0 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 CS-0060836 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.61 CC(=O)C1=CC=NC=C1N CS-0060851 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.61 CC(=O)C1=NC=CC=C1C CS-0092057 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.61 CC(=O)C1=NC=CC=C1Cl CS-0052888 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.61 CC(=O)C1=NC=CC=C1O CS-W019613 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.61 CC(=O)C1=NC=CN=C1Cl CS-0052889 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.61 CC(=O)C1=NC=NC=C1C CS-0102215 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.61 CC(N)C1=C(F)C=CC=N1 CS-0091419 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.61 CC(N)C1=CC=CC=C1Br CS-0061054 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.61 CC1=C(C(N)=O)C=CC=N1 CS-0061159 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.61 CC1=CC=CN=C1[C@H](C)N CS-0069075 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] CS-0051266 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.61 CC1=CC=NC=C1C(N)=O CS-0061336 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.61 CC1=CC=NC=C1[N+](=O)[O-] CS-W002247 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br CS-0036643 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.61 C[C@@H](O)C1=CC=CC=C1F CS-0085730 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.61 C[C@H](O)C1=CC=CC=C1N CS-0093936 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.61 N=C(N)C1=C(Br)C=CC=N1 CS-0060324 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.61 NC(=O)C1=C(N)C=CN=C1 CS-W018959 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.61 NC(=O)C1=CC=CN=C1Cl CS-0030384 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.61 NC(=O)C1=CC=CN=C1O CS-0081575 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.61 NC1=CC=CN=C1C(=O)O CS-W002358 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.61 O=C(O)C1=NC=NC=C1F CS-0050473 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.6 C=C(C)C1=NC=CC=C1 CS-0059949 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.6 CC(=O)C1=CC=NN=C1 CS-W018948 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.6 CN(N)C1=CC=CN=C1 CS-0089162 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.6 N=C(N)C1=NC=CC=N1 CS-0088245 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0035271 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.15 C=CC1=CC=CC=C1C CS-0110436 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.15 CC1=CC=NC=C1CN CS-0053195 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.15 CCC1=NC=CC=C1O CS-0036687 [1,0,0,0,0,0|2,0,1]=4 31 B9R1.15 CNC1=CC=CC=C1N CS-W007682 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.15 COC1=CC=CC=C1Cl CS-W018270 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.15 COC1=NC=CC=C1O CS-0096331 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.15 NC1=CN=CN=C1C=O CS-0056612 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.15 NCC1=C(Cl)C=CN=C1 CS-0047558 [1,0,0,0,0,0|2,0,1]=4 36 B9R1.15 NCC1=CC=CC=C1O CS-0080161 [1,0,0,0,0,0|0,0,1]=2 37 B9R1.15 NCC1=CC=CC=C1O CS-D1655 [1,0,0,0,0,0|0,0,1]=2 38 B9R1.15 NCC1=CC=CN=C1F CS-0112238 [1,0,0,0,0,0|2,0,1]=4 39 B9R1.15 NCC1=CC=CNC1=O CS-0109597 [1,0,0,0,0,0|1,0,2]=4 40 B9R1.15 NCC1=NC=CC=C1F CS-0053866 [1,0,0,0,0,0|2,0,1]=4 41 B9R1.15 NNC1=C(Br)C=CC=N1 CS-0060371 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.15 NNC1=CC=CN=C1Cl CS-0108611 [1,0,0,0,0,0|3,0,0]=4 43 B9R1.15 O=CC1=C(Br)C=CN=C1 CS-0050961 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.15 O=CC1=C(Cl)C=CN=C1 CS-0018845 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.53 CCC1=NC=CC=C1C(=O)O CS-W019286 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.53 COC1=C(C(=O)O)C=NC=C1 CS-0082368 [0,1,0,0,0,0|2,0,0]=3 47 B11R1.53 COC1=C(C(C)=O)C=NC=C1 CS-0052874 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.53 COC1=CC=CC=C1C(=N)N CS-0062382 [0,1,0,0,0,0|1,0,0]=2 49 B11R1.53 COC1=CC=CC=C1C(C)N CS-0089766 [0,1,0,0,0,0|1,0,1]=3 50 B11R1.53 COC1=CN=CC=C1C(C)=O CS-0082296 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.53 N#CC1=C(C(=O)O)C=CN=C1 CS-0099997 [0,1,0,0,0,0|3,0,0]=4 52 B11R1.53 N#CC1=CC=CC=C1C(=O)O CS-0112283 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.53 N#CC1=CC=NC=C1C(=O)O CS-0050878 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] CS-0100001 [0,1,0,0,0,0|3,0,0]=4 55 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] CS-0108771 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.53 O=C(O)C1=CC=CN=C1CO CS-0112632 [0,1,0,0,0,0|2,0,0]=3 57 B11R1.53 O=C(O)C1=NC=CC=C1CO CS-0112784 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 CS-0050845 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.156 