Br)Br S943029 [0,1,0,0,0,0|2,1,0]=4 107 B10R1.22 BrC1=CC(=C(C(=C1)Br)I)Br S547263 [0,1,0,0,0,0|2,1,0]=4 108 B10R1.22 CC1=C(C(=CC(=C1)Cl)Cl)I R416231 [0,1,0,0,0,0|2,1,0]=4 109 B10R1.22 CC1=C(C(=CC(=C1)Cl)Cl)O S443786 [0,1,0,0,0,0|2,1,0]=4 110 B10R1.22 CC1=C(C=C(C=C1Br)Cl)Br S943002 [0,1,0,0,0,0|1,1,0]=3 111 B10R1.22 CC1=C(C=C(C=C1Br)Cl)N CDS023787 [0,1,0,0,0,0|0,1,0]=2 112 B10R1.22 CC1=C(C=C(C=C1F)I)F CDS021213 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.22 CC1=C(C=C(C=C1O)Br)Br S810576 [0,1,0,0,0,0|1,1,0]=3 114 B10R1.22 CC1=C(C=C(C=C1O)O)O S414913 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.22 CC1=CC(=C(C(=C1)Br)I)Br S888508 [0,1,0,0,0,0|2,1,0]=4 116 B10R1.22 CC1=CC(=C(C(=C1)Br)N)C S294144 [0,1,0,0,0,0|2,1,0]=4 117 B10R1.22 CC1=CC(=C(C(=C1)C)C)C CDS000400 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.22 CC1=CC(=C(C(=C1)C)Cl)C PH010961 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.22 CC1=CC(=C(C(=C1)C)I)C R258377 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.22 CC1=CC(=C(C(=C1)Cl)O)Cl PH009955 [0,1,0,0,0,0|2,1,0]=4 121 B10R1.22 CC1=CC(=C(C(=C1)I)O)I S633119 [0,1,0,0,0,0|2,1,0]=4 122 B10R1.22 CC1=CC(=C(C(=O)O1)C)O S763454 [0,1,0,0,0,0|3,0,0]=4 123 B10R1.22 CC1=CC(=CC(=C1F)C)Br CDS003019 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.22 CC1=CC(=CC(=C1N)C)Cl PH000327 [0,1,0,0,0,0|3,0,0]=4 125 B10R1.22 CC1=CC(=CC(=C1O)C)I S842702 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.22 CC1=CC(=CC(=C1O)N)N S943975 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.22 CC1=CC(=O)C=C(N1C)C S11003 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.22 CC1=CC(=O)N(C(=C1)N)C T324760 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.22 CC1=CC(=[N+](C(=C1)C)C)C R255408 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.22 CC1=CC(=[O+]C(=C1C)C)C S920193 [0,1,0,0,0,0|3,0,0]=4 131 B10R1.22 CC1=NC(=C(C(=C1)O)C)O PH001768 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.22 ClC1=CC(=C(C(=C1)Cl)Br)Cl S943061 [0,1,0,0,0,0|2,1,0]=4 133 B10R1.22 ClC1=CC(=C(C(=C1)Cl)Cl)Br S943037 [0,1,0,0,0,0|2,1,0]=4 134 B10R1.22 ClC1=CC(=CC(=C1Cl)Cl)Br S943045 [0,1,0,0,0,0|2,1,0]=4 135 B10R1.22 ClC1=CC(=CC(=C1I)Cl)Br S943053 [0,1,0,0,0,0|2,1,0]=4 136 B10R1.22 FC1=CC(=C(C(=C1)F)Br)Br R158321 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.22 NC1=C(C(=CC(=C1)F)Br)O CDS021903 [0,1,0,0,0,0|1,1,0]=3 138 B10R1.22 NC1=C(C(=CC(=C1)F)F)N CDS010697 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.22 NC1=C(C=C(C=C1Cl)Br)Br S676926 [0,1,0,0,0,0|2,1,0]=4 140 B10R1.22 NC1=CC(=C(C(=C1)Br)O)Cl