0 B13R1.547 CNC(=O)C1=C(B(O)O)C=CC=C1 AC1047 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.547 COC(=O)C1=C(C(=O)O)C=NC=C1 W10245 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.547 COC(=O)C1=C(C(C)=O)C=CC=C1 72700 [0,0,0,0,0,0|2,0,0]=2 3 B13R1.547 COC(=O)C1=C(C(C)C)C=CC=C1 AC7725 [0,0,0,0,0,0|1,0,0]=1 4 B13R1.547 COC(=O)C1=C(C(N)=O)C=CC=C1 AC7190 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.547 COC(=O)C1=C([C@H](C)N)C=CC=C1 Y11575 [0,0,0,0,0,0|2,0,0]=2 6 B13R1.547 COC(=O)C1=C([C@H](C)N)C=CC=C1 Y11577 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.77 C=CC1=C(C(=O)OC)C=CC=C1 F53555 [1,0,0,0,0,0|1,0,1]=3 8 B12R1.77 C=CC1=C(C(=O)OC)C=CC=N1 70929 [1,0,0,0,0,0|2,0,1]=4 9 B12R1.77 COC(=O)C1=C(C#N)C=NC=C1 85332 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.77 COC(=O)C1=C(CCl)C=CN=C1 63528 [1,0,0,0,0,0|3,0,0]=4 11 B12R1.77 COC(=O)C1=C(CN)N=CC=C1 O11853 [1,0,0,0,0,0|3,0,0]=4 12 B12R1.77 COC(=O)C1=C(NN)C=CC=C1 20930 [1,0,0,0,0,0|1,0,0]=2 13 B12R1.77 COC(=O)C1=CC=CN=C1CCl 84738 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.77 COC(=O)C1=NC=CC=C1C#N AC6324 [1,0,0,0,0,0|3,0,0]=4 15 B12R1.77 COC(=O)C1=NC=CC=C1OC 27447 [1,0,0,0,0,0|2,0,0]=3 16 B12R1.261 CC(=O)C1=C(B(O)O)C=CC=C1 50324 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.261 CC(=O)C1=CC=CN=C1C(=O)O D95040 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.261 CC(C)C1=C([C@H](C)N)C=CC=C1 N14721 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.261 CN(C)C1=C(C(=O)O)C=CC=N1 79702 [1,0,0,0,0,0|1,0,0]=2 20 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y10100 [1,0,0,0,0,0|2,0,0]=3 21 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y12102 [1,0,0,0,0,0|2,0,0]=3 22 B12R1.261 C[C@H](N)C1=C(C(=O)O)C=CC=C1 Y12103 [1,0,0,0,0,0|2,0,0]=3 23 B12R1.261 C[C@H](N)C1=C(N(C)C)C=CC=C1 Y14571 [1,0,0,0,0,0|1,0,1]=3 24 B12R1.261 C[SiH](C)C1=C([SiH](C)C)C=CC=C1 T70451 [1,0,0,0,0,0|2,1,0]=4 25 B14R1.623 CCOC(=O)C1=C(C(Br)Br)C=CC=C1 F53189 [0,1,0,0,0,0|3,0,0]=4 26 B14R1.707 COC(=O)C1=C(B(O)O)C=CC(F)=C1 98342 [0,1,0,0,0,0|3,0,0]=4 27 B14R1.707 COC(=O)C1=C(C(=O)O)C=CC(F)=C1 C90105 [0,1,0,0,0,0|3,0,0]=4 28 B14R1.707 COC(=O)C1=C(N(C)C)C=CC(Br)=C1 D82663 [0,1,0,0,0,0|0,0,0]=1 29 B14R1.707 