0 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 M52180 [0,0,0,0,0,0|1,0,3]=4 1 B11R1.12 COC(OC)C1=CC=CC=C1 B69843 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 M50282 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 B64382 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [1,0,0,0,0,0|0,0,1]=2 5 B10R1.15 C=C[S@](=O)C1=CC=CC=C1 V62500 [1,0,0,0,0,0|1,0,1]=3 6 B10R1.15 CCC(=O)C1=CN=CC=C1 P49262 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.15 CCC(=O)C1=NC=CC=N1 P61892 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.15 CCC(=O)C1=NC=CN=C1 P14589 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 P39004 [1,0,0,0,0,0|1,0,2]=4 10 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M50312 [1,0,0,0,0,0|1,0,2]=4 11 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M52164 [1,0,0,0,0,0|1,0,2]=4 12 B10R1.15 COC(=O)C1=CC=NC=C1 M64933 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.15 COC(=O)C1=CN=CN=C1 M10227 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.15 COC(=O)C1=CN=NC=C1 M12256 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.15 COC(=O)C1=NC=CC=C1 M28469 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.15 COC(=O)C1=NC=CC=N1 M3445 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.15 COC(=O)C1=NC=CN=C1 M2717 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.15 COC(=O)C1=NC=NC=C1 P0159 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.15 COC(=O)C1=NN=CC=C1 M0217 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.15 CO[S@@](=O)C1=CC=CC=C1 M46243 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P37912 [1,0,0,0,0,0|1,0,2]=4 22 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P39584 [1,0,0,0,0,0|1,0,2]=4 23 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P60945 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 P10845 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.15 C\C(=N\O)C1=NC=CC=C1 M66365 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.15 NNC(=O)C1=NC=CC=C1 P43090 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.15 O=C(CBr)C1=CN=CC=C1 B68250 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.15 O=C(CBr)C1=NC=CC=C1 B45477 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.15 O=C(CCl)C1=CN=CC=C1 C45489 [1,0,0,0,0,0|2,0,1]=4 31 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [1,0,0,0,0,0|1,0,1]=3 32 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [1,0,0,0,0,0|1,0,0]=2 33 B12R1.478 CC[C@@H](C(=O)Cl)C1=CC=CC=C1 P52669 [0,1,0,0,0,0|0,0,2]=3 34 B12R1.478 CO[C@@H](C(=O)O)C1=CC=CC=C1 M68323 [0,1,0,0,0,0|1,0,1]=3 35 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 M49926 [0,1,0,0,0,0|1,0,1]=3 36 B12R1.478 N#C[C@@H](C(N)=O)C1=CC=CC=C1 C51349 [0,1,0,0,0,0|1,0,2]=4 37 B12R2.1 COC1=NNC2=C1C=CC=C2 M15069 [0,0,0,1,0,0|3,0,0]=4 38 B12R2.1 ClCC1=COC2=C1C=CC=C2 C51318 [0,0,0,1,0,0|1,0,2]=4 39 B12R2.1 N#CC1=CSC2=C1C=CC=C2 B50761 [0,0,0,1,0,0|1,1,1]=4 40 B12R2.1 NCC1=CNC2=C1C=CC=C2 K22443 [0,0,0,1,0,0|2,0,1]=4 41 B12R2.1 O=CC1=C2C=CC=CN2C=C1 K61492 [0,0,0,1,0,0|1,0,1]=3 42 B12R2.1 O=CC1=C2C=CC=CN2C=N1 K47871 [0,0,0,1,0,0|2,0,1]=4 43 B12R2.1 O=CC1=CN=C2C=CC=CN12 I3368 [0,0,0,1,0,0|2,0,0]=3 44 B12R2.1 O=CC1=CN=C2N=CC=CN12 K61863 [0,0,0,1,0,0|3,0,0]=4 45 B12R2.1 O=CC1=CNC2=C1C=CC=N2 P0802 [0,0,0,1,0,0|2,0,0]=3 46 B12R2.1 O=CC1=CNC2=C1C=CN=C2 P47872 [0,0,0,1,0,0|2,0,0]=3 47 B12R2.1 O=CC1=CNC2=C1C=NC=C2 P26608 [0,0,0,1,0,0|2,0,0]=3 48 B12R2.1 O=CC1=CNC2=C1C=NC=N2 P13850 [0,0,0,1,0,0|3,0,0]=4 49 B12R2.1 O=CC1=CNC2=CC=CN=C12 P22788 [0,0,0,1,0,0|2,0,0]=3 50 B12R2.1 O=CC1=CNC2=NC=CN=C12 P10335 [0,0,0,1,0,0|3,0,0]=4 51 B12R2.1 O=CC1=COC2=C1C=CC=C2 B23789 [0,0,0,1,0,0|1,0,0]=2 52 B12R2.1 O=CC1=CSC2=C1C=CC=C2 B67477 [0,0,0,1,0,0|1,0,0]=2 53 B12R2.1 O=CC1=NC=C2C=CC=CN21 