0 B12R1.56 CC(=O)C1=CC(C#N)=C(F)C=C1 CS-0043851 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 CS-W017876 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.56 COC1=CC(B(O)O)=CC=C1C CS-W016069 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.56 COC1=CC(B(O)O)=CC=C1O CS-0044961 [0,0,0,0,0,0|1,0,1]=2 4 B12R1.56 COC1=CC(C(=O)O)=CC=C1N CS-M0329 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1Br CS-W014685 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1C CS-W017839 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O CS-W005249 [0,0,0,0,0,0|1,0,1]=2 8 B12R1.56 N#CC1=CC(C(=O)O)=CC=C1Cl CS-0030476 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.56 N#CC1=CC(C(=O)O)=CC=C1F CS-WAA0109 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.56 O=C(O)C1=CC=C(Br)C(CO)=C1 CS-W022098 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.56 O=CC1=CC([N+](=O)[O-])=CC=C1O CS-M1907 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 CS-W005607 [1,0,0,0,0,0|3,0,0]=4 13 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 CS-W016243 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.21 CC(=O)C1=CC=C(O)C(Br)=C1 CS-0042105 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 CS-W007779 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 CS-0032913 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.21 CC1=C(Cl)N=C(C(=O)O)C=C1 CS-W019905 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 CS-0043478 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 CS-W022384 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 CS-W010963 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl CS-W017678 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.21 CC1=CC(B(O)O)=CC=C1O CS-0061270 [1,0,0,0,0,0|1,0,1]=3 23 B11R1.21 CC1=CC(C(=O)O)=CC=C1N CS-W018121 [1,0,0,0,0,0|1,0,0]=2 24 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br CS-D1645 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1Br CS-W014876 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1F CS-W020035 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1I CS-W012470 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.21 CC1=CC=C(B(O)O)C=C1O CS-0083482 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.21 CC1=CC=C(C(=O)O)C=C1C CS-W018150 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.21 CC1=CC=C(C(=O)O)C=C1I CS-W020661 [1,0,0,0,0,0|2,0,0]=3 31 B11R1.21 CC1=CN=C(C(=O)O)C=C1Br CS-W007217 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 CS-0067533 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.21 NC(=O)C1=CC=C(I)C(O)=C1 CS-W020532 [1,0,0,0,0,0|2,0,0]=3 34 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=N1 