0 B10R1.18 CC(=O)NC1=NC=CC=C1 A14929 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 CN(C)CC1=CC=CC=C1 D18840 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.18 N=C(N)CC1=CC=CC=C1 P13924 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 N=C(N)CC1=CN=CC=C1 P13906 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.18 N=C(N)CC1=NC=CC=C1 P13905 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.18 N=C(N)NC1=CC=CC=C1 P8891 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.18 N=C(N)SC1=CC=CC=C1 P13914 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 C7929 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.18 NC(N)=NC1=CC=CC=C1 D8941 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.18 O=C(O)CC1=CC=CN=C1 P3052 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.18 O=C(O)CC1=CC=NC=C1 P7971 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.18 O=C(O)CC1=NC=CC=C1 P7970 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.18 O=C(O)CC1=NC=CC=N1 P14936 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.8 BrCCC1=CC=CC=C1 B1499 [1,0,0,0,0,0|1,0,1]=3 14 B9R1.8 BrCCC1=NC=CC=C1 B18468 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.8 CCC[N+]1=CC=CC=C1 P9114 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.8 CNCC1=CC=CC=C1 C12471 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.8 CNCC1=CN=CC=C1 M13405 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.8 C\N=C/C1=CC=CC=C1 B11532 [1,0,0,0,0,0|2,0,1]=4 19 B9R1.8 NCCC1=CC=CC=C1 P18797 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.8 NCCC1=CC=CC=C1 P19425 [1,0,0,0,0,0|1,0,1]=3 21 B9R1.8 NCCC1=CC=CC=N1 P3233 [1,0,0,0,0,0|2,0,1]=4 22 B9R1.8 NCCC1=CC=CN=C1 A18111 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.8 NCCC1=CC=NC=C1 A18195 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.8 NCCC1=CN=CC=C1 A12910 [1,0,0,0,0,0|2,0,1]=4 25 B9R1.8 NNCC1=CC=CC=C1 B8798 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.8 NOCC1=CC=CC=C1 B7490 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.8 NOCC1=CC=CC=C1 B7490 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.8 OCCC1=NC=CC=C1 P0121 [1,0,0,0,0,0|1,0,1]=3 29 B9R1.8 OCCC1=NC=CN=C1 H13361 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.8 O\N=C/C1=CC=CC=C1 B18348 [1,0,0,0,0,0|1,0,1]=3 31 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 A1579 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 A1916 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 A3877 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 I17180 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 B9590 [0,1,0,0,0,0|2,0,1]=4 36 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 T13930 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T2230 [0,1,0,0,0,0|0,0,0]=1 38 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 B13672 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 C13729 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.20 N=C(N)CC1=CC=C(I)C=C1 P13840 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.20 NC(=O)NC1=CC=C(N)C=C1 A18166 [0,1,0,0,0,0|2,0,0]=3 42 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 B10339 [0,1,0,0,0,0|2,1,0]=4 43 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 H7775 [0,1,0,0,0,0|2,1,0]=4 44 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 A0970 [0,1,0,0,0,0|0,0,0]=1 45 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 B10452 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 F7924 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B1332 [0,1,0,0,0,0|0,0,0]=1 48 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B1332 [0,1,0,0,0,0|0,0,0]=1 49 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C11770 [0,1,0,0,0,0|0,0,0]=1 50 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 F0757 [0,1,0,0,0,0|0,0,0]=1 51 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 H4994 [0,1,0,0,0,0|0,0,0]=1 52 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A5471 [0,1,0,0,0,0|0,0,1]=2 53 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A5471 [0,1,0,0,0,0|0,0,1]=2 54 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 P18879 [0,1,0,0,0,0|0,0,0]=1 55 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 A14115 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.36 NC(C(=O)O)C1=CN=CC=C1 A15477 [0,1,0,0,0,0|1,0,0]=2 57 B11R1.36 N[C@@H](C(=O)O)C1=CCC=CC1 D0215 [0,1,0,0,0,0|0,0,2]=3 58 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 P6188 [0,1,0,0,0,0|0,0,0]=1 59 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 P6912 [0,1,0,0,0,0|0,0,0]=1 60 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 P6912 [0,1,0,0,0,0|0,0,0]=1 61 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M5987 [0,1,0,0,0,0|0,0,0]=1 62 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M5987 [0,1,0,0,0,0|0,0,0]=1 63 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 M0801 [0,1,0,0,0,0|0,0,0]=1 64 B11R1.40 C(=O)\C(Br)=C\C1=CC=CC=C1 B0897 [0,1,0,0,0,0|1,0,1]=3 65 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 M17930 [0,1,0,0,0,0|1,0,1]=3 66 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 A2030 [0,1,0,0,0,0|1,0,1]=3 67 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P5891 [0,1,0,0,0,0|1,0,1]=3 68 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P5891 [0,1,0,0,0,0|1,0,1]=3 69 B11R1.40 N\C(CC1=NC=CC=C1)=N\O H13806 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C7816 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.86 CC(=O)NC1=NC=CC=C1Br B15307 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.86 CC(=O)NC1=NC=CC=C1O A15061 [0,1,0,0,0,0|3,0,0]=4 73 B11R1.86 CC(=O)NC1=[N+]([O-])C=CC=C1 O17203 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.86 CC(=O)OC1=C(Cl)C=CC=C1 C7844 [0,1,0,0,0,0|2,0,0]=3 75 B11R1.86 CC1=CC=CC=C1CC(=N)N T13940 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.86 CC1=CC=CC=C1CC(=O)O T4259 [0,1,0,0,0,0|0,0,0]=1 77 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 B10338 [0,1,0,0,0,0|2,1,0]=4 78 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 B3813 [0,1,0,0,0,0|0,0,0]=1 79 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 C7842 [0,1,0,0,0,0|0,0,0]=1 80 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 H1271 [0,1,0,0,0,0|0,0,0]=1 81 B11R1.86 O=C(O)CC1=CC=CC=C1F F1336 [0,1,0,0,0,0|0,0,0]=1 82 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 A1578 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 A0689 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.157 CC(=O)NC1=NC(Br)=CC=C1 B15302 [0,1,0,0,0,0|3,0,0]=4 85 B11R1.157 CC1=CC=CC(CC(=N)N)=C1 T13941 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 C16713 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.157 N=C(N)CC1=CC(F)=CC=C1 F14030 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.157 NC(=S)NC1=CC(Br)=CC=C1 B10340 [0,1,0,0,0,0|2,1,0]=4 89 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 H7774 [0,1,0,0,0,0|2,1,0]=4 90 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 A5096 [0,1,0,0,0,0|0,0,0]=1 91 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 B3814 [0,1,0,0,0,0|0,0,0]=1 92 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 C0700 [0,1,0,0,0,0|0,0,0]=1 93 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [0,1,0,0,0,0|0,0,0]=1 94 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [0,1,0,0,0,0|0,0,0]=1 95 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 B7832 [0,1,0,0,0,0|1,0,1]=3 96 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 P7869 [0,1,0,0,0,0|2,0,1]=4 97 B11R2.10 BrC1=NC2=CC=CC=C2N1 B14422 [0,0,0,1,0,0|3,0,0]=4 98 B11R2.10 BrC1=NC2=CC=CC=C2S1 B18485 [0,0,0,1,0,0|2,1,0]=4 99 B11R2.10 CC1CC2=CC=CC=C2N1 M1671 [0,0,0,1,0,0|2,0,1]=4 100 B11R2.10 ClC1=NC2=CC=CC=C2N1 C3376 [0,0,0,1,0,0|3,0,0]=4 101 B11R2.10 ClC1=NC2=CC=CC=C2S1 C1056 [0,0,0,1,0,0|2,1,0]=4 102 B11R2.10 ClC1=NC2=CC=CC=C2S1 C1056 [0,0,0,1,0,0|2,1,0]=4 103 B11R2.10 FC1=NC2=CC=CC=C2S1 F3369 [0,0,0,1,0,0|2,1,0]=4 104 B11R2.10 N1C2=CC=CC=C2N=C1C M1656 [0,0,0,1,0,0|3,0,0]=4 105 B11R2.10 NC1=CC2=C(C=CC=C2)N1 A11341 [0,0,0,1,0,0|2,0,1]=4 106 B11R2.10 NC1=NC2=C(C=CC=C2)N1 A3457 [0,0,0,1,0,0|3,0,0]=4 107 B11R2.10 NC1=NC2=CC=CC=C2S1 A5444 [0,0,0,1,0,0|2,1,0]=4 108 B11R2.10 O=C1CC2=C(C=CC=C2)N1 O2191 [0,0,0,1,0,0|1,0,0]=2 109 B11R2.10 O=C1CC2=CN=CC=C2N1 A12570 [0,0,0,1,0,0|2,0,0]=3 110 B11R2.10 O=C1NC2=C(C=CC=N2)O1 O5431 [0,0,0,1,0,0|2,0,0]=3 111 B11R2.10 O=C1NC2=C(C=CC=N2)O1 O5431 [0,0,0,1,0,0|2,0,0]=3 112 B11R2.10 O=C1NC2=CC=CC=C2N1 D11101 [0,0,0,1,0,0|2,0,0]=3 113 B11R2.10 O=C1NC2=CC=CC=C2O1 B0351 [0,0,0,1,0,0|1,0,0]=2 114 B11R2.10 O=C1NC2=CC=CC=C2S1 B13424 [0,0,0,1,0,0|1,1,0]=3 115 B11R2.10 SC1=NC2=C(C=CC=C2)O1 B5423 [0,0,0,1,0,0|1,1,0]=3 116 B11R2.10 SC1=NC2=CC=CC=C2N1 M0641 [0,0,0,1,0,0|2,1,0]=4 117 B9R1.6 CC(=O)C1=CN=CC=C1 P2763 [0,0,0,0,1,0|2,0,0]=3 118 B9R1.6 CC(=O)C1=CN=CC=N1 A0581 [0,0,0,0,1,0|3,0,0]=4 119 B9R1.6 CC(=O)C1=NC=CC=C1 A1164 [0,0,0,0,1,0|2,0,0]=3 120 B9R1.6 C[C@@H](N)C1=CC=CC=C1 M5022 [0,0,0,0,1,0|2,0,1]=4 121 B9R1.6 C[C@H](N)C1=CC=CC=C1 M5997 [0,0,0,0,1,0|2,0,1]=4 122 B9R1.6 N=C(N)C1=CC=CC=C1 B11293 [0,0,0,0,1,0|2,0,0]=3 123 B9R1.6 N=C(N)C1=CC=CC=C1 B13002 [0,0,0,0,1,0|2,0,0]=3 124 B9R1.6 N=C(N)C1=CC=CC=C1 T1538 [0,0,0,0,1,0|2,0,0]=3 125 B9R1.6 N=C(N)C1=CC=CN=C1 P13006 [0,0,0,0,1,0|3,0,0]=4 126 B9R1.6 N=C(N)C1=NC=CC=C1 P13904 [0,0,0,0,1,0|3,0,0]=4 127 B9R1.6 N=C(\C1=CC=NC=C1)N P13011 [0,0,0,0,1,0|3,0,0]=4 128 B9R1.6 NC(=O)C1=CC=NC=C1 P1409 [0,0,0,0,1,0|2,0,0]=3 129 B9R1.6 NC(=O)C1=CN=CN=C1 P17598 [0,0,0,0,1,0|3,0,0]=4 130 B9R1.6 NC(=O)C1=NC=CN=C1 P1326 [0,0,0,0,1,0|3,0,0]=4 131 B9R1.6 O=C(Cl)C1=CN=CC=N1 P12749 [0,0,0,0,1,0|3,0,0]=4 132 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [0,0,0,0,1,0|1,0,0]=2 133 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [0,0,0,0,1,0|1,0,0]=2 134 B9R1.6 O=C(O)C1=CC=NN=C1 P12249 [0,0,0,0,1,0|2,0,0]=3 135 B9R1.6 O=C(O)C1=CN=CN=C1 P12245 [0,0,0,0,1,0|2,0,0]=3 136 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [0,0,0,0,1,0|1,0,0]=2 137 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [0,0,0,0,1,0|1,0,0]=2 138 B9R1.6 O=C(O)C1=NC=CC=N1 P12246 [0,0,0,0,1,0|2,0,0]=3 139 B9R1.6 O=C(O)C1=NC=CN=C1 P4976 [0,0,0,0,1,0|2,0,0]=3 140 B9R1.6 O=C(O)C1=NC=NC=C1 P12243 [0,0,0,0,1,0|2,0,0]=3 141 B9R1.6 OB(O)C1=CC=CC=C1 N2145 [0,0,0,0,1,0|1,0,1]=3 142 B9R1.6 OB(O)C1=CC=CC=N1 P4048 [0,0,0,0,1,0|2,0,1]=4 143 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [0,0,0,0,1,0|2,0,1]=4 144 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [0,0,0,0,1,0|2,0,1]=4 145 B9R1.6 OB(O)C1=CC=NC=C1 P2873 [0,0,0,0,1,0|2,0,1]=4 146 B9R1.13 N=C(N)CC1=CC=CS1 T13938 [0,0,0,0,1,0|3,0,0]=4 147 B9R1.13 O=C(Cl)CC1=CC=CS1 T0852 [0,0,0,0,1,0|2,0,0]=3 148 B9R1.13 O=C(O)CC1=CC=CS1 T0647 [0,0,0,0,1,0|1,0,0]=2 149 B9R1.13 O=C(O)CC1=CNC=N1 I7550 [0,0,0,0,1,0|2,0,0]=3 150 B9R1.13 O=C(O)CC1=COC=C1 F15733 [0,0,0,0,1,0|1,0,0]=2 151 B9R1.13 O=C(O)CC1=CSC=C1 T5371 [0,0,0,0,1,0|1,0,0]=2 152 B9R1.13 O=C(O)CC1=CSC=N1 T17624 [0,0,0,0,1,0|2,0,0]=3 153 B9R1.13 O=C(O)CN1C=CN=C1 I7551 [0,0,0,0,1,0|2,0,0]=3 154 B9R1.13 O=C(O)CN1C=CN=C1 I7551 [0,0,0,0,1,0|2,0,0]=3 155 B9R1.13 O=C(O)CN1C=NC=N1 T3689 [0,0,0,0,1,0|3,0,0]=4 156 B11R1.91 CC(N)CCC1=CC=CC=C1 M0184 [0,0,0,0,0,1|2,0,1]=4 157 B11R1.91 N=C(N)CCC1=CN=CC=C1 P15961 [0,0,0,0,0,1|3,0,0]=4 158 B11R1.91 N=C(N)COC1=CC=CC=C1 P16903 [0,0,0,0,0,1|2,0,0]=3 159 B11R1.91 O=C(Cl)CSC1=CC=NC=C1 P10067 [0,0,0,0,0,1|2,0,0]=3 160 B11R1.91 O=C(Cl)\C=C\C1=CC=CN=C1 P4462 [0,0,0,0,0,1|2,0,1]=4 161 B11R1.91 O=C(O)CCC1=CC=CC=C1 P11665 [0,0,0,0,0,1|0,0,0]=1 162 B11R1.91 O=C(O)CCC1=NC=CC=C1 P14084 [0,0,0,0,0,1|1,0,0]=2 163 B11R1.91 O=C(O)CCC1=NC=CC=N1 P14965 [0,0,0,0,0,1|2,0,0]=3 164 B11R1.91 O=C(O)CNC1=CC=CC=C1 P17764 [0,0,0,0,0,1|0,0,0]=1 165 B11R1.91 O=C(O)CSC1=CC=CC=C1 T3907 [0,0,0,0,0,1|0,0,0]=1 166 B11R1.91 O=C(O)CSC1=CC=NC=C1 P3183 [0,0,0,0,0,1|1,0,0]=2 167 B11R1.91 O=C(O)CSC1=NC=CC=N1 P7830 [0,0,0,0,0,1|2,0,0]=3 168 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 P14394 [0,0,0,0,0,1|1,0,1]=3 169 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 P14396 [0,0,0,0,0,1|1,0,1]=3 170 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 S7823 [0,0,0,0,0,1|0,0,2]=3 171 B8R1.2 C#CC1=CC=CC=C1 P18887 [2,0,0,0,0,0|0,0,2]=4 172 B8R1.2 C(=O)C1=CC=CN=C1 P11581 [2,0,0,0,0,0|1,0,0]=3 173 B8R1.2 C(=O)C1=CC=NC=C1 P11582 [2,0,0,0,0,0|1,0,0]=3 174 B8R1.2 CC[N+]1=CC=CC=C1 E8507 [2,0,0,0,0,0|1,0,1]=4 175 B8R1.2 ClCC1=CC=CN=C1 C1770 [2,0,0,0,0,0|2,0,0]=4 176 B8R1.2 ClCC1=CC=NC=C1 C2804 [2,0,0,0,0,0|2,0,0]=4 177 B8R1.2 ClCC1=NC=CC=C1 C5538 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.2 NCC1=CC=CN=C1 P2319 [2,0,0,0,0,0|2,0,0]=4 179 B8R1.2 OCC1=CN=CN=C1 P17132 [2,0,0,0,0,0|2,0,0]=4 180 B8R1.2 OCC1=NC=CC=C1 P1495 [2,0,0,0,0,0|1,0,0]=3 181 B8R1.2 OCC1=NC=CC=N1 P17605 [2,0,0,0,0,0|2,0,0]=4 182 B8R1.2 OCC1=NC=NC=C1 P14938 [2,0,0,0,0,0|2,0,0]=4 183 B10R1.1 CNCC1=CC=C(F)C=C1 F17963 [1,1,0,0,0,0|2,0,0]=4 184 B10R1.1 ClC1=CC=C(CCBr)C=C1 B9884 [1,1,0,0,0,0|1,0,1]=4 185 B10R1.1 FC1=CC=C(CCBr)C=C1 B9148 [1,1,0,0,0,0|1,0,1]=4 186 B10R1.1 FC1=CC=C(CCCl)C=C1 C7477 [1,1,0,0,0,0|1,0,1]=4 187 B10R1.1 N#CCC1=CC=C(Br)C=C1 B0747 [1,1,0,0,0,0|1,0,1]=4 188 B10R1.1 N#CCC1=CC=C(Cl)C=C1 C18852 [1,1,0,0,0,0|1,0,1]=4 189 B10R1.1 N#CCC1=CC=C(F)C=C1 F0758 [1,1,0,0,0,0|1,0,1]=4 190 B10R1.1 N#CCC1=CC=C(N)C=C1 A0432 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.1 N#CCC1=CC=C(O)C=C1 H0435 [1,1,0,0,0,0|1,0,1]=4 192 B10R1.1 NC1=CC=C(CCO)C=C1 A6857 [1,1,0,0,0,0|0,0,1]=3 193 B10R1.1 NCCC1=CC=C(Br)C=C1 B2101 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.1 NCCC1=CC=C(Cl)C=C1 C2522 [1,1,0,0,0,0|1,0,1]=4 195 B10R1.1 NCCC1=CC=C(N)C=C1 A18081 [1,1,0,0,0,0|1,0,1]=4 196 B10R1.1 NCCC1=CC=C(N)C=C1 A18082 [1,1,0,0,0,0|1,0,1]=4 197 B10R1.1 NCCC1=CC=C(O)C=C1 T0145 [1,1,0,0,0,0|1,0,1]=4 198 B10R1.1 NCCC1=CC=C(O)C=C1 T0145 [1,1,0,0,0,0|1,0,1]=4 199 B10R1.1 OCCC1=CC=C(Br)C=C1 B18704 [1,1,0,0,0,0|0,0,1]=3 200 B10R1.1 OCCC1=CC=C(F)C=C1 F4316 [1,1,0,0,0,0|0,0,1]=3 201 B10R1.1 [C-]#[N+]CC1=CC=C(Br)C=C1 B8836 [1,1,0,0,0,0|2,0,0]=4 202 B10R1.4 ClC1=C(CCBr)C=CC=C1 B9886 [1,1,0,0,0,0|1,0,1]=4 203 B10R1.4 FC1=C(CCBr)C=CC=C1 B9149 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.4 N#CCC1=C(Br)C=CC=C1 B0604 [1,1,0,0,0,0|1,0,1]=4 205 B10R1.4 N#CCC1=CC=CC=C1Cl C5020 [1,1,0,0,0,0|1,0,1]=4 206 B10R1.4 N#CCC1=CC=CC=C1F F3993 [1,1,0,0,0,0|1,0,1]=4 207 B10R1.4 NCCC1=CC=CC=C1N A18075 [1,1,0,0,0,0|1,0,1]=4 208 B10R1.4 NCCC1=CC=CC=C1N A18076 [1,1,0,0,0,0|1,0,1]=4 209 B10R1.4 NCCC1=CC=CC=C1O A15642 [1,1,0,0,0,0|1,0,1]=4 210 B10R1.4 O=C=NC1=C(Br)C=CC=C1 B8927 [1,1,0,0,0,0|1,0,1]=4 211 B10R1.4 O\N=C\C1=CC=CC=C1Cl C11090 [1,1,0,0,0,0|1,0,1]=4 212 B10R1.10 ClC1=CC(CCBr)=CC=C1 C9887 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.10 N#CCC1=CC(N)=CC=C1 A0433 [1,1,0,0,0,0|1,0,1]=4 214 B10R1.10 N#CCC1=CC=CC(Br)=C1 B1331 [1,1,0,0,0,0|1,0,1]=4 215 B10R1.10 N#CCC1=CC=CC(Cl)=C1 C18898 [1,1,0,0,0,0|1,0,1]=4 216 B10R1.10 N#CCC1=CC=CC(F)=C1 F1335 [1,1,0,0,0,0|1,0,1]=4 217 B10R1.10 NCCC1=CC(F)=CC=C1 F11687 [1,1,0,0,0,0|1,0,1]=4 218 B10R1.10 NCCC1=CC(F)=CC=C1 F11687 [1,1,0,0,0,0|1,0,1]=4 219 B10R1.10 NCCC1=CC(N)=CC=C1 A18201 [1,1,0,0,0,0|1,0,1]=4 220 B10R1.10 NCCC1=CC=CC(Br)=C1 B18673 [1,1,0,0,0,0|1,0,1]=4 221 B10R1.10 NCCC1=CC=CC(O)=C1 H7973 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 E6698 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.15 CC[C@H](N)C1=CC=CC=C1 E6699 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A14785 [1,1,0,0,0,0|1,0,1]=4 225 B10R1.15 NC[C@H](O)C1=CC=CC=C1 A18262 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.15 N\C(=N\O)C1=CC=CC=C1 B13505 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 P4802 [1,1,0,0,0,0|0,0,1]=3 228 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P4801 [1,1,0,0,0,0|0,0,1]=3 229 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P4801 [1,1,0,0,0,0|0,0,1]=3 230 B10R1.15 [C@@H](N)(CO)C1=CC=CC=C1 P5892 [1,1,0,0,0,0|0,0,1]=3 231 B10R1.15 [C@@H](N)(CO)C1=CC=CC=C1 P5892 [1,1,0,0,0,0|0,0,1]=3 232 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 P1975 [1,1,0,0,0,0|0,0,1]=3 233 B10R1.17 BrCCOC1=CC=CC=C1 B3358 [1,1,0,0,0,0|1,0,1]=4 234 B10R1.17 BrCCOC1=CC=CC=C1 B3358 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.17 CNCCC1=CC=CC=C1 M12421 [1,1,0,0,0,0|1,0,1]=4 236 B10R1.17 ClCCOC1=CC=CC=C1 C3357 [1,1,0,0,0,0|1,0,1]=4 237 B10R1.17 ClCOCC1=CC=CC=C1 B7431 [1,1,0,0,0,0|1,0,1]=4 238 B10R1.17 NCCOC1=CC=CC=C1 P3356 [1,1,0,0,0,0|1,0,1]=4 239 B10R1.17 OCCOC1=CC=CC=C1 P2904 [1,1,0,0,0,0|0,0,1]=3 240 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F1700 [0,1,0,0,1,0|1,0,0]=3 241 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A18848 [0,1,0,0,1,0|1,0,0]=3 242 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B11426 [0,1,0,0,1,0|2,0,0]=4 243 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 C1062 [0,1,0,0,1,0|1,0,1]=4 244 B10R1.13 CC1=CC=C(B(O)O)C=C1 T4039 [0,1,0,0,1,0|1,0,1]=4 245 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M13863 [0,1,0,0,1,0|2,0,0]=4 246 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 M18854 [0,1,0,0,1,0|1,0,0]=3 247 B10R1.13 CC1=CC=C(C(=O)O)C=N1 M5526 [0,1,0,0,1,0|1,0,0]=3 248 B10R1.13 CC1=CC=C(C(=O)O)C=N1 M5526 [0,1,0,0,1,0|1,0,0]=3 249 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M0470 [0,1,0,0,1,0|2,0,0]=4 250 B10R1.13 CC1=NC=C(C(=O)O)C=N1 M12568 [0,1,0,0,1,0|2,0,0]=4 251 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B13676 [0,1,0,0,1,0|2,0,0]=4 252 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C13004 [0,1,0,0,1,0|2,0,0]=4 253 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F12780 [0,1,0,0,1,0|2,0,0]=4 254 B10R1.13 N=C(N)C1=CC=C(I)C=C1 I16414 [0,1,0,0,1,0|2,0,0]=4 255 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A18192 [0,1,0,0,1,0|2,0,0]=4 256 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A9362 [0,1,0,0,1,0|2,0,0]=4 257 B10R1.13 N=C(N)C1=CC=C(O)C=C1 C7930 [0,1,0,0,1,0|2,0,0]=4 258 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H13795 [0,1,0,0,1,0|2,0,0]=4 259 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C18869 [0,1,0,0,1,0|1,0,0]=3 260 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A0176 [0,1,0,0,1,0|1,0,0]=3 261 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 B9721 [0,1,0,0,1,0|1,1,0]=4 262 B10R1.13 NC(=S)C1=CC=C(N)C=C1 A5434 [0,1,0,0,1,0|1,1,0]=4 263 B10R1.13 NC1=CC=C(C(=O)O)C=C1 A11243 [0,1,0,0,1,0|0,0,0]=2 264 B10R1.13 NC1=CC=C(C(=O)O)C=C1 A11243 [0,1,0,0,1,0|0,0,0]=2 265 B10R1.13 NC1=CC=C(C(=O)O)C=N1 A7302 [0,1,0,0,1,0|1,0,0]=3 266 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A19387 [0,1,0,0,1,0|0,0,1]=3 267 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A14646 [0,1,0,0,1,0|1,0,0]=3 268 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A4099 [0,1,0,0,1,0|1,0,0]=3 269 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A4099 [0,1,0,0,1,0|1,0,0]=3 270 B10R1.13 NC1=CN=C(C(=O)O)N=C1 A15426 [0,1,0,0,1,0|2,0,0]=4 