0 B10R1.18 CC(C)NC1=CC=CC=C1 CS-W019925 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.18 N=C(O)NC1=CC=CC=C1 CS-W017760 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.8 BrCCC1=CC=CC=C1 CS-W019955 [1,0,0,0,0,0|1,0,1]=3 3 B9R1.8 CNCC1=CC=CC=C1 CS-W007426 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.8 C\C=C\C1=CC=CC=C1 CS-0069845 [1,0,0,0,0,0|1,0,1]=3 5 B9R1.8 N#CCC1=CC=CC=N1 CS-W019430 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.8 NOCC1=CC=CC=C1 CS-W008955 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.8 O=C=NC1=NC=CC=C1 CS-B1694 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.8 O\N=C\C1=CC=CC=C1 CS-0034180 [1,0,0,0,0,0|1,0,1]=3 9 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 CS-0028773 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS-W008979 [0,1,0,0,0,0|0,0,0]=1 11 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 CS-W010778 [0,1,0,0,0,0|0,0,0]=1 12 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 CS-W019544 [0,1,0,0,0,0|1,0,1]=3 13 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 CS-W019313 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 CS-W010964 [0,1,0,0,0,0|0,0,0]=1 15 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 CS-W018122 [0,1,0,0,0,0|0,0,0]=1 16 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 CS-D1423 [0,1,0,0,0,0|0,0,0]=1 17 B11R1.40 C=CC(=O)NC1=CC=CC=C1 CS-W019368 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.40 COC(=O)CC1=CC=NC=C1 CS-0015139 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.40 NC(CO)CC1=CC=CC=C1 CS-W019002 [0,1,0,0,0,0|1,0,1]=3 20 B11R1.86 CC(=O)CC1=CC=CC=C1Br CS-W007949 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.86 CC(=O)NC1=CC=CC=C1N CS-W008938 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.86 CC1=CC=CC=C1CC(=O)O CS-W018151 [0,1,0,0,0,0|0,0,0]=1 23 B11R1.86 NC(=S)NC1=CC=CC=C1Br CS-0093548 [0,1,0,0,0,0|2,1,0]=4 24 B11R1.86 O=C(O)CC1=C(Cl)N=CC=C1 CS-0043768 [0,1,0,0,0,0|1,0,0]=2 25 B11R1.86 O=C(O)CC1=CC=CC=C1F CS-W020118 [0,1,0,0,0,0|0,0,0]=1 26 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 CS-0046111 [0,1,0,0,0,0|0,0,0]=1 27 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 CS-W004766 [0,1,0,0,0,0|0,0,0]=1 28 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS-0015806 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS-0019417 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.509 O=P(Cl)(Cl)OC1=CC=CC=C1 CS-0016064 [0,1,0,0,0,0|3,0,0]=4 31 B11R2.10 CC1=CC2=CC=CC=C2N1 CS-W007556 [0,0,0,1,0,0|2,0,1]=4 32 B11R2.10 CC1=NC2=CC=CC=C2O1 CS-0095153 [0,0,0,1,0,0|2,0,0]=3 33 B11R2.10 CC1=NC2=CC=CC=C2S1 CS-W009170 [0,0,0,1,0,0|2,1,0]=4 34 B11R2.10 ClC1=NC2=CC=CC=C2N1 CS-W016291 [0,0,0,1,0,0|3,0,0]=4 35 B11R2.10 ClC1=NC2=CC=CC=C2O1 CS-0030558 [0,0,0,1,0,0|2,0,0]=3 36 B11R2.10 N=C1NC2=CC=CC=C2S1 CS-W018140 [0,0,0,1,0,0|2,1,0]=4 37 B11R2.10 O=C1CC2=C(C=CC=C2)C1 CS-W020518 [0,0,0,1,0,0|1,0,0]=2 38 