CS-W022442 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 CS-W014872 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 CS-W008331 [1,0,0,0,0,0|2,0,0]=3 37 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 CS-W016253 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl CS-W020673 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.21 NC1=CC=C(C(=O)O)C=C1O CS-W002114 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.21 O=C(O)C1=CC(Br)=C(Br)N=C1 CS-0041188 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 CS-W006144 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 CS-W007398 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 CS-W008099 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 CS-W014591 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.21 O=C(O)C1=CC(I)=C(O)C=C1 CS-0060337 [1,0,0,0,0,0|1,0,0]=2 46 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 CS-W014369 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 CS-W008049 [1,0,0,0,0,0|1,0,0]=2 48 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 CS-W009127 [1,0,0,0,0,0|2,0,0]=3 49 B11R1.21 O=[N+]([O-])C1=CC=C(Cl)C(O)=C1 CS-W021663 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(O)=C1 CS-0060329 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 CS-0058406 [1,0,0,0,0,0|1,0,1]=3 52 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 CS-0044005 [1,0,0,0,0,0|1,0,1]=3 53 B11R1.266 COC1=CC(C(=O)O)=CC=N1 CS-D0186 [1,0,0,0,0,0|1,0,0]=2 54 B11R1.266 COC1=CC(C(=O)O)=NC=C1 CS-W005027 [1,0,0,0,0,0|1,0,0]=2 55 B11R1.266 COC1=CC(C(C)=O)=CC=C1 CS-W020599 [1,0,0,0,0,0|1,0,0]=2 56 B11R1.266 COC1=CC=CC(B(O)O)=N1 CS-0043972 [1,0,0,0,0,0|2,0,1]=4 57 B11R1.266 COC1=CC=CC(C(C)N)=C1 CS-B0044 [1,0,0,0,0,0|2,0,1]=4 58 B11R1.266 COC1=CN=CC(C(N)=O)=N1 CS-0097635 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.266 COC1=NC=NC(C(=O)O)=C1 CS-W022509 [1,0,0,0,0,0|2,0,0]=3 60 B11R1.266 CSC1=CC(B(O)O)=CC=C1 CS-D1040 [1,0,0,0,0,0|1,1,1]=4 61 B11R1.266 N#CC1=NC=CC(C(=O)O)=C1 CS-W006242 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.266 O=C(O)C1=CC=CC(CO)=C1 CS-0067117 [1,0,0,0,0,0|2,0,0]=3 63 B11R1.266 O=C(O)C1=NC=CC(CO)=C1 CS-0100548 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 CS-W005212 [1,0,0,0,0,0|1,0,0]=2 65 B11R1.280 COC1=C(N)C=CC(C#N)=C1 CS-W006078 [1,0,0,0,0,0|2,0,1]=4 66 B11R1.280 COC1=CC(C#N)=CC=C1O CS-0046224 [1,0,0,0,0,0|1,0,1]=3 67 B11R1.280 O=CC1=CC(CO)=CC=C1O CS-0102097 [1,0,0,0,0,0|2,0,1]=4 68 B13R1.13 CC(=O)C1=CC(C(=O)O)=CC=C1O CS-0102036 [0,1,0,0,0,0|1,0,0]=2 69 B13R1.13 CC(=O)C1=CC=C(O)C([N+](=O)[O-])=C1 CS-W017168 [0,1,0,0,0,0|3,0,0]=4 70 B13R1.13 NC1=CC=C(C(=O)O)C=C1[N+](=O)[O-] CS-W008978 [0,1,0,0,0,0|3,0,0]=4 