271 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A14647 [0,1,0,0,1,0|1,0,0]=3 272 B10R1.13 NC1=NC=C(C(=O)O)C=N1 A14683 [0,1,0,0,1,0|2,0,0]=4 273 B10R1.13 NC1=NN=C(C(=O)O)C=C1 A15424 [0,1,0,0,1,0|2,0,0]=4 274 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 B2712 [0,1,0,0,1,0|1,0,0]=3 275 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 C18851 [0,1,0,0,1,0|1,0,0]=3 276 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 F7471 [0,1,0,0,1,0|1,0,0]=3 277 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 B0745 [0,1,0,0,1,0|0,0,0]=2 278 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 B9108 [0,1,0,0,1,0|1,0,0]=3 279 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 C2910 [0,1,0,0,1,0|1,0,0]=3 280 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 C2910 [0,1,0,0,1,0|1,0,0]=3 281 B10R1.13 O=C(O)C1=CC=C(F)C=C1 F0172 [0,1,0,0,1,0|0,0,0]=2 282 B10R1.13 O=C(O)C1=CC=C(I)C=C1 I4019 [0,1,0,0,1,0|0,0,0]=2 283 B10R1.13 O=C(O)C1=CC=C(O)C=N1 H14882 [0,1,0,0,1,0|1,0,0]=3 284 B10R1.13 O=C(O)C1=CC=C(O)N=C1 H5358 [0,1,0,0,1,0|1,0,0]=3 285 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M3209 [0,1,0,0,1,0|0,0,0]=2 286 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M3209 [0,1,0,0,1,0|0,0,0]=2 287 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B2892 [0,1,0,0,1,0|1,0,0]=3 288 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 B14545 [0,1,0,0,1,0|2,0,0]=4 289 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 C17460 [0,1,0,0,1,0|1,0,0]=3 290 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 C14005 [0,1,0,0,1,0|2,0,0]=4 291 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 S7517 [0,1,0,0,1,0|0,0,1]=3 292 B10R1.13 O=S([O-])C1=CC=C(Cl)C=C1 C8973 [0,1,0,0,1,0|1,0,1]=4 293 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 C1352 [0,1,0,0,1,0|1,0,1]=4 294 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 F11154 [0,1,0,0,1,0|1,0,1]=4 295 B10R1.13 OB(O)C1=CC=C(Br)C=C1 B5337 [0,1,0,0,1,0|1,0,1]=4 296 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 C0706 [0,1,0,0,1,0|1,0,1]=4 297 B10R1.13 OB(O)C1=CC=C(F)C=C1 F0294 [0,1,0,0,1,0|1,0,1]=4 298 B10R1.13 OB(O)C1=CC=C(O)C=C1 H12503 [0,1,0,0,1,0|1,0,1]=4 299 B10R1.61 CC(=O)C1=CC=CC=C1Br B8980 [0,1,0,0,1,0|1,0,0]=3 300 B10R1.61 CC(=O)C1=CC=CC=C1F F0912 [0,1,0,0,1,0|1,0,0]=3 301 B10R1.61 CC(=O)C1=CC=CC=C1N A0266 [0,1,0,0,1,0|1,0,0]=3 302 B10R1.61 CC(=O)C1=CC=CN=C1N A7312 [0,1,0,0,1,0|2,0,0]=4 303 B10R1.61 CC(=O)C1=NC=CC=C1N A12969 [0,1,0,0,1,0|2,0,0]=4 304 B10R1.61 CC1=C(C(=O)O)C=CN=C1 M12881 [0,1,0,0,1,0|1,0,0]=3 305 B10R1.61 CC1=CC=CC=C1B(O)O T4038 [0,1,0,0,1,0|1,0,1]=4 306 B10R1.61 CC1=CC=CC=C1C(=N)N M13850 [0,1,0,0,1,0|2,0,0]=4 307 B10R1.61 CC1=CC=CC=C1C(=O)Cl M18896 [0,1,0,0,1,0|1,0,0]=3 308 B10R1.61 CC1=CC=CN=C1C(=O)O M17500 [0,1,0,0,1,0|1,0,0]=3 309 B10R1.61 CC1=NC=CC=C1C(=O)O M17501 [0,1,0,0,1,0|1,0,0]=3 310 B10R1.61 N=C(N)C1=C(O)C=CC=C1 H13821 [0,1,0,0,1,0|2,0,0]=4 311 B10R1.61 N=C(N)C1=CC=CC=C1Br B13674 [0,1,0,0,1,0|2,0,0]=4 312 B10R1.61 N=C(N)C1=CC=CC=C1Cl C13733 [0,1,0,0,1,0|2,0,0]=4 313 B10R1.61 N=C(N)C1=CC=CC=C1F F14049 [0,1,0,0,1,0|2,0,0]=4 314 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 B9015 [0,1,0,0,1,0|1,0,0]=3 315 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 C18868 [0,1,0,0,1,0|1,0,0]=3 316 B10R1.61 NC(=O)C1=C(O)C=CC=C1 S1278 [0,1,0,0,1,0|1,0,0]=3 317 B10R1.61 NC(=O)C1=CC=CC=C1N A16466 [0,1,0,0,1,0|1,0,0]=3 318 B10R1.61 NC(=O)C1=NC=CC=C1N A16469 [0,1,0,0,1,0|2,0,0]=4 319 B10R1.61 NC(=O)C1=NC=CC=C1O H17175 [0,1,0,0,1,0|2,0,0]=4 320 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 B9723 [0,1,0,0,1,0|1,1,0]=4 321 B10R1.61 NC1=C(C(=O)O)C=CN=C1 A13797 [0,1,0,0,1,0|1,0,0]=3 322 B10R1.61 NC1=C(C(=O)O)C=NC=N1 A12837 [0,1,0,0,1,0|2,0,0]=4 323 B10R1.61 NC1=CC=CC=C1B(O)O A18186 [0,1,0,0,1,0|1,0,1]=4 324 B10R1.61 NC1=CC=CN=C1C(=O)O A11570 [0,1,0,0,1,0|1,0,0]=3 325 B10R1.61 NC1=NC=CC=C1C(=O)O A2326 [0,1,0,0,1,0|1,0,0]=3 326 B10R1.61 NC1=NC=CC=C1C(=O)O A2326 [0,1,0,0,1,0|1,0,0]=3 327 B10R1.61 NC1=NC=CN=C1C(=O)O A2119 [0,1,0,0,1,0|2,0,0]=4 328 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 B9882 [0,1,0,0,1,0|1,0,0]=3 329 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 C2477 [0,1,0,0,1,0|2,0,0]=4 330 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 F7469 [0,1,0,0,1,0|1,0,0]=3 331 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 B9109 [0,1,0,0,1,0|1,0,0]=3 332 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 B9110 [0,1,0,0,1,0|1,0,0]=3 333 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 C5345 [0,1,0,0,1,0|1,0,0]=3 334 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 C17301 [0,1,0,0,1,0|1,0,0]=3 335 B10R1.61 O=C(O)C1=C(O)C=CC=C1 S1290 [0,1,0,0,1,0|0,0,0]=2 336 B10R1.61 O=C(O)C1=CC=CC=C1F F1796 [0,1,0,0,1,0|0,0,0]=2 337 B10R1.61 O=C(O)C1=CC=CC=C1I I1314 [0,1,0,0,1,0|0,0,0]=2 338 B10R1.61 O=C(O)C1=CC=CN=C1Cl C4998 [0,1,0,0,1,0|1,0,0]=3 339 B10R1.61 O=C(O)C1=CC=CN=C1F F11719 [0,1,0,0,1,0|1,0,0]=3 340 B10R1.61 O=C(O)C1=CC=CN=C1O H2508 [0,1,0,0,1,0|1,0,0]=3 341 B10R1.61 O=C(O)C1=CC=CN=C1S M5419 [0,1,0,0,1,0|1,0,0]=3 342 B10R1.61 O=C(O)C1=CC=NC=C1Br B9107 [0,1,0,0,1,0|1,0,0]=3 343 B10R1.61 O=C(O)C1=N(O)C=CC=C1 P17505 [0,1,0,0,1,0|1,0,0]=3 344 B10R1.61 O=C(O)C1=NC=CC=C1Cl C17308 [0,1,0,0,1,0|1,0,0]=3 345 B10R1.61 O=C(O)C1=NC=CC=C1O H5458 [0,1,0,0,1,0|1,0,0]=3 346 B10R1.61 O=C(O)C1=NC=CN=C1Cl C12255 [0,1,0,0,1,0|2,0,0]=4 347 B10R1.61 O=C(O)C1=NC=CN=C1O H7209 [0,1,0,0,1,0|2,0,0]=4 348 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 S7518 [0,1,0,0,1,0|0,0,1]=3 349 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 C1351 [0,1,0,0,1,0|1,0,1]=4 350 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F F11152 [0,1,0,0,1,0|1,0,1]=4 351 B10R1.61 OB(O)C1=C(Br)C=CC=C1 B5382 [0,1,0,0,1,0|1,0,1]=4 352 B10R1.61 OB(O)C1=CC=CC=C1Cl C3844 [0,1,0,0,1,0|1,0,1]=4 353 B10R1.61 OB(O)C1=CC=CC=C1F F3994 [0,1,0,0,1,0|1,0,1]=4 354 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 B8981 [0,1,0,0,1,0|1,0,0]=3 355 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 A11417 [0,1,0,0,1,0|2,0,0]=4 356 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F0654 [0,1,0,0,1,0|1,0,0]=3 357 B10R1.113 CC(=O)C1=CC=CC(N)=C1 A0078 [0,1,0,0,1,0|1,0,0]=3 358 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 A11415 [0,1,0,0,1,0|2,0,0]=4 359 B10R1.113 CC(=O)C1=NC=CC(C)=C1 A11428 [0,1,0,0,1,0|2,0,0]=4 360 B10R1.113 CC1=CC(B(O)O)=CC=C1 T0344 [0,1,0,0,1,0|1,0,1]=4 361 B10R1.113 CC1=CC(C(=N)N)=CC=C1 M13856 [0,1,0,0,1,0|2,0,0]=4 362 B10R1.113 CC1=CC(C(=N)N)=CC=C1 M19426 [0,1,0,0,1,0|2,0,0]=4 363 B10R1.113 CC1=CC(C(=O)Cl)=CC=C1 M18897 [0,1,0,0,1,0|1,0,0]=3 364 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M11540 [0,1,0,0,1,0|1,0,0]=3 365 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M11540 [0,1,0,0,1,0|1,0,0]=3 366 B10R1.113 CC1=CC(C(=O)O)=NC=C1 M17497 [0,1,0,0,1,0|1,0,0]=3 367 B10R1.113 CC1=CC=CC(C(=O)O)=N1 M17496 [0,1,0,0,1,0|1,0,0]=3 368 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 B13675 [0,1,0,0,1,0|2,0,0]=4 369 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 C13735 [0,1,0,0,1,0|2,0,0]=4 370 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F14047 [0,1,0,0,1,0|2,0,0]=4 371 B10R1.113 NC(=O)C1=CC(N)=CC=C1 A0175 [0,1,0,0,1,0|1,0,0]=3 372 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 C7888 [0,1,0,0,1,0|1,1,0]=4 373 B10R1.113 NC1=CC(C(=O)O)=CC=C1 A11244 [0,1,0,0,1,0|0,0,0]=2 374 B10R1.113 NC1=CC=CC(B(O)O)=C1 A5500 [0,1,0,0,1,0|1,0,1]=4 375 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 N1381 [0,1,0,0,1,0|1,0,1]=4 376 B10R1.113 NC1=CN=CC(C(=O)O)=C1 A2778 [0,1,0,0,1,0|1,0,0]=3 377 B10R1.113 NC1=CN=CC(C(=O)O)=C1 A2778 [0,1,0,0,1,0|1,0,0]=3 378 B10R1.113 NC1=NC(C(=O)O)=CC=C1 A11777 [0,1,0,0,1,0|1,0,0]=3 379 B10R1.113 NC1=NC=CC(C(=O)O)=C1 A11776 [0,1,0,0,1,0|1,0,0]=3 380 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 B9883 [0,1,0,0,1,0|1,0,0]=3 381 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 C18856 [0,1,0,0,1,0|1,0,0]=3 382 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 F7470 [0,1,0,0,1,0|1,0,0]=3 383 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 B9063 [0,1,0,0,1,0|0,0,0]=2 384 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 B5429 [0,1,0,0,1,0|1,0,0]=3 385 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 B2652 [0,1,0,0,1,0|1,0,0]=3 386 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 C7453 [0,1,0,0,1,0|1,0,0]=3 387 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 C3228 [0,1,0,0,1,0|1,0,0]=3 388 B10R1.113 O=C(O)C1=CC(F)=CN=C1 F17488 [0,1,0,0,1,0|1,0,0]=3 389 B10R1.113 O=C(O)C1=CC(F)=NC=C1 F17489 [0,1,0,0,1,0|1,0,0]=3 390 B10R1.113 O=C(O)C1=CC(O)=CC=C1 H16582 [0,1,0,0,1,0|0,0,0]=2 391 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H11542 [0,1,0,0,1,0|1,0,0]=3 392 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 C7454 [0,1,0,0,1,0|1,0,0]=3 393 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F0060 [0,1,0,0,1,0|0,0,0]=2 394 B10R1.113 O=C(O)C1=CC=CC(I)=C1 I4018 [0,1,0,0,1,0|0,0,0]=2 395 B10R1.113 O=C(O)C1=CC=CC(S)=C1 M11264 [0,1,0,0,1,0|0,0,0]=2 396 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H2614 [0,1,0,0,1,0|1,0,0]=3 397 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H2614 [0,1,0,0,1,0|1,0,0]=3 398 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 B2833 [0,1,0,0,1,0|1,0,0]=3 399 B10R1.113 O=C(O)C1=NC(F)=CC=C1 F17487 [0,1,0,0,1,0|1,0,0]=3 400 B10R1.113 O=C(O)C1=NC(O)=CC=C1 H4016 [0,1,0,0,1,0|1,0,0]=3 401 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B2851 [0,1,0,0,1,0|1,0,0]=3 402 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B2851 [0,1,0,0,1,0|1,0,0]=3 403 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C12505 [0,1,0,0,1,0|1,0,0]=3 404 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C12505 [0,1,0,0,1,0|1,0,0]=3 405 B10R1.113 O=C(O)C1=NC=CC(I)=C1 I12208 [0,1,0,0,1,0|1,0,0]=3 406 B10R1.113 O=C(O)C1=NC=CC(O)=C1 H17493 [0,1,0,0,1,0|1,0,0]=3 407 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 C1350 [0,1,0,0,1,0|1,0,1]=4 408 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 N0309 [0,1,0,0,1,0|1,0,1]=4 409 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 B0312 [0,1,0,0,1,0|1,0,1]=4 410 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 F11153 [0,1,0,0,1,0|1,0,1]=4 411 B10R1.113 OB(O)C1=CC(Br)=CC=C1 B5439 [0,1,0,0,1,0|1,0,1]=4 412 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 C2120 [0,1,0,0,1,0|1,0,1]=4 413 B10R1.113 OB(O)C1=CC=CC(F)=C1 F3995 [0,1,0,0,1,0|1,0,1]=4 414 B10R1.23 NC(C(=O)O)C1=CSC=C1 A17994 [0,1,0,0,1,0|1,0,0]=3 415 B10R1.23 N[C@H](C(=O)O)C1=CC=CS1 A12787 [0,1,0,0,1,0|1,0,0]=3 416 B10R1.23 O=C(O)C(=O)C1=CC=CS1 T7418 [0,1,0,0,1,0|1,0,1]=4 417 B10R1.54 CC1=CC(CC(=O)O)=NN1 M14951 [0,1,0,0,1,0|2,0,0]=4 418 B10R1.54 NC1=NC(CC(=O)O)=CS1 A4723 [0,1,0,0,1,0|2,0,0]=4 419 B10R1.54 NC1=NC(CC(=O)O)=CS1 A6861 [0,1,0,0,1,0|2,0,0]=4 420 B10R1.54 NC1=NNC(CC(=O)O)=C1 A13746 [0,1,0,0,1,0|2,0,0]=4 421 B10R1.54 NC1=NNC(CC(=O)O)=C1 A13746 [0,1,0,0,1,0|2,0,0]=4 422 B10R1.64 CC1=C(CC(=O)O)SC=N1 M2421 [0,1,0,0,1,0|2,0,0]=4 423 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 H0461 [0,1,0,0,0,1|1,0,0]=3 424 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 M3913 [0,1,0,0,0,1|0,0,0]=2 425 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 M0221 [0,1,0,0,0,1|0,0,1]=3 426 B12R1.21 N=C(N)COC1=CC=C(Cl)C=C1 C14734 [0,1,0,0,0,1|2,0,0]=4 427 B12R1.21 NC(=O)NCC1=CC=C(N)C=C1 A17898 [0,1,0,0,0,1|1,0,0]=3 428 B12R1.21 NC1=CC=C(\C=C\C(=O)O)C=C1 A7581 [0,1,0,0,0,1|0,0,1]=3 429 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 B10266 [0,1,0,0,0,1|0,0,0]=2 430 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 C8385 [0,1,0,0,0,1|0,0,0]=2 431 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 F2688 [0,1,0,0,0,1|0,0,0]=2 432 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 H0304 [0,1,0,0,0,1|0,0,0]=2 433 B12R1.21 O=C(O)COC1=CC=C(Br)C=C1 B1089 [0,1,0,0,0,1|0,0,0]=2 434 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 F5239 [0,1,0,0,0,1|0,0,0]=2 435 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 I0062 [0,1,0,0,0,1|0,0,0]=2 436 B12R1.21 O=C(O)COC1=NNC(=O)C=C1 O15905 [0,1,0,0,0,1|2,0,0]=4 437 B12R1.21 O=C(O)CSC1=CC=C(Cl)C=C1 C13273 [0,1,0,0,0,1|0,0,0]=2 438 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 F0226 [0,1,0,0,0,1|0,0,1]=3 439 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 H0216 [0,1,0,0,0,1|0,0,1]=3 440 B12R1.27 CC(CO)NCC1=CC=CC=C1 B14686 [0,1,0,0,0,1|1,0,1]=4 441 B12R1.27 CCC(=O)CCC1=CC=CC=C1 P7542 [0,1,0,0,0,1|1,0,0]=3 442 B12R1.27 CNC(=S)NCC1=CC=CC=C1 B8222 [0,1,0,0,0,1|1,1,0]=4 