0 B11R1.41 C=CCC1=CC=CC=C1C=O CS-0696392 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.41 CCC1=C(CC#N)C=CC=C1 CS-0369113 [0,0,0,0,0,0|1,0,2]=3 2 B11R1.41 CCOC1=CC=CC=C1C#N CS-W016345 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.41 CCOC1=CC=CC=C1C=O CS-W018149 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.41 CCOC1=CC=CC=C1CN CS-W018113 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.41 CNCC1=CC=CC=C1C#N CS-0513966 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.41 CNCC1=CC=CC=C1OC CS-W023049 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.41 COC1=CC=CC=C1CCBr CS-0035870 [0,0,0,0,0,0|1,0,0]=1 8 B11R1.41 COC1=CC=CC=C1CCO CS-W001944 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.41 N#CCC1=CC=CC=C1C#N CS-W016427 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.41 N#CCC1=CC=CC=C1CBr CS-0696346 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.41 O=CC1=CC=CC=C1CCBr CS-0171418 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.4 BrCCC1=CC=CC=C1Br CS-0156656 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.4 C=CCC1=C(Br)C=CC=C1 CS-0157945 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.4 CC1=CC=CC=C1CC#N CS-W019570 [1,0,0,0,0,0|0,0,2]=3 15 B10R1.4 CC1=CC=CC=C1CCBr CS-0217103 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.4 CC1=CC=CC=C1CCO CS-W021450 [1,0,0,0,0,0|1,0,0]=2 17 B10R1.4 CCCC1=CC=CC=C1N CS-0152410 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.4 CCCC1=CC=CC=C1O CS-0236906 [1,0,0,0,0,0|1,0,0]=2 19 B10R1.4 CCNC1=CC=CC=C1N CS-0151974 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.4 CCOC1=C(O)C=CC=N1 CS-0209330 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.4 CCOC1=CC=CC=C1F CS-W014358 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.4 CCOC1=CC=CC=C1N CS-0330467 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.4 CCOC1=CC=CC=C1O CS-0040351 [1,0,0,0,0,0|2,0,0]=3 24 B10R1.4 CNCC1=CC=CC=C1Br CS-0031414 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.4 CNCC1=CC=CC=C1C CS-0045339 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.4 CNCC1=CC=CC=C1Cl CS-0151001 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.4 CNCC1=CC=CC=C1F CS-W005782 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.4 COCC1=CC=CC=C1Br CS-0195278 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.4 COCC1=CC=CC=C1N CS-0505134 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.4 COCC1=CC=CC=C1O CS-W021443 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.4 ClC1=CC=CC=C1CCBr CS-0081877 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.4 FC1=CC=CC=C1CCBr CS-0139578 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.4 N#CCC1=CC=CC=C1Br CS-W019568 [1,0,0,0,0,0|1,0,2]=4 34 B10R1.4 N#CCC1=CC=CC=C1Cl CS-W020135 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.4 N#CCC1=CC=CC=C1F CS-W013356 [1,0,0,0,0,0|1,0,2]=4 36 B10R1.4 N#CCC1=CC=CC=C1I CS-0041514 [1,0,0,0,0,0|1,0,2]=4 37 B10R1.4 N#CCC1=CC=CC=C1N CS-W008009 [1,0,0,0,0,0|1,0,2]=4 38 B10R1.4 NC1=CC=CC=C1CCO CS-W004959 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.4 NNCC1=C(Cl)C=CC=C1 CS-0053073 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.4 NNCC1=C(F)C=CC=C1 CS-0053071 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.4 NNCC1=C(F)C=CC=C1 CS-0053072 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.4 NOCC1=CC=CC=C1Br CS-0323003 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.4 NOCC1=CC=CC=C1Cl CS-0213485 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.4 NOCC1=CC=CC=C1F CS-0098085 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.4 NOCC1=CC=CC=C1F CS-0269655 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.4 OCCC1=CC=CC=C1Br CS-W002365 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.4 OCCC1=CC=CC=C1Cl CS-W017988 [1,0,0,0,0,0|2,0,0]=3 48 B10R1.4 OCCC1=CC=CC=C1F CS-W016461 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.4 OCCC1=CC=CC=C1I CS-0045354 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.4 OCCC1=CC=CC=C1O CS-W016503 [1,0,0,0,0,0|1,0,0]=2 51 B10R1.4 ONCC1=C(Cl)C=CC=C1 CS-0966676 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.4 O\N=C\C1=CC=CC=C1O CS-0010128 [1,0,0,0,0,0|2,0,1]=4 53 B10R1.20 C#CC1=C(CO)C=CC=C1 CS-0188006 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.20 C#CC1=C(OC)C=CC=N1 CS-0059692 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.20 C#CC1=C(OC)N=CC=C1 CS-0158573 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.20 C#CC1=CC=CC=C1CN CS-0162334 [1,0,0,0,0,0|1,0,1]=3 57 B10R1.20 C#CC1=CC=CC=C1OC CS-W005515 [1,0,0,0,0,0|0,0,2]=3 58 B10R1.20 C=CC1=CC=CC=C1OC CS-0144527 [1,0,0,0,0,0|0,0,2]=3 59 B10R1.20 CCC1=CC=CC=C1C#N CS-0172218 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.20 CCC1=CC=CC=C1C=O CS-W007787 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.20 CCC1=CC=CC=C1CO CS-W007268 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.20 CCC1=CC=CC=C1NN CS-W017568 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.20 CNC1=CC=CC=C1C#N CS-0139322 [1,0,0,0,0,0|1,0,2]=4 64 B10R1.20 CNC1=CC=CC=C1C=O CS-W021444 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.20 CNC1=CC=CC=C1CO CS-0151025 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.20 CNC1=CC=CC=C1NC CS-W000645 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.20 CNC1=CC=CC=C1OC CS-0151024 [1,0,0,0,0,0|1,0,0]=2 68 B10R1.20 CNC1=NC=CC=C1CO CS-W023173 [1,0,0,0,0,0|3,0,0]=4 69 B10R1.20 COC1=C(C#N)C=CN=C1 CS-0063326 [1,0,0,0,0,0|1,0,2]=4 70 B10R1.20 COC1=C(C#N)C=NC=C1 CS-0142298 [1,0,0,0,0,0|1,0,2]=4 71 B10R1.20 COC1=C(C#N)N=CC=C1 CS-0082321 [1,0,0,0,0,0|1,0,2]=4 72 B10R1.20 COC1=C(C=O)C=CC=N1 CS-W004144 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.20 COC1=C(C=O)C=NC=C1 CS-D0961 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.20 COC1=C(CCl)C=CC=N1 CS-0329418 [1,0,0,0,0,0|2,0,0]=3 75 B10R1.20 COC1=C(CCl)C=CN=C1 CS-0497532 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.20 COC1=C(CO)C=CN=C1 CS-0054446 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.20 COC1=C(CO)N=CC=C1 CS-0044028 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.20 COC1=C(NN)N=CC=C1 CS-0302441 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.20 COC1=C(OC)C=NC=C1 CS-0089788 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.20 COC1=C(OC)N=CC=C1 CS-W008190 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.20 COC1=C(OC)N=CC=N1 CS-0331366 