0 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 Y10008 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.40 CNC(=O)OC1=CC=CC=C1 C10489 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 81451 [0,0,0,0,0,0|2,0,2]=4 3 B11R1.40 C[C@@H](CN)OC1=CC=CC=C1 AR3791 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.40 NCC(=O)CC1=CC=CC=C1 A10565 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22065 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.40 NCC(=O)NC1=CC=CC=C1 AB22066 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.40 NNC(=O)OC1=CC=CC=C1 Y11606 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.40 N\C(CC1=CC=CC=C1)=N/O W18702 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Y10931 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.40 O=C(CO)NC1=CC=CC=C1 C77599 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 C=C\C=C\C1=CC=CC=C1 54349 [1,0,0,0,0,0|1,0,0]=2 12 B10R1.17 OC\C=C\C1=NC=CC=C1 AC7737 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.18 BrC(Br)=CC1=CC=CC=C1 31017 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.18 CC(=O)CC1=CN=CC=C1 28512 [1,0,0,0,0,0|1,0,1]=3 15 B10R1.18 CC(=O)NC1=CC=CC=C1 D72485 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.18 N=C(N)CC1=CC=CC=C1 F19863 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.18 NC(=S)CC1=CC=CC=C1 71029 [1,0,0,0,0,0|1,1,1]=4 18 B12R1.43 CC(=O)[C@@H](C)CC1=CC=CC=C1 Y10616 [0,1,0,0,0,0|0,0,2]=3 19 B12R1.43 C[C@@H](CC1=NC=CC=C1)C(=O)O F14472 [0,1,0,0,0,0|1,0,2]=4 20 B12R1.43 C[C@H](NC1=CC=CC=C1)C(=O)O D82882 [0,1,0,0,0,0|1,0,1]=3 21 B12R1.43 C[C@H](OC1=NC=CC=C1)C(=O)O W18936 [0,1,0,0,0,0|2,0,1]=4 22 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O F14501 [0,1,0,0,0,0|1,0,0]=2 23 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O C73515 [0,1,0,0,0,0|1,0,2]=4 24 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 W18568 [0,1,0,0,0,0|2,0,0]=3 25 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 F16780 [0,1,0,0,0,0|1,0,2]=4 26 B12R1.49 C=CC(=O)NC1=CC=C(N)C=C1 A10042 [0,1,0,0,0,0|3,0,0]=4 27 B12R1.50 C=CC(=O)NC1=CC(O)=CC=C1 P18258 [0,1,0,0,0,0|3,0,0]=4 28 B12R1.371 C=CC(=O)NC1=C(I)C=CC=C1 AR2315 [0,1,0,0,0,0|3,0,0]=4 29 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)O1 54481 [0,0,0,1,0,0|2,0,0]=3 30 B12R2.18 CC1=C(Br)C2=C(C=NC=C2)N1 P13974 [0,0,0,1,0,0|3,0,0]=4 31 B12R2.18 CC1=C(Br)C2=C(N=CC=C2)N1 37703 [0,0,0,1,0,0|3,0,0]=4 32 B12R2.18 CC1=C(I)C2=C(N=CC=C2)N1 38229 [0,0,0,1,0,0|3,0,0]=4 33 B12R2.18 CC1=C(N)N2C=CC=CC2=N1 35348 [0,0,0,1,0,0|3,0,0]=4 34 B12R2.18 CC1=C2C=CC=CC2=NN1C D83537 [0,0,0,1,0,0|3,0,0]=4 35 B12R2.18 CC1=NC2=C(C=CC=C2)N1C T70720 [0,0,0,1,0,0|3,0,0]=4 36 B12R2.18 CN1N=C2C=CC=CC2=C1Br P13368 [0,0,0,1,0,0|3,0,0]=4 37 B12R2.18 CN1N=C2C=CC=CC2=C1N D83793 [0,0,0,1,0,0|3,0,0]=4 38 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O 27540 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.24 BrC1=CC2=CC=CC=C2N=N1 C76515 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.24 BrC1=CC2=CC=CN=C2N=C1 39321 [0,0,0,1,0,0|3,0,0]=4 41 B12R2.24 BrC1=CC2=CN=CC=C2N=C1 C73415 [0,0,0,1,0,0|3,0,0]=4 42 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 BL002815 [0,0,0,1,0,0|3,0,0]=4 43 B12R2.24 BrC1=CC2=NC=CC=C2N=C1 SC1031 [0,0,0,1,0,0|3,0,0]=4 44 B12R2.24 CC1=CC=C2C=NN=CC2=C1 T72939 [0,0,0,1,0,0|3,0,0]=4 45 B12R2.24 ClC1=CC2=CC=CC=C2N=N1 32281 [0,0,0,1,0,0|3,0,0]=4 46 B12R2.24 ClC1=CC2=CC=CN=C2N=C1 C74810 [0,0,0,1,0,0|3,0,0]=4 47 B12R2.24 ClC1=CC2=CN=CC=C2C=C1 24371 [0,0,0,1,0,0|3,0,0]=4 48 B12R2.24 FC1=CC2=CC=CC=C2N=C1 F30311 [0,0,0,1,0,0|2,0,0]=3 49 B12R2.24 FC1=CC2=CN=CC=C2C=C1 90642 [0,0,0,1,0,0|3,0,0]=4 50 B12R2.24 FC1=NC2=CC=CC=C2C=C1 H10138 [0,0,0,1,0,0|3,0,0]=4 51 B12R2.24 IC1=CC2=CC=CC=C2N=C1 AB9519 [0,0,0,1,0,0|2,0,0]=3 52 B12R2.24 IC1=NC2=CC=CC=C2C=C1 71122 [0,0,0,1,0,0|3,0,0]=4 53 B12R2.24 NC1=CC2=NC=CC=C2N=C1 86466 [0,0,0,1,0,0|3,0,0]=4 54 B12R2.24 NC1=CC=C2C=CC=NC2=C1 32470 [0,0,0,1,0,0|3,0,0]=4 55 B12R2.24 NC1=CC=C2C=CN=CC2=C1 24616 [0,0,0,1,0,0|3,0,0]=4 56 B12R2.24 O=C1C=C2C=CC=CC2=NN1 O11709 [0,0,0,1,0,0|3,0,0]=4 57 B12R2.24 SC1=CC2=CC=CC=C2N=C1 D83175 [0,0,0,1,0,0|2,0,0]=3 58 B12R2.24 [O-]C1=CC2=CC=CC=C2C=C1 A12912 [0,0,0,1,0,0|2,0,0]=3 59 B12R2.27 O=CC1CC1C2=CC=NC=C2 30186 [0,0,0,1,0,0|1,0,2]=4 60 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 25413 [0,0,0,1,0,0|2,0,1]=4 61 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 AC2210 [0,0,0,1,0,0|2,0,1]=4 62 B12R2.32 O=CC1=CC2=C(C=CC=N2)N1 24171 [0,0,0,1,0,0|2,0,0]=3 63 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 P11151 [0,0,0,1,0,0|2,0,0]=3 64 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 69373 [0,0,0,1,0,0|2,0,0]=3 65 B12R2.32 O=CC1=CC2=C(C=CN=C2)S1 W19264 [0,0,0,1,0,0|2,0,0]=3 66 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 F53415 [0,0,0,1,0,0|2,0,0]=3 67 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 83174 [0,0,0,1,0,0|2,0,0]=3 68 B12R2.32 O=CC1=CC2=CC=CN=C2S1 F30586 [0,0,0,1,0,0|2,0,0]=3 69 B12R2.32 O=CC1=CN2C=CC=CC2=N1 20279 [0,0,0,1,0,0|2,0,0]=3 70 B10R1.15 C=C(CBr)C1=CC=CC=C1 35089 [0,0,0,0,1,0|1,0,2]=4 71 B10R1.15 C=C(CC)C1=CC=CC=C1 C73845 [0,0,0,0,1,0|1,0,2]=4 72 B10R1.15 C=CC(=O)C1=CC=CC=C1 77875 [0,0,0,0,1,0|2,0,0]=3 73 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11941 [0,0,0,0,1,0|2,0,1]=4 74 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y11942 [0,0,0,0,1,0|2,0,1]=4 75 B10R1.15 C=C[C@H](N)C1=CC=CC=C1 Y12425 [0,0,0,0,1,0|2,0,1]=4 76 B10R1.15 CCN(C)C1=CC=CC=C1 S10715 [0,0,0,0,1,0|2,0,1]=4 77 B10R1.15 CN(C=O)C1=NC=CC=C1 A12745 [0,0,0,0,1,0|2,0,0]=3 78 B10R1.15 N=C(NN)C1=CC=CC=C1 D97377 [0,0,0,0,1,0|3,0,0]=4 79 B10R1.15 NNC(=S)C1=CC=CC=C1 W10972 [0,0,0,0,1,0|3,0,0]=4 80 B10R1.15 O=C[C@H](Br)C1=CC=CC=C1 F13390 [0,0,0,0,1,0|1,0,1]=3 81 B9R1.8 N\N=C\C1=CC=CC=C1 D81797 [2,0,0,0,0,0|2,0,0]=4 82 B9R1.8 O\N=C/C1=CC=CC=C1 N10040 [2,0,0,0,0,0|1,0,1]=4 83 B11R1.1 N#C\C=C\C1=CC=C(F)C=C1 A12335 [1,1,0,0,0,0|1,0,1]=4 84 B11R1.1 O=CCCC1=CC=C(Br)C=C1 29444 [1,1,0,0,0,0|0,0,2]=4 85 B11R1.1 O=CCCC1=CC=C(Cl)C=C1 AB6893 [1,1,0,0,0,0|0,0,2]=4 86 B11R1.1 O=CCCC1=CC=C(O)C=C1 F19751 [1,1,0,0,0,0|0,0,2]=4 87 B11R1.1 OC\C=C\C1=CC=C(O)C=C1 A11786 [1,1,0,0,0,0|0,0,2]=4 88 B11R1.17 O=CCCC1=C(Cl)C=CC=C1 20776 [1,1,0,0,0,0|0,0,2]=4 89 B11R1.17 O=C\C=C\C1=C(F)C=CC=C1 24137 [1,1,0,0,0,0|0,0,0]=2 90 B11R1.24 O=CCCC1=CC=CC(Br)=C1 A10169 [1,1,0,0,0,0|0,0,2]=4 91 B11R1.91 CC(=O)C#CC1=CC=CC=C1 F21355 [1,1,0,0,0,0|0,0,2]=4 92 B11R1.91 NC(=O)COC1=CC=CC=C1 N16863 [1,1,0,0,0,0|1,0,1]=4 93 B11R1.91 O=C(O)\C=C\C1=NC=CC=N1 P18972 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 W18616 [1,1,0,0,0,0|2,0,0]=4 95 B11R1.91 O=C([O-])CCC1=CC=CC=C1 A11567 [1,1,0,0,0,0|0,0,2]=4 96 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 D70623 [1,1,0,0,0,0|1,0,1]=4 97 B11R1.20 CC(=O)NC1=CN=C(C)C=C1 N16920 [1,1,0,0,0,0|2,0,0]=4 98 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 C75099 [1,1,0,0,0,0|2,0,0]=4 99 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 C73008 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 69913 [1,1,0,0,0,0|1,0,1]=4 101 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 52120 [1,1,0,0,0,0|1,0,1]=4 102 B11R1.36 CC(=O)[C@H](N)C1=CC=CC=C1 N13201 [1,1,0,0,0,0|0,0,1]=3 103 B11R1.36 CC(=O)[C@H](O)C1=CC=CC=C1 AC1336 [1,1,0,0,0,0|0,0,1]=3 104 B11R1.36 C[C@H](F)C(=O)C1=CC=CC=C1 C10603 [1,1,0,0,0,0|1,0,1]=4 105 B11R1.86 CC(=O)NC1=C(I)C=CC=C1 AR2168 [1,1,0,0,0,0|1,0,0]=3 106 B11R1.86 FC1=C(C=C(Br)Br)C=CC=C1 D79986 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.86 