0 B10R1.176 CC1=C(C=C(C=C1)C=O)C Z147641440 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.176 CC1=C(C=C(C=C1)CN)Cl Z4658099850 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.176 CC1=C(C=C(C=C1)CN)F Z166652084 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.176 CC1=C(C=C(C=C1)CN)N Z5023069916 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.176 CC1=C(C=C(C=C1)CN)O Z3951014909 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.176 CC1=C(C=C(C=C1)CO)Br Z1269190523 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.176 CC1=C(C=C(C=C1)CO)I Z1269159118 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.176 CC1=C(C=C(C=C1)CO)N Z1203578220 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.176 CC1=C(C=C(C=N1)C#N)N Z1203587232 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.176 CC1=C(C=CC(=C1)CN)Br Z2293605627 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.176 CC1=C(C=CC(=C1)CN)Cl Z1255503196 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.176 CC1=C(C=CC(=C1)CN)I Z1992316385 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.176 CC1=C(C=CC(=C1)CO)Br Z1269142250 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.176 CC1=C(C=CC(=C1)CO)Cl Z1201623310 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.176 CC1=C(C=CC(=N1)C#N)Br Z1255495365 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.176 CC1=C(C=CC(=N1)C#N)O Z1255468313 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.176 CC1=C(C=CC(=N1)C=O)O Z1255405992 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.176 CC1=C(C=CC(=N1)CN)Br Z4442967682 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.176 CC1=C(C=NC(=N1)CO)N Z3556573052 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.176 CC1=C(N=C(C=C1)C#N)Br Z1198307101 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.176 CC1=C(N=C(C=C1)C#N)C Z1198307112 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.176 CC1=C(N=C(C=C1)C#N)Cl Z1255390084 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.176 CC1=C(N=C(C=C1)C=O)C Z1255398335 [0,0,0,0,0,0|2,0,1]=3 23 B10R1.176 CC1=C(N=C(C=C1)CN)C Z4767745752 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.176 CC1=C(N=CC(=C1)C#N)Cl Z1198218511 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.176 CC1=C(N=CC(=C1)C#N)N Z1201623543 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.176 CC1=C(N=CC(=C1)C=O)C Z1255402338 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.176 CC1=C(N=CC(=C1)C=O)O Z1415926172 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.176 CC1=C(N=CC(=C1)CN)C Z3300709046 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.176 CC1=C(N=CC(=C1)CO)C Z1255392915 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.176 CC1=C(N=NC(=C1)C#N)C Z4189884376 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.176 CC1=C(N=NC(=C1)C=O)C Z4189818847 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.176 CC1=C(N=NC(=C1)CN)C Z5444181393 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.176 CC1=C(N=NC(=C1)CO)C Z4189815936 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.176 CCC1=CC(=C(C=C1)Br)Cl Z1551924078 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.176 CCC1=CC(=C(C=C1)Br)N Z2753220544 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.176 CCC1=CC(=C(C=C1)N)F Z1255421063 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.176 CCC1=CC(=C(C=C1)N)N Z1198311235 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.176 CCC1=CC(=C(C=C1)O)N Z1318147478 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.176 CCC1=NC(=C(C=N1)F)Cl Z1255429301 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.176 CNC1=CC(=C(C=C1)Br)C Z335264426 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.176 COC1=CC(=C(C=C1)C)N Z1203578033 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.176 COC1=CC(=C(C=C1)C)O Z1255384359 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.176 COC1=CC(=C(C=C1)Cl)C Z54850187 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.176 COC1=CC(=C(C=C1)I)C Z1269244593 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.176 COC1=CC(=C(C=C1)N)C Z239604794 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.176 COC1=CC(=C(N=C1)C)Br Z1269227186 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.176 COC1=CC(=C(N=C1)N)F Z1255367183 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.176 COC1=NC(=C(C=C1)N)Br Z1269148967 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.176 COC1=NC(=C(C=C1)N)C Z1198161549 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.176 COC1=NC(=C(C=C1)N)N Z1198169423 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.176 COC1=NC(=C(C=C1)O)C Z1255447798 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.176 CSC1=CC(=C(C=C1)C)N Z1037567098 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.176 CSC1=NC(=C(N=N1)C)C Z821284212 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.176 CSC1=NC(=O)C(=NN1)C Z90122581 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.176 NC1=C(C=C(C=N1)CO)Cl Z1065630414 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.176 NCC1=CC(=C(N=C1)N)Br Z5028402202 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.176 NCC1=CC(=C(N=C1)O)F Z5004159399 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 BrCC1=NC=C(N=C1)Br Z3244822385 [1,0,0,0,0,0|2,0,0]=3 61 B9R1.1 C#CC1=CN=C(C=N1)Cl Z1255362190 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.1 C=CC1=NC=C(C=C1)C Z1198181628 [1,0,0,0,0,0|1,0,2]=4 63 B9R1.1 CC1=CN=C(C=C1)C=O Z1198172069 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.1 CC1=CN=C(C=C1)CO Z1198270889 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.1 CC1=CN=C(N=C1)CN Z2327893645 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.1 CC1=CN=C(N=C1)CO Z1198277216 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.1 CC1=NC=C(C=C1)C#N Z362778572 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.1 CC1=NC=C(C=C1)C=O Z744849420 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.1 CC1=NC=C(C=C1)CN Z444349734 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.1 CC1=NC=C(C=C1)CO Z397587474 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.1 CC1=NC=C(C=N1)CO