CC1=C(C(N)=O)C(Cl)=CC=C1 CS-0034828 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.156 CC1=C([N+](=O)[O-])C(N)=CC=C1 CS-W021963 [0,1,0,0,0,0|3,0,0]=4 61 B11R1.156 CC1=NC=CC(C)=C1C(=O)O CS-0089820 [0,1,0,0,0,0|3,0,0]=4 62 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F CS-0040140 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.156 O=C(O)C1=C(Br)N=CC=C1Cl CS-0107135 [0,1,0,0,0,0|3,0,0]=4 64 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1O CS-0103690 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.156 OB(O)C1=C(O)C=CC=C1O CS-0108563 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.159 CC(=O)C1=CC=CC(Br)=C1Cl CS-0105739 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.159 CC(=O)C1=CC=CC(C)=C1N CS-0061143 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.159 CC1=C(C(N)=O)C=CC=C1F CS-0061158 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.159 CC1=C(O)C([N+](=O)[O-])=CC=N1 CS-0036757 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F CS-0035513 [0,1,0,0,0,0|2,0,1]=4 71 B11R1.159 NC(=O)C1=C(N)C(F)=CC=C1 CS-0062057 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.159 NC(=O)C1=NC=CC(Cl)=C1I CS-0092838 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1I CS-0112595 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 CS-0060697 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 CS-W005695 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.159 O=C(O)C1=C(O)C(Cl)=NC=C1 CS-0112271 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.159 O=C(O)C1=CC=CC(I)=C1Cl CS-0102026 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1F CS-W002615 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.159 O=[N+]([O-])C1=CN=CC(I)=C1O CS-0082405 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.159 OB(O)C1=CC=CC(F)=C1O CS-0111946 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.159 [C@H](C)(N)C1=C(F)C(Cl)=CC=C1 CS-W006676 [0,1,0,0,0,0|2,0,1]=4 82 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 CS-0038878 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.166 CC(=O)C1=CC=C(C)NC1=O CS-0112128 [0,1,0,0,0,0|2,0,1]=4 84 B11R1.166 CC(=O)C1=CC=C(O)C=C1N CS-0088238 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1N CS-0088192 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Br CS-0106160 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.166 CC(N)C1=CC=C(F)C=C1F CS-0096247 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 CS-0049769 [0,1,0,0,0,0|2,0,1]=4 89 B11R1.166 CC1=CC=C(C(N)=O)C(O)=C1 CS-0084853 [0,1,0,0,0,0|0,0,0]=1 90 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 CS-0051359 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.166 C[C@@H](N)C1=C(F)C=C(Br)C=C1 CS-0059834 [0,1,0,0,0,0|2,0,1]=4 92 B11R1.166 NC(=O)C1=C(F)C=C(N)C=C1 CS-0038662 [0,1,0,0,0,0|1,0,0]=2 93 B11R1.166 NC(=O)C1=CC=C(Br)N=C1Br CS-0100916 [0,1,0,0,0,0|2,0,0]=3 94 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1O CS-0037776 [0,1,0,0,0,0|0,0,0]=1 95 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 CS-W017641 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O CS-0051546 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O CS-W018949 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.166 NC1=CC(F)=CN=C1C(=O)O CS-0051545 [0,1,0,0,0,0|3,0,0]=4 99 B11R1.166 NC1=CC=C(C(=O)O)C(Cl)=N1 CS-0100833 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 CS-0037965 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br CS-0022361 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.166 O=C(O)C1=CC=C(I)C=C1O CS-0103689 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br CS-0060141 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.166 O=C(O)C1=CN=C(O)C=C1O CS-0060146 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O CS-0106543 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O CS-0112194 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.166 OC1=CC=C(C(=S)S)C(O)=C1 CS-0112006 [0,1,0,0,0,0|1,1,0]=3 108 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 CS-0061174 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.167 CC(=O)C1=C(F)C=CC(I)=C1 CS-0060839 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl CS-0021075 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.167 CC(N)C1=CC(O)=CC=C1F CS-0112088 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 CS-W008654 [0,1,0,0,0,0|3,0,0]=4 113 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 CS-0050272 [0,1,0,0,0,0|3,0,0]=4 114 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 CS-0061251 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 CS-0050683 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.167 CC1=CC=C(Br)C=C1C(N)=O CS-0061324 [0,1,0,0,0,0|1,0,0]=2 117 