COC(=O)C1=C(N(C)C)C=CC(F)=C1 AB22737 [0,1,0,0,0,0|0,0,0]=1 30 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(N)=C1 TD1276 [0,1,0,0,0,0|2,0,1]=4 31 B14R1.746 CNC(=O)C1=C(C(=O)NC)C=CC=C1 D93387 [0,1,0,0,0,0|3,0,0]=4 32 B14R1.1126 COC(=O)C1=C([N+](=O)[O-])C=C(O)C=C1 AB7538 [0,1,0,0,0,0|2,0,1]=4 33 B14R1.1126 COC(=O)C1=CN=C(Cl)C=C1N(C)C D79903 [0,1,0,0,0,0|1,0,0]=2 34 B14R1.1153 COC(=O)C1=CC=CC(Br)=C1C(=O)O AC1556 [0,1,0,0,0,0|3,0,0]=4 35 B14R1.1153 COC(=O)C1=CC=CC(Br)=C1[N+](=O)[O-] 95603 [0,1,0,0,0,0|2,0,1]=4 36 B14R1.1153 COC(=O)C1=CC=CC(N)=C1[N+](=O)[O-] 76625 [0,1,0,0,0,0|2,0,1]=4 37 B14R1.1164 COC(=O)C1=C(Br)C=CC=C1[N+](=O)[O-] CL9654 [0,1,0,0,0,0|2,0,1]=4 38 B14R1.1164 COC(=O)C1=C(Cl)C=CC=C1[N+](=O)[O-] D96078 [0,1,0,0,0,0|2,0,1]=4 39 B14R1.1164 COC(=O)C1=C([N+](=O)[O-])C=CC=C1O C72077 [0,1,0,0,0,0|2,0,1]=4 40 B14R2.10655 COC(=O)C1=C(C2CC2)C=CC=C1 F14172 [0,0,0,1,0,0|1,0,0]=2 41 B12R1.368 COC(=O)C1=C(C(C)C)C=CN1 D79401 [0,0,0,0,1,0|2,0,0]=3 42 B12R1.368 COC(=O)C1=CC=NN1C(C)C A11816 [0,0,0,0,1,0|3,0,0]=4 43 B14R1.744 COC(=O)C1=C(CC(=O)O)C=CC=C1 S11314 [0,0,0,0,0,1|3,0,0]=4 44 B14R1.744 COC(=O)C1=C(CC(C)C)N=CC=C1 P20769 [0,0,0,0,0,1|2,0,0]=3 45 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 77937 [2,0,0,0,0,0|1,0,1]=4 46 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 79244 [2,0,0,0,0,0|1,0,1]=4 47 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 O10770 [2,0,0,0,0,0|2,0,0]=4 48 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 O11001 [2,0,0,0,0,0|2,0,0]=4 49 B11R1.53 CCC1=C(C(=O)O)C=NC=C1 C75477 [2,0,0,0,0,0|2,0,0]=4 50 B11R1.53 CCC1=C(C(C)=O)C=CC=C1 A10857 [2,0,0,0,0,0|1,0,0]=3 51 B11R1.53 CN(C)C1=C(CN)C=CC=C1 C16014 [2,0,0,0,0,0|1,0,1]=4 52 B11R1.53 CN(C)C1=C(CO)C=CC=C1 W18685 [2,0,0,0,0,0|0,0,1]=3 53 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 C73575 [2,0,0,0,0,0|0,0,0]=2 54 B11R1.53 COC1=C(C(C)=O)C=CC=N1 32755 [2,0,0,0,0,0|2,0,0]=4 55 B11R1.53 COC1=C(C(C)=O)C=CN=C1 C76667 [2,0,0,0,0,0|2,0,0]=4 56 B11R1.53 COC1=C(C(C)=O)C=NC=C1 CS1683 [2,0,0,0,0,0|2,0,0]=4 57 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 52750 [2,0,0,0,0,0|2,0,0]=4 58 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 F16921 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 