0 B14R2.781 CC(=O)C1=CC=C2C=CC=CC2=C1 432360 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.781 CC(=O)C1=CC=C2CCCCC2=C1 209650 [0,0,0,0,0,0|0,0,4]=4 2 B14R2.781 CC(O)C1=CC2=C(C=CC=C2)C=C1 354137 [0,0,0,0,0,0|0,0,2]=2 3 B14R2.781 C[C@@H](N)C1=CC=C2C=CC=CC2=C1 229098 [0,0,0,0,0,0|1,0,1]=2 4 B14R2.781 C[C@@H](O)C1=CC2=CC=CC=C2C=C1 245761 [0,0,0,0,0,0|0,0,2]=2 5 B14R2.781 NC(=O)C1=CC=C2C=CC=CC2=C1 321834 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.781 O=C(Cl)C1=CC=C2C=CC=CC2=C1 386708 [0,0,0,0,0,0|1,0,0]=1 7 B14R2.781 O=C(O)C1=CC2=C(C=C1)C=NC=C2 223438 [0,0,0,0,0,0|2,0,0]=2 8 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 066331 [0,0,0,0,0,0|2,0,0]=2 9 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 066337 [0,0,0,0,0,0|2,0,0]=2 10 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 036134 [0,0,0,0,0,0|2,0,0]=2 11 B14R2.781 O=C(O)C1=CC2=CC=CN=C2C=C1 057738 [0,0,0,0,0,0|2,0,0]=2 12 B14R2.781 O=C(O)C1=CC=C2C=CC=CC2=C1 092221 [0,0,0,0,0,0|1,0,0]=1 13 B14R2.781 O=C(O)C1=CC=C2C=CC=NC2=N1 023689 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 036133 [0,0,0,0,0,0|2,0,0]=2 15 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 064456 [0,0,0,0,0,0|3,0,0]=3 16 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 016068 [0,0,0,0,0,0|3,0,0]=3 17 B14R2.781 O=S([O-])C1=CC=C2C=CC=CC2=C1 045964 [0,0,0,0,0,0|2,0,0]=2 18 B14R2.781 O=[N+]([O-])C1=CC=C2C=CC=CC2=C1 239981 [0,0,0,0,0,0|2,0,0]=2 19 B14R2.781 O=[N+]([O-])C1=CC=C2N=CC=CC2=C1 047735 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)C=C1 011007 [0,0,0,0,0,0|2,0,1]=3 21 B14R2.781 OB(O)C1=CC2=C(C=CC=C2)N=C1 011058 [0,0,0,0,0,0|3,0,1]=4 22 B14R2.781 OB(O)C1=CC2=CC=CC=C2N=C1 219866 [0,0,0,0,0,0|3,0,1]=4 23 B14R2.781 OB(O)C1=CC=C2N=CC=CC2=C1 092413 [0,0,0,0,0,0|3,0,1]=4 24 B13R2.57 BrCC1=CC=C2C=CC=CC2=C1 211108 [1,0,0,0,0,0|1,0,1]=3 25 B13R2.57 BrCC1=CC=C2C=CN=CC2=C1 105339 [1,0,0,0,0,0|2,0,1]=4 26 B13R2.57 C#CC1=CC=C2C=CC=CC2=C1 040180 [1,0,0,0,0,0|0,0,2]=3 27 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 238808 [1,0,0,0,0,0|1,0,0]=2 28 B13R2.57 COC1=CC=C2N=CC=CC2=C1 219254 [1,0,0,0,0,0|2,0,0]=3 29 B13R2.57 N#CC1=CC2=CC=CC=C2C=N1 068841 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 079076 [1,0,0,0,0,0|1,0,1]=3 31 B13R2.57 NCC1=CC=C2C=CC=CC2=N1 048207 [1,0,0,0,0,0|2,0,1]=4 