71 B13R1.13 O=C(O)C1=CC(C(=O)O)=C(F)C=C1 CS-M3487 [0,1,0,0,0,0|3,0,0]=4 72 B13R1.13 O=C(O)C1=CC=C(F)C([N+](=O)[O-])=C1 CS-W008650 [0,1,0,0,0,0|3,0,0]=4 73 B13R1.13 O=C(O)C1=CC=C(O)C(C(=O)O)=C1 CS-M1087 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.49 COC(=O)C1=CC(C#N)=C(F)C=C1 CS-W019451 [0,1,0,0,0,0|3,0,0]=4 75 B13R1.49 COC(=O)C1=CC(C=O)=C(N)C=C1 CS-0043681 [0,1,0,0,0,0|3,0,0]=4 76 B13R1.49 COC(=O)C1=CC=C(Br)C(CO)=C1 CS-0097067 [0,1,0,0,0,0|3,0,0]=4 77 B13R1.49 COC(=O)C1=CC=C(I)C(OC)=C1 CS-0045004 [0,1,0,0,0,0|1,0,0]=2 78 B13R1.49 COC(=O)C1=CC=C(O)C(C#N)=C1 CS-0033761 [0,1,0,0,0,0|2,0,0]=3 79 B13R1.49 O=CC1=CC(C(=O)CBr)=CC=C1O CS-M2582 [0,1,0,0,0,0|3,0,0]=4 80 B13R1.354 CCOC1=C(F)C=CC(B(O)O)=C1 CS-0038629 [0,1,0,0,0,0|2,0,1]=4 81 B13R1.354 CCOC1=CC(B(O)O)=CC=C1Cl CS-0042905 [0,1,0,0,0,0|2,0,1]=4 82 B13R1.651 COC1=C(Cl)C=C(F)C([N+](=O)[O-])=C1 CS-0042699 [0,1,0,0,0,0|2,0,1]=4 83 B13R1.651 COC1=C(O)C=C(F)C(C(C)=O)=C1 CS-0060846 [0,1,0,0,0,0|1,0,0]=2 84 B13R1.651 COC1=CC(B(O)O)=C(F)C=C1Cl CS-0061949 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.651 COC1=CC([N+](=O)[O-])=C(F)C=C1N CS-0042953 [0,1,0,0,0,0|2,0,1]=4 86 B13R2.430 CC(=O)C1=CC=C2OCCC2=C1 CS-M0161 [0,0,0,1,0,0|2,0,0]=3 87 B13R2.430 O=C(O)C1=CC2=C(C=C1)COC2 CS-0059222 [0,0,0,1,0,0|3,0,0]=4 88 B13R2.430 O=C(O)C1=CC=C2N=COC2=C1 CS-D0343 [0,0,0,1,0,0|1,0,1]=3 89 B13R2.430 O=C(O)C1=CC=C2NN=NC2=C1 CS-W019369 [0,0,0,1,0,0|3,0,0]=4 90 B13R2.430 O=C(O)C1=CC=C2OCOC2=C1 CS-D1455 [0,0,0,1,0,0|0,0,0]=1 91 B13R2.430 O=[N+]([O-])C1=CC=C2OCOC2=C1 CS-0059218 [0,0,0,1,0,0|1,0,1]=3 92 B13R2.430 OB(O)C1=CC=C2CCOC2=C1 CS-W018732 [0,0,0,1,0,0|2,0,1]=4 93 B13R1.52 N#CC1=C(F)C=CC(CC(=O)O)=C1 CS-0037049 [0,0,0,0,0,1|3,0,0]=4 94 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS-W016264 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.13 CC(=O)C1=CC=C(N)C=C1 CS-W009534 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS-0043751 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS-W016478 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 CS-D1204 [2,0,0,0,0,0|2,0,0]=4 99 B10R1.13 O=C(O)C1=CN=C(O)N=C1 CS-0044024 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS-W016216 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS-W018028 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.113 CC(=O)C1=CC(N)=CC=C1 CS-W013353 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.113 CC(=O)C1=CC=CC(F)=C1 CS-D1392 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.113 CC(=O)C1=NC(C)=CC=C1 CS-D0743 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.113 CC1=CC(B(O)O)=CC=C1 CS-W007381 [2,0,0,0,0,0|1,0,1]=4 106 B10R1.113 O=C(O)C1=CC(F)=CN=C1 CS-W016443 