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 CS-0051542 [0,1,0,0,0,0|3,0,0]=4 118 B11R1.167 C[C@@H](N)C1=CC(F)=CC=C1O CS-0096268 [0,1,0,0,0,0|1,0,1]=3 119 B11R1.167 NC(=O)C1=CC(N)=CC=C1F CS-0046121 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=C1 CS-0051543 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 CS-0083218 [0,1,0,0,0,0|3,0,0]=4 122 B11R1.167 NC1=CC=C(N)C(C(=O)O)=C1 CS-0113090 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.167 NC1=CC=C(O)C([N+](=O)[O-])=C1 CS-0059135 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 CS-0050688 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.167 NC1=NC=C(F)C=C1C(=O)O CS-0052054 [0,1,0,0,0,0|3,0,0]=4 126 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 CS-W014777 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.167 O=C(O)C1=C(Br)C=NC(Br)=C1 CS-D0434 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 CS-W016245 [0,1,0,0,0,0|1,0,0]=2 129 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S CS-0041775 [0,1,0,0,0,0|1,1,0]=3 130 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F CS-W000432 [0,1,0,0,0,0|3,0,0]=4 131 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O CS-W006688 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.167 O=[N+]([O-])C1=NC(Cl)=CC=C1O CS-0096483 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.222 CC1=CC=CC=C1C(=O)NN CS-0096270 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 CS-0038403 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.222 CCC(=O)C1=CC=CC=C1Cl CS-B1195 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.222 CNC(=O)C1=NC=CC=C1C CS-0091298 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.222 COC(=O)C1=C(C)C=NC=C1 CS-0049071 [0,1,0,0,0,0|3,0,0]=4 138 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 CS-0107308 [0,1,0,0,0,0|3,0,0]=4 139 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 CS-0111580 [0,1,0,0,0,0|3,0,0]=4 140 B11R1.222 COC(=O)C1=CC=COC1=O CS-0091175 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.222 COC(=O)C1=NC=CC=C1C CS-0037427 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.222 N#CC(=O)C1=CC=CC=C1F CS-0108811 [0,1,0,0,0,0|1,0,1]=3 143 B11R1.222 N=C(NO)C1=CC=CC=C1Br CS-0036567 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 CS-0104715 [0,1,0,0,0,0|1,0,2]=4 145 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl CS-0035934 [0,1,0,0,0,0|1,0,2]=4 146 B11R1.222 O=C(NO)C1=CC=CC=C1Br CS-0108617 [0,1,0,0,0,0|1,0,0]=2 147 B11R2.1 BrC1=COC2=C1C=NC=C2 CS-0087976 [0,0,0,1,0,0|3,0,0]=4 148 B11R2.1 BrC1=COC2=C1N=CC=C2 CS-0060633 [0,0,0,1,0,0|3,0,0]=4 149 B11R2.1 BrC1=NOC2=CC=CC=C21 CS-0112728 [0,0,0,1,0,0|1,0,1]=3 150 B11R2.1 ClC1=CNC2=C1C=CC=C2 CS-0005541 [0,0,0,1,0,0|3,0,0]=4 151 B11R2.1 NC1=CNC2=CN=CC=C12 CS-0092062 [0,0,0,1,0,0|3,0,0]=4 152 B11R2.1 NC1=CSC2=NC=CC=C12 CS-0084843 [0,0,0,1,0,0|2,1,0]=4 153 B11R2.1 NN1N=CC2=CC=CC=C21 CS-0060586 [0,0,0,1,0,0|3,0,0]=4 154 B11R2.1 O=C1COC2=C1C=NC=C2 CS-0087986 [0,0,0,1,0,0|2,0,0]=3 155 B11R2.1 O=C1NC=C2C=CC=CN12 CS-0029727 [0,0,0,1,0,0|2,0,0]=3 156 B11R2.1 O=C1NCC2=C1C=CN=C2 CS-0098692 [0,0,0,1,0,0|2,0,0]=3 157 B11R2.1 O=C1NCC2=C1CC=CC2 CS-0052182 [0,0,0,1,0,0|1,0,2]=4 158 B11R2.1 O=C1NCC2=CC=NC=C12 CS-0052557 [0,0,0,1,0,0|2,0,0]=3 159 B11R2.1 O=C1SSC2=CC=CC=C12 CS-0112260 [0,0,0,1,0,0|1,1,0]=3 160 B11R2.1 S=C1NN=C2C=CC=CN12 CS-0085157 [0,0,0,1,0,0|2,1,0]=4 161 B9R1.41 CC(=O)C1=CSC=C1Cl CS-D0052 [0,0,0,0,1,0|3,0,0]=4 162 B9R1.41 NC(=O)C1=C(Br)C=CS1 CS-0089827 [0,0,0,0,1,0|2,0,0]=3 163 B9R1.41 NC(=O)C1=CC=CN1N CS-0052646 [0,0,0,0,1,0|2,0,0]=3 164 B9R1.41 NC(=O)C1=CNN=C1N CS-W009403 [0,0,0,0,1,0|3,0,0]=4 165 B9R1.41 NC(=O)C1=NNC=C1N CS-0060154 [0,0,0,0,1,0|3,0,0]=4 166 B9R1.41 NC1=C(C(=O)O)C=CO1 CS-0112432 [0,0,0,0,1,0|3,0,0]=4 167 B9R1.41 NC1=C(C(=O)O)C=CS1 CS-0060720 [0,0,0,0,1,0|3,0,0]=4 168 B9R1.41 O=C(O)C1=C(O)C=CS1 CS-0096798 [0,0,0,0,1,0|2,0,0]=3 169 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 CS-0084722 [0,0,0,0,0,1|2,0,0]=3 170 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 CS-0081581 [0,0,0,0,0,1|2,0,0]=3 171 B11R1.86 CC(=O)NC1=CC=CC=C1Br CS-0089804 [0,0,0,0,0,1|2,0,0]=3 172 B11R1.86 CC(=O)NC1=CC=CNC1=O CS-0081578 [0,0,0,0,0,1|2,0,1]=4 173 B11R1.86 CC(=O)NC1=NC=CC=C1C CS-0092042 [0,0,0,0,0,1|3,0,0]=4 174 B11R1.86 CC(=O)NC1=NC=CC=C1O CS-0084789 [0,0,0,0,0,1|2,0,0]=3 175 B11R1.86 CC(=O)OC1=C(Br)N=CC=C1 CS-0051984 [0,0,0,0,0,1|3,0,0]=4 176 B11R1.86 N=C(N)CC1=CC=CC=C1Cl CS-0038731 [0,0,0,0,0,1|2,0,0]=3 177 B11R1.86 O=C(O)CC1=NC=CC=C1Br CS-0052285 [0,0,0,0,0,1|3,0,0]=4 178 B11R1.86 O=C(O)CC1=NC=CC=C1O CS-0052280 [0,0,0,0,0,1|2,0,0]=3 179 B8R1.2 NCC1=CC=CC=C1 CS-0005944 [2,0,0,0,0,0|0,0,1]=3 180 B8R1.2 NNC1=CC=CN=C1 CS-0022347 [2,0,0,0,0,0|2,0,0]=4 181 B8R1.2 O=CC1=CC=NN=C1 CS-W023111 