443 B12R1.27 NCC(=O)OCC1=CC=CC=C1 B9098 [0,1,0,0,0,1|1,0,0]=3 444 B12R1.27 NCC(O)COC1=CC=CC=C1 A13152 [0,1,0,0,0,1|1,0,1]=4 445 B12R1.27 NNC(=O)OCC1=CC=CC=C1 B7715 [0,1,0,0,0,1|1,0,0]=3 446 B12R1.27 NNC(=S)NCC1=CC=CC=C1 B8255 [0,1,0,0,0,1|1,1,0]=4 447 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B7538 [0,1,0,0,0,1|0,0,0]=2 448 B12R1.43 CC(CC1=CC=NC=N1)C(=O)O M14751 [0,1,0,0,0,1|2,0,0]=4 449 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O M14643 [0,1,0,0,0,1|2,0,0]=4 450 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O P0034 [0,1,0,0,0,1|1,0,0]=3 451 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O A5988 [0,1,0,0,0,1|0,0,0]=2 452 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P0032 [0,1,0,0,0,1|1,0,0]=3 453 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O P7721 [0,1,0,0,0,1|1,0,0]=3 454 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O P7717 [0,1,0,0,0,1|1,0,0]=3 455 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O P0823 [0,1,0,0,0,1|0,0,0]=2 456 B12R1.43 N[C@H](CC1=CC=CC=N1)C(=O)O P7716 [0,1,0,0,0,1|1,0,0]=3 457 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O P0033 [0,1,0,0,0,1|1,0,0]=3 458 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O P7720 [0,1,0,0,0,1|1,0,0]=3 459 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 P7705 [0,1,0,0,0,1|0,0,0]=2 460 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 H7711 [0,1,0,0,0,1|0,0,0]=2 461 B12R1.43 O=C([O-])C(=O)CC1=CC=CC=C1 P1200 [0,1,0,0,0,1|0,0,1]=3 462 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 A1934 [0,1,0,0,0,1|1,0,0]=3 463 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 A14509 [0,1,0,0,0,1|1,0,0]=3 464 B12R1.107 NC(CC(=O)O)C1=CN=CN=C1 A14522 [0,1,0,0,0,1|2,0,0]=4 465 B12R1.107 NC(CC(=O)O)C1=NC=CC=C1 A14654 [0,1,0,0,0,1|1,0,0]=3 466 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 A12635 [0,1,0,0,0,1|0,0,0]=2 467 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CN=C1 A1932 [0,1,0,0,0,1|1,0,0]=3 468 B12R1.107 N[C@H](CC(=O)O)C1=CC=CN=C1 A1933 [0,1,0,0,0,1|1,0,0]=3 469 B12R1.107 O=C(C[N+](=O)[O-])C1=CC=CC=C1 B7666 [0,1,0,0,0,1|1,0,1]=4 470 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 H14844 [0,1,0,0,0,1|0,0,0]=2 471 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 M7536 [0,1,0,0,0,1|0,0,1]=3 472 B12R1.125 NC1=C(\C=C\C(=O)O)C=CC=N1 A14657 [0,1,0,0,0,1|1,0,1]=4 473 B12R1.125 O=C(Cl)\C=C\C1=C(Cl)C=CC=C1 C9064 [0,1,0,0,0,1|1,0,1]=4 474 B12R1.125 O=C(O)CCC1=CC=CC=C1Br B10264 [0,1,0,0,0,1|0,0,0]=2 475 B12R1.125 O=C(O)CCC1=CC=CC=C1F F2686 [0,1,0,0,0,1|0,0,0]=2 476 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 H7620 [0,1,0,0,0,1|0,0,1]=3 477 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl C1634 [0,1,0,0,0,1|0,0,1]=3 478 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F F2690 [0,1,0,0,0,1|0,0,1]=3 479 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 A1801 [0,1,0,0,0,1|0,0,0]=2 480 B12R1.226 NC1=NC(CCC(=O)O)=CC=C1 A14728 [0,1,0,0,0,1|1,0,0]=3 481 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 H7709 [0,1,0,0,0,1|0,0,0]=2 482 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 B10265 [0,1,0,0,0,1|0,0,0]=2 483 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F2687 [0,1,0,0,0,1|0,0,0]=2 484 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 C17836 [0,1,0,0,0,1|0,0,0]=2 485 B12R1.226 O=C(O)COC1=CC(F)=CC=C1 F17844 [0,1,0,0,0,1|0,0,0]=2 486 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 C8303 [0,1,0,0,0,1|0,0,1]=3 487 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 B3797 [0,1,0,0,0,1|0,0,1]=3 488 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 F0985 [0,1,0,0,0,1|0,0,1]=3 489 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 H4009 [0,1,0,0,0,1|0,0,1]=3 490 B12R1.4 CC(=O)CC1=CC=C(C#N)C=C1 C13033 [0,2,0,0,0,0|1,0,0]=3 491 B12R1.4 CC(=O)NC1=CC=C(C#N)C=C1 A7494 [0,2,0,0,0,0|2,0,0]=4 492 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 A0738 [0,2,0,0,0,0|2,0,0]=4 493 B12R1.4 CCC1=CC=C(CC(=N)N)C=C1 E14094 [0,2,0,0,0,0|2,0,0]=4 494 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 E7545 [0,2,0,0,0,0|1,0,0]=3 495 B12R1.4 COC1=CC=C(CC(=N)N)C=C1 M13849 [0,2,0,0,0,0|2,0,0]=4 496 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 M4993 [0,2,0,0,0,0|0,0,0]=2 497 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 M1760 [0,2,0,0,0,0|1,0,0]=3 498 B12R1.4 CSC1=CC=C(CC(=N)N)C=C1 M13860 [0,2,0,0,0,0|2,0,0]=4 499 B12R1.4 O=C(O)CC1=CC=C(CCl)C=C1 C8389 [0,2,0,0,0,0|0,0,0]=2 500 B12R1.19 CC(=O)NC1=CC(N)=C(Cl)C=C1 A8391 [0,2,0,0,0,0|2,0,0]=4 501 B12R1.19 CC(=O)NC1=CC=C(C)C(C)=C1 A18038 [0,2,0,0,0,0|2,0,0]=4 502 B12R1.19 CC1=CC=C(CC(=N)N)C=C1C D13642 [0,2,0,0,0,0|2,0,0]=4 503 B12R1.19 N=C(N)CC1=CC=C(Cl)C(Cl)=C1 D13774 [0,2,0,0,0,0|2,0,0]=4 504 B12R1.19 NC1=C(Cl)C=CC(CC(=O)O)=C1 A12846 [0,2,0,0,0,0|0,0,0]=2 505 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 B10333 [0,2,0,0,0,0|0,0,0]=2 506 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 D9231 [0,2,0,0,0,0|0,0,0]=2 507 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 C8542 [0,2,0,0,0,0|0,0,0]=2 508 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 D0997 [0,2,0,0,0,0|0,0,0]=2 509 B12R1.19 O=C(O)CC1=CC=C(O)C(Cl)=C1 C2432 [0,2,0,0,0,0|0,0,0]=2 510 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 C3480 [0,2,0,0,0,0|1,0,1]=4 511 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 A15457 [0,2,0,0,0,0|0,0,0]=2 512 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 M7642 [0,2,0,0,0,0|0,0,0]=2 513 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 H15811 [0,2,0,0,0,0|0,0,0]=2 514 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 C8423 [0,2,0,0,0,0|0,0,0]=2 515 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 A8427 [0,2,0,0,0,0|0,0,0]=2 516 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 A8427 [0,2,0,0,0,0|0,0,0]=2 517 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 F7800 [0,2,0,0,0,0|0,0,0]=2 518 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 H7018 [0,2,0,0,0,0|0,0,0]=2 519 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 A8426 [0,2,0,0,0,0|0,0,0]=2 520 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 F7801 [0,2,0,0,0,0|0,0,0]=2 521 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 H0212 [0,2,0,0,0,0|0,0,0]=2 522 