0 B11R1.21 C=C(C)C1=CC=C(C(=C1)Cl)Cl PH007056 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)N CBR02053 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)O R174114 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.21 CC(=O)C1=CC=C(C(=C1)F)O CDS002790 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.21 CC(=O)C1=CC=C(C(=C1)N)Cl JRD0473 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.21 CC(=O)C1=CC=C(C(=C1)N)F JRD0487 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N CDS009515 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.21 CC(C)C1=CC=C(C(=C1)N)O S818887 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.21 CC(C)C1=NC=C(C(=N1)Cl)F PH018925 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.21 CC(N)C1=CC=C(C(=C1)F)F CDS011131 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.21 CC(O)C1=CC=C(C(=C1)Cl)Cl S345539 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.21 CC1=C(C=C(C=C1)B(O)O)N CDS003846 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.21 CC1=C(C=C(C=C1)B(O)O)N CDS004788 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.21 CC1=C(C=C(C=C1)C(=N)N)Cl PH014636 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.21 CC1=C(C=C(C=C1)C(=N)N)F CDS015050 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.21 CC1=C(C=C(C=C1)C(=S)N)F PH015302 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.21 CC1=CC=C(C=C1C)B(O)O CDS013650 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.21 CC1=CC=C(C=C1C)C(=S)N BOG00231 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.21 CC1=CC=C(C=C1C)C(C)C S412686 [0,0,0,0,0,0|1,0,0]=1 19 B11R1.21 CC1=CC=C(C=C1Cl)C(=O)N S716782 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.21 CC1=CC=C(C=C1I)[N+](=O)[O-] S432938 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.21 CC1=CC=C(C=C1O)N(C)C PH006982 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.21 FC1=C(C=C(C=C1)C(F)F)F MNO000096 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.21 NC(=S)C1=CC=C(C(=C1)O)O BOG00242 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.21 O=C(O)C1=CC=C(C(=C1)O)Cl CDS020712 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.21 O=[N+]([O-])C1=CC=C(C(=C1)O)Br SYX00192 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.13 C=C(C)C1=CC=C(C=C1)F CDS001211 [1,0,0,0,0,0|1,0,2]=4 27 B10R1.13 CC(=O)C1=CC=C(C=N1)C CBR02273 [1,0,0,0,0,0|2,0,1]=4 28 B10R1.13 CC(=O)C1=CC=[N+](C=C1)C R228613 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.13 CC(C)C1=CC=C(C=C1)F S362034 [1,0,0,0,0,0|1,0,0]=2 30 B10R1.13 CC(C)C1=CC=C(C=C1)S R262188 [1,0,0,0,0,0|1,0,0]=2 31 B10R1.13 CC1=CC=C(C=C1)C(=N)N CDS004524 [1,0,0,0,0,0|2,0,1]=4 32 B10R1.13 CC1=CC=C(C=C1)S(=O)O T212016 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.13 CN(C)C1=CC=C(C=C1)S CDS006116 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.13 CN(C)C1=NC=C(C=C1)Br SYX00280 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.13 