CDS023792 [0,1,0,0,0,0|2,1,0]=4 141 B10R1.22 NC1=CC(=C(C(=C1)F)Br)F CDS000756 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.22 NC1=CC(=C(C(=C1)I)I)I PH001971 [0,1,0,0,0,0|2,1,0]=4 143 B10R1.22 NC1=CC(=CC(=C1F)F)Br CDS024554 [0,1,0,0,0,0|1,0,0]=2 144 B10R1.22 NC1=CC(=CC(=C1S)Cl)Cl PH008417 [0,1,0,0,0,0|1,1,0]=3 145 B10R1.22 OC1=C(C=C(C=C1Cl)Br)Br S676977 [0,1,0,0,0,0|2,1,0]=4 146 B10R1.22 OC1=C(C=C(C=C1Cl)Cl)I S405183 [0,1,0,0,0,0|2,1,0]=4 147 B10R1.22 [O-]C1=C(C=C(C=C1Br)Br)Br S825875 [0,1,0,0,0,0|2,1,0]=4 148 B10R1.119 CC1=C(C(=C(C=C1)Cl)N)Cl PH011039 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.119 CC1=C(C(=CC=C1Cl)N)Cl CBR00888 [0,1,0,0,0,0|1,1,0]=3 150 B10R1.119 CC1=C(C(=CC=C1F)O)Cl PH017188 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.119 CC1=C(C(=CC=C1N)Br)C CDS022788 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.119 CC1=C(C=CC(=C1Cl)O)Cl R426490 [0,1,0,0,0,0|1,1,0]=3 153 B10R1.119 CC1=C(C=C[N+](=C1C)[O-])Cl T138479 [0,1,0,0,0,0|2,1,0]=4 154 B10R1.119 CC1=C([N+](=CC=C1N)C)C S995037 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.119 CC1=CC=C(C(=C1C)Br)C T332577 [0,1,0,0,0,0|1,1,0]=3 156 B10R1.119 CC1=CC=C(C(=C1C)N)N R228389 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.119 CC1=CC=C(C(=C1F)O)F CDS021693 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.119 CC1=CC=C(C(=C1N)C)N R750859 [0,1,0,0,0,0|1,0,0]=2 159 B10R1.119 ClC1=CC=C(C(=C1Cl)Cl)I S111104 [0,1,0,0,0,0|2,1,0]=4 160 B10R1.119 ClC1=CC=C(C(=C1Cl)Cl)I S17877 [0,1,0,0,0,0|2,1,0]=4 161 B10R1.119 FC1=CC=C(C(=C1F)Br)F CDS001196 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.119 NC1=C(C(=NC=C1I)Cl)I PHB00152 [0,1,0,0,0,0|2,1,0]=4 163 B10R1.119 NC1=CC=C(C(=C1F)F)Br CDS022896 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.119 NC1=NC=C(C(=C1Cl)Cl)Cl PHB00294 [0,1,0,0,0,0|2,1,0]=4 165 B10R1.119 NC1=NC=C(C(=C1I)Cl)Br ADE000793 [0,1,0,0,0,0|2,1,0]=4 166 B10R1.119 OC1=C(C(=CC=C1F)Cl)F CDS002898 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.119 OC1=CC=C(C(=C1Cl)F)F PH017343 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.245 C#CC1=C(C=CC=C1Cl)Cl CDS021281 [0,1,0,0,0,0|1,1,1]=4 169 B10R1.245 C#CC1=C(C=CC=C1F)F CDS021025 [0,1,0,0,0,0|1,0,1]=3 170 B10R1.245 C(=O)C1=C(C=CN=C1F)Br SYX00399 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.245 C(=O)C1=C(C=CN=C1F)I SYX00351 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.245 C(=O)C1=C(C=NC=C1F)F CDS009040 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.245 CC1=C(C(=CC=C1)Br)C=O CDS024325 [0,1,0,0,0,0|1,1,1]=4 174 B10R1.245 