0 B10R1.20 C#CC1=C(CO)C=CC=N1 W12663 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.20 C#CC1=CC=CN=C1OC C71657 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.20 CNC1=C(C=O)C=CC=N1 FD10569 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.20 CNC1=C(CCl)C=CC=C1 D93985 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.20 COC1=C(CBr)C=CC=N1 55281 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.20 COC1=C(CN)N=CC=C1 AC6429 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.20 COC1=C(CN)N=CC=C1 D94536 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.20 COC1=C(CO)N=CC=C1 F17518 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.20 COC1=CC=CN=C1C=O P10318 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.20 COC1=CC=CN=C1CBr O10505 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.20 COC1=CC=CN=C1CCl 60117 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.20 COC1=CN=CN=C1OC H10157 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.20 COC1=NC=CC=C1CN 37576 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.20 COC1=NC=CC=C1NN D84114 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.20 COC1=NC=CN=C1NN C74005 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.20 COC1=NC=CN=C1OC 21131 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.20 N#CC1=C(CBr)C=CC=N1 87640 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.20 N#CC1=CC=CN=C1CCl A51113 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.20 NCC1=C(CN)C=CC=C1 20182 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.20 OCC1=C(CBr)C=CC=C1 O10024 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.20 OCC1=C(CF)C=CC=C1 W10520 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.20 OCC1=CC=CN=C1CO 75308 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.20 OCC1=CC=CN=C1CO S11918 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.15 BrCC1=C(Br)C=CC=N1 N13045 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.15 C#CC1=NC=CN=C1C 79091 [1,0,0,0,0,0|0,0,2]=3 25 B9R1.15 C=CC1=CC=CN=C1C P11579 [1,0,0,0,0,0|1,0,2]=4 26 B9R1.15 CC1=C(C#N)C=CC=N1 AB2931 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.15 CC1=C(CBr)C=CC=N1 F16424 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.15 CC1=C(CCl)C=CC=N1 24248 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.15 CC1=C(CCl)C=NC=N1 F31172 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.15 CC1=CC=CN=C1CN C72913 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.15 CC1=NC=CC=C1CN 72802 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.15 CC1=NC=CC=C1CN AB7634 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.15 CC1=NC=CN=C1C=O 30985 [1,0,0,0,0,0|1,0,1]=3 34 B9R1.15 CC1=NC=CN=C1CCl P11784 [1,0,0,0,0,0|1,0,0]=2 35 B9R1.15 CC1=NC=CN=C1CN E70300 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.15 CC1=NC=CN=C1CN P19746 [1,0,0,0,0,0|1,0,0]=2 37 B9R1.15 CC1=NC=CN=C1CO P10784 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.15 CC1=NC=CN=C1NN BL010270 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.15 