C[N+]1=CC=C(C=C1)[S+](C)C S887838 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.113 BrC1=CC(=CC=C1)C(Br)Br S600709 [1,0,0,0,0,0|3,0,0]=4 37 B10R1.113 C=C(C)C1=CC(=CC=C1)C PH015479 [1,0,0,0,0,0|1,0,2]=4 38 B10R1.113 CC(C)C1=CC(=CC=C1)N CDS000639 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.113 CC(C)C1=CC=CC(=C1)Br CDS003768 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.113 CC(C)C1=CC=CC(=N1)N CDS009744 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.113 CC(N)C1=CC=CC(=C1)O CDS012752 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.113 CC(O)C1=CC=CC(=N1)N PH018818 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.113 CC(O)C1=C[N+](=CC=C1)[O-] S668419 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.113 CC1=CC(=CC=C1)C(C)N CDS020205 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.113 CC1=CC(=CC=C1)[C@H](C)N CDS015842 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.113 CC1=CC=CC(=C1)N(C)N PH012296 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.113 CN(C)C1=CC=CC(=C1)Cl S428612 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.113 CN(C)C1=CC=CC(=C1)N OTV000176 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.113 CN(C)C1=CC=CC(=N1)Br CDS004323 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.113 CN(N)C1=CC=CC(=C1)Br PH012297 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.113 FC1=CC=CC(=C1)C(F)F MNO000026 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.113 N=C(N)C1=CC=CC(=C1)O PH015280 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.113 NC1=CC(=CC=C1)C(F)F MNO000180 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.176 CC1=C(C=C(C=C1)CN)C CDS002514 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.176 CC1=C(C=CC(=C1)CBr)F CDS002874 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.176 CC1=C(C=CC(=C1)CN)F CDS003159 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.176 CC1=CC=C(C=C1C)C#N S454001 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.176 CC1=CC=C(C=C1C)[Hg]Cl S881147 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.176 CCC1=CC=C(C(=C1)N)O TMT00004 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.176 CC[N+]1=CC=C(C(=C1)C)C S621005 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.176 COC1=CC(=C(C=C1)Br)F CDS003153 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.176 COC1=CC(=C(C=C1)O)C T276596 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.176 COC1=CC=C(C(=C1)Br)N CDS022893 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.176 COC1=CC=C(C(=C1)C)Cl S514284 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.176 COC1=CC=C(C(=C1)N)Br CDS020665 [1,0,0,0,0,0|3,0,0]=4 66 B10R1.176 COC1=CC=C(C(=C1)O)Cl S452114 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.176 COC1=CC=C(C(=C1)[S-])I ANV00045 [1,0,0,0,0,0|2,1,0]=4 68 B10R1.176 CSC1=CC=C(C(=C1)C)O S533777 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.176 CSC1=CC=C(C(=C1)Cl)Cl S696323 