0 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.13 CC(=O)C1=NC=C(C)N=C1 MC444078 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.13 CC(=O)C1CC=C(C)CC1 CS14813 [0,0,0,0,0,0|1,0,3]=4 5 B10R1.13 CC(Br)C1=CC=C(F)C=C1 CS16140 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.13 CC(C)C1=CC=C(Br)C=C1 CS19162 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.13 CC(C)C1=CC=C(Cl)N=N1 CS15951 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 CC(C)C1=CC=C(N)C=C1 CS22915 [0,0,0,0,0,0|1,0,2]=3 9 B10R1.13 CC(C)C1=CC=C(N)C=N1 CS22406 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.13 CC(C)C1=CN=C(Br)C=C1 MC432364 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.13 CC(C)C1=CN=C(Cl)C=C1 MC107619 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 MC113225 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 CC(C)C1=CN=C(N)C=C1 CS21752 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.13 CC(C)C1=NC=C(Br)C=N1 MC441127 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS10540 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS20256 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.13 CC(N)C1=CC=C(F)C=C1 CS19253 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC40832 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC429424 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.13 CC(N)C1=CC=C(I)C=C1 MC113505 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.13 CC(N)C1=CC=C(N)C=C1 CS22422 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.13 CC(N)C1=NC=C(F)C=C1 CS16980 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.13 CC(N)C1=NC=C(F)C=C1 MC102962 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 CC(N)c1ccc(Cl)cc1 MC433903 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.13 CC(O)C1=CC=C(F)C=C1 MC33129 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.13 CC(O)C1=CC=C(N)C=C1 MC40728 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.13 CC1=NC=C(C(C)N)C=N1 MC112001 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.13 CC1CCC(C(C)C)CC1 MC428284 [0,0,0,0,0,0|0,0,4]=4 29 B10R1.13 CN(C)C1=CC=C(Br)C=C1 CS15132 [0,0,0,0,0,0|2,0,2]=4 30 B10R1.13 CN(C)C1=CC=C(Br)N=C1 CS17769 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 MC20289 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.13 CN(C)C1=CC=C(I)C=C1 CS16430 [0,0,0,0,0,0|2,0,2]=4 33 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS16528 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.13 CN(C)C1=CC=C(O)C=C1 MC442505 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.13 CN(C)C1=NC=C(Br)C=C1 MC425751 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.13 CN(C)C1=NC=C(Br)N=C1 CS17460 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.13 CN(C)C1=NC=C(I)C=C1 CS16969 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.13 CN(C)C1=NC=C(N)C=C1 MC427118 