CC1=C(C(=CC=C1)Cl)CN CDS000918 [0,1,0,0,0,0|1,1,0]=3 175 B10R1.245 CC1=CC=CC(=C1CBr)C CDS022041 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.245 CC1=CC=CC(=C1CBr)F CDS020960 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.245 CC1=CC=CC(=C1CO)C PH002994 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.245 COC1=C(C=CC=C1Br)N CDS023930 [0,1,0,0,0,0|0,1,0]=2 179 B10R1.245 COC1=C(C=CC=C1Cl)F CDS002901 [0,1,0,0,0,0|1,0,0]=2 180 B10R1.245 COC1=C(C=CN=C1Br)I ADE000177 [0,1,0,0,0,0|2,1,0]=4 181 B10R1.245 COC1=C(C=CN=C1Br)O ADE000159 [0,1,0,0,0,0|2,1,0]=4 182 B10R1.245 COC1=C(C=CN=C1C)Cl CDS024135 [0,1,0,0,0,0|2,1,0]=4 183 B10R1.245 FC1=CC=CC(=C1CS)F CDS006153 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.245 NCC1=C(C=CC=C1Cl)Cl L480827 [0,1,0,0,0,0|1,1,0]=3 185 B10R1.245 OCC1=C(C=CN=C1Cl)I ADE000565 [0,1,0,0,0,0|2,1,0]=4 186 B8R1.50 CC1=C(C(=NO1)N)C SYX00035 [0,0,0,0,1,0|3,0,0]=4 187 B7R0.3 C=C/C=C/C(C)C=C S418986 [1,0,1,0,0,0|1,0,1]=4 188 B7R1.3 CC1=CC=NC=C1 T256412 [2,0,0,0,0,0|1,0,0]=3 189 B7R1.3 CC1=CC=NC=C1 T330418 [2,0,0,0,0,0|1,0,0]=3 190 B7R1.3 NC1=CC=CC=C1 S698326 [2,0,0,0,0,0|0,0,0]=2 191 B7R1.3 NC1=CC=CC=N1 S822329 [2,0,0,0,0,0|1,0,0]=3 192 B7R1.3 NC1=CC=NN=C1 CDS006078 [2,0,0,0,0,0|2,0,0]=4 193 B7R1.3 O=C1C=CC=CN1 T160121 [2,0,0,0,0,0|2,0,0]=4 194 B7R1.3 O=C1C=CNC=C1 T161470 [2,0,0,0,0,0|2,0,0]=4 195 B7R1.3 O=C1C=CSC=C1 T162035 [2,0,0,0,0,0|2,0,0]=4 196 B7R1.3 OC1=CC=NC=C1 CDS013613 [2,0,0,0,0,0|2,0,0]=4 197 B7R1.3 S=C1C=CSC=C1 S874310 [2,0,0,0,0,0|2,0,0]=4 198 B7R1.3 [O-]C1=CC=CC=C1 CDS001581 [2,0,0,0,0,0|1,0,0]=3 199 B7R1.3 [S-]C1=CC=CC=C1 S578991 [2,0,0,0,0,0|1,0,0]=3 200 B9R1.2 C#CC1=CC(=CC=C1)Br CDS007533 [1,1,0,0,0,0|1,1,0]=4 201 B9R1.2 C(=O)C1=CC=CC(=N1)F CDS021920 [1,1,0,0,0,0|2,0,0]=4 202 B9R1.2 CC1=CC(=CC=C1)[IH2]=O T330566 [1,1,0,0,0,0|1,1,0]=4 203 B9R1.2 CC1=CC=CC(=C1)CS PH011231 [1,1,0,0,0,0|2,0,0]=4 204 B9R1.2 CC1=CC=NC(=C1)CN CDS018220 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.2 CCC1=CC(=NC=C1)N CDS001263 [1,1,0,0,0,0|2,0,0]=4 206 B9R1.2 CCC1=CC=CC(=C1)Br CDS013673 [1,1,0,0,0,0|1,1,0]=4 207 B9R1.2 CNC1=CC(=CC=C1)N S604097 [1,1,0,0,0,0|1,0,0]=3 208 B9R1.2 COC1=CC=CC(=C1)N CDS000467 [1,1,0,0,0,0|1,0,0]=3 209 B9R1.2 COC1=CC=CC(=N1)N ADE000359 [1,1,0,0,0,0|2,0,0]=4 210 B9R1.2 COC1=NC=CC(=C1)N ADE000354 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.2 CSC1=CC=CC(=C1)O KOB0118 [1,1,0,0,0,0|2,0,0]=4 212 B9R1.2 N#CC1=CC=CC(=C1)N S679151 [1,1,0,0,0,0|1,0,0]=3 213 B9R1.2 N#CC1=CC=NC(=C1)N CDS000695 [1,1,0,0,0,0|2,0,0]=4 214 B9R1.2 NCC1=CC(=CC=C1)O CDS016848 [1,1,0,0,0,0|1,0,0]=3 215 B9R1.2 NCC1=CC=CC(=N1)Br CDS015880 [1,1,0,0,0,0|1,1,0]=4 216 B9R1.2 NCC1=CN=CC(=C1)Br CDS005093 [1,1,0,0,0,0|1,1,0]=4 217 B9R1.2 NCC1=NC(=CC=C1)Br CDS009036 [1,1,0,0,0,0|1,1,0]=4 218 B9R1.2 NNC1=CC=CC(=N1)Cl SYX00272 [1,1,0,0,0,0|1,1,0]=4 219 B9R1.2 OCC1=CC=NC(=C1)F MNO000064 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.2 OCC1=CN=CC(=C1)F CDS021735 [1,1,0,0,0,0|2,0,0]=4 221 B9R1.34 CC1=CC(=CC(=C1)Br)F CDS003810 [1,1,0,0,0,0|1,0,0]=3 222 B9R1.34 CC1=CC(=CC(=N1)C)N CDS019979 [1,1,0,0,0,0|2,0,0]=4 223 B9R1.34 FC1=CC(=CC(=C1)S)F CDS003868 [1,1,0,0,0,0|1,0,0]=3 224 B9R1.34 NC1=CC(=CC(=C1)Cl)N S751774 [1,1,0,0,0,0|0,1,0]=3 225 B9R1.34 NC1=CC(=CC(=C1)F)Cl CDS002929 [1,1,0,0,0,0|0,0,0]=2 226 B9R1.34 NC1=NC(=CC(=C1)Cl)Cl CDS005457 [1,1,0,0,0,0|1,1,0]=4 227 B9R1.69 CC1=C(C=C(C=C1)Cl)N R304832 [1,1,0,0,0,0|0,1,0]=3 228 B9R1.69 CC1=C(C=C(C=C1)Cl)N S507989 [1,1,0,0,0,0|0,1,0]=3 229 B9R1.69 CC1=C(C=C(C=C1)F)O CDS003102 [1,1,0,0,0,0|1,0,0]=3 230 B9R1.69 CC1=C(C=C(C=C1)I)Cl CDS013761 [1,1,0,0,0,0|1,1,0]=4 231 B9R1.69 CC1=C(C=CC(=C1)Cl)I PH011333 [1,1,0,0,0,0|1,1,0]=4 232 B9R1.69 CC1=C(C=CC(=C1)F)S KOB0166 [1,1,0,0,0,0|1,0,0]=3 233 B9R1.69 CC1=C(C=CC(=C1)O)N S430048 [1,1,0,0,0,0|2,0,0]=4 234 B9R1.69 CC1=C(C=CC(=C1)S)F KOB0143 [1,1,0,0,0,0|2,0,0]=4 235 B9R1.69 CC1=C(C=CC(=N1)N)I ADE000318 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.69 CC1=C(C=NC(=C1)N)I ADE000313 [1,1,0,0,0,0|2,0,0]=4 237 B9R1.69 CC1=CC(=C(C=C1)Br)Cl CDS003121 [1,1,0,0,0,0|1,1,0]=4 238 B9R1.69 CC1=CC(=C(C=C1)Cl)C T332828 [1,1,0,0,0,0|2,0,0]=4 239 B9R1.69 CC1=CC(=CC=C1N)N S442275 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.69 CC1=CC(=CN=C1Br)N CDS014715 [1,1,0,0,0,0|2,0,0]=4 241 B9R1.69 CC1=CC(=CN=C1F)N CDS017686 [1,1,0,0,0,0|2,0,0]=4 242 B9R1.69 CC1=CC(=NC=C1Cl)F CDS003110 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.69 CC1=CC=C(C(=C1)Br)N S741949 [1,1,0,0,0,0|1,1,0]=4 244 B9R1.69 CC1=CC=C(C(=C1)Br)N S908630 [1,1,0,0,0,0|1,1,0]=4 245 B9R1.69 CC1=CC=C(C(=C1)F)O CDS010738 [1,1,0,0,0,0|1,0,0]=3 246 B9R1.69 CC1=CC=C(C(=C1)I)I S943894 [1,1,0,0,0,0|1,1,0]=4 247 B9R1.69 CC1=CC=C(C(=C1)N)N S446149 [1,1,0,0,0,0|1,0,0]=3 248 B9R1.69 CC1=CC=C(C=C1F)O CDS000245 [1,1,0,0,0,0|1,0,0]=3 249 B9R1.69 CC1=NC(=C(C=C1)Br)F CDS021914 [1,1,0,0,0,0|2,0,0]=4 250 B9R1.69 FC1=C(C=CC(=N1)Cl)I BCH00052 [1,1,0,0,0,0|2,0,0]=4 251 B9R1.69 FC1=CC(=CC=C1Cl)Br CDS014130 [1,1,0,0,0,0|1,0,0]=3 252 B9R1.69 FC1=CC=C(C(=C1)Cl)Br CDS004020 [1,1,0,0,0,0|1,0,0]=3 253 B9R1.69 FC1=CC=C(C(=C1)Cl)I CDS003030 [1,1,0,0,0,0|1,0,0]=3 254 B9R1.69 