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.20 COC1=CC=CC=C1C#N CS-W007580 [1,0,0,0,0,0|0,0,2]=3 83 B10R1.20 COC1=CC=CC=C1C=O CS-W018515 [1,0,0,0,0,0|1,0,1]=3 84 B10R1.20 COC1=CC=CC=C1CN CS-W011056 [1,0,0,0,0,0|0,0,0]=1 85 B10R1.20 COC1=CC=CC=C1CO CS-W016501 [1,0,0,0,0,0|1,0,0]=2 86 B10R1.20 COC1=CC=CC=C1NN CS-W002166 [1,0,0,0,0,0|1,0,0]=2 87 B10R1.20 COC1=CC=CC=C1OC CS-B1822 [1,0,0,0,0,0|1,0,0]=2 88 B10R1.20 COC1=CC=CN=C1C=O CS-W021956 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.20 COC1=CC=CN=C1CN CS-0071730 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.20 COC1=NC=CC=C1C#N CS-0006842 [1,0,0,0,0,0|1,0,2]=4 91 B10R1.20 COC1=NC=CC=C1CBr CS-0610210 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.20 COC1=NC=CC=C1CN CS-0053527 [1,0,0,0,0,0|1,0,0]=2 93 B10R1.20 COC1=NC=CC=C1CN CS-W021066 [1,0,0,0,0,0|1,0,0]=2 94 B10R1.20 COC1=NC=CC=C1CO CS-0031357 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.20 COC1=NC=CN=C1CN CS-0111727 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.20 COC1=NC=NC=C1CO CS-0131605 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.20 CSC1=CC=CC=C1C=O CS-0006413 [1,0,0,0,0,0|1,1,1]=4 98 B10R1.20 CSC1=CC=CC=C1CN CS-0453750 [1,0,0,0,0,0|0,1,0]=2 99 B10R1.20 N#CC1=CC=CC=C1CN CS-W003351 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.20 N#CC1=CC=CC=C1CN CS-W006008 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.20 N#CC1=CC=CC=C1NN CS-W006296 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.20 NCC1=CC=CC=C1CN CS-0156044 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.20 NCC1=CC=CC=C1CO CS-W003577 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.20 OCC1=CC=CC=C1CBr CS-0156043 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.20 OCC1=CC=CC=C1CO CS-0017881 [1,0,0,0,0,0|3,0,0]=4 106 B12R1.75 COC1=C(CC(=O)O)N=CC=C1 CS-0055505 [0,1,0,0,0,0|2,0,1]=4 107 B12R1.75 COC1=C(CC(C)C)N=CC=N1 CS-W017857 [0,1,0,0,0,0|3,0,0]=4 108 B12R1.75 COC1=CC=CC=C1CC(=O)O CS-D0984 [0,1,0,0,0,0|1,0,1]=3 109 B12R1.75 COC1=CC=CC=C1NC(N)=O CS-0303218 [0,1,0,0,0,0|1,0,1]=3 110 B12R1.75 COC1=CC=CC=C1NC(N)=S CS-0143650 [0,1,0,0,0,0|1,0,1]=3 111 B12R1.75 COC1=CC=CC=C1OC(C)=O CS-0068376 [0,1,0,0,0,0|2,0,1]=4 112 B12R1.75 COC1=NC=CC=C1CC(=O)O CS-0106456 [0,1,0,0,0,0|2,0,1]=4 113 B12R1.77 CCC(=O)C1=C(OC)C=CC=C1 CS-0071889 [0,1,0,0,0,0|1,0,1]=3 114 B12R1.77 CCC(=O)C1=CC=CC=C1CC CS-0324216 [0,1,0,0,0,0|2,0,1]=4 115 B12R1.77 CCC(C)C1=C(OC)N=CC=N1 CS-W017856 [0,1,0,0,0,0|3,0,0]=4 116 B12R1.77 COC1=CC=CC=C1C(=O)CBr CS-W012983 [0,1,0,0,0,0|1,0,1]=3 117 B12R1.77 COC1=CC=CC=C1C(=O)NN CS-W003975 [0,1,0,0,0,0|1,0,1]=3 118 B12R1.77 COC1=CC=CC=C1C(N)CO CS-0091305 [0,1,0,0,0,0|1,0,0]=2 119 B12R1.112 CCOC1=C(OC)C=C(Br)C=C1 CS-0191953 [0,1,0,0,0,0|2,0,0]=3 120 B12R1.112 COC1=CC(Br)=CC=C1CC#N CS-0097933 [0,1,0,0,0,0|0,0,2]=3 121 B12R1.112 COC1=CC(F)=CC=C1CC#N CS-B1268 [0,1,0,0,0,0|0,0,2]=3 122 B12R1.121 CCCOC1=CC=CC=C1C=O CS-0084129 [0,1,0,0,0,0|3,0,0]=4 123 B12R1.121 COC1=C(OCCN)C=CC=C1 CS-0030728 [0,1,0,0,0,0|0,0,0]=1 124 B12R1.121 COC1=CC=CC=C1CCCBr CS-0303187 [0,1,0,0,0,0|1,0,0]=2 125 B12R1.121 COC1=CC=CC=C1\C=C\C=O CS-0065992 [0,1,0,0,0,0|1,0,2]=4 126 B12R1.121 O=CC1=CC=CC=C1OCCBr CS-0060469 [0,1,0,0,0,0|3,0,0]=4 127 B12R1.169 OCCC1=CC=CC=C1CCO CS-0200239 [0,1,0,0,0,0|2,0,0]=3 128 B12R1.268 COC1=CC=C(Br)C=C1CC#N CS-0097806 [0,1,0,0,0,0|0,0,2]=3 129 B12R1.268 COC1=CC=C(Cl)C=C1CC#N CS-B1013 [0,1,0,0,0,0|0,0,2]=3 130 B12R1.268 COC1=CC=C(F)C=C1CC#N CS-0134619 [0,1,0,0,0,0|0,0,2]=3 131 B12R1.283 CCOC1=CC=CC=C1C(C)=O CS-0307804 [0,1,0,0,0,0|3,0,0]=4 132 B12R1.283 O=[N+]([O-])C1=CC=CC=C1CCO CS-W008358 [0,1,0,0,0,0|3,0,0]=4 133 B12R2.1 BrCC1=NOC2=C1C=CC=C2 CS-0085292 [0,0,0,1,0,0|2,0,1]=4 134 B12R2.1 NCC1=CNC2=C1C=CC=C2 CS-D1572 [0,0,0,1,0,0|1,0,2]=4 135 B12R2.1 NCC1=CSC2=CC=CC=C12 CS-0156018 [0,0,0,1,0,0|0,1,2]=4 136 B12R2.1 NCC1=CSC2=CC=CC=C12 CS-0156019 [0,0,0,1,0,0|0,1,2]=4 137 B12R2.1 NCC1=NNC2=C1C=CC=C2 CS-0186027 [0,0,0,1,0,0|2,0,1]=4 138 B12R2.1 NCC1=NNC2=C1C=CC=C2 CS-D1638 [0,0,0,1,0,0|2,0,1]=4 139 B12R2.1 NCC1=NOC2=CC=CC=C21 CS-0342618 [0,0,0,1,0,0|1,0,1]=3 140 B12R2.18 CC1CC2=CC=CC=C2C1=O CS-W018228 [0,0,0,1,0,0|3,0,0]=4 141 B12R2.18 CC1NC2=C(C=CC=C2)C1C CS-0137235 [0,0,0,1,0,0|3,0,0]=4 142 B12R2.18 CN1C(=O)CC2=CC=CC=C21 CS-W013308 [0,0,0,1,0,0|2,0,1]=4 143 B12R2.18 CN1C(=S)CC2=CC=CC=C21 CS-0300848 [0,0,0,1,0,0|2,0,1]=4 144 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 CS-0038976 [0,0,0,1,0,0|2,0,1]=4 145 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O CS-W007401 [0,0,0,1,0,0|3,0,0]=4 146 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@@H]1O CS-0034926 [0,0,0,1,0,0|3,0,0]=4 147 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O CS-W002530 [0,0,0,1,0,0|3,0,0]=4 148 B12R2.18 O=C1C2=CC=CC=C2CC1Br CS-W015067 [0,0,0,1,0,0|3,0,0]=4 149 B12R2.24 CC1CCC2=CC=CC=C2N1 CS-W019554 [0,0,0,1,0,0|3,0,0]=4 150 B12R2.24 CC1CNC2=C(C=CC=C2)C1 CS-W021961 [0,0,0,1,0,0|2,0,0]=3 151 B12R2.24 CC1CNC2=C(C=CC=C2)N1 CS-0122518 [0,0,0,1,0,0|3,0,0]=4 152 B12R2.24 CN1CCC2=CC=CC=C2C1 CS-0186657 [0,0,0,1,0,0|3,0,0]=4 153 B12R2.24 CN1CCC2=CC=CC=C2C1 CS-0197549 [0,0,0,1,0,0|3,0,0]=4 154 B12R2.24 NC1CCC2=CC=CC=C2C1 CS-W006188 [0,0,0,1,0,0|1,0,0]=2 155 B12R2.24 NC1CNC2=CC=CC=C2C1 CS-W021270 [0,0,0,1,0,0|1,0,0]=2 156 B12R2.24 NC1COC2=CC=CC=C2C1 CS-0137502 [0,0,0,1,0,0|0,0,0]=1 157 B12R2.24 N[C@H]1COC2=CC=CC=C2C1 CS-0137501 [0,0,0,1,0,0|0,0,0]=1 158 B12R2.24 O=C1CCC2=CC=CC=C2C1 CS-B0118 [0,0,0,1,0,0|2,0,1]=4 159 B12R2.24 O=C1COC2=CC=CC=C2N1 CS-W002455 [0,0,0,1,0,0|2,0,1]=4 160 B12R2.24 O=C1COC2=CC=CC=C2O1 CS-0062232 [0,0,0,1,0,0|2,0,1]=4 161 B12R2.24 OC1CCC2=CC=CC=C2C1 CS-W004310 [0,0,0,1,0,0|2,0,0]=3 162 B12R2.24 OC1CNC2=C(C=CC=C2)C1 CS-B0459 [0,0,0,1,0,0|2,0,0]=3 163 B12R2.24 [C@@H]1(N)CCC2=CC=CC=C2C1 CS-W007303 [0,0,0,1,0,0|1,0,0]=2 164 B12R2.24 [C@H]1(N)CCC2=CC=CC=C2C1 CS-W006551 [0,0,0,1,0,0|1,0,0]=2 165 B12R2.41 C1=CC=C2CCNCCC2=C1 CS-0139564 [0,0,0,1,0,0|1,0,0]=2 166 B12R2.41 C1=CC=C2NCCCCC2=C1 CS-0149007 [0,0,0,1,0,0|2,0,0]=3 167 B12R2.41 C1=CC=C2NCCCCC2=C1 CS-W005435 [0,0,0,1,0,0|2,0,0]=3 168 B12R2.41 C1=CC=C2NCCCNC2=C1 CS-0126745 [0,0,0,1,0,0|3,0,0]=4 169 B12R2.41 C1=CC=C2OCCCNC2=C1 CS-0139288 [0,0,0,1,0,0|2,0,0]=3 170 B12R2.41 C1=CN=C2CCCCCC2=C1 CS-0043610 [0,0,0,1,0,0|3,0,0]=4 171 B12R2.315 C=CC1=C2CCOC2=CC=C1 CS-0033270 [0,0,0,1,0,0|2,0,1]=4 172 B12R2.315 CNC1=CC=CC2=C1C=NN2 CS-0048808 [0,0,0,1,0,0|2,0,1]=4 173 B12R2.315 COC1=C2C=CNC2=CC=C1 CS-W008893 [0,0,0,1,0,0|0,0,2]=3 