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.5 FC1=CC=CC=C1S CS-0040417 [2,0,0,0,0,0|1,1,0]=4 183 B8R1.5 NC1=CN=CC=C1I CS-W007755 [2,0,0,0,0,0|2,0,0]=4 184 B8R1.5 O=C1C=COC=C1O CS-D1527 [2,0,0,0,0,0|1,0,0]=3 185 B8R1.5 OC1=C(I)C=CC=N1 CS-0060372 [2,0,0,0,0,0|2,0,0]=4 186 B8R1.5 OC1=C(S)C=CC=C1 CS-0010969 [2,0,0,0,0,0|0,1,0]=3 187 B8R1.5 OC1=CN=CC=C1Br CS-W006061 [2,0,0,0,0,0|2,0,0]=4 188 B10R1.13 CC(=O)C1=NC=C(F)C=C1 CS-0088242 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 CS-B0177 [1,1,0,0,0,0|1,0,1]=4 190 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS-0060230 [1,1,0,0,0,0|1,0,0]=3 191 B10R1.13 N=C(N)C1=CN=C(F)C=C1 CS-0050193 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.13 N=C(N)C1=NC=C(F)C=C1 CS-0050475 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.13 NC(=O)C1=CN=C(Br)N=C1 CS-0101948 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.13 NC(=O)C1=CN=C(Cl)N=C1 CS-0045677 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.13 NC(=O)C1=CNC(=O)C=N1 CS-0062145 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.13 NC(=O)C1=NC=C(O)C=C1 CS-0050458 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.13 NC(=O)C1=NN=C(Br)C=C1 CS-0101954 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.13 NC(=O)C1=NN=C(N)C=C1 CS-0050340 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.13 O=C(O)C1=CC=C(S)C=C1 CS-W018038 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.13 O=C1C=CC(C(=O)O)=CO1 CS-0001427 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.15 CC(ON)C1=CC=CC=C1 CS-0080699 [1,1,0,0,0,0|1,0,1]=4 202 B10R1.15 COC(=N)C1=CC=CC=C1 CS-0037087 [1,1,0,0,0,0|0,0,2]=4 203 B10R1.15 N=C(NO)C1=CC=NC=C1 CS-0060266 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.15 NNC(=O)C1=NC=NC=C1 CS-W022945 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.15 N[C@H](CF)C1=CC=CC=C1 CS-0035746 [1,1,0,0,0,0|1,0,1]=4 206 B10R1.15 O=C(CF)C1=CC=CC=C1 CS-0037091 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.28 NS(=O)(=O)C1=CC=CN=C1 CS-0044993 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 CS-0048731 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.113 CC(=O)C1=CC(F)=NC=C1 CS-0105960 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.113 CC(=O)C1=CC(N)=NC=C1 CS-W021199 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.113 CC(=O)C1=NC(N)=CC=C1 CS-0104676 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.113 CC1=CC(C(N)=O)=CN=C1 CS-0037467 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.113 NC(=O)C1=CC(F)=CN=C1 CS-0036700 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.113 NC(=O)C1=CC(O)=CN=C1 CS-0062251 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.113 NC(=O)C1=NC(Br)=CC=C1 CS-0089806 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 CS-0061696 [1,1,0,0,0,0|2,0,0]=4 217 B10R1.113 NC(=O)C1=NC(F)=CC=C1 CS-0088243 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 CS-0050962 [1,1,0,0,0,0|1,0,0]=3 219 B10R1.113 NC(=O)C1=NC=NC(Cl)=C1 CS-0099873 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CS-0033962 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.113 NC1=NC=CC(C(=O)O)=C1 CS-D1172 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.2 CC1=C(Cl)C(C=O)=CC=C1 CS-0036697 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.2 O=CC1=C(Cl)C(Br)=CN=C1 CS-0099728 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.2 O=CC1=C(O)C(Br)=NC=C1 CS-0068899 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.4 CC1=CC=CC=C1CC=O CS-0038162 [1,1,0,0,0,0|1,0,0]=3 226 B10R1.4 CC1=CC=CC=C1CON CS-0080700 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.4 CC1=CC=CC=C1NC=O CS-0038689 [1,1,0,0,0,0|1,0,0]=3 228 B10R1.4 CCNC1=CC=CC=C1O CS-0061529 [1,1,0,0,0,0|1,0,1]=4 229 B10R1.4 NNCC1=C(Br)C=CC=C1 CS-0053075 [1,1,0,0,0,0|1,0,1]=4 230 B10R1.4 NNCC1=C(Cl)C=CC=C1 CS-0053073 [1,1,0,0,0,0|1,0,1]=4 231 B10R1.4 NNCC1=C(F)C=CC=C1 CS-0053072 [1,1,0,0,0,0|1,0,1]=4 232 B10R1.4 NNCC1=CC=CC=C1Cl CS-0036680 [1,1,0,0,0,0|1,0,1]=4 233 B10R1.4 O=CCC1=CC=CC=C1Br CS-0038248 [1,1,0,0,0,0|1,0,0]=3 234 B10R1.4 O=CCC1=CC=CC=C1Cl CS-0038107 [1,1,0,0,0,0|1,0,0]=3 235 B10R1.4 O=CCC1=CC=CC=C1F CS-0038111 [1,1,0,0,0,0|1,0,0]=3 236 B10R1.4 O=CNC1=CC=CC=C1Br CS-0035790 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.20 CNC1=C(C=O)C=CC=N1 CS-0061781 [1,1,0,0,0,0|2,0,0]=4 238 B10R1.20 COC1=C(CN)C=CN=C1 CS-0053363 [1,1,0,0,0,0|1,0,1]=4 239 B10R1.20 COC1=CC=CN=C1CN CS-0071730 [1,1,0,0,0,0|1,0,1]=4 240 B10R1.20 COC1=CN=CC=C1C=O CS-W005812 [1,1,0,0,0,0|1,0,0]=3 241 B10R1.20 COC1=NC=CC=C1CN CS-0053527 [1,1,0,0,0,0|1,0,1]=4 242 B10R1.25 CC1=NC(Cl)=CC=C1C=O CS-0036209 [1,1,0,0,0,0|2,0,0]=4 243 B10R1.25 N#CC1=CC=C(I)C=C1O CS-0108656 [1,1,0,0,0,0|0,0,2]=4 244 B10R1.25 N#CC1=CC=C(O)C=C1O