Z1013716404 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.1 CC1=NC=C(N=C1)C#N Z1198164470 [1,0,0,0,0,0|1,0,1]=3 73 B9R1.1 CC1=NC=C(N=C1)C=O Z1079442402 [1,0,0,0,0,0|1,0,1]=3 74 B9R1.1 CC1=NC=C(N=C1)CN Z3271770568 [1,0,0,0,0,0|1,0,0]=2 75 B9R1.1 CC1=NC=C(N=C1)CO Z397587476 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.1 CCC1=CC=C(C=C1)I Z381540768 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.1 CCC1=CC=C(C=C1)N Z104477836 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.1 CCC1=CC=C(C=C1)O Z104479728 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 CCC1=CN=C(C=C1)N Z1198224278 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.1 CCC1=CN=C(N=C1)Br Z1255367602 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.1 CCC1=CN=C(N=C1)Cl Z1255423971 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.1 CCC1=CN=C(N=C1)N Z1137168329 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.1 CCC1=NC=C(C=N1)N Z381402598 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.1 CCC1=NC=C(N=C1)Br Z1198319305 [1,0,0,0,0,0|1,0,0]=2 85 B9R1.1 CNC1=NC=C(C=C1)Br Z359297630 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 CNC1=NC=C(C=C1)C Z359297596 [1,0,0,0,0,0|2,0,0]=3 87 B9R1.1 CNC1=NC=C(C=C1)Cl Z359297632 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 CNC1=NC=C(C=C1)F Z802823886 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 CNC1=NN=C(C=C1)C Z802821708 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.1 COC1=CC=C(C=C1)C Z53834227 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.1 COC1=CN=C(C=C1)C Z1198232754 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.1 COC1=NC=C(C=C1)Br Z808608370 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 COC1=NC=C(C=C1)Cl Z1094698482 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 COC1=NC=C(C=C1)N Z56899049 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.1 COC1=NC=C(C=C1)O Z1201623942 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 CSC1=CN=C(C=C1)N Z412025068 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.1 CSC1=NC=C(C=C1)N Z412022842 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.1 CSC1=NN=C(C=N1)C Z1255500736 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.1 ClCC1=NC=C(N=C1)Cl Z1198277950 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.1 N#CC1=CN=C(C=N1)Cl Z1095350204 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.1 N#CC1=CN=C(C=N1)F Z1681360151 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.1 NC1=NC=C(C=C1)CO Z960446254 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.1 NC1=NC=C(N=C1)CO Z1203583050 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.1 NCC1=CN=C(C=C1)Cl Z247612574 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.1 NCC1=CN=C(C=C1)F Z1198311144 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.1 NCC1=CN=C(C=C1)O Z1269638445 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.1 NCC1=NC=C(C=C1)Br Z3241254216 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.1 NCC1=NC=C(C=C1)Cl Z636367336 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.1 NCC1=NC=C(C=C1)F Z1198277779 [1,0,0,0,0,0|3,0,0]=4 110 B9R1.1 NCC1=NC=C(C=C1)N Z3244746175 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.1 NCC1=NC=C(C=C1)O Z3324887230 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.1 NCC1=NC=C(N=C1)Br Z1416181963 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.1 NCC1=NC=C(N=C1)Cl Z1198278893 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.1 OCC1=NC=C(C=C1)Br Z1065600752 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.1 OCC1=NC=C(C=C1)Cl Z1198272591 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.1 OCC1=NC=C(C=C1)O Z1217915045 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.1 OCC1=NC=C(N=C1)Br Z1255381074 [1,0,0,0,0,0|2,0,0]=3 118 B9R1.2 C#CC1=CC=CC(=N1)C Z1198181708 [1,0,0,0,0,0|1,0,2]=4 119 B9R1.2 CC1=CC(=CN=C1)C#N Z1203162272 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.2 CC1=CC(=CN=C1)C=O Z1198176743 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.2 CC1=CC(=CN=C1)CO Z4562296729 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.2 CC1=NC(=CC=C1)C#N Z445153364 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.2 CC1=NC(=CC=C1)C=O Z1079442396 [1,0,0,0,0,0|2,0,1]=4 125 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.2 CC1=NC(=CC=C1)CO Z397587486 [1,0,0,0,0,0|2,0,0]=3 127 B9R1.2 CC1=NC(=CC=N1)CO Z1013685034 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.2 CC1=NC(=CN=C1)C#N Z1198181973 [1,0,0,0,0,0|1,0,1]=3 129 B9R1.2 CC1=NC(=NC=C1)CN Z2372278985 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.2 CCC1=NC(=CC=C1)C Z1255485781 [1,0,0,0,0,0|1,0,0]=2 133 B9R1.2 CCC1=NC(=CC=N1)Cl Z445153086 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.2 CCC1=NC(=NC=C1)Cl Z1198279743 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.2 CCC1=NC(=NC=C1)N Z1203579436 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.2 CNC1=CC(=CN=C1)Br Z1255444030 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.2 CNC1=NC(=CC=C1)C Z600403388 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.2 CNC1=NC(=NC=C1)C Z960796268 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.2 COC1=NC(=CN=C1)N Z1198261569 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.2 CSC1=CC(=CN=C1)N Z2239020735 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.2 CSC1=NC(=CC=N1)C Z275763960 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.2 CSC1=NC(=CN=C1)Cl Z732207920 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.2 CSC1=NC(=CN=N1)C Z1255426895 [1,0,0,0,0,0|2,0,0]=3 146 B9R1.2 ClCC1=CC(=CN=C1)Br Z381037204 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.2 ClCC1=NC(=CN=C1)Cl Z1255357868 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.2 N#CC1=CN=CC(=N1)Br Z1165304242 [1,0,0,0,0,0|2,0,1]=4 149 B9R1.2 N#CC1=CN=CC(=N1)Cl Z1165304152 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.2 N#CC1=CN=CC(=N1)F Z1681360134 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.2 NC1=NC(=CC=C1)CO Z154209994 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.2 NC1=NC(=CN=C1)CO Z1203641562 