174 B12R2.315 COC1=C2C=CNC2=NC=C1 CS-B0504 [0,0,0,1,0,0|1,0,2]=4 175 B12R2.315 COC1=C2N=CSC2=CC=C1 CS-0465103 [0,0,0,1,0,0|2,0,1]=4 176 B12R2.315 COC1=C2SC=CC2=CC=C1 CS-0527575 [0,0,0,1,0,0|2,0,1]=4 177 B12R2.315 COC1=CC=CC2=C1C=CS2 CS-0099933 [0,0,0,1,0,0|1,0,2]=4 178 B12R2.315 COC1=CC=CC2=C1C=NN2 CS-D1594 [0,0,0,1,0,0|1,0,1]=3 179 B12R2.315 COC1=CC=CC2=C1CCN2 CS-0045053 [0,0,0,1,0,0|0,0,0]=1 180 B12R2.315 COC1=CC=CC2=C1CNC2 CS-W022208 [0,0,0,1,0,0|2,0,0]=3 181 B12R2.315 COC1=CC=CC2=C1NC=C2 CS-W001536 [0,0,0,1,0,0|2,0,1]=4 182 B12R2.315 COC1=CC=CC2=C1NC=N2 CS-0043995 [0,0,0,1,0,0|1,0,2]=4 183 B12R2.315 COC1=CC=CC2=C1NCC2 CS-0085466 [0,0,0,1,0,0|2,0,0]=3 184 B12R2.315 COC1=CC=CC2=C1OC=C2 CS-0150289 [0,0,0,1,0,0|2,0,1]=4 185 B12R2.315 COC1=CC=CC2=CNN=C21 CS-0043993 [0,0,0,1,0,0|3,0,0]=4 186 B12R2.315 COC1=NC=CC2=C1C=CN2 CS-W006663 [0,0,0,1,0,0|1,0,2]=4 187 B12R2.315 NCC1=C2CCOC2=CC=C1 CS-0159663 [0,0,0,1,0,0|3,0,0]=4 188 B12R2.315 OCC1=C2CCNC2=CC=C1 CS-W018974 [0,0,0,1,0,0|2,0,0]=3 189 B12R2.1081 CC1=NCCC2=CC=CC=C21 CS-0152737 [0,0,0,1,0,0|1,0,1]=3 190 B12R2.1081 CC1CCNC2=C1C=CC=C2 CS-0019301 [0,0,0,1,0,0|3,0,0]=4 191 B12R2.1081 CC1NCCC2=CC=CC=C21 CS-W002686 [0,0,0,1,0,0|1,0,0]=2 192 B12R2.1081 CN1CCNC2=C1C=CC=C2 CS-W021345 [0,0,0,1,0,0|3,0,0]=4 193 B12R2.1081 NC1CCCC2=C1C=CC=C2 CS-0131597 [0,0,0,1,0,0|3,0,0]=4 194 B12R2.1081 NC1CCCC2=CC=CC=C21 CS-W007739 [0,0,0,1,0,0|3,0,0]=4 195 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 CS-W007717 [0,0,0,1,0,0|3,0,0]=4 196 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 CS-0357434 [0,0,0,1,0,0|3,0,0]=4 197 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 CS-W008303 [0,0,0,1,0,0|3,0,0]=4 198 B12R2.1081 O=C1CCCC2=C1C=CC=C2 CS-0226151 [0,0,0,1,0,0|3,0,0]=4 199 B12R2.1081 O=C1NCCC2=C1C=CC=C2 CS-W008863 [0,0,0,1,0,0|2,0,0]=3 200 B12R2.1081 O=C1NCCC2=C1N=CC=C2 CS-W019035 [0,0,0,1,0,0|3,0,0]=4 201 B12R2.1081 O=C1OCCC2=C1C=CC=C2 CS-W018632 [0,0,0,1,0,0|3,0,0]=4 202 B12R2.1081 OC1CCCC2=CC=CC=C21 CS-W004317 [0,0,0,1,0,0|3,0,0]=4 203 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 CS-0079970 [0,0,0,1,0,0|3,0,0]=4 204 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 CS-0079961 [0,0,0,1,0,0|3,0,0]=4 205 B12R2.2048 COC1=CC=CC=C1C2CO2 CS-0047012 [0,0,0,1,0,0|1,0,0]=2 206 B12R2.2048 O=CC1=CC=CC=C1C2CC2 CS-0112242 [0,0,0,1,0,0|3,0,0]=4 207 B9R1.8 BrCCC1=CC=CC=C1 CS-W019955 [2,0,0,0,0,0|1,0,0]=3 208 B9R1.8 BrCCC1=CC=CC=N1 CS-W003488 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.8 BrCCC1=CC=NC=C1 CS-0161004 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.8 C=CCC1=CC=CC=C1 CS-W011219 [2,0,0,0,0,0|1,0,1]=4 211 B9R1.8 CCCC1=CC=CC=C1 CS-0035165 [2,0,0,0,0,0|1,0,0]=3 212 B9R1.8 CCCC1=CN=CC=C1 CS-0359933 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.8 CCOC1=CC=CC=C1 CS-0017190 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.8 COCC1=CC=CC=C1 CS-W013553 [2,0,0,0,0,0|2,0,0]=4 215 B9R1.8 CSCC1=CC=CC=C1 CS-0322476 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.8 ClCCC1=CC=CC=C1 CS-W016446 [2,0,0,0,0,0|1,0,0]=3 217 B9R1.8 ClCCC1=NC=CC=C1 CS-0096286 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.8 ClCSC1=CC=CC=C1 CS-0326545 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.8 ICCC1=CC=CC=C1 CS-W012940 [2,0,0,0,0,0|1,0,0]=3 220 B9R1.8 NCCC1=CC=CC=N1 CS-0028882 [2,0,0,0,0,0|1,0,0]=3 221 B9R1.8 NCCC1=CC=CC=N1 CS-W005000 [2,0,0,0,0,0|1,0,0]=3 222 B9R1.8 NCCC1=CC=CN=C1 CS-0514591 [2,0,0,0,0,0|1,0,0]=3 223 B9R1.8 NCCC1=CC=NC=C1 CS-W013547 [2,0,0,0,0,0|1,0,0]=3 224 B9R1.8 NCCC1=CN=CC=C1 CS-W008641 [2,0,0,0,0,0|1,0,0]=3 225 B9R1.8 NNCC1=CC=CC=C1 CS-0013904 [2,0,0,0,0,0|1,0,0]=3 226 B9R1.8 NNCC1=CC=CC=C1 CS-W008735 [2,0,0,0,0,0|1,0,0]=3 227 B9R1.8 NNCC1=CC=CC=C1 CS-W010888 [2,0,0,0,0,0|1,0,0]=3 228 B9R1.8 NNCC1=CC=CC=N1 CS-0155841 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.8 NNCC1=NC=CC=C1 CS-0052228 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.8 NOCC1=CC=CC=C1 CS-W008676 [2,0,0,0,0,0|1,0,0]=3 231 B9R1.8 NOCC1=CC=CC=C1 CS-W008955 [2,0,0,0,0,0|1,0,0]=3 232 B9R1.8 NOCC1=CN=CC=C1 CS-0156816 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.8 N\N=C\C1=CC=CC=C1 CS-0163075 [2,0,0,0,0,0|1,0,1]=4 234 B9R1.8 OCCC1=CC=CC=C1 CS-B1821 [2,0,0,0,0,0|1,0,0]=3 235 B9R1.8 OCCC1=CC=CN=C1 CS-0139429 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.8 OCCC1=CC=NC=C1 CS-W016575 [2,0,0,0,0,0|2,0,0]=4 237 B9R1.8 OCCC1=NC=CC=C1 CS-0129864 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.8 ONCC1=CC=CC=C1 CS-W002216 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.15 C#CC1=CC=CC=C1C CS-W013609 [2,0,0,0,0,0|0,0,2]=4 240 B9R1.15 C#CC1=CC=CC=C1N CS-W004892 [2,0,0,0,0,0|1,0,1]=4 241 B9R1.15 C=CC1=CC=CC=C1C CS-0110436 [2,0,0,0,0,0|0,0,2]=4 242 B9R1.15 C=CC1=CC=CC=C1N CS-W006235 [2,0,0,0,0,0|1,0,1]=4 243 B9R1.15 CC1=C(CN)N=CC=C1 CS-0153451 [2,0,0,0,0,0|1,0,0]=3 244 B9R1.15 CC1=C(CN)N=CC=C1 CS-0153452 [2,0,0,0,0,0|1,0,0]=3 245 B9R1.15 CC1=C(CO)C=CC=N1 CS-W013541 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.15 CC1=C(CO)C=NC=C1 CS-0053194 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.15 CC1=C(CO)N=CC=C1 CS-0046819 [2,0,0,0,0,0|2,0,0]=4 248 B9R1.15 CC1=C(NN)C=CN=C1 CS-0282175 [2,0,0,0,0,0|2,0,0]=4 249 B9R1.15 CC1=C(NN)N=CC=C1 CS-0153434 [2,0,0,0,0,0|2,0,0]=4 250 B9R1.15 CC1=CC=CC=C1C=O CS-W008902 [2,0,0,0,0,0|1,0,1]=4 251 B9R1.15 CC1=CC=CC=C1CN CS-M1443 [2,0,0,0,0,0|0,0,0]=2 252 B9R1.15 CC1=CC=CC=C1CO CS-0152955 [2,0,0,0,0,0|1,0,0]=3 253 B9R1.15 CC1=CC=CC=C1NN CS-W007773 [2,0,0,0,0,0|1,0,0]=3 254 B9R1.15 CC1=CC=CN=C1CN CS-0094519 [2,0,0,0,0,0|1,0,0]=3 255 B9R1.15 CC1=CC=NC=C1CN CS-0053195 [2,0,0,0,0,0|1,0,0]=3 256 B9R1.15 CC1=CN=CC=C1CN CS-0235394 [2,0,0,0,0,0|1,0,0]=3 257 B9R1.15 CC1=CN=CC=C1CO CS-0053354 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.15 CC1=NC=CN=C1CN CS-0089039 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.15 CCC1=C(Br)C=CC=N1 CS-W005860 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.15 CCC1=C(Br)C=NC=C1 CS-W021862 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.15 CCC1=C(C)N=CC=N1 CS-W013548 [2,0,0,0,0,0|2,0,0]=4 262 B9R1.15 CCC1=C(N)C=CN=C1 CS-0611114 [2,0,0,0,0,0|2,0,0]=4 263 B9R1.15 CCC1=CC=CC=C1Br CS-W016966 [2,0,0,0,0,0|1,0,0]=3 264 B9R1.15 CCC1=CC=CC=C1I CS-0109507 [2,0,0,0,0,0|1,0,0]=3 265 B9R1.15 CCC1=CC=CC=C1O CS-0152504 [2,0,0,0,0,0|0,0,0]=2 266 B9R1.15 CC[N+]1=CC=CC=C1Br CS-W012340 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.15 