0 B11R2.1 BrC1=C2C=CC=CN2C=N1 CS-0006455 [0,0,0,0,0,0|3,0,1]=4 1 B11R2.1 BrC1=CN=C2C=CC=CN12 CS-M1377 [0,0,0,0,0,0|4,0,0]=4 2 B11R2.1 BrC1=CNC2=C1N=CC=C2 CS-W006051 [0,0,0,0,0,0|4,0,0]=4 3 B11R2.1 BrC1=NNC2=C1C=CN=C2 CS-0006103 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 CC1=CNC2=NC=CC=C12 CS-B0512 [0,0,0,0,0,0|4,0,0]=4 5 B11R2.1 CC1=NNC2=CC=CN=C21 CS-W021962 [0,0,0,0,0,0|4,0,0]=4 6 B11R2.1 ClC1=CNC2=C1C=CC=N2 CS-0003968 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.1 IC1=CNC2=NC=CC=C12 CS-0004128 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.1 NC1=NCC2=C1C=CC=C2 CS-0102029 [0,0,0,0,0,0|2,0,0]=2 9 B11R2.1 NC1=NNC2=NC=CC=C12 CS-M2176 [0,0,0,0,0,0|4,0,0]=4 10 B11R2.1 NC1=NSC2=C1C=CC=C2 CS-W019021 [0,0,0,0,0,0|3,0,0]=3 11 B11R2.1 N[C@H]1CCC2=CC=CC=C21 CS-M1707 [0,0,0,0,0,0|2,0,1]=3 12 B11R2.1 O=C1CCC2=C1C=CC=N2 CS-W005016 [0,0,0,0,0,0|2,0,0]=2 13 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 CS-W013372 [0,0,0,0,0,0|1,0,2]=3 14 B10R2.7 C1=CC2=C(C=C1)CC=C2 CS-0015092 [1,0,0,0,0,0|1,0,0]=2 15 B10R2.7 C1=CC2=C(C=C1)SCS2 CS-0040606 [1,0,0,0,0,0|3,0,0]=4 16 B10R2.7 C1=CC2=C(C=N1)NN=C2 CS-W019668 [1,0,0,0,0,0|3,0,0]=4 17 B10R2.7 C1=CC2=C(C=N1)SC=C2 CS-0006104 [1,0,0,0,0,0|3,0,0]=4 18 B10R2.7 C1=CC2=CC=NN2C=C1 CS-B0647 [1,0,0,0,0,0|3,0,0]=4 19 B10R2.7 C1=CC2=NN=CN2C=C1 CS-0088107 [1,0,0,0,0,0|3,0,0]=4 20 B10R2.7 C1=CC2=NSN=C2C=C1 CS-W017754 [1,0,0,0,0,0|2,1,0]=4 21 B10R2.7 C1=CC=C2NN=NC2=C1 CS-D1407 [1,0,0,0,0,0|3,0,0]=4 22 B10R2.7 C1=CC=C2OC=NC2=C1 CS-W004722 [1,0,0,0,0,0|3,0,0]=4 23 B10R2.7 C1=CC=C2OCCC2=C1 CS-M0160 [1,0,0,0,0,0|2,0,0]=3 24 B10R2.7 C1=CC=C2SC=NC2=C1 CS-W013350 [1,0,0,0,0,0|3,0,0]=4 25 B10R2.7 C1=CN=C2NN=CC2=C1 CS-W000643 [1,0,0,0,0,0|3,0,0]=4 26 B10R2.7 C1=NC=C2CNCC2=C1 CS-W003872 [1,0,0,0,0,0|2,0,1]=4 27 B12R2.1 N#CC1=NNC2=C1C=CC=C2 CS-0005527 [0,1,0,0,0,0|3,0,0]=4 28 B12R2.1 O=CC1=C2C=CC=CN2C=N1 CS-W022762 [0,1,0,0,0,0|2,0,1]=4 29 B12R2.18 CC1=C(Br)C2=CC=CC=C2S1 CS-W021857 [0,1,0,0,0,0|3,0,0]=4 30 B12R2.132 CC1=NOC2=C1C=C(Br)C=C2 CS-D0883 [0,1,0,0,0,0|3,0,0]=4 31 B12R2.132 ClC1=CC=C2NN=C(I)C2=C1 CS-W022350 [0,1,0,0,0,0|3,0,0]=4 32 B12R2.132 NC1=NNC2=C1C=C(Br)C=C2 CS-D0991 [0,1,0,0,0,0|3,0,0]=4 33 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 CS-D0208 [0,1,0,0,0,0|1,0,0]=2 34 B12R2.132 O=C1OCC2=CC=C(I)C=C12 CS-0041355 [0,1,0,0,0,0|0,0,0]=1 35 B12R2.196 NC1=NNC2=C1C=CC=C2Br CS-W006669 [0,1,0,0,0,0|3,0,0]=4 36 B12R2.196 NC1=NOC2=C1C=CC=C2Br CS-W007150 [0,1,0,0,0,0|3,0,0]=4 37 B12R2.196 O=C1CCC2=C(F)C=CC=C12 