32 B13R2.57 NCC1=CN=C2C=CC=CC2=C1 055573 [1,0,0,0,0,0|2,0,1]=4 33 B13R2.57 NNC1=CC=C2C=CC=CC2=C1 077433 [1,0,0,0,0,0|2,0,0]=3 34 B13R2.57 NNC1=NC2=CC=CC=C2C=C1 145900 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.57 O=CC1=CC=C2C=CC=CC2=C1 209194 [1,0,0,0,0,0|0,0,0]=1 36 B13R2.57 OCC1=CC2=CC=CC=C2N=C1 233783 [1,0,0,0,0,0|1,0,2]=4 37 B13R2.57 OCC1=CC=C2C=CC=CC2=C1 079059 [1,0,0,0,0,0|0,0,2]=3 38 B15R2.627 CC(=O)C1CCC2=CC=CC=C2C1=O 436867 [0,1,0,0,0,0|0,0,3]=4 39 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2N=C1 319178 [0,1,0,0,0,0|2,0,0]=3 40 B15R2.627 O=C(O)C1=CC=C2C=CC=CC2=C1O 318228 [0,1,0,0,0,0|1,0,0]=2 41 B15R2.627 O=C(O)C1=CNC2=C(C=CC=C2)C1=O 219611 [0,1,0,0,0,0|2,0,0]=3 42 B15R2.984 CC(=O)C1=C(C)N=C2C=CN=CC2=C1 023692 [0,1,0,0,0,0|2,0,0]=3 43 B15R2.984 CC1=NC2=C(C=NC=C2)C=C1C(=O)O 023696 [0,1,0,0,0,0|3,0,0]=4 44 B15R2.984 NC1=C(C(=O)O)C=C2C=CC=CC2=C1 010658 [0,1,0,0,0,0|1,0,0]=2 45 B15R2.984 NC1=CC2=CC=CC=C2C=C1C(=O)O 105489 [0,1,0,0,0,0|1,0,0]=2 46 B15R2.984 O=C(O)C1=C(O)C=C2C=CC=CC2=C1 047076 [0,1,0,0,0,0|1,0,0]=2 47 B15R2.984 O=C(O)C1=CC2=C(C=CC=C2)OC1=O 358178 [0,1,0,0,0,0|2,0,0]=3 48 B15R2.984 O=C(O)C1=NC2=C(C=CC=C2)NC1=O 076089 [0,1,0,0,0,0|3,0,0]=4 49 B15R2.1601 CNC(=O)C1=CC2=CC=CC=C2C=C1 102589 [0,1,0,0,0,0|0,0,0]=1 50 B15R2.1601 COC(=O)C1=CC2=C(C=CC=C2)C=C1 013169 [0,1,0,0,0,0|0,0,0]=1 51 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2C=N1 067046 [0,1,0,0,0,0|1,0,0]=2 52 B15R2.1601 COC(=O)C1=CC=C2N=CC=NC2=C1 232206 [0,1,0,0,0,0|2,0,0]=3 53 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2C=C1 220111 [0,1,0,0,0,0|1,0,0]=2 54 B15R2.1601 O=C(CBr)C1=CC2=C(C=CC=C2)C=C1 358274 [0,1,0,0,0,0|0,0,0]=1 55 B15R2.4441 O=S(=O)(Cl)C1=CC=C2C=CC=CC2=C1 216687 [0,1,0,0,0,0|2,0,0]=3 56 B15R2.4441 O=S(=O)(O)C1=CC2=CC=CC=C2C=C1 104130 [0,1,0,0,0,0|2,0,0]=3 57 B15R2.4441 O=S(=O)(O)C1=CC=C2C=CC=CC2=C1 046726 [0,1,0,0,0,0|2,0,0]=3 58 B15R2.7174 O=C(O)C1=CC2=CC(Cl)=CC=C2OC1 017265 [0,1,0,0,0,0|2,0,1]=4 59 B15R2.7180 NC1=CC2=CC=C(C(=O)O)C=C2C=C1 010652 [0,1,0,0,0,0|1,0,0]=2 60 B15R2.7180 O=C(O)C1=CC2=CC=C(O)C=C2C=C1 013602 [0,1,0,0,0,0|1,0,0]=2 61 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=CC2=C1 215678 [0,1,0,0,0,0|1,0,0]=2 62 B15R2.7180 OB(O)C1=CC=C2C=C(O)C=CC2=C1 224017 [0,1,0,0,0,0|2,0,1]=4 63 B15R2.14951 