K61874 [0,0,0,1,0,0|2,0,1]=4 54 B12R2.1 O=CC1=NNC2=C1C=CC=C2 K9332 [0,0,0,1,0,0|2,0,0]=3 55 B12R2.1 O=CC1=NNC2=C1C=CC=N2 P10434 [0,0,0,1,0,0|3,0,0]=4 56 B12R2.1 OCC1=CNC2=C1C=CC=C2 I4626 [0,0,0,1,0,0|1,0,2]=4 57 B12R2.2 C1=CC(C2=CSC=C2)=CC=N1 T51247 [0,0,0,1,0,0|1,1,1]=4 58 B12R2.2 C1=CC=C(C2=CC=CN2)C=C1 P38157 [0,0,0,1,0,0|2,0,1]=4 59 B12R2.2 C1=CC=C(C2=CC=CS2)C=C1 P53834 [0,0,0,1,0,0|2,0,1]=4 60 B12R2.2 C1=CC=C(C2=CC=NN2)C=C1 P22610 [0,0,0,1,0,0|2,0,1]=4 61 B12R2.2 C1=CC=C(C2=CN=CO2)C=C1 P68097 [0,0,0,1,0,0|2,0,1]=4 62 B12R2.2 C1=CC=C(C2=CN=CS2)C=C1 P51246 [0,0,0,1,0,0|2,0,1]=4 63 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 P68881 [0,0,0,1,0,0|2,0,1]=4 64 B12R2.2 C1=CC=C(C2=CNN=C2)C=C1 P16046 [0,0,0,1,0,0|2,0,0]=3 65 B12R2.2 C1=CC=C(C2=COC=N2)C=C1 P51158 [0,0,0,1,0,0|1,0,2]=4 66 B12R2.2 C1=CC=C(N2C=CN=C2)C=C1 P67670 [0,0,0,1,0,0|2,0,1]=4 67 B12R2.2 C1=CC=C(N2C=NN=C2)C=C1 P48388 [0,0,0,1,0,0|3,0,0]=4 68 B12R2.23 O=C1CC[C@@H]1C2=CC=CC=C2 P13262 [0,0,0,1,0,0|0,0,2]=3 69 B9R1.6 CC(=O)C1=CN=CN=C1 A7446 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.6 CC(=O)C1=CN=NC=C1 A10222 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.6 CC(=O)C1=NC=CC=N1 A8017 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.6 CC(=O)C1=NC=NC=C1 A12246 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [2,0,0,0,0,0|2,0,0]=4 75 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [2,0,0,0,0,0|1,0,1]=4 76 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [2,0,0,0,0,0|0,0,2]=4 77 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [2,0,0,0,0,0|1,0,1]=4 78 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [2,0,0,0,0,0|1,0,1]=4 79 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [2,0,0,0,0,0|0,0,2]=4 80 B9R1.6 C[S@](=O)C1=CC=CC=C1 M61814 [2,0,0,0,0,0|1,0,0]=3 81 B9R1.6 C[S@](=O)C1=NC=CC=C1 M43172 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.6 N=C(N)C1=CC=CC=C1 B39428 [2,0,0,0,0,0|2,0,0]=4 83 B9R1.6 NC(=O)C1=CC=CC=C1 B69845 [2,0,0,0,0,0|1,0,0]=3 84 B9R1.6 NC(=O)C1=NC=CC=C1 P60877 [2,0,0,0,0,0|2,0,0]=4 85 B9R1.6 O=C(Cl)C1=CC=NC=C1 N39246 [2,0,0,0,0,0|2,0,0]=4 86 B9R1.6 O=C(Cl)C1=NC=CC=C1 P42299 [2,0,0,0,0,0|2,0,0]=4 87 B9R1.6 O=C(O)C1=NC=CC=C1 P62145 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.6 O=[S@]([O-])C1=CC=CC=C1 S68689 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.8 CC#CC1=CC=CC=C1 P68608 [2,0,0,0,0,0|0,0,2]=4 90 B9R1.8 CNNC1=CC=CC=C1 M46459 [2,0,0,0,0,0|2,0,0]=4 91 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [2,0,0,0,0,0|0,0,0]=2 92 B9R1.8 O=COC1=CC=CC=C1 P45508 [2,0,0,0,0,0|1,0,0]=3 93 B9R1.8 O\N=C\C1=CC=CC=C1 B61148 [2,0,0,0,0,0|1,0,1]=4 94 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 V37846 [1,1,0,0,0,0|1,0,1]=4 95 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 M46268 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P68339 [1,1,0,0,0,0|0,0,0]=2 97 B11R1.16 CCCC(=O)C1=CN=CC=C1 P50020 [1,1,0,0,0,0|1,0,1]=4 98 B11R1.16 CCCC(=O)C1=NC=CC=C1 B50017 [1,1,0,0,0,0|1,0,1]=4 99 B11R1.16 CCOC(=O)C1=CC=NC=C1 E69401 [1,1,0,0,0,0|1,0,1]=4 100 B11R1.16 CCOC(=O)C1=CN=CC=C1 E68695 [1,1,0,0,0,0|1,0,1]=4 101 B11R1.16 CCOC(=O)C1=NC=CC=C1 E67964 [1,1,0,0,0,0|1,0,1]=4 102 B11R1.16 CCO[P@@H](=O)C1=CC=CC=C1 E46942 [1,1,0,0,0,0|1,0,1]=4 103 B11R1.16 N#CCC(=O)C1=CC=CC=C1 X67635 [1,1,0,0,0,0|0,0,2]=4 104 B11R1.16 O=C(OCCl)C1=CC=CC=C1 C48587 [1,1,0,0,0,0|1,0,0]=3 105 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 X51560 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 B52024 [1,1,0,0,0,0|1,0,1]=4 107 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [1,1,0,0,0,0|1,0,1]=4 108 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 T46647 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 B16168 [1,1,0,0,0,0|0,0,1]=3 110 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [1,1,0,0,0,0|0,0,1]=3 111 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 K52052 [1,1,0,0,0,0|0,0,1]=3 112 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 B49023 [1,1,0,0,0,0|1,0,0]=3 113 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 K63815 [1,1,0,0,0,0|1,0,0]=3 114 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 A69158 [1,1,0,0,0,0|1,0,0]=3 115 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 C45698 [1,1,0,0,0,0|2,0,0]=4 116 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 B60995 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 M39489 [1,1,0,0,0,0|1,0,0]=3 118 B11R1.22 COC(=O)C1=CC=C(C)C=C1 M60598 [1,1,0,0,0,0|1,0,0]=3 119 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 M64818 [1,1,0,0,0,0|1,0,0]=3 120 B11R1.22 COC(=O)C1=CC=C(F)C=C1 M67923 [1,1,0,0,0,0|1,0,0]=3 121 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 M0015 [1,1,0,0,0,0|2,0,0]=4 122 B11R1.22 COC(=O)C1=CN=C(C)C=C1 M13760 [1,1,0,0,0,0|2,0,0]=4 123 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 M39382 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.22 COC(=O)C1=CN=C(F)C=C1 M4740 [1,1,0,0,0,0|2,0,0]=4 125 B11R1.22 COC(=O)C1=CNC(=O)C=C1 M7692 [1,1,0,0,0,0|2,0,0]=4 126 B11R1.22 COC(=O)C1=COC(=O)C=C1 M38530 [1,1,0,0,0,0|2,0,0]=4 127 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 M10296 [1,1,0,0,0,0|2,0,0]=4 128 B11R1.22 COC(=O)C1=NC=C(C)C=C1 M22900 [1,1,0,0,0,0|2,0,0]=4 129 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 M45366 [1,1,0,0,0,0|2,0,0]=4 130 B11R1.22 COC(=O)C1=NC=C(F)C=C1 M16415 [1,1,0,0,0,0|2,0,0]=4 131 B11R1.22 COC(=O)C1=NC=C(I)C=C1 M45392 [1,1,0,0,0,0|2,0,0]=4 132 B11R1.22 COC(=O)C1=NC=C(N)C=C1 M0251 [1,1,0,0,0,0|2,0,0]=4 133 B11R1.22 COC(=O)C1=NC=C(O)C=C1 M7706 [1,1,0,0,0,0|2,0,0]=4 134 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 C67180 [1,1,0,0,0,0|1,0,1]=4 135 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 B49032 [1,1,0,0,0,0|1,0,1]=4 136 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 A49045 [1,1,0,0,0,0|1,0,1]=4 137 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 A49617 [1,1,0,0,0,0|1,0,1]=4 138 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 C45695 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 F45705 [1,1,0,0,0,0|2,0,0]=4 140 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 B48246 [1,1,0,0,0,0|1,0,1]=4 141 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 C69024 [1,1,0,0,0,0|1,0,1]=4 142 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 B47769 [1,1,0,0,0,0|1,0,0]=3 143 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 C47781 [1,1,0,0,0,0|1,0,0]=3 144 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [1,1,0,0,0,0|1,0,1]=4 145 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 M46653 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 H49893 [1,1,0,0,0,0|0,0,1]=3 147 B11R1.23 CCC(=O)C1=CC=CC(Br)=N1 B61988 [1,1,0,0,0,0|1,0,1]=4 148 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F38669 [1,1,0,0,0,0|0,0,1]=3 149 B11R1.23 CCC(=O)C1=NC=CC(Cl)=C1 C49039 [1,1,0,0,0,0|1,0,1]=4 150 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 B69408 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45697 [1,1,0,0,0,0|2,0,0]=4 152 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45702 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.23 COC(=O)C1=CC(=O)C=CN1 M45849 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.23 COC(=O)C1=CC(=O)NC=C1 M1682 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 M12724 [1,1,0,0,0,0|2,0,0]=4 156 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 M22704 [1,1,0,0,0,0|2,0,0]=4 157 B11R1.23 COC(=O)C1=CC(C)=NC=C1 M67329 [1,1,0,0,0,0|2,0,0]=4 