CCC1=C(Br)C=CC=N1 P11641 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.15 CCC1=C(F)C=CC=C1 F20938 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.15 CCC1=C(O)C=CC=N1 71246 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.15 CCC1=CC=CN=C1Br D80252 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.15 CCC1=CC=CN=C1N 55791 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.15 CCC1=CC=NN=C1Cl S11385 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.15 CCC1=NC=CN=C1N RB3385 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.15 CCC1=NC=CNC1=O S12194 [1,0,0,0,0,0|1,0,1]=3 47 B9R1.15 CNC1=CC=CN=C1N 94808 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.15 CNC1=NC=CC=C1N 72351 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.15 CNC1=NC=CN=C1N 25161 [1,0,0,0,0,0|2,0,0]=3 50 B9R1.15 COC1=NC=CC=C1C C73664 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.15 COC1=NC=CN=C1Br 27717 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.15 CSC1=C(F)N=CC=C1 F50785 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.15 ClCC1=C(Br)C=CC=N1 W15864 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.15 ClCC1=C(Cl)C=CC=N1 86866 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.15 ClCC1=C(Cl)C=CC=N1 C71965 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.15 FC1=C(CBr)C=CC=N1 72213 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.15 FC1=CC=CN=C1CBr 38126 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.15 FC1=CC=CN=C1CCl AC1446 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.15 NC1=CC=CN=C1CO H10562 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.15 NC1=NC=CN=C1C=O 27460 [1,0,0,0,0,0|2,0,1]=4 61 B9R1.15 NCC1=C(Br)C=CC=N1 N13373 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.15 NCC1=C(Br)C=CC=N1 Y13366 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.15 NCC1=C(Cl)C=CC=N1 20194 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.15 NCC1=C(F)C=CC=N1 37501 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.15 NCC1=C(F)C=CC=N1 71993 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.15 NCC1=C(F)C=CC=N1 P10857 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.15 NCC1=CC=CN=C1Br D82416 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.15 NCC1=CC=CN=C1Cl 51113 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.15 NCC1=CC=CN=C1N 89358 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.15 NCC1=CC=CN=C1O 55767 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.15 NCC1=NC=CC=C1N AC4283 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 NCC1=NC=CN=C1N AB3037 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.15 O=CC1=NC=CN=C1Br P14054 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.15 O=CC1=NC=CN=C1Cl P10456 [1,0,0,0,0,0|2,0,1]=4 75 B9R1.15 OCC1=NC=CN=C1Cl 80497 [1,0,0,0,0,0|2,0,0]=3 76 B11R1.37 CCC1=C(CO)C=C(Br)C=C1 C13891 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.37 CCC1=C(OC)C=CC(Br)=C1 C74737 [0,1,0,0,0,0|3,0,0]=4 78 B11R1.37 COC1=C(CBr)C=CC(Br)=N1 D80185 [0,1,0,0,0,0|3,0,0]=4 79 B11R1.37 COC1=C(CN)C=CC(Br)=N1 N10742 [0,1,0,0,0,0|3,0,0]=4 80 B11R1.37 COC1=C(CN)C=CC(Br)=N1 Y11170 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.37 COC1=C(CO)C=CC(Br)=N1 N10745 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.37 COC1=CC(Br)=CN=C1OC 82178 [0,1,0,0,0,0|3,0,0]=4 83 B11R1.37 COC1=CC(C)=CN=C1OC C71876 [0,1,0,0,0,0|3,0,0]=4 84 B11R1.37 COC1=NC=C(Br)C=C1CO P11193 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.37 OCC1=C(CO)N=C(Cl)C=C1 N12730 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.37 OCC1=CC(Br)=CN=C1CO F30570 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.41 CNCC1=C(CO)C=CC=C1 31935 [0,1,0,0,0,0|3,0,0]=4 88 B11R1.41 COC1=C(CCN)C=CC=C1 C11486 [0,1,0,0,0,0|3,0,0]=4 89 B11R1.41 COC1=C(CCO)N=CC=C1 52931 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 39100 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.53 CC(C)C1=CC=CN=C1CCl D80268 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.53 CC(C)C1=CC=CN=C1CO D83406 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.53 CCC1=C(B(O)O)C=CC=N1 FD10096 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 O10770 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.53 CCC1=C(C(C)=O)C=CC=C1 A10857 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11921 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y11922 [0,1,0,0,0,0|2,0,0]=3 98 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12590 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.53 CCC1=C([C@H](C)N)C=CC=C1 Y12977 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.53 COC1=C(C(C)=O)C=CC=N1 32755 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52750 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 F16921 [0,1,0,0,0,0|3,0,0]=4 103 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 N10418 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10162 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10512 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.53 COC1=NC=CC=C1[C@H](C)N Y12492 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.53 COC1=NC=CC=C1[C@H](C)O CS1968 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.53 COC1=NC=CN=C1C(=O)O 26255 [0,1,0,0,0,0|2,0,1]=4 109 B11R1.53 C[C@H](N)C1=C(C#N)C=CC=N1 D81046 [0,1,0,0,0,0|2,0,1]=4 110 B11R1.53 OCC1=CC=CN=C1C(F)F D80251 [0,1,0,0,0,0|3,0,0]=4 111 B11R1.265 CCC1=C(SC)N=CN=C1Cl W16886 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.265 COC1=NC=CC(O)=C1OC W10568 [0,1,0,0,0,0|3,0,0]=4 113 B11R2.1 CC1=NNC2=NC=CN=C12 52551 [0,0,0,1,0,0|2,0,1]=4 114 B11R2.1 CN1CCC2=C1C=CC=C2 D83554 [0,0,0,1,0,0|3,0,0]=4 115 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E72710 [0,0,0,1,0,0|3,0,0]=4 116 B11R2.1 C[C@H]1CNC2=C1C=CC=C2 I11746 [0,0,0,1,0,0|3,0,0]=4 117 B11R2.1 N[C@H]1CCC2=CC=CN=C21 H10539 [0,0,0,1,0,0|2,0,0]=3 118 B11R2.1 N[C@H]1CCC2=NC=CC=C21 87179 [0,0,0,1,0,0|2,0,0]=3 119 B11R2.1 N[C@H]1CCC2=NC=CC=C21 D79495 [0,0,0,1,0,0|2,0,0]=3 120 B11R2.1 O=C1NCC2=NC=CN=C12 AT22460 [0,0,0,1,0,0|2,0,1]=4 121 B11R2.1 