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.176 CSC1=CC=C(C(=C1)O)N S883239 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.176 ClC1=CC(=CC=C1Br)CBr MNO000028 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.176 FC1=C(C=C(C=C1)CBr)Cl CDS003168 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.176 FC1=CC(=CC=C1Cl)CBr CDS019938 [1,0,0,0,0,0|3,0,0]=4 74 B10R1.176 FC1=CC=C(C=C1F)CS CDS003759 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.176 N#CC1=CC=C(C(=C1)O)F CDS022789 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.176 NCC1=CC=C(C(=C1)Br)F CDS001554 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.176 OCC1=CC(=C(C=C1)Br)Br PH010512 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.176 OCC1=CC(=C(C=N1)O)O CBR00377 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.176 OCC1=CC=C(C(=C1)F)Cl CDS010758 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.176 [C-]#[N+]C1=CC=C(C(=C1)C)C PH014891 [1,0,0,0,0,0|2,0,1]=4 81 B12R1.23 CC1=CC=C(C=C1Br)C(C)(C)C S866571 [0,1,0,0,0,0|1,0,0]=2 82 B12R1.23 CC1=CC=C(C=C1Br)C(F)(F)F CDS000804 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.23 CC1=CC=C(C=C1O)C(C)(C)C PH002954 [0,1,0,0,0,0|0,0,0]=1 84 B12R1.48 CC(C)C1=CC=C(C(=C1)F)CN PH019497 [0,1,0,0,0,0|1,0,0]=2 85 B12R1.48 CC(C)C1=CC=C(C(=N1)Cl)C#N CBR01456 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.48 CC1=CC(=CC=C1C=O)N(C)C PH010205 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)N PH011636 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.48 COC1=CC=C(C=C1O)B(O)O CDS019414 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.56 CC(C)C1=CC(=C(C=C1)O)C=O ASX00021 [0,1,0,0,0,0|1,0,1]=3 90 B12R1.56 CC1=CC=C(C=C1CO)[N+](=O)[O-] S310832 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.56 CNC1=CC(=CC=C1C)C(C)C S893048 [0,1,0,0,0,0|1,0,0]=2 92 B12R1.56 COC1=CC(=CC=C1C)B(O)O CDS020070 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)C)C S413607 [0,1,0,0,0,0|2,0,1]=4 94 B12R1.232 CC(=O)C1=CC(=C(C=C1C)C)N S764752 [0,1,0,0,0,0|2,0,1]=4 95 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)C PH010635 [0,1,0,0,0,0|2,0,1]=4 96 B12R1.232 CC(=O)C1=CC(=C(C=C1O)C)O R151963 [0,1,0,0,0,0|1,0,1]=3 97 B12R1.232 CC1=C(C=C(C(=C1)O)C(C)C)N R397687 [0,1,0,0,0,0|1,0,0]=2 98 B12R1.232 CC1=C(C=C(C(=C1)O)C(C)C)N S565636 [0,1,0,0,0,0|1,0,0]=2 99 B12R1.232 CC1=CC(=C(C=C1Br)C(C)C)O OTV000984 [0,1,0,0,0,0|1,0,0]=2 100 B12R1.367 CC1=C(C=C(C=C1)C(=O)CCl)C OTV000344 [0,1,0,0,0,0|2,0,1]=4 101 B12R1.367 CCC(=O)C1=CC=C(C(=C1)C)C OTV000603 [0,1,0,0,0,0|2,0,1]=4 102 B12R1.367 CCC(=O)C1=CC=C(C(=C1)O)O PH011570 [0,1,0,0,0,0|2,0,1]=4 103 B12R1.367 CCC(C)C1=CC=C(C(=C1)Br)O PH010070 [0,1,0,0,0,0|2,0,0]=3 104 B12R1.367 CCC(C)C1=CC=C(C(=C1)N)O S626791 [0,1,0,0,0,0|2,0,0]=3 105 B12R1.367 CCC(C)C1=CC=C(C(=C1)O)O PH007367 [0,1,0,0,0,0|1,0,0]=2 106 B12R1.367 CNC(=O)C1=CC(=C(C=C1)C)N CBR00280 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.367 COC(=O)C1=CC(=C(C=C1)C)C