158 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 M60826 [1,1,0,0,0,0|2,0,0]=4 159 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 M0407 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.23 COC(=O)C1=CC(F)=CN=C1 M0721 [1,1,0,0,0,0|2,0,0]=4 161 B11R1.23 COC(=O)C1=CC(F)=NC=C1 M23752 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.23 COC(=O)C1=CC(N)=CC=C1 M69084 [1,1,0,0,0,0|1,0,0]=3 163 B11R1.23 COC(=O)C1=CC(N)=NC=C1 M4534 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.23 COC(=O)C1=CC(O)=CC=C1 M37841 [1,1,0,0,0,0|1,0,0]=3 165 B11R1.23 COC(=O)C1=CC=CC(=O)N1 M38198 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 M48565 [1,1,0,0,0,0|1,0,0]=3 167 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 M22709 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 M22864 [1,1,0,0,0,0|1,0,0]=3 169 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 M24789 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.23 COC(=O)C1=CC=CC(F)=C1 M39493 [1,1,0,0,0,0|1,0,0]=3 171 B11R1.23 COC(=O)C1=CC=CC(F)=N1 M23753 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.23 COC(=O)C1=CC=CC(I)=C1 M48629 [1,1,0,0,0,0|1,0,0]=3 173 B11R1.23 COC(=O)C1=CN=CC(C)=C1 M12907 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.23 COC(=O)C1=CN=CC(N)=C1 M14137 [1,1,0,0,0,0|2,0,0]=4 175 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M61635 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M9186 [1,1,0,0,0,0|2,0,0]=4 177 B11R1.23 COC(=O)C1=NC(C)=CC=C1 M49292 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.23 COC(=O)C1=NC(N)=CC=C1 M8927 [1,1,0,0,0,0|2,0,0]=4 179 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 M1665 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M49276 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M0974 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M7541 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.23 COC(=O)C1=NC=CC(I)=C1 M1513 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M0975 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 B45685 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 C45694 [1,1,0,0,0,0|2,0,0]=4 187 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 B48248 [1,1,0,0,0,0|1,0,1]=4 188 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 B48255 [1,1,0,0,0,0|1,0,1]=4 189 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 B68743 [1,1,0,0,0,0|1,0,1]=4 190 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 B68490 [1,1,0,0,0,0|1,0,1]=4 191 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 F63112 [1,1,0,0,0,0|1,0,0]=3 192 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A51548 [1,1,0,0,0,0|0,0,0]=2 193 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 P69231 [1,1,0,0,0,0|0,0,0]=2 194 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 B39601 [1,1,0,0,0,0|0,0,1]=3 195 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 P49885 [1,1,0,0,0,0|0,0,1]=3 196 B11R1.36 C[C@H](Br)C(=O)C1=CC=CC=C1 B52026 [1,1,0,0,0,0|0,0,1]=3 197 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 P36930 [1,1,0,0,0,0|0,0,1]=3 198 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 A69457 [1,1,0,0,0,0|1,0,1]=4 199 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 A69199 [1,1,0,0,0,0|1,0,1]=4 200 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 A68336 [1,1,0,0,0,0|1,0,1]=4 201 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 A69083 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.36 O=C(C1=CC=CC=C1)C(F)F D63183 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M64934 [1,1,0,0,0,0|1,0,1]=4 204 B11R1.36 O=C(O)[C@H](Cl)C1=CC=CC=C1 C48589 [1,1,0,0,0,0|1,0,1]=4 205 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 M52778 [1,1,0,0,0,0|0,0,1]=3 206 