CS-W018705 [1,1,0,0,0,0|0,0,2]=4 245 B10R1.25 NC1=C(C=O)C=CC(Br)=N1 CS-0038663 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.25 NC1=CC(Br)=CN=C1C=O CS-0051548 [1,1,0,0,0,0|2,0,0]=4 247 B10R1.25 NC1=CC=C(CO)C(O)=C1 CS-0103176 [1,1,0,0,0,0|0,0,2]=4 248 B10R1.25 NC1=NC(Cl)=CC=C1C=O CS-0088194 [1,1,0,0,0,0|2,0,0]=4 249 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 CS-0110010 [1,1,0,0,0,0|2,0,0]=4 250 B10R1.25 O=CC1=C(F)C=C(Cl)N=C1 CS-0096691 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.25 O=CC1=C(O)C=C(Cl)N=C1 CS-0096692 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.25 O=CC1=CC=C(Br)N=C1Br CS-0052135 [1,1,0,0,0,0|2,0,0]=4 253 B10R1.25 O=CC1=NC=C(F)C=C1F CS-0091202 [1,1,0,0,0,0|2,0,0]=4 254 B10R1.30 C#CC1=CC(N)=CC=C1O CS-0101908 [1,1,0,0,0,0|1,0,1]=4 255 B10R1.30 CC1=CC=C(C)C(CN)=C1 CS-0099734 [1,1,0,0,0,0|1,0,1]=4 256 B10R1.30 CC1=CC=C(Cl)C=C1C=O CS-0061327 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.30 CC1=CN=C(F)C(C=O)=C1 CS-0088263 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.30 CC1=NC=C(F)C(C=O)=C1 CS-0088261 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.30 NC1=CC=C(Cl)C=C1C=O CS-W007919 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.30 NC1=CC=C(I)C=C1C=O CS-0100668 [1,1,0,0,0,0|1,0,0]=3 261 B10R1.30 NCC1=CC(Cl)=CC=C1Cl CS-0099747 [1,1,0,0,0,0|1,0,1]=4 262 B10R1.30 NCC1=CC(N)=CC=C1F CS-0090675 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.30 O=CC1=CC(Br)=NC=C1Br CS-0092869 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.30 O=CC1=CC(Cl)=CN=C1Cl CS-0091260 [1,1,0,0,0,0|2,0,0]=4 265 B10R1.30 O=CC1=CC(F)=CC=C1I CS-0038109 [1,1,0,0,0,0|1,0,0]=3 266 B10R1.245 C=CC1=C(Br)C=CN=C1O CS-0050994 [1,1,0,0,0,0|2,0,0]=4 267 B10R1.245 C=CC1=C(Cl)C=CN=C1O CS-0050932 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.245 N#CC1=C(Cl)C=CC=C1O CS-0051935 [1,1,0,0,0,0|0,0,2]=4 269 B10R1.245 NCC1=C(Br)C=CC=C1F CS-0036328 [1,1,0,0,0,0|1,0,1]=4 270 B10R1.245 O=CC1=C(F)C=CC=C1O CS-W007917 [1,1,0,0,0,0|0,0,0]=2 271 B10R1.245 O=CC1=C(F)C=NC=C1F CS-0091205 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.192 NC(=O)C1=C(Cl)C=CN1N CS-0107392 [0,1,0,0,1,0|2,0,0]=4 273 B12R1.75 CC(=O)OC1=CC=CC=C1C=O CS-0099717 [0,1,0,0,0,1|1,0,1]=4 274 B12R1.75 COC1=CC=CN=C1CC(=O)[O-] CS-0048708 [0,1,0,0,0,1|2,0,0]=4 275 B12R1.75 COC1=NC=CC=C1CC(=O)O CS-0106456 [0,1,0,0,0,1|2,0,0]=4 276 B12R1.124 CC1=CC=CC=C1C(F)C(=O)O CS-0104541 [0,1,0,0,0,1|2,0,0]=4 277 B12R1.124 O=C(O)C(=O)C1=C(Cl)C=CC=C1 CS-0085188 [0,1,0,0,0,1|2,0,0]=4 278 B12R1.124 O=C(O)C(F)C1=CC=CC=C1Cl CS-0104540 [0,1,0,0,0,1|2,0,0]=4 279 B12R1.224 CC(=O)NC1=CC=CC(C)=C1Cl CS-0061206 [0,1,0,0,0,1|2,0,0]=4 280 B12R1.224 CC1=C(I)C=CC=C1CC(=O)O CS-0093908 [0,1,0,0,0,1|2,0,0]=4 281 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Cl CS-0089652 [0,1,0,0,0,1|2,0,0]=4 282 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 CS-0038858 [0,1,0,0,0,1|2,0,0]=4 283 B12R1.233 CC(=O)NC1=CC=C(Cl)C=C1C CS-0037986 [0,1,0,0,0,1|2,0,0]=4 284 B12R1.233 CC(=O)OC1=CC=C(Cl)C=C1Br CS-0093668 [0,1,0,0,0,1|2,0,0]=4 285 B12R1.233 CC1=CC(N)=CC=C1CC(=O)O CS-0038602 [0,1,0,0,0,1|2,0,0]=4 286 B12R1.233 O=C(O)CC1=C(Br)C=C(Br)C=C1 CS-0060423 [0,1,0,0,0,1|2,0,0]=4 287 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1O CS-0089323 [0,1,0,0,0,1|1,0,0]=3 288 B12R1.371 CNC(=O)CC1=C(Br)C=CC=C1 CS-0035872 [0,1,0,0,0,1|1,0,0]=3 289 B12R1.371 CNC(=O)CC1=CC=CC=C1Cl CS-0037557 [0,1,0,0,0,1|1,0,0]=3 290 B12R1.371 COC(=O)CC1=CC=CC=C1F CS-0061879 [0,1,0,0,0,1|2,0,0]=4 291 B12R1.371 NNC(=O)CC1=C(F)C=CC=C1 CS-0099915 [0,1,0,0,0,1|1,0,0]=3 292 B12R1.371 NNC(=O)NC1=CC=CC=C1Cl CS-0096191 [0,1,0,0,0,1|1,0,0]=3 293 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F CS-W017625 [0,1,0,0,0,1|2,0,0]=4 294 B12R1.46 C=CC1=CC=C(Cl)C=C1C(C)=O CS-0092416 [0,2,0,0,0,0|2,0,0]=4 295 B12R1.46 CC1=CC=C(CO)C([N+](=O)[O-])=C1 CS-0077261 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.46 CCC1=CC=C(Cl)C=C1C(C)=O CS-0092418 [0,2,0,0,0,0|2,0,0]=4 297 B12R1.46 COC1=C(C(=O)O)C=C(F)C=N1 CS-0088287 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.46 COC1=C(C(C)=O)C=C(C)C=N1 CS-0081677 [0,2,0,0,0,0|2,0,0]=4 299 B12R1.46 COC1=C([N+](=O)[O-])C=C(O)C=C1 CS-0061910 [0,2,0,0,0,0|2,0,0]=4 300 B12R1.46 COC1=CC=C(C)N=C1C(C)=O CS-0092373 [0,2,0,0,0,0|2,0,0]=4 301 B12R1.46 NC1=CC=C(CO)C([N+](=O)[O-])=C1 CS-0112770 [0,2,0,0,0,0|2,0,0]=4 302 B12R1.57 COC1=C(C(=O)O)C=CC(C)=N1 CS-0061366 [0,2,0,0,0,0|2,0,0]=4 303 B12R1.57 COC1=C(C(C)=O)C=CC(O)=C1 CS-0060838 [0,2,0,0,0,0|1,0,0]=3 304 B12R1.57 COC1=CC(Br)=CN=C1C(=O)O CS-0108720 [0,2,0,0,0,0|2,0,0]=4 305 B12R1.57 COC1=CC(Cl)=CN=C1C(=O)O CS-0050528 [0,2,0,0,0,0|2,0,0]=4 306 B12R1.57 COC1=CC(N)=CC=C1C(N)=O CS-0107344 [0,2,0,0,0,0|0,0,0]=2 307 B12R1.57 