CNC1=C(N)C=CC=N1 CS-0046883 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.15 CNC1=C(N)C=NC=C1 CS-0146043 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.15 CNC1=CC=CC=C1Br CS-0130527 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.15 CNC1=CC=CC=C1C CS-0152952 [2,0,0,0,0,0|1,0,0]=3 271 B9R1.15 CNC1=CC=CC=C1Cl CS-0095956 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.15 CNC1=CC=CC=C1F CS-W013511 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.15 CNC1=CC=CC=C1N CS-W007682 [2,0,0,0,0,0|1,0,0]=3 274 B9R1.15 CNC1=CC=CC=C1N CS-W015729 [2,0,0,0,0,0|1,0,0]=3 275 B9R1.15 CNC1=CC=CC=C1O CS-B1556 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.15 CNC1=CC=CN=C1N CS-0090257 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.15 CNC1=CN=CC=C1C CS-M3532 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.15 CNC1=NC=CC=C1C CS-0238113 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.15 COC1=C(Br)C=CN=C1 CS-0031482 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.15 COC1=C(Br)N=CC=C1 CS-W007501 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.15 COC1=C(C)C=CC=C1 CS-0071775 [2,0,0,0,0,0|0,0,0]=2 282 B9R1.15 COC1=C(C)C=CC=N1 CS-0153433 [2,0,0,0,0,0|1,0,0]=3 283 B9R1.15 COC1=C(C)N=CC=C1 CS-0197095 [2,0,0,0,0,0|1,0,0]=3 284 B9R1.15 COC1=C(C)N=CC=N1 CS-W016571 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.15 COC1=C(Cl)C=CC=N1 CS-W003028 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.15 COC1=C(Cl)N=CC=C1 CS-W003068 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.15 COC1=C(F)C=CC=N1 CS-W005457 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.15 COC1=C(F)C=NC=C1 CS-0040329 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.15 COC1=C(I)C=CC=N1 CS-W003011 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.15 COC1=C(N)C=CC=N1 CS-W008209 [2,0,0,0,0,0|1,0,0]=3 291 B9R1.15 COC1=C(N)C=CN=C1 CS-W007049 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.15 COC1=C(N)C=CN=N1 CS-0081659 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.15 COC1=C(N)C=NC=C1 CS-W000346 [2,0,0,0,0,0|1,0,0]=3 294 B9R1.15 COC1=CC=CC=C1Br CS-W007633 [2,0,0,0,0,0|1,0,0]=3 295 B9R1.15 COC1=CC=CC=C1Cl CS-W018270 [2,0,0,0,0,0|1,0,0]=3 296 B9R1.15 COC1=CC=CC=C1I CS-W009305 [2,0,0,0,0,0|1,0,0]=3 297 B9R1.15 COC1=CC=CC=C1N CS-0150305 [2,0,0,0,0,0|0,0,0]=2 298 B9R1.15 COC1=CC=CC=C1O CS-D1347 [2,0,0,0,0,0|1,0,0]=3 299 B9R1.15 COC1=CC=CC=C1S CS-W018309 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.15 COC1=CC=CN=C1F CS-0097752 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.15 COC1=CC=CN=C1I CS-0063167 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.15 COC1=CC=CN=C1N CS-W019632 [2,0,0,0,0,0|1,0,0]=3 303 B9R1.15 COC1=CC=CNC1=O CS-0149617 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.15 COC1=CC=NC=C1Br CS-W004248 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.15 COC1=CC=NC=C1O CS-0150284 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.15 COC1=NC=CC=C1Br CS-D0942 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.15 COC1=NC=CC=C1O CS-0096331 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.15 COC1=NC=CN=C1N CS-W018865 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.15 COC1=NC=NC=C1N CS-0045739 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.15 CSC1=C(N)C=CC=C1 CS-0072892 [2,0,0,0,0,0|0,1,0]=3 311 B9R1.15 CSC1=CC=CC=C1Br CS-0150107 [2,0,0,0,0,0|1,1,0]=4 312 B9R1.15 CSC1=CC=CC=C1Cl CS-0150105 [2,0,0,0,0,0|1,1,0]=4 313 B9R1.15 CSC1=CC=CC=C1I CS-0142865 [2,0,0,0,0,0|1,1,0]=4 314 B9R1.15 CSC1=CC=CC=C1O CS-W018308 [2,0,0,0,0,0|1,0,0]=3 315 B9R1.15 CSC1=CC=CN=C1N CS-0127768 [2,0,0,0,0,0|1,1,0]=4 316 B9R1.15 N#CC1=CC=CC=C1N CS-W013598 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.15 N#CC1=CC=CC=C1O CS-W013585 [2,0,0,0,0,0|0,0,2]=4 318 B9R1.15 NC1=CC=CC=C1C=O CS-W007486 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.15 NC1=CC=CC=C1CO CS-W004705 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.15 NCC1=C(Br)C=NC=C1 CS-0200327 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.15 NCC1=C(Cl)C=CN=C1 CS-0038079 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.15 NCC1=C(F)N=CC=C1 CS-0043863 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.15 NCC1=CC=CC=C1Br CS-W004667 [2,0,0,0,0,0|1,0,0]=3 324 B9R1.15 NCC1=CC=CC=C1Cl CS-W016433 [2,0,0,0,0,0|1,0,0]=3 325 B9R1.15 NCC1=CC=CC=C1F CS-W004092 [2,0,0,0,0,0|1,0,0]=3 326 B9R1.15 NCC1=CC=CC=C1I CS-0096870 [2,0,0,0,0,0|1,0,0]=3 327 B9R1.15 NCC1=CC=CC=C1O CS-0080161 [2,0,0,0,0,0|0,0,0]=2 328 B9R1.15 NCC1=CC=CC=C1O CS-D1655 [2,0,0,0,0,0|0,0,0]=2 329 B9R1.15 NCC1=CC=CN=C1Br CS-0147258 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.15 NCC1=CC=CN=C1F CS-0112238 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.15 NCC1=CC=CNC1=O CS-0186713 [2,0,0,0,0,0|1,0,1]=4 332 B9R1.15 NCC1=CC=NC=C1F CS-0443474 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.15 NCC1=CC=NC=C1F CS-W006645 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.15 NCC1=NC=CC=C1Br CS-0136640 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.15 NCC1=NC=CC=C1F CS-0047058 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.15 NCC1=NC=CC=C1F CS-0053366 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.15 NCC1=NC=CC=C1F CS-0053866 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.15 NNC1=C(Br)C=CC=C1 CS-0696658 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.15 NNC1=CC=CC=C1Br CS-W013082 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.15 NNC1=CC=CC=C1F CS-W016106 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.15 NNC1=CC=CC=C1I CS-0156628 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.15 OCC1=CC=CC=C1Br CS-W008828 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.15 OCC1=CC=CC=C1Cl CS-W016422 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.15 OCC1=CC=CC=C1F CS-0156643 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.15 OCC1=CC=CC=C1I CS-W004678 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.15 OCC1=CC=NC=C1O CS-0157312 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.15 OCC1=NC=CC=C1O CS-0020046 [2,0,0,0,0,0|2,0,0]=4 348 B11R1.13 CC1=C(CC#N)C=CC=C1F CS-W018177 [1,1,0,0,0,0|0,0,2]=4 349 B11R1.13 OCCC1=C(Cl)C(Cl)=CC=C1 CS-0157237 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.13 OCCC1=C(F)C(F)=CC=C1 CS-0157224 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.17 BrCCCC1=CC=CC=C1Br CS-0217098 