FC1=CC=C(C(=C1)I)Cl CDS010723 [1,1,0,0,0,0|1,0,0]=3 255 B9R1.69 FC1=CC=C(C(=C1)S)F CDS011187 [1,1,0,0,0,0|1,0,0]=3 256 B9R1.69 FC1=CC=C(C=C1Br)S CDS008156 [1,1,0,0,0,0|1,1,0]=4 257 B9R1.69 FC1=CN=C(C(=C1)I)Cl ADE000396 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.69 NC1=C(C=C(C=C1)S)F KOB0167 [1,1,0,0,0,0|1,0,0]=3 259 B9R1.69 NC1=CC(=C(C=N1)I)Cl ADE001302 [1,1,0,0,0,0|1,1,0]=4 260 B9R1.69 NC1=CC(=CN=C1Br)Br ADE000414 [1,1,0,0,0,0|1,1,0]=4 261 B9R1.69 NC1=CC(=CN=C1Br)I ADE000540 [1,1,0,0,0,0|1,1,0]=4 262 B9R1.69 NC1=CC=C(C(=C1)Br)Cl CDS020727 [1,1,0,0,0,0|0,1,0]=3 263 B9R1.69 NC1=CC=C(C(=C1)Br)F CDS001086 [1,1,0,0,0,0|0,1,0]=3 264 B9R1.69 NC1=CC=C(C(=C1)N)N PH019157 [1,1,0,0,0,0|1,0,0]=3 265 B9R1.69 NC1=CC=C(C(=C1)N)N S836168 [1,1,0,0,0,0|1,0,0]=3 266 B9R1.69 NC1=CC=C(C(=C1)O)N S579009 [1,1,0,0,0,0|1,0,0]=3 267 B9R1.69 NC1=CC=C(C(=N1)Cl)Br ADE001344 [1,1,0,0,0,0|1,1,0]=4 268 B9R1.69 NC1=CC=C(C(=N1)Cl)I ADE001343 [1,1,0,0,0,0|1,1,0]=4 269 B9R1.69 NC1=CC=C(C=C1Cl)Cl S851930 [1,1,0,0,0,0|1,1,0]=4 270 B9R1.69 NC1=NC(=CC=C1Cl)Cl R428159 [1,1,0,0,0,0|1,1,0]=4 271 B9R1.69 NC1=NC=C(C(=C1)Cl)Cl PHB00293 [1,1,0,0,0,0|1,1,0]=4 272 B9R1.69 NC1=NC=C(C=C1I)F ADE000390 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.69 OC1=CC(=C(C=C1)Br)Cl CDS001095 [1,1,0,0,0,0|1,1,0]=4 274 B9R1.69 OC1=CC(=CC=C1Cl)Br CDS003254 [1,1,0,0,0,0|1,1,0]=4 275 B9R1.69 OC1=CC=C(C(=C1)Br)Cl CDS020664 [1,1,0,0,0,0|1,1,0]=4 276 B9R1.69 OC1=NC=C(C=C1I)F ADE000397 [1,1,0,0,0,0|2,0,0]=4 277 B9R1.69 [O-]C1=CC=C(C(=C1)Cl)Cl S697400 [1,1,0,0,0,0|1,1,0]=4 278 B9R1.15 C#CC1=CC=CN=C1F CDS021219 [1,1,0,0,0,0|1,0,1]=4 279 B9R1.15 C#CC1=NC=CC=C1C CDS023892 [1,1,0,0,0,0|2,0,0]=4 280 B9R1.15 C(=O)C1=C(C=CC=C1)[O-] S17079 [1,1,0,0,0,0|1,0,1]=4 281 B9R1.15 CC1=C(C=CC=C1)NN R580260 [1,1,0,0,0,0|0,0,0]=2 282 B9R1.15 CC1=C(C=CC=C1)[IH2]=O T330531 [1,1,0,0,0,0|0,1,0]=3 283 B9R1.15 CC1=C(N=CC=C1)CCl PH010818 [1,1,0,0,0,0|1,1,0]=4 284 B9R1.15 CC1=CC=CN=C1CN CDS004048 [1,1,0,0,0,0|1,0,0]=3 285 B9R1.15 CC1=CC=NC=C1CN CDS013951 [1,1,0,0,0,0|1,0,0]=3 286 B9R1.15 CC1=CN=CC=C1C=O CDS010214 [1,1,0,0,0,0|2,0,0]=4 287 B9R1.15 CC1=NC=CC=C1CBr MNO000159 [1,1,0,0,0,0|1,1,0]=4 288 B9R1.15 CC1=NC=CC=C1CCl CBR02441 [1,1,0,0,0,0|1,1,0]=4 289 B9R1.15 CCN1C=CC=CC1=O S683159 [1,1,0,0,0,0|2,0,0]=4 290 B9R1.15 CC[N+]1=C(C=CC=C1)Br S765686 [1,1,0,0,0,0|1,1,0]=4 291 B9R1.15 CC[N+]1=C(N=CC=C1)N S140686 [1,1,0,0,0,0|2,0,0]=4 292 B9R1.15 CC[N+]1=CC=CC=C1N S142549 [1,1,0,0,0,0|1,0,0]=3 293 B9R1.15 CNC1=C(C=CC=C1)F CDS000433 [1,1,0,0,0,0|0,0,0]=2 294 B9R1.15 CNC1=NC=CC=C1Cl T169315 [1,1,0,0,0,0|1,1,0]=4 