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.2 NCC1=CC(=CN=C1)Br Z2692250391 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.2 NCC1=CC(=CN=C1)Cl Z3244925674 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.2 NCC1=NC(=CC=C1)N Z2310698959 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.2 NCC1=NC(=CN=C1)Cl Z3235038825 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.2 NNC1=NC(=CN=C1)Cl Z319443864 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.2 OCC1=CC(=CN=C1)Br Z381037198 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.2 OCC1=NC(=CC=C1)O Z1198343459 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.69 CC1=C(C=C(C=C1)N)C Z104472552 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.69 CC1=C(C=C(C=C1)O)C Z104477218 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.69 CC1=C(C=C(C=N1)Br)N Z1198183234 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.69 CC1=C(C=C(C=N1)Br)O Z1255428492 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.69 CC1=C(C=C(C=N1)N)Br Z1198175716 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.69 CC1=C(C=C(C=N1)O)Br Z1198234267 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.69 CC1=C(C=CC(=N1)Cl)I Z1269206091 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.69 CC1=C(C=CC(=N1)N)Br Z57376600 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.69 CC1=C(C=CC(=N1)N)I Z57296056 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.69 CC1=C(N=C(C=N1)Br)C Z1416194403 [1,0,0,0,0,0|1,0,0]=2 171 B9R1.69 CC1=C(N=C(C=N1)Cl)C Z1255462913 [1,0,0,0,0,0|1,0,0]=2 172 B9R1.69 CC1=C(N=C(C=N1)Cl)Cl Z1198342669 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.69 CC1=C(N=C(C=N1)O)C Z1255400771 [1,0,0,0,0,0|1,0,0]=2 174 B9R1.69 CC1=C(N=C(N=C1)Cl)C Z1255505274 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.69 CC1=C(N=C(N=N1)Cl)C Z1216825228 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.69 CC1=C(N=C(N=N1)N)C Z1203162685 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.69 CC1=C(N=C(N=N1)[O-])C Z1696871460 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.69 CC1=C(N=CC(=C1)Br)Br Z1269220337 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.69 CC1=C(N=CC(=C1)N)C Z1198174887 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.69 CC1=C(N=NC(=C1)Br)C Z1813162615 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.69 CC1=C(N=NC(=C1)Cl)C Z1013743394 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.69 CC1=C(N=NC(=C1)N)C Z1013744332 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.69 CC1=C(N=NC(=C1)O)C Z1258992450 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.69 CC1=C(N=NC(=C1)S)C Z3003235829 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.69 CC1=C(N=NC(=N1)Cl)Cl Z1255363674 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.69 CC1=CC(=C(C=C1)C)C Z104476700 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.69 CC1=CC(=C(C=C1)C)N Z57127441 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.69 CC1=CC(=C(C=C1)C)O Z104477216 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.69 CC1=CC(=C(C=C1)N)C Z57127436 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.69 CC1=CC(=C(N=C1)C)N Z3996549873 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.69 CC1=CC(=C(N=C1)N)C Z1197891469 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.69 CC1=CC(=C(N=C1)N)N Z1198163678 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.69 CC1=CC(=NN=C1Cl)C Z1255433917 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.69 CC1=CNC(=O)C(=C1)C Z1203732572 [1,0,0,0,0,0|2,0,1]=4 195 B9R1.69 CC1=NC(=C(C=C1)Br)N Z1201622094 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.69 CC1=NC(=C(C=C1)Br)S Z2739314860 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.69 CC1=NC(=C(C=C1)N)O Z1198173820 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.69 CC1=NC(=C(C=C1)O)I Z1269109440 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.69 CC1=NC(=C(C=C1)O)N Z955136382 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.69 CC1=NC(=C(C=N1)C)Br Z2937803268 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.69 CC1=NC(=C(C=N1)C)Cl Z1198223810 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.69 CC1=NC(=C(C=N1)C)N Z1198261676 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.69 CC1=NC(=C(C=N1)N)C Z1198220830 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.69 CC1=NC(=C(C=N1)O)C Z1255426535 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.69 CC1=NC(=C(N=C1)C)Cl Z104479244 [1,0,0,0,0,0|1,0,0]=2 206 B9R1.69 CC1=NC(=C(N=C1)C)F Z2920901477 [1,0,0,0,0,0|1,0,0]=2 207 B9R1.69 CC1=NC(=C(N=C1)C)N Z1203578739 [1,0,0,0,0,0|1,0,0]=2 208 B9R1.69 CC1=NC(=C(N=C1)C)O Z1198723414 [1,0,0,0,0,0|1,0,0]=2 209 B9R1.69 CC1=NC(=C(N=C1)Cl)C Z1201619176 [1,0,0,0,0,0|1,0,0]=2 210 B9R1.69 CC1=NN=C(C(=C1)Br)C Z3377872794 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.14 CC1=CC(=CC(=C1C)C)CO Z1198151784 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.14 CCC1=CC(=C(C(=C1)C)O)C Z1513805646 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.14 CCC1=NC(=C(C(=N1)Cl)C)Cl Z1140399185 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.14 CCC1=NC(=C(C(=O)N1)F)C Z1270003725 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.14 CCC1=NC(=O)C(=C(N1)N)C Z2235681291 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.14 COC1=NC(=C(C(=C1)C)Br)C Z1269241228 [0,1,0,0,0,0|3,0,0]=4 217 B11R1.14 COC1=NC(=C(C(=C1)C)N)C Z1262689269 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)C Z104477440 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)C Z1255426822 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.21 CC(=O)C1=NC(=C(C=C1)C)F Z1255393952 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.21 CC1=C(C=C(C=C1)C(C)N)F Z363990474 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.21 CC1=C(C=C(C=C1)[C@@H](C)O)C Z360055396 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.21 CC1=C(C=C(C=C1)[C@H](C)O)C Z360055400 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)C Z1198307150 [0,1,0,0,0,0|2,0,1]=4 228 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)C Z3244908427 [0,1,0,0,0,0|2,0,1]=4 229 B11R1.21 CC1=C(N=CC(=C1)[N+](=O)[O-])C