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.17 C=CCOC1=CC=CC=C1O CS-0010474 [1,1,0,0,0,0|1,0,1]=4 353 B11R1.17 CC1=CC=CC=C1C#CCO CS-0354502 [1,1,0,0,0,0|1,0,1]=4 354 B11R1.17 CCCCC1=CC=CC=C1N CS-0313034 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.17 CCCOC1=CC=CC=C1Br CS-0192013 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.17 CCCOC1=CC=CC=C1N CS-0216358 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.17 CCCOC1=CC=CC=C1N CS-0449840 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.17 COCCC1=CC=CC=C1O CS-0150181 [1,1,0,0,0,0|1,0,0]=3 359 B11R1.17 FC1=CC=CC=C1OCCBr CS-0117208 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.17 N#CCCC1=CC=CC=C1Cl CS-0197396 [1,1,0,0,0,0|1,0,1]=4 361 B11R1.17 NCCOC1=CC=CC=C1Br CS-0450301 [1,1,0,0,0,0|1,0,0]=3 362 B11R1.17 OCCCC1=CC=CC=C1Br CS-W021756 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.17 OCCCC1=CC=CC=C1Cl CS-0208633 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.81 CC1=CC(Br)=CC=C1CC#N CS-0103703 [1,1,0,0,0,0|0,0,2]=4 365 B11R1.81 CCCC1=C(O)C=C(O)C=C1 CS-0152424 [1,1,0,0,0,0|1,0,0]=3 366 B11R1.81 ClC1=CC(Cl)=C(CCBr)C=C1 CS-0156858 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 CS-0038821 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.81 NNCC1=CC=C(F)C=C1F CS-0188141 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.81 NOCC1=CC=C(Cl)C=C1Cl CS-0104661 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 CS-W010738 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.81 OCCC1=C(Cl)C=C(F)C=C1 CS-0156855 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.86 CC(C)OC1=CC=CC=C1O CS-W010952 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.86 CC1=CC=CC=C1CC(=O)O CS-W018151 [1,1,0,0,0,0|1,0,1]=4 374 B11R1.86 CC1=CC=CC=C1OC(F)F CS-0121262 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.86 O=C(O)CC1=CC=CC=C1O CS-W016306 [1,1,0,0,0,0|1,0,1]=4 376 B11R1.86 OC1=CC=CC=C1OC(F)F CS-0029849 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.182 C=CCC1=CC(F)=CC=C1O CS-0231852 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.182 CC1=CC(CCO)=C(C)C=C1 CS-0061224 [1,1,0,0,0,0|1,0,0]=3 379 B11R1.182 CC1=CC=C(Br)C=C1CC#N CS-0442946 [1,1,0,0,0,0|0,0,2]=4 380 B11R1.182 CCNC1=CC(O)=CC=C1C CS-0040446 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.182 CNCC1=CC(Br)=CC=C1O CS-0151007 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.182 CNCC1=CC(F)=CC=C1O CS-0652897 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.182 COCC1=CC(F)=CC=C1O CS-0163407 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.182 NNCC1=CC(Cl)=CC=C1F CS-0162534 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.182 OCCC1=CC(Cl)=CC=C1Br CS-0142769 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.182 OCCC1=CC(F)=CC=C1F CS-0037438 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.222 CC1=CC=CC=C1C(=O)CBr CS-0029521 [1,1,0,0,0,0|1,0,1]=4 388 B11R1.222 CC1=CC=CC=C1C(=O)NN CS-0096270 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.222 CCC(=O)C1=CC=CC=C1C CS-0152651 [1,1,0,0,0,0|1,0,1]=4 390 B11R1.222 CCC(=O)C1=CC=CC=C1O CS-0064037 [1,1,0,0,0,0|1,0,1]=4 391 B11R1.222 CCC(C)C1=CC=CC=C1O CS-0152626 [1,1,0,0,0,0|1,0,0]=3 392 B11R1.222 CC[C@H](N)C1=CC=CC=C1F CS-0153931 [1,1,0,0,0,0|2,0,0]=4 393 B11R1.222 NC(CO)C1=CC=CC=C1Cl CS-0156698 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.222 NCC(=O)C1=CC=CC=C1F CS-W021538 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.222 NCC(O)C1=CC=CC=C1Cl CS-0171192 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.222 NNC(=O)C1=CC=CC=C1O CS-W004074 [1,1,0,0,0,0|1,0,1]=4 397 B11R1.222 N[C@@H](CO)C1=C(F)C=CC=C1 CS-0104715 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.222 N[C@H](CO)C1=CC=CC=C1Br CS-0162077 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.222 N[C@H](CO)C1=CC=CC=C1Cl CS-0163394 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.222 N[C@H](CO)C1=CC=CC=C1F CS-0042554 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.222 OC[C@H](O)C1=CC=CC=C1Cl CS-0890062 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.605 CCCC1=C(O)C=CC=C1O CS-0128889 [1,1,0,0,0,0|1,0,0]=3 403 B11R1.605 OCCC1=C(Cl)C=CC=C1Cl CS-W023063 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.605 OCCC1=C(Cl)C=CC=C1F CS-0060364 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.37 CCC1=CC(Br)=CC=C1C=O CS-0152528 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.37 CCC1=CC=C(Br)C=C1CO CS-0149199 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.37 CNC1=CC=C(Cl)C=C1OC CS-0168193 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.37 COC1=C(C#N)C=C(C)C=C1 CS-W018209 [1,1,0,0,0,0|0,0,2]=4 409 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 CS-W003329 [1,1,0,0,0,0|0,0,2]=4 410 B11R1.37 COC1=C(C#N)C=CC(F)=C1 CS-W014294 [1,1,0,0,0,0|0,0,2]=4 411 B11R1.37 COC1=C(C#N)C=CC(N)=C1 CS-W006863 [1,1,0,0,0,0|0,0,2]=4 412 B11R1.37 COC1=C(C=O)C=C(Br)C=C1 CS-M0570 [1,1,0,0,0,0|1,0,1]=4 413 B11R1.37 COC1=C(C=O)C=C(C)C=C1 CS-M1298 [1,1,0,0,0,0|1,0,1]=4 414 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 CS-W007792 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 CS-W019440 [1,1,0,0,0,0|1,0,1]=4 416 B11R1.37 COC1=C(C=O)C=CC(F)=C1 CS-W018054 [1,1,0,0,0,0|1,0,1]=4 417 B11R1.37 COC1=C(C=O)C=CC(O)=C1 CS-W016303 [1,1,0,0,0,0|1,0,1]=4 418 B11R1.37 COC1=C(CN)C=C(N)C=C1 CS-0076568 [1,1,0,0,0,0|0,0,0]=2 419 B11R1.37 COC1=C(CN)C=CC(F)=C1 CS-W017740 [1,1,0,0,0,0|0,0,0]=2 420 B11R1.37 COC1=C(CO)C=C(Br)C=C1 CS-M0571 [1,1,0,0,0,0|1,0,0]=3 421 B11R1.37 COC1=C(CO)C=C(C)C=C1 CS-0196208 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.37 COC1=C(CO)C=CC(Br)=C1 CS-W005395 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.37 COC1=C(CO)C=CC(C)=C1 CS-0196180 [1,1,0,0,0,0|1,0,0]=3 424 B11R1.37 COC1=C(CO)C=CC(Cl)=C1 CS-0192358 [1,1,0,0,0,0|1,0,0]=3 425 B11R1.37 COC1=C(CO)C=NC(Cl)=C1 CS-0095038 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.37 COC1=C(OC)C=C(C)C=C1 CS-W018091 [1,1,0,0,0,0|1,0,0]=3 427 B11R1.37 COC1=C(OC)C=C(Cl)C=C1 CS-0061908 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.37 COC1=C(OC)C=C(F)C=C1 CS-W004941 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.37 COC1=C(OC)C=C(S)C=C1 CS-W017698 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.37 COC1=CC(Br)=CN=C1OC CS-0114153 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.37 COC1=CC(C)=CC=C1C#N CS-0100569 [1,1,0,0,0,0|0,0,2]=4 432 B11R1.37 COC1=CC(C)=CC=C1C=O