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.113 O=C(O)C1=CC(O)=CN=C1 CS-W009148 [2,0,0,0,0,0|1,0,0]=3 108 B10R1.113 O=C(O)C1=CC=CC(I)=C1 CS-W009273 [2,0,0,0,0,0|1,0,0]=3 109 B10R1.113 O=C(O)C1=CC=NC(Cl)=C1 CS-W020044 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CS-W006791 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CS-W018591 [2,0,0,0,0,0|1,0,0]=3 112 B10R1.176 CC1=CC=C(CO)C=C1C CS-0044039 [2,0,0,0,0,0|1,0,1]=4 113 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 CS-W007483 [2,0,0,0,0,0|1,0,0]=3 114 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 CS-W005655 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 CS-W007504 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 CS-W007521 [2,0,0,0,0,0|2,0,0]=4 117 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CS-W014392 [2,0,0,0,0,0|1,0,0]=3 118 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 CS-B1308 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.176 O=CC1=CC=C(I)C(O)=C1 CS-0038831 [2,0,0,0,0,0|1,0,0]=3 120 B10R1.176 OCC1=CC(O)=C(Br)C=C1 CS-W006136 [2,0,0,0,0,0|1,0,1]=4 121 B10R1.172 COC1=CC(CO)=NC=C1 CS-0030488 [2,0,0,0,0,0|1,0,1]=4 122 B10R1.172 COC1=CC=CC(C=O)=C1 CS-W007346 [2,0,0,0,0,0|0,0,0]=2 123 B10R1.172 COC1=CC=CC(CO)=N1 CS-W021123 [2,0,0,0,0,0|1,0,1]=4 124 B10R1.172 COC1=NC=CC(C=O)=C1 CS-D1632 [2,0,0,0,0,0|1,0,0]=3 125 B10R1.172 COC1=NC=CC(C=O)=N1 CS-W006622 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.30 COC1=C(Br)C=CC(O)=C1 CS-W008128 [2,0,0,0,0,0|1,0,0]=3 127 B10R1.30 COC1=C(C)C=CC(Br)=C1 CS-W008193 [2,0,0,0,0,0|2,0,0]=4 128 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 CS-W005884 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS-W016214 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.30 COC1=C(F)C=CC(N)=C1 CS-W005619 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.30 COC1=C(O)C=CC(N)=C1 CS-W008263 [2,0,0,0,0,0|1,0,0]=3 132 B10R1.30 COC1=CC(Br)=CC=C1Br CS-0040073 [2,0,0,0,0,0|2,0,0]=4 133 B10R1.30 COC1=CC(C)=CC=C1N CS-W021709 [2,0,0,0,0,0|1,0,1]=4 134 B10R1.30 COC1=CC(C)=CC=C1O CS-W021711 [2,0,0,0,0,0|0,0,1]=3 135 B10R1.30 COC1=CC(Cl)=CC=C1N CS-0042669 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.30 COC1=CC(Cl)=CC=C1O CS-0096842 [2,0,0,0,0,0|1,0,0]=3 137 B10R1.30 COC1=CC(I)=CC=C1Cl CS-0041284 [2,0,0,0,0,0|2,0,0]=4 138 B10R1.30 COC1=NC(Br)=CC=C1O CS-0046307 [2,0,0,0,0,0|2,0,0]=4 139 B10R1.30 O=CC1=CC(O)=CC=C1O CS-0017335 [2,0,0,0,0,0|2,0,0]=4 140 B12R1.48 CCC1=CC=C(C(=O)O)C=C1N CS-0030449 [1,1,0,0,0,0|2,0,0]=4 141 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 CS-W017706 [1,1,0,0,0,0|1,0,0]=3 142 B12R1.48 COC1=CC=C(C(C)=O)C=C1F CS-W017811 [1,1,0,0,0,0|2,0,0]=4 