PH000182 [0,1,0,0,0,0|2,0,1]=4 108 B12R1.367 COC(=O)C1=CC(=C(C=C1)N)O CDS014285 [0,1,0,0,0,0|2,0,1]=4 109 B12R1.893 CC1=C(C(=C(C=C1)C(C)C)O)O S351784 [0,1,0,0,0,0|0,0,0]=1 110 B12R1.893 CC1=CC=C(C(=C1N)C)C(C)C S775371 [0,1,0,0,0,0|1,0,0]=2 111 B12R1.1005 CN(C)C1=CC(=C(C(=C1)Cl)O)Cl S596345 [0,1,0,0,0,0|3,0,0]=4 112 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Cl S753084 [0,0,0,0,0,1|2,0,1]=4 113 B12R1.19 CC(=O)NC1=CC=C(C(=C1)N)C CBR00068 [0,0,0,0,0,1|2,0,1]=4 114 B12R1.19 CC(=O)OC1=CC(=C(C=C1)C)C S240591 [0,0,0,0,0,1|2,0,1]=4 115 B9R1.1 CC1=CC=C(C=C1)CS S369497 [2,0,0,0,0,0|1,0,0]=3 116 B9R1.1 CC1=CC=C(C=C1)S[TlH2] S828378 [2,0,0,0,0,0|2,0,0]=4 117 B9R1.1 CC1=CC=C(C=C1)[Hg]Cl S706736 [2,0,0,0,0,0|2,0,0]=4 118 B9R1.1 CC1=CC=C(N=C1)CN CDS009272 [2,0,0,0,0,0|2,0,0]=4 119 B9R1.1 CCC1=CC=[N+](C=C1)[O-] S869325 [2,0,0,0,0,0|2,0,0]=4 120 B9R1.1 CNC1=CC=C(C=C1)N TMT00162 [2,0,0,0,0,0|2,0,0]=4 121 B9R1.1 CNC1=CC=C(C=C1)[O-] R580708 [2,0,0,0,0,0|2,0,0]=4 122 B9R1.1 COC1=CC=[N+](C=C1)C S523216 [2,0,0,0,0,0|2,0,0]=4 123 B9R1.1 CSC1=CC=C(C=C1)Cl S633658 [2,0,0,0,0,0|2,0,0]=4 124 B9R1.1 CSC1=CC=C(C=C1)N S418595 [2,0,0,0,0,0|2,0,0]=4 125 B9R1.1 NCC1=CC=C(C=C1)F R750263 [2,0,0,0,0,0|2,0,0]=4 126 B9R1.1 NCC1=CC=C(C=C1)I CDS000797 [2,0,0,0,0,0|2,0,0]=4 127 B9R1.6 CC(Br)C1=NC=CC=C1 CDS022641 [2,0,0,0,0,0|2,0,0]=4 128 B9R1.6 CC(C)C1=CC=NC=C1 R751863 [2,0,0,0,0,0|1,0,0]=3 129 B9R1.6 CC(N)C1=CC=CN=C1 BOG00119 [2,0,0,0,0,0|2,0,0]=4 130 B9R1.6 CC(N)C1=CC=CN=C1 CDS005298 [2,0,0,0,0,0|2,0,0]=4 131 B9R1.6 CC(S)C1=CC=CC=C1 CDS000677 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.6 CN(N)C1=CC=CC=C1 S416320 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.6 C[Te+](C)C1=CC=CC=C1 S14878 [2,0,0,0,0,0|1,0,0]=3 134 B9R1.2 CC1=CC=CC(=C1)CS PH011231 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.2 CCC1=CC(=NC=C1)Br CDS011534 [2,0,0,0,0,0|2,0,0]=4 136 B9R1.2 CCC1=CC(=NC=C1)N CDS001263 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.2 CCC1=CC=CC(=C1)Br CDS013673 [2,0,0,0,0,0|1,0,0]=3 138 B9R1.2 CCC1=NC(=CC=C1)C S580031 [2,0,0,0,0,0|2,0,0]=4 139 B9R1.2 CNC1=CC(=CC=C1)N S604097 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.2 COC1=CC=CC(=C1)N CDS000467 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.2 COC1=CN=CC(=C1)O ADE000384 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.2 CSC1=CC=CC(=C1)O KOB0118 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.2 NCC1=CC(=CC=C1)O CDS016848 [2,0,0,0,0,0|1,0,0]=3 144 B9R1.69 CC1=C(C=C(C=C1)Cl)N R304832 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.69 CC1=C(C=C(C=C1)Cl)N S507989 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.69 CC1=C(C=C(C=C1)F)O CDS003102 [2,0,0,0,0,0|1,0,0]=3 147 B9R1.69 CC1=C(C=C(C=C1)I)Cl CDS013761 [2,0,0,0,0,0|2,0,0]=4 148 B9R1.69 CC1=CC(=C(C=C1)Br)Cl CDS003121 [2,0,0,0,0,0|2,0,0]=4 149 B9R1.69 CC1=CC(=C(C=C1)Cl)C T332828 [2,0,0,0,0,0|2,0,0]=4 150 B9R1.69 CC1=CC=C(C(=C1)Br)N