CS-W021710 [1,1,0,0,0,0|1,0,1]=4 433 B11R1.37 COC1=CC(Cl)=CC=C1C#N CS-0115635 [1,1,0,0,0,0|0,0,2]=4 434 B11R1.37 COC1=CC(I)=CC=C1C=O CS-0131371 [1,1,0,0,0,0|1,0,1]=4 435 B11R1.37 COC1=CC(N)=CC=C1CO CS-0112710 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.37 COC1=CC(O)=CC=C1CO CS-0099797 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.37 COC1=CC=C(Br)C=C1C#N CS-0042159 [1,1,0,0,0,0|0,0,2]=4 438 B11R1.37 COC1=CC=C(Br)C=C1CN CS-W021112 [1,1,0,0,0,0|0,0,0]=2 439 B11R1.37 COC1=CC=C(Br)C=C1OC CS-W007396 [1,1,0,0,0,0|1,0,0]=3 440 B11R1.37 COC1=CC=C(Cl)C=C1C#N CS-W017825 [1,1,0,0,0,0|0,0,2]=4 441 B11R1.37 COC1=CC=C(Cl)C=C1C=O CS-W017675 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.37 COC1=CC=C(F)C=C1C#N CS-W014293 [1,1,0,0,0,0|0,0,2]=4 443 B11R1.37 COC1=CC=C(F)C=C1C=O CS-W005085 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.37 COC1=CC=C(F)C=C1CN CS-0447041 [1,1,0,0,0,0|0,0,0]=2 445 B11R1.37 COC1=CC=C(F)C=C1CO CS-0043936 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.37 COC1=CC=C(I)C=C1C=O CS-0110027 [1,1,0,0,0,0|1,0,1]=4 447 B11R1.37 COC1=CC=C(I)C=C1OC CS-W022198 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.37 COC1=CC=C(I)N=C1OC CS-0082365 [1,1,0,0,0,0|2,0,0]=4 449 B11R1.37 COC1=CC=C(N)C=C1C#N CS-W006487 [1,1,0,0,0,0|0,0,2]=4 450 B11R1.37 COC1=CC=C(N)C=C1OC CS-W019949 [1,1,0,0,0,0|1,0,0]=3 451 B11R1.37 COC1=CC=C(N)N=C1OC CS-0036553 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.37 COC1=CC=C(O)C=C1C=O CS-W006530 [1,1,0,0,0,0|1,0,1]=4 453 B11R1.37 COC1=CC=C(O)C=C1OC CS-B1823 [1,1,0,0,0,0|1,0,0]=3 454 B11R1.37 COC1=NC(Br)=CC=C1CN CS-0169649 [1,1,0,0,0,0|1,0,0]=3 455 B11R1.37 COC1=NC(Cl)=CC=C1CO CS-0144761 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.37 COC1=NC=C(Br)C=C1CBr CS-0527033 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.37 COC1=NC=C(Br)C=C1CO CS-0053164 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.37 COC1=NC=C(F)C=C1CO CS-0186088 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.53 CC(C)C1=CC=CC=C1C=O CS-W019200 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.53 CC(N)C1=CC=CC=C1C#N CS-0173256 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.53 CCC1=CC=CC=C1B(O)O CS-W008004 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.53 CCC1=CC=CC=C1C(=O)O CS-W004346 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.53 CNC1=CC=CC=C1C(C)=O CS-0155084 [1,1,0,0,0,0|1,0,1]=4 464 B11R1.53 CNC1=CC=CC=C1C(N)=O CS-0151026 [1,1,0,0,0,0|1,0,1]=4 465 B11R1.53 COC1=CC=CC=C1B(O)O CS-W002569 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.53 COC1=CC=CC=C1C(=O)O CS-W019888 [1,1,0,0,0,0|1,0,1]=4 467 B11R1.53 COC1=CC=CC=C1C(C)=O CS-W016325 [1,1,0,0,0,0|0,0,1]=3 468 B11R1.53 COC1=CC=CC=C1C(C)N CS-0089766 [1,1,0,0,0,0|0,0,0]=2 469 B11R1.53 COC1=CC=CC=C1C(C)N CS-0158118 [1,1,0,0,0,0|0,0,0]=2 470 B11R1.53 COC1=CC=CC=C1C(C)O CS-0154083 [1,1,0,0,0,0|0,0,0]=2 471 B11R1.53 COC1=CC=CC=C1C(N)=O CS-0006716 [1,1,0,0,0,0|0,0,1]=3 472 B11R1.53 COC1=CC=CC=C1C(N)=S CS-0343401 [1,1,0,0,0,0|0,0,1]=3 473 B11R1.53 COC1=CC=CC=C1[C@@H](C)N CS-0000285 [1,1,0,0,0,0|0,0,0]=2 474 B11R1.53 COC1=CC=CC=C1[C@@H](C)N CS-0158193 [1,1,0,0,0,0|0,0,0]=2 475 B11R1.53 COC1=CC=CC=C1[C@H](C)N CS-0000284 [1,1,0,0,0,0|0,0,0]=2 476 B11R1.53 COC1=CC=CC=C1[C@H](C)N CS-0158255 [1,1,0,0,0,0|0,0,0]=2 477 B11R1.53 COC1=CC=CN=C1C(C)=O CS-W021223 [1,1,0,0,0,0|1,0,1]=4 478 B11R1.53 COC1=NC=CC=C1C(C)=O CS-W021206 [1,1,0,0,0,0|1,0,1]=4 479 B11R1.53 NCC1=CC=CC=C1B(O)O CS-0043156 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.53 NCC1=CC=CC=C1B(O)O CS-W019371 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.53 NCC1=CC=CC=C1C(=O)O CS-0269604 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.53 NCC1=CC=CC=C1C(=O)O CS-0341385 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] CS-0108771 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.265 COC1=C(Br)C=CC=C1C#N CS-0028742 [1,1,0,0,0,0|0,0,2]=4 485 B11R1.265 COC1=C(C#N)C(Br)=CC=C1 CS-W021624 [1,1,0,0,0,0|0,0,2]=4 486 B11R1.265 COC1=C(C#N)C(Cl)=CC=C1 CS-0131325 [1,1,0,0,0,0|0,0,2]=4 487 B11R1.265 COC1=C(C#N)C(F)=CC=C1 CS-0009963 [1,1,0,0,0,0|0,0,2]=4 488 B11R1.265 COC1=C(C#N)C(I)=CC=C1 CS-0131328 [1,1,0,0,0,0|0,0,2]=4 489 B11R1.265 COC1=C(C)C=CC=C1C=O CS-0131314 [1,1,0,0,0,0|1,0,1]=4 490 B11R1.265 COC1=C(C)C=CC=C1CO CS-0181746 [1,1,0,0,0,0|1,0,0]=3 491 B11R1.265 COC1=C(C=O)C=CC=C1Br CS-W021855 [1,1,0,0,0,0|1,0,1]=4 492 B11R1.265 COC1=C(C=O)C=CC=C1Cl CS-W006013 [1,1,0,0,0,0|1,0,1]=4 493 B11R1.265 COC1=C(C=O)C=CC=C1O CS-0071433 [1,1,0,0,0,0|1,0,1]=4 494 B11R1.265 COC1=C(CN)C(F)=CC=C1 CS-0044942 [1,1,0,0,0,0|0,0,0]=2 495 B11R1.265 COC1=C(CN)C=CC=C1F CS-0691309 [1,1,0,0,0,0|0,0,0]=2 496 B11R1.265 COC1=C(F)C=CC=C1C#N CS-0098779 [1,1,0,0,0,0|0,0,2]=4 497 B11R1.265 COC1=C(F)C=CC=C1C=O CS-0007666 [1,1,0,0,0,0|1,0,1]=4 498 B11R1.265 COC1=C(F)C=CC=C1CO CS-0097354 [1,1,0,0,0,0|1,0,0]=3 499 B11R1.265 COC1=C(N)C=CC=C1C#N CS-0567164 [1,1,0,0,0,0|0,0,2]=4 500 B11R1.265 COC1=C(OC)C(C)=CC=C1 CS-M3411 [1,1,0,0,0,0|1,0,0]=3 501 B11R1.265 COC1=C(OC)C(C)=NC=C1 CS-0159880 [1,1,0,0,0,0|2,0,0]=4 502 B11R1.265 COC1=C(OC)C(Cl)=NC=C1 CS-0146029 [1,1,0,0,0,0|2,0,0]=4 503 B11R1.265 COC1=CC=CC(Br)=C1C=O CS-W020432 [1,1,0,0,0,0|1,0,1]=4 504 B11R1.265 COC1=CC=CC(Br)=C1OC CS-W014821 [1,1,0,0,0,0|1,0,0]=3 505 B11R1.265 COC1=CC=CC(C)=C1C#N CS-W021712 [1,1,0,0,0,0|0,0,2]=4 506 B11R1.265 COC1=CC=CC(C)=C1C=O CS-W006853 [1,1,0,0,0,0|1,0,1]=4 507 B11R1.265 COC1=CC=CC(C)=C1CO CS-0621245 [1,1,0,0,0,0|1,0,0]=3 508 B11R1.265 COC1=CC=CC(Cl)=C1C=O CS-W018596 [1,1,0,0,0,0|1,0,1]=4 509 B11R1.265 COC1=CC=CC(F)=C1C=O CS-M0642 [1,1,0,0,0,0|1,0,1]=4 510 B11R1.265 COC1=CC=CC(F)=C1CN CS-0150325 [1,1,0,0,0,0|0,0,0]=2 511 B11R1.265 COC1=CC=CC(F)=C1OC CS-0035430 [1,1,0,0,0,0|1,0,0]=3 512 B11R1.265 COC1=CC=CC(N)=C1C#N CS-W006615 [1,1,0,0,0,0|0,0,2]=4 513 B11R1.265 COC1=CC=CC(N)=C1OC CS-W016280 [1,1,0,0,0,0|1,0,0]=3 514 B11R1.265 COC1=CC=CC(O)=C1C=O CS-W001199 [1,1,0,0,0,0|1,0,1]=4 515 B11R1.265 COC1=CC=CC(O)=C1OC CS-0150321 [1,1,0,0,0,0|1,0,0]=3 516 B13R1.51 COC1=C(CC(=O)O)C=CC(Br)=C1 CS-W005525 [0,2,0,0,0,0|1,0,1]=4 517 B13R1.51 COC1=C(CC(=O)O)C=CC(F)=C1 CS-0460992 [0,2,0,0,0,0|1,0,1]=4 518 B13R1.51 COC1=C(OC(C)C)C=CC(Br)=C1 CS-0194347 [0,2,0,0,0,0|2,0,0]=4 519 B13R1.51 COC1=C(OC(F)F)C=CC(N)=C1 CS-0240554 [0,2,0,0,0,0|2,0,0]=4 520 B13R1.51 COC1=CC(Br)=CC=C1OC(F)F CS-0639353 [0,2,0,0,0,0|2,0,0]=4 521 B13R1.51 COC1=CC(Cl)=CC=C1CC(=O)O CS-0135272 [0,2,0,0,0,0|1,0,1]=4 522 B13R1.89 COC1=CC=CC=C1C(C)C(=O)O CS-0197497 [0,2,0,0,0,0|1,0,1]=4 523 B13R1.89 COC1=CC=CC=C1C(N)C(=O)O CS-W021541 [0,2,0,0,0,0|1,0,1]=4 524 B13R1.91 COC(=O)CC1=CC=CC=C1OC CS-0083149 [0,2,0,0,0,0|1,0,1]=4 525 B13R1.115 COC1=C(F)C=CC=C1CC(=O)O CS-0373049 [0,2,0,0,0,0|1,0,1]=4 526 B13R1.622 COC1=CC=CC=C1OC(F)(F)F CS-0087899 [0,2,0,0,0,0|2,0,0]=4 527 B13R1.3089 COC1=CC=C(Br)C=C1CC(=O)O CS-0150364 [0,2,0,0,0,0|1,0,1]=4 528 B13R1.3089 COC1=CC=C(C)C=C1NC(N)=S CS-0132850 [0,2,0,0,0,0|1,0,1]=4 529 B13R1.3089 COC1=CC=C(Cl)C=C1CC(=O)O CS-0012618 [0,2,0,0,0,0|1,0,1]=4 530 B13R1.3089 COC1=CC=C(F)C=C1CC(=O)O CS-0022340 [0,2,0,0,0,0|1,0,1]=4 531 B13R1.382 CCOC1=CC=CC=C1C(=O)NN CS-0113628 [0,2,0,0,0,0|1,0,1]=4 532 B13R1.382 COC(=O)C1=CC=CC=C1CCBr CS-W022777 [0,2,0,0,0,0|1,0,0]=3 533 B13R1.464 CCOC(=O)C1=CC=CC=C1OC CS-0100631 [0,2,0,0,0,0|1,0,1]=4 534 B13R1.2065 COC1=CC(Cl)=CC=C1C(=O)CBr CS-0161336 [0,2,0,0,0,0|1,0,1]=4 535 B13R1.2209 COC1=CC=C(F)C=C1C(=O)CBr CS-0093673 [0,2,0,0,0,0|1,0,1]=4 536 B13R1.1248 CCOC1=C(OCC)C=C(N)C=C1 CS-0151505 [0,2,0,0,0,0|2,0,0]=4 537 B13R1.1249 C=CCC1=C(OC)C=C(OC)C=C1 CS-0710237 [0,2,0,0,0,0|1,0,1]=4 538 B13R1.1249 CCOC1=CC=C(CO)C=C1OC CS-0132462 [0,2,0,0,0,0|2,0,0]=4 539 B13R1.1249 CNCC1=C(OC)C=C(OC)C=C1 CS-W006302 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.1249 CNCC1=CC=C(OC)C=C1OC CS-0045322 [0,2,0,0,0,0|2,0,0]=4 541 B13R1.1249 COC1=CC(OC)=C(CNN)C=C1 CS-0216265 [0,2,0,0,0,0|1,0,0]=3 542 B13R1.2899 COC1=CC(F)=C(F)C=C1CC#N CS-0199683 [0,2,0,0,0,0|0,0,2]=4 543 B13R1.90 COC1=C(OCC(N)=O)C=CC=C1 CS-0182661 [0,2,0,0,0,0|0,0,1]=3 544 B13R1.90 COC1=CC=CC=C1CCC(=O)O CS-W017211 [0,2,0,0,0,0|1,0,0]=3 545 B13R1.90 COC1=CC=CC=C1OCC(=O)O CS-0106585 [0,2,0,0,0,0|1,0,1]=4 546 B13R1.485 CCOC1=CC=CC=C1OCCBr CS-W002871 [0,2,0,0,0,0|1,0,0]=3 547 B13R1.485 CCOC1=CC=CC=C1OCCN CS-W021381 [0,2,0,0,0,0|0,0,0]=2 548 B13R1.485 CCOC1=CC=CC=C1OCCO CS-0162632 [0,2,0,0,0,0|1,0,0]=3 549 B13R1.355 CCOC1=CC(C#N)=CC=C1OC CS-M3350 [0,2,0,0,0,0|2,0,0]=4 550 B13R1.355 CCOC1=CC(C=O)=CC=C1OC CS-M2547 [0,2,0,0,0,0|2,0,0]=4 551 B13R1.355 COC1=CC=C(OC)C(CC#N)=C1 CS-0302682 [0,2,0,0,0,0|0,0,2]=4 552 B11R1.280 COC1=CC=C(Br)C(CN)=C1 CS-0131611 [0,0,1,1,0,0|1,0,1]=4 553 B11R1.280 COC1=CC=C(Br)C(CN)=C1 CS-0150437 [0,0,1,1,0,0|1,0,1]=4 554 B11R1.280 COC1=CC=C(C)C(CN)=C1 CS-0377573 [0,0,1,1,0,0|0,0,2]=4 555 B11R1.280 COC1=CC=C(F)C(CN)=C1 CS-0209268 [0,0,1,1,0,0|1,0,1]=4 556 B11R1.280 COC1=CC=C(O)C(CN)=C1 CS-0626408 [0,0,1,1,0,0|1,0,1]=4 557 B11R2.10 BrC1CC2=C(C=CC=C2)C1 CS-0042740 [1,0,0,1,0,0|1,0,0]=3 558 B11R2.10 CC1CC2=CC=CC=C2N1 CS-W013390 [1,0,0,1,0,0|2,0,0]=4 559 B11R2.10 NC1=NC2=CC=CC=C2O1 CS-W007637 [1,0,0,1,0,0|1,0,1]=4 560 B11R2.10 O=C1CC2=C(C=CC=C2)C1 CS-W020518 [1,0,0,1,0,0|1,0,1]=4 561 B11R2.10 O=C1CC2=CC=CC=C2O1 CS-M0764 [1,0,0,1,0,0|1,0,1]=4 562 B11R2.10 OC1CC2=CC=CC=C2C1 CS-W004877 [1,0,0,1,0,0|1,0,0]=3 563 B11R2.20 C1=CC2=C(C=C1)NCCC2 CS-D1404 [1,0,0,1,0,0|2,0,0]=4 564 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS-W000461 [1,0,0,1,0,0|1,0,0]=3 565 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS-W005397 [1,0,0,1,0,0|1,0,0]=3 566 B11R2.20 C1=CC2=C(CCNC2)N=C1 CS-W005893 [1,0,0,1,0,0|1,0,0]=3 567 B11R2.20 C1=CC=C2CC=CCC2=C1 CS-0155868 [1,0,0,1,0,0|1,0,1]=4 568 B11R2.20 C1=CC=C2CCC=CC2=C1 CS-W004318 [1,0,0,1,0,0|1,0,1]=4 569 B11R2.20 C1=CC=C2CCN=CC2=C1 CS-0155870 [1,0,0,1,0,0|0,0,2]=4 570 B11R2.20 C1=CC=C2CNCCC2=C1 CS-W002013 [1,0,0,1,0,0|0,0,0]=2 571 B11R2.20 C1=CC=C2COCCC2=C1 CS-W002017 [1,0,0,1,0,0|1,0,0]=3 572 B11R2.20 C1=CC=C2OCCCC2=C1 CS-M3130 [1,0,0,1,0,0|1,0,0]=3 573 B11R2.20 C1=CC=C2OCCNC2=C1 CS-W004783 [1,0,0,1,0,0|2,0,0]=4 574 B11R2.20 C1=CC=C2OCCOC2=C1 CS-W017762 [1,0,0,1,0,0|2,0,0]=4 575 B11R2.20 C1=CN=C2OCCCC2=C1 CS-0099338 [1,0,0,1,0,0|2,0,0]=4 576 B11R2.20 C1=NC=C2CCCCC2=C1 CS-0114104 [1,0,0,1,0,0|2,0,0]=4 577 B11R2.20 C1=NC=C2CCNCC2=C1 CS-0052758 [1,0,0,1,0,0|1,0,0]=3 578 B11R2.20 C1=NC=C2CCNCC2=C1 CS-0157263 [1,0,0,1,0,0|1,0,0]=3 579 B11R2.20 C1=NC=C2CCNCC2=C1 CS-WAA0313 [1,0,0,1,0,0|1,0,0]=3 580 B11R2.20 C1=NC=C2CNCCC2=C1 CS-0007713 [1,0,0,1,0,0|1,0,0]=3 581 B11R2.20 C1=NC=C2CNCCC2=C1 CS-D0201 [1,0,0,1,0,0|1,0,0]=3 582 B11R2.20 C1=NC=NC2=C1CNCC2 CS-W003720 [1,0,0,1,0,0|2,0,0]=4 583 B11R2.20 C1=NC=NC2=C1CNCC2 CS-W022271 [1,0,0,1,0,0|2,0,0]=4 584 B11R2.55 BrC1=CC=CC=C1C2CO2 CS-0505158 [1,0,0,1,0,0|2,0,0]=4 585 B11R2.55 NC1=CC=CC=C1C2CC2 CS-0042319 [1,0,0,1,0,0|2,0,0]=4 586 B11R2.106 BrC1=C2CCNC2=CC=C1 CS-0269024 [1,0,0,1,0,0|1,0,0]=3 587 B11R2.106 BrC1=C2CCNC2=CC=C1 CS-W006183 [1,0,0,1,0,0|1,0,0]=3 588 B11R2.106 BrC1=C2CCOC2=CC=C1 CS-0159358 [1,0,0,1,0,0|2,0,0]=4 589 B11R2.106 BrC1=CC=CC2=C1CCC2 CS-0028240 [1,0,0,1,0,0|2,0,0]=4 590 B11R2.106 BrC1=CC=NC2=C1CCN2 CS-0051019 [1,0,0,1,0,0|2,0,0]=4 591 B11R2.106 CC1=C2NCCC2=CC=C1 CS-0341596 [1,0,0,1,0,0|2,0,0]=4 592 B11R2.106 CC1=CC=CC2=C1C=CN2 CS-W001971 [1,0,0,1,0,0|0,0,2]=4 593 B11R2.106 CC1=CC=CC2=C1C=NN2 CS-D0853 [1,0,0,1,0,0|1,0,1]=4 594 B11R2.106 CC1=CC=CC2=C1CCN2 CS-0138285 [1,0,0,1,0,0|0,0,0]=2 595 B11R2.106 CC1=CC=CC2=C1CNC2 CS-0039707 [1,0,0,1,0,0|2,0,0]=4 596 B11R2.106 ClC1=C2CCOC2=CC=C1 CS-0171072 [1,0,0,1,0,0|2,0,0]=4 597 B11R2.106 ClC1=NC=CC2=C1CCN2 CS-D0299 [1,0,0,1,0,0|2,0,0]=4 598 B11R2.106 FC1=C2CCNC2=CC=C1 CS-0060380 [1,0,0,1,0,0|1,0,0]=3 599 B11R2.106 IC1=CC=CC2=C1CCC2 CS-0155376 [1,0,0,1,0,0|2,0,0]=4 600 B11R2.106 NC1=C2CCOC2=CC=C1 CS-W018648 [1,0,0,1,0,0|2,0,0]=4 601 B11R2.106 NC1=CC=CC2=C1CCC2 CS-0069588 [1,0,0,1,0,0|2,0,0]=4 602 B11R2.106 NC1=CC=CC2=C1CCN2 CS-0105948 [1,0,0,1,0,0|1,0,0]=3 603 B11R2.106 OC1=C2CCOC2=CC=C1 CS-0136454 [1,0,0,1,0,0|1,0,0]=3 604 B11R2.106 OC1=C2N=CNC2=CC=C1 CS-0035564 [1,0,0,1,0,0|1,0,1]=4 605 B11R2.106 OC1=C2OCOC2=CC=C1 CS-0086795 [1,0,0,1,0,0|2,0,0]=4 606 B11R2.106 OC1=CC=CC2=C1C=CN2 CS-D1727 [1,0,0,1,0,0|0,0,2]=4 607 B11R2.106 OC1=CC=CC2=C1C=NN2 CS-W003364 [1,0,0,1,0,0|1,0,1]=4 608 B11R2.106 OC1=CC=CC2=C1CCC2 CS-W006868 [1,0,0,1,0,0|1,0,0]=3 609 B11R2.106 OC1=CC=CC2=C1CCN2 CS-0136453 [1,0,0,1,0,0|0,0,0]=2 610 B11R2.106 OC1=CC=CC2=C1CNC2 CS-0006561 [1,0,0,1,0,0|2,0,0]=4 611 B11R2.1 CC1=COC2=CC=CC=C12 CS-0006837 [1,0,0,1,0,0|0,0,2]=4 612 B11R2.1 CC1=NOC2=CC=CC=C21 CS-W008538 [1,0,0,1,0,0|1,0,1]=4 613 B11R2.1 CC1CNC2=C1C=CC=C2 CS-0073172 [1,0,0,1,0,0|1,0,0]=3 614 B11R2.1 CC1CNC2=CC=CC=C21 CS-0199425 [1,0,0,1,0,0|1,0,0]=3 615 B11R2.1 CN1CCC2=CC=CC=C21 CS-0151095 [1,0,0,1,0,0|1,0,0]=3 616 B11R2.1 NC1=NOC2=C1C=CC=C2 CS-W009278 [1,0,0,1,0,0|1,0,1]=4 