O=C1NCC2=NC=CN=C12 P20256 [0,0,0,1,0,0|2,0,1]=4 122 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D70931 [0,0,0,1,0,0|3,0,0]=4 123 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 87180 [0,0,0,1,0,0|2,0,0]=3 124 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 D79493 [0,0,0,1,0,0|2,0,0]=3 125 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 D79494 [0,0,0,1,0,0|2,0,0]=3 126 B11R2.1 O[C@H]1CCC2=CC=CN=C21 D86160 [0,0,0,1,0,0|2,0,0]=3 127 B11R2.1 O[C@H]1CCC2=CC=CN=C21 E72697 [0,0,0,1,0,0|2,0,0]=3 128 B11R2.1 O[C@H]1COC2=NC=CC=C21 D97315 [0,0,0,1,0,0|3,0,0]=4 129 B11R2.20 C1=CN=C2CCCNC2=C1 30555 [0,0,0,1,0,0|2,0,0]=3 130 B11R2.20 C1=CN=C2CNCCC2=C1 67455 [0,0,0,1,0,0|2,0,0]=3 131 B11R2.20 C1=CN=C2OCCCC2=C1 AT22008 [0,0,0,1,0,0|2,0,0]=3 132 B11R2.20 C1=CN=C2OCCNC2=C1 83897 [0,0,0,1,0,0|3,0,0]=4 133 B11R2.20 C1=CN=C2OCCOC2=C1 F14644 [0,0,0,1,0,0|3,0,0]=4 134 B11R2.20 C1=NC=C2CCCCC2=N1 F16382 [0,0,0,1,0,0|2,0,0]=3 135 B11R2.20 C1=NC=C2CCNCC2=N1 P13445 [0,0,0,1,0,0|3,0,0]=4 136 B11R2.20 C1=NC=C2CNCCC2=N1 24629 [0,0,0,1,0,0|3,0,0]=4 137 B11R2.20 C1=NC=C2CNCCC2=N1 35879 [0,0,0,1,0,0|3,0,0]=4 138 B11R2.20 C1=NC=C2CNCCC2=N1 SC2801 [0,0,0,1,0,0|3,0,0]=4 139 B9R1.14 OCC1=C(CO)SC=C1 W18906 [0,0,0,0,1,0|3,0,0]=4 140 B8R1.2 BrCC1=NC=CN=C1 31757 [2,0,0,0,0,0|1,0,0]=3 141 B8R1.2 C#CC1=NC=CN=C1 P11646 [2,0,0,0,0,0|0,0,2]=4 142 B8R1.2 CCC1=NC=NC=C1 F17281 [2,0,0,0,0,0|2,0,0]=4 143 B8R1.2 ClCC1=NC=CN=C1 37060 [2,0,0,0,0,0|1,0,0]=3 144 B8R1.2 NCC1=NC=CN=C1 67569 [2,0,0,0,0,0|1,0,0]=3 145 B8R1.2 SCC1=CN=CC=C1 F18343 [2,0,0,0,0,0|2,0,0]=4 146 B8R1.2 SCC1=NC=CC=C1 Y10072 [2,0,0,0,0,0|2,0,0]=4 147 B8R1.5 CC1=C(I)C=CC=N1 F19761 [2,0,0,0,0,0|2,0,0]=4 148 B8R1.5 CC1=NC=CN=C1Br 26975 [2,0,0,0,0,0|1,0,0]=3 149 B8R1.5 CC1=NCCN=C1C N13379 [2,0,0,0,0,0|0,0,2]=4 150 B8R1.5 CC1=NNC=NC1=O D79535 [2,0,0,0,0,0|2,0,0]=4 151 B8R1.5 ClC1=NC=CN=C1Br C71707 [2,0,0,0,0,0|2,0,0]=4 152 B8R1.5 ClC1=NC=CN=C1I AC1564 [2,0,0,0,0,0|2,0,0]=4 153 B8R1.5 FC1=NC=CN=C1Br W17938 [2,0,0,0,0,0|2,0,0]=4 154 B8R1.5 NC1=NC=CN=C1Br 27472 [2,0,0,0,0,0|2,0,0]=4 155 B8R1.5 NC1=NC=CN=C1I 27241 [2,0,0,0,0,0|2,0,0]=4 156 B8R1.5 OC1=NC=CN=C1Br A11981 [2,0,0,0,0,0|2,0,0]=4 157 B8R1.5 OC1=NC=CN=C1O C74124 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.2 CC1=C(Cl)C=CN=C1CCl W19099 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.2 COC1=NC=CC(Br)=C1C C71404 [1,1,0,0,0,0|2,0,0]=4 160 B10R1.2 COC1=NC=CC(I)=C1C 96428 [1,1,0,0,0,0|2,0,0]=4 161 B10R1.4 CC1=C(CCN)C=CC=C1 C78305 [1,1,0,0,0,0|2,0,0]=4 162 B10R1.4 CC1=CC=CN=C1CCN C80033 [1,1,0,0,0,0|1,0,0]=3 163 B10R1.4 CCNC1=CC=CN=C1N P19791 [1,1,0,0,0,0|2,0,0]=4 164 B10R1.4 CCOC1=CC=CN=C1F AC1769 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.4 CCOC1=NC=CC=C1O 79061 [1,1,0,0,0,0|2,0,0]=4 166 B10R1.4 CCOC1=NC=CN=C1N 25986 [1,1,0,0,0,0|1,0,0]=3 167 B10R1.4 CNCC1=CC=CN=C1C AC2519 [1,1,0,0,0,0|1,0,0]=3 168 B10R1.4 N#CCC1=NC=CN=C1Cl 38700 [1,1,0,0,0,0|1,0,1]=4 169 B10R1.4 NC1=C(CCO)C=CC=N1 70885 [1,1,0,0,0,0|2,0,0]=4 170 B10R1.4 NCCC1=C(Br)C=CC=N1 P10594 [1,1,0,0,0,0|2,0,0]=4 171 