B11R2.10 S=C1NC2=CC=CC=C2N1 CS-W023180 [0,0,0,1,0,0|2,1,0]=4 39 B11R2.10 S=C1NC2=CC=CC=C2S1 CS-W017829 [0,0,0,1,0,0|1,2,0]=4 40 B9R1.6 CC(=O)C1=NC=CC=C1 CS-W008602 [0,0,0,0,1,0|2,0,0]=3 41 B9R1.6 CS(=O)C1=CC=CC=C1 CS-0046805 [0,0,0,0,1,0|2,0,0]=3 42 B9R1.6 C[C@H](N)C1=CC=CC=C1 CS-W019840 [0,0,0,0,1,0|2,0,1]=4 43 B9R1.6 N=C(N)C1=CC=NC=C1 CS-0094490 [0,0,0,0,1,0|3,0,0]=4 44 B9R1.6 O=C(O)C1=NC=CC=N1 CS-D0763 [0,0,0,0,1,0|2,0,0]=3 45 B9R1.6 O=C(O)C1=NN=CC=C1 CS-W004823 [0,0,0,0,1,0|2,0,0]=3 46 B9R1.6 O=S([O-])C1=CC=CC=C1 CS-W014314 [0,0,0,0,1,0|1,0,1]=3 47 B9R1.13 O=C(O)CC1=NNC=C1 CS-D0036 [0,0,0,0,1,0|2,0,0]=3 48 B11R1.91 CC(=O)NNC1=CC=CC=C1 CS-W018141 [0,0,0,0,0,1|2,0,0]=3 49 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 CS-W018211 [0,0,0,0,0,1|1,0,1]=3 50 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CS-W007319 [0,0,0,0,0,1|0,0,1]=2 51 B11R1.91 O=C(O)COC1=CC=CC=C1 CS-0013736 [0,0,0,0,0,1|0,0,0]=1 52 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 CS-0031477 [0,0,0,0,0,1|1,0,1]=3 53 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 CS-0031474 [0,0,0,0,0,1|1,0,2]=4 54 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 CS-W007478 [0,0,0,0,0,1|1,0,2]=4 55 B8R1.2 ICC1=CC=CC=C1 CS-W005987 [2,0,0,0,0,0|1,0,0]=3 56 B8R1.2 NCC1=CC=NC=C1 CS-W007632 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.2 NNC1=CC=CC=C1 CS-W014355 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.2 NOC1=CC=CC=C1 CS-0022011 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.2 O=CC1=CC=CN=C1 CS-D1122 [2,0,0,0,0,0|1,0,0]=3 60 B8R1.2 O=CC1=NC=NC=C1 CS-W004778 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.2 OCC1=CC=NC=C1 CS-W007605 [2,0,0,0,0,0|1,0,0]=3 62 B8R1.2 OCC1=CN=CC=N1 CS-W018634 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.2 OCC1=NC=CC=C1 CS-W020042 [2,0,0,0,0,0|1,0,0]=3 64 B8R1.2 OCC1=NC=CC=N1 CS-D1205 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.2 OCC1=NC=NC=C1 CS-W018611 [2,0,0,0,0,0|2,0,0]=4 66 B10R1.1 C=CCC1=CC=C(C)C=C1 CS-0109480 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.1 CC1=CC=C(CC#N)C=C1 CS-W020586 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.1 CCCC1=CC=C(N)C=C1 CS-W013343 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.1 N#CCC1=CC=C(Cl)C=C1 CS-W018106 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.1 NCCC1=CC=C(Cl)C=C1 CS-W004775 [1,1,0,0,0,0|1,0,1]=4 71 B10R1.1 NOCC1=CC=C(Cl)C=C1 CS-B1210 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.4 CC1=CC=CC=C1CC#N CS-W019570 [1,1,0,0,0,0|1,0,1]=4 73 B10R1.4 CC1=CC=CC=C1CCO CS-W021450 [1,1,0,0,0,0|0,0,1]=3 74 B10R1.4 COCC1=CC=CC=C1O CS-W021443 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.4 N#CCC1=CC=CC=C1Br CS-W019568 [1,1,0,0,0,0|1,0,1]=4 76 B10R1.4 N#CCC1=CC=CC=C1Cl CS-W020135 [1,1,0,0,0,0|1,0,1]=4 77 B10R1.4 O\N=C\C1=CC=CC=C1F CS-W020474 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.10 CC1=CC(CC#N)=CC=C1 CS-W005445 