143 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1O CS-B1762 [1,1,0,0,0,0|1,0,1]=4 144 B12R1.48 COC1=NC=C(C(=O)O)C=C1Br CS-0041802 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.48 N#CC1=C(N)C=C(C(=O)O)C=C1 CS-0060338 [1,1,0,0,0,0|2,0,0]=4 146 B12R1.48 O=CC1=C(Br)C=C(C(=O)O)C=C1 CS-W006155 [1,1,0,0,0,0|1,0,1]=4 147 B12R1.232 CC(=O)C1=CC(C)=C(Cl)C=C1F CS-0100652 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.232 CC1=C(C)N=C(Cl)C(C(=O)O)=C1 CS-WAA0101 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1Br CS-W006866 [1,1,0,0,0,0|1,0,0]=3 150 B12R1.232 CC1=CC(C(=O)O)=C(F)C=C1F CS-W017622 [1,1,0,0,0,0|1,0,0]=3 151 B12R1.232 NC1=C(C(=O)O)C=C(Cl)C(Br)=C1 CS-W006846 [1,1,0,0,0,0|2,0,0]=4 152 B12R1.232 NC1=C(F)C=C(C(=O)O)C(F)=C1 CS-0105580 [1,1,0,0,0,0|2,0,0]=4 153 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Cl)=C1 CS-W022046 [1,1,0,0,0,0|2,0,0]=4 154 B12R1.232 O=C(O)C1=C(I)C=C(F)C(F)=C1 CS-W012245 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1F CS-0040475 [1,1,0,0,0,0|2,0,0]=4 156 B12R1.232 O=C(O)C1=CC(Cl)=C(Cl)C=C1Cl CS-W006200 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1F CS-W006705 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Cl CS-W015797 [1,1,0,0,0,0|2,0,0]=4 159 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1Cl CS-0098696 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.367 COC(=O)C1=CC(Br)=C(F)C=C1 CS-W005915 [1,1,0,0,0,0|2,0,0]=4 161 B12R1.367 COC(=O)C1=CC(C)=C(N)N=C1 CS-0100539 [1,1,0,0,0,0|2,0,0]=4 162 B12R1.367 COC(=O)C1=CC(Cl)=C(O)C=C1 CS-W007871 [1,1,0,0,0,0|1,0,0]=3 163 B12R1.367 COC(=O)C1=CC(F)=C(N)C=C1 CS-M0954 [1,1,0,0,0,0|2,0,0]=4 164 B12R1.367 COC(=O)C1=CC(N)=C(F)C=C1 CS-W019434 [1,1,0,0,0,0|2,0,0]=4 165 B12R1.367 COC(=O)C1=CC(N)=C(I)C=C1 CS-W008063 [1,1,0,0,0,0|2,0,0]=4 166 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 CS-W007431 [1,1,0,0,0,0|2,0,0]=4 167 B12R1.367 COC(=O)C1=CC=C(Br)C(Cl)=C1 CS-0036923 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=C1 CS-0095864 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.367 COC(=O)C1=CC=C(Cl)C(I)=C1 CS-0094444 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.367 COC(=O)C1=CC=C(I)C(O)=C1 CS-W018915 [1,1,0,0,0,0|1,0,0]=3 171 B12R1.367 COC(=O)C1=CC=C(O)C(I)=C1 CS-W019910 [1,1,0,0,0,0|1,0,0]=3 172 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 CS-W016884 [1,1,0,0,0,0|1,0,0]=3 173 B12R1.893 CC1=C(C)C([N+](=O)[O-])=CC=C1O CS-W017840 [1,1,0,0,0,0|1,0,1]=4 174 B12R1.893 CC1=C(F)C(C(=O)O)=CC=C1Cl CS-0061147 [1,1,0,0,0,0|1,0,0]=3 175 B12R1.893 NC1=C(C(=O)O)C=CC(F)=C1F CS-0037720 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.893 O=C(O)C1=C(Br)C(F)=C(F)C=C1 CS-W019552 