CS-0001929 [0,1,0,0,0,0|1,0,0]=2 38 B12R2.196 O=C1OCC2=C1C=CC=C2Br CS-W004185 [0,1,0,0,0,0|0,0,0]=1 39 B12R2.203 NC1=NNC2=C1C(Br)=CC=C2 CS-W009221 [0,1,0,0,0,0|3,0,0]=4 40 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 CS-B0435 [0,1,0,0,0,0|1,0,0]=2 41 B12R2.203 O=C1NOC2=C1C(F)=CC=C2 CS-B1578 [0,1,0,0,0,0|2,0,0]=3 42 B12R2.612 CC1=C2C=CC(Br)=CC2=NN1 CS-0079873 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 CS-0059293 [0,1,0,0,0,0|0,0,0]=1 44 B12R2.612 O=C1CCC2=CC(F)=CC=C12 CS-W008930 [0,1,0,0,0,0|1,0,0]=2 45 B12R2.612 O=C1COC2=CC(Br)=CC=C12 CS-0028254 [0,1,0,0,0,0|2,0,0]=3 46 B12R2.612 O=C1COC2=CC(O)=CC=C12 CS-M3296 [0,1,0,0,0,0|2,0,0]=3 47 B12R2.612 OC1=NNC2=CC(Br)=CC=C21 CS-W022448 [0,1,0,0,0,0|2,0,1]=4 48 B12R2.2028 O=C1CC(=O)C2=CC=CC=C12 CS-W007948 [0,1,0,0,0,0|1,0,1]=3 49 B12R2.2028 O=C1OC(=O)C2=CN=CC=C12 CS-W007774 [0,1,0,0,0,0|1,0,1]=3 50 B12R2.2028 O=C1[N-]C(=O)C2=C1C=CC=C2 CS-0015141 [0,1,0,0,0,0|1,0,1]=3 51 B10R1.15 C=CS(=O)C1=CC=CC=C1 CS-0081516 [0,0,1,0,0,0|2,0,1]=4 52 B10R1.15 COC(=O)C1=CC=NC=C1 CS-D1405 [0,0,1,0,0,0|1,0,0]=2 53 B10R1.15 COC(=O)C1=NC=CC=N1 CS-M2690 [0,0,1,0,0,0|2,0,0]=3 54 B10R1.17 C#CCCC1=CC=CC=C1 CS-0081605 [0,0,1,0,0,0|2,0,1]=4 55 B10R1.17 C=CCOC1=CC=CC=C1 CS-W013371 [0,0,1,0,0,0|3,0,0]=4 56 B10R1.17 CCNCC1=CC=CC=C1 CS-W013340 [0,0,1,0,0,0|2,0,1]=4 57 B10R1.20 CNC1=NC=CC=C1CO CS-W023173 [0,0,1,0,0,0|3,0,0]=4 58 B10R1.20 COC1=CC=CC=C1C=O CS-W018515 [0,0,1,0,0,0|2,0,0]=3 59 B10R1.61 CC(=O)C1=CC=CC=C1C CS-W013374 [0,0,1,0,0,0|1,0,0]=2 60 B10R1.61 CC(=O)C1=CC=CC=C1Cl CS-W010929 [0,0,1,0,0,0|2,0,0]=3 61 B10R1.61 CC(=O)C1=CC=CC=C1I CS-W007878 [0,0,1,0,0,0|2,0,0]=3 62 B10R1.61 CC(=O)C1=CC=CN=C1N CS-0002197 [0,0,1,0,0,0|3,0,0]=4 63 B10R1.61 CC(=O)C1=NC=CC=C1F CS-W021536 [0,0,1,0,0,0|3,0,0]=4 64 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS-M1701 [0,0,1,0,0,0|2,0,1]=4 65 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] CS-D0206 [0,0,1,0,0,0|2,0,1]=4 66 B10R1.61 NC(=O)C1=CC=CC=C1Br CS-0038446 [0,0,1,0,0,0|2,0,0]=3 67 B10R1.61 NC(=O)C1=CC=CC=C1N CS-D1680 [0,0,1,0,0,0|2,0,0]=3 68 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS-D0792 [0,0,1,0,0,0|2,0,0]=3 69 B10R1.61 NC1=CC=CC=C1B(O)O CS-W008208 [0,0,1,0,0,0|2,0,1]=4 70 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 CS-D1685 [0,0,1,0,0,0|2,0,0]=3 71 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 CS-W017965 [0,0,1,0,0,0|2,0,0]=3 72 B10R1.61 O=C(O)C1=CC=CC=C1F CS-W019975 [0,0,1,0,0,0|1,0,0]=2 73 B10R1.61 O=C(O)C1=CC=CN=C1F