NC(=O)NC1=C(Cl)C=CC=C1 W18608 [1,1,0,0,0,0|2,0,0]=4 108 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 36520 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 FD10602 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 Y11318 [1,1,0,0,0,0|1,0,0]=3 111 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 C75148 [1,1,0,0,0,0|1,0,0]=3 112 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 C72191 [1,1,0,0,0,0|1,0,1]=4 113 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 57489 [1,1,0,0,0,0|1,0,1]=4 114 B11R1.509 C[S@](=N)(=O)CC1=CC=CC=C1 W18265 [1,1,0,0,0,0|1,0,1]=4 115 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 AB9399 [0,1,0,0,1,0|2,0,0]=4 116 B11R1.23 O=CC(=O)C1=CC=CC(Cl)=C1 N16981 [0,1,0,0,1,0|1,0,0]=3 117 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 W19004 [0,1,0,0,1,0|1,0,1]=4 118 B13R1.42 CC(=CC#N)CCC1=CC=CC=C1 D93259 [0,1,0,0,0,1|1,0,1]=4 119 B13R1.351 C[C@H](NCC1=CC=CC=C1)C(=O)O 60095 [0,1,0,0,0,1|0,0,2]=4 120 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 27901 [0,2,0,0,0,0|1,0,1]=4 121 B13R1.133 CC1=CC=C(O[C@@H](C)C(=O)O)C=C1 AR3824 [0,2,0,0,0,0|1,0,1]=4 122 B13R1.133 C[C@@H](CC1=CC=C(Br)C=C1)C(=O)O D79738 [0,2,0,0,0,0|0,0,2]=4 123 B13R1.133 C[C@@H](CC1=CC=C(F)C=C1)C(=O)O 71965 [0,2,0,0,0,0|0,0,2]=4 124 B13R1.133 C[C@H](OC1=CC=C(Cl)C=C1)C(=O)O A50595 [0,2,0,0,0,0|1,0,1]=4 125 B13R1.133 C\C(=C/C1=CC=C(F)C=C1)C(=O)O D95596 [0,2,0,0,0,0|0,0,0]=2 126 B13R1.133 NC1=CC=C(CC(=O)C(=O)O)C=C1 A11480 [0,2,0,0,0,0|1,0,1]=4 127 B13R1.148 C\C(=C/C1=CC=CC(Br)=C1)[N+](=O)[O-] C11704 [0,2,0,0,0,0|1,0,0]=3 128 B13R1.148 O=C(O)C(=O)CC1=CC(O)=CC=C1 C15825 [0,2,0,0,0,0|1,0,1]=4 129 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O 32246 [0,2,0,0,0,0|0,0,2]=4 130 B13R1.418 O=C(O)[C@H](CO)CC1=CC=CC=C1 87873 [0,2,0,0,0,0|0,0,2]=4 131 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O F10695 [0,2,0,0,0,0|0,0,2]=4 132 B13R1.5 COC1=CC=C(C[C@H](C)C=O)C=C1 64484 [0,2,0,0,0,0|0,0,2]=4 133 B11R2.1 CC1=CCC2=C1C=CC=C2 C76459 [1,0,0,1,0,0|1,0,1]=4 134 B11R2.1 ClC1=COC2=C1C=CC=C2 F14423 [1,0,0,1,0,0|2,0,0]=4 135 B11R2.1 NC1=CNC2=C1C=CC=C2 51896 [1,0,0,1,0,0|2,0,0]=4 136 B11R2.1 NC1=CSC2=C1C=CC=C2 25380 [1,0,0,1,0,0|2,0,0]=4 137 B11R2.1 O=C1C=CC2=C1C=CC=C2 O10409 [1,0,0,1,0,0|0,0,0]=2 138 B11R2.1 O=C1CSC2=C1C=CC=C2 26760 [1,0,0,1,0,0|1,0,1]=4 139 B11R2.20 C1=CC2=C(C=C1)OCC=C2 N13096 [1,0,0,1,0,0|0,0,2]=4 140 B11R2.20 C1=CC2=CC=NC=C2N=C1 50496 [1,0,0,1,0,0|2,0,0]=4 141 B11R2.20 C1=CC2=CN=CC=C2N=C1 SC3611 [1,0,0,1,0,0|2,0,0]=4 142 B11R2.20 C1=CC=C2N=NC=CC2=C1 76492 [1,0,0,1,0,0|2,0,0]=4 143 B11R2.20 C1=CC=C2N=NC=CC2=C1 Y10640 [1,0,0,1,0,0|2,0,0]=4 144 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 30106 [1,0,0,1,0,0|1,0,1]=4 145 B11R2.10 CC1=CC2=C(C=CC=C2)O1 F11695 [1,0,0,1,0,0|0,0,1]=3 146 B11R2.10 CC1=CC2=C(C=CN=C2)N1 36232 [1,0,0,1,0,0|2,0,0]=4 147 B11R2.10 CC1=CC2=C(C=NC=C2)N1 64428 [1,0,0,1,0,0|2,0,0]=4 148 B11R2.10 CC1=CC2=NC=CC=C2N1 27734 [1,0,0,1,0,0|2,0,0]=4 149 B11R2.10 CC1=CN2C=CC=CC2=C1 AC8553 [1,0,0,1,0,0|1,0,0]=3 150 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 F11679 [1,0,0,1,0,0|2,0,0]=4 151 B11R2.10 IC1=CC2=C(C=CC=C2)N1 F18254 [1,0,0,1,0,0|2,0,0]=4 152 B11R2.10 IC1=CC2=C(C=CC=C2)O1 D83864 [1,0,0,1,0,0|1,0,1]=4 153 B11R2.10 IC1=CC2=C(C=CC=C2)S1 F13439 [1,0,0,1,0,0|1,1,0]=4 154 B11R2.10 NC1=CC2=C(C=CC=C2)S1 27373 [1,0,0,1,0,0|1,1,0]=4 155 B11R2.10 O=C1CC2=C(C=CN=C2)N1 86499 [1,0,0,1,0,0|2,0,0]=4 156 B11R2.10 O=C1CN2C=CC=CC2=N1 78878 [1,0,0,1,0,0|2,0,0]=4 157 B11R2.36 CC1=CC2=C(C=C1)SC=C2 F11127 [0,0,0,1,1,0|2,0,0]=4 158 B11R2.36 CC1=CC2=C(C=CS2)C=C1 C73204 [0,0,0,1,1,0|2,0,0]=4 159 B11R2.36 CC1=CN=C2C=CNC2=C1 54346 [0,0,0,1,1,0|2,0,0]=4 160 B11R2.36 CC1=CN=C2NC=CC2=C1 25496 [0,0,0,1,1,0|2,0,0]=4 