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.13 CN(C)C1=NC=C(N)C=C1 MC427390 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.13 Cc1ccc(C(C)C)cc1 MC444976 [0,0,0,0,0,0|0,0,2]=2 41 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [1,0,0,0,0,0|1,0,2]=4 42 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [1,0,0,0,0,0|1,0,2]=4 43 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [1,0,0,0,0,0|1,0,2]=4 44 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [1,0,0,0,0,0|1,0,2]=4 45 B9R1.1 CC1=CC=C(CO)C=N1 MC21041 [1,0,0,0,0,0|2,0,1]=4 46 B9R1.1 CC1=CN=C(CCl)C=C1 MC115829 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.1 CC1=CN=C(CCl)C=N1 MC103599 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.1 CC1=CN=C(CO)C=N1 CS12383 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [1,0,0,0,0,0|1,0,2]=4 52 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [1,0,0,0,0,0|1,0,2]=4 53 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [1,0,0,0,0,0|1,0,2]=4 54 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [1,0,0,0,0,0|1,0,2]=4 55 B9R1.1 CCC1=CN=C(Br)C=C1 CS13124 [1,0,0,0,0,0|2,0,1]=4 56 B9R1.1 CCC1=CN=C(Br)C=N1 MC443464 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.1 CCC1=CN=C(C)C=C1 MC20566 [1,0,0,0,0,0|1,0,1]=3 58 B9R1.1 CCC1=NC=C(Br)C=C1 CS12376 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.1 COC1=NC=C(C)C=C1 CS21644 [1,0,0,0,0,0|2,0,1]=4 60 B9R1.6 CC(Br)C1=CC=CC=C1 MC40570 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.6 CC(C)C1=NC=CC=C1 CS21621 [1,0,0,0,0,0|1,0,1]=3 62 B9R1.6 CC(N)C1=CC=CC=C1 CS10551 [1,0,0,0,0,0|1,0,2]=4 63 B9R1.6 CC(N)C1=CC=CC=C1 MC20344 [1,0,0,0,0,0|1,0,2]=4 64 B9R1.6 CC(N)C1=NC=CC=C1 CS15370 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 CC(N)C1=NC=CC=C1 CS20271 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.6 CC(N)C1=NC=CN=C1 CS12997 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [1,0,0,0,0,0|1,0,2]=4 68 B9R1.6 CC(O)C1=NC=CC=C1 CS20801 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.6 CC(O)C1=NC=CC=C1 MC20310 [1,0,0,0,0,0|2,0,1]=4 70 B9R1.6 CN(C)C1=CC=CC=C1 MC40906 [1,0,0,0,0,0|1,0,2]=4 71 B11R1.3 C(C)(N)C1=CC=C(OC)C=C1 MC20521 [0,1,0,0,0,0|1,0,2]=4 72 B11R1.3 CC(C)C1=CC=C(CBr)C=C1 CS14001 [0,1,0,0,0,0|0,0,2]=3 73 B11R1.3 CC(C)C1=CCC(CO)C=C1 MC428335 [0,1,0,0,0,0|0,0,2]=3 74 B11R1.3 CN(C)C1=NC=C(CN)C=C1 MC443720 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.3 COC1=CC=C(C(C)C)C=C1 MC41346 [0,1,0,0,0,0|0,0,2]=3 76 B11R1.3 COC1=CC=C(C(C)N)C=C1 CS13954 [0,1,0,0,0,0|1,0,2]=4 77 B11R1.3 COC1=CC=C(N(C)C)C=C1 MC20811 [0,1,0,0,0,0|1,0,2]=4 78 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 CS19038 [0,1,0,0,0,0|1,0,2]=4 79 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 CS20810 [0,1,0,0,0,0|1,0,2]=4 80 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 MC40938 [0,1,0,0,0,0|1,0,2]=4 81 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 CS16411 [0,1,0,0,0,0|1,0,2]=4 82 B11R1.19 CC(C)(N)C1=NC=C(Br)C=C1 MC102695 [0,1,0,0,0,0|2,0,1]=4 83 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 CS14403 [0,1,0,0,0,0|1,0,2]=4 84 B11R1.19 CC(C)(O)C1=CC=C(Br)N=C1 MC106089 [0,1,0,0,0,0|2,0,1]=4 85 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 MC21168 [0,1,0,0,0,0|2,0,1]=4 86 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 CS16019 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 MC112792 [0,1,0,0,0,0|1,0,2]=4 88 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 MC443561 [0,1,0,0,0,0|1,0,2]=4 89 B11R1.21 CC(C)C1=CC=C(N)C(N)=C1 MC107237 [0,1,0,0,0,0|1,0,2]=4 90 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 MC433331 [0,1,0,0,0,0|0,0,2]=3 91 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 MC20541 [0,1,0,0,0,0|0,0,2]=3 92 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,1,0,0,0,0|1,0,2]=4 93 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,1,0,0,0,0|1,0,2]=4 94 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,1,0,0,0,0|1,0,2]=4 95 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,1,0,0,0,0|1,0,2]=4 96 B11R1.166 CC1=CC(Br)=C(C(C)N)C=C1 MC112224 [0,1,0,0,0,0|1,0,2]=4 97 B11R2.34 BrC1=CC=C(C2CC2)C=C1 CS22811 [0,0,0,1,0,0|1,0,2]=4 98 B11R2.34 BrC1=NC=C(C2CC2)C=C1 MC442244 [0,0,0,1,0,0|2,0,1]=4 99 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [0,0,0,1,0,0|1,0,2]=4 100 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS17100 [0,0,0,1,0,0|1,0,2]=4 101 B9R1.35 CC(C)C1=CN=C(Br)S1 CS14917 [0,0,0,0,1,0|3,0,0]=4 102 B9R1.35 CC(C)C1=CSC(Br)=N1 MC432525 [0,0,0,0,1,0|3,0,0]=4 103 B9R1.35 CC(C)C1=CSC(N)=N1 MC443375 [0,0,0,0,1,0|3,0,0]=4 104 B9R1.35 CC(C)N1C=C(Br)C=N1 MC425593 [0,0,0,0,1,0|3,0,0]=4 105 B9R1.35 CC(C)N1C=C(N)C=N1 CS22541 [0,0,0,0,1,0|3,0,0]=4 106 B9R1.35 CC(C)N1C=NC(Br)=C1 MC425027 [0,0,0,0,1,0|3,0,0]=4 107 B9R1.35 CC(C)N1C=NC(I)=C1 MC430799 [0,0,0,0,1,0|3,0,0]=4 108 B9R1.35 CC(N)C1=CSC(Cl)=C1 MC104598 [0,0,0,0,1,0|3,0,0]=4 109 B9R1.35 CC(O)C1=CN(C)C=N1 MC103373 [0,0,0,0,1,0|3,0,0]=4 110 B9R1.35 CC1=NNC(C(C)C)=C1 MC431144 [0,0,0,0,1,0|2,0,0]=3 111 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 MC433485 [0,0,0,0,0,1|1,0,2]=4 112 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 MC443740 [0,0,0,0,0,1|1,0,2]=4 113 B11R1.20 CC(C)NC1=CC=C(F)C=C1 CS22842 [0,0,0,0,0,1|1,0,2]=4 114 B11R1.20 CC(C)OC1=CC=C(N)C=C1 CS10912 [0,0,0,0,0,1|1,0,2]=4 115 B11R1.20 CC(C)OC1=CC=C(O)C=C1 MC443483 [0,0,0,0,0,1|1,0,2]=4 116 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 MC443766 [0,0,0,0,0,1|2,0,1]=4 117 B11R1.20 CC(C)OC1=CN=C(Cl)C=N1 CS17390 [0,0,0,0,0,1|3,0,0]=4 118 B11R1.20 CC(C)SC1=CC=C(O)C=C1 MC112512 [0,0,0,0,0,1|1,0,2]=4 119 B8R1.2 CCC1=CC=CC=C1 MC41556 [2,0,0,0,0,0|0,0,2]=4 120 B8R1.2 