CS-D0952 [0,0,1,0,0,0|2,0,0]=3 74 B10R1.61 O=C(O)C1=CC=CNC1=S CS-W020029 [0,0,1,0,0,0|2,0,0]=3 75 B10R1.61 O=C(O)C1=NC=CC=C1F CS-D1556 [0,0,1,0,0,0|2,0,0]=3 76 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F CS-W008586 [0,0,1,0,0,0|2,0,1]=4 77 B12R2.24 BrC1=NC2=CC=CC=C2N=C1 CS-W008094 [0,0,0,0,0,1|3,0,0]=4 78 B12R2.24 CC1=CC2=CC=CC=C2N=C1 CS-W016413 [0,0,0,0,0,1|3,0,0]=4 79 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 CS-W007458 [0,0,0,0,0,1|2,0,1]=4 80 B12R2.24 ClC1=NC2=CC=CC=C2C=N1 CS-W005337 [0,0,0,0,0,1|2,0,1]=4 81 B12R2.24 NC1=NC2=CC=CC=C2C=C1 CS-W007524 [0,0,0,0,0,1|2,0,1]=4 82 B12R2.24 O=C1COC2=CC=CN=C2N1 CS-W002009 [0,0,0,0,0,1|3,0,0]=4 83 B12R2.24 OC1=CC2=CC=CC=C2N=C1 CS-W008203 [0,0,0,0,0,1|2,0,1]=4 84 B12R2.1081 BrC1=CN=CC2=C1C=CC=C2 CS-D1707 [0,0,0,0,0,1|2,0,1]=4 85 B12R2.1081 ClC1=CN=CC2=CC=CC=C12 CS-W019128 [0,0,0,0,0,1|2,0,1]=4 86 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 CS-0001469 [0,0,0,0,0,1|2,0,1]=4 87 B12R2.1081 NC1=CN=CC2=CC=CC=C12 CS-W008059 [0,0,0,0,0,1|2,0,1]=4 88 B12R2.1081 NC1CCOC2=C1C=CC=C2 CS-W019884 [0,0,0,0,0,1|2,0,1]=4 89 B12R2.1081 O=C1C=NNC2=C1C=CC=C2 CS-W022612 [0,0,0,0,0,1|2,0,0]=3 90 B12R2.1081 O=C1CCCC2=C1C=NC=C2 CS-W022438 [0,0,0,0,0,1|2,0,0]=3 91 B12R2.1081 O=C1CCCC2=CC=CC=C12 CS-D0598 [0,0,0,0,0,1|1,0,0]=2 92 B12R2.1081 O=C1N=CNC2=NC=CC=C12 CS-W022942 [0,0,0,0,0,1|2,0,1]=4 93 B9R1.6 CC(=O)C1=NC=CC=C1 CS-W008602 [1,0,1,0,0,0|1,0,0]=3 94 B9R1.6 CS(=O)C1=CC=CC=C1 CS-0046805 [1,0,1,0,0,0|1,0,0]=3 95 B9R1.6 C[C@H](N)C1=CC=CC=C1 CS-W019840 [1,0,1,0,0,0|1,0,1]=4 96 B9R1.6 O=C(O)C1=NC=CC=N1 CS-D0763 [1,0,1,0,0,0|2,0,0]=4 97 B9R1.6 O=C(O)C1=NN=CC=C1 CS-W004823 [1,0,1,0,0,0|2,0,0]=4 98 B9R1.6 O=S([O-])C1=CC=CC=C1 CS-W014314 [1,0,1,0,0,0|1,0,1]=4 99 B9R1.8 BrCCC1=CC=CC=C1 CS-W019955 [1,0,1,0,0,0|1,0,1]=4 100 B9R1.8 CNCC1=CC=CC=C1 CS-W007426 [1,0,1,0,0,0|1,0,1]=4 101 B9R1.8 C\C=C\C1=CC=CC=C1 CS-0069845 [1,0,1,0,0,0|1,0,0]=3 102 B9R1.8 NOCC1=CC=CC=C1 CS-W008955 [1,0,1,0,0,0|1,0,0]=3 103 B9R1.8 O\N=C\C1=CC=CC=C1 CS-0034180 [1,0,1,0,0,0|2,0,0]=4 104 B9R1.15 C=CC1=CC=CC=C1Br CS-W017069 [1,0,1,0,0,0|2,0,0]=4 105 B9R1.15 C=CC1=CC=CC=C1Cl CS-W016485 [1,0,1,0,0,0|2,0,0]=4 106 B9R1.15 CCC1=CC=CC=C1Br CS-W016966 [1,0,1,0,0,0|2,0,0]=4 107 B9R1.15 CCC1=CC=CC=C1I CS-0109507 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.15 NC1=C(C=O)C=CC=N1 CS-M0437 [1,0,1,0,0,0|2,0,0]=4 109 B9R1.15 NC1=C(CO)C=NC=C1 CS-0044077 [1,0,1,0,0,0|2,0,0]=4 110 B9R1.15 NCC1=CC=CC=C1I CS-0096870 [1,0,1,0,0,0|2,0,0]=4 111 B9R1.15 