O=C(O)C1=CC(=O)C2=CC=CC=C2O1 012033 [0,1,0,0,0,0|2,0,0]=3 64 B15R2.14951 O=C(O)C1=CC(O)=C2C=CC=CC2=N1 047165 [0,1,0,0,0,0|2,0,0]=3 65 B15R2.61353 O=C(O)C1=NC2=C(Br)C=NC=C2C=C1 023613 [0,1,0,0,0,0|3,0,0]=4 66 B15R2.61353 O=C(O)C1=NC2=C(Cl)C=CC=C2C=C1 305739 [0,1,0,0,0,0|2,0,0]=3 67 B15R2.61353 O=C(O)C1=NC2=C(O)C=CC=C2C=C1 220263 [0,1,0,0,0,0|2,0,0]=3 68 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 242631 [0,0,1,0,0,0|3,0,0]=4 69 B13R1.90 COC1=C(\C=C\C(=O)O)C=CC=C1 103441 [0,0,1,0,0,0|2,0,1]=4 70 B13R1.418 N#C\C(=C/C1=CC=CC=C1)C(=O)O 103703 [0,0,1,0,0,0|2,0,1]=4 71 B13R2.72 CC(=O)C1=CNC2=CC=CC=C21 068787 [0,0,0,0,1,0|1,0,0]=2 72 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 036611 [0,0,0,0,1,0|2,0,0]=3 73 B13R2.72 CC(=O)N1C=CC2=C1C=CC=C2 303166 [0,0,0,0,1,0|1,0,0]=2 74 B13R2.72 NC(=S)C1=CNC2=CC=CC=C21 097931 [0,0,0,0,1,0|2,1,0]=4 75 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 214752 [0,0,0,0,1,0|3,0,0]=4 76 B13R2.72 O=C(O)C1=CN=C2C=CC=CN12 093158 [0,0,0,0,1,0|3,0,0]=4 77 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 003408 [0,0,0,0,1,0|2,0,0]=3 78 B13R2.72 O=C(O)C1=CNC2=NC=CC=C12 066602 [0,0,0,0,1,0|3,0,0]=4 79 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 036412 [0,0,0,0,1,0|3,0,0]=4 80 B13R2.430 CC(=O)C1=CC=C2CCCC2=C1 104311 [0,0,0,0,1,0|0,0,3]=4 81 B13R2.430 CC(=O)C1=CC=C2OCCC2=C1 021797 [0,0,0,0,1,0|1,0,2]=4 82 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 047688 [0,0,0,0,1,0|2,0,0]=3 83 B13R2.430 O=C(O)C1=CC2=C(C=C1)NN=C2 066535 [0,0,0,0,1,0|3,0,0]=4 84 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 023377 [0,0,0,0,1,0|2,0,0]=3 85 B13R2.430 O=C(O)C1=CC=C2N=CSC2=C1 005892 [0,0,0,0,1,0|3,0,0]=4 86 B13R2.430 O=C(O)C1=CC=C2NC=NC2=C1 066310 [0,0,0,0,1,0|3,0,0]=4 87 B13R2.430 O=C(O)C1=CC=C2SC=CC2=C1 325184 [0,0,0,0,1,0|2,0,0]=3 88 B13R2.430 O=C(O)C1=CC=C2SC=NC2=C1 066307 [0,0,0,0,1,0|3,0,0]=4 89 B13R2.430 O=C(O)C1=CN2C=CN=C2C=C1 066553 [0,0,0,0,1,0|3,0,0]=4 90 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)NC=C2 010352 [0,0,0,0,1,0|3,0,0]=4 91 B13R2.430 O=[N+]([O-])C1=CC2=C(C=CN2)C=C1 093666 [0,0,0,0,1,0|3,0,0]=4 92 B13R2.435 CC(=O)C1=CC2=CC=CC=C2S1 036613 [0,0,0,0,1,0|1,0,0]=2 93 B13R2.435 CC(=O)C1=NC2=CC=CC=C2S1 009660 [0,0,0,0,1,0|2,0,0]=3 94 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 