B10R1.4 OCCC1=C(F)C=CC=N1 P15943 [1,1,0,0,0,0|2,0,0]=4 172 B10R1.25 CC1=C(C#N)N=CC(Cl)=N1 BL010403 [1,1,0,0,0,0|1,0,1]=4 173 B10R1.25 CC1=C(CN)C=CC(N)=N1 D93406 [1,1,0,0,0,0|2,0,0]=4 174 B10R1.25 CC1=C(CO)C=CC(F)=N1 C76920 [1,1,0,0,0,0|2,0,0]=4 175 B10R1.25 CC1=CC(Br)=CN=C1CCl 79673 [1,1,0,0,0,0|2,0,0]=4 176 B10R1.25 CC1=CC(Br)=CN=C1CN 24121 [1,1,0,0,0,0|2,0,0]=4 177 B10R1.25 CC1=CC(Cl)=CN=C1CN 24127 [1,1,0,0,0,0|2,0,0]=4 178 B10R1.25 CC1=CN=C(CN)C(C)=C1 D83303 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.25 CC1=NC(C)=C(CO)C=C1 F12480 [1,1,0,0,0,0|2,0,0]=4 180 B10R1.25 CC1=NC(N)=CN=C1C#N BL010402 [1,1,0,0,0,0|1,0,1]=4 181 B10R1.25 CCC1=NC=C(Br)C=C1N 38360 [1,1,0,0,0,0|2,0,0]=4 182 B10R1.25 CCC1=NC=C(Cl)N=C1Cl C72268 [1,1,0,0,0,0|1,0,0]=3 183 B10R1.25 COC1=C(C)N=C(Br)C=C1 W15448 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.25 COC1=C(N)N=C(Cl)C=N1 C91504 [1,1,0,0,0,0|2,0,0]=4 185 B10R1.25 COC1=NC=C(Cl)N=C1Cl W12644 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.25 COC1=NC=C(F)C=C1C C76918 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.25 CSC1=NC=C(Cl)N=C1Cl 38290 [1,1,0,0,0,0|2,0,0]=4 188 B10R1.30 CC1=CC=C(C)C(CO)=N1 C16468 [1,1,0,0,0,0|2,0,0]=4 189 B10R1.30 CC1=CN=C(C)C(C#N)=N1 W18439 [1,1,0,0,0,0|1,0,1]=4 190 B10R1.30 CC1=NC=C(Br)C=C1CN AC1104 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.30 CCC1=C(O)C=CC(C)=N1 T71674 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.30 CCC1=NC(C)=CN=C1C F20894 [1,1,0,0,0,0|0,0,0]=2 193 B10R1.30 COC1=CC(Br)=CN=C1C 82190 [1,1,0,0,0,0|2,0,0]=4 194 B10R1.30 COC1=NC(Br)=CN=C1Br I11275 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.30 COC1=NC(Br)=CN=C1I 27639 [1,1,0,0,0,0|2,0,0]=4 196 B10R1.30 COC1=NC(C)=CN=C1C Y10564 [1,1,0,0,0,0|1,0,0]=3 197 B10R1.30 COC1=NC(C)=CN=C1N C77014 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.30 COC1=NC(N)=CN=C1Br D82133 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.30 NC1=C(CO)N=C(Br)C=N1 51254 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.61 CC(=O)C1=C(C)N=CC=C1 C73307 [1,1,0,0,0,0|1,0,1]=4 201 B10R1.61 CC(C)C1=C(O)C=CC=N1 72523 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.61 CC(C)C1=CC=CN=C1Br C72641 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.61 CC(C)C1=CC=CN=C1N 60027 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.61 CC(C)C1=NC=CC=C1N C72482 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.61 CC(C)C1=NC=CN=C1O W12756 [1,1,0,0,0,0|1,0,0]=3 206 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52748 [1,1,0,0,0,0|2,0,0]=4 207 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 52749 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 N10464 [1,1,0,0,0,0|2,0,0]=4 209 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 Y10511 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y11090 [1,1,0,0,0,0|1,0,0]=3 211 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12107 [1,1,0,0,0,0|1,0,0]=3 212 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y12108 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13392 