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 C52038 [1,1,0,0,0,0|0,0,1]=3 207 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 H39530 [1,1,0,0,0,0|0,0,1]=3 208 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 B49022 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 A67666 [1,1,0,0,0,0|1,0,0]=3 210 B11R1.222 CNC(=O)C1=C(N)C=CN=C1 A46341 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.222 CNC(=O)C1=C(N)N=CC=C1 A46340 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 M64518 [1,1,0,0,0,0|1,0,0]=3 213 B11R1.222 CNC(=O)C1=NC=CC=C1O H46003 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 M39488 [1,1,0,0,0,0|1,0,0]=3 215 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 M14100 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 M12636 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.222 COC(=O)C1=C(C)C=CC=C1 M39531 [1,1,0,0,0,0|1,0,0]=3 218 B11R1.222 COC(=O)C1=C(C)C=CN=C1 M38020 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.222 COC(=O)C1=C(C)C=NC=C1 M11262 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.222 COC(=O)C1=C(C)N=CC=C1 M11023 [1,1,0,0,0,0|2,0,0]=4 221 B11R1.222 COC(=O)C1=C(Cl)C=CC=N1 M45351 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 M45369 [1,1,0,0,0,0|2,0,0]=4 223 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 M45356 [1,1,0,0,0,0|2,0,0]=4 224 B11R1.222 COC(=O)C1=C(F)C=CC=C1 M69073 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.222 COC(=O)C1=C(F)C=CC=N1 M25907 [1,1,0,0,0,0|2,0,0]=4 226 B11R1.222 COC(=O)C1=C(F)C=NC=C1 M1911 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.222 COC(=O)C1=C(I)C=CC=C1 M67835 [1,1,0,0,0,0|1,0,0]=3 228 B11R1.222 COC(=O)C1=C(I)C=CC=N1 M45391 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.222 COC(=O)C1=C(I)C=NC=C1 M10415 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.222 COC(=O)C1=C(N)C=CN=C1 A1097 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.222 COC(=O)C1=C(N)C=NC=C1 M0549 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.222 COC(=O)C1=C(N)N=CC=C1 M27310 [1,1,0,0,0,0|2,0,0]=4 233 B11R1.222 COC(=O)C1=C(O)C=NC=C1 M15996 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.222 COC(=O)C1=C(O)N=CC=C1 M38592 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.222 COC(=O)C1=C(S)C=CC=C1 M69035 [1,1,0,0,0,0|1,0,0]=3 236 B11R1.222 COC(=O)C1=CC=CN=C1Br M24089 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.222 COC(=O)C1=CC=CN=C1Cl M0433 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.222 COC(=O)C1=CC=CN=C1F M45374 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.222 COC(=O)C1=CC=CNC1=O M45848 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.222 COC(=O)C1=CNC=CC1=O M36878 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.222 COC(=O)C1=NC=CC=C1C M24449 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.222 COC(=O)C1=NC=CC=C1N M23281 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.222 N#CC(=O)C1=C(F)C=CC=C1 F47445 [1,1,0,0,0,0|1,0,1]=4 244 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 A69482 [1,1,0,0,0,0|1,0,1]=4 245 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 C45693 [1,1,0,0,0,0|2,0,0]=4 246 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 F45704 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 B60597 [1,1,0,0,0,0|1,0,1]=4 248 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 B48254 [1,1,0,0,0,0|1,0,1]=4 249 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 B48582 [1,1,0,0,0,0|1,0,1]=4 250 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 F48290 [1,1,0,0,0,0|1,0,1]=4 251 B13R1.418 CN[C@@H](CC1=CC=CC=C1)C(=O)O M37956 [0,1,0,0,0,1|1,0,1]=4 252 B13R1.706 CC[C@@H](C(=O)O)C1=CC=C(Br)C=C1 B52613 [0,2,0,0,0,0|0,0,2]=4 253 B13R1.706 CC[C@@H](C(=O)O)C1=CC=C(N)C=C1 