043684 [0,0,0,0,1,0|2,0,0]=3 95 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 018198 [0,0,0,0,1,0|2,0,0]=3 96 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)N1 079065 [0,0,0,0,1,0|3,0,0]=4 97 B13R2.435 O=C(O)C1=CC2=CC=CC=C2O1 019325 [0,0,0,0,1,0|2,0,0]=3 98 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 015246 [0,0,0,0,1,0|3,0,0]=4 99 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 041905 [0,0,0,0,1,0|3,0,0]=4 100 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)O1 237503 [0,0,0,0,1,0|3,0,0]=4 101 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 033774 [0,0,0,0,1,0|3,0,0]=4 102 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 361046 [0,0,0,0,1,0|3,0,0]=4 103 B15R2.1668 O=C(O)CC1=CC=C2C=CC=CC2=C1 209982 [0,0,0,0,0,1|1,0,0]=2 104 B12R1.71 C=CCOC1=CC=C(C=O)C=C1 102102 [1,0,1,0,0,0|1,0,1]=4 105 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 103214 [1,0,1,0,0,0|2,0,0]=4 106 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O 340690 [1,0,1,0,0,0|1,0,1]=4 107 B12R1.125 NC(=O)\C=C\C1=C(F)C=CC=C1 102686 [1,0,1,0,0,0|2,0,0]=4 108 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1F 014739 [1,0,1,0,0,0|2,0,0]=4 109 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 001107 [1,0,1,0,0,0|2,0,0]=4 110 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 001142 [1,0,1,0,0,0|2,0,0]=4 111 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F 001440 [1,0,1,0,0,0|2,0,0]=4 112 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O 375171 [1,0,1,0,0,0|2,0,0]=4 113 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O 209321 [1,0,1,0,0,0|1,0,1]=4 114 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 241185 [1,0,1,0,0,0|1,0,1]=4 115 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 209319 [1,0,1,0,0,0|2,0,0]=4 116 B12R2.24 BrC1=CC2=C(C=CC=C2)N=C1 044937 [2,0,0,0,0,0|2,0,0]=4 117 B12R2.24 BrC1=CC2=C(C=CN=C2)C=C1 038558 [2,0,0,0,0,0|2,0,0]=4 118 B12R2.24 BrC1=CC=C2C=CC=CC2=C1 077976 [2,0,0,0,0,0|1,0,0]=3 119 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 076676 [2,0,0,0,0,0|2,0,0]=4 120 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 036991 [2,0,0,0,0,0|2,0,0]=4 121 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 067503 [2,0,0,0,0,0|2,0,0]=4 122 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 