N10418 [2,0,0,0,0,0|2,0,0]=4 60 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10162 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 Y10512 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.222 CC1=C(C(=O)C#N)C=CC=C1 AB1507 [2,0,0,0,0,0|2,0,0]=4 63 B11R1.222 COC(=O)C1=C(Br)C=CN=C1 I11422 [2,0,0,0,0,0|2,0,0]=4 64 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 26180 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.222 COC(=O)C1=C(N)N=CN=C1 26406 [2,0,0,0,0,0|2,0,0]=4 66 B11R1.222 COC(=O)C1=C(N)N=NC=C1 32233 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.222 COC(=O)C1=C(O)C=CN=C1 F30285 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.222 COC(=O)C1=NC=NC=C1N P21150 [2,0,0,0,0,0|2,0,0]=4 69 B13R1.107 CCC1=C(C(=O)OC)C=CC=C1O C73537 [1,1,0,0,0,0|1,0,0]=3 70 B13R1.107 COC(=O)C1=C(C#N)C(C)=CC=C1 S10851 [1,1,0,0,0,0|2,0,0]=4 71 B13R1.107 COC(=O)C1=C(OC)C(N)=CC=C1 D73910 [1,1,0,0,0,0|1,0,0]=3 72 B13R1.107 COC(=O)C1=C(OC)C(O)=CC=C1 D82749 [1,1,0,0,0,0|1,0,0]=3 73 B13R1.107 COC(=O)C1=CC=CC(Br)=C1CBr AR3734 [1,1,0,0,0,0|2,0,0]=4 74 B13R1.107 COC(=O)C1=CC=CC(Br)=C1OC 55833 [1,1,0,0,0,0|1,0,0]=3 75 B13R1.107 COC(=O)C1=CC=CC(F)=C1CBr 90027 [1,1,0,0,0,0|2,0,0]=4 76 B13R1.464 CCOC(=O)C1=C(CBr)C=CC=C1 F11922 [1,1,0,0,0,0|2,0,0]=4 77 B13R1.464 CCOC(=O)C1=C(NC)N=CC=C1 AC2786 [1,1,0,0,0,0|1,0,0]=3 78 B13R1.464 CCOC(=O)C1=C(NN)N=CC=C1 W15401 [1,1,0,0,0,0|2,0,0]=4 79 B13R1.2065 CCC1=C(C(=O)OC)C=CC(N)=C1 C71769 [1,1,0,0,0,0|1,0,0]=3 80 B13R1.2065 CNC1=CC(F)=NC=C1C(=O)OC D79969 [1,1,0,0,0,0|1,0,0]=3 81 B13R1.2065 COC(=O)C1=C(C#N)C=C(Cl)C=C1 84779 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.2065 COC(=O)C1=C(C=O)C=C(Br)C=C1 98199 [1,1,0,0,0,0|2,0,0]=4 83 B13R1.2065 COC(=O)C1=C(C=O)C=C(O)C=C1 D79386 [1,1,0,0,0,0|2,0,0]=4 84 B13R1.2065 COC(=O)C1=C(OC)C=C(O)C=C1 F15602 [1,1,0,0,0,0|1,0,0]=3 85 B13R1.2065 COC(=O)C1=C(OC)N=C(Br)C=C1 C71051 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.2065 COC(=O)C1=C(OC)N=C(Cl)C=C1 52594 [1,1,0,0,0,0|2,0,0]=4 87 B13R1.2065 COC(=O)C1=C(OC)N=C(N)C=C1 52593 [1,1,0,0,0,0|2,0,0]=4 88 B13R1.2065 COC(=O)C1=C(SC)C=C(Br)C=C1 W15270 [1,1,0,0,0,0|1,0,0]=3 89 B13R1.2065 COC(=O)C1=CN=C(Cl)C=C1OC 85559 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.2065 