A52945 [0,2,0,0,0,0|0,0,2]=4 254 B13R1.3085 CC[C@](N)(C(=O)O)C1=CC=CC=C1 A52942 [0,2,0,0,0,0|0,0,2]=4 255 B13R1.1111 CC(C)[C@@H](C(=O)O)C1=CC=CC=C1 A54773 [0,2,0,0,0,0|0,0,2]=4 256 B13R1.1111 CC(C)[C@@H](C(=O)O)C1=CC=CC=C1 M54776 [0,2,0,0,0,0|0,0,2]=4 257 B13R1.1111 CC(C)[C@H](C(=O)O)C1=CC=CC=C1 M54777 [0,2,0,0,0,0|0,0,2]=4 258 B11R1.265 COC1=C(C=O)C(C)=CC=C1 M24211 [0,0,1,1,0,0|1,0,1]=4 259 B11R1.72 CC1=C(F)C=CC(F)=C1C=O D48289 [0,0,1,1,0,0|2,0,0]=4 260 B11R1.267 O=CC1=CC=CC(C=O)=C1Br B47763 [0,0,1,1,0,0|2,0,0]=4 261 B11R1.267 O=CC1=CC=CC(C=O)=C1O H48208 [0,0,1,1,0,0|2,0,0]=4 262 B11R2.1 BrC1=COC2=C1C=CC=C2 B47829 [1,0,0,1,0,0|1,0,1]=4 263 B11R2.1 BrC1=CSC2=C1C=CC=C2 B47535 [1,0,0,1,0,0|1,1,0]=4 264 B11R2.1 CC1=CCC2=C1C=CC=C2 M52270 [1,0,0,1,0,0|0,0,1]=3 265 B11R2.1 CC1=CN=C2C=CC=CN12 M0025 [1,0,0,1,0,0|2,0,0]=4 266 B11R2.1 CC1=CNC2=C1C=CC=C2 M13894 [1,0,0,1,0,0|1,0,0]=3 267 B11R2.1 CC1=CNC2=C1C=NC=C2 M22503 [1,0,0,1,0,0|2,0,0]=4 268 B11R2.1 CC1=CNC2=NC=CC=C12 M7858 [1,0,0,1,0,0|2,0,0]=4 269 B11R2.1 CC1=NNC2=C1C=CC=C2 M1829 [1,0,0,1,0,0|2,0,0]=4 270 B11R2.1 CC1=NOC2=C1C=CC=C2 M68053 [1,0,0,1,0,0|1,0,1]=4 271 B11R2.1 CN1C=CC2=C1C=CC=C2 M68120 [1,0,0,1,0,0|2,0,0]=4 272 B11R2.1 CN1C=NC2=C1C=CC=C2 M48776 [1,0,0,1,0,0|2,0,0]=4 273 B11R2.1 NC1=NCC2=C1C=CC=C2 K49609 [1,0,0,1,0,0|2,0,0]=4 274 B11R2.1 NC1=NCC2=C1C=CC=C2 K64548 [1,0,0,1,0,0|2,0,0]=4 275 B11R2.1 O=C1CCC2=C1C=CC=N2 D5364 [1,0,0,1,0,0|1,0,1]=4 276 B11R2.1 O=C1CCC2=C1C=CN=C2 C23220 [1,0,0,1,0,0|1,0,1]=4 277 B11R2.1 O=C1CCC2=C1C=NC=C2 C24049 [1,0,0,1,0,0|1,0,1]=4 278 B11R2.1 O=C1CCC2=CC=CN=C12 C48452 [1,0,0,1,0,0|1,0,1]=4 279 B11R2.1 O=C1NCC2=C1C=CC=C2 I12007 [1,0,0,1,0,0|1,0,0]=3 280 B11R2.1 O=C1NCC2=C1C=CC=N2 D45227 [1,0,0,1,0,0|2,0,0]=4 281 B11R2.1 O=C1NCC2=C1C=NC=C2 D1721 [1,0,0,1,0,0|2,0,0]=4 282 B11R2.1 O=C1OCC2=C1C=CC=N2 F44926 [1,0,0,1,0,0|2,0,0]=4 283 B11R2.1 O=[S@]1C=NC2=C1C=CC=C2 B45069 [1,0,0,1,0,0|2,0,0]=4 284 B13R2.45 CC1=C(C#N)NC2=C1C=CC=C2 M53633 [0,0,0,1,0,1|1,0,1]=4 285 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 M61458 [0,0,0,1,0,1|0,0,0]=2 286 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 M53796 [0,0,0,1,0,1|0,0,0]=2 287 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 M53907 [0,0,0,1,0,1|1,0,0]=3 288 B13R2.45 CN1C(C=O)=CC2=C1N=CC=C2 M19102 [0,0,0,1,0,1|2,0,0]=4 289 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 M28682 [0,0,0,1,0,1|1,0,0]=3 290 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 V55310 [0,0,0,1,0,1|1,0,1]=4 291 B13R2.57 CNC1=NC2=CC=CC=C2C=C1 M52278 [0,0,0,1,0,1|2,0,0]=4 292 B13R2.57 COC1=CC2=CC=CC=C2N=C1 M53890 [0,0,0,1,0,1|2,0,0]=4 293 B13R2.57 COC1=NC2=CC=CC=C2C=C1 M53889 [0,0,0,1,0,1|2,0,0]=4 294 B13R2.57 O=CC1=CC2=CC=CC=C2C=C1 N64900 [0,0,0,1,0,1|0,0,1]=3 295 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 I3896 [0,0,0,1,0,1|1,0,1]=4 296 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 Q1105 [0,0,0,1,0,1|1,0,1]=4 297 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 F1406 [0,0,0,1,0,1|1,0,0]=3 298 B13R2.1 C=CCC1=CNC2=C1C=CC=C2 P21731 [0,1,0,1,0,0|1,0,1]=4 299 B13R2.1 NCCC1=COC2=C1C=CC=C2 B69209 [0,1,0,1,0,0|0,0,2]=4 300 B13R2.1 OCCC1=CNC2=C1C=CC=C2 I24086 [0,1,0,1,0,0|1,0,1]=4 301 B13R2.3 C1=CC=C(C2=CC=NC=C2)C=C1 P69068 [0,1,0,1,0,0|1,0,1]=4 302 B13R2.3 C1=CC=C(C2=CCOCC2)C=C1 P0629 [0,1,0,1,0,0|0,0,2]=4 303 B13R2.3 C1=CC=C(C2=NC=CC=C2)C=C1 P67859 [0,1,0,1,0,0|1,0,1]=4 304 B13R2.3 C1=CC=C(C2=NC=NC=C2)C=C1 P53630 [0,1,0,1,0,0|1,0,1]=4 305 B13R2.10 BrC1=CC=C(C2=CC=CC=C2)S1 B53499 [0,1,0,1,0,0|1,0,1]=4 306 B13R2.10 BrC1=NC=C(C2=CC=CC=C2)O1 B50911 [0,1,0,1,0,0|2,0,0]=4 307 B13R2.10 CC1=CNC(C2=CC=CC=C2)=N1 M52284 [0,1,0,1,0,0|2,0,0]=4 308 B13R2.10 CC1=NC(C2=CC=CC=C2)=CN1 M52283 [0,1,0,1,0,0|1,0,0]=3 309 B13R2.10 CC1=NN(C2=CC=CC=C2)C=C1 