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 H0212 [0,2,0,0,0,0|0,0,0]=2 523 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 B5333 [0,2,0,0,0,0|0,0,0]=2 524 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 M6928 [0,2,0,0,0,0|0,0,0]=2 525 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 F7822 [0,2,0,0,0,0|0,0,0]=2 526 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 F7822 [0,2,0,0,0,0|0,0,0]=2 527 B12R1.49 C=CC(=O)CC1=CC=C(F)C=C1 F15737 [0,2,0,0,0,0|1,0,0]=3 528 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 M7638 [0,2,0,0,0,0|0,0,0]=2 529 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 A17809 [0,2,0,0,0,0|0,0,0]=2 530 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 M7703 [0,2,0,0,0,0|0,0,0]=2 531 B12R1.49 N#CC(O)CC1=CC=C(F)C=C1 F1362 [0,2,0,0,0,0|1,0,1]=4 532 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N\O B10269 [0,2,0,0,0,0|1,0,0]=3 533 B12R1.49 N\C(CC1=CC=C(Cl)C=C1)=N\O C13730 [0,2,0,0,0,0|1,0,0]=3 534 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 C9185 [0,2,0,0,0,0|2,0,0]=4 535 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 C8494 [0,2,0,0,0,0|2,0,0]=4 536 B12R1.106 CS(=O)(=O)CC1=CC=C(F)C=C1 F8528 [0,2,0,0,0,0|1,0,1]=4 537 B12R1.233 CC(=O)NC1=C(C)C=C(Cl)C=C1 C8342 [0,2,0,0,0,0|2,0,0]=4 538 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1F B3301 [0,2,0,0,0,0|2,0,0]=4 539 B12R1.233 CC(=O)NC1=CC=C(C)C=C1Br B18488 [0,2,0,0,0,0|2,0,0]=4 540 B12R1.233 CC(=O)NC1=CC=C(F)C=C1Br B3300 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.233 CC1=CC(C)=C(NC(N)=O)C=C1 D7647 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.233 CC1=CC=C(CC(=O)O)C(C)=C1 D7645 [0,2,0,0,0,0|0,0,0]=2 543 B12R1.233 N=C(N)CC1=CC=C(Cl)C=C1Cl D13772 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.233 O=C(O)CC1=C(F)C=C(F)C=C1 D7897 [0,2,0,0,0,0|0,0,0]=2 545 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Cl D0915 [0,2,0,0,0,0|0,0,0]=2 546 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 C1060 [0,2,0,0,0,0|2,0,0]=4 547 B12R1.34 CN(C(=O)CO)C1=CC=CC=C1 H1068 [0,2,0,0,0,0|1,0,0]=3 548 B12R1.34 CNC(=O)C(Br)C1=CC=CC=C1 B18458 [0,2,0,0,0,0|1,0,0]=3 549 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 M7621 [0,2,0,0,0,0|0,0,1]=3 550 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 M8386 [0,2,0,0,0,0|0,0,0]=2 551 B12R1.34 N[C@@H](CO)[C@@H](O)C1=CC=CC=C1 A0003 [0,2,0,0,0,0|1,0,1]=4 552 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 P2153 [0,2,0,0,0,0|0,0,0]=2 553 B12R1.124 CC(C(=O)O)C1=CC=CC=C1Cl C8390 [0,2,0,0,0,0|0,0,0]=2 554 B12R1.124 CC1=C([C@H](N)C(=O)O)C=CC=C1 A12803 [0,2,0,0,0,0|0,0,0]=2 555 B12R1.124 NC(C(=O)O)C1=C(Cl)C=CC=C1 C1482 [0,2,0,0,0,0|0,0,0]=2 556 B12R1.124 NC(C(=O)O)C1=C(Cl)C=CC=C1 C1482 [0,2,0,0,0,0|0,0,0]=2 557 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O H07290 [0,2,0,0,0,0|0,0,0]=2 558 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O H07290 [0,2,0,0,0,0|0,0,0]=2 559 B12R1.124 N[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 A8425 [0,2,0,0,0,0|0,0,0]=2 560 B12R1.124 N[C@@H](C(=O)O)C1=CC=CC=C1Cl C17752 [0,2,0,0,0,0|0,0,0]=2 561 B12R1.124 N[C@H](C(=O)O)C1=CC=CC=C1Cl A2655 [0,2,0,0,0,0|0,0,0]=2 562 B12R1.124 O=C(O)C(Br)C1=C(Cl)C=CC=C1 B3794 [0,2,0,0,0,0|0,0,0]=2 563 B12R1.124 O=C(O)C(F)C1=CC=CC=C1Br F10428 [0,2,0,0,0,0|0,0,0]=2 564 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Br B10336 [0,2,0,0,0,0|0,0,0]=2 565 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Cl C6929 [0,2,0,0,0,0|0,0,0]=2 566 B12R1.124 O=C(O)[C@@H](O)C1=C(Cl)C=CC=C1 C0528 [0,2,0,0,0,0|0,0,0]=2 567 B12R1.124 O=C(O)[C@H](O)C1=CC=CC=C1Cl C6930 [0,2,0,0,0,0|0,0,0]=2 568 B12R1.225 CC(C(=O)O)C1=CC=CC(Cl)=C1 C8387 [0,2,0,0,0,0|0,0,0]=2 569 B12R1.225 CC1=CC=CC(C(N)C(=O)O)=C1 A15379 [0,2,0,0,0,0|0,0,0]=2 570 B12R1.225 NC(C(=O)O)C1=CC(Cl)=CC=C1 A13598 [0,2,0,0,0,0|0,0,0]=2 571 B12R1.225 NC(C(=O)O)C1=CC=CC(Cl)=C1 A15382 [0,2,0,0,0,0|0,0,0]=2 572 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 A13194 [0,2,0,0,0,0|0,0,0]=2 573 B12R1.225 N[C@H](C(=O)O)C1=CC(F)=CC=C1 A12800 [0,2,0,0,0,0|0,0,0]=2 574 B12R1.225 O=C(O)C(O)C1=CC(Br)=CC=C1 B10335 [0,2,0,0,0,0|0,0,0]=2 575 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 D2960 [0,2,0,0,0,0|0,0,0]=2 576 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 D2960 [0,2,0,0,0,0|0,0,0]=2 577 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 D7857 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.478 CCC(C(N)=O)C1=CC=CC=C1 P0867 [0,2,0,0,0,0|1,0,0]=3 579 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 T7706 [0,2,0,0,0,0|0,0,0]=2 580 B12R1.32 CCCC(=O)OC1=CC=CC=C1 P7639 [0,2,0,0,0,0|2,0,0]=4 581 B12R1.32 CNCC(=O)CC1=CC=CC=C1 M5866 [0,2,0,0,0,0|1,0,0]=3 582 B12R1.50 C=CC(=O)CC1=CC(F)=CC=C1 F15736 [0,2,0,0,0,0|1,0,0]=3 583 B12R1.50 CCC(=O)NC1=CC=CC(N)=C1 A1583 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.50 CNC(=O)OC1=CC(C)=CC=C1 M2025 [0,2,0,0,0,0|2,0,0]=4 585 B12R1.50 CNC(=O)OC1=CC(C)=CC=C1 M2025 [0,2,0,0,0,0|2,0,0]=4 586 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 B14248 [0,2,0,0,0,0|0,0,0]=2 587 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 C8495 [0,2,0,0,0,0|2,0,0]=4 588 B12R1.118 CNC(CO)CC1=CC=CC=C1 M7684 [0,2,0,0,0,0|1,0,1]=4 589 B12R1.118 CNC(CO)CC1=CC=CC=C1 M9105 [0,2,0,0,0,0|1,0,1]=4 590 B12R1.371 COC(=O)CC1=CC=CC=C1O H15810 [0,2,0,0,0,0|0,0,0]=2 591 B12R1.371 O=C(CBr)NC1=C(Cl)C=CC=C1 C10994 [0,2,0,0,0,0|2,0,0]=4 592 B12R1.75 CC(=O)CC1=CC=CC=C1C#N C13032 [0,2,0,0,0,0|1,0,0]=3 593 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 M7633 [0,2,0,0,0,0|1,0,0]=3 594 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 M7633 [0,2,0,0,0,0|1,0,0]=3 595 B12R1.75 NCC1=CC=CC=C1CC(=O)O A13331 [0,2,0,0,0,0|0,0,0]=2 596 B12R1.127 N=C(N)CC1=CC(F)=CC=C1F D13768 [0,2,0,0,0,0|2,0,0]=4 597 B12R1.127 NC1=CC(CC(=O)O)=C(F)C=C1 A14571 [0,2,0,0,0,0|0,0,0]=2 598 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 D7898 [0,2,0,0,0,0|0,0,0]=2 599 B12R1.151 CS(=O)(=O)CC1=C(F)C=CC=C1 F8527 [0,2,0,0,0,0|1,0,1]=4 600 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 D7646 [0,2,0,0,0,0|0,0,0]=2 601 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 D7646 [0,2,0,0,0,0|0,0,0]=2 602 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Cl D5546 [0,2,0,0,0,0|0,0,0]=2 603 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F