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.10 N#CCC1=CC(Cl)=CC=C1 CS-W018107 [1,1,0,0,0,0|1,0,1]=4 80 B10R1.10 NCCC1=CC(Cl)=CC=C1 CS-W005099 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.10 OCCC1=CC(Br)=CC=C1 CS-W007864 [1,1,0,0,0,0|0,0,1]=3 82 B10R1.15 C=CS(=O)C1=CC=CC=C1 CS-0081516 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 CS-W007718 [1,1,0,0,0,0|1,0,1]=4 84 B10R1.15 N[C@H](CO)C1=CC=CC=C1 CS-W008706 [1,1,0,0,0,0|0,0,1]=3 85 B10R1.17 C#CCCC1=CC=CC=C1 CS-0081605 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.17 C=CCOC1=CC=CC=C1 CS-W013371 [1,1,0,0,0,0|1,0,0]=3 87 B10R1.17 CCNCC1=CC=CC=C1 CS-W013340 [1,1,0,0,0,0|1,0,1]=4 88 B10R1.17 NCCNC1=CC=CC=C1 CS-0045385 [1,1,0,0,0,0|1,0,1]=4 89 B10R1.17 OCC#CC1=CC=CC=C1 CS-W007420 [1,1,0,0,0,0|0,0,2]=4 90 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS-W020546 [0,1,0,0,1,0|1,0,0]=3 91 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS-W013369 [0,1,0,0,1,0|1,0,0]=3 92 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS-W020117 [0,1,0,0,1,0|1,0,0]=3 93 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS-B1315 [0,1,0,0,1,0|1,0,1]=4 94 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS-D1603 [0,1,0,0,1,0|1,0,0]=3 95 B10R1.13 CC1=CN=C(C(=O)O)N=C1 CS-W022418 [0,1,0,0,1,0|2,0,0]=4 96 B10R1.13 N=C1C=CC(C(=O)O)=CN1 CS-W016509 [0,1,0,0,1,0|1,0,0]=3 97 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 CS-W019519 [0,1,0,0,1,0|1,0,0]=3 98 B10R1.13 NC(=O)C1=CC=C(N)C=C1 CS-W017757 [0,1,0,0,1,0|1,0,0]=3 99 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS-W018071 [0,1,0,0,1,0|1,1,0]=4 100 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS-D0614 [0,1,0,0,1,0|1,0,0]=3 101 B10R1.13 NC1=NC=C(C(=O)O)N=C1 CS-W019175 [0,1,0,0,1,0|2,0,0]=4 102 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS-M3680 [0,1,0,0,1,0|0,0,0]=2 103 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS-W014112 [0,1,0,0,1,0|0,0,0]=2 104 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 CS-W019608 [0,1,0,0,1,0|2,0,0]=4 105 B10R1.13 O=C(O)C1=NN=C(O)C=C1 CS-W005425 [0,1,0,0,1,0|2,0,0]=4 106 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 CS-W005156 [0,1,0,0,1,0|1,0,1]=4 107 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 CS-W008789 [0,1,0,0,1,0|1,0,1]=4 108 B10R1.13 OB(O)C1=CC=C(F)C=C1 CS-D1103 [0,1,0,0,1,0|1,0,1]=4 109 B10R1.13 OB(O)C1=CC=C(O)C=C1 CS-D1375 [0,1,0,0,1,0|1,0,1]=4 110 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 CS-W020081 [0,1,0,0,1,0|1,0,1]=4 111 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 CS-W016183 [0,1,0,0,1,0|2,0,0]=4 112 B10R1.61 CC(=O)C1=CC=CC=C1C CS-W013374 [0,1,0,0,1,0|1,0,0]=3 113 B10R1.61 CC(=O)C1=CC=CC=C1Cl CS-W010929 [0,1,0,0,1,0|1,0,0]=3 114 B10R1.61 CC(=O)C1=CC=CC=C1I CS-W007878 [0,1,0,0,1,0|1,0,0]=3 115 B10R1.61 CC(=O)C1=CC=CN=C1N CS-0002197 [0,1,0,0,1,0|2,0,0]=4 116 B10R1.61 CC(=O)C1=NC=CC=C1F CS-W021536 [0,1,0,0,1,0|2,0,0]=4 117 