Z1255467278 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [0,1,0,0,0,0|3,0,0]=4 236 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [0,1,0,0,0,0|3,0,0]=4 239 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.192 COCC1=NC(=C(C=N1)N)C Z3446469140 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.277 CC1=C(C=C(C(=C1)Cl)CO)C Z1462950881 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.277 CC1=C(N=C(C(=C1)Br)C#N)C Z5074645239 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.277 CC1=C(N=C(C(=C1)Br)C=O)C Z5432532475 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.277 CC1=C(N=C(C(=C1)Br)CN)C Z5410120977 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.277 CC1=NC(=C(N=C1C=O)C)C Z1201628611 [0,1,0,0,0,0|1,0,1]=3 249 B11R1.277 CCC1=C(N=C(C(=C1)Br)C)N Z1269236322 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.277 COC1=C(C=C(C(=C1)C)C)I Z1269173674 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.279 C#CC1=CC(=C(N=C1)OC)C Z1416177866 [0,1,0,0,0,0|1,0,2]=4 252 B11R1.279 CCC1=CC(=C(C=C1)C=O)C Z1511897707 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.279 CCC1=CC(=C(C=C1)CC)Br Z1203016482 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.279 CCC1=CC(=C(C=C1)CC)N Z1276502928 [0,1,0,0,0,0|3,0,0]=4 255 B11R1.279 CCC1=CC(=C(C=C1)OC)N Z1209420082 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.279 COC1=C(C=C(C=C1)CN)C Z446021090 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.279 COC1=C(C=C(C=N1)C=O)C Z1255428321 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.279 COC1=C(C=C(C=N1)CN)Cl Z2235386853 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.279 COC1=C(N=C(C=C1)C=O)C Z1255392726 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.279 COC1=C(N=C(C=C1)CN)C Z5159661244 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.279 COC1=C(N=C(C=C1)CO)C Z1504670506 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.279 COC1=CC(=C(C=C1)CN)C Z1190318959 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.279 COC1=CC(=C(N=C1)C=O)C Z1255504594 [0,1,0,0,0,0|2,0,1]=4 264 B11R1.279 COC1=NC(=C(C=C1)C=O)C Z1198307211 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.279 CSC1=C(C=C(C=C1)CN)C Z732208378 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.280 CCC1=C(C=CC(=N1)OC)N Z2061819023 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.280 CCC1=CC(=C(C=C1)O)OC Z57234301 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.280 CNC1=CC(=C(C=C1)C)NC Z1463349151 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.280 CNC1=CC(=C(C=C1)C)OC Z5981152945 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.280 COC1=C(C=CC(=C1)CN)C Z812517018 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.280 COC1=C(C=CC(=C1)CO)C Z397587200 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.280 COC1=C(C=CC(=N1)C=O)C Z1198311272 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.280 COC1=C(N=CC(=C1)C#N)C Z1255445535 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.280 COC1=C(N=CC(=C1)C=O)C Z1255504574 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.280 COC1=CC(=C(N=C1)Br)OC Z1269122334 [0,1,0,0,0,0|3,0,0]=4 276 B11R1.280 COC1=NC(=C(C=C1)C)C=O Z1198311271 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.280 COC1=NC(=C(C=C1)C)CN Z4607149761 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.280 COC1=NC(=C(N=C1)Br)OC Z1813180361 [0,1,0,0,0,0|2,0,0]=3 279 B9R1.23 CC1=C(NC(=N1)C#N)C Z1509315990 [0,0,0,0,1,0|1,0,2]=4 280 B9R1.23 CC1=C(NC(=N1)C=O)C Z1172333176 [0,0,0,0,1,0|1,0,2]=4 281 B9R1.23 CC1=C(NC(=N1)CO)C Z1172334787 [0,0,0,0,1,0|1,0,1]=3 282 B9R1.23 CC1=C(OC(=N1)C=O)C Z1404730693 [0,0,0,0,1,0|2,0,1]=4 283 B9R1.23 CC1=C(OC(=N1)CN)C Z661694000 [0,0,0,0,1,0|2,0,0]=3 284 B9R1.23 CC1=C(OC(=N1)CO)C Z1374898967 [0,0,0,0,1,0|2,0,0]=3 285 B9R1.23 CC1=C(SC(=C1)C=O)C Z1255488969 [0,0,0,0,1,0|2,0,1]=4 286 B9R1.23 CC1=C(SC(=C1)CN)C Z1258578420 [0,0,0,0,1,0|2,0,0]=3 287 B9R1.23 CC1=C(SC(=N1)C=O)C Z1037606538 [0,0,0,0,1,0|2,0,1]=4 288 B9R1.23 CC1=C(SC(=N1)CN)C Z803066590 [0,0,0,0,1,0|2,0,0]=3 289 B9R1.23 CC1=C(SC(=N1)CO)C Z1037609712 [0,0,0,0,1,0|2,0,0]=3 290 B9R1.23 CC1=CC(=NN1C)C#N Z1198164901 [0,0,0,0,1,0|2,0,1]=4 291 B9R1.23 CC1=CC(=NN1C)C=O Z1201623008 [0,0,0,0,1,0|2,0,1]=4 292 B9R1.23 CC1=CC(=NN1C)CN Z3243684506 [0,0,0,0,1,0|2,0,0]=3 293 B9R1.23 CC1=NC(=NN1C)C=O Z1416193142 [0,0,0,0,1,0|2,0,1]=4 294 B9R1.23 CC1=NC(=NN1C)CO Z3026707856 [0,0,0,0,1,0|2,0,0]=3 295 B9R1.23 CCC1=NC(=C(S1)N)C Z1762997381 [0,0,0,0,1,0|2,0,0]=3 296 B9R1.23 CCC1=NN(C(=C1)N)C Z385401436 [0,0,0,0,1,0|2,0,0]=3 297 B9R1.23 CCC1=NN(C(=N1)N)C Z995040956 [0,0,0,0,1,0|2,0,0]=3 298 B9R1.23 CCC1=NN(C(=O)C1)C Z50146895 [0,0,0,0,1,0|2,0,1]=4 299 B9R1.23 CCN1C=C(C(=N1)C)N Z2106593745 [0,0,0,0,1,0|2,0,0]=3 300 B9R1.23 CCN1C=C(C(=N1)N)Cl Z2736561383 [0,0,0,0,1,0|3,0,0]=4 301 B9R1.23 CN1N=C(C=C1N)CO Z1726083922 [0,0,0,0,1,0|3,0,0]=4 302 B9R1.23 CN1N=C(N=C1N)CN Z4556925391 [0,0,0,0,1,0|3,0,0]=4 303 B9R1.23 COC1=NN(C(=C1)N)C Z2792040941 [0,0,0,0,1,0|3,0,0]=4 304 B9R1.132 CC1=C(C(=CS1)C=O)C Z1511763162 [0,0,0,0,1,0|2,0,1]=4 305 B9R1.132 CC1=C(C(=CS1)CO)C Z1198310118 [0,0,0,0,1,0|2,0,0]=3 306 B9R1.132 CC1=C(C(=CS1)CO)N Z4895300395 [0,0,0,0,1,0|3,0,0]=4 307 B9R1.132 CC1=C(C=NN1C)C=O Z275170376 [0,0,0,0,1,0|2,0,1]=4 308 B9R1.132 CC1=C(C=NN1C)CN Z275170390 [0,0,0,0,1,0|2,0,0]=3 309 B9R1.132 CC1=C(C=NN1C)CO Z275128446 [0,0,0,0,1,0|2,0,0]=3 310 B9R1.132 CC1=C(N=NN1C)CN Z5620925684 [0,0,0,0,1,0|3,0,0]=4 311 B9R1.132 CC1=CC=C(N1C)CN Z56968795 [0,0,0,0,1,0|3,0,0]=4 312 B9R1.132 CC1=NC=C(N1C)C=O Z1201623537 [0,0,0,0,1,0|2,0,1]=4 313 B9R1.132 CC1=NN=C(N1C)CO Z422595466 [0,0,0,0,1,0|3,0,0]=4 314 B9R1.132 CC1=NNC(=C1C)CN Z2798298791 [0,0,0,0,1,0|2,0,0]=3 315 B9R1.132 CCC1=C(C(=NN1)N)Br Z1318147484 [0,0,0,0,1,0|3,0,0]=4 316 B9R1.132 CCC1=C(C(=NN1)N)C Z1266823277 [0,0,0,0,1,0|2,0,0]=3 317 B9R1.132 CCC1=C(C(=O)NC1)C Z1203731042 [0,0,0,0,1,0|1,0,2]=4 318 B9R1.132 CN1C(=CN=C1S)CO Z1201619807 [0,0,0,0,1,0|3,0,0]=4 319 B9R1.132 CNC1=NN=C(N1C)C Z2491046484 [0,0,0,0,1,0|3,0,0]=4 320 B9R1.132 COC1=C(C(=NN1)C)Br Z1416192291 [0,0,0,0,1,0|3,0,0]=4 321 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.2 CCC1=CN=CC=C1 