0 B12R1.121 COC1=C(CCC=O)C=CC=C1 M52790 [0,0,0,0,0,0|0,0,2]=2 1 B12R1.121 COC1=C(CCCO)C=CC=C1 M53089 [0,0,0,0,0,0|0,0,4]=4 2 B12R1.121 COC1=C(OCCBr)C=CC=C1 B50122 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.121 COC1=C(OCCN)C=CC=C1 M39585 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.121 COC1=C(OCCN)C=CC=C1 M50361 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.17 O=C\C=C\C1=C(Cl)C=CC=C1 C51320 [1,0,0,0,0,0|1,0,0]=2 6 B11R1.41 CNCC1=C(OC)C=CC=C1 M50356 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.41 COC1=C(CC#N)C=CC=C1 M62292 [1,0,0,0,0,0|1,0,2]=4 8 B11R1.41 COC1=C(CCBr)C=CC=C1 B50155 [1,0,0,0,0,0|1,0,2]=4 9 B11R1.41 COC1=C(CCN)C=CC=C1 M66296 [1,0,0,0,0,0|1,0,2]=4 10 B11R1.41 COC1=C(CCO)C=CC=C1 M50284 [1,0,0,0,0,0|0,0,3]=4 11 B11R1.41 COC1=C(CNN)C=CC=C1 M12218 [1,0,0,0,0,0|2,0,1]=4 12 B13R1.90 COC1=C(C=CC(=O)O)C=CC=C1 M39590 [0,1,0,0,0,0|0,0,0]=1 13 B13R1.90 COC1=C(CCC(=O)O)C=CC=C1 M52828 [0,1,0,0,0,0|0,0,2]=3 14 B13R1.90 COC1=C(OCC(=O)O)C=CC=C1 M64054 [0,1,0,0,0,0|1,0,1]=3 15 B13R1.90 COC1=C(\C=C\[N+](=O)[O-])C=CC=C1 M66294 [0,1,0,0,0,0|1,0,0]=2 16 B13R1.90 O=CC1=C(C=CC(=O)O)C=CC=C1 F53805 [0,1,0,0,0,0|2,0,0]=3 17 B13R1.91 COC(=O)CC1=C(OC)C=CC=C1 M52820 [0,1,0,0,0,0|2,0,1]=4 18 B13R1.91 COC1=C(NC(=O)CCl)C=CC=C1 C49814 [0,1,0,0,0,0|2,0,1]=4 19 B13R2.32 CC1=C(Br)C=CC2=CC=CN=C21 B53711 [0,0,0,1,0,0|3,0,0]=4 20 B13R2.32 CC1=C(Br)C=CC2=NC=CC=C21 B53707 [0,0,0,1,0,0|3,0,0]=4 21 B13R2.32 CC1=C(Br)C=NC2=CC=CC=C21 B53702 [0,0,0,1,0,0|3,0,0]=4 22 B13R2.32 CC1=C(Cl)C=CC2=CC=CN=C21 C53728 [0,0,0,1,0,0|3,0,0]=4 23 B13R2.32 CC1=C(O)C=NC2=CC=CC=C21 M53894 [0,0,0,1,0,0|2,0,1]=4 24 B13R2.32 CC1=C([Mg+])C2=CC=CC=C2C=C1 M31716 [0,0,0,1,0,0|3,0,0]=4 25 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=C1 B39639 [0,0,0,1,0,0|2,0,1]=4 26 B13R2.32 OC1=C(Br)C=CC2=CC=CC=C21 B67708 [0,0,0,1,0,0|3,0,0]=4 27 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 C38681 [0,0,0,1,0,0|2,0,1]=4 28 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 K53627 [0,0,0,1,0,0|2,0,1]=4 29 B13R2.33 O=C1CCC2=C(C=CC=C2)CC1 D54551 [0,0,0,1,0,0|1,0,2]=4 30 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 M61458 [0,0,0,1,0,0|2,0,0]=3 31 B13R2.45 CC1=C(C=O)OC2=C1C=CC=C2 M53796 [0,0,0,1,0,0|2,0,0]=3 32 B13R2.45 CN1C(C=O)=CC2=C1C=CC=C2 M53907 [0,0,0,1,0,0|1,0,0]=2 33 