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS-M1701 [0,1,0,0,1,0|1,0,1]=4 118 B10R1.61 NC(=O)C1=CC=CC=C1Br CS-0038446 [0,1,0,0,1,0|1,0,0]=3 119 B10R1.61 NC(=O)C1=CC=CC=C1N CS-D1680 [0,1,0,0,1,0|1,0,0]=3 120 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS-D0792 [0,1,0,0,1,0|1,0,0]=3 121 B10R1.61 NC1=CC=CC=C1B(O)O CS-W008208 [0,1,0,0,1,0|1,0,1]=4 122 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 CS-D1685 [0,1,0,0,1,0|1,0,0]=3 123 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 CS-W017965 [0,1,0,0,1,0|1,0,0]=3 124 B10R1.61 O=C(O)C1=CC=CC=C1F CS-W019975 [0,1,0,0,1,0|0,0,0]=2 125 B10R1.61 O=C(O)C1=CC=CN=C1F CS-D0952 [0,1,0,0,1,0|1,0,0]=3 126 B10R1.61 O=C(O)C1=CC=CNC1=S CS-W020029 [0,1,0,0,1,0|1,0,0]=3 127 B10R1.61 O=C(O)C1=NC=CC=C1F CS-D1556 [0,1,0,0,1,0|1,0,0]=3 128 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F CS-W008586 [0,1,0,0,1,0|1,0,1]=4 129 B10R1.113 CC(=O)C1=CC(F)=CN=C1 CS-0046260 [0,1,0,0,1,0|2,0,0]=4 130 B10R1.113 CC(=O)C1=CC(I)=CC=C1 CS-W010241 [0,1,0,0,1,0|1,0,0]=3 131 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 CS-W009131 [0,1,0,0,1,0|1,0,0]=3 132 B10R1.113 CC(=O)C1=CC=CC(C)=C1 CS-W013375 [0,1,0,0,1,0|1,0,0]=3 133 B10R1.113 CC(=O)C1=CC=CC(O)=C1 CS-0015375 [0,1,0,0,1,0|1,0,0]=3 134 B10R1.113 CC(=O)C1=NC=CC(C)=C1 CS-W013352 [0,1,0,0,1,0|2,0,0]=4 135 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 CS-W007109 [0,1,0,0,1,0|1,0,1]=4 136 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 CS-W021882 [0,1,0,0,1,0|1,0,0]=3 137 B10R1.113 NC1=CC(C(=O)O)=CC=C1 CS-W019987 [0,1,0,0,1,0|0,0,0]=2 138 B10R1.113 NC1=NC=CC(C(=O)O)=N1 CS-W021582 [0,1,0,0,1,0|2,0,0]=4 139 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 CS-W020058 [0,1,0,0,1,0|1,0,0]=3 140 B10R1.113 O=C(O)C1=CC(F)=CC=C1 CS-W016469 [0,1,0,0,1,0|0,0,0]=2 141 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 CS-W019787 [0,1,0,0,1,0|0,0,0]=2 142 B10R1.113 O=C(O)C1=NC(F)=CC=C1 CS-W019850 [0,1,0,0,1,0|1,0,0]=3 143 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 CS-W004860 [0,1,0,0,1,0|1,0,0]=3 144 B10R1.113 OB(O)C1=CC=CC(F)=C1 CS-D1463 [0,1,0,0,1,0|1,0,1]=4 145 B12R1.21 C(C(=O)O)=CC1=CC=C(Br)C=C1 CS-W013013 [0,1,0,0,0,1|0,0,1]=3 146 B12R1.21 CC(=O)\C=C\C1=CC=C(O)C=C1 CS-B1377 [0,1,0,0,0,1|1,0,1]=4 147 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 CS-W019863 [0,1,0,0,0,1|0,0,0]=2 148 B12R1.27 COC(=O)CCC1=CC=CC=C1 CS-W007828 [0,1,0,0,0,1|0,0,0]=2 149 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 CS-M1051 [0,1,0,0,0,1|1,0,1]=4 150 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O CS-W021018 [0,1,0,0,0,1|0,0,0]=2 151 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O CS-W018529 [0,1,0,0,0,1|0,0,0]=2 152 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O CS-0041637 [0,1,0,0,0,1|1,0,0]=3 153 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O CS-0042547 [0,1,0,0,0,1|0,0,0]=2 154 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O