161 B13R2.10 BrC1=COC(C2=CC=CC=C2)=N1 70771 [0,0,0,1,0,1|1,0,1]=4 162 B13R2.10 BrC1=CSC(C2=CC=CC=C2)=N1 95210 [0,0,0,1,0,1|1,1,0]=4 163 B13R2.10 CC1=NC(C2=CC=CC=C2)=CN1 F14663 [0,0,0,1,0,1|2,0,0]=4 164 B13R2.10 CC1=NC=C(C2=CC=CC=C2)O1 63684 [0,0,0,1,0,1|2,0,0]=4 165 B13R2.10 IC1=CN(C2=CC=CC=C2)N=C1 65357 [0,0,0,1,0,1|2,0,0]=4 166 B13R2.10 NC1=CN(C2=CC=CC=C2)N=C1 F18640 [0,0,0,1,0,1|2,0,0]=4 167 B13R2.32 CC1=C(Br)C2=CC=CN=C2C=C1 F52037 [0,0,0,1,0,1|2,0,0]=4 168 B13R2.32 CC1=C(Br)C2=CC=NC=C2C=C1 20251 [0,0,0,1,0,1|2,0,0]=4 169 B13R2.32 CC1=C(Br)C=NC2=CC=CC=C21 C75769 [0,0,0,1,0,1|2,0,0]=4 170 B13R2.32 CC1=C(N)C=NC2=CC=CC=C21 84297 [0,0,0,1,0,1|2,0,0]=4 171 B13R2.32 CC1=C(N)N=CC2=CC=CC=C21 D94798 [0,0,0,1,0,1|2,0,0]=4 172 B13R2.32 CC1=C(O)C2=CC=CC=C2N=C1 AC6544 [0,0,0,1,0,1|0,0,1]=3 173 B13R2.32 CC1=C(O)C2=CC=CN=C2C=C1 F20274 [0,0,0,1,0,1|1,0,1]=4 174 B13R2.32 CC1=C(O)C=NC2=CC=CC=C21 C75922 [0,0,0,1,0,1|2,0,0]=4 175 B13R2.32 NC1=C(Br)C=CC2=CC=CC=C21 F13404 [0,0,0,1,0,1|2,0,0]=4 176 B13R2.32 NC1=C(Cl)N=CC2=CC=CC=C21 27243 [0,0,0,1,0,1|2,0,0]=4 177 B13R2.32 NC1=C(N)C2=CC=CC=C2N=C1 C11386 [0,0,0,1,0,1|2,0,0]=4 178 B13R2.32 NC1=C(O)C2=CC=CC=C2C=C1 A12509 [0,0,0,1,0,1|1,0,1]=4 179 B13R2.32 NC1=C(O)C2=CC=CC=C2N=C1 C77388 [0,0,0,1,0,1|1,0,1]=4 180 B13R2.32 NC1=COC2=C(C=CC=C2)C1=O 50132 [0,0,0,1,0,1|1,0,0]=3 181 B13R2.32 O=C1NC=C2C=CC=CC2=C1Br P20049 [0,0,0,1,0,1|2,0,0]=4 182 B13R2.32 OC1=C(Br)C2=CC=CC=C2N=C1 79295 [0,0,0,1,0,1|2,0,0]=4 183 B13R2.32 OC1=C(I)C2=CC=CC=C2C=C1 34754 [0,0,0,1,0,1|2,0,0]=4 184 B13R2.32 OC1=C(O)C2=CC=CC=C2C=C1 T71079 [0,0,0,1,0,1|1,0,1]=4 185 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 80295 [0,0,0,1,0,1|2,0,0]=4 186 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 AT15535 [0,0,0,1,0,1|1,0,1]=4 187 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 26625 [0,0,0,1,0,1|1,0,1]=4 188 B13R2.57 O=CC1=CC2=NC=CC=C2C=C1 24417 [0,0,0,1,0,1|1,0,1]=4 189 B13R2.15 BrC1=C(C2=CC=CC=C2)N=CO1 AT18676 [0,1,0,1,0,0|2,0,0]=4 190 B13R2.15 BrC1=C(C2=CC=CC=C2)OC=N1 C76368 [0,1,0,1,0,0|1,0,1]=4 191 B13R2.15 BrC1=CSC=C1C2=CC=CC=C2 AC5681 [0,1,0,1,0,0|1,1,0]=4 192 B13R2.15 CC1=C(C2=CC=CC=C2)SC=N1 F52712 [0,1,0,1,0,0|0,1,0]=3 193 B13R2.15 CC1=CC=NN1C2=CC=CC=C2 F20811 [0,1,0,1,0,0|2,0,0]=4 194 B13R2.15 NC1=C(C2=CC=CC=C2)NN=C1 D85523 [0,1,0,1,0,0|2,0,0]=4 195 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 67222 [0,1,0,1,0,0|0,0,2]=4 196 B13R2.135 CC1=C(C=O)C2=C(N=CC=C2)N1 26469 [0,1,0,1,0,0|2,0,0]=4 197 B13R2.135 CC1=C(C=O)N2C=CC=CC2=N1 71381 [0,1,0,1,0,0|2,0,0]=4 198 B13R2.135 CN1N=C2C=CC=CC2=C1C=O 30208 [0,1,0,1,0,0|2,0,0]=4 199 B13R2.135 O=CC1=C(Br)NC2=C1C=CC=C2 W10804 [0,1,0,1,0,0|2,0,0]=4 200 B13R2.328 BrC1=CC2=CC=CC=C2C(Br)=N1 26785 [0,1,0,1,0,0|2,0,0]=4 201 B13R2.328 CC1=CC2=C(C=CC=C2)C(=O)N1 F13592 [0,1,0,1,0,0|0,0,0]=2 202 B13R2.328 CC1=CC2=CC=CC=C2C(Br)=C1 N10649 [0,1,0,1,0,0|1,0,0]=3 203 B13R2.328 CC1=CC2=CC=CC=C2C(Cl)=N1 58010 [0,1,0,1,0,0|1,0,0]=3 204 B13R2.328 CC1=CC2=CC=CC=C2C(N)=C1 N13183 [0,1,0,1,0,0|1,0,0]=3 205 B13R2.328 CC1=CC2=CC=CN=C2C(Cl)=C1 27754 [0,1,0,1,0,0|2,0,0]=4 206 B13R2.328 CC1=CC2=CC=CN=C2C(O)=C1 C73976 [0,1,0,1,0,0|1,0,1]=4 207 B13R2.328 CC1=NC(Cl)=CC2=CC=CC=C21 D80082 [0,1,0,1,0,0|2,0,0]=4 208 B13R2.328 CC1=NC2=C(C=NC=C2)C(=O)N1 F51927 [0,1,0,1,0,0|2,0,0]=4 209 B13R2.328 CC1=NC2=CC=CC=C2C(Br)=C1 35493 [0,1,0,1,0,0|2,0,0]=4 210 B13R2.328 CC1=NC2=CC=CC=C2C(C)=N1 27607 [0,1,0,1,0,0|2,0,0]=4 211 B13R2.328 CC1=NC2=CC=CC=C2C(I)=C1 P17848 [0,1,0,1,0,0|2,0,0]=4 212 B13R2.328 C[C@H]1CC(=O)C2=C(C=CC=C2)N1 72373 [0,1,0,1,0,0|1,0,1]=4 213 B13R2.328 NC1=CC2=CC=CC=C2C(Br)=C1 O11192 [0,1,0,1,0,0|2,0,0]=4 214 B13R2.328 NC1=CC2=CC=CC=C2C(Cl)=N1 D97487 [0,1,0,1,0,0|2,0,0]=4 215 B13R2.328 NC1=NC(Cl)=CC2=CC=CC=C21 F52120 [0,1,0,1,0,0|2,0,0]=4 216 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 Y10382 [0,1,0,1,0,0|1,0,1]=4 217 B13R2.328 O=C1NC(Cl)=NC2=C1C=CC=C2 F11681 [0,1,0,1,0,0|2,0,0]=4 218 B13R2.328 OC1=CC(Br)=CC2=CC=CC=C12 F19625 [0,1,0,1,0,0|1,0,1]=4 219 B13R2.45 CC1=C(C=O)N=C2C=CC=CN21 72019 [0,1,0,1,0,0|2,0,0]=4 220 B13R2.45 CC1=C(C=O)NC2=C1C=CC=C2 C13632 [0,1,0,1,0,0|1,0,0]=3 221 B13R2.45 CN1C(C=O)=NC2=C1C=CC=N2 D83620 [0,1,0,1,0,0|2,0,0]=4 222 B13R2.45 CN1C(CN)=CC2=C1C=CC=C2 D70659 [0,1,0,1,0,0|1,0,1]=4 223 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)O1 W18830 [0,1,0,1,0,0|1,0,0]=3 224 B13R2.45 O=CC1=C(Cl)C2=C(C=CC=C2)S1 FD7228 [0,1,0,1,0,0|1,0,0]=3 225 B13R2.369 CC1=CC2=CC=CC=C2C=C1C A12662 [0,1,0,1,0,0|1,0,0]=3 226 B13R2.369 CC1=NC2=CC=CC=C2C=C1N 84046 [0,1,0,1,0,0|2,0,0]=4 227 B13R2.369 CC1=NC2=CC=CC=C2N=C1Br AC1545 [0,1,0,1,0,0|2,0,0]=4 228 B13R2.369 CC1=NC2=CC=CC=C2N=C1N Y10497 [0,1,0,1,0,0|2,0,0]=4 229 B13R2.369 C[C@@H]1NC2=C(C=CC=C2)NC1=O 38076 [0,1,0,1,0,0|1,0,1]=4 230 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O 79239 [0,1,0,1,0,0|1,0,0]=3 231 B13R2.369 NC1=CC2=CC=CC=C2C=C1Br F13558 [0,1,0,1,0,0|2,0,0]=4 232 B13R2.369 NC1=CC2=CC=CC=C2C=C1I 68062 [0,1,0,1,0,0|2,0,0]=4 233 B13R2.369 NC1=CC2=CC=CC=C2N=C1Cl AC1585 [0,1,0,1,0,0|2,0,0]=4 234 B13R2.369 NC1=NC2=CC=CC=C2C=C1Br 25602 [0,1,0,1,0,0|2,0,0]=4 235 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1Br F10206 [0,1,0,1,0,0|1,0,0]=3 236 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1O 67380 [0,1,0,1,0,0|1,0,0]=3 237 B13R2.369 O=C1NC2=C(C=CC=C2)N=C1Cl 38522 [0,1,0,1,0,0|2,0,0]=4 238 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Br 57054 [0,1,0,1,0,0|1,0,0]=3 239 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1Cl W10453 [0,1,0,1,0,0|2,0,0]=4 240 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1O 98636 [0,1,0,1,0,0|2,0,0]=4 241 B13R2.369 OC1=CC2=CC=CC=C2C=C1Br T70735 [0,1,0,1,0,0|1,0,1]=4 242 B13R2.369 OC1=CC2=CC=CC=C2C=C1O AC2509 [0,1,0,1,0,0|1,0,1]=4 243 B13R2.369 OC1=CC2=CC=CC=C2N=C1Cl 87954 [0,1,0,1,0,0|2,0,0]=4 244 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 F12973 [0,1,0,1,0,0|0,0,2]=4 245 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 W13292 [0,1,0,1,0,0|0,0,2]=4 246 B13R2.435 CC(=O)C1=CN2C=CC=CC2=N1 72371 [0,1,0,1,0,0|2,0,0]=4 247 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)O1 25646 [0,1,0,1,0,0|2,0,0]=4 248 B13R2.435 CC(=O)C1CC2=C(C=CC=C2)C1 75402 [0,1,0,1,0,0|0,0,2]=4 249 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 F53644 [0,1,0,1,0,0|1,0,0]=3 250 B13R2.435 NC(=O)C1=CC2=C(N=CC=C2)N1 P15923 [0,1,0,1,0,0|2,0,0]=4 251 B13R2.435 NC(=O)C1=NN2C=CC=CC2=C1 F52742 [0,1,0,1,0,0|2,0,0]=4 252 B13R2.435 NC(=S)C1=CC2=C(C=CC=C2)N1 D97587 [0,1,0,1,0,0|1,1,0]=4 253 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 AC1335 [0,1,0,1,0,0|0,0,0]=2 254 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 37347 [0,1,0,1,0,0|2,0,0]=4 255 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)S1 81378 [0,1,0,1,0,0|2,0,0]=4 256 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 87399 [0,1,0,1,0,0|2,0,0]=4 257 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 87593 [0,1,0,1,0,0|2,0,0]=4 258 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 68599 [0,1,0,1,0,0|2,0,0]=4 259 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 25340 [0,1,0,1,0,0|2,0,0]=4 260 B13R2.435 O=C([O-])C1=NC2=C(C=CC=C2)O1 20910 [0,1,0,1,0,0|2,0,0]=4 261 B13R2.435 O=[N+]([O-])C1=CC2=C(C=CC=C2)O1 A12428 [0,1,0,1,0,0|2,0,0]=4 262 B13R2.42 O=CC1CC1C2=CC=C(Cl)C=C2 72789 [0,1,0,1,0,0|0,0,2]=4 263 B13R2.43 O=CC1=CC2=C(C=C(Br)C=C2)N1 P10395 [0,1,0,1,0,0|1,0,0]=3 264 B13R2.43 O=CC1=CC2=C(C=C(Cl)C=C2)N1 27099 [0,1,0,1,0,0|1,0,0]=3 265 