B13R2.45 CN1C(C=O)=CC2=C1N=CC=C2 M19102 [0,0,0,1,0,0|2,0,0]=3 34 B13R2.45 CN1C(C=O)=NC2=C1C=CC=C2 M28682 [0,0,0,1,0,0|2,0,0]=3 35 B13R2.57 O=CC1=CC2=CC=CC=C2C=C1 N64900 [0,0,0,1,0,0|1,0,1]=3 36 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 I3896 [0,0,0,1,0,0|2,0,0]=3 37 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 Q1105 [0,0,0,1,0,0|2,0,1]=4 38 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 F1406 [0,0,0,1,0,0|2,0,1]=4 39 B13R2.57 O=C[C@@H]1COC2=C(C=CC=C2)O1 D36985 [0,0,0,1,0,0|1,0,1]=3 40 B13R2.573 COC1=C2C=CN(C)C2=NC=C1 M27225 [0,0,0,1,0,0|3,0,0]=4 41 B13R2.573 COC1=C2NC=C(I)C2=NC=C1 K48384 [0,0,0,1,0,0|3,0,0]=4 42 B13R2.573 COC1=CC=CC2=C1CCC2=O M52435 [0,0,0,1,0,0|0,0,2]=3 43 B13R2.573 COC1=CC=CC2=C1CNC2=O M51775 [0,0,0,1,0,0|1,0,1]=3 44 B13R2.573 COC1=CC=CC2=C1NN=C2I K48381 [0,0,0,1,0,0|3,0,0]=4 45 B13R2.1613 CCC1=CC=CC2=CC=CC=C21 E55695 [0,0,0,1,0,0|2,0,0]=3 46 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 M54375 [0,0,0,1,0,0|2,0,0]=3 47 B13R2.1613 COC1=CC=CC2=CC=CC=C21 M68560 [0,0,0,1,0,0|1,0,0]=2 48 B13R2.1613 COC1=CC=CC2=CC=CN=C21 M61592 [0,0,0,1,0,0|2,0,0]=3 49 B13R2.1613 COC1=CC=CC2=CN=CC=C21 M53896 [0,0,0,1,0,0|2,0,0]=3 50 B13R2.1613 COC1=CC=CC2=CN=CC=C21 M54231 [0,0,0,1,0,0|2,0,0]=3 51 B13R2.1613 COC1=CC=CC2=NC=CC=C12 M53891 [0,0,0,1,0,0|1,0,0]=2 52 B13R2.1613 COC1=CN=CC2=CC=CC=C21 M53893 [0,0,0,1,0,0|2,0,0]=3 53 B13R2.1613 NCC1=C2C=CC=NC2=CC=C1 Q37653 [0,0,0,1,0,0|3,0,0]=4 54 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 N54368 [0,0,0,1,0,0|3,0,0]=4 55 B13R2.1613 NNC1=CC=CC2=CC=CC=C21 N54083 [0,0,0,1,0,0|3,0,0]=4 56 B13R2.1613 OCC1=CC=CC2=CC=CC=C21 N69061 [0,0,0,1,0,0|3,0,0]=4 57 B10R1.17 O=CC#CC1=CC=CC=C1 P68152 [2,0,0,0,0,0|0,0,2]=4 58 B10R1.20 C#CC1=C(C=O)C=CC=C1 E67701 [2,0,0,0,0,0|1,0,1]=4 59 B10R1.20 C#CC1=C(OC)C=CC=C1 E38630 [2,0,0,0,0,0|0,0,2]=4 60 B10R1.20 C=CC1=C(C=O)C=CC=C1 V51543 [2,0,0,0,0,0|1,0,1]=4 61 B10R1.20 C=CC1=C(CO)C=CC=C1 V49872 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.20 CCC1=C(C=O)C=CC=C1 E49869 [2,0,0,0,0,0|1,0,0]=3 63 B10R1.20 CNC1=C(C=O)C=CC=C1 M49260 [2,0,0,0,0,0|1,0,0]=3 64 B10R1.20 CNC1=C(C=O)C=CC=N1 M45978 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.20 CNC1=C(OC)C=CC=C1 M46897 [2,0,0,0,0,0|1,0,1]=4 66 B10R1.20 COC1=C(C#N)C=CC=C1 M67889 [2,0,0,0,0,0|1,0,1]=4 67 