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.61 CC1=CC=CN=C1[C@H](C)N Y13393 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.61 CC1=CC=CN=C1[C@H](C)O 21080 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.61 CC1=NC=CC=C1[C@H](C)N Y12491 [1,1,0,0,0,0|1,0,0]=3 217 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 70080 [1,1,0,0,0,0|2,0,0]=4 218 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 90519 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.61 C[C@H](N)C1=C(Br)C=CC=N1 D81561 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=N1 90516 [1,1,0,0,0,0|2,0,0]=4 221 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13070 [1,1,0,0,0,0|2,0,0]=4 222 B10R1.61 C[C@H](N)C1=C(F)C=CC=N1 N13095 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=N1 P19330 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.61 C[C@H](O)C1=C(F)C=CC=N1 F13157 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.61 C[C@H](O)C1=CC=CN=C1F F15555 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.245 CC1=CC=NC(C)=C1CO W18063 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.245 COC1=C(Br)C=CN=C1C A11666 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.112 CCOC1=NC=C(Br)C=C1OC C71954 [0,2,0,0,0,0|2,0,0]=4 229 B12R1.75 CC(C)CC1=C(CO)C=CC=N1 W12144 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.283 CCOC1=C([C@H](C)N)C=CC=C1 Y10278 [0,2,0,0,0,0|2,0,0]=4 231 B12R1.261 CC(C)C1=C([C@H](C)N)C=CC=C1 N14721 [0,2,0,0,0,0|2,0,0]=4 232 B10R2.7 C1=CN=C2CCNC2=C1 70854 [1,0,0,1,0,0|2,0,0]=4 233 B10R2.7 C1=CN=C2CNCC2=C1 83068 [1,0,0,1,0,0|2,0,0]=4 234 B10R2.7 C1=CN=C2CNCC2=C1 SC3341 [1,0,0,1,0,0|2,0,0]=4 235 B10R2.7 C1=CN=C2CNCC2=N1 50637 [1,0,0,1,0,0|1,0,0]=3 236 B10R2.32 O[C@H]1CCN2C=CN=C12 D85477 [0,0,0,1,1,0|2,0,0]=4 237 B12R2.24 BrC1=CN=C2CCNCC2=C1 21007 [0,1,0,1,0,0|2,0,0]=4 238 B12R2.24 BrC1=CN=C2CCNCC2=C1 P19234 [0,1,0,1,0,0|2,0,0]=4 239 B12R2.24 BrC1=CN=C2CCNCC2=C1 SC2711 [0,1,0,1,0,0|2,0,0]=4 240 B12R2.24 BrC1=CN=C2NCCCC2=C1 51323 [0,1,0,1,0,0|2,0,0]=4 241 B12R2.24 BrC1=NC2=C(C=C1)CCCC2 D82621 [0,1,0,1,0,0|1,0,0]=3 242 B12R2.24 BrC1=NC2=C(C=C1)NCCC2 C71819 [0,1,0,1,0,0|2,0,0]=4 243 B12R2.24 CC1=CC2=C(C=C1)CCCC2 I10992 [0,1,0,1,0,0|2,0,0]=4 244 B12R2.24 CN1CCC2=C(C=CC=C2)C1 66638 [0,1,0,1,0,0|2,0,0]=4 245 B12R2.24 CN1CCC2=C(C=CC=C2)C1 O10829 [0,1,0,1,0,0|2,0,0]=4 246 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 N11405 [0,1,0,1,0,0|2,0,0]=4 247 B12R2.24 ClC1=NC2=C(C=C1)CCCC2 51056 [0,1,0,1,0,0|1,0,0]=3 248 B12R2.24 ClC1=NC2=C(C=C1)CCCN2 C72207 [0,1,0,1,0,0|2,0,0]=4 249 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 F11138 [0,1,0,1,0,0|2,0,0]=4 250 B12R2.24 ClC1=NC2=C(CCCC2)N=C1 F50761 [0,1,0,1,0,0|0,0,0]=2 251 B12R2.24 FC1=CC2=C(C=C1)CCCC2 N10855 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.24 NC1=CC2=C(CCOC2)N=C1 72372 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.24 NC1=CN=C2CCCCC2=C1 F30818 [0,1,0,1,0,0|1,0,0]=3 254 B12R2.24 NC1=CN=C2CCNCC2=C1 67454 [0,1,0,1,0,0|2,0,0]=4 255 B12R2.24 NC1=CN=C2CCNCC2=C1 FD7018 [0,1,0,1,0,0|2,0,0]=4 