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br CS-0098718 [1,1,0,0,0,0|1,0,0]=3 178 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1O CS-W017872 [1,1,0,0,0,0|0,0,0]=2 179 B12R1.1005 O=C(O)C1=CC(Br)=C(F)C(F)=C1 CS-W021860 [1,1,0,0,0,0|2,0,0]=4 180 B12R1.11 COC1=CC(Br)=CC(B(O)O)=C1 CS-0046216 [1,1,0,0,0,0|1,0,1]=4 181 B12R1.11 COC1=CC(C(=O)O)=CC(Br)=C1 CS-W007621 [1,1,0,0,0,0|0,0,0]=2 182 B12R1.11 COC1=CC(C(=O)O)=NC(Cl)=C1 CS-0005507 [1,1,0,0,0,0|1,0,0]=3 183 B12R1.11 COC1=CC(Cl)=CC(B(O)O)=C1 CS-0086824 [1,1,0,0,0,0|1,0,1]=4 184 B12R1.279 CCOC1=CC(C(=O)O)=CC=C1 CS-0100628 [1,1,0,0,0,0|0,0,0]=2 185 B12R1.279 CCOC1=CC([N+](=O)[O-])=CC=C1 CS-B0032 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.435 C#CC1=CC(C(=O)OC)=CC=C1 CS-W005738 [1,1,0,0,0,0|1,0,1]=4 187 B12R1.435 COC(=O)C1=CC(C#N)=CC=C1 CS-W022828 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.435 COC(=O)C1=CC=CC(CO)=C1 CS-0096392 [1,1,0,0,0,0|2,0,0]=4 189 B12R1.435 COC(=O)C1=NC(OC)=CN=C1 CS-0035570 [1,1,0,0,0,0|2,0,0]=4 190 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 CS-0005486 [1,1,0,0,0,0|1,0,0]=3 191 B12R1.440 COC1=C(C)C(B(O)O)=CC=C1 CS-0101369 [1,1,0,0,0,0|1,0,1]=4 192 B12R1.440 COC1=C(F)C(B(O)O)=CC=C1 CS-W020414 [1,1,0,0,0,0|1,0,1]=4 193 B12R1.440 COC1=C(F)C(C(=O)O)=CC=C1 CS-W005198 [1,1,0,0,0,0|0,0,0]=2 194 B12R1.440 COC1=C(N)C(C(=O)O)=CC=C1 CS-B0779 [1,1,0,0,0,0|0,0,0]=2 195 B12R1.440 COC1=C(O)C(C(C)=O)=CC=C1 CS-0046269 [1,1,0,0,0,0|1,0,0]=3 196 B12R1.440 COC1=CC=CC(C(=O)O)=C1Cl CS-W016878 [1,1,0,0,0,0|0,0,0]=2 197 B12R1.440 COC1=CC=CC(C(=O)O)=C1O CS-W017817 [1,1,0,0,0,0|0,0,0]=2 198 B12R1.440 N#CC1=C(Cl)C(C(=O)O)=CC=C1 CS-0060304 [1,1,0,0,0,0|2,0,0]=4 199 B12R1.453 COC1=CC(C(=O)O)=C(Br)C=C1 CS-W012953 [1,1,0,0,0,0|0,0,0]=2 200 B12R1.453 COC1=CC(C(=O)O)=C(C)C=C1 CS-W006228 [1,1,0,0,0,0|0,0,0]=2 201 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 CS-W007923 [1,1,0,0,0,0|0,0,0]=2 202 B12R1.453 COC1=CC(C(=O)O)=C(F)C=N1 CS-D0436 [1,1,0,0,0,0|1,0,0]=3 203 B12R1.453 COC1=CC(C(C)=O)=C(Br)C=C1 CS-0045042 [1,1,0,0,0,0|1,0,0]=3 204 B12R1.453 COC1=CC=C(I)C([N+](=O)[O-])=C1 CS-W007848 [1,1,0,0,0,0|1,0,1]=4 205 B12R1.453 COC1=CC=C(N)C(C(=O)O)=C1 CS-W009211 [1,1,0,0,0,0|0,0,0]=2 206 B12R1.453 N#CC1=CC=C(F)C(C(=O)O)=C1 CS-W022368 [1,1,0,0,0,0|2,0,0]=4 207 B12R1.453 O=C(O)C1=C(F)C=CC(CO)=C1 CS-M3488 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.453 O=CC1=CC(C(=O)O)=C(F)C=C1 CS-M3441 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.78 COC1=C(OC)C=C(NN)C=C1 CS-W006381 [1,1,0,0,0,0|2,0,0]=4 210 B12R1.78 COC1=CC(OC)=C(CO)C=C1 CS-W007584 [1,1,0,0,0,0|2,0,0]=4 211 B12R1.270 CCOC1=CC(C#N)=CC=C1O CS-Z0025 [1,1,0,0,0,0|1,0,1]=4 212 