M52280 [0,1,0,1,0,0|2,0,0]=4 310 B13R2.10 CC1=NNC(C2=CC=CC=C2)=C1 M52281 [0,1,0,1,0,0|2,0,0]=4 311 B13R2.10 IC1=CC=C(C2=CC=CC=C2)S1 K53503 [0,1,0,1,0,0|1,0,1]=4 312 B13R2.10 NC1=NC=C(C2=CC=CC=C2)N1 P38913 [0,1,0,1,0,0|2,0,0]=4 313 B13R2.10 NC1=NC=C(C2=CC=CC=C2)N1 P59346 [0,1,0,1,0,0|2,0,0]=4 314 B13R2.10 O=C1C=CN(C2=CC=CC=C2)N1 P51358 [0,1,0,1,0,0|1,0,1]=4 315 B13R2.10 O=C1CN=C(C2=CC=CC=C2)O1 P37550 [0,1,0,1,0,0|1,0,0]=3 316 B13R2.15 BrC1=C(C2=CC=CC=C2)OC=N1 B50913 [0,1,0,1,0,0|2,0,0]=4 317 B13R2.15 CC1=CC=NN1C2=CC=CC=C2 M62966 [0,1,0,1,0,0|2,0,0]=4 318 B13R2.15 CC1=CNN=C1C2=CC=CC=C2 M52282 [0,1,0,1,0,0|2,0,0]=4 319 B13R2.15 O=C1NCCN1C2=CC=CC=C2 P61718 [0,1,0,1,0,0|1,0,1]=4 320 B13R2.1613 CCC1=CC=CC2=CC=CC=C21 E55695 [0,1,0,1,0,0|1,0,1]=4 321 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 M54375 [0,1,0,1,0,0|2,0,0]=4 322 B13R2.1613 COC1=CC=CC2=CC=CC=C21 M68560 [0,1,0,1,0,0|2,0,0]=4 323 B13R2.1613 COC1=CN=CC2=CC=CC=C21 M53893 [0,1,0,1,0,0|2,0,0]=4 324 B13R2.1613 O=CC1=CC=CC2=CC=CN=C12 Q3935 [0,1,0,1,0,0|1,0,1]=4 325 B13R2.1613 O=CC1=CC=CC2=CC=NC=C12 I9346 [0,1,0,1,0,0|1,0,1]=4 326 B13R2.1613 O=CC1=CC=CC2=CN=CC=C12 Q4921 [0,1,0,1,0,0|1,0,1]=4 327 B13R2.1613 O=CC1=CN=CC2=CC=CC=C21 I3897 [0,1,0,1,0,0|0,0,1]=3 328 B13R2.1613 O=CC1=NC=CC2=CC=CC=C21 Q53566 [0,1,0,1,0,0|0,0,1]=3 329 B13R2.2931 CN1C=C(C=O)C2=C1C=CC=C2 M22052 [0,1,0,1,0,0|0,0,0]=2 330 B13R2.2931 CN1C=C(C=O)C2=C1N=CC=C2 M21780 [0,1,0,1,0,0|1,0,0]=3 331 B13R2.2931 CN1C=C(CN)C2=C1C=CC=C2 M14457 [0,1,0,1,0,0|1,0,1]=4 332 B13R2.2931 CN1N=C(C=O)C2=C1C=CC=C2 M9333 [0,1,0,1,0,0|1,0,0]=3 333 B13R2.2931 CN1N=C(C=O)C2=C1N=CC=C2 M20159 [0,1,0,1,0,0|2,0,0]=4 334 B13R2.2931 CO[IH2]1OC(=O)C2=C1C=CC=C2 M28000 [0,1,0,1,0,0|2,0,0]=4 335 B13R2.12 NC1=CC=C(C2=CNN=C2)C=C1 P51703 [0,1,0,1,0,0|2,0,0]=4 336 B13R2.662 CC1=CC2=C(C=C1)C(C=O)=CN2 M67931 [0,1,0,1,0,0|1,0,0]=3 337 B13R2.662 NC1=CC2=C(C=C1)C(C=O)=NN2 A14663 [0,1,0,1,0,0|2,0,0]=4 338 B13R2.662 O=CC1=CN=C2C=C(Br)C=CN12 B37685 [0,1,0,1,0,0|2,0,0]=4 339 B13R2.662 O=CC1=CNC2=C1C=CC(Cl)=C2 C9543 [0,1,0,1,0,0|1,0,0]=3 340 B13R2.662 O=CC1=CNC2=C1C=CC(F)=C2 F50950 [0,1,0,1,0,0|1,0,0]=3 341 B13R2.662 O=CC1=CNC2=CC(Br)=CN=C12 B37621 [0,1,0,1,0,0|2,0,0]=4 342 B13R2.662 O=CC1=CNC2=CC(Br)=NC=C12 B13347 [0,1,0,1,0,0|2,0,0]=4 343 B13R2.662 O=CC1=CNC2=CC(Cl)=NC=C12 C47617 [0,1,0,1,0,0|2,0,0]=4 344 B13R2.662 O=CC1=NNC2=C1C=CC(Br)=C2 B9685 [0,1,0,1,0,0|2,0,0]=4 345 B13R2.662 O=CC1=NNC2=C1C=CC(Cl)=C2 C38730 [0,1,0,1,0,0|2,0,0]=4 346 B13R2.9 CC1=CC=CC2=C1NC=C2C=O F2104 [0,1,0,1,0,0|1,0,0]=3 347 B13R2.9 O=CC1=CN=C2C(Br)=CC=CN12 B63744 [0,1,0,1,0,0|2,0,0]=4 348 B13R2.9 O=CC1=CNC2=C(Cl)C=CC=C12 C50940 [0,1,0,1,0,0|1,0,0]=3 349 B13R2.9 O=CC1=CNC2=C(F)C=CC=C12 F37060 [0,1,0,1,0,0|1,0,0]=3 350 B13R2.2136 CC1=CC2=C(C=C1)NC=C2C=O M24084 [0,1,0,1,0,0|1,0,0]=3 351 B13R2.2136 O=CC1=CN=C2C=CC(Br)=CN12 B12290 [0,1,0,1,0,0|2,0,0]=4 352 B13R2.2136 O=CC1=CN=C2C=CC(Cl)=CN12 C47616 [0,1,0,1,0,0|2,0,0]=4 353 B13R2.2136 O=CC1=CNC2=C1C=C(Br)C=C2 B67494 [0,1,0,1,0,0|1,0,0]=3 354 B13R2.2136 O=CC1=CNC2=C1C=C(Cl)C=C2 C9541 [0,1,0,1,0,0|1,0,0]=3 355 B13R2.2136 O=CC1=CNC2=C1C=C(O)C=C2 H23152 [0,1,0,1,0,0|1,0,0]=3 356 B13R2.2136 O=CC1=CNC2=NC=C(Br)C=C12 B12403 [0,1,0,1,0,0|2,0,0]=4 357 B13R2.2136 O=CC1=CNC2=NC=C(Cl)C=C12 C12404 [0,1,0,1,0,0|2,0,0]=4 358 B13R2.2136 O=CC1=CSC2=C1C=C(Cl)C=C2 C62195 [0,1,0,1,0,0|1,0,0]=3 359 B13R2.2136 O=CC1=NNC2=C1C=C(Br)C=C2 B12651 [0,1,0,1,0,0|2,0,0]=4 360 B13R2.2136 O=CC1=NNC2=C1C=C(Cl)C=C2 C37668 [0,1,0,1,0,0|2,0,0]=4 361 B13R2.2136 O=CC1=NNC2=C1C=C(F)C=C2 F47619 [0,1,0,1,0,0|2,0,0]=4 362 B13R2.135 CC1=C(C#N)C2=C(C=CC=C2)N1 M38858 [0,1,0,1,0,0|1,0,1]=4 363 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)N1 M53912 [0,1,0,1,0,0|0,0,0]=2 364 B13R2.135 