Z104476778 [2,0,0,0,0,0|1,0,0]=3 323 B8R1.2 CCC1=NC=CC=C1 Z113558650 [2,0,0,0,0,0|1,0,0]=3 324 B8R1.2 CCC1=NC=CC=N1 Z1198725952 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.2 CCC1=NC=NC=C1 Z1198725956 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 CCC1=NN=CC=C1 Z1222425026 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.2 CNC1=NN=CC=N1 Z1198323671 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.2 CSC1=NC=CN=C1 Z1203162104 [2,0,0,0,0,0|1,0,0]=3 330 B8R1.2 N#CC1=NC=CN=C1 Z448103898 [2,0,0,0,0,0|1,0,1]=4 331 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|2,0,0]=4 332 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.2 NCC1=NC=CN=C1 Z241059702 [2,0,0,0,0,0|1,0,0]=3 334 B8R1.2 O=CC1=NC=CN=C1 Z1013412214 [2,0,0,0,0,0|1,0,1]=4 335 B8R1.2 OCC1=CN=CC=C1 Z104495622 [2,0,0,0,0,0|2,0,0]=4 336 B8R1.2 OCC1=NC=CC=C1 Z57921252 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.3 CC1=CC=C(C=C1)C Z199056432 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.3 CC1=CN=C(C=C1)Br Z415645054 [2,0,0,0,0,0|2,0,0]=4 339 B8R1.3 CC1=CN=C(C=C1)N Z104475374 [2,0,0,0,0,0|2,0,0]=4 340 B8R1.3 CC1=CN=C(C=C1)O Z1255523405 [2,0,0,0,0,0|2,0,0]=4 341 B8R1.3 CC1=CN=C(C=C1)S Z271138132 [2,0,0,0,0,0|2,0,0]=4 342 B8R1.3 CC1=NC=C(C=C1)N Z425834586 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.3 CC1=NC=C(C=C1)O Z838078132 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.3 CC1=NC=C(N=C1)Br Z1198181968 [2,0,0,0,0,0|1,0,0]=3 345 B8R1.3 CC1=NC=C(N=C1)Cl Z1198149378 [2,0,0,0,0,0|1,0,0]=3 346 B8R1.3 CC1=NC=C(N=C1)N Z1198177429 [2,0,0,0,0,0|1,0,0]=3 347 B8R1.3 CC1=NN=C(N=C1)N Z1203578846 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.3 ClC1=CN=C(C=N1)Cl Z1198164590 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.3 ClC1=NC=C(N=C1)Br Z1198179757 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.3 ClC1=NC=C(N=C1)I Z1269194601 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.3 FC1=NC=C(N=C1)Cl Z1198220735 [2,0,0,0,0,0|2,0,0]=4 352 B8R1.4 CC1=CC(=CN=C1)Br Z1255461727 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.4 CC1=CC=CC(=C1)C Z199056430 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.4 CC1=CC=CC(=N1)C Z104472820 [2,0,0,0,0,0|1,0,0]=3 355 B8R1.4 CC1=NC(=CC=C1)Br Z600403652 [2,0,0,0,0,0|2,0,0]=4 356 B8R1.4 CC1=NC(=CC=C1)N Z104476000 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.4 CC1=NC(=CN=C1)Br Z1255361267 [2,0,0,0,0,0|1,0,0]=3 358 B8R1.4 CC1=NC(=CN=C1)Cl Z1162448376 [2,0,0,0,0,0|1,0,0]=3 359 B8R1.4 CC1=NC(=CN=C1)F Z1862003526 [2,0,0,0,0,0|1,0,0]=3 360 B8R1.4 CC1=NC(=CN=C1)N Z1203578408 [2,0,0,0,0,0|1,0,0]=3 361 B8R1.4 CC1=NC(=NN=C1)N Z381019664 [2,0,0,0,0,0|2,0,0]=4 362 B8R1.4 ClC1=CN=CC(=N1)Cl Z217291786 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.4 FC1=NC(=CN=C1)Cl Z1255444361 [2,0,0,0,0,0|2,0,0]=4 364 B8R1.4 NC1=NC(=CN=C1)Cl Z850999210 [2,0,0,0,0,0|2,0,0]=4 365 B8R1.5 CC1=C(C=CC=C1)C Z212053190 [2,0,0,0,0,0|2,0,0]=4 366 B8R1.5 CC1=C(C=CC=N1)I Z1269190410 [2,0,0,0,0,0|2,0,0]=4 367 B8R1.5 CC1=C(N=CC=C1)Br Z968908232 [2,0,0,0,0,0|2,0,0]=4 368 B8R1.5 CC1=C(N=CC=C1)C Z104472816 [2,0,0,0,0,0|1,0,0]=3 369 B8R1.5 CC1=C(N=CC=C1)N Z203045034 [2,0,0,0,0,0|2,0,0]=4 370 B8R1.5 CC1=C(N=CC=C1)S Z968907338 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.5 CC1=C(N=CC=N1)Br Z1198181977 [2,0,0,0,0,0|1,0,0]=3 372 B8R1.5 CC1=C(N=CC=N1)C Z448248230 [2,0,0,0,0,0|0,0,0]=2 373 B8R1.5 CC1=C(N=CC=N1)Cl Z1198147877 [2,0,0,0,0,0|1,0,0]=3 374 B8R1.5 CC1=C(N=CC=N1)F Z1551948468 [2,0,0,0,0,0|1,0,0]=3 375 B8R1.5 CC1=C(N=CC=N1)N Z3068686273 [2,0,0,0,0,0|1,0,0]=3 376 B8R1.5 CC1=C(N=CC=N1)O Z1198157257 [2,0,0,0,0,0|1,0,0]=3 377 B8R1.5 CC1=C(N=CN=C1)C Z2760929781 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.5 ClC1=C(N=CC=N1)Br Z1255362476 [2,0,0,0,0,0|2,0,0]=4 379 B8R1.5 ClC1=C(N=CC=N1)Cl Z850504018 [2,0,0,0,0,0|2,0,0]=4 380 B8R1.5 ClC1=C(N=CC=N1)I Z1813099369 [2,0,0,0,0,0|2,0,0]=4 381 B8R1.5 FC1=C(N=CC=N1)Cl Z1551935456 [2,0,0,0,0,0|2,0,0]=4 382 B8R1.5 NC1=C(N=CC=N1)N Z1198174211 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.5 NC1=C(N=CC=N1)S Z1203579756 [2,0,0,0,0,0|2,0,0]=4 384 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,1,0,0,0,0|2,0,0]=4 385 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [1,1,0,0,0,0|2,0,0]=4 386 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.1 CC1=NC=C(N=C1)CCO Z1504684184 [1,1,0,0,0,0|0,0,0]=2 388 B10R1.1 CCNC1=NC=C(C=C1)Br Z359297778 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.1 CCNC1=NC=C(C=C1)I Z2233927789 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.1 CCNC1=NN=C(C=C1)C Z802821712 [1,1,0,0,0,0|2,0,0]=4 391 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.1 CCOC1=NC=C(C=C1)N Z240084310 [1,1,0,0,0,0|2,0,0]=4 393 B10R1.1 CCSC1=NC=C(C=C1)Br Z742922262 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.1 CCSC1=NC=C(C=C1)N Z332377604 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.1 CNCC1=CN=C(C=C1)Cl Z265498862 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.1 CNCC1=CN=C(C=C1)F Z1745074466 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.1 CNCC1=CN=C(C=C1)N Z1255388567 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.1 CNCC1=NC=C(C=C1)Br Z5436471179 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.1 CNCC1=NC=C(C=C1)C Z1255425232 [1,1,0,0,0,0|1,0,0]=3 401 B10R1.1 CNCC1=NC=C(N=C1)C Z2310677427 [1,1,0,0,0,0|0,0,0]=2 402 B10R1.1 CSCC1=CN=C(C=C1)Cl Z732206922 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.1 NC1=CN=C(C=C1)CCO Z1898597735 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.3 CCC1=CC=C(C=C1)CN Z239626560 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.3 CCC1=CN=C(C=C1)C=O Z1198235245 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.3 CCC1=NC=C(C=C1)C=O Z1255494858 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.3 CNC1=CN=C(C=C1)OC Z335249570 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.3 CNC1=NC=C(C=C1)OC Z1255359415 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.3 CNC1=NC=C(N=C1)C#N Z1217199212 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.3 CNC1=NC=C(N=C1)CN Z3324787427 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.3 