B12R1.270 CCOC1=CC(C=O)=CC=C1Br CS-0041871 [1,1,0,0,0,0|1,0,0]=3 213 B12R1.300 COC1=C(O)C(O)=CC(C=O)=C1 CS-0043430 [1,1,0,0,0,0|0,0,0]=2 214 B12R1.449 COC1=C(Br)C=C(F)C(C=O)=C1 CS-0089647 [1,1,0,0,0,0|1,0,0]=3 215 B12R1.449 COC1=C(F)C=C(Br)C(C=O)=C1 CS-0097503 [1,1,0,0,0,0|1,0,0]=3 216 B14R1.3405 COC(=O)CC1=CC=C(O)C(C=O)=C1 CS-W020458 [0,1,0,0,0,1|2,0,0]=4 217 B14R1.3651 COC1=CC=C(CC(=N)N)C=C1OC CS-M1302 [0,1,0,0,0,1|2,0,0]=4 218 B14R1.748 COC(=O)C1=CC=C(O)C(C(=O)O)=C1 CS-M1089 [0,2,0,0,0,0|2,0,0]=4 219 B14R1.6035 CC(=O)C1=CC(C(C)C)=C(O)C=C1O CS-M1288 [0,2,0,0,0,0|2,0,0]=4 220 B14R1.358 COC(=O)C1=CC(C=O)=C(O)C(Br)=C1 CS-0102643 [0,2,0,0,0,0|2,0,0]=4 221 B14R1.358 COC(=O)C1=CC(OC)=C(N)C(I)=C1 CS-0105573 [0,2,0,0,0,0|1,0,0]=3 222 B14R1.626 CCOC(=O)C1=CC=C(Br)C(OC)=C1 CS-0041362 [0,2,0,0,0,0|1,0,0]=3 223 B14R1.626 CCOC(=O)C1=CC=C(N)C(OC)=C1 CS-0020828 [0,2,0,0,0,0|1,0,0]=3 224 B14R1.1864 COC(=O)C1=CC=C(C=O)C(OC)=C1 CS-0038404 [0,2,0,0,0,0|0,0,1]=3 225 B14R1.2283 COC(=O)C1=CC(OC)=C(Br)C=C1N CS-0102730 [0,2,0,0,0,0|1,0,0]=3 226 B14R1.12249 COC1=C(F)C(C(=O)O)=CC(F)=C1F CS-0092455 [0,2,0,0,0,0|1,0,0]=3 227 B14R1.441 CCOC1=CC(C(N)=O)=CC=C1OC CS-Z0024 [0,2,0,0,0,0|1,0,0]=3 228 B14R1.5389 CCCC1=C(O)C(C(C)=O)=CC=C1O CS-M0927 [0,2,0,0,0,0|2,0,0]=4 229 B14R1.43 CNC1=CC(C(=O)O)=CC=C1[N+](=O)[O-] CS-0097074 [0,2,0,0,0,0|1,0,1]=4 230 B14R1.43 COC1=CC(B(O)O)=CC=C1C(=O)O CS-0047533 [0,2,0,0,0,0|1,0,1]=4 231 B12R2.44 N#CC1=CC=C2OCOC2=C1 CS-D1495 [1,0,0,1,0,0|1,0,1]=4 232 B12R2.44 NCC1=CC2=C(C=C1)OCO2 CS-W016315 [1,0,0,1,0,0|1,0,1]=4 233 B12R2.44 O=CC1=CC=C2N=COC2=C1 CS-W006738 [1,0,0,1,0,0|1,0,1]=4 234 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 CS-W007484 [0,0,0,1,0,1|0,0,0]=2 235 B14R2.1008 O=C(O)CC1=CC=C2OCCC2=C1 CS-M0929 [0,0,0,1,0,1|1,0,0]=3 236 B14R2.24358 CN1C=NC2=CC=C(C(=O)O)C=C21 CS-W006830 [0,1,0,1,0,0|2,0,0]=4 237 B14R2.24358 CN1N=CC2=CC=C(C(=O)O)C=C21 CS-0046211 [0,1,0,1,0,0|2,0,0]=4 238 B14R2.966 O=C(CBr)C1=CC=C2OCCC2=C1 CS-M0162 [0,1,0,1,0,0|2,0,0]=4 239 B14R2.601 CC1=NC2=CC(C(=O)O)=CC=C2O1 CS-D0089 [0,1,0,1,0,0|1,0,0]=3 240 B14R2.781 CC(=O)C1=CC=C2OCCOC2=C1 CS-W019478 [0,1,0,1,0,0|1,0,0]=3 241 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCC2 CS-W006431 [0,1,0,1,0,0|2,0,0]=4 242 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=C1 CS-W007799 [0,0,0,0,1,1|1,0,0]=3 243 B12R1.57 COC1=CC(Cl)=NC=C1C(=O)O CS-W003725 [0,0,0,0,1,1|2,0,0]=4 244 B12R1.57 COC1=CC(I)=CC=C1C(=O)O CS-0099430 [0,0,0,0,1,1|1,0,0]=3 245 B12R1.57 COC1=CC(O)=CC=C1[N+](=O)[O-] CS-W001464 [0,0,0,0,1,1|1,0,1]=4 246 B12R1.87 COC1=C(Cl)C=CN=C1C(=O)O CS-0102804 [0,0,0,0,1,1|1,0,0]=3 247 B12R1.87 COC1=C(F)C=CC=C1C(=O)O CS-0028739 [0,0,0,0,1,1|1,0,0]=3