B10R1.20 COC1=C(C=O)C=CC=C1 A69129 [2,0,0,0,0,0|0,0,0]=2 68 B10R1.20 COC1=C(C=O)C=CC=N1 M4987 [2,0,0,0,0,0|1,0,0]=3 69 B10R1.20 COC1=C(C=O)C=CN=C1 M32191 [2,0,0,0,0,0|1,0,0]=3 70 B10R1.20 COC1=C(C=O)C=NC=C1 M45822 [2,0,0,0,0,0|1,0,0]=3 71 B10R1.20 COC1=C(CN)C=CC=C1 M46906 [2,0,0,0,0,0|1,0,1]=4 72 B10R1.20 COC1=C(OC)C=CC=C1 D64830 [2,0,0,0,0,0|1,0,1]=4 73 B10R1.20 COC1=CC=CN=C1C=O M3691 [2,0,0,0,0,0|1,0,0]=3 74 B10R1.20 N#CC1=C(C=O)C=CC=C1 C38451 [2,0,0,0,0,0|2,0,0]=4 75 B10R1.20 O=CC1=C(C=O)C=CC=C1 B68577 [2,0,0,0,0,0|2,0,0]=4 76 B12R1.125 CC(=O)NCC1=C(O)C=CC=C1 H50049 [1,1,0,0,0,0|1,0,1]=4 77 B12R1.125 CC1=C(C=CC(=O)O)C=CC=C1 M52420 [1,1,0,0,0,0|0,0,0]=2 78 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 M52804 [1,1,0,0,0,0|0,0,2]=4 79 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 M62392 [1,1,0,0,0,0|1,0,1]=4 80 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 B62216 [1,1,0,0,0,0|1,0,0]=3 81 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 C6638 [1,1,0,0,0,0|1,0,0]=3 82 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 F68685 [1,1,0,0,0,0|1,0,0]=3 83 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 H68558 [1,1,0,0,0,0|0,0,0]=2 84 B12R1.125 O=[N+]([O-])C=CC1=C(Cl)C=CC=C1 C47994 [1,1,0,0,0,0|2,0,0]=4 85 B12R1.125 O=[N+]([O-])\C=C\C1=C(Cl)C=CC=C1 C47995 [1,1,0,0,0,0|2,0,0]=4 86 B12R1.125 O=[N+]([O-])\C=C\C1=C(F)C=CC=C1 F61821 [1,1,0,0,0,0|2,0,0]=4 87 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 M64892 [1,1,0,0,0,0|0,0,1]=3 88 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 M69051 [1,1,0,0,0,0|0,0,1]=3 89 B12R1.75 COC1=C(CC(N)=O)C=CC=C1 M66295 [1,1,0,0,0,0|0,0,1]=3 90 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 B51907 [1,1,0,0,0,0|1,0,1]=4 91 B12R1.77 COC1=C(C(=O)CN)C=CC=C1 A52119 [1,1,0,0,0,0|1,0,1]=4 92 B14R1.3135 COC1=C(C[C@H](N)C(=O)O)C=CC=C1 A52981 [0,2,0,0,0,0|0,0,2]=4 93 B14R1.4522 O=C(O)\C=C\C1=C([N+](=O)[O-])C=CC=C1 N61791 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.435 COC(=O)C1=CC(C=O)=CC=C1 M51624 [0,0,1,1,0,0|1,0,0]=3 95 B12R1.435 COC(=O)C1=CC(C=O)=NC=C1 M48503 [0,0,1,1,0,0|2,0,0]=4 96 B12R1.435 COC(=O)C1=NC(C=O)=CC=C1 M48505 [0,0,1,1,0,0|2,0,0]=4 97 B12R1.450 COC1=C(Br)C=C(C=O)C(O)=C1 B48651 [0,0,1,1,0,0|2,0,0]=4 98 B12R1.450 COC1=C(F)C=C(C=O)C(F)=C1 D48200 [0,0,1,1,0,0|2,0,0]=4 99 B12R1.450 