295 B9R1.15 COC1=C(C=NC=C1)I ADE000651 [1,1,0,0,0,0|1,1,0]=4 296 B9R1.15 COC1=CC=CC=C1N CDS000192 [1,1,0,0,0,0|0,0,0]=2 297 B9R1.15 COC1=CC=NC=C1Br CDS007984 [1,1,0,0,0,0|1,1,0]=4 298 B9R1.15 COC1=NC=CC=C1N CDS002836 [1,1,0,0,0,0|1,0,0]=3 299 B9R1.15 ClC1=C(C=CC=N1)CBr CDS022464 [1,1,0,0,0,0|1,1,0]=4 300 B9R1.15 N#[N+]C1=C(C=CC=C1)Cl R288675 [1,1,0,0,0,0|1,0,1]=4 301 B9R1.15 NC1=C(C=CN=C1)CO ADE000287 [1,1,0,0,0,0|1,0,0]=3 302 B9R1.15 NC1=C(C=NC=C1)C=O ADE000099 [1,1,0,0,0,0|1,0,1]=4 303 B9R1.15 NC1=C(N=CC=C1)C=O CDS022545 [1,1,0,0,0,0|1,0,1]=4 304 B9R1.15 NC1=CC=NC=C1CO ADE000311 [1,1,0,0,0,0|1,0,0]=3 305 B9R1.15 NC1=CN=CC=C1C=O ADE000254 [1,1,0,0,0,0|1,0,1]=4 306 B9R1.15 NC1=NC=CC=C1CO ADE000265 [1,1,0,0,0,0|1,0,0]=3 307 B9R1.15 NCC1=C(C=CC=C1)O CDS008020 [1,1,0,0,0,0|1,0,0]=3 308 B9R1.15 NCC1=CC=CC=C1Br T151114 [1,1,0,0,0,0|0,1,0]=3 309 B9R1.15 OCC1=C(C=NC=C1)Cl MNO000070 [1,1,0,0,0,0|1,1,0]=4 310 B9R1.15 OCC1=C(C=NC=C1)F MNO000191 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.15 OCC1=CC=CC=N1O S459240 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.15 OCC1=CC=NC=C1Br MNO000077 [1,1,0,0,0,0|1,1,0]=4 313 B9R1.15 OCC1=NC=CC=C1O R578177 [1,1,0,0,0,0|2,0,0]=4 314 B11R1.8 NCC1=C(C(=CC(=C1)F)F)F CDS002986 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.13 CC1=C(C(=CC=C1)N=C=S)C TMT00526 [0,2,0,0,0,0|1,0,1]=4 316 B11R1.13 CC1=C(C(=CC=C1)NC=O)C PH010206 [0,2,0,0,0,0|1,0,0]=3 317 B11R1.13 CC1=C(C=CC=C1Cl)NC=O S576794 [0,2,0,0,0,0|0,1,0]=3 318 B11R1.13 NCCC1=CC=CC(=C1Cl)Cl L300195 [0,2,0,0,0,0|1,1,0]=4 319 B11R1.13 O=CNC1=C(C(=CC=C1)Cl)Cl S623296 [0,2,0,0,0,0|1,1,0]=4 320 B11R1.72 CC1=CC=C(C(=C1Cl)CBr)F CDS021694 [0,2,0,0,0,0|1,0,0]=3 321 B11R1.72 CC1=CC=C(C(=C1F)C=O)F CDS001752 [0,2,0,0,0,0|1,0,1]=4 322 B11R1.72 CC1=CC=C(C(=C1F)CBr)F CDS001777 [0,2,0,0,0,0|1,0,0]=3 323 B11R1.72 CC1=CC=C(C(=C1F)CN)F CDS001922 [0,2,0,0,0,0|1,0,0]=3 324 B11R1.72 CCC1=C(C(=CC=C1F)O)Cl PH017290 [0,2,0,0,0,0|1,0,0]=3 325 B11R1.72 CCC1=C(C(=CC=C1O)F)Cl PH017315 [0,2,0,0,0,0|1,1,0]=4 326 B11R1.72 COC1=C(C(=CC=C1O)F)C PH017341 [0,2,0,0,0,0|1,0,0]=3 327 B11R1.72 COC1=C(C=CC(=C1C)O)O L300217 [0,2,0,0,0,0|2,0,0]=4 328 B11R1.72 N#CC1=C(C=CC(=C1Cl)O)F PH017310 [0,2,0,0,0,0|1,0,1]=4 329 B11R1.72 NCC1=C(C(=CC=C1F)F)F CDS002581 [0,2,0,0,0,0|1,0,0]=3 330 B11R1.72 NCC1=C(C=CC(=C1F)Cl)F CDS010757 [0,2,0,0,0,0|1,0,0]=3 331 B11R1.72 O=CC1=C(C(=CC=C1F)Br)F CDS022691 [0,2,0,0,0,0|1,0,1]=4 332 B11R1.72 O=CC1=C(C(=CC=C1F)O)F CDS012447 [0,2,0,0,0,0|1,0,1]=4 333 B11R1.72 OCC1=C(C(=CC=C1Cl)Br)F CDS024342 [0,2,0,0,0,0|1,0,0]=3 334 B11R1.159 