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)N1 25706 [0,1,0,1,0,0|1,0,0]=3 266 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)S1 D75718 [0,1,0,1,0,0|1,0,0]=3 267 B13R2.43 O=CC1=CN2C=C(Br)C=CC2=N1 73475 [0,1,0,1,0,0|2,0,0]=4 268 B13R2.43 O=CC1=CN2C=CC(Br)=CC2=N1 38439 [0,1,0,1,0,0|2,0,0]=4 269 B13R2.43 O=CC1=NC2=C(C=C(Br)C=C2)O1 F13897 [0,1,0,1,0,0|2,0,0]=4 270 B13R2.43 O=CC1=NC2=C(C=CC(F)=C2)N1 20296 [0,1,0,1,0,0|2,0,0]=4 271 B13R2.3028 CC1=C(C)C2=C(C=CC(Cl)=C2)N1 C15308 [0,1,0,1,0,0|2,0,0]=4 272 B13R2.3028 CC1=C(C)C2=C(C=CC(F)=C2)N1 29250 [0,1,0,1,0,0|2,0,0]=4 273 B13R2.3028 CN1CC2=C(C=C(N)C=C2)C1=O 35777 [0,1,0,1,0,0|1,0,1]=4 274 B13R2.3028 CN1CC2=C(C=C(O)C=C2)C1=O C72365 [0,1,0,1,0,0|1,0,1]=4 275 B13R2.3028 C[C@H]1CC2=C(C=C(Br)C=C2)C1=O N12524 [0,1,0,1,0,0|0,0,2]=4 276 B13R2.3028 C[C@H]1CC2=C(C=C(Cl)C=C2)C1=O Y11349 [0,1,0,1,0,0|0,0,2]=4 277 B13R2.3683 BrC1=CN=C2C=C(I)C=CC2=C1 W17827 [0,1,0,1,0,0|2,0,0]=4 278 B13R2.3683 CC1=CC2=C(C=C1)OC(=O)C=C2 AC7838 [0,1,0,1,0,0|2,0,0]=4 279 B13R2.3683 CC1=CC=C2C=C(I)C=CC2=N1 72392 [0,1,0,1,0,0|2,0,0]=4 280 B13R2.3683 CC1=CC=C2C=C(O)C=CC2=C1 O11612 [0,1,0,1,0,0|1,0,0]=3 281 B13R2.3683 CC1=CC=C2N=C(N)C=CC2=C1 W10173 [0,1,0,1,0,0|2,0,0]=4 282 B13R2.3683 CC1=CN=C2C=C(Cl)C=CC2=N1 91924 [0,1,0,1,0,0|2,0,0]=4 283 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 30124 [0,1,0,1,0,0|2,0,0]=4 284 B13R2.3683 CC1=NC=C2C=C(O)C=CC2=C1 W17783 [0,1,0,1,0,0|2,0,0]=4 285 B13R2.3683 ClC1=CC=C2C=C(Br)C=CC2=C1 F11291 [0,1,0,1,0,0|2,0,0]=4 286 B13R2.3683 ClC1=CC=C2C=C(Br)C=NC2=C1 80430 [0,1,0,1,0,0|2,0,0]=4 287 B13R2.3683 ClC1=CN=C2C=C(Br)C=CC2=C1 80424 [0,1,0,1,0,0|2,0,0]=4 288 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 C76276 [0,1,0,1,0,0|2,0,0]=4 289 B13R2.3683 NC1=CC=C2C=C(Br)C=NC2=C1 33235 [0,1,0,1,0,0|2,0,0]=4 290 B13R2.3683 NC1=CC=C2C=C(Cl)C=NC2=C1 32795 [0,1,0,1,0,0|2,0,0]=4 291 B13R2.3683 NC1=CC=C2C=C(O)C=NC2=C1 33248 [0,1,0,1,0,0|2,0,0]=4 292 B13R2.3683 NC1=CN=C2C=C(Br)C=CC2=C1 80378 [0,1,0,1,0,0|2,0,0]=4 293 B13R2.3683 NC1=CN=C2C=C(Cl)C=CC2=C1 80393 [0,1,0,1,0,0|2,0,0]=4 294 B13R2.3683 NC1=CN=C2C=C(F)C=CC2=C1 80403 [0,1,0,1,0,0|2,0,0]=4 295 B13R2.3683 NC1=CN=C2C=C(O)C=CC2=C1 80447 [0,1,0,1,0,0|2,0,0]=4 296 B13R2.3683 OC1=CC=C2C=C(Cl)C=CC2=C1 N12660 [0,1,0,1,0,0|2,0,0]=4 297 B13R2.3683 OC1=CC=C2C=C(Cl)C=NC2=C1 80456 [0,1,0,1,0,0|2,0,0]=4 298 B13R2.3683 OC1=CC=C2C=C(F)C=CC2=C1 N14582 [0,1,0,1,0,0|2,0,0]=4 299 B13R2.3683 OC1=CC=C2C=C(F)C=NC2=C1 80458 [0,1,0,1,0,0|2,0,0]=4 300 B13R2.3683 OC1=CN=C2C=C(Br)C=CC2=C1 K10058 [0,1,0,1,0,0|2,0,0]=4 301 B13R2.3683 OC1=CN=C2C=C(F)C=CC2=C1 K10005 [0,1,0,1,0,0|2,0,0]=4 302 B13R2.54 CC1=CC=CC2=NC(C=O)=CN12 71530 [0,1,0,1,0,0|2,0,0]=4 303 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2N1 C72474 [0,1,0,1,0,0|1,0,0]=3 304 B13R2.54 O=CC1=CC2=C(Br)C=CC=C2S1 W19304 [0,1,0,1,0,0|1,0,0]=3 305 B13R2.54 O=CC1=CC2=C(Br)C=CN=C2N1 P16582 [0,1,0,1,0,0|2,0,0]=4 306 B13R2.54 O=CC1=CC2=C(C=CN=C2Cl)N1 D80237 [0,1,0,1,0,0|2,0,0]=4 307 B13R2.54 O=CC1=CC2=C(C=CN=C2Cl)O1 W19386 [0,1,0,1,0,0|2,0,0]=4 308 B13R2.54 O=CC1=CC2=C(C=CN=C2Cl)S1 C90273 [0,1,0,1,0,0|2,0,0]=4 309 B13R2.54 O=CC1=CC2=C(C=CN=C2F)N1 P20058 [0,1,0,1,0,0|2,0,0]=4 310 B13R2.54 O=CC1=CC2=C(C=CNC2=O)O1 W16861 [0,1,0,1,0,0|2,0,0]=4 311 B13R2.54 O=CC1=CC2=C(Cl)C=CC=C2N1 72070 [0,1,0,1,0,0|1,0,0]=3 312 B13R2.54 O=CC1=CC2=CC=CC(Cl)=C2S1 W19231 [0,1,0,1,0,0|1,0,0]=3 313 B13R2.54 O=CC1=CC2=CN=CC(I)=C2O1 AC2181 [0,1,0,1,0,0|2,0,0]=4 314 B13R2.54 O=CC1=CC2=NC=CC(Cl)=C2S1 P11518 [0,1,0,1,0,0|2,0,0]=4 315 B13R2.54 O=CC1=CN2C(Cl)=CC=CC2=N1 D76138 [0,1,0,1,0,0|2,0,0]=4 316 B13R2.155 BrC1=CN=C2C=CC(I)=CC2=C1 C73886 [0,1,0,1,0,0|2,0,0]=4 317 B13R2.155 CC1=CC=C2C=CC(C)=CC2=C1 71004 [0,1,0,1,0,0|1,0,0]=3 318 B13R2.155 CC1=CC=C2C=CC(C)=NC2=C1 I11455 [0,1,0,1,0,0|2,0,0]=4 319 B13R2.155 CC1=CC=C2C=CC(Cl)=NC2=C1 97613 [0,1,0,1,0,0|2,0,0]=4 320 B13R2.155 CC1=CC=C2C=CC(O)=CC2=C1 N12964 [0,1,0,1,0,0|1,0,0]=3 321 B13R2.155 CC1=CC=C2C=CC(O)=CC2=N1 AC4651 [0,1,0,1,0,0|2,0,0]=4 322 B13R2.155 CC1=CN=C2C=CC(Br)=CC2=C1 AC8709 [0,1,0,1,0,0|1,0,0]=3 323 B13R2.155 CC1=NC=C2C=CC(Cl)=CC2=C1 C72624 [0,1,0,1,0,0|2,0,0]=4 324 B13R2.155 ClC1=CC=C2C=CC(Br)=CC2=C1 74553 [0,1,0,1,0,0|2,0,0]=4 325 B13R2.155 ClC1=CC=C2N=CC(Br)=CC2=C1 80390 [0,1,0,1,0,0|2,0,0]=4 326 B13R2.155 ClC1=CN=C2C=CC(Br)=CC2=C1 80407 [0,1,0,1,0,0|2,0,0]=4 327 B13R2.155 FC1=CC=C2N=CC(Br)=CC2=C1 80396 [0,1,0,1,0,0|2,0,0]=4 328 B13R2.155 NC1=CC=C2C=CC(N)=CC2=C1 D82402 [0,1,0,1,0,0|2,0,0]=4 329 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 C75426 [0,1,0,1,0,0|2,0,0]=4 330 B13R2.155 NC1=CC=C2N=CC(Cl)=CC2=C1 33243 [0,1,0,1,0,0|2,0,0]=4 331 B13R2.155 NC1=CC=C2N=CC(F)=CC2=C1 86894 [0,1,0,1,0,0|2,0,0]=4 332 B13R2.155 NC1=CN=C2C=CC(Br)=CC2=C1 80351 [0,1,0,1,0,0|2,0,0]=4 333 B13R2.155 NC1=CN=C2C=CC(Cl)=CC2=C1 80340 [0,1,0,1,0,0|2,0,0]=4 334 B13R2.155 NC1=CN=C2C=CC(F)=CC2=C1 68616 [0,1,0,1,0,0|2,0,0]=4 335 B13R2.155 NC1=CN=C2C=CC(O)=CC2=C1 80347 [0,1,0,1,0,0|2,0,0]=4 336 B13R2.155 OC1=CC=C2C=CC(Cl)=CC2=C1 N14581 [0,1,0,1,0,0|2,0,0]=4 337 B13R2.155 OC1=CC=C2N=CC(Br)=CC2=C1 80395 [0,1,0,1,0,0|2,0,0]=4 338 B13R2.155 OC1=CC=C2N=CC(F)=CC2=C1 80397 [0,1,0,1,0,0|2,0,0]=4 339 B13R2.155 OC1=CC=C2N=CC(I)=CC2=C1 C76988 [0,1,0,1,0,0|2,0,0]=4 340 B13R2.155 OC1=CN=C2C=CC(Br)=CC2=C1 83287 [0,1,0,1,0,0|2,0,0]=4 341 B13R2.155 OC1=CN=C2C=CC(Cl)=CC2=C1 33286 [0,1,0,1,0,0|2,0,0]=4 342 B13R2.155 OC1=CN=C2C=CC(F)=CC2=C1 33295 [0,1,0,1,0,0|2,0,0]=4 343 B13R2.4856 CN1CC2=CC=CC(Br)=C2C1=O 72566 [0,1,0,1,0,0|1,0,1]=4 344 B13R2.4856 CN1CC2=CC=CC(N)=C2C1=O P11531 [0,1,0,1,0,0|1,0,1]=4 345 B13R2.4856 O=C1NC2=CC=CC(F)=C2C1=O 83458 [0,1,0,1,0,0|2,0,0]=4 346 B13R2.5179 BrC1=C2N=CC(I)=CC2=CC=C1 21029 [0,1,0,1,0,0|2,0,0]=4 347 B13R2.5179 CC1=C2N=CC(Br)=CC2=CC=C1 P17587 [0,1,0,1,0,0|2,0,0]=4 348 B13R2.5179 CC1=CC2=C(C=C1)C(=O)NC=C2 W11384 [0,1,0,1,0,0|2,0,0]=4 349 B13R2.5179 CC1=CC2=CC=CC(N)=C2N=C1 D72054 [0,1,0,1,0,0|1,0,0]=3 350 B13R2.5179 CC1=CC=C2C(Br)=CC=CC2=N1 AC2042 [0,1,0,1,0,0|2,0,0]=4 351 B13R2.5179 CC1=CC=C2C(Cl)=CC=CC2=N1 H10153 [0,1,0,1,0,0|2,0,0]=4 352 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=C1 C71537 [0,1,0,1,0,0|1,0,0]=3 353 B13R2.5179 CC1=CN=C2C(O)=CC=CC2=C1 D82795 [0,1,0,1,0,0|1,0,0]=3 354 B13R2.5179 CC1=NC2=CC=CC(N)=C2C=C1 76214 [0,1,0,1,0,0|2,0,0]=4 355 B13R2.5179 CC1=NC=C2C(Br)=CC=CC2=C1 D79826 [0,1,0,1,0,0|2,0,0]=4 356 B13R2.5179 ClC1=C2N=CC(Br)=CC2=CC=C1 33277 [0,1,0,1,0,0|2,0,0]=4 357 B13R2.5179 ClC1=C2N=CC(I)=CC2=CC=C1 95157 [0,1,0,1,0,0|2,0,0]=4 358 B13R2.5179 FC1=C2N=CC(Br)=CC2=CC=C1 86860 [0,1,0,1,0,0|2,0,0]=4 359 B13R2.5179 FC1=C2N=CC(I)=CC2=CC=C1 87270 [0,1,0,1,0,0|2,0,0]=4 360 B13R2.5179 FC1=CN=C2C(Br)=CC=CC2=C1 21023 [0,1,0,1,0,0|2,0,0]=4 361 B13R2.5179 NC1=C2N=CC(Br)=CC2=CC=C1 21043 [0,1,0,1,0,0|2,0,0]=4 362 B13R2.5179 NC1=C2N=CC(Cl)=CC2=CC=C1 21045 [0,1,0,1,0,0|2,0,0]=4 363 B13R2.5179 NC1=C2N=CC(F)=CC2=CC=C1 21041 [0,1,0,1,0,0|2,0,0]=4 364 B13R2.5179 NC1=CC=C2C(O)=CC=CC2=C1 A51054 [0,1,0,1,0,0|2,0,0]=4 365 B13R2.5179 NC1=CN=C2C(Br)=CC=CC2=C1 27081 [0,1,0,1,0,0|2,0,0]=4 366 B13R2.5179 NC1=CN=C2C(Cl)=CC=CC2=C1 33239 [0,1,0,1,0,0|2,0,0]=4 367 B13R2.5179 NC1=CN=C2C(F)=CC=CC2=C1 87273 [0,1,0,1,0,0|2,0,0]=4 368 B13R2.5179 OC1=C2C=CC(Br)=CC2=CC=C1 21067 [0,1,0,1,0,0|2,0,0]=4 369 B13R2.5179 OC1=C2C=CC(Cl)=CC2=CC=C1 53844 [0,1,0,1,0,0|2,0,0]=4 370 B13R2.5179 OC1=C2C=CC(F)=CC2=CC=C1 53843 [0,1,0,1,0,0|2,0,0]=4 371 B13R2.5179 OC1=C2N=CC(Br)=CC2=CC=C1 80449 [0,1,0,1,0,0|2,0,0]=4 372 B13R2.5179 OC1=C2N=CC(Cl)=CC2=CC=C1 80448 [0,1,0,1,0,0|2,0,0]=4 373 B13R2.5179 