N#CC1=CC(Br)=CC=C1C(=O)O CS-0102027 [0,2,0,0,0,0|2,0,0]=4 308 B12R1.57 O=[N+]([O-])C1=C(CO)C=C(F)C=C1 CS-W003267 [0,2,0,0,0,0|2,0,0]=4 309 B12R1.57 O=[N+]([O-])C1=CC=C(Br)C=C1CO CS-0060201 [0,2,0,0,0,0|2,0,0]=4 310 B12R1.77 COC(=O)C1=CN=CC=C1OC CS-0038371 [0,2,0,0,0,0|2,0,0]=4 311 B12R1.77 COC1=CC=CC=C1C(N)CO CS-0091305 [0,2,0,0,0,0|0,0,2]=4 312 B12R1.87 COC1=C(F)C=CC=C1C(C)=O CS-0113129 [0,2,0,0,0,0|1,0,0]=3 313 B12R1.261 NC(=O)C1=CC=CC=C1C(=O)O CS-0034611 [0,2,0,0,0,0|0,0,0]=2 314 B12R1.283 CCOC1=NC=CC=C1C(N)=O CS-0090995 [0,2,0,0,0,0|1,0,0]=3 315 B12R1.437 CCC1=C(C(=O)O)C(O)=CC=C1 CS-0104570 [0,2,0,0,0,0|1,0,0]=3 316 B12R1.437 COC1=C(C(C)=O)C(F)=CC=C1 CS-W019467 [0,2,0,0,0,0|1,0,0]=3 317 B12R1.437 N#CC1=C(C(=O)O)C(F)=CC=C1 CS-0051918 [0,2,0,0,0,0|2,0,0]=4 318 B12R1.126 NC1=CC(Cl)=CC=C1S(N)(=O)=O CS-0112557 [0,2,0,0,0,0|2,0,0]=4 319 B12R1.894 CC(=O)C1=C(O)C=CC(Cl)=C1O CS-0096015 [0,2,0,0,0,0|1,0,0]=3 320 B12R1.894 CC1=C(Br)C=CC(O)=C1C(=O)O CS-0105595 [0,2,0,0,0,0|1,0,0]=3 321 B12R1.894 CC1=C(C(=O)O)C(F)=C(F)C=C1 CS-0102005 [0,2,0,0,0,0|2,0,0]=4 322 B12R1.894 CC1=C(Cl)C=CC(O)=C1C(=O)O CS-0105592 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.894 CC1=C(F)C=CC(N)=C1C(=O)O CS-0108287 [0,2,0,0,0,0|2,0,0]=4 324 B12R1.894 NC1=C(C(=O)O)C(Cl)=C(F)C=C1 CS-0088468 [0,2,0,0,0,0|2,0,0]=4 325 B12R1.894 NC1=C(C(=O)O)C(F)=C(Br)C=C1 CS-0060313 [0,2,0,0,0,0|2,0,0]=4 326 B12R1.894 NC1=C(Cl)C(C(=O)O)=C(F)C=C1 CS-0112414 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.894 NC1=C(F)C=CC(F)=C1C(=O)O CS-0107347 [0,2,0,0,0,0|2,0,0]=4 328 B12R1.894 O=C(O)C1=C(Cl)C(Br)=CC=C1Cl CS-0051486 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.894 O=C(O)C1=C(F)C=CC(O)=C1F CS-0060322 [0,2,0,0,0,0|2,0,0]=4 330 B12R1.1000 CC(=O)C1=C(F)C=C(Br)C=C1O CS-0038297 [0,2,0,0,0,0|1,0,0]=3 331 B12R1.1000 CC1=CC(Br)=CC(F)=C1C(=O)O CS-0054155 [0,2,0,0,0,0|2,0,0]=4 332 B12R1.1000 CC1=CC(C)=C(C(N)=O)C(Cl)=N1 CS-0051967 [0,2,0,0,0,0|2,0,0]=4 333 B12R1.1000 CC1=CC(C)=C(C(N)=O)C(N)=N1 CS-0089790 [0,2,0,0,0,0|2,0,0]=4 334 B12R1.1000 CC1=CC(C)=C([S@@](N)=O)C(C)=C1 CS-0101726 [0,2,0,0,0,0|2,0,0]=4 335 B12R1.1000 CC1=CC(C)=C([S@](N)=O)C(C)=C1 CS-0104497 [0,2,0,0,0,0|2,0,0]=4 336 B12R1.1000 CC1=CC(Cl)=NC(Cl)=C1C(N)=O CS-0061288 [0,2,0,0,0,0|2,0,0]=4 337 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(=O)N1 CS-0092000 [0,2,0,0,0,0|2,0,0]=4 338 B12R1.1000 NC(=O)C1=C(F)C=C(Cl)C=C1Br CS-0112058 [0,2,0,0,0,0|1,0,0]=3 339 B12R1.1000 O=C(O)C1=C(Br)C=C(O)C=C1Br CS-0105755 [0,2,0,0,0,0|2,0,0]=4 340 B12R1.3441 COC(=O)C1=C(Br)C=CC=C1N CS-W006104 [0,2,0,0,0,0|2,0,0]=4 341 B12R1.24 CCC(=O)C1=C(O)C(Cl)=CC=C1 CS-0052891 [0,2,0,0,0,0|1,0,0]=3 342 B12R1.24 COC(=O)C1=C(F)C(N)=CC=C1 CS-0038763 [0,2,0,0,0,0|2,0,0]=4 343 B12R1.24 COC(=O)C1=CC=CC(O)=C1C CS-0029811 [0,2,0,0,0,0|2,0,0]=4 344 B12R1.440 COC1=C(N)C(C(C)=O)=CC=C1 CS-0088235 [0,2,0,0,0,0|2,0,0]=4 345 B12R1.440 O=[N+]([O-])C1=C(O)C(CO)=CC=C1 CS-0096940 [0,2,0,0,0,0|2,0,0]=4 346 B12R1.511 CC(=O)C1=C(F)C(Cl)=CC(Cl)=C1 CS-0037694 [0,2,0,0,0,0|2,0,0]=4 347 B12R1.511 CC1=C(Br)C=C(S)C=C1C(=O)O CS-0068987 [0,2,0,0,0,0|2,0,0]=4 348 B12R1.511 CC1=C(N)C(C(=O)O)=CC(F)=C1 CS-0108286 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.511 CC1=CC(C(=O)O)=C(F)C(F)=C1 CS-0061218 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.511 CC1=CC(C(=O)O)=C(I)C(Br)=C1 CS-0059673 [0,2,0,0,0,0|2,0,0]=4 351 B12R1.511 CC1=CC([N+](=O)[O-])=C(O)C(O)=C1 CS-0100160 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.511 NC(=O)C1=CC(Br)=CC(F)=C1N CS-0094038 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.511 NC(=O)C1=CC(Cl)=NC(Cl)=C1N CS-0061687 [0,2,0,0,0,0|2,0,0]=4 354 B12R1.511 NC1=C(C(=O)O)C=C(Cl)C=C1I CS-0060169 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.511 NC1=CC(F)=C(F)C(C(=O)O)=C1 CS-0111954 [0,2,0,0,0,0|2,0,0]=4 356 B12R1.511 O=C(O)C1=C(I)C(I)=CC(I)=C1 CS-W011500 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.511 O=C(O)C1=C(O)C(Br)=CC(F)=C1 CS-0106496 [0,2,0,0,0,0|1,0,0]=3 358 B12R1.511 O=C(O)C1=C(O)C(F)=CC(Br)=C1 CS-0106497 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.511 O=[N+]([O-])C1=C(O)C(Br)=CC(Cl)=C1 CS-0108774 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.511 O=[N+]([O-])C1=C(O)C(Cl)=CC(Br)=C1 CS-0088485 [0,2,0,0,0,0|2,0,0]=4 361 B12R1.893 CC1=C(Cl)C(C(=O)O)=CC=C1Cl CS-0061146 [0,2,0,0,0,0|2,0,0]=4 362 B12R1.893 O=C(O)C1=C(F)C(Br)=C(F)C=C1 CS-0037194 [0,2,0,0,0,0|2,0,0]=4 363 B12R1.893 O=C(O)C1=C(O)C(F)=C(Br)C=C1 CS-0104741 [0,2,0,0,0,0|1,0,0]=3 364 B12R1.893 O=C(O)C1=CC=C(F)C(O)=C1F CS-0105364 [0,2,0,0,0,0|2,0,0]=4 365 B12R1.893 O=[N+]([O-])C1=C(O)C(Cl)=C(Cl)C=C1 CS-0060320 [0,2,0,0,0,0|2,0,0]=4 366 B12R1.232 CC(=O)C1=CC(Br)=C(F)C=C1O CS-0059739 [0,2,0,0,0,0|1,0,0]=3 367 B12R1.232 CC(=O)C1=CC(Cl)=C(Cl)C=C1C