COC1=CC(Br)=C(C=O)C=C1O B48650 [0,0,1,1,0,0|2,0,0]=4 100 B12R1.450 COC1=CC(C)=C(C=O)C=C1C M52810 [0,0,1,1,0,0|0,0,2]=4 101 B12R1.78 COC1=CC(C#N)=C(C=O)C=C1 C69491 [0,0,1,1,0,0|1,0,1]=4 102 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 B39635 [1,0,0,1,0,0|1,0,1]=4 103 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 B1013 [1,0,0,1,0,0|2,0,0]=4 104 B12R2.24 FC1=CC2=CC=CC=C2C=C1 F53501 [1,0,0,1,0,0|1,0,1]=4 105 B12R2.24 IC1=CC2=CC=CC=C2C=C1 I38722 [1,0,0,1,0,0|1,0,1]=4 106 B12R2.24 NC1=CC2=CC=CC=C2C=C1 N65553 [1,0,0,1,0,0|1,0,1]=4 107 B12R2.24 NC1=NC2=CC=CC=C2C=C1 Q9616 [1,0,0,1,0,0|2,0,0]=4 108 B12R2.24 O=C1C=CC2=C(C=CC=N2)N1 N37672 [1,0,0,1,0,0|2,0,0]=4 109 B12R2.24 O=C1C=CC2=CC=CNC2=N1 N0688 [1,0,0,1,0,0|2,0,0]=4 110 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 C39572 [1,0,0,1,0,0|1,0,1]=4 111 B12R2.24 O=C1COC2=C(C=CC=C2)O1 B62111 [1,0,0,1,0,0|1,0,1]=4 112 B12R2.24 [Mg+]C1=CC2=CC=CC=C2C=C1 N31715 [1,0,0,1,0,0|1,0,1]=4 113 B12R2.32 N#CC1=CC2=C(C=CC=C2)O1 B50747 [1,0,0,1,0,0|1,0,1]=4 114 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 I38005 [1,0,0,1,0,0|1,0,0]=3 115 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 B50964 [1,0,0,1,0,0|0,0,0]=2 116 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 B37929 [1,0,0,1,0,0|0,1,0]=3 117 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 F10728 [1,0,0,1,0,0|1,0,0]=3 118 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 P24641 [1,0,0,1,0,0|2,0,0]=4 119 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 P1530 [1,0,0,1,0,0|2,0,0]=4 120 B12R2.32 O=CC1=CC2=CC=CN=C2S1 T47760 [1,0,0,1,0,0|1,1,0]=4 121 B12R2.32 O=CC1=NC2=C(C=CC=C2)N1 B23090 [1,0,0,1,0,0|2,0,0]=4 122 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 B9216 [1,0,0,1,0,0|1,1,0]=4 123 B12R2.196 CC1=CC=CC2=C1CCC2=O M52415 [1,0,0,1,0,0|0,0,2]=4 124 B12R2.196 CC1=CC=CC2=C1ONC2=O M60993 [1,0,0,1,0,0|2,0,0]=4 125 B12R2.196 CN1C=CC2=C(O)C=CC=C21 M60832 [1,0,0,1,0,0|2,0,0]=4 126 B12R2.196 O=C1CCC2=C1C=CC=C2O H38442 [1,0,0,1,0,0|0,0,2]=4 127 B12R2.196 O=C1NCC2=C1C=CC=C2O H48467 [1,0,0,1,0,0|1,0,1]=4 128 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 B1008 [1,0,0,1,0,0|2,0,0]=4 129 B12R2.1081 BrC1=CC=CC2=NC=CC=C12 B50848 [1,0,0,1,0,0|2,0,0]=4 130 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 M53836 [1,0,0,1,0,0|1,0,0]=3 