S741949 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.69 CC1=CC=C(C(=C1)Br)N S908630 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.69 CC1=CC=C(C(=C1)F)O CDS010738 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.69 CC1=CC=C(C(=C1)I)I S943894 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.69 CC1=CC=C(C(=C1)N)N S446149 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.69 CC1=CC=C(C=C1F)O CDS000245 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.69 CC1=CN=C(C(=C1)O)Cl ADE000745 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.69 NC1=CC=C(C(=C1)O)N S579009 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.69 OC1=CC(=CC=C1Cl)Br CDS003254 [2,0,0,0,0,0|2,0,0]=4 159 B11R1.3 C#CC1=CC=C(C=C1)C(C)C CDS003828 [1,1,0,0,0,0|0,0,1]=3 160 B11R1.3 CC(C)C1=CC=C(C=C1)CN L481181 [1,1,0,0,0,0|0,0,0]=2 161 B11R1.3 CC(C)C1=CC=C(C=C1)CN S362883 [1,1,0,0,0,0|0,0,0]=2 162 B11R1.3 CCC1=CC=C(C=C1)C(C)N CBR00761 [1,1,0,0,0,0|1,0,0]=3 163 B11R1.3 CCC1=CC=C(C=C1)C(C)N OTV000097 [1,1,0,0,0,0|1,0,0]=3 164 B11R1.3 COC1=CCC(=CC1)C(C)C T209813 [1,1,0,0,0,0|0,0,2]=4 165 B11R1.3 ClCC1=CC=C(C=C1)C(Cl)Cl PH007301 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.19 CC(C)(C)C1=CC=C(C=N1)O CDS010096 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.19 CC(C)(C)C1=CC=[N+](C=C1)[O-] S748013 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Cl OTV000619 [1,1,0,0,0,0|1,0,0]=3 169 B11R1.19 CC(C)(N)C1=CC=C(C=C1)F OTV000626 [1,1,0,0,0,0|1,0,0]=3 170 B11R1.19 CC1=CC=C(C=C1)C(C)(C)N PH010321 [1,1,0,0,0,0|0,0,0]=2 171 B11R1.19 CC1=CC=C(C=C1)[Te](C)(Br)Br S200956 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.19 CC1=CC=C(C=C1)[Te](C)(C)I S200972 [1,1,0,0,0,0|1,0,0]=3 173 B11R1.19 CC1=CC=C(C=C1)[Te](C)(Cl)Cl S200948 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.19 C[Si](C)(C)C1=CC=C(C=C1)O S757365 [1,1,0,0,0,0|1,1,0]=4 175 B11R1.22 BrCC(Br)C1=CC=C(C=C1)Br S568422 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.22 CC1=CC=C(C=C1)/C(=N/N)/C S323020 [1,1,0,0,0,0|1,0,1]=4 177 B11R1.22 CC1=CC=C(C=C1)/C(=N\O)/C S682802 [1,1,0,0,0,0|1,0,1]=4 178 B11R1.22 CCC(Cl)C1=CC=C(C=C1)C S722235 [1,1,0,0,0,0|1,0,0]=3 179 B11R1.22 CCC(N)C1=CC=C(C=C1)C CBR02307 [1,1,0,0,0,0|1,0,0]=3 180 B11R1.22 CCC(N)C1=CC=C(C=C1)F CDS005688 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.22 CCC(N)C1=CC=C(C=C1)O CBR00896 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.22 CCC(O)C1=CC=C(C=C1)Br S434892 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl S434884 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.22 CCC(O)C1=CC=C(C=C1)F S434876 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.22 CC[C@@H](O)C1=CC=C(C=C1)Cl PH018690 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.22 CC[C@H](O)C1=CC=C(C=C1)Cl PH018691 [1,1,0,0,0,0|2,0,0]=4 187 B11R1.22 CNC(=O)C1=CC=C(C=C1)C R580023 [1,1,0,0,0,0|1,0,1]=4 188 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl CBR02474 [1,1,0,0,0,0|1,0,0]=3 189 B11R1.22 NC(CF)C1=CC=C(C=C1)F CVT00026 [1,1,0,0,0,0|2,0,0]=4 190 B11R1.22 NC(CO)C1=CC=C(C=C1)Br CDS023854 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.166 CC(N)C1=CC=C(C=C1Cl)Cl CDS000450 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.166 CC(O)C1=CC=C(C=C1Cl)Cl R161403 [1,1,0,0,0,0|2,0,0]=4 193 B11R1.166 CC(O)C1=CC=C(C=C1Cl)Cl S463965 [1,1,0,0,0,0|2,0,0]=4 194 B11R1.166 CC1=CC=C(C(=C1)Br)C(C)C S406864 [1,1,0,0,0,0|0,0,0]=2 195 B11R1.166 CC1=CC=C(C(=C1)Cl)N(C)C S504149 [1,1,0,0,0,0|1,0,0]=3 196 B11R1.166 CC1=CC=C(C(=C1)S)C(C)C PH007971 [1,1,0,0,0,0|0,0,0]=2 197 B11R1.166 CN(C)C1=C(C=C(C=C1)Br)N CBR01423 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.166 CN(C)C1=C(C=C(C=C1)N)Cl CBR00671 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.166 CN(C)C1=CC=C(C=C1N)Br CDS022330 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.166 C[C@@H](O)C1=CC=C(C=C1Cl)F CDS023126 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.166 C[C@H](O)C1=CC=C(C=C1Cl)F CDS023125 [1,1,0,0,0,0|2,0,0]=4 202 B11R1.23 CCC(=O)C1=CC=CC(=C1)O PH010905 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.23 CC[C@@H](O)C1=CC(=CC=C1)F PH018824 [1,1,0,0,0,0|2,0,0]=4 204 B11R1.23 CC[C@H](O)C1=CC(=CC=C1)F PH018897 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.23 CNC(=O)C1=CC(=CC=C1)O EME00408 [1,1,0,0,0,0|1,0,1]=4 206 B11R1.23 CNN(C)C1=CC=CC(=C1)Br PH012310 [1,1,0,0,0,0|2,0,0]=4 207 B11R1.23 NC(CF)C1=CC(=CC=C1)Br CVT00033 [1,1,0,0,0,0|2,0,0]=4 208 B11R1.23 OC1=CC=CC(=C1)C(CN)O TMT00167 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.74 CC1=CC(=CC(=C1)C(C)C)C S369373 [1,1,0,0,0,0|1,0,0]=3 210 B11R1.74 CN(C)C1=CC(=CC(=C1)Cl)Cl S886807 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.155 CC(C)(C)C1=CC(=CC=C1)N CDS013665 [1,1,0,0,0,0|1,0,0]=3 212 B11R1.155 CC(C)(O)C1=CC(=CC=C1)Br BML00258 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.155 CC(C)(O)C1=CN=CC(=C1)Br PH007865 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.155 CC(C)(O)C1=C[N+](=CC=C1)[O-] S668338 [1,1,0,0,0,0|1,0,1]=4 215 B11R1.159 CC(=O)C1=CC=CC(=C1N)O CDS000114 [1,1,0,0,0,0|1,0,1]=4 216 B11R1.159 CC1=C(C(=CC=C1)[C@H](C)N)C CDS015873 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.167 CC(C)C1=CC(=CC=C1O)O S841269 [1,1,0,0,0,0|0,0,0]=2 218 B11R1.167 CC(O)C1=C(C=CC(=C1)F)O CDS021193 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.167 CC(O)C1=CC(=CC=C1Cl)Cl S546992 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N CBR01396 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.167 CC1=CC=C(C(=C1)N(C)C)Br S820725 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.167 CC1=CC=C(C=C1N(C)C)Cl S504246 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.266 CC(C)C1=CC=CC(=C1)C=O CDS004820 [1,1,0,0,0,0|0,0,1]=3 224 B11R1.266 CN(C)C1=CC(=CC=C1)C#N S869449 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.266 COC1=CC(=CC=C1)C(C)O S460761 [1,1,0,0,0,0|1,0,0]=3 226 