CS-0061236 [0,2,0,0,0,0|2,0,0]=4 368 B12R1.232 CC(=O)C1=CC(F)=C(Br)C=C1O CS-0060847 [0,2,0,0,0,0|1,0,0]=3 369 B12R1.232 CC(=O)C1=CC(O)=C(O)C=C1O CS-0060848 [0,2,0,0,0,0|1,0,0]=3 370 B12R1.232 CC1=C(Br)C=C(C(=O)O)C(F)=C1 CS-0096422 [0,2,0,0,0,0|2,0,0]=4 371 B12R1.232 CC1=C(N)C=C(F)C(C(=O)O)=C1 CS-0077260 [0,2,0,0,0,0|2,0,0]=4 372 B12R1.232 CC1=CC(Cl)=C(Cl)C=C1C(=O)O CS-0061238 [0,2,0,0,0,0|2,0,0]=4 373 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O CS-0112810 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.232 CC1=CC(O)=C([N+](=O)[O-])C=C1F CS-0061247 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.232 CC1=NC(O)=C(C(=O)O)C=C1Cl CS-0061369 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.232 NC1=C(F)C=C(Cl)C(C(=O)O)=C1 CS-0111951 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.232 NC1=C(F)C=C(F)C(C(=O)O)=C1 CS-0109535 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.232 O=C(O)C1=C(O)C=C(F)C(Br)=C1 CS-0106498 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1O CS-0089405 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1O CS-0100089 [0,2,0,0,0,0|1,0,0]=3 381 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1F CS-0052150 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.232 O=C(O)C1=CC(O)=C(Cl)C=C1Cl CS-0100365 [0,2,0,0,0,0|2,0,0]=4 383 B12R1.452 CC1=CC(C=O)=CC=C1C(=O)O CS-0112527 [0,2,0,0,0,0|2,0,0]=4 384 B12R1.452 N#CC1=CC=C(C(=O)O)C(N)=C1 CS-0102040 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.1703 CNC(=O)C1=C(Br)C=C(F)C=C1 CS-0061779 [0,2,0,0,0,0|1,0,0]=3 386 B12R1.1703 CNC(=O)C1=C(F)C=C(C)C=C1 CS-0069893 [0,2,0,0,0,0|1,0,0]=3 387 B12R1.1703 CNC(=O)C1=C(F)C=C(I)C=C1 CS-0062053 [0,2,0,0,0,0|1,0,0]=3 388 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Br CS-0037930 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.1703 COC(=O)C1=CC=C(F)C=C1I CS-0062063 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.1703 NCC(=O)C1=CC=C(F)C=C1F CS-0089763 [0,2,0,0,0,0|1,0,0]=3 391 B12R1.1703 O=C(CCl)C1=CC=C(Cl)C=C1F CS-0059807 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.354 CCC(=O)C1=C(C)C=CC(Cl)=C1 CS-0061424 [0,2,0,0,0,0|2,0,0]=4 393 B12R1.354 COC(=O)C1=C(C)C=CC(F)=C1 CS-W005778 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.354 COC(=O)C1=C(O)C=CC(Br)=N1 CS-0048939 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.354 COC(=O)C1=C(O)C=NC(Br)=C1 CS-0049175 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.354 COC(=O)C1=CC(C)=CC=C1F CS-0059150 [0,2,0,0,0,0|2,0,0]=4 397 B12R1.354 COC(=O)C1=CC(O)=CC=C1Br CS-B1202 [0,2,0,0,0,0|2,0,0]=4 398 B12R1.354 COC(=O)C1=NC(Cl)=CC=C1O CS-0104587 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.453 CC1=C(C(=O)O)C=C(C#N)C=C1 CS-0112401 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 CS-0037834 [0,2,0,0,0,0|0,0,0]=2 401 B12R1.308 CCOC(=O)C1=CC=CC=C1I CS-0085183 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.308 CCOC(=O)C1=CN=CC=C1O CS-0089684 [0,2,0,0,0,0|2,0,0]=4 403 B10R1.66 O=C(O)\C=C\C1=CC=CS1 CS-W018039 [0,0,1,1,0,0|1,1,0]=4 404 B10R2.7 C1=CC2=C(C=CO2)C=N1 CS-0084800 [1,0,0,1,0,0|2,0,0]=4 405 B12R2.24 NC1=CC2=C(C=CC=C2)N=N1 CS-0060744 [0,0,0,1,0,1|2,0,0]=4 406 B12R2.24 NC1=NC=C2C=CC=CC2=N1 CS-W009159 [0,0,0,1,0,1|2,0,0]=4 407 B12R2.24 O=C1CSC2=CC=CC=C2N1 CS-0085251 [0,0,0,1,0,1|1,1,0]=4 408 B12R2.24 O=C1N=CC2=CC=CC=C2N1 CS-0085121 [0,0,0,1,0,1|1,0,1]=4 409 B12R2.202 CC1=CC2=C(Br)C=CC=C2N1 CS-W005700 [0,0,0,1,0,1|2,0,0]=4 410 B12R2.202 CC1=CC=CC2=C1N=C(N)N2 CS-0036161 [0,0,0,1,0,1|2,0,0]=4 411 B12R2.202 CC1=NC2=C(O)C=CC=C2O1 CS-0111712 [0,0,0,1,0,1|1,0,1]=4 412 B12R2.202 CC1=NC2=CC=CC(O)=C2N1 CS-0059017 [0,0,0,1,0,1|1,0,1]=4 413 B12R2.202 NC1=NC2=CC=CC(Br)=C2S1 CS-0038098 [0,0,0,1,0,1|2,0,0]=4 414 B12R2.202 NC1=NC2=CC=CC(F)=C2S1 CS-0054538 [0,0,0,1,0,1|2,0,0]=4 415 B12R2.202 O=C1CC2=C(Br)N=CC=C2N1 CS-0058504 [0,0,0,1,0,1|2,0,0]=4 416 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 CS-0050830 [0,0,0,1,0,1|1,0,0]=3 417 B12R2.202 O=C1CC2=C(C=CN=C2Cl)N1 CS-0055966 [0,0,0,1,0,1|2,0,0]=4 418 B12R2.202 O=C1CC2=C(Cl)C=NC=C2N1 CS-0058491 [0,0,0,1,0,1|2,0,0]=4 419 B12R2.202 O=C1CC2=C(F)C=CN=C2N1 CS-0004611 [0,0,0,1,0,1|2,0,0]=4 420 B12R2.202 O=C1CC2=C(F)C=NC=C2N1 CS-0058490 [0,0,0,1,0,1|2,0,0]=4 421 B12R2.202 O=C1CC2=C(F)N=CC=C2N1 CS-0058505 [0,0,0,1,0,1|2,0,0]=4 422 B12R2.202 O=C1CC2=C(I)C=CN=C2N1 CS-0050833 [0,0,0,1,0,1|2,0,0]=4 423 B12R2.202 O=C1CC2=C(N1)C(I)=CC=C2 CS-0109537 [0,0,0,1,0,1|2,0,0]=4 424 B12R2.202 O=C1NC2=CC=CC(Br)=C2O1 CS-0112701 [0,0,0,1,0,1|1,0,0]=3 425 B12R2.202 O=C1NC2=CC=CC(F)=C2O1 CS-0098303 [0,0,0,1,0,1|1,0,0]=3 426 B12R2.202 OC1=C2SC(Cl)=NC2=CC=C1 CS-0051980 [0,0,0,1,0,1|1,0,1]=4 427 B12R2.1081 NC1COCC2=CC=CC=C21 CS-0018940 [0,1,0,1,0,0|1,0,1]=4 428 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 