256 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69307 [0,1,0,1,0,0|2,0,0]=4 257 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 69309 [0,1,0,1,0,0|2,0,0]=4 258 B12R2.24 OC1=CN=C2CCNCC2=C1 S11487 [0,1,0,1,0,0|2,0,0]=4 259 B12R2.24 OC1=CN=C2CCNCC2=C1 SC1341 [0,1,0,1,0,0|2,0,0]=4 260 B12R2.132 O[C@H]1CCC2=C1N=C(Br)C=C2 D79272 [0,1,0,1,0,0|2,0,0]=4 261 B12R2.132 O[C@H]1CCC2=C1N=C(Cl)C=C2 N11829 [0,1,0,1,0,0|2,0,0]=4 262 B12R2.612 CN1CCC2=CC(Br)=CN=C21 S10257 [0,1,0,1,0,0|2,0,0]=4 263 B12R2.612 O[C@H]1CCC2=CC(Br)=CN=C21 81985 [0,1,0,1,0,0|2,0,0]=4 264 B12R2.18 CC1NC2=C(C=CC=C2)C1C C74121 [0,1,0,1,0,0|2,0,0]=4 265 B12R2.315 OCC1=NC=CC2=C1CCO2 W11883 [0,1,0,1,0,0|2,0,0]=4 266 B12R2.1081 BrC1=C2CCCNC2=NC=C1 W14857 [0,1,0,1,0,0|2,0,0]=4 267 B12R2.1081 CC1=CC=CC2=C1CCCC2 N10858 [0,1,0,1,0,0|2,0,0]=4 268 B12R2.1081 CN1CCNC2=NC=CC=C21 D80285 [0,1,0,1,0,0|2,0,0]=4 269 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 36617 [0,1,0,1,0,0|2,0,0]=4 270 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 A10659 [0,1,0,1,0,0|2,0,0]=4 271 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 64901 [0,1,0,1,0,0|2,0,0]=4 272 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 72471 [0,1,0,1,0,0|2,0,0]=4 273 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 W10122 [0,1,0,1,0,0|2,0,0]=4 274 B12R2.1081 ClC1=C2CCCCC2=CC=C1 Y13222 [0,1,0,1,0,0|2,0,0]=4 275 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 50212 [0,1,0,1,0,0|1,0,0]=3 276 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 50215 [0,1,0,1,0,0|1,0,0]=3 277 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 RB3334 [0,1,0,1,0,0|1,0,0]=3 278 B12R2.1081 N[C@H]1CCCC2=NC=CC=C21 39151 [0,1,0,1,0,0|1,0,0]=3 279 B12R2.1081 N[C@H]1CCCC2=NC=CN=C21 O11320 [0,1,0,1,0,0|0,0,0]=2 280 B12R2.1081 N[C@H]1CCOC2=C1N=CC=C2 50286 [0,1,0,1,0,0|2,0,0]=4 281 B12R2.1081 OC1=C2CCCCC2=NC=C1 C16516 [0,1,0,1,0,0|1,0,0]=3 282 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72122 [0,1,0,1,0,0|2,0,0]=4 283 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 T72587 [0,1,0,1,0,0|2,0,0]=4 284 B12R2.2403 C[C@]1(O)CCC2=C1C=CC=C2 72298 [0,1,0,1,0,0|2,0,0]=4 285 B12R2.196 O[C@H]1CCC2=C(Cl)C=CN=C21 26883 [0,1,0,1,0,0|2,0,0]=4 286 B8R1.11 CC1=C(CCl)N=CO1 AC3323 [1,0,0,0,1,0|2,0,0]=4 287 B8R1.11 CC1=C(CO)C=CO1 30727 [1,0,0,0,1,0|2,0,0]=4 288 B8R1.11 CC1=C(CO)N=CO1 AT18595 [1,0,0,0,1,0|2,0,0]=4 289 B8R1.11 CC1=CNN=C1CN P17767 [1,0,0,0,1,0|2,0,0]=4 290 B8R1.11 CC1=CON=C1CN AT25740 [1,0,0,0,1,0|2,0,0]=4 291 B8R1.11 CC1=NOC=C1CN 72854 [1,0,0,0,1,0|2,0,0]=4 292 B8R1.11 CC1=NOC=C1CN N10525 [1,0,0,0,1,0|2,0,0]=4 293 B8R1.11 CC1=NON=C1CN 70844 [1,0,0,0,1,0|2,0,0]=4 294 B8R1.11 CCC1=C(C)N=CS1 60935 [1,0,0,0,1,0|1,0,0]=3 295 B8R1.11 CCC1=CNN=C1C AC8755 [1,0,0,0,1,0|1,0,0]=3 296 B8R1.11 CCC1=NNC=C1Br 98406 [1,0,0,0,1,0|2,0,0]=4 297 B8R1.11 CCN1C=CN=C1Br AT15593 [1,0,0,0,1,0|2,0,0]=4 298 B8R1.11 CN1N=CC=C1CCl 31784 [1,0,0,0,1,0|2,0,0]=4 299 B8R1.11 CN1N=CC=C1CN AC1023 [1,0,0,0,1,0|2,0,0]=4 300 B8R1.11 CN1N=CN=C1CCl D93361 [1,0,0,0,1,0|2,0,0]=4