OC1=C2N=CC(F)=CC2=CC=C1 80450 [0,1,0,1,0,0|2,0,0]=4 374 B13R2.5179 OC1=CC=C2C(Br)=CC=CC2=C1 N14953 [0,1,0,1,0,0|2,0,0]=4 375 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=C1 N14954 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.5179 OC1=CN=C2C(Cl)=CC=CC2=C1 33276 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.5179 OC1=CN=C2C(F)=CC=CC2=C1 33251 [0,1,0,1,0,0|2,0,0]=4 378 B13R2.5190 CC1=CC2=C(C=C1)C(=O)C(=O)N2 30937 [0,1,0,1,0,0|2,0,0]=4 379 B13R2.5190 CN1CC2=C(C=CC(Br)=C2)C1=O 82186 [0,1,0,1,0,0|1,0,1]=4 380 B13R2.5190 C[C@H]1CC2=C(C=CC(Br)=C2)C1=O F12673 [0,1,0,1,0,0|0,0,2]=4 381 B13R2.243 CC1(C)NC2=C(C=CC=C2)C1=O N10640 [0,1,0,1,0,0|1,0,1]=4 382 B13R2.162 CC1=C2C=C(Br)C=CC2=CC=C1 97755 [0,1,0,1,0,0|2,0,0]=4 383 B13R2.162 CC1=CC2=C(C=C1)OC=CC2=O D76209 [0,1,0,1,0,0|2,0,0]=4 384 B13R2.162 CC1=CC2=C(C=CNC2=O)C=C1 F30995 [0,1,0,1,0,0|2,0,0]=4 385 B13R2.162 CC1=CC2=C(N)C=CC=C2C=N1 96525 [0,1,0,1,0,0|2,0,0]=4 386 B13R2.162 CC1=CC=C2C=CC=C(Cl)C2=C1 P16840 [0,1,0,1,0,0|1,0,0]=3 387 B13R2.162 CC1=CC=C2C=CN=C(O)C2=C1 32391 [0,1,0,1,0,0|2,0,0]=4 388 B13R2.162 CC1=CC=C2C=NC=C(Br)C2=C1 Y10378 [0,1,0,1,0,0|2,0,0]=4 389 B13R2.162 CC1=CC=C2N=CC=C(Cl)C2=C1 27969 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.162 CC1=CC=C2N=CC=C(O)C2=C1 C74209 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.162 CC1=CN=C2C=CC=C(Br)C2=C1 C15736 [0,1,0,1,0,0|1,0,0]=3 392 B13R2.162 CC1=NC2=C(C)C=CC=C2C=C1 F12427 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.162 CC1=NC=C2C=CC=C(Br)C2=C1 78671 [0,1,0,1,0,0|2,0,0]=4 394 B13R2.162 ClC1=C2C=C(Br)C=CC2=CC=C1 A10733 [0,1,0,1,0,0|2,0,0]=4 395 B13R2.162 ClC1=C2C=C(Br)C=NC2=CC=C1 80405 [0,1,0,1,0,0|2,0,0]=4 396 B13R2.162 FC1=C2C=C(Br)C=NC2=CC=C1 80406 [0,1,0,1,0,0|2,0,0]=4 397 B13R2.162 FC1=CN=C2C=CC=C(Br)C2=C1 80412 [0,1,0,1,0,0|2,0,0]=4 398 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 D93765 [0,1,0,1,0,0|2,0,0]=4 399 B13R2.162 NC1=C2C=C(Br)C=CC2=CC=C1 W18066 [0,1,0,1,0,0|2,0,0]=4 400 B13R2.162 NC1=C2C=C(Br)C=NC2=CC=C1 33232 [0,1,0,1,0,0|2,0,0]=4 401 B13R2.162 NC1=C2C=C(Cl)C=NC2=CC=C1 33259 [0,1,0,1,0,0|2,0,0]=4 402 B13R2.162 NC1=C2C=C(F)C=NC2=CC=C1 33211 [0,1,0,1,0,0|2,0,0]=4 403 B13R2.162 NC1=CC=C2C=CC=C(O)C2=C1 Y11357 [0,1,0,1,0,0|2,0,0]=4 404 B13R2.162 NC1=CN=C2C=CC=C(Br)C2=C1 80357 [0,1,0,1,0,0|2,0,0]=4 405 B13R2.162 NC1=CN=C2C=CC=C(F)C2=C1 80355 [0,1,0,1,0,0|2,0,0]=4 406 B13R2.162 NC1=CN=C2C=CC=C(O)C2=C1 80356 [0,1,0,1,0,0|2,0,0]=4 407 B13R2.162 OC1=C2C=C(Br)C=NC2=CC=C1 80399 [0,1,0,1,0,0|2,0,0]=4 408 B13R2.162 OC1=C2C=C(Cl)C=CC2=CC=C1 W18102 [0,1,0,1,0,0|2,0,0]=4 409 B13R2.162 OC1=C2C=C(F)C=CC2=CC=C1 S10318 [0,1,0,1,0,0|2,0,0]=4 410 B13R2.162 OC1=C2C=C(F)C=NC2=CC=C1 80401 [0,1,0,1,0,0|2,0,0]=4 411 B13R2.162 OC1=CC=C2C=CC=C(Br)C2=C1 N12565 [0,1,0,1,0,0|2,0,0]=4 412 B13R2.162 OC1=CC=C2C=CC=C(Cl)C2=C1 Y11367 [0,1,0,1,0,0|2,0,0]=4 413 B13R2.162 OC1=CC=C2C=CC=C(F)C2=C1 83450 [0,1,0,1,0,0|2,0,0]=4 414 B13R2.162 OC1=CN=C2C=CC=C(F)C2=C1 33309 [0,1,0,1,0,0|2,0,0]=4 415 B13R2.4825 CN1CC2=C(Br)C=CC=C2C1=O 24291 [0,1,0,1,0,0|1,0,1]=4 416 B13R2.4825 CN1CC2=C(C=CC=C2N)C1=O P12614 [0,1,0,1,0,0|1,0,1]=4 417 B13R2.4825 C[C@H]1CC2=C(Br)C=CC=C2C1=O F19995 [0,1,0,1,0,0|0,0,2]=4 418 B13R2.4825 NC1=CC=CC2=C1NC(=O)C2=O AC5802 [0,1,0,1,0,0|2,0,0]=4 419 B13R2.4825 O=C1NC2=C(C=CC=C2O)C1=O AC3054 [0,1,0,1,0,0|2,0,0]=4 420 B13R2.4825 O=C1NC2=C(I)C=CC=C2C1=O 82428 [0,1,0,1,0,0|2,0,0]=4 421 B9R1.6 C=C(C)C1=NC=CC=C1 W17791 [1,0,0,0,1,0|1,0,0]=3 422 B9R1.6 CC(=O)C1=NN=CC=C1 37064 [1,0,0,0,1,0|2,0,0]=4 423 B9R1.6 C[C@H](N)C1=CC=CC=C1 D77753 [1,0,0,0,1,0|1,0,1]=4 424 B9R1.6 C[S@](=O)C1=NC=CC=C1 C74099 [1,0,0,0,1,0|2,0,0]=4 425 B9R1.13 CC(=O)CC1=CC=CS1 W16827 [1,0,0,0,1,0|1,0,1]=4 426 B9R1.11 O=CC(=O)C1=CC=CO1 D94856 [0,0,0,0,2,0|2,0,0]=4