COC1=NC=C(C=C1)CO Z800297984 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.3 COC1=NC=C(N=C1)C#N Z1198277942 [1,1,0,0,0,0|1,0,1]=4 416 B10R1.13 CC(N)C1=CN=C(C=C1)O Z4423361180 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.13 CC(N)C1=NC=C(N=C1)Cl Z4188952637 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.13 CC(O)C1=NC=C(C=C1)F Z1255406174 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.13 CC1=CC=C(C=C1)C(C)C Z104497772 [1,1,0,0,0,0|2,0,0]=4 420 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [1,1,0,0,0,0|2,0,0]=4 422 B10R1.13 CC1=NC=C(N=C1)C(=O)O Z104478058 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.13 C[C@H](N)C1=NC=C(C=C1)Cl Z1753033020 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.13 FC(F)C1=NC=C(N=C1)Cl Z2944520663 [1,1,0,0,0,0|2,0,0]=4 425 B10R1.25 CC1=CC(=NC=C1CN)C Z2255111767 [1,1,0,0,0,0|2,0,0]=4 426 B10R1.25 CC1=NC(=C(N=C1)C=O)C Z1255418740 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.25 CCC1=C(C=C(C=C1)C)O Z1198181015 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.25 CCC1=C(C=C(N=C1)C)N Z1198157196 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.25 CCC1=C(N=C(C=C1)C)N Z1201619216 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.25 COC1=C(C=C(N=C1)C)Br Z2327128840 [1,1,0,0,0,0|2,0,0]=4 431 B10R1.25 COC1=C(N=C(C=C1)C)N Z955136104 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.25 ClC1=NC(=C(N=C1)CBr)Cl Z1486028094 [1,1,0,0,0,0|2,0,0]=4 433 B10R1.25 NCC1=C(N=C(C=N1)Cl)Cl Z2568737584 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.2 CCC1=C(C(=CC=C1)C)N Z104472756 [1,1,0,0,0,0|2,0,0]=4 435 B10R1.8 CC1=NC(=CC(=C1)Br)CN Z4873016211 [1,1,0,0,0,0|2,0,0]=4 436 B10R1.8 CCC1=NC(=CC(=N1)C)Br Z1269142318 [1,1,0,0,0,0|2,0,0]=4 437 B10R1.8 CCC1=NC(=CC(=N1)C)Cl Z274575942 [1,1,0,0,0,0|2,0,0]=4 438 B10R1.8 CCC1=NC(=NC(=C1)Br)C Z1267820859 [1,1,0,0,0,0|2,0,0]=4 439 B10R1.8 CCC1=NC(=NC(=C1)Cl)C Z431783828 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.8 CCC1=NC(=NC(=C1)N)C Z960785798 [1,1,0,0,0,0|2,0,0]=4 441 B10R1.8 COC1=NC(=CC(=C1)C)C Z1255389258 [1,1,0,0,0,0|2,0,0]=4 442 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|2,0,0]=4 443 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.10 CC1=NC(=NC=C1)CCO Z1255460290 [1,1,0,0,0,0|2,0,0]=4 445 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.10 CCOC1=NC(=CC=C1)C Z1198168604 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.10 CCOC1=NC(=CC=C1)N Z1139188017 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.10 CCOC1=NC(=CN=C1)Cl Z291235528 [1,1,0,0,0,0|1,0,0]=3 449 B10R1.10 CCOC1=NC(=CN=C1)N Z1198727889 [1,1,0,0,0,0|1,0,0]=3 450 B10R1.10 CCSC1=NC(=CN=C1)Cl Z408197356 [1,1,0,0,0,0|1,0,0]=3 451 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [1,1,0,0,0,0|2,0,0]=4 452 B10R1.10 CNCC1=CC(=CN=C1)Br Z5095377359 [1,1,0,0,0,0|2,0,0]=4 453 B10R1.10 CNCC1=NC(=CC=C1)C Z1255523287 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [1,1,0,0,0,0|2,0,0]=4 455 B10R1.30 CC1=NC(=C(C=C1)Br)CN Z5405244890 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.30 CC1=NC(=C(C=C1)Cl)CN Z4481990655 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.30 CC1=NC(=C(C=C1)O)CN Z3476873846 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.30 CC1=NC(=C(C=C1)O)CO Z1104852895 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.30 CC1=NC(=C(N=C1)Cl)C#N Z1551942864 [1,1,0,0,0,0|1,0,1]=4 460 B10R1.30 CCC1=C(C=CC(=N1)C)O Z1741975119 [1,1,0,0,0,0|1,0,0]=3 461 B10R1.30 CCC1=C(N=CC(=C1)Cl)N Z1197892627 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.30 CCC1=C(N=CC(=C1)N)C Z3033333120 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.30 COC1=C(C=CC(=N1)C)O Z1255397596 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.113 CC(=O)C1=CC(=CN=C1)C Z1198331406 [1,1,0,0,0,0|1,0,1]=4 465 B10R1.113 CC(=O)C1=NC(=CN=C1)Cl Z1681347110 [1,1,0,0,0,0|1,0,1]=4 466 B10R1.113 CC(O)C1=CC(=CN=C1)F Z823275188 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.113 CC1=CC=CC(=N1)[C@@H](C)N Z1492797078 [1,1,0,0,0,0|1,0,0]=3 474 B10R1.113 CC1=CC=NC(=N1)C(C)N Z2257510671 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.113 CN(C)C1=NC(=CN=C1)Cl Z850998362 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.172 CCC1=CC(=CC=C1)NC Z335280692 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.172 CCC1=CC(=CN=C1)C=O Z1255382321 [1,1,0,0,0,0|1,0,1]=4 478 B10R1.172 CCC1=CC(=CN=C1)CN Z2310718462 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.172 CCC1=NC(=CC=C1)C=O Z1255375781 [1,1,0,0,0,0|1,0,1]=4 480 B10R1.172 CNC1=CC=CC(=N1)NC Z1203731164 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.172 CNC1=NC(=CC=C1)OC Z104494274 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.172 CNC1=NC(=CN=C1)OC Z1431178752 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.172 COC1=CN=CC(=C1)OC Z1198157277 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.172 COC1=NC(=CC=C1)CCl Z969097374 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.172 COC1=NC(=CC=C1)CN Z875024662 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.172 COC1=NC(=CC=C1)CO Z969097688 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.172 COC1=NC(=CN=C1)CN Z2944291893 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.172 NCC1=NC(=CC=C1)CO Z2009833143 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.172 OCC1=CN=CC(=C1)CO Z1198341608 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.22 CC1=CC(=C(C(=C1)C)C)O Z147642480 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.22 CC1=CC(=NC(=C1N)C)C Z235348157 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.22 CC1=CC(=O)C(=C(N1)C)C Z2218555527 [1,1,0,0,0,0|1,0,1]=4 493 B10R1.22 CC1=NC(=C(C(=C1)Cl)C)Cl Z1198316718 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.22 CC1=NC(=C(C(=C1)N)N)C Z1203583402 [1,1,0,0,0,0|2,0,0]=4 495 B10R1.22 CC1=NC(=C(C(=C1)O)N)C Z1203581617 [1,1,0,0,0,0|2,0,0]=4 496 B10R1.22 CC1=NC(=C(C(=N1)C)C)Cl Z727721514 [1,1,0,0,0,0|2,0,0]=4 497 B10R1.22 CC1=NC(=C(C(=N1)C)C)O Z1262691682 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.118 CC1=C(N=C(C(=N1)Br)Br)C Z1269143934 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.118 