131 B12R2.1081 CC1=C2N=CC=NC2=CC=C1 M4609 [1,0,0,1,0,0|2,0,0]=4 132 B12R2.1081 ClC1=CC=CC2=NC=CC=C12 C24659 [1,0,0,1,0,0|2,0,0]=4 133 B12R2.1081 FC1=CC=CC2=CC=CC=C12 F60518 [1,0,0,1,0,0|2,0,0]=4 134 B12R2.1081 IC1=CC=CC2=CC=CC=C12 K53502 [1,0,0,1,0,0|2,0,0]=4 135 B12R2.1081 OC1=CC=CC2=CC=NC=C12 Q3877 [1,0,0,1,0,0|2,0,0]=4 136 B12R2.1081 OC1=CC=CC2=CN=CC=C12 H51161 [1,0,0,1,0,0|2,0,0]=4 137 B12R2.1081 OC1=CC=CC2=NC=CC=C12 H4784 [1,0,0,1,0,0|1,0,0]=3 138 B12R2.1081 OC1=CC=CC2=NC=CN=C12 Q47865 [1,0,0,1,0,0|2,0,0]=4 139 B12R2.1081 OC1=CN=CC2=CC=CC=C12 H6069 [1,0,0,1,0,0|2,0,0]=4 140 B12R2.1081 OC1=NC=CC2=CC=CC=C21 H38444 [1,0,0,1,0,0|2,0,0]=4 141 B12R2.1081 [Mg+]C1=CC=CC2=CC=CC=C12 N31714 [1,0,0,1,0,0|2,0,0]=4 142 B12R2.1 O=CC1=COC2=C1C=CC=C2 B23789 [1,0,0,1,0,0|0,0,1]=3 143 B12R2.1 O=CC1=CSC2=C1C=CC=C2 B67477 [1,0,0,1,0,0|0,1,1]=4 144 B12R2.1 O=CC1=NNC2=C1C=CC=C2 K9332 [1,0,0,1,0,0|2,0,0]=4 145 B12R2.18 CC1=CC2=C(C=CC=C2)N1C D26007 [1,0,0,1,0,0|1,0,1]=4 146 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 M48815 [1,0,0,1,0,0|2,0,0]=4 147 B12R2.18 CN1C(N)=CC2=C1C=CC=C2 M38994 [1,0,0,1,0,0|2,0,0]=4 148 B12R2.315 COC1=C2C=CNC2=CC=C1 M2322 [1,0,0,1,0,0|1,0,0]=3 149 B12R2.315 COC1=C2C=CNC2=CN=C1 M15509 [1,0,0,1,0,0|2,0,0]=4 150 B12R2.315 COC1=C2C=CNC2=NC=C1 M3804 [1,0,0,1,0,0|2,0,0]=4 151 B12R2.315 COC1=C2C=NNC2=CC=C1 M7685 [1,0,0,1,0,0|2,0,0]=4 152 B12R2.315 COC1=C2NC=CC2=CC=C1 M2324 [1,0,0,1,0,0|1,0,0]=3 153 B12R2.315 COC1=C2NC=CC2=CN=C1 M15521 [1,0,0,1,0,0|2,0,0]=4 154 B12R2.315 COC1=C2NC=CC2=NC=C1 M15523 [1,0,0,1,0,0|2,0,0]=4 155 B12R2.315 COC1=C2NC=NC2=CC=C1 M48806 [1,0,0,1,0,0|2,0,0]=4 156 B12R2.315 COC1=C2NN=CC2=CC=C1 M12706 [1,0,0,1,0,0|2,0,0]=4 157 B12R2.315 COC1=C2OC=CC2=CC=C1 M51551 [1,0,0,1,0,0|1,0,0]=3 158 B12R2.315 COC1=C2OC=CC2=CC=N1 M12912 [1,0,0,1,0,0|2,0,0]=4 159 B12R2.315 COC1=CC=CC2=C1C=CS2 M63543 [1,0,0,1,0,0|0,1,0]=3 160 B12R2.315 COC1=NC=CC2=C1C=CN2 M15512 [1,0,0,1,0,0|2,0,0]=4 161 B12R2.315 COC1=NC=CC2=C1NC=C2 M12031 [1,0,0,1,0,0|2,0,0]=4 162 B14R2.1146 COC1=CC(=O)NC2=C1C=CC=C2 M53922 [0,1,0,1,0,0|2,0,0]=4 163 B14R2.1146 COC1=CC(=O)OC2=C1C=CC=C2 M62171 [0,1,0,1,0,0|2,0,0]=4 164 B14R2.1146 COC1=CC(Br)=CC2=CC=CN=C21 B32293 [0,1,0,1,0,0|2,0,0]=4 165 B14R2.1146 COC1=CC(Br)=CC2=CC=NC=C21 B65741 [0,1,0,1,0,0|2,0,0]=4 166 B14R2.1146 