B11R1.266 COC1=CC(=CC=C1)N(C)C CDS001202 [1,1,0,0,0,0|1,0,0]=3 227 B11R1.266 COC1=CC=CC(=C1)C(C)N CDS002381 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.14 COC1=CC(=C(C(=C1)Br)C)Br S310824 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.192 CC1=CC=C(C=C1C)CCN CDS003135 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.192 CC1=CC=C(C=C1C)CON PH013762 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.192 CCCC1=CC=C(C(=C1)N)O R703311 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.192 CCC[N+]1=CC=C(C(=C1)C)C S635464 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.192 CCOC1=CC=C(C(=C1)N)Cl PH004977 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.192 CCOC1=CC=C(C(=C1)N)N CDS007491 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl PH010199 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.192 N#CCC1=CC(=C(C=C1)O)O PH005053 [1,1,0,0,0,0|1,0,1]=4 237 B11R1.192 OCCC1=CC(=C(C=C1)F)Cl CDS022215 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.192 OCCC1=CC=C(C(=C1)Br)O S739227 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.277 CC1=CC(=C(C=C1CCl)C)C S663352 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.277 CC1=CC(=C(C=C1CO)C)C PH015738 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.277 CCC1=C(C=C(C(=C1)C)C)O S360961 [1,1,0,0,0,0|1,0,0]=3 242 B11R1.277 CCC1=C(C=C([N+](=C1)[O-])C)N S320536 [1,1,0,0,0,0|1,0,1]=4 243 B11R1.277 CCC1=CC(=C(C=C1C)C)C S504343 [1,1,0,0,0,0|1,0,0]=3 244 B11R1.277 COC1=CC(=C(C=C1N)C)Cl PH011485 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.278 COC1=C(C(=C(C=C1)F)O)Cl CDS021067 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.278 COC1=CC=C(C(=C1O)O)Br L134910 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.279 BrCC1=CC=C(C(=C1)Br)CBr T306096 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.279 CCC1=CC(=C(C=C1)CC)N PH010292 [1,1,0,0,0,0|1,0,0]=3 249 B11R1.279 CCC1=CC(=C(C=C1)CN)F PH018848 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.279 COC1=CC(=C(C=C1)OC)O PH002885 [1,1,0,0,0,0|1,0,0]=3 251 B11R1.279 COC1=CC=C(C(=C1)C)SC S323705 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.279 COC1=CC=C(C(=C1)F)CCl CDS022915 [1,1,0,0,0,0|2,0,0]=4 253 B11R1.279 COC1=CC=C(C=C1Br)SC PH001313 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.279 COC1=CC=C(C=C1C)CO PH017423 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.279 COC1=CC=C(C=C1Cl)CS PH002997 [1,1,0,0,0,0|2,0,0]=4 256 B11R1.280 COC1=CC(=C(C=C1)Br)CO PH010837 [1,1,0,0,0,0|2,0,0]=4 257 B11R1.280 COC1=CC(=C(C=C1)Cl)CO TMT00626 [1,1,0,0,0,0|2,0,0]=4 258 B11R1.280 COC1=CC(=CC=C1F)CO CDS013926 [1,1,0,0,0,0|2,0,0]=4 259 B13R1.510 CC1=C(C=C(C=C1)C(=O)C(C)Br)C OTV000775 [0,1,0,0,0,1|2,0,0]=4 260 B13R1.510 CC1=CC=C(C=C1Br)C(=O)N(C)C S100749 [0,1,0,0,0,1|2,0,0]=4 261 B13R1.2879 CCC(N)CC1=CC(=C(C=C1)C)O T340685 [0,1,0,0,0,1|1,0,0]=3 262 B13R1.38 C(=O)C1=CC=C(C=C1O)C(C)(C)C CDS004791 [0,2,0,0,0,0|0,0,1]=3 263 B13R1.38 