CS-0060637 [0,1,0,1,0,0|1,0,1]=4 429 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 CS-0005279 [0,1,0,1,0,0|1,0,1]=4 430 B12R2.1081 O=C1C=COC2=CC=CC=C12 CS-W005942 [0,1,0,1,0,0|1,0,0]=3 431 B12R2.1081 O=C1C=CSC2=CC=CC=C12 CS-0081199 [0,1,0,1,0,0|1,1,0]=4 432 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS-W005292 [0,1,0,1,0,0|2,0,0]=4 433 B12R2.1081 O=C1NCCC2=C1N=CC=C2 CS-W019035 [0,1,0,1,0,0|2,0,0]=4 434 B12R2.1081 O=C1NN=CC2=C1C=CN=C2 CS-0106966 [0,1,0,1,0,0|2,0,0]=4 435 B12R2.1081 O=C1NN=CC2=C1C=NC=C2 CS-0106967 [0,1,0,1,0,0|2,0,0]=4 436 B12R2.1081 O=C1NN=NC2=CC=CC=C12 CS-0084775 [0,1,0,1,0,0|1,0,0]=3 437 B12R2.1081 O=C1OC=NC2=CC=CC=C12 CS-0046535 [0,1,0,1,0,0|2,0,0]=4 438 B12R2.1081 S=C1NC=NC2=C1C=CC=C2 CS-0084769 [0,1,0,1,0,0|1,1,0]=4 439 B12R2.1081 S=C1NN=CC2=C1C=CC=C2 CS-0090901 [0,1,0,1,0,0|1,1,0]=4 440 B12R2.2028 CC1NC(=O)C2=CC=CC=C21 CS-0058508 [0,1,0,1,0,0|1,0,0]=3 441 B12R2.2028 O=C1CC(O)C2=C1C=CC=C2 CS-0113155 [0,1,0,1,0,0|1,0,0]=3 442 B12R2.88 NC1(C2=C(O)C=CC=C2)CC1 CS-0091434 [0,1,0,1,0,0|1,0,1]=4 443 B12R2.203 BrC1=CC=CC2=C1C(I)=NN2 CS-0053829 [0,1,0,1,0,0|2,0,0]=4 444 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 CS-0061213 [0,1,0,1,0,0|2,0,0]=4 445 B12R2.203 CC1=C2C(Br)=CC=CC2=NN1 CS-0038555 [0,1,0,1,0,0|2,0,0]=4 446 B12R2.203 CC1=CNC2=C1C(N)=CC=C2 CS-0051277 [0,1,0,1,0,0|2,0,0]=4 447 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 CS-0001936 [0,1,0,1,0,0|2,0,0]=4 448 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 CS-0050115 [0,1,0,1,0,0|1,0,0]=3 449 B12R2.203 NC1=CC=CC2=C1C(Br)=NN2 CS-0088072 [0,1,0,1,0,0|2,0,0]=4 450 B12R2.203 NC1=CC=CC2=C1C(Cl)=NN2 CS-0051424 [0,1,0,1,0,0|2,0,0]=4 451 B12R2.203 NC1=CC=CC2=C1C(I)=NN2 CS-0051330 [0,1,0,1,0,0|2,0,0]=4 452 B12R2.203 O=C1COC2=C1C(I)=CC=C2 CS-0111717 [0,1,0,1,0,0|1,0,0]=3 453 B12R2.203 O=C1COC2=CC=CC(O)=C12 CS-0106453 [0,1,0,1,0,0|1,0,0]=3 454 B12R2.203 O=C1NCC2=NC=CC(Br)=C12 CS-0078947 [0,1,0,1,0,0|2,0,0]=4 455 B12R2.196 CC1=C2C=CC=C(Br)C2=NN1 CS-0037244 [0,1,0,1,0,0|2,0,0]=4 456 B12R2.196 CC1=NOC2=C1C=CC=C2Br CS-0106925 [0,1,0,1,0,0|1,0,1]=4 457 B12R2.196 ClC1=NOC2=C1C=CC=C2Br CS-0098086 [0,1,0,1,0,0|1,0,1]=4 458 B12R2.196 NC1=C2COC(=O)C2=CC=C1 CS-0064854 [0,1,0,1,0,0|2,0,0]=4 459 B12R2.196 O=C1COC2=C(F)C=CC=C12 CS-0106328 [0,1,0,1,0,0|1,0,0]=3 460 B12R2.196 O=C1NCC2=C1C=CC=C2F CS-0062221 [0,1,0,1,0,0|1,0,0]=3 461 B12R2.196 O=C1NN=C2C(Cl)=CC=CN12 CS-0084377 [0,1,0,1,0,0|2,0,0]=4 462 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 CS-0085338 [0,1,0,1,0,0|1,0,1]=4 463 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 CS-0085325 [0,1,0,1,0,0|1,0,1]=4 464 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 CS-W008688 [0,1,0,1,0,0|2,0,0]=4 465 B12R2.612 NC1=CC=C2C(=O)COC2=C1 CS-0104549 [0,1,0,1,0,0|1,0,0]=3 466 B12R2.612 NC1COC2=CC(Br)=CC=C21 CS-0107295 [0,1,0,1,0,0|1,0,1]=4 467 B12R2.612 O=C1COC2=CC(F)=CC=C12 CS-0105957 [0,1,0,1,0,0|1,0,0]=3 468 B12R2.612 O=C1CSC2=CC(Br)=CC=C12 CS-0101747 [0,1,0,1,0,0|1,1,0]=4 469 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 CS-D0305 [0,1,0,1,0,0|1,0,0]=3 470 B12R2.132 CC1=CC2=C(C=C1)CCC2=O CS-W014350 [0,1,0,1,0,0|2,0,0]=4 471 B12R2.132 CC1=CC2=C(I)NN=C2C=C1 CS-0037305 [0,1,0,1,0,0|2,0,0]=4 472 B12R2.132 N=C1NNC2=C1C=C(F)C=C2 CS-0060649 [0,1,0,1,0,0|2,0,0]=4 473 B12R2.132 NC1=CC=C2COC(=O)C2=C1 CS-0036733 [0,1,0,1,0,0|2,0,0]=4 474 B12R2.132 NC1=CC=C2CSC(=O)C2=C1 CS-0093507 [0,1,0,1,0,0|2,0,0]=4 475 B12R2.132 NC1=NNC2=C1C=C(Cl)C=C2 CS-0085350 [0,1,0,1,0,0|2,0,0]=4 476 B12R2.132 O=C1NC=C2C=CC(Br)=CN12 CS-0100755 [0,1,0,1,0,0|2,0,0]=4 477 B12R2.132 O=C1NCC2=C1C=C(Br)N=C2 CS-0099944 [0,1,0,1,0,0|2,0,0]=4 478 B12R2.132 O=C1NCC2=C1C=C(Cl)C=C2 CS-0082122 [0,1,0,1,0,0|1,0,0]=3 479 B12R2.132 O=C1NCC2=C1C=C(Cl)N=C2 CS-0100307 [0,1,0,1,0,0|2,0,0]=4 480 B12R2.132 O=C1NCC2=C1C=C(I)C=C2 CS-0096365 [0,1,0,1,0,0|1,0,0]=3 481 B12R2.132 O=C1NNC2=C1C=C(I)C=C2 CS-D0093 [0,1,0,1,0,0|1,0,0]=3 482 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 CS-B1580 [0,1,0,1,0,0|0,0,0]=2 483 B12R2.1 BrCC1=NOC2=C1C=CC=C2 CS-0085292 [0,1,0,1,0,0|1,0,1]=4 484 B12R2.18 CN1N=C2C=CC=CC2=C1Br CS-0051481 [0,1,0,1,0,0|2,0,0]=4 485 B12R2.18 NC1C(=O)NC2=C1C=CC=C2 CS-0111958 [0,1,0,1,0,0|1,0,1]=4 486 B12R2.18 O=C1CC2=CC=CC=C2C1=O CS-W014296 [0,1,0,1,0,0|2,0,0]=4 487 B8R1.7 NC(=O)C1=NC=CO1 CS-0039003 [1,0,0,0,1,0|2,0,0]=4 488 B8R1.11 CC1=CSC=C1C=O CS-0050796 [1,0,0,0,1,0|2,0,0]=4 489 B8R1.11 NC1=C(C=O)OC=C1 CS-0089104 [1,0,0,0,1,0|2,0,0]=4 490 B8R1.11 O=CC1=C(Br)C=CS1 CS-W007753 [1,0,0,0,1,0|2,0,0]=4 491 B8R1.11 O=CC1=C(F)C=CS1 CS-0084808 [1,0,0,0,1,0|2,0,0]=4 492 B12R1.125 C(C(=O)O)=CC1=CC=CC=C1Br CS-W014204 [0,0,0,0,0,2|2,0,0]=4 493 B12R1.125 CC(=O)SCC1=CC=CC=C1Cl CS-0036273 [0,0,0,0,0,2|2,0,0]=4