CCC1=CC=CN=C1 CS22277 [2,0,0,0,0,0|1,0,1]=4 121 B8R1.2 CCC1=NC=CN=C1 CS21534 [2,0,0,0,0,0|2,0,0]=4 122 B8R1.3 CC1=CC=C(C)C=C1 MC41551 [2,0,0,0,0,0|0,0,2]=4 123 B8R1.3 CC1=CN=C(C)C=C1 CS21154 [2,0,0,0,0,0|1,0,1]=4 124 B10R1.1 CC1=CC=C(CCBr)C=C1 CS19977 [1,1,0,0,0,0|0,0,2]=4 125 B10R1.1 CC1=CC=C(CCN)C=C1 CS18979 [1,1,0,0,0,0|0,0,2]=4 126 B10R1.1 CC1=CC=C(CCO)C=C1 MC40744 [1,1,0,0,0,0|0,0,2]=4 127 B10R1.1 CNCC1=CC=C(C)C=C1 CS11795 [1,1,0,0,0,0|0,0,2]=4 128 B10R1.3 CCC1=CC=C(CCl)C=C1 MC40596 [1,1,0,0,0,0|0,0,2]=4 129 B10R1.176 CCC1=CN=C(C)C(C)=N1 CS21048 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [1,1,0,0,0,0|0,0,2]=4 131 B10R1.15 CC(CN)c1ccccc1 MC110750 [1,1,0,0,0,0|0,0,2]=4 132 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [1,1,0,0,0,0|0,0,2]=4 133 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [1,1,0,0,0,0|0,0,2]=4 134 B10R1.28 CC(C)(C)C1=CC=CC=C1 MC41559 [1,1,0,0,0,0|0,0,2]=4 135 B10R1.28 CC(C)(C)C1=CC=CN=C1 MC430933 [1,1,0,0,0,0|1,0,1]=4 136 B10R1.28 CC(C)(C)C1CC=CCC1 CS14977 [1,1,0,0,0,0|0,0,2]=4 137 B10R1.28 CC(C)(N)C1=NC=CC=C1 MC430649 [1,1,0,0,0,0|1,0,1]=4 138 B10R1.28 CC(C)(O)C1=NC=CC=C1 MC443311 [1,1,0,0,0,0|1,0,1]=4 139 B10R1.61 CC(C)C1=C(Br)C=CC=C1 CS19988 [1,1,0,0,0,0|0,0,2]=4 140 B10R1.61 CC(C)C1=NC=CC=C1Br MC441304 [1,1,0,0,0,0|1,0,1]=4 141 B10R1.61 CC(C)C1=NC=CC=C1N MC445692 [1,1,0,0,0,0|1,0,1]=4 142 B10R1.113 CC(C)C1=CC=CC(Br)=N1 MC434005 [1,1,0,0,0,0|1,0,1]=4 143 B10R1.113 CC(C)C1=CC=CC(N)=N1 MC425411 [1,1,0,0,0,0|1,0,1]=4 144 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 MC431795 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.113 CC(C)c1cccc(Br)c1 MC433484 [1,1,0,0,0,0|0,0,2]=4 146 B10R1.31 CC(C)C1=NC(CCl)=CS1 MC113790 [0,1,0,0,1,0|2,0,0]=4 147 B10R1.31 CC(C)c1cc(CN)on1 MC121101 [0,1,0,0,1,0|2,0,0]=4 148 B10R1.194 CC1=C(N)N(C(C)C)N=C1 MC106893 [0,1,0,0,1,0|2,0,0]=4 149 B12R1.6 CC(C)(C)C1=CC=C(CCl)C=C1 MC445129 [0,2,0,0,0,0|0,0,2]=4 150 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 MC41350 [0,2,0,0,0,0|0,0,2]=4 151 B12R1.48 COC1=C(N)C=C(C(C)C)C=C1 MC106490 [0,2,0,0,0,0|0,0,2]=4 152 B12R1.256 CC(=O)C1=CC=C(C(C)C)N=C1 MC429993 [0,2,0,0,0,0|1,0,1]=4 153 B12R1.23 CC1=C(N)C=C(C(C)(C)C)C=C1 MC442510 [0,2,0,0,0,0|0,0,2]=4 154 B12R1.126 CC1=CC(O)=C(C(C)(C)C)C=C1 MC41205 [0,2,0,0,0,0|0,0,2]=4 155 B12R1.12 CC1=CC=C(C(CN)CO)C=C1 MC105877 [0,2,0,0,0,0|0,0,2]=4 156 B12R1.12 CC1=CC=C(C(CN)CO)C=C1 MC105878 [0,2,0,0,0,0|0,0,2]=4 157 B10R2.14 CN1C=NC(C2CC2)=C1 MC105123 [0,0,0,1,1,0|2,0,0]=4 158 B8R0.23 CC(=O)CC(=O)C(C)C MC41930 [0,0,1,0,1,0|2,0,0]=4 159 B8R1.1 CC1=COC(CN)=C1 MC105034 [1,0,0,0,1,0|2,0,0]=4 160 B8R1.7 CC(C)C1=CC=CO1 MC428131 [1,0,0,0,1,0|1,0,0]=3 161 B8R1.7 CC(C)C1=NC=CN1 CS21624 [1,0,0,0,1,0|2,0,0]=4 162 B10R1.18 CC(C)NC1=CC=CC=C1 CS11787 [1,0,0,0,0,1|0,0,2]=4 163 B10R1.18 CC(C)OC1=CC=CC=C1 MC41360 [1,0,0,0,0,1|0,0,2]=4