D2156 [0,2,0,0,0,0|0,0,0]=2 604 B12R1.1009 N=C(N)CC1=C(Cl)C=CC=C1Cl D10634 [0,2,0,0,0,0|2,0,0]=4 605 B12R1.1009 N=C(N)CC1=C(F)C=CC=C1Cl C13731 [0,2,0,0,0,0|2,0,0]=4 606 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl D1338 [0,2,0,0,0,0|0,0,0]=2 607 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1Cl C0623 [0,2,0,0,0,0|0,0,0]=2 608 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F D2141 [0,2,0,0,0,0|0,0,0]=2 609 B12R1.101 O=C(O)CC1=CC(Br)=CC(Br)=C1 D4789 [0,2,0,0,0,0|0,0,0]=2 610 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 D1085 [0,2,0,0,0,0|0,0,0]=2 611 B12R1.101 O=C(O)CC1=CC(O)=CC(O)=C1 D5876 [0,2,0,0,0,0|0,0,0]=2 612 B12R1.119 CS(=O)(=O)CC1=CC=CC(F)=C1 F8526 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.438 COC1=CC(CC(=N)N)=CC=C1 M13859 [0,2,0,0,0,0|2,0,0]=4 614 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 M0114 [0,2,0,0,0,0|0,0,0]=2 615 B12R1.438 CSC1=CC=CC(NC(C)=O)=C1 A3896 [0,2,0,0,0,0|2,0,0]=4 616 B12R1.438 O=C(O)CC1=CC=CC(CCl)=C1 C4257 [0,2,0,0,0,0|0,0,0]=2 617 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 P4799 [1,0,0,1,0,0|0,0,1]=3 618 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P4800 [1,0,0,1,0,0|0,0,1]=3 619 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P4800 [1,0,0,1,0,0|0,0,1]=3 620 B10R2.7 C1=CC2=C(C=C1)OCO2 M1431 [1,0,0,1,0,0|1,0,1]=4 621 B10R2.7 C1=CC2=C(C=C1)[S+]=CS2 B10645 [1,0,0,1,0,0|1,1,0]=4 622 B10R2.7 C1=CC=C2OC=CC2=C1 B1365 [1,0,0,1,0,0|0,0,1]=3 623 B10R2.7 C1=CC=C2OC=CC2=C1 B1365 [1,0,0,1,0,0|0,0,1]=3 624 B12R2.24 O=C1CC2=CC=CC=C2CN1 D13329 [0,0,0,1,0,1|1,0,0]=3 625 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 O5368 [0,0,0,1,0,1|1,0,0]=3 626 B12R2.24 O=C1CCC2=C(C=CC=C2)N1 O5368 [0,0,0,1,0,1|1,0,0]=3 627 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 B7679 [0,0,0,1,0,1|1,0,0]=3 628 B12R2.24 OC1=NC2=CC=CC=C2N=C1 H0574 [0,0,0,1,0,1|1,0,1]=4 629 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 E4816 [0,0,0,1,0,1|1,0,1]=4 630 B12R2.2057 C1=CC=C(OC[C@H]2CO2)C=C1 E4817 [0,0,0,1,0,1|1,0,1]=4 631 B12R2.2403 NC1(O)CCC2=C1C=CC=C2 A15409 [0,0,0,1,0,1|1,0,1]=4 632 B12R2.606 CC1=CC=C2OC(C)=NC2=C1 D11741 [0,1,0,1,0,0|2,0,0]=4 633 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 C3840 [0,1,0,1,0,0|2,0,0]=4 634 B12R2.606 CC1=NC2=CC=C(N)C=C2O1 M5486 [0,1,0,1,0,0|2,0,0]=4 635 B12R2.606 ClC1=CC=C2N=C(Cl)OC2=C1 D3680 [0,1,0,1,0,0|2,0,0]=4 636 B12R2.606 ClC1=CC=C2N=C(Cl)OC2=C1 D3680 [0,1,0,1,0,0|2,0,0]=4 637 B12R2.606 ClC1=CC=C2OC(Cl)=NC2=C1 C17875 [0,1,0,1,0,0|2,0,0]=4 638 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 A0178 [0,1,0,1,0,0|2,0,0]=4 639 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 A0178 [0,1,0,1,0,0|2,0,0]=4 640 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 A5322 [0,1,0,1,0,0|1,0,0]=3 641 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 B9528 [0,1,0,1,0,0|1,0,0]=3 642 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 C7755 [0,1,0,1,0,0|1,0,0]=3 643 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 H14834 [0,1,0,1,0,0|1,0,0]=3 644 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 B4472 [0,1,0,1,0,0|1,0,0]=3 645 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 B4472 [0,1,0,1,0,0|1,0,0]=3 646 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 F4471 [0,1,0,1,0,0|1,0,0]=3 647 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 F4471 [0,1,0,1,0,0|1,0,0]=3 648 B12R2.606 O=C1CC2=CC=C(F)C=C2N1 F11056 [0,1,0,1,0,0|1,0,0]=3 649 B12R2.606 O=C1CC2=CC=C(O)C=C2N1 H14906 [0,1,0,1,0,0|1,0,0]=3 650 B12R2.606 O=C1NC2=CC(Cl)=CC=C2O1 C1739 [0,1,0,1,0,0|1,0,0]=3 651 B12R2.606 O=C1NC2=CC(Cl)=CC=C2S1 C5390 [0,1,0,1,0,0|1,1,0]=4 652 B12R2.606 O=C1NC2=CC=C(Cl)C=C2O1 C1063 [0,1,0,1,0,0|1,0,0]=3 653 B12R2.606 O=C1NC2=CC=C(Cl)C=C2O1 C1063 [0,1,0,1,0,0|1,0,0]=3 654 B12R2.606 OC1=NC2=C(C=CC(Cl)=C2)N1 C15657 [0,1,0,1,0,0|2,0,0]=4 655 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 M5858 [0,1,0,1,0,0|1,0,0]=3 656 B12R2.18 CN1C(=O)SC2=CC=CC=C21 M18425 [0,1,0,1,0,0|1,1,0]=4 657 B12R2.18 N[C@@H]1C2=CC=CC=C2C[C@@H]1O A7187 [0,1,0,1,0,0|1,0,1]=4 658 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O A6026 [0,1,0,1,0,0|1,0,1]=4 659 B12R2.18 O=C1CC2=C(C=CC=C2)C1=O I12742 [0,1,0,1,0,0|0,0,1]=3 660 B12R2.18 O=C1NC2=CC=CC=C2C1=O I0531 [0,1,0,1,0,0|1,0,1]=4 661 B12R2.18 O[C@H]1C2=C(C=CC=C2)C[C@@H]1Br B9587 [0,1,0,1,0,0|1,0,1]=4 662 B12R2.32 CSC1=NC2=CC=CC=C2O1 M11740 [0,1,0,1,0,0|1,1,0]=4 663 B12R2.32 O=CC1=CC2=C(C=CC=C2)O1 I0657 [0,1,0,1,0,0|0,0,1]=3 664 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 B7588 [0,1,0,1,0,0|1,1,0]=4 665 B12R2.32 OCC1=CC2=C(C=CC=C2)S1 B7651 [0,1,0,1,0,0|0,1,1]=4 666 B12R2.32 OCC1=NC2=C(C=CC=C2)S1 B7680 [0,1,0,1,0,0|1,1,0]=4 667 B12R2.32 ON=C1CC2=CC=CC=C2C1 I2106 [0,1,0,1,0,0|1,0,0]=3 668 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 M19383 [0,1,0,1,0,0|1,0,0]=3 669 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 C12293 [0,1,0,1,0,0|1,0,0]=3 670 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 F12294 [0,1,0,1,0,0|1,0,0]=3 671 B12R2.202 O=C1CC2=C(O)C=CC=C2N1 H3671 [0,1,0,1,0,0|1,0,0]=3 672 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 F11057 [0,1,0,1,0,0|1,0,0]=3 673 B12R2.202 O=C1NC2=C(C=CC=C2Cl)S1 H1623 [0,1,0,1,0,0|1,1,0]=4 674 B8R1.8 OCCC1=CC=CS1 T0443 [1,0,0,0,1,0|1,0,1]=4 675 B8R1.7 CC(=O)C1=CC=CN1 A0582 [0,0,0,0,2,0|2,0,0]=4 676 B8R1.7 CC(=O)C1=CC=CO1 A1473 [0,0,0,0,2,0|2,0,0]=4 677 B8R1.7 CC(=O)C1=CC=CS1 A0583 [0,0,0,0,2,0|2,0,0]=4 678 B8R1.7 CC(=O)C1=CNC=C1 P7297 [0,0,0,0,2,0|2,0,0]=4 679 B8R1.7 O=C(O)C1=CC=CS1 T4980 [0,0,0,0,2,0|1,0,0]=3 680 B8R1.7 O=C(O)C1=CC=CS1 T4980 [0,0,0,0,2,0|1,0,0]=3 681 B8R1.7 O=C(O)C1=CN=CS1 T17631 [0,0,0,0,2,0|2,0,0]=4 682 B8R1.7 O=C(O)C1=CNC=C1 P7298 [0,0,0,0,2,0|1,0,0]=3 683 B8R1.7 O=C(O)C1=CNC=C1 P7298 [0,0,0,0,2,0|1,0,0]=3 684 B8R1.7 O=C(O)C1=CNC=N1 I11557 [0,0,0,0,2,0|2,0,0]=4 685 B8R1.7 O=C(O)C1=CSC=N1 T11462 [0,0,0,0,2,0|2,0,0]=4 686 B8R1.7 O=C(O)C1=NNC=C1 P4441 [0,0,0,0,2,0|2,0,0]=4 687 B12R1.252 CC(=O)CSCC1=CC=CC=C1 B8221 [0,0,0,0,0,2|1,0,0]=3 688 B12R1.252 N=C(N)CCOC1=CC=CC=C1 P16902 [0,0,0,0,0,2|2,0,0]=4 689 B12R1.252 NC(=O)CNCC1=CC=CC=C1 B13928 [0,0,0,0,0,2|1,0,0]=3 690 B12R1.252 O=C(O)CNCC1=CC=CC=C1 B3212 [0,0,0,0,0,2|0,0,0]=2 691 B12R1.252 O=C(O)CNCC1=CC=CC=C1 B9099 [0,0,0,0,0,2|0,0,0]=2