CC1=C(N=C(C(=N1)Cl)Cl)C Z1198725897 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.118 CC1=CC(=C(C=C1Br)C)C Z1250002649 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.118 CC1=CC(=C(C=C1C)C)C Z104473710 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.118 CC1=NC(=C(C=C1Cl)N)C Z4897436475 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.118 CC1=NC(=C(N=C1C)C)C Z1741976694 [1,1,0,0,0,0|0,0,0]=2 504 B10R1.118 CC1=NC(=C(N=C1Cl)C)C Z1267672098 [1,1,0,0,0,0|0,0,0]=2 505 B10R1.118 CC1=NC(=C(N=C1N)C)C Z1203587263 [1,1,0,0,0,0|0,0,0]=2 506 B10R1.118 CC1=NC(=C(NC1=O)C)C Z1255391249 [1,1,0,0,0,0|0,0,1]=3 507 B10R1.119 CC1=C(C(=C(C=C1)C)O)C Z104479158 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.119 CC1=C(C(=C(N=C1)C)C)N Z2310717132 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.119 CC1=C(C(=C(N=C1)C)O)C Z4984123266 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.34 CCN1N=C(C(=C1C)Br)C Z959367760 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.34 CCN1N=C(C(=C1N)C)C Z904980660 [0,1,0,0,1,0|1,0,0]=3 512 B10R1.35 CCC1=NC(=C(N1)C=O)C Z2940229148 [0,1,0,0,1,0|0,0,2]=4 513 B10R1.35 CCC1=NC(=C(O1)CN)C Z2197092576 [0,1,0,0,1,0|1,0,0]=3 514 B10R1.35 CCC1=NC(=C(O1)CO)C Z1897843014 [0,1,0,0,1,0|1,0,0]=3 515 B10R1.35 CCC1=NC(=C(S1)Br)CO Z2751144304 [0,1,0,0,1,0|2,0,0]=4 516 B10R1.35 CCC1=NN(C(=C1)C=O)C Z1270331882 [0,1,0,0,1,0|1,0,1]=4 517 B10R1.35 CCN1C=C(C(=N1)C)C=O Z275174118 [0,1,0,0,1,0|1,0,1]=4 518 B10R1.35 CCN1C=C(C(=N1)OC)N Z2106609687 [0,1,0,0,1,0|2,0,0]=4 519 B10R1.35 CCN1N=C(C(=N1)C=O)C Z2217316195 [0,1,0,0,1,0|1,0,1]=4 520 B10R1.35 CCN1N=C(C(=N1)CN)C Z2378828634 [0,1,0,0,1,0|1,0,0]=3 521 B10R1.35 CCN1N=C(C(=N1)CO)C Z2235330340 [0,1,0,0,1,0|1,0,0]=3 522 B10R1.35 COC1=NN(C(=C1)CN)C Z5178507101 [0,1,0,0,1,0|2,0,0]=4 523 B10R1.58 CC(=O)C1=NN(C(=C1)C)C Z1255365884 [0,1,0,0,1,0|1,0,1]=4 524 B10R1.58 CC(C)C1=NN(C(=N1)N)C Z997587036 [0,1,0,0,1,0|2,0,0]=4 525 B10R1.58 CC1=CN(N=C1N)C(C)C Z995041874 [0,1,0,0,1,0|2,0,0]=4 526 B10R1.58 CC1=NN(C=C1N)C(C)C Z3380844931 [0,1,0,0,1,0|2,0,0]=4 527 B10R1.131 CC1=C(SC(=N1)CC#N)C Z48848938 [0,1,0,0,1,0|1,0,1]=4 528 B10R1.131 CC1=C(SC(=N1)CCN)C Z803066586 [0,1,0,0,1,0|1,0,0]=3 529 B10R1.131 CC1=CN(N=C1N)CCO Z1267773817 [0,1,0,0,1,0|2,0,0]=4 530 B10R1.131 CC1=NN(C=C1N)CCF Z2106611004 [0,1,0,0,1,0|2,0,0]=4 531 B10R1.131 CC1=NN(C=C1N)CCO Z5597631535 [0,1,0,0,1,0|2,0,0]=4 532 B10R1.131 CCCC1=NN(C(=C1)N)C Z385401460 [0,1,0,0,1,0|2,0,0]=4 533 B10R1.131 CSCC1=NN(C(=C1)C)C Z1446871754 [0,1,0,0,1,0|1,0,0]=3 534 B10R1.94 CC1=C(C=NN1C)CCN Z1198178790 [0,1,0,0,1,0|1,0,0]=3 535 B10R1.94 CC1=C(N(C=N1)CCN)C Z3247610126 [0,1,0,0,1,0|1,0,0]=3 536 B10R1.94 CC1=NN=C(N1C)CCN Z1824482726 [0,1,0,0,1,0|2,0,0]=4 537 B10R1.94 CCCC1=C(C(=NO1)N)C Z1201626676 [0,1,0,0,1,0|2,0,0]=4 538 B10R1.94 CCOC1=C(C(=NN1)C)Br Z277558226 [0,1,0,0,1,0|2,0,0]=4 539 B10R1.94 CCSC1=NN=C(N1C)C Z24308698 [0,1,0,0,1,0|2,0,0]=4 540 B10R1.94 CNCC1=C(N(N=C1)C)C Z1917295010 [0,1,0,0,1,0|1,0,0]=3 541 B10R1.94 CNCC1=NN=C(N1C)C Z426410632 [0,1,0,0,1,0|2,0,0]=4 542 B10R1.194 CC(=O)C1=C(N(N=C1)C)C Z235418366 [0,1,0,0,1,0|1,0,1]=4 543 B10R1.194 CC(C)C1=CN=C(N1C)S Z1250607798 [0,1,0,0,1,0|2,0,0]=4 544 B10R1.194 CC1=C(C=NN1C)C(C)N Z336085918 [0,1,0,0,1,0|1,0,0]=3 545 B10R1.256 CC1=NN(C(=C1CN)C)C Z275170236 [0,1,0,0,1,0|2,0,0]=4 546 B10R1.256 CC1=NN(C(=C1CO)C)C Z385370256 [0,1,0,0,1,0|2,0,0]=4 547 B10R1.256 CCN1C(=NC(=C1N)C)C Z5122363869 [0,1,0,0,1,0|2,0,0]=4 548 B10R1.257 CCC1=C(C(=NO1)C)C=O Z1511852808 [0,1,0,0,1,0|1,0,1]=4 549 B10R1.257 CCC1=C(C(=NO1)C)CO Z1725998736 [0,1,0,0,1,0|1,0,0]=3 550 B10R1.257 CCN1C(=CN=C1C)CN Z2310728090 [0,1,0,0,1,0|2,0,0]=4 551 B10R1.257 CCN1N=NC(=C1CO)C Z2235386824 [0,1,0,0,1,0|2,0,0]=4 552 B10R1.257 CSC1=C(N(N=C1)C)CN Z4548536299 [0,1,0,0,1,0|2,0,0]=4 553 B10R1.258 CCC1=NN=C(N1C)CO Z1206898637 [0,1,0,0,1,0|2,0,0]=4 554 B10R1.258 CCC1=NNC(=C1I)CC Z1269193463 [0,1,0,0,1,0|2,0,0]=4 555 B10R1.258 CSC1=NC=C(N1C)CO Z1270377736 [0,1,0,0,1,0|2,0,0]=4 556 B12R1.44 CSCC1=NC(=C(C(=O)N1)C)C Z995115580 [0,2,0,0,0,0|2,0,0]=4 557 B12R1.23 CC1=C(N=C(N=N1)S(=O)(=O)C)C Z2732616610 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.56 COC1=C(C=CC(=C1)C(C)C)C Z54854001 [0,2,0,0,0,0|2,0,0]=4 559 B12R1.232 CC1=NC(=C(N=C1C(=O)O)C)C Z1255460872 [0,2,0,0,0,0|1,0,1]=4 560 B12R1.232 CC1=NC(=C(N=C1C)N(C)C)C Z1198155418 [0,2,0,0,0,0|1,0,0]=3 561 B12R1.367 COC(=O)C1=NC(=C(N=C1)Cl)C Z1198649623 [0,2,0,0,0,0|1,0,1]=4 562 B12R1.367 COC(=O)C1=NC(=C(N=C1)N)C Z1813199913 [0,2,0,0,0,0|1,0,1]=4 563 B12R1.286 CCOC1=NC(=C(C=C1)N)OC Z3858525756 [0,2,0,0,0,0|2,0,0]=4 564 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [0,2,0,0,0,0|2,0,0]=4 565 B12R1.288 CCOC1=CC(=C(C=C1)CN)C Z5009842923 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.288 CNCC1=CC(=C(C=C1)OC)C Z1101435075 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.385 CC1=C(C=C(C=C1)SCCN)C Z56347318 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.385 CC1=C(C=C(C=C1)SCCO)C Z149235456 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.385 CC1=C(C=CC(=N1)NCCO)Br Z1652081916 [0,2,0,0,0,0|2,0,0]=4 570 B12R1.385 CCCCC1=NC(=C(C=C1)N)C Z1947958364 [0,2,0,0,0,0|2,0,0]=4 571 B12R1.385 CCCNC1=CC(=C(C=C1)C)C Z3179194889 [0,2,0,0,0,0|2,0,0]=4 572 B12R1.1123 CNCC1=C(C=C(C(=C1)C)C)C Z5470466430 [0,2,0,0,0,0|2,0,0]=4 573 B12R1.448 CCC1=C(N=C(C(=N1)Cl)Cl)CC Z1688642811 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.78 CCC1=C(N=C(N=N1)SC)CC Z1863743701 [0,2,0,0,0,0|2,0,0]=4 575 B12R1.78 COC1=NC(=C(C=C1)OC)CN Z5467393345 [0,2,0,0,0,0|2,0,0]=4 576 B12R1.452 CC(=O)C1=C(N=C(C=C1)CN)C Z1495452125 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.452 CC1=C(C=CC(=N1)CN)C(C)O Z1569709176 [0,2,0,0,0,0|2,0,0]=4 578 B12R1.452 CCC1=NC(=C(C=C1)C(=O)O)C Z1255381842 [0,2,0,0,0,0|1,0,1]=4 579 B12R1.452 COC1=NC(=C(C=C1)C(=O)C)C Z1255449232 [0,2,0,0,0,0|2,0,0]=4 580 B10R2.32 CC1=NNC2=C1CCC2 Z1198165737 [0,0,0,1,1,0|1,0,0]=3 581 B10R2.32 CN1N=CC2=C1CNC2 Z2235790781 [0,0,0,1,1,0|2,0,0]=4 582 B10R2.32 NC1=NC=C2N1CCC2 Z1203653058 [0,0,0,1,1,0|2,0,0]=4 583 B10R2.32 SC1=NC=C2N1CCC2 Z3490723931 [0,0,0,1,1,0|2,0,0]=4 584 B12R2.291 CC1=C(C=C(C=C1)C2CO2)C Z285186472 [0,1,0,1,0,0|2,0,0]=4 