CS-0041636 [0,1,0,0,0,1|1,0,0]=3 155 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=N)O CS-W015584 [0,1,0,0,0,1|1,0,0]=3 156 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 CS-M0683 [0,1,0,0,0,1|1,0,0]=3 157 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 CS-0019256 [0,1,0,0,0,1|1,0,0]=3 158 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 CS-W021936 [0,1,0,0,0,1|0,0,0]=2 159 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 CS-0073823 [0,1,0,0,0,1|0,0,0]=2 160 B12R1.125 CC1=CC=CC=C1CCC(=O)O CS-W005547 [0,1,0,0,0,1|0,0,0]=2 161 B12R1.125 O=C(O)CCC1=CC=CC=C1Br CS-W007510 [0,1,0,0,0,1|0,0,0]=2 162 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl CS-W016978 [0,1,0,0,0,1|0,0,0]=2 163 B12R1.125 O=C(O)CCC1=CC=CC=C1F CS-W007890 [0,1,0,0,0,1|0,0,0]=2 164 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br CS-0063883 [0,1,0,0,0,1|0,0,1]=3 165 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F CS-W014304 [0,1,0,0,0,1|0,0,1]=3 166 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 CS-W017867 [0,1,0,0,0,1|0,0,0]=2 167 B12R1.226 O=C(O)CCC1=CC(Cl)=CC=C1 CS-W016980 [0,1,0,0,0,1|0,0,0]=2 168 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 CS-D0633 [0,1,0,0,0,1|0,0,0]=2 169 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 CS-B0762 [0,2,0,0,0,0|0,0,0]=2 170 B12R1.19 CC(=O)NC1=CC(Cl)=C(O)C=C1 CS-W022899 [0,2,0,0,0,0|2,0,0]=4 171 B12R1.19 CC(=O)NC1=CC=C(C)C(Cl)=C1 CS-M1325 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 CS-W020073 [0,2,0,0,0,0|0,0,0]=2 173 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 CS-0020117 [0,2,0,0,0,0|0,0,0]=2 174 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 CS-0059256 [0,2,0,0,0,0|0,0,0]=2 175 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 CS-W016914 [0,2,0,0,0,0|0,0,0]=2 176 B12R1.20 [C@@H](N)(C(=O)O)C1=CC=C(Cl)C=C1 CS-W005720 [0,2,0,0,0,0|0,0,0]=2 177 B12R1.49 CNC(=O)CC1=CC=C(Cl)C=C1 CS-0038025 [0,2,0,0,0,0|1,0,0]=3 178 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 CS-W022850 [0,2,0,0,0,0|0,0,0]=2 179 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 CS-W008065 [0,2,0,0,0,0|0,0,0]=2 180 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 CS-0028736 [0,2,0,0,0,0|0,0,0]=2 181 B12R1.49 COC(=O)CC1=NC=C(Br)C=C1 CS-0036244 [0,2,0,0,0,0|1,0,0]=3 182 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 CS-B1335 [0,2,0,0,0,0|1,0,0]=3 183 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 CS-W005447 [0,2,0,0,0,0|0,0,0]=2 184 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 CS-W005090 [0,2,0,0,0,0|0,0,0]=2 185 B12R1.233 O=C(O)CC1=C(Cl)C=C(Cl)C=C1 CS-W015389 [0,2,0,0,0,0|0,0,0]=2 186 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 CS-W018755 [0,2,0,0,0,0|0,0,0]=2 187 B12R1.34 COC(=O)C(N)C1=CC=NC=C1 CS-0111724 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.34 COC(=O)[C@H](N)C1=CC=CC=C1 CS-W015540 [0,2,0,0,0,0|0,0,0]=2 189 