CC1=C(C=O)C2=C(N=CC=C2)N1 M25752 [0,1,0,1,0,0|1,0,0]=3 365 B13R2.135 O=CC1=C(Br)SC2=C1C=CC=C2 B50785 [0,1,0,1,0,0|1,0,0]=3 366 B13R2.135 O=CC1=C(Cl)NC2=C1C=CC=C2 C50937 [0,1,0,1,0,0|1,0,0]=3 367 B13R2.135 O=C[C@@H]1C(=O)NC2=C1C=CC=C2 X51176 [0,1,0,1,0,0|1,0,1]=4 368 B13R2.2091 CC1=C2C(C=O)=CNC2=CC=C1 F2770 [0,1,0,1,0,0|1,0,0]=3 369 B13R2.2091 CC1=C2C(C=O)=CNC2=CC=N1 M15083 [0,1,0,1,0,0|2,0,0]=4 370 B13R2.2091 CC1=C2C(C=O)=CNC2=NC=C1 M10814 [0,1,0,1,0,0|2,0,0]=4 371 B13R2.2091 NC1=CC=CC2=NC=C(C=O)N12 A48401 [0,1,0,1,0,0|2,0,0]=4 372 B13R2.2091 O=CC1=CN=C2C=CC=C(Cl)N12 C63072 [0,1,0,1,0,0|2,0,0]=4 373 B13R2.2091 O=CC1=CNC2=CC=CC(Br)=C12 B2058 [0,1,0,1,0,0|1,0,0]=3 374 B13R2.2091 O=CC1=CNC2=CC=CC(Cl)=C12 C9549 [0,1,0,1,0,0|1,0,0]=3 375 B13R2.2091 O=CC1=CNC2=CC=CC(F)=C12 F22518 [0,1,0,1,0,0|1,0,0]=3 376 B13R2.2091 O=CC1=CNC2=NC=CC(Br)=C12 B0739 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.2091 O=CC1=CNC2=NC=CC(Cl)=C12 C9652 [0,1,0,1,0,0|2,0,0]=4 378 B13R2.72 CC(=O)C1=C2C=CC=CN2N=C1 P67372 [0,1,0,1,0,0|2,0,0]=4 379 B13R2.72 CC(=O)C1=CN=C2C=CC=CN12 K51361 [0,1,0,1,0,0|2,0,0]=4 380 B13R2.72 CC(=O)C1=CN=C2NC=CC=C12 P0773 [0,1,0,1,0,0|2,0,0]=4 381 B13R2.72 CC(=O)C1=CNC2=C1C=CC=C2 I24984 [0,1,0,1,0,0|1,0,0]=3 382 B13R2.72 CC(=O)C1=CNC2=C1C=CN=C2 P51363 [0,1,0,1,0,0|2,0,0]=4 383 B13R2.72 CC(=O)C1=CNC2=C1C=NC=C2 P51364 [0,1,0,1,0,0|2,0,0]=4 384 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 K9334 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 K52542 [0,1,0,1,0,0|1,0,1]=4 386 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 K51345 [0,1,0,1,0,0|1,0,0]=3 387 B13R2.72 NC(=O)C1=NNC2=C1C=CC=C2 K26321 [0,1,0,1,0,0|2,0,0]=4 388 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 P11236 [0,1,0,1,0,0|2,0,0]=4 389 B13R2.72 O=C(O)C1=CNC2=C1C=CC=N2 P1023 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.72 O=C(O)C1=CNC2=C1C=CN=C2 P7859 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.72 O=C(O)C1=CNC2=C1C=NC=C2 A7966 [0,1,0,1,0,0|2,0,0]=4 392 B13R2.72 O=C(O)C1=CNC2=CC=CN=C21 P1670 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 B50992 [0,1,0,1,0,0|1,0,0]=3 394 B13R2.72 O=C(O)C1=CSC2=C1C=CC=C2 B37963 [0,1,0,1,0,0|1,0,0]=3 395 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 I1543 [0,1,0,1,0,0|2,0,0]=4 396 B13R2.72 O=C(O)[C@@H]1CCC2=C1C=CC=C2 K52427 [0,1,0,1,0,0|0,0,2]=4 397 B13R2.72 O=C(O)[C@@H]1NCC2=C1C=CC=C2 K52237 [0,1,0,1,0,0|1,0,1]=4 398 B13R2.72 O=C(O)[C@H]1NCC2=C1C=CC=C2 K52238 [0,1,0,1,0,0|1,0,1]=4 399 B13R2.72 O=[N+]([O-])C1=CNC2=C1C=CC=C2 N47873 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.439 O=C(O)C1(C2=CC=CC=C2)CC1 P24524 [0,1,0,1,0,0|0,0,2]=4 401 B9R1.11 COC(=O)C1=CC=CN1 M11015 [1,0,0,0,1,0|2,0,0]=4 402 B9R1.11 COC(=O)C1=CC=CO1 M39270 [1,0,0,0,1,0|2,0,0]=4 403 B9R1.11 COC(=O)C1=CC=CS1 M42941 [1,0,0,0,1,0|2,0,0]=4 404 B9R1.11 COC(=O)C1=CNC=C1 M37783 [1,0,0,0,1,0|2,0,0]=4 405 B9R1.11 COC(=O)C1=CSC=C1 M12826 [1,0,0,0,1,0|2,0,0]=4 406 B11R1.40 C=CC(=O)NC1=CC=CC=C1 P38034 [1,0,0,0,0,1|0,0,1]=3 407 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P32241 [1,0,0,0,0,1|0,0,1]=3 408 B11R1.40 CNC(=O)CC1=CN=CC=C1 M46657 [1,0,0,0,0,1|2,0,0]=4 409 B11R1.40 COC(=O)CC1=CC=NC=C1 M22906 [1,0,0,0,0,1|2,0,0]=4 410 B11R1.40 COC(=O)CC1=CN=CC=C1 M12485 [1,0,0,0,0,1|2,0,0]=4 411 B11R1.40 COC(=O)CC1=NC=CC=C1 M12486 [1,0,0,0,0,1|2,0,0]=4 412 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [1,0,0,0,0,1|1,0,0]=3 413 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B49021 [1,0,0,0,0,1|1,0,1]=4 414 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B64861 [1,0,0,0,0,1|1,0,1]=4 415 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [1,0,0,0,0,1|1,0,1]=4 416 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C38641 [1,0,0,0,0,1|1,0,1]=4