585 B12R2.82 CC1=C(C2=C(C=N1)COC2)O Z1216824433 [0,1,0,1,0,0|2,0,0]=4 586 B12R2.100 CC1=C(C=C2NCCC2=C1)C Z1203734724 [0,1,0,1,0,0|2,0,0]=4 587 B12R2.44 CCC1=CC2=C(C=C1)NCC2 Z1270207865 [0,1,0,1,0,0|2,0,0]=4 588 B12R2.44 COC1=NC2=C(C=C1)CCN2 Z1255390060 [0,1,0,1,0,0|2,0,0]=4 589 B8R1.1 CC1=CC(=NO1)CCl Z90122430 [1,0,0,0,1,0|2,0,0]=4 590 B8R1.1 CC1=CN=C(O1)CN Z1198236438 [1,0,0,0,1,0|2,0,0]=4 591 B8R1.1 CC1=CN=C(O1)CO Z1198313418 [1,0,0,0,1,0|2,0,0]=4 592 B8R1.1 CC1=CN=C(S1)CN Z994267440 [1,0,0,0,1,0|2,0,0]=4 593 B8R1.1 CC1=CNC(=N1)CO Z3015789123 [1,0,0,0,1,0|1,0,1]=4 594 B8R1.1 CC1=CSC(=C1)CN Z2235810231 [1,0,0,0,1,0|2,0,0]=4 595 B8R1.1 CC1=CSC(=N1)CO Z1037609598 [1,0,0,0,1,0|2,0,0]=4 596 B8R1.1 CC1=NC(=CS1)CCl Z56943451 [1,0,0,0,1,0|2,0,0]=4 597 B8R1.1 CC1=NC(=CS1)CN Z54749838 [1,0,0,0,1,0|2,0,0]=4 598 B8R1.1 CC1=NC(=NN1)CN Z2895197976 [1,0,0,0,1,0|2,0,0]=4 599 B8R1.1 CC1=NC(=NN1)CO Z1431002733 [1,0,0,0,1,0|2,0,0]=4 600 B8R1.1 CC1=NC(=NO1)CN Z1357774192 [1,0,0,0,1,0|2,0,0]=4 601 B8R1.1 CC1=NC(=NO1)CO Z431951982 [1,0,0,0,1,0|2,0,0]=4 602 B8R1.1 CC1=NC=C(S1)CO Z608610310 [1,0,0,0,1,0|2,0,0]=4 603 B8R1.1 CC1=NOC(=C1)CCl Z119990894 [1,0,0,0,1,0|2,0,0]=4 604 B8R1.1 CC1=NOC(=C1)CO Z431951966 [1,0,0,0,1,0|2,0,0]=4 605 B8R1.1 CC1=NOC(=N1)CN Z802671508 [1,0,0,0,1,0|2,0,0]=4 606 B8R1.1 CC1=NOC(=N1)CO Z431951984 [1,0,0,0,1,0|2,0,0]=4 607 B8R1.1 CCC1=CC(=CS1)Br Z1255374735 [1,0,0,0,1,0|2,0,0]=4 608 B8R1.1 CCC1=CC(=NN1)O Z1198163105 [1,0,0,0,1,0|2,0,0]=4 609 B8R1.1 CCC1=CN=C(O1)N Z994289172 [1,0,0,0,1,0|2,0,0]=4 610 B8R1.1 CCC1=CN=C(S1)N Z851799002 [1,0,0,0,1,0|2,0,0]=4 611 B8R1.1 CCC1=CSC(=N1)Cl Z1037582854 [1,0,0,0,1,0|2,0,0]=4 612 B8R1.1 CCC1=CSC(=N1)N Z1263824431 [1,0,0,0,1,0|2,0,0]=4 613 B8R1.1 CCC1=NC(=NS1)N Z1203581808 [1,0,0,0,1,0|2,0,0]=4 614 B8R1.1 CCC1=NNC(=C1)N Z360168062 [1,0,0,0,1,0|2,0,0]=4 615 B8R1.1 CCC1=NNC(=N1)C Z1271843082 [1,0,0,0,1,0|1,0,0]=3 616 B8R1.1 CCC1=NNC(=N1)N Z1431904363 [1,0,0,0,1,0|2,0,0]=4 617 B8R1.1 CCC1=NNC(=N1)S Z55982179 [1,0,0,0,1,0|2,0,0]=4 618 B8R1.1 CCC1=NOC(=C1)N Z360168622 [1,0,0,0,1,0|2,0,0]=4 619 B8R1.1 CCC1=NOC(=N1)N Z991477732 [1,0,0,0,1,0|2,0,0]=4 620 B8R1.1 CCN1C=C(C=N1)O Z1165304366 [1,0,0,0,1,0|2,0,0]=4 621 B8R1.1 CCN1C=CC(=N1)C Z2696515582 [1,0,0,0,1,0|2,0,0]=4 622 B8R1.1 CCN1C=NC(=C1)N Z2313530831 [1,0,0,0,1,0|2,0,0]=4 623 B8R1.1 CCN1C=NC(=N1)N Z600615070 [1,0,0,0,1,0|2,0,0]=4 624 B8R1.1 CCN1N=CC(=N1)N Z3244908712 [1,0,0,0,1,0|2,0,0]=4 625 B8R1.1 CN1C=C(C=N1)CN Z317041916 [1,0,0,0,1,0|2,0,0]=4 626 B8R1.1 CN1C=C(C=N1)CO Z198954582 [1,0,0,0,1,0|2,0,0]=4 627 B8R1.1 CN1C=NC(=C1)CO Z1137167436 [1,0,0,0,1,0|2,0,0]=4 628 B8R1.1 CN1N=CC(=N1)CN Z1203652613 [1,0,0,0,1,0|2,0,0]=4 629 B8R1.1 CN1N=CC(=N1)CO Z1896980083 [1,0,0,0,1,0|2,0,0]=4 630 B8R1.1 CNC1=CN(N=C1)C Z1255523371 [1,0,0,0,1,0|2,0,0]=4 631 B8R1.1 CNC1=NC(=CS1)C Z48860943 [1,0,0,0,1,0|2,0,0]=4 632 B8R1.1 CNC1=NC(=NS1)C Z1203731956 [1,0,0,0,1,0|2,0,0]=4 633 B8R1.1 CNC1=NC=C(S1)C Z3333486563 [1,0,0,0,1,0|2,0,0]=4 634 B8R1.1 CNC1=NOC(=C1)C Z3069017324 [1,0,0,0,1,0|2,0,0]=4 635 B8R1.1 COC1=CC(=NN1)C Z1813157463 [1,0,0,0,1,0|2,0,0]=4 636 B8R1.1 CSC1=NC(=NN1)C Z3223608753 [1,0,0,0,1,0|2,0,0]=4 637 B8R1.11 CC1=C(C=NN1)CN Z1837077131 [1,0,0,0,1,0|2,0,0]=4 638 B8R1.11 CC1=C(C=NN1)CO Z1198107480 [1,0,0,0,1,0|2,0,0]=4 639 B8R1.11 CC1=C(C=NO1)CN Z2895200737 [1,0,0,0,1,0|2,0,0]=4 640 B8R1.11 CC1=C(NN=C1)CN Z2865543087 [1,0,0,0,1,0|2,0,0]=4 641 B8R1.11 CC1=COC=C1CN Z5616265876 [1,0,0,0,1,0|2,0,0]=4 642 B8R1.11 CC1=CSC=C1CN Z1345189827 [1,0,0,0,1,0|2,0,0]=4 643 B8R1.11 CCC1=CSC=C1N Z4935394961 [1,0,0,0,1,0|2,0,0]=4 644 B8R1.11 CCC1=NN=CN1C Z992282430 [1,0,0,0,1,0|2,0,0]=4 645 B8R1.11 CCN1C=NN=C1C Z992282678 [1,0,0,0,1,0|2,0,0]=4 646 B8R1.11 CN1C=NC=C1CN Z1198266141 [1,0,0,0,1,0|2,0,0]=4 647 B8R1.11 CN1C=NC=C1CO Z1115775402 [1,0,0,0,1,0|2,0,0]=4 648 B8R1.18 CC1=C(NC(=N1)N)C Z2418413556 [1,0,0,0,1,0|1,0,1]=4 649 B8R1.18 CC1=C(NC(=N1)S)C Z1198163261 [1,0,0,0,1,0|1,0,1]=4 650 B8R1.18 CC1=C(OC(=N1)N)C Z85932429 [1,0,0,0,1,0|2,0,0]=4 651 B8R1.18 CC1=C(OC(=N1)S)C Z234904536 [1,0,0,0,1,0|2,0,0]=4 652 B8R1.18 CC1=C(SC(=N1)Cl)C Z1037582644 [1,0,0,0,1,0|2,0,0]=4 653 B8R1.18 CC1=C(SC(=N1)N)C Z48847528 [1,0,0,0,1,0|2,0,0]=4 654 B8R1.18 CC1=C(SC(=N1)S)C Z1198148053 [1,0,0,0,1,0|2,0,0]=4 655 B8R1.18 CC1=CC(=C(S1)Br)C Z1255397918 [1,0,0,0,1,0|2,0,0]=4 656 B8R1.18 CC1=CC(=C(S1)C)Br Z1198655269 [1,0,0,0,1,0|2,0,0]=4 657 B8R1.18 CC1=CC(=C(S1)C)I Z1347205942 [1,0,0,0,1,0|2,0,0]=4 658 B8R1.18 CC1=CC(=C(S1)C)N Z3013884071 [1,0,0,0,1,0|2,0,0]=4 659 B8R1.18 CC1=CC(=NN1C)C Z1201023055 [1,0,0,0,1,0|1,0,0]=3 660 B8R1.18 CC1=CC(=NN1C)N Z995041200 [1,0,0,0,1,0|2,0,0]=4 661 B8R1.18 CC1=NC(=C(N1)C)C Z2785909774 [1,0,0,0,1,0|0,0,1]=3 662 B8R1.18 CC1=NC(=C(S1)N)C Z951281412 [1,0,0,0,1,0|2,0,0]=4 663 B8R1.18 CC1=NC(=NN1C)N Z1198175662 [1,0,0,0,1,0|2,0,0]=4 664 B8R1.18 CC1=NN(C(=C1)N)C Z55423092 [1,0,0,0,1,0|2,0,0]=4 665 B8R1.18 CC1=NN(C(=N1)N)C Z56757682 [1,0,0,0,1,0|2,0,0]=4 666 B8R1.18 CC1=NN(C=C1Br)C Z2235790808 [1,0,0,0,1,0|2,0,0]=4 667 B8R1.18 CC1=NN(C=C1N)C Z1742055027 [1,0,0,0,1,0|2,0,0]=4 668 B8R1.18 CC1=NN(C=C1O)C Z4131782830 [1,0,0,0,1,0|2,0,0]=4 669 B8R1.50 CC1=C(C(=NO1)N)C Z1198162059 [1,0,0,0,1,0|2,0,0]=4 670 B8R1.50 CC1=C(C=NN1C)Br Z1198224382 [1,0,0,0,1,0|2,0,0]=4 671 B8R1.50 CC1=C(C=NN1C)I Z1269221703 [1,0,0,0,1,0|2,0,0]=4 672 B8R1.50 CC1=C(C=NN1C)N Z235263805 [1,0,0,0,1,0|2,0,0]=4 673 B8R1.50 CC1=C(N(C=N1)C)N Z951327034 [1,0,0,0,1,0|2,0,0]=4 674 B8R1.50 CC1=C(N(N=C1)C)N Z2106610991 [1,0,0,0,1,0|2,0,0]=4 675 B8R1.50 CC1=CNC(=C1C)C Z1162450215 [1,0,0,0,1,0|0,0,1]=3 676 B8R1.50 CC1=NC=C(N1C)Br Z1201623659 [1,0,0,0,1,0|2,0,0]=4 677 B8R1.50 CC1=NC=C(N1C)N Z2310678658 [1,0,0,0,1,0|2,0,0]=4 678 B8R1.50 CC1=NNC(=C1Br)C Z275169976 [1,0,0,0,1,0|2,0,0]=4 679 B8R1.50 CC1=NNC(=C1C)C Z50145985 [1,0,0,0,1,0|1,0,0]=3 680 B8R1.50 CC1=NNC(=C1C)N Z385386488 [1,0,0,0,1,0|2,0,0]=4 681 B8R1.50 CC1=NNC(=C1Cl)C Z3020185376 [1,0,0,0,1,0|2,0,0]=4 682 B8R1.50 CC1=NNC(=C1N)C Z56761496 [1,0,0,0,1,0|2,0,0]=4 683 B8R1.50 CC1=NNC(=C1O)C Z1255485863 [1,0,0,0,1,0|2,0,0]=4 684 B8R1.50 CC1=NOC(=C1Br)C Z372796498 [1,0,0,0,1,0|2,0,0]=4 685 B8R1.50 CC1=NSC(=C1I)C Z1783198803 [1,0,0,0,1,0|2,0,0]=4