COC1=CC(Br)=CC2=NC=CC=C12 B64349 [0,1,0,1,0,0|1,0,0]=3 167 B14R2.1146 COC1=CC(Br)=NC2=CC=CC=C21 B53772 [0,1,0,1,0,0|2,0,0]=4 168 B14R2.1146 COC1=CC(Cl)=CC2=CC=CN=C21 C53785 [0,1,0,1,0,0|2,0,0]=4 169 B14R2.1146 COC1=NC(N)=CC2=CC=CC=C21 M52291 [0,1,0,1,0,0|2,0,0]=4 170 B14R2.2332 O=CC1=CC2=CC=C(O)C=C2C=C1 H25376 [0,1,0,1,0,0|1,0,1]=4 171 B14R2.4513 CN1C(=O)C=CC2=C1C=C(Br)C=C2 B53779 [0,1,0,1,0,0|1,0,0]=3 172 B14R2.92 O=CC1=C(Br)C2=CC=CC=C2C=C1 B55211 [0,1,0,1,0,0|1,0,1]=4 173 B14R2.92 O=CC1=C(Cl)C2=CC=CC=C2N=C1 C63922 [0,1,0,1,0,0|1,0,1]=4 174 B14R2.92 O=CC1=C(O)C2=CC=CC=C2C=C1 H62030 [0,1,0,1,0,0|1,0,1]=4 175 B14R2.92 O=CC1=COC2=C(C=CC=C2)C1=O X53493 [0,1,0,1,0,0|0,0,1]=3 176 B14R2.98 COC1=C(C2=CC=CO2)C=CC=C1 M54340 [0,1,0,1,0,0|0,0,1]=3 177 B14R2.98 COC1=C(C2=NC=CN2)C=CC=C1 M66019 [0,1,0,1,0,0|1,0,0]=3 178 B14R2.98 COC1=C(N2C=CC=N2)C=CC=C1 M52293 [0,1,0,1,0,0|1,0,0]=3 179 B14R2.1078 COC1=C2N=CC=C(Br)C2=CC=C1 B68278 [0,1,0,1,0,0|1,0,0]=3 180 B14R2.1078 COC1=C2N=CN=C(Cl)C2=CC=C1 C51130 [0,1,0,1,0,0|2,0,0]=4 181 B14R2.1078 COC1=CC=CC2=C(O)C=CN=C12 M62099 [0,1,0,1,0,0|0,0,1]=3 182 B14R2.1078 COC1=CC=CC2=C(O)N=CN=C12 M51372 [0,1,0,1,0,0|1,0,1]=4 183 B14R2.1078 COC1=CC=CC2=C1CCCC2=O M36834 [0,1,0,1,0,0|0,0,2]=4 184 B14R2.1078 COC1=CC=CC2=C1CCNC2=O M62396 [0,1,0,1,0,0|0,0,2]=4 185 B14R2.1078 COC1=CC=CC2=C1OCCC2=O M52449 [0,1,0,1,0,0|0,0,2]=4 186 B14R2.2 O=C(O)CC1=COC2=C1C=CC=C2 B24693 [0,1,0,1,0,0|0,0,2]=4 187 B14R2.2 O=C(O)CC1=NOC2=C1C=CC=C2 B51206 [0,1,0,1,0,0|1,0,1]=4 188 B14R2.450 CC1=C(C(=O)O)NC2=C1C=CC=C2 M16318 [0,1,0,1,0,0|2,0,0]=4 189 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 M22616 [0,1,0,1,0,0|2,0,0]=4 190 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 M20601 [0,1,0,1,0,0|1,0,0]=3 191 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=C1 N64544 [0,1,0,1,0,0|1,0,1]=4 192 B14R2.781 NC(=O)C1=CC2=CC=CC=C2C=C1 N69496 [0,1,0,1,0,0|1,0,1]=4 193 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 I3901 [0,1,0,1,0,0|2,0,0]=4 194 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 Q9606 [0,1,0,1,0,0|2,0,0]=4 195 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 Q53568 [0,1,0,1,0,0|1,0,1]=4 196 B14R2.781 O=C(O)[C@@H]1COC2=C(C=CC=C2)O1 D9562 [0,1,0,1,0,0|1,0,1]=4 197 B14R2.1073 COC1=C2C=CC(Cl)=NC2=CC=C1 C53783 [0,1,0,1,0,0|1,0,0]=3 198 B14R2.1073 