076108 [2,0,0,0,0,0|2,0,0]=4 123 B12R2.24 CC1=CC2=C(C=C1)C=NC=C2 208923 [2,0,0,0,0,0|1,0,0]=3 124 B12R2.24 CC1=CC=C2C=CC=CC2=C1 216647 [2,0,0,0,0,0|0,0,0]=2 125 B12R2.24 CC1=CC=C2N=CC=NC2=C1 002740 [2,0,0,0,0,0|2,0,0]=4 126 B12R2.24 CC1=NC2=CC=CC=C2C=C1 078623 [2,0,0,0,0,0|1,0,0]=3 127 B12R2.24 CC1=NC2=CC=CC=C2N=C1 303297 [2,0,0,0,0,0|2,0,0]=4 128 B12R2.24 CC1=NC2=NC=CC=C2C=C1 208943 [2,0,0,0,0,0|2,0,0]=4 129 B12R2.24 ClC1=CC2=CC=CN=C2C=C1 049700 [2,0,0,0,0,0|2,0,0]=4 130 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 238872 [2,0,0,0,0,0|1,0,0]=3 131 B12R2.24 NC1=CC2=CC=CC=C2N=C1 064971 [2,0,0,0,0,0|2,0,0]=4 132 B12R2.24 NC1=CC2=CC=CN=C2C=C1 045222 [2,0,0,0,0,0|2,0,0]=4 133 B12R2.24 NC1=CC=C2C=CC=CC2=C1 079046 [2,0,0,0,0,0|1,0,0]=3 134 B12R2.24 NC1=CC=C2C=NC=CC2=C1 036790 [2,0,0,0,0,0|2,0,0]=4 135 B12R2.24 NC1=NC2=CC=CC=C2C=C1 105400 [2,0,0,0,0,0|2,0,0]=4 136 B12R2.24 O=C1C=C2C=CC=CC2=CN1 208952 [2,0,0,0,0,0|1,0,0]=3 137 B12R2.24 O=C1C=CC2=C(C=CC=C2)N1 358402 [2,0,0,0,0,0|1,0,0]=3 138 B12R2.24 O=C1C=CC2=CC=CC=C2O1 239149 [2,0,0,0,0,0|1,0,0]=3 139 B12R2.24 O=C1C=NC2=CC=CC=C2N1 042360 [2,0,0,0,0,0|2,0,0]=4 140 B12R2.24 OC1=CC2=CC=CC=C2N=C1 076701 [2,0,0,0,0,0|1,0,1]=4 141 B12R2.24 OC1=CC=C2C=CC=CC2=C1 235727 [2,0,0,0,0,0|0,0,1]=3 142 B12R2.24 OC1=CC=C2C=CC=NC2=C1 076325 [2,0,0,0,0,0|1,0,1]=4 143 B12R2.24 OC1=CC=C2C=CN=CC2=C1 068840 [2,0,0,0,0,0|1,0,1]=4 144 B12R2.24 OC1=CC=C2N=CC=CC2=C1 076700 [2,0,0,0,0,0|1,0,1]=4 145 B12R2.24 SC1=CC=C2C=CC=CC2=C1 227409 [2,0,0,0,0,0|0,1,0]=3 146 B14R2.92 C(=O)C1=COC2=CC=CC=C2C1=O 003431 [1,1,0,0,0,0|1,0,0]=3 147 B14R2.92 COC1=CC=C2C=CC=CC2=C1Br 231149 [1,1,0,0,0,0|1,0,0]=3 148 B14R2.112 OCCC1=CC=C2C=CC=CC2=C1 319501 [1,1,0,0,0,0|0,0,1]=3 149 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 077064 [1,1,0,0,0,0|1,0,1]=4 150 B14R2.142 COC1=CC2=C(N)C=CC=C2C=C1 226190 [1,1,0,0,0,0|1,0,0]=3 151 B14R2.142 O=CC1=NC2=C(O)C=CC=C2C=C1 221569 [1,1,0,0,0,0|1,0,0]=3 152 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl 012246 [1,1,0,0,0,0|1,0,0]=3 153 B14R2.2332 COC1=CC2=CC=C(O)C=C2C=C1 215979 [1,1,0,0,0,0|1,0,0]=3 154 B14R2.2332 COC1=CC=C2C=C(Br)C=CC2=C1 023276 [1,1,0,0,0,0|1,0,0]=3 155 B14R2.2332 COC1=CC=C2N=C(C)C=CC2=C1 002592 [1,1,0,0,0,0|2,0,0]=4 156 B14R2.2332 N#CC1=CC=C2C=C(O)C=CC2=C1 069169 [1,1,0,0,0,0|1,0,1]=4 157 B14R2.2332 O=CC1=CC=C2OC(=O)C=CC2=C1 023435 [1,1,0,0,0,0|1,0,0]=3 158 B14R2.95 COC(=O)C1=CCC2=CC=CC=C21 023353 [0,1,0,0,1,0|0,0,1]=3 159 B14R2.95 COC(=O)C1=CNC2=CC=CC=C21 003455 [0,1,0,0,1,0|1,0,0]=3 160 B14R2.300 O=C(O)C1=CNC2=C1C=CC(Br)=C2 080050 [0,1,0,0,1,0|2,0,0]=4 161 B14R2.5816 O=C(O)C1=CNC2=C1C=C(Br)C=C2 037073 [0,1,0,0,1,0|2,0,0]=4 162 B14R2.5816 O=C(O)C1=CNC2=CC=C(Cl)C=C21 040487 [0,1,0,0,1,0|2,0,0]=4 163 B14R2.8032 O=C(O)C1=CNC2=C(Br)C=CC=C12 040861 [0,1,0,0,1,0|2,0,0]=4 164 B14R2.8032 O=C(O)C1=CNC2=C(Cl)C=CC=C12 040488 [0,1,0,0,1,0|2,0,0]=4 165 B14R2.25733 CN1C=C(C(=O)O)C2=C1C=CC=C2 078949 [0,1,0,0,1,0|2,0,0]=4 166 B14R2.601 CC(=O)C1=CC=C2NC(=O)SC2=C1 222571 [0,1,0,0,1,0|2,0,0]=4 167 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=C2 016239 [0,1,0,0,1,0|1,0,0]=3 168 B14R2.966 COC(=O)C1=CC2=C(C=C1)NC=N2 067042 [0,1,0,0,1,0|2,0,0]=4 169 B14R2.966 COC(=O)C1=CC2=C(C=C1)NN=C2 092973 [0,1,0,0,1,0|2,0,0]=4 170 B14R2.966 COC(=O)C1=CC2=C(C=CN2)C=C1 016240 [0,1,0,0,1,0|1,0,0]=3 171 B14R2.966 O=C(CBr)C1=CC=C2SC=CC2=C1 103146 [0,1,0,0,1,0|1,0,0]=3 172 B14R2.450 CC1=C(C(=O)Cl)OC2=CC=CC=C21 013630 [0,1,0,0,1,0|2,0,0]=4 173 B14R2.450 CC1=C(C(=O)O)OC2=CC=CC=C21 018818 [0,1,0,0,1,0|2,0,0]=4 174 B14R2.450 CC1=C(C(=O)[O-])OC2=CC=CC=C21 022117 [0,1,0,0,1,0|2,0,0]=4 175 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 077339 [0,1,0,0,1,0|2,0,0]=4 176 B14R2.450 O=C(Cl)C1=C(Cl)C2=C(C=CC=C2)S1 019062 [0,1,0,0,1,0|2,0,0]=4 177 B14R2.450 O=C(O)C1=C(Br)C2=CC=CC=C2N1 023842 [0,1,0,0,1,0|2,0,0]=4 178 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)S1 014581 [0,1,0,0,1,0|2,0,0]=4 179 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 047899 [0,1,0,0,1,0|2,0,0]=4 180 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 077200 [0,1,0,0,1,0|2,0,0]=4 181 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)N1 010193 [0,1,0,0,1,0|2,0,0]=4 182 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 321377 [0,1,0,0,1,0|2,0,0]=4 183 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2O1 066298 [0,1,0,0,1,0|2,0,0]=4 184 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 066291 [0,1,0,0,1,0|2,0,0]=4 185 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2O1 018361 [0,1,0,0,1,0|2,0,0]=4 186 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2S1 