CC1=C(C(=CC=C1)[C@H](C)N)C CDS015873 [0,2,0,0,0,0|1,0,0]=3 335 B11R1.159 CC1=C(C=CC=C1B(O)O)Cl CDS006288 [0,2,0,0,0,0|1,1,0]=4 336 B11R1.159 CC1=C(C=CC=C1C(=O)O)O PH005167 [0,2,0,0,0,0|2,0,0]=4 337 B11R1.159 CC1=C(C=CC=C1N)C(=O)N TMT00436 [0,2,0,0,0,0|1,0,0]=3 338 B11R1.159 CC1=CC=CC(=C1C)C(=O)Cl CDS001566 [0,2,0,0,0,0|1,1,0]=4 339 B11R1.159 CC1=CC=CC(=C1C)C(=O)N PH011109 [0,2,0,0,0,0|1,0,0]=3 340 B11R1.159 NC1=C(C(=CC=C1)[N+](=O)[O-])Cl CDS020839 [0,2,0,0,0,0|2,0,0]=4 341 B11R1.159 NC1=C(C=CC=C1F)C(=O)O CDS000074 [0,2,0,0,0,0|2,0,0]=4 342 B11R1.159 O=C(O)C1=CC=CC(=C1Br)F CDS002241 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.159 OB(O)C1=CC=CC(=C1Cl)F CDS011895 [0,2,0,0,0,0|2,0,0]=4 344 B11R1.265 COC1=C(C=CC=C1C=O)Br CDS023099 [0,2,0,0,0,0|1,1,0]=4 345 B11R1.265 COC1=C(C=CC=C1C=O)Cl CDS021098 [0,2,0,0,0,0|1,1,0]=4 346 B11R1.265 COC1=CN=CC(=C1OC)N ADE000479 [0,2,0,0,0,0|2,0,0]=4 347 B11R1.265 N#CC1=CC=CC(=C1CBr)F CDS023695 [0,2,0,0,0,0|0,0,1]=3 348 B11R1.267 COC1=CC=CC(=C1C)NN PH019503 [0,2,0,0,0,0|1,0,0]=3 349 B11R1.278 CC1=C(C(=C(C=C1)C=O)F)F CDS001118 [0,2,0,0,0,0|2,0,0]=4 350 B11R1.278 CC1=C(C(=C(C=C1)C=O)O)C ASX00132 [0,2,0,0,0,0|2,0,0]=4 351 B11R1.278 CC1=C(C=CC(=C1C)N=O)O L168378 [0,2,0,0,0,0|1,0,1]=4 352 B11R1.278 COC1=C(C(=C(C=C1)F)O)Cl CDS021067 [0,2,0,0,0,0|2,0,0]=4 353 B11R1.278 COC1=C(C(=C(C=C1)O)F)F CDS002829 [0,2,0,0,0,0|2,0,0]=4 354 B11R1.278 N#CC1=C(C(=C(C=C1)F)F)F T340588 [0,2,0,0,0,0|1,0,1]=4 355 B11R1.278 NCC1=C(C(=C(C=C1)F)F)F CDS002894 [0,2,0,0,0,0|1,0,0]=3 356 B11R1.278 OCC1=CC=C(C(=C1F)F)F CDS003044 [0,2,0,0,0,0|2,0,0]=4 357 B11R1.14 C#CC1=CC(=C(C(=C1)F)F)F CDS012006 [0,2,0,0,0,0|2,0,0]=4 358 B11R1.14 COC1=CC(=C(C(=C1)Br)C)Br S310824 [0,2,0,0,0,0|1,1,0]=4 359 B11R1.14 COC1=CC(=C(C(=C1)Br)O)N CDS021998 [0,2,0,0,0,0|1,1,0]=4 360 B11R1.14 NCC1=CC(=C(C(=C1)F)F)F CDS002863 [0,2,0,0,0,0|2,0,0]=4 361 B11R1.14 O=CC1=CC(=C(C(=C1)F)O)Br CDS024542 [0,2,0,0,0,0|2,0,0]=4 362 B11R1.32 CC1=C(C(=C(C(=C1)Br)C)Br)N R289779 [0,2,0,0,0,0|1,1,0]=4 363 B11R1.32 CC1=C(C(=C(C(=C1)Br)C)C)C S38084 [0,2,0,0,0,0|1,1,0]=4 364 B11R1.32 CC1=C(C(=C(C(=C1)Cl)C)C)C S35999 [0,2,0,0,0,0|1,1,0]=4 365 B11R1.32 CC1=C(C(=C(C(=C1)O)C)C)Cl S344621 [0,2,0,0,0,0|1,1,0]=4 366 B11R1.32 CC1=C(C(=C(C(=C1)O)Cl)C)Cl S412643 [0,2,0,0,0,0|1,1,0]=4 367 B11R1.32 CC1=C(C(=O)C(=CC1=O)Cl)C R163597 [0,2,0,0,0,0|2,0,0]=4 368 B11R1.32 CC1=C(C=C(C(=C1Br)O)Br)Br S548618 [0,2,0,0,0,0|1,1,0]=4 369 B11R1.32 CC1=CC(=C(C(=C1Br)C)Br)C S407445 [0,2,0,0,0,0|1,1,0]=4 370 B11R1.32 CC1=CC(=C(C(=C1C)Br)N)C S943614 [0,2,0,0,0,0|1,1,0]=4 371 B11R1.32 