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 CS-0059225 [0,2,0,0,0,0|0,0,0]=2 190 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 CS-0088534 [0,2,0,0,0,0|0,0,0]=2 191 B12R1.371 COC(=O)CC1=CC=CC=C1Cl CS-0030578 [0,2,0,0,0,0|0,0,0]=2 192 B12R1.75 COC1=CC=CC=C1CC(=O)O CS-D0984 [0,2,0,0,0,0|0,0,0]=2 193 B12R1.75 N#CC1=CC=CC=C1CC(=O)O CS-W005104 [0,2,0,0,0,0|0,0,0]=2 194 B12R1.127 O=C(O)CC1=CC(Br)=CC=C1Cl CS-W006149 [0,2,0,0,0,0|0,0,0]=2 195 B12R1.127 O=C(O)CC1=CC(Cl)=CC=C1Br CS-W005252 [0,2,0,0,0,0|0,0,0]=2 196 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 CS-W004733 [0,2,0,0,0,0|0,0,0]=2 197 B12R1.101 O=C(O)CC1=CC(Cl)=CC(F)=C1 CS-W008457 [0,2,0,0,0,0|0,0,0]=2 198 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 CS-0007716 [0,2,0,0,0,0|0,0,0]=2 199 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 CS-M0190 [0,2,0,0,0,0|2,0,0]=4 200 B12R1.438 N#CC1=CC=CC(CC(=O)O)=C1 CS-W005265 [0,2,0,0,0,0|0,0,0]=2 201 B10R2.7 C1=CC2=C(C=C1)CC=C2 CS-0015092 [1,0,0,1,0,0|1,0,0]=3 202 B10R2.7 C1=CC2=C(N=C1)N=CO2 CS-0044085 [1,0,0,1,0,0|2,0,0]=4 203 B10R2.7 C1=CC=C2OC=NC2=C1 CS-W004722 [1,0,0,1,0,0|1,0,0]=3 204 B10R2.7 C1=CC=C2OCCC2=C1 CS-M0160 [1,0,0,1,0,0|0,0,1]=3 205 B10R2.7 C1=CC=C2SC=NC2=C1 CS-W013350 [1,0,0,1,0,0|1,1,0]=4 206 B12R2.24 O=C1COC2=CC=CN=C2N1 CS-W002009 [0,0,0,1,0,1|2,0,0]=4 207 B12R2.24 OC1=CC2=CC=CC=C2N=C1 CS-W008203 [0,0,0,1,0,1|1,0,1]=4 208 B12R2.606 CC1=NC2=C(C=CC(Br)=C2)O1 CS-W005533 [0,1,0,1,0,0|2,0,0]=4 209 B12R2.606 N=C1NC2=C(C=CC(Br)=C2)O1 CS-W005168 [0,1,0,1,0,0|2,0,0]=4 210 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 CS-W019563 [0,1,0,1,0,0|2,0,0]=4 211 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 CS-W008941 [0,1,0,1,0,0|1,0,0]=3 212 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 CS-W008657 [0,1,0,1,0,0|1,0,0]=3 213 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)O1 CS-W022467 [0,1,0,1,0,0|1,0,0]=3 214 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 CS-W020374 [0,1,0,1,0,0|2,0,0]=4 215 B12R2.18 CN1C(=O)NC2=CC=CC=C21 CS-0035509 [0,1,0,1,0,0|2,0,0]=4 216 B12R2.32 O=CC1=NC2=CC=CC=C2N1 CS-W004873 [0,1,0,1,0,0|2,0,0]=4 217 B12R2.32 OCC1=CC2=CC=CC=C2O1 CS-0062599 [0,1,0,1,0,0|0,0,2]=4 218 B12R2.32 OCC1=NC2=C(C=CC=C2)O1 CS-W019081 [0,1,0,1,0,0|1,0,1]=4 219 B12R2.32 OCC1CC2=CC=CC=C2O1 CS-0031351 [0,1,0,1,0,0|0,0,2]=4 220 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 CS-W022163 [0,1,0,1,0,0|1,0,0]=3 221 B12R2.202 O=C1NC2=C(Cl)C=CC=C2S1 CS-0030555 [0,1,0,1,0,0|1,1,0]=4 222 B12R2.202 OC1=NC2=CC=CC(Br)=C2C1 CS-W005098 [0,1,0,1,0,0|1,0,0]=3 223 B8R1.7 CC(=O)C1=CC=CN1 CS-W013672 [0,0,0,0,2,0|2,0,0]=4 224 B8R1.7 CC(=O)C1=CC=CO1 CS-W016628 [0,0,0,0,2,0|2,0,0]=4 225 B8R1.7 CC(=O)C1=CC=CS1 CS-W020047 [0,0,0,0,2,0|2,0,0]=4 226 B8R1.7 CC(=O)C1=CSC=C1 CS-W007361 [0,0,0,0,2,0|2,0,0]=4 227 B8R1.7 O=C(O)C1=CN=CO1 CS-W007534 [0,0,0,0,2,0|2,0,0]=4 228 B12R1.252 O=C(O)CCNC1=CC=CC=C1 CS-W021779 [0,0,0,0,0,2|0,0,0]=2