COC(=O)C1=NC=C(Br)C=C1OC P11335 [1,1,0,0,0,0|2,0,0]=4 91 B13R1.2209 CCC1=C(C(=O)OC)C=C(Br)C=C1 CL9462 [1,1,0,0,0,0|1,0,0]=3 92 B13R1.2209 CNC1=C(C(=O)OC)C=C(Cl)C=C1 C75582 [1,1,0,0,0,0|0,0,0]=2 93 B13R1.2209 CNC1=C(C(=O)OC)C=C(F)C=C1 C77167 [1,1,0,0,0,0|0,0,0]=2 94 B13R1.2209 CNC1=C(C(=O)OC)N=C(Br)C=N1 N13229 [1,1,0,0,0,0|2,0,0]=4 95 B13R1.2209 CNC1=CC=C(C)N=C1C(=O)OC D81457 [1,1,0,0,0,0|1,0,0]=3 96 B13R1.2209 CNC1=CN=C(Cl)C=C1C(=O)OC 52090 [1,1,0,0,0,0|1,0,0]=3 97 B13R1.2209 COC(=O)C1=C(C#N)C=CC(N)=C1 N10633 [1,1,0,0,0,0|2,0,0]=4 98 B13R1.2209 COC(=O)C1=C(C=O)C=CC(F)=C1 55859 [1,1,0,0,0,0|2,0,0]=4 99 B13R1.2209 COC(=O)C1=C(CBr)C=CC(I)=C1 87914 [1,1,0,0,0,0|2,0,0]=4 100 B13R1.2209 COC(=O)C1=C(CN)C=CC(Br)=C1 CL9469 [1,1,0,0,0,0|2,0,0]=4 101 B13R1.2209 COC(=O)C1=C(NN)C=CC(Cl)=C1 D88070 [1,1,0,0,0,0|1,0,0]=3 102 B13R1.2209 COC(=O)C1=C(OC)C=CC(Cl)=N1 W18514 [1,1,0,0,0,0|2,0,0]=4 103 B13R1.2209 COC(=O)C1=C(OC)C=CC(F)=C1 N12614 [1,1,0,0,0,0|1,0,0]=3 104 B13R1.2209 COC(=O)C1=C(OC)N=CC(N)=C1 85043 [1,1,0,0,0,0|2,0,0]=4 105 B13R1.2209 COC(=O)C1=C(OC)N=CC(O)=C1 82672 [1,1,0,0,0,0|2,0,0]=4 106 B13R1.2357 COC(=O)C1=C(CBr)C=CC=C1Cl 90025 [1,1,0,0,0,0|2,0,0]=4 107 B13R1.2357 COC(=O)C1=C(CBr)C=CC=C1F 90028 [1,1,0,0,0,0|2,0,0]=4 108 B13R1.2357 COC(=O)C1=C(Cl)C=CN=C1OC C72030 [1,1,0,0,0,0|2,0,0]=4 109 B13R1.2357 COC(=O)C1=C(F)C=CC=C1C=O 98195 [1,1,0,0,0,0|2,0,0]=4 110 B13R1.2357 COC(=O)C1=C(I)C=CC=C1CBr 54872 [1,1,0,0,0,0|2,0,0]=4 111 B13R1.2357 COC(=O)C1=C(I)C=CC=C1OC 58594 [1,1,0,0,0,0|1,0,0]=3 112 B13R1.2357 COC(=O)C1=C(N)C=CC=C1C#N CL9652 [1,1,0,0,0,0|2,0,0]=4 113 B13R1.2357 COC(=O)C1=C(OC)C=CC=C1C F17492 [1,1,0,0,0,0|1,0,0]=3 114 B13R1.2357 COC(=O)C1=C(OC)C=CC=C1N W11056 [1,1,0,0,0,0|1,0,0]=3 115 B13R1.2357 COC(=O)C1=C(OC)C=CC=C1O Y13599 [1,1,0,0,0,0|1,0,0]=3 116 B13R1.2357 COC(=O)C1=C(OC)C=CN=C1Cl C13750 [1,1,0,0,0,0|2,0,0]=4 117 B13R1.349 CC(C)(C)C1=C(C(=O)O)C=CC=C1 C14140 [1,1,0,0,0,0|1,0,0]=3 118 B13R1.349 CC(C)(C)C1=C(C(=O)O)C=CC=N1 W16377 [1,1,0,0,0,0|2,0,0]=4 119 B15R1.3847 COC(=O)CC1=C(C(=O)OC)C=CC=C1 Y13597 [0,1,0,0,0,1|2,0,0]=4 120 B15R1.11677 COC(=O)C1=C(OC(C)C)C=C(N)C=C1 W17284 [0,1,0,0,0,1|1,0,0]=3 121 B15R1.11677 COC(=O)C1=CN=C(F)C=C1NC(C)C D79968 [0,1,0,0,0,1|2,0,0]=4 122 B15R1.927 COC(=O)C1=C(C(C)(C)C)C=CC(N)=C1 C91660 [0,2,0,0,0,0|1,0,0]=3 123 B15R1.927 COC(=O)C1=C(S(C)(=O)=O)C=CC(Br)=C1 Y14615 [0,2,0,0,0,0|2,0,0]=4 124 B15R1.927 COC(=O)C1=C(S(C)(=O)=O)C=CC(C)=C1 AC2453 [0,2,0,0,0,0|2,0,0]=4 125 B15R1.38521 COC(=O)C1=C(C(=O)OC)C=C(Cl)C=C1 AB11161 [0,2,0,0,0,0|2,0,0]=4 126 B15R1.38521 COC(=O)C1=C(C(=O)OC)C=C(I)C=C1 AC6425 [0,2,0,0,0,0|2,0,0]=4 127 B15R1.38509 COC(=O)C1=CC=CC(Cl)=C1C(=O)OC D84552 [0,2,0,0,0,0|2,0,0]=4 128 B15R1.38509 COC(=O)C1=CC=CC(O)=C1C(=O)OC W16937 [0,2,0,0,0,0|2,0,0]=4 129 B13R1.15 COC(=O)\C=C\C1=CC(C)=CC=C1 W11679 [0,0,1,1,0,0|1,0,1]=4 130 B13R2.371 N[C@H]1COC(=O)C2=C1C=CC=C2 Y11200 [1,0,0,1,0,0|2,0,0]=4 131 B13R2.371 O=C1COC(=O)C2=C1C=CC=C2 C75667 [1,0,0,1,0,0|2,0,0]=4 132 B13R2.582 COC1=C2C(=O)NCC2=CC=C1 F17802 [1,0,0,1,0,0|2,0,0]=4 133 B13R2.582 COC1=C2C(=O)OCC2=CC=C1 N14311 [1,0,0,1,0,0|1,0,0]=3 134 B13R2.5252 O=C1NCCOC2=C1C=CC=C2 71397 [1,0,0,1,0,0|2,0,0]=4 135 B13R2.5252 O=C1NCCSC2=C1C=CC=C2 81809 [1,0,0,1,0,0|2,0,0]=4 136 B13R2.5514 O=C(O)C1=NC=CC=C1C2CC2 C76896 [1,0,0,1,0,0|2,0,0]=4 137 B13R2.12159 CC1(C)NC(=O)C2=C1C=CC=C2 37674 [1,0,0,1,0,0|2,0,0]=4 138 B13R2.12159 CC1=CC(C)(C)C2=C1C=CC=C2 D93282 [1,0,0,1,0,0|2,0,0]=4 139 B15R2.19309 COC(=O)C1=C2SC(C)=NC2=CC=C1 W10268 [0,0,0,1,0,1|2,0,0]=4 140 B15R2.19309 COC(=O)C1=CC=CC2=CN(C)N=C21 P11069 [0,0,0,1,0,1|0,0,1]=3 141 B15R2.23388 COC(=O)C1=NN(C)C2=C1C=CC=C2 BL002605 [0,0,0,1,0,1|1,0,0]=3 142 B15R2.7494 CC1(C)CCC(=O)C2=C1C=CC(Br)=C2 59796 [0,1,0,1,0,0|2,0,0]=4 143 B15R2.7494 CC1(C)CCC(=O)C2=C1C=CC(N)=C2 59799 [0,1,0,1,0,0|2,0,0]=4 144 B15R2.19310 COC(=O)C1=C2C(=CC=C1)C=NN2C P11068 [0,1,0,1,0,0|0,0,1]=3 145 B15R2.14787 CC1(C)CCC(=O)C2=C1C=C(Br)C=C2 I10575 [0,1,0,1,0,0|2,0,0]=4 146 B13R1.91 COC(=O)CC1=C(CCl)C=CC=C1 71911 [1,0,0,0,0,1|2,0,0]=4 147 B13R1.91 COC(=O)NC1=C(CO)C=CC=C1 W11200 [1,0,0,0,0,1|2,0,0]=4 148 B13R1.543 CN(C)C1=CC=CC(C(=O)NN)=C1 C11419 [0,0,0,0,1,1|2,0,0]=4 149 B13R1.543 COC(=O)C1=CC([C@H](C)N)=CC=C1 20351 [0,0,0,0,1,1|2,0,0]=4 150 B13R1.543 COC(=O)C1=CC([C@H](C)N)=CC=C1 Y10357 [0,0,0,0,1,1|2,0,0]=4 151 B13R1.543 COC(=O)C1=CC=CC([C@H](C)Br)=C1 32631 [0,0,0,0,1,1|2,0,0]=4 152 B13R1.543 COC(=O)C1=CN=CC(N(C)C)=C1 30521 [0,0,0,0,1,1|1,0,0]=3