CC1=CC(=C(C(=C1C)C)Br)C S109738 [0,2,0,0,0,0|1,1,0]=4 372 B11R1.32 CC1=CC(=C(C(=C1C)I)C)C S38548 [0,2,0,0,0,0|1,1,0]=4 373 B11R1.32 CC1=CC(=O)C(=C(C1=O)Br)C R539902 [0,2,0,0,0,0|1,1,0]=4 374 B11R1.32 CC1=CC(=O)C(=C(C1=O)C)C PH006916 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.32 FC1=CC(=C(C(=C1Br)F)F)F S643475 [0,2,0,0,0,0|2,0,0]=4 376 B11R1.32 NC1=C(C(=C(C(=C1)F)F)F)F S752045 [0,2,0,0,0,0|1,0,0]=3 377 B11R1.32 NC1=C(C=C(C(=C1Br)Cl)Br)Cl S411523 [0,2,0,0,0,0|1,1,0]=4 378 B11R1.32 NC1=C(C=C(C(=C1Br)F)F)F R751375 [0,2,0,0,0,0|1,0,0]=3 379 B11R1.464 CC1=CC(=C(C(=C1)C)CN)C CDS021956 [0,2,0,0,0,0|2,0,0]=4 380 B11R1.464 COC1=C(C=C(C=C1C)O)C PH009142 [0,2,0,0,0,0|2,0,0]=4 381 B11R1.464 COC1=C(C=C(C=C1Cl)N)Cl PH010475 [0,2,0,0,0,0|1,1,0]=4 382 B11R1.464 COC1=C(C=C(C=C1Cl)N)F CDS021066 [0,2,0,0,0,0|1,0,0]=3 383 B11R1.464 FC1=CC(=C(C(=C1)F)CBr)F CDS014241 [0,2,0,0,0,0|1,0,0]=3 384 B11R1.464 N#CC1=C(C=C(C=C1F)O)F UPL0004 [0,2,0,0,0,0|1,0,1]=4 385 B11R1.464 NCC1=C(C=C(C=C1F)Cl)F CDS000828 [0,2,0,0,0,0|1,0,0]=3 386 B11R1.464 NCC1=C(C=C(C=C1F)F)F CDS001002 [0,2,0,0,0,0|1,0,0]=3 387 B11R1.156 CC(=O)C1=C(C=CC=C1C)C PH014537 [0,2,0,0,0,0|2,0,0]=4 388 B11R1.156 CC1=CC=CC(=C1C(=O)O)F CDS007502 [0,2,0,0,0,0|1,0,1]=4 389 B11R1.156 CC1=CC=CC(=C1[N+](=O)[O-])F MNO000069 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.156 FC1=CC=CC(=C1C(F)F)F MNO000192 [0,2,0,0,0,0|1,0,0]=3 391 B11R1.156 NC(=O)C1=C(C=CC=C1N)F CDS011322 [0,2,0,0,0,0|0,0,1]=3 392 B11R1.156 NC(=S)C1=C(C=CC=C1F)F OTV000289 [0,2,0,0,0,0|1,0,1]=4 393 B11R1.156 NC1=C(C(=CC=C1)F)[N+](=O)[O-] CDS011868 [0,2,0,0,0,0|1,0,0]=3 394 B11R1.156 O=[N+]([O-])C1=C(C=CC=C1O)F CDS004611 [0,2,0,0,0,0|2,0,0]=4 395 B11R1.605 CCOC1=C(C=CC=C1N)N S767417 [0,2,0,0,0,0|1,0,0]=3 396 B11R1.605 NC1=CC=CC(=C1CCO)Cl PH014566 [0,2,0,0,0,0|0,1,0]=3 397 B11R1.605 NCCC1=C(C=CC=C1F)F T151203 [0,2,0,0,0,0|1,0,0]=3 398 B11R1.605 NNCC1=C(C=CC=C1Cl)Cl S761540 [0,2,0,0,0,0|1,1,0]=4 399 B11R1.605 O=C=NC1=C(C=CC=C1F)Cl CDS013093 [0,2,0,0,0,0|1,0,1]=4 400 B11R1.605 OCCC1=C(C=CC=C1Cl)Cl PH011763 [0,2,0,0,0,0|1,1,0]=4 401 B9R1.11 C/C(=N\N)/C1=CC=CS1 L164542 [0,0,1,1,0,0|2,0,0]=4 402 B9R1.11 C/C(=N\O)/C1=CC=CN1 L166960 [0,0,1,1,0,0|2,0,0]=4 403 B9R1.1 NCC1=CC=C(C=C1)F R750263 [0,0,1,1,0,0|0,0,2]=4 404 B9R1.1 O=CC1=CC=C(C=N1)F CDS005163 [0,0,1,1,0,0|2,0,0]=4 405 B9R1.21 N1C(=CC=C1CC)C=O CBR01642 [0,0,1,1,0,0|1,0,1]=4 406 B11R2.106 CC1=C2C=NNC2=CC=C1 CBR00232 [0,1,0,1,0,0|1,0,1]=4 407 B11R2.106 ClC1=CC=CC2=C1C=NN2 BML00245 [0,1,0,1,0,0|0,1,1]=4 408 B11R2.106 OC1=CC=CC2=C1N=CN2 CDS008334 [0,1,0,1,0,0|1,0,1]=4