050233 [0,1,0,0,1,0|2,0,0]=4 187 B14R2.7969 CC(=O)C1=CC2=CC=CC(O)=C2O1 456363 [0,1,0,0,1,0|1,0,0]=3 188 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2Br)N1 079941 [0,1,0,0,1,0|2,0,0]=4 189 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2S1 010734 [0,1,0,0,1,0|2,0,0]=4 190 B16R2.5347 COC(=O)CC1=CC2=C(C=CC=C2)C=C1 101682 [0,1,0,0,0,1|0,0,0]=2 191 B16R2.1229 COC(=O)C1=C(O)C2=C(C=CC=C2)C=C1 350796 [0,2,0,0,0,0|0,0,0]=2 192 B16R2.1229 COC(=O)C1=C(O)C2=CC=CC=C2N=C1 092040 [0,2,0,0,0,0|1,0,0]=3 193 B16R2.12044 CC1=CC=C2OC=C(C(=O)O)C(=O)C2=C1 012042 [0,2,0,0,0,0|2,0,0]=4 194 B16R2.1612 COC1=CC2=CC=CC=C2C=C1C(=O)O 374715 [0,2,0,0,0,0|1,0,0]=3 195 B16R2.23521 O=C(O)C1=C(O)C=C2C=CC(O)=CC2=C1 223024 [0,2,0,0,0,0|1,0,0]=3 196 B16R2.23521 O=C(O)C1=CC2=CC(Br)=CC=C2OC1=O 012134 [0,2,0,0,0,0|2,0,0]=4 197 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2C=C1O 373507 [0,2,0,0,0,0|0,0,0]=2 198 B16R2.33941 NNC(=O)C1=C(O)C=C2C=CC=CC2=C1 226520 [0,2,0,0,0,0|1,0,0]=3 199 B16R2.33941 O=C(CBr)C1=CC2=CC=CC=C2OC1=O 369197 [0,2,0,0,0,0|1,0,0]=3 200 B16R2.126889 O=C(O)C1=CC2=CC=CC(O)=C2C=C1O 103054 [0,2,0,0,0,0|1,0,0]=3 201 B16R2.767 CCOC(=O)C1=CC2=CC=CC=C2C=C1 018687 [0,2,0,0,0,0|0,0,0]=2 202 B16R2.33799 COC(=O)C1=CC2=CC=C(O)C=C2C=C1 067140 [0,2,0,0,0,0|0,0,0]=2 203 B16R2.33799 COC(=O)C1=CC=C2C=C(Br)C=CC2=C1 212416 [0,2,0,0,0,0|0,0,0]=2 204 B16R2.173132 COC(=O)C1=CC2=NC=NC(O)=C2C=C1 230864 [0,2,0,0,0,0|2,0,0]=4 205 B16R2.11987 NC1=CC2=CC=C(S(=O)(=O)O)C=C2C=C1 241616 [0,2,0,0,0,0|2,0,0]=4 206 B16R2.7486 COC1=CC2=CC=C(C(=O)O)C=C2C=C1 022658 [0,2,0,0,0,0|1,0,0]=3 207 B16R2.7486 COC1=CC2=CC=C(C(C)=O)C=C2C=C1 077909 [0,2,0,0,0,0|0,0,0]=2 208 B16R2.7486 COC1=CC=C2C=C(C(C)O)C=CC2=C1 103496 [0,2,0,0,0,0|0,0,2]=4 209 B16R2.23501 CC1=CC=C2OC(C(=O)O)=CC(=O)C2=C1 012034 [0,2,0,0,0,0|2,0,0]=4 210 B16R2.23501 O=C(O)C1=CC(=O)C2=CC(Br)=CC=C2O1 012036 [0,2,0,0,0,0|2,0,0]=4 211 B16R2.23501 O=C(O)C1=CC(=O)C2=CC(Cl)=CC=C2O1 012035 [0,2,0,0,0,0|2,0,0]=4 212 B16R2.40082 COC1=C2C=CC=CC2=NC(C(=O)O)=C1 066330 [0,2,0,0,0,0|2,0,0]=4 213 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 237505 [0,0,1,1,0,0|2,0,0]=4 214 B14R2.31359 CC(=O)C1=C2C=CC=CC2=CC=C1 079037 [0,0,1,1,0,0|0,0,0]=2 215 B14R2.31359 CC(N)C1=C2C=CC=CC2=CC=C1 219511 [0,0,1,1,0,0|1,0,1]=4 216 B14R2.31359 