617 B11R2.1 NC1CCC2=C1C=CC=C2 CS-D1386 [1,0,0,1,0,0|1,0,0]=3 618 B11R2.1 NC1CCC2=CC=CC=C21 CS-W007551 [1,0,0,1,0,0|1,0,0]=3 619 B11R2.1 NC1CCC2=CC=CN=C21 CS-W018844 [1,0,0,1,0,0|2,0,0]=4 620 B11R2.1 NC1COC2=CC=CC=C21 CS-0070832 [1,0,0,1,0,0|0,0,0]=2 621 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 CS-0077082 [1,0,0,1,0,0|1,0,0]=3 622 B11R2.1 N[C@H]1CCC2=CC=CC=C21 CS-M1707 [1,0,0,1,0,0|1,0,0]=3 623 B11R2.1 N[C@H]1CCC2=CC=CC=C21 CS-W019947 [1,0,0,1,0,0|1,0,0]=3 624 B11R2.1 O=C1CCC2=C1C=CC=C2 CS-W004333 [1,0,0,1,0,0|2,0,0]=4 625 B11R2.1 O=C1COC2=C1C=CC=C2 CS-W001165 [1,0,0,1,0,0|1,0,1]=4 626 B11R2.1 O=C1NCC2=C1C=CC=C2 CS-W004767 [1,0,0,1,0,0|2,0,0]=4 627 B11R2.1 OC1CCC2=C1C=CC=C2 CS-0017842 [1,0,0,1,0,0|2,0,0]=4 628 B11R2.1 OC1COC2=C1C=CC=N2 CS-0187924 [1,0,0,1,0,0|2,0,0]=4 629 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 CS-W013378 [1,0,0,1,0,0|2,0,0]=4 630 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 CS-W013372 [1,0,0,1,0,0|2,0,0]=4 631 B11R2.1 [C@@H]1(N)CCC2=CC=CC=C21 CS-W005779 [1,0,0,1,0,0|1,0,0]=3 632 B13R2.163 O=C1CC2=CC=CC=C2CCN1 CS-W000444 [0,1,0,1,0,0|1,0,1]=4 633 B13R2.581 COC1=C2SC(N)=NC2=CC=C1 CS-0054536 [0,1,0,1,0,0|1,0,1]=4 634 B13R2.581 COC1=CC=CC2=C1C=C(C)N2 CS-0152892 [0,1,0,1,0,0|0,0,2]=4 635 B13R2.581 COC1=CC=CC2=C1CC(=O)N2 CS-W003375 [0,1,0,1,0,0|0,0,1]=3 636 B13R2.581 COC1=CC=CC2=C1N=C(N)S2 CS-0054537 [0,1,0,1,0,0|1,0,1]=4 637 B13R2.582 COC1=CC=CC2=C1C(=O)CC2 CS-W013258 [0,1,0,1,0,0|1,0,1]=4 638 B13R2.582 COC1=CC=CC2=C1C(N)CC2 CS-0160494 [0,1,0,1,0,0|1,0,0]=3 639 B13R2.1613 COC1=CC=CC2=C1CCCN2 CS-0150294 [0,1,0,1,0,0|0,0,0]=2 640 B13R2.1613 COC1=CC=CC2=C1CCNC2 CS-0047669 [0,1,0,1,0,0|0,0,0]=2 641 B13R2.1613 COC1=CC=CC2=C1CCNC2 CS-0416079 [0,1,0,1,0,0|0,0,0]=2 642 B13R2.1613 COC1=CC=CC2=C1NCCC2 CS-0199155 [0,1,0,1,0,0|1,0,0]=3 643 B13R2.1613 NCC1OCCC2=CC=CC=C21 CS-0270386 [0,1,0,1,0,0|1,0,0]=3 644 B13R2.1613 OCC1CCCC2=C1C=CC=C2 CS-0258328 [0,1,0,1,0,0|2,0,0]=4 645 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 CS-0070941 [0,1,0,1,0,0|2,0,0]=4 646 B13R2.5252 O=C1NCCCC2=CC=CC=C12 CS-0071404 [0,1,0,1,0,0|2,0,0]=4 647 B13R2.5252 O=C1NCCNC2=CC=CC=C12 CS-W021798 [0,1,0,1,0,0|2,0,0]=4 648 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 CS-0038100 [0,1,0,1,0,0|2,0,0]=4 649 B13R2.162 CC1=CC2=C(C=C1)CCNC2=O CS-0072508 [0,1,0,1,0,0|2,0,0]=4 650 B13R2.162 CN1CCCC2=CC=C(O)C=C21 CS-0146895 [0,1,0,1,0,0|2,0,0]=4 651 B13R2.162 O=C1NCCC2=C1C=C(Br)C=C2 CS-D0454 [0,1,0,1,0,0|2,0,0]=4 652 B13R2.162 O=C1NCCC2=C1C=C(Cl)C=C2 CS-0036532 [0,1,0,1,0,0|2,0,0]=4 653 B13R2.162 O=C1NCCC2=C1C=C(O)C=C2 CS-W022543 [0,1,0,1,0,0|2,0,0]=4 654 B13R2.623 COC1=C2OCOC2=CC(O)=C1 CS-0069216 [0,1,0,1,0,0|2,0,0]=4 655 B13R2.623 COC1=CC(Br)=CC2=C1C=CN2 CS-W022463 [0,1,0,1,0,0|0,0,2]=4 656 B13R2.623 COC1=CC(Br)=CC2=C1C=NN2 CS-0041911 [0,1,0,1,0,0|1,0,1]=4 657 B13R2.623 COC1=CC(C)=CC2=C1C=CN2 CS-0187026 [0,1,0,1,0,0|0,0,2]=4 658 B13R2.623 COC1=CC(Cl)=CC2=C1C=CN2 CS-W022485 [0,1,0,1,0,0|0,0,2]=4 659 B13R2.3683 NC1CCC2=C(C=CC(Br)=C2)C1 CS-0041332 [0,1,0,1,0,0|1,0,0]=3 660 B13R2.3683 NC1CCC2=CC(F)=CC=C2C1 CS-0199247 [0,1,0,1,0,0|1,0,0]=3 661 B13R2.3683 OC1CCC2=C(C=CC(F)=C2)C1 CS-0131577 [0,1,0,1,0,0|2,0,0]=4 662 B13R2.1 BrCCC1=NOC2=C1C=CC=C2 CS-0342397 [0,1,0,1,0,0|2,0,0]=4 663 B13R2.1 NCCC1=CNC2=C1C=CC=C2 CS-D1750 [0,1,0,1,0,0|1,0,1]=4 664 B13R2.1 NCCC1=CNC2=CC=CC=C12 CS-W015687 [0,1,0,1,0,0|1,0,1]=4 665 B13R2.1 NCCC1=COC2=CC=CC=C12 CS-W019375 [0,1,0,1,0,0|0,0,1]=3 666 B13R2.33 O=C1CCC2=CC=CC=C2CC1 CS-W020691 [0,1,0,1,0,0|2,0,0]=4 667 B13R2.45 CN1C(CN)=CC2=CC=CC=C21 CS-0151215 [0,1,0,1,0,0|1,0,1]=4 668 B13R2.45 CN1C(CN)=NC2=C1C=CC=C2 CS-0151132 [0,1,0,1,0,0|1,0,1]=4 669 B13R2.57 BrC[C@H]1COC2=CC=CC=C2O1 CS-0060603 [0,1,0,1,0,0|1,0,0]=3 670 B13R2.57 NCC1CCC2=CC=CC=C2O1 CS-0127797 [0,1,0,1,0,0|1,0,0]=3 671 B13R2.57 NCC1CCC2=CC=CC=C2O1 CS-0155925 [0,1,0,1,0,0|1,0,0]=3 672 B13R2.57 NCC1COC2=CC=CC=C2C1 CS-0308932 [0,1,0,1,0,0|0,0,0]=2 673 B13R2.57 NCC1COC2=CC=CC=C2O1 CS-0005269 [0,1,0,1,0,0|0,0,0]=2 674 B13R2.57 NCC1COC2=CC=CC=C2O1 CS-0130531 [0,1,0,1,0,0|0,0,0]=2 675 B13R2.57 NC[C@@H]1COC2=CC=CC=C2O1 CS-0188329 [0,1,0,1,0,0|0,0,0]=2 676 B13R2.57 NC[C@H]1CCC2=C(C=CC=C2)O1 CS-0055030 [0,1,0,1,0,0|1,0,0]=3 677 B13R2.57 NC[C@H]1COC2=CC=CC=C2O1 CS-0186145 [0,1,0,1,0,0|0,0,0]=2 678 B13R2.57 OCC1CCC2=C(C=CC=C2)N1 CS-W021056 [0,1,0,1,0,0|2,0,0]=4 679 B13R2.57 OCC1CCC2=C(C=CC=C2)O1 CS-0036516 [0,1,0,1,0,0|2,0,0]=4 680 B13R2.57 OCC1COC2=CC=CC=C2O1 CS-W017870 [0,1,0,1,0,0|1,0,0]=3 681 B13R2.57 OC[C@@H]1COC2=CC=CC=C2O1 CS-0128007 [0,1,0,1,0,0|1,0,0]=3 682 B13R2.57 OC[C@H]1COC2=CC=CC=C2O1 CS-0128008 [0,1,0,1,0,0|1,0,0]=3 683 B13R2.573 COC1=CC=CC2=C1C=CN2C CS-0141834 [0,1,0,1,0,0|0,0,2]=4 684 B13R2.573 COC1=CC=CC2=C1CCC2=O CS-D1014 [0,1,0,1,0,0|1,0,0]=3 685 B13R2.573 COC1=CC=CC2=C1CCC2N CS-0042888 [0,1,0,1,0,0|0,0,0]=2 686 B13R2.573 COC1=CC=CC2=C1COC2=O CS-0094318 [0,1,0,1,0,0|1,0,1]=4 687 B13R2.573 COC1=CC=CC2=C1OCC2=O CS-W010840 [0,1,0,1,0,0|1,0,1]=4 688 B13R2.573 N#CC1=C2CC[C@H](N)C2=CC=C1 CS-0099888 [0,1,0,1,0,0|2,0,0]=4 689 B13R2.573 N#CC1=CC=CC2=C1CC[C@@H]2N CS-0054957 [0,1,0,1,0,0|2,0,0]=4 690 B13R2.155 CC1=CC2=C(C=C1)OCC(C)N2 CS-0152904 [0,1,0,1,0,0|2,0,0]=4 691 B13R2.611 COC1=C2C=CNC2=C(Br)C=C1 CS-0050074 [0,1,0,1,0,0|0,0,2]=4 692 B13R2.611 COC1=CC=C(Br)C2=C1C=NN2 CS-0102600 [0,1,0,1,0,0|1,0,1]=4 693 B13R2.611 COC1=CC=C(Cl)C2=C1C=CN2 CS-0188485 [0,1,0,1,0,0|0,0,2]=4 694 B13R2.5179 CC1=CC2=C(C=C1)C(=O)NCC2 CS-0084842 [0,1,0,1,0,0|2,0,0]=4 695 B13R2.5179 NC1=CC=C2C(=O)NCCC2=C1 CS-0199518 [0,1,0,1,0,0|2,0,0]=4 696 B13R2.5179 O=C1NCCC2=C1C=CC(Br)=C2 CS-D0456 [0,1,0,1,0,0|2,0,0]=4 697 B13R2.5179 O=C1NCCC2=C1C=CC(O)=C2 CS-W019427 [0,1,0,1,0,0|2,0,0]=4 698 B13R2.5179 O=C1NCCC2=CC(Cl)=CC=C12 CS-W003172 [0,1,0,1,0,0|2,0,0]=4 699 B13R2.5179 O=C1NCCC2=CC(F)=CC=C12 CS-0036315 [0,1,0,1,0,0|2,0,0]=4 700 B13R2.121 COC1=C(Br)C=CC2=C1C=NN2 CS-0103493 [0,1,0,1,0,0|1,0,1]=4 701 B13R2.4818 CC1=C2C(=O)NCCC2=CC=C1 CS-0153394 [0,1,0,1,0,0|2,0,0]=4 702 B13R2.342 CC1=CC=CC2=C1CCNC2=O CS-W022412 [0,1,0,1,0,0|2,0,0]=4 703 B13R2.342 O=C1NCCC2=C(O)C=CC=C12 CS-0071856 [0,1,0,1,0,0|2,0,0]=4 704 B13R2.342 O=C1NCCC2=C1C=CC=C2Br CS-W006085 [0,1,0,1,0,0|2,0,0]=4 705 B13R2.342 O=C1NCCC2=C1C=CC=C2Cl CS-0341965 [0,1,0,1,0,0|2,0,0]=4 706 B13R3.2262 C1=CC2=C(C=C1)C3(CC3)CN2 CS-0052751 [0,0,0,2,0,0|2,0,0]=4 707 B9R1.33 CC1=NC=CN1CCN CS-0152771 [1,0,0,0,1,0|2,0,0]=4 708 B9R1.14 COC1=CSC=C1OC CS-W008823 [1,0,0,0,1,0|2,0,0]=4