COC1=C2N=CC(Cl)=NC2=CC=C1 C51127 [0,1,0,1,0,0|2,0,0]=4 199 B14R2.1073 COC1=CC=CC2=C1C=CC(=O)N2 M53923 [0,1,0,1,0,0|0,0,0]=2 200 B14R2.1073 COC1=CC=CC2=C1CCC(=O)C2 M4692 [0,1,0,1,0,0|0,0,2]=4 201 B14R2.11645 COC1=CC=CC2=C1NC(=O)C2=O M51201 [0,1,0,1,0,0|1,0,0]=3 202 B14R2.11647 COC1=CC=CC2=C1C=C(C#N)S2 M65374 [0,1,0,1,0,0|1,0,1]=4 203 B14R2.11684 COC1=C2C=C(Br)C=CC2=NC=C1 B25985 [0,1,0,1,0,0|2,0,0]=4 204 B14R2.11684 COC1=C2N=C(Cl)C=NC2=CC=C1 C51129 [0,1,0,1,0,0|2,0,0]=4 205 B14R2.11684 COC1=C2OC(=O)C=CC2=CC=C1 M61686 [0,1,0,1,0,0|2,0,0]=4 206 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 M55783 [0,1,0,1,0,0|2,0,0]=4 207 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 M56573 [0,1,0,1,0,0|2,0,0]=4 208 B14R2.7150 OCCC1=CC=CC2=CC=CC=C21 N55759 [0,1,0,1,0,0|2,0,0]=4 209 B14R2.7724 CN1C(=O)NC(=O)C2=C1C=CC=C2 M51388 [0,1,0,1,0,0|2,0,0]=4 210 B14R2.11635 COC1=C2C(Br)=CC=NC2=CC=C1 B53773 [0,1,0,1,0,0|1,0,0]=3 211 B14R2.11691 COC1=C2C(=O)OC(=O)C2=CC=C1 M51000 [0,1,0,1,0,0|1,0,0]=3 212 B14R2.203 COC1=C(Br)C=CC2=CC=CC=C21 B55421 [0,1,0,1,0,0|1,0,0]=3 213 B14R2.203 COC1=C(C)C=CC2=CC=CC=C21 M55760 [0,1,0,1,0,0|1,0,0]=3 214 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl C53477 [0,1,0,1,0,0|1,0,1]=4 215 B14R2.134 O=CC1=CN=C2C=CC(Br)=CC2=C1 B53475 [0,1,0,1,0,0|1,0,1]=4 216 B14R2.134 O=CC1=CN=C2C=CC(Cl)=CC2=C1 C53479 [0,1,0,1,0,0|1,0,1]=4 217 B14R2.1131 COC1=CC=C(Br)C2=CC=CC=C12 B55420 [0,1,0,1,0,0|1,0,0]=3 218 B14R2.1131 COC1=CC=C(Br)C2=CC=NC=C12 B24866 [0,1,0,1,0,0|2,0,0]=4 219 B14R2.1131 COC1=CC=C(N)C2=NC=CC=C12 M67830 [0,1,0,1,0,0|1,0,0]=3 220 B14R2.1131 COC1=CC=C(O)C2=CC=CC=C12 M61582 [0,1,0,1,0,0|1,0,0]=3 221 B14R2.1131 COC1=CC=C(O)C2=NC=CC=C12 M63387 [0,1,0,1,0,0|1,0,0]=3 222 B14R2.1131 COC1=CN=C(Cl)C2=CC=CC=C12 C23098 [0,1,0,1,0,0|2,0,0]=4 223 B14R2.1131 COC1=NC=C(Br)C2=CC=CC=C21 B38645 [0,1,0,1,0,0|2,0,0]=4 224 B14R2.1745 COC1=C2CCC(=O)C2=C(Br)C=C1 B53990 [0,1,0,1,0,0|0,0,2]=4 225 B14R2.31359 CC(=O)C1=CC=CC2=CC=CC=C21 A69305 [0,1,0,1,0,0|2,0,0]=4 226 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 N13772 [0,1,0,1,0,0|2,0,0]=4 227 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 N65859 [0,1,0,1,0,0|2,0,0]=4 228 B14R2.31359 C[C@H](N)C1=CC=CC2=CC=CC=C21 N16221 [0,1,0,1,0,0|2,0,0]=4 229 B14R2.31359 C[C@H](O)C1=CC=CC2=CC=CC=C21 N55761 [0,1,0,1,0,0|2,0,0]=4