CC(O)C1=C2C=CC=CC2=CC=C1 303344 [0,0,1,1,0,0|0,0,2]=4 217 B14R2.31359 CN(C)C1=CC=CC2=CC=CC=C21 003644 [0,0,1,1,0,0|2,0,0]=4 218 B14R2.31359 C[C@@H](N)C1=C2C=CC=CC2=CC=C1 046443 [0,0,1,1,0,0|1,0,1]=4 219 B14R2.31359 C[C@H](N)C1=C2C=CC=CC2=CC=C1 046444 [0,0,1,1,0,0|1,0,1]=4 220 B14R2.31359 NC(=O)C1=CC=CC2=CC=CC=C21 018890 [0,0,1,1,0,0|1,0,0]=3 221 B14R2.31359 NC(=S)C1=CC=CC2=CC=CC=C21 097864 [0,0,1,1,0,0|1,1,0]=4 222 B14R2.31359 O=C(Cl)C1=CC=CC2=C1C=CC=C2 013172 [0,0,1,1,0,0|1,0,0]=3 223 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=C1 209592 [0,0,1,1,0,0|1,0,0]=3 224 B14R2.31359 O=C(O)C1=C2C=CC=NC2=CC=C1 066328 [0,0,1,1,0,0|2,0,0]=4 225 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 093264 [0,0,1,1,0,0|2,0,0]=4 226 B14R2.31359 O=C(O)C1=CC=NC2=CC=CC=C21 066325 [0,0,1,1,0,0|2,0,0]=4 227 B14R2.31359 O=C(O)C1=NC=CC2=CC=CC=C21 019060 [0,0,1,1,0,0|2,0,0]=4 228 B14R2.31359 O=[N+]([O-])C1=C2C=CC=CC2=CC=C1 099415 [0,0,1,1,0,0|2,0,0]=4 229 B16R3.335 NC1=NC2=C(C=CC3=C2C=CC=C3)S1 358001 [0,0,0,1,0,1|2,0,0]=4 230 B16R3.335 NC1=NC2=C(S1)C3=C(C=CC=C3)C=C2 030009 [0,0,0,1,0,1|1,1,0]=4 231 B12R2.1 O=CC1=CNC2=C1C=CC=C2 036402 [1,0,0,0,1,0|1,0,0]=3 232 B12R2.1 O=CC1=CNC2=NC=CC=C12 035903 [1,0,0,0,1,0|2,0,0]=4 233 B12R2.1 O=CC1=CSC2=CC=CC=C12 065306 [1,0,0,0,1,0|1,0,0]=3 234 B12R2.1 O=CC1=NC=C2C=CC=CN21 095336 [1,0,0,0,1,0|2,0,0]=4 235 B12R2.32 O=CC1=CC2=C(C=CC=C2)S1 013717 [1,0,0,0,1,0|1,0,0]=3 236 B12R2.32 O=CC1=CC2=CC=CC=C2O1 036892 [1,0,0,0,1,0|1,0,0]=3 237 B12R2.32 O=CC1=CN2C=CC=CC2=N1 046410 [1,0,0,0,1,0|2,0,0]=4 238 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 033756 [1,0,0,0,1,0|2,0,0]=4 239 B12R2.44 COC1=CC2=C(C=C1)NC=C2 024491 [1,0,0,0,1,0|2,0,0]=4 240 B12R2.44 COC1=CC2=C(C=CN2)C=C1 013620 [1,0,0,0,1,0|2,0,0]=4 241 B12R2.44 CSC1=CC=C2NC=CC2=C1 040233 [1,0,0,0,1,0|2,0,0]=4 242 B12R2.44 O=CC1=CC2=C(C=C1)NC=C2 016156 [1,0,0,0,1,0|1,0,0]=3 243 B12R2.44 O=CC1=CC=C2C=CNC2=C1 040135 [1,0,0,0,1,0|1,0,0]=3 244 B14R2.1008 O=C(O)CC1=CC2=C(C=CN2)C=C1 226020 [0,0,0,0,1,1|2,0,0]=4 245 B16R2.477 CC(C)COC1=CC=C2C=CC=CC2=C1 243016 [0,0,0,0,0,2|1,0,1]=4 246 B16R2.477 O=C(O)COC1=CC=C2C=CC=CC2=C1 014522 [0,0,0,0,0,2|1,0,0]=3 247 B16R2.477 O=C(O)CSC1=CC=C2C=CC=CC2=C1 106303 [0,0,0,0,0,2|1,0,0]=3 248 B16R2.477 O=C(O)\C=C\C1=CC2=C(C=CC=C2)C=C1 011199 [0,0,0,0,0,2|1,0,0]=3