CC(C)(C)C1=CC(=C(C=C1)CN)Cl PH015945 [0,2,0,0,0,0|1,0,0]=3 264 B13R1.38 CC(C)(C)C1=CC(=C(C=C1)CN)O PH015922 [0,2,0,0,0,0|0,0,0]=2 265 B13R1.50 CC(C)(C)C1=CC(=C(C=C1)O)CN PH008833 [0,2,0,0,0,0|2,0,0]=4 266 B13R1.50 COC1=CC(=CC=C1O)C(C)(C)C T287008 [0,2,0,0,0,0|1,0,0]=3 267 B13R1.272 CC(C)(CN)C1=CC=C(C(=C1)Cl)Cl CDS023678 [0,2,0,0,0,0|2,0,0]=4 268 B13R1.272 CCC(C)(C)C1=CC=C(C(=C1)Cl)O S565989 [0,2,0,0,0,0|2,0,0]=4 269 B13R1.877 CC(C)(C)C1=CC(=O)C(=CC1=O)Cl R164070 [0,2,0,0,0,0|1,0,1]=4 270 B13R1.884 CC1=C(C(=C(C=C1)C(C)(C)C)O)O S367168 [0,2,0,0,0,0|0,0,0]=2 271 B13R1.7922 CC(C)(C)C1=CC(=C(C(=C1)Br)O)Br PH002079 [0,2,0,0,0,0|2,0,0]=4 272 B13R1.7922 CC(C)(C)C1=CC(=C(C(=C1)Cl)O)Cl PH007149 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.7922 CC(C)(C)C1=CC(=C(C(=C1)N)O)Cl R703214 [0,2,0,0,0,0|2,0,0]=4 274 B13R1.120 CN(C)C1=CC=C(C(=C1)O)C(=O)O S462195 [0,2,0,0,0,0|1,0,1]=4 275 B13R1.144 CC1=C(C=CC(=C1)C(C)C)CCO PH014700 [0,2,0,0,0,0|1,0,0]=3 276 B13R1.144 CNCC1=CC=C(C=C1F)C(C)C PH019050 [0,2,0,0,0,0|1,0,0]=3 277 B13R1.3088 COC1=CC=C(C=C1O)/C(=N/O)/C S80390 [0,2,0,0,0,0|1,0,1]=4 278 B13R1.3088 COC1=CC=C(C=C1O)C(O)C#N S114057 [0,2,0,0,0,0|1,0,1]=4 279 B13R1.3091 C(=O)C1=C(C=C(C=C1)N(C)C)OC R276847 [0,2,0,0,0,0|1,0,1]=4 280 B13R1.3096 COC1=C(C(=C(C=C1)C(=O)C)O)O TMT00632 [0,2,0,0,0,0|1,0,1]=4 281 B13R1.13 CC(C)C1=CC=C(C(=C1)C(C)C)Br S38157 [0,2,0,0,0,0|2,0,0]=4 282 B13R1.354 CC1=C(C=C(C=C1)C(C)C)NC=O S721646 [0,2,0,0,0,0|0,0,1]=3 283 B13R1.651 CC1=C(C=C(C(=C1)O)C(C)C)N=O S953520 [0,2,0,0,0,0|0,0,1]=3 284 B13R1.3230 CC1=CC=C(C(=C1C=O)O)C(C)C ASX00139 [0,2,0,0,0,0|0,0,1]=3 285 B13R1.3230 CC\1=CC=C(C(=O)/C1=N/O)C(C)C R397059 [0,2,0,0,0,0|0,0,0]=2 286 B13R1.2398 COC1=CC(=C(C=C1C(C)C)Br)C OTV000707 [0,2,0,0,0,0|1,0,0]=3 287 B13R1.2398 COC1=CC(=C(C=C1C(C)C)Cl)C S720410 [0,2,0,0,0,0|1,0,0]=3 288 B11R1.53 CC(C)C1=CC=CC=C1C=O CDS004427 [0,0,1,1,0,0|0,0,2]=4 289 B11R2.35 BrC1=CC=CC(=C1)C2CC2 MNO000086 [1,0,0,1,0,0|1,0,0]=3 290 B11R2.35 NC1=CC=CC(=C1)C2CC2 CDS022395 [1,0,0,1,0,0|1,0,0]=3 291 B11R2.117 CC1=CC=C2CC(C2=N1)C T174130 [1,0,0,1,0,0|2,0,0]=4 292 B13R2.430 CC(O)C1=CC=C2OCOC2=C1 CDS012449 [0,1,0,1,0,0|1,0,0]=3 293 B9R1.35 CC1=CC=C(S1)C(C)N CDS012543 [1,0,0,0,1,0|2,0,0]=4 294 B11R1.20 CC(=CC1=CC=C(C=C1)Cl)C S428086 [1,0,0,0,0,1|1,0,1]=4 295 B11R1.20 CC(=O)SC1=CC=C(C=C1)C S836516 [1,0,0,0,0,1|1,0,1]=4 296 B11R1.20 CC(C)OC1=CC=C(C=C1)Br S671118 [1,0,0,0,0,1|1,0,0]=3 297 B11R1.20 CC(C)OC1=CC=C(C=C1)N CDS002559 [1,0,0,0,0,1|1,0,0]=3 298 B11R1.20 CC(C)OC1=CC=C(C=C1)N PH011325 [1,0,0,0,0,1|1,0,0]=3 299 B11R1.20 CC(C)SC1=CC=C(C=C1)Cl PH000601 [1,0,0,0,0,1|1,0,0]=3 300 B11R1.20 CN(C)CC1=CC=C(C=C1)Br PH012027 [1,0,0,0,0,1|2,0,0]=4 301 B11R1.157 CC(N)CC1=CC=CC(=C1)Br CDS022739 [1,0,0,0,0,1|2,0,0]=4 302 B11R1.157 CC1=CC(=CC=C1)NC(C)C S657476 [1,0,0,0,0,1|1,0,0]=3 303 B11R1.157 OC1=CC=CC(=C1)OC(F)F CDS005791 [1,0,0,0,0,1|2,0,0]=4 304 B13R1.511 CN(C)CCC1=CC=C(C(=C1)O)O PH013462 [0,0,0,0,0,2|2,0,0]=4