O=CC1=CC=CC=C1F CS-W008891 [1,0,1,0,0,0|1,0,0]=3 112 B9R1.15 O=CC1=CC=CN=C1Cl CS-W008584 [1,0,1,0,0,0|2,0,0]=4 113 B9R1.15 O=CC1=CC=CN=C1F CS-W019721 [1,0,1,0,0,0|2,0,0]=4 114 B9R1.15 O=CC1=NC=CC=C1Br CS-0094289 [1,0,1,0,0,0|2,0,0]=4 115 B9R1.15 OCC1=CC=CC=C1Cl CS-W016422 [1,0,1,0,0,0|1,0,0]=3 116 B9R1.15 OCC1=CC=CN=C1F CS-D0977 [1,0,1,0,0,0|2,0,0]=4 117 B11R1.12 COC(CO)C1=CC=CC=C1 CS-0028761 [0,1,1,0,0,0|0,0,2]=4 118 B11R1.12 COC(OC)C1=CC=CC=C1 CS-Z0014 [0,1,1,0,0,0|0,0,2]=4 119 B11R1.16 CCOC(=O)C1=NC=CC=N1 CS-W022718 [0,1,1,0,0,0|2,0,0]=4 120 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CS-W004658 [0,1,1,0,0,0|1,0,1]=4 121 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 CS-W007335 [0,1,1,0,0,0|2,0,0]=4 122 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS-0059258 [0,1,1,0,0,0|1,0,0]=3 123 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 CS-W018773 [0,1,1,0,0,0|1,0,0]=3 124 B11R1.22 COC(=O)C1=CC=C(C)C=C1 CS-0008417 [0,1,1,0,0,0|0,0,0]=2 125 B11R1.22 COC(=O)C1=CC=C(C)C=C1 CS-M1189 [0,1,1,0,0,0|0,0,0]=2 126 B11R1.22 COC(=O)C1=COC(=O)C=C1 CS-W008753 [0,1,1,0,0,0|1,0,0]=3 127 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 CS-D0954 [0,1,1,0,0,0|1,0,0]=3 128 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 CS-W019731 [0,1,1,0,0,0|2,0,0]=4 129 B11R1.22 COC(=O)C1=NC=C(O)C=C1 CS-W005963 [0,1,1,0,0,0|1,0,0]=3 130 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 CS-B1331 [0,1,1,0,0,0|2,0,0]=4 131 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 CS-W005465 [0,1,1,0,0,0|0,0,0]=2 132 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 CS-W004976 [0,1,1,0,0,0|1,0,0]=3 133 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 CS-W014906 [0,1,1,0,0,0|2,0,0]=4 134 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 CS-W019544 [0,1,1,0,0,0|1,0,0]=3 135 B11R1.36 O=C(C1=CC=CC=C1)C(F)F CS-0095863 [0,1,1,0,0,0|2,0,0]=4 136 B11R1.222 COC(=O)C1=C(C)N=CC=N1 CS-W023218 [0,1,1,0,0,0|2,0,0]=4 137 B11R1.222 COC(=O)C1=CC=CC=C1N CS-W019645 [0,1,1,0,0,0|0,0,0]=2 138 B11R1.222 COC(=O)C1=NC=CC=C1N CS-W009043 [0,1,1,0,0,0|1,0,0]=3 139 B11R1.222 COC(=O)C1=NC=CN=C1I CS-0041319 [0,1,1,0,0,0|2,0,0]=4 140 B11R1.222 COC(=O)C1=NC=CN=C1N CS-D1517 [0,1,1,0,0,0|2,0,0]=4 141 B11R1.91 CC(=O)NNC1=CC=CC=C1 CS-W018141 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 CS-W018211 [0,1,1,0,0,0|1,0,1]=4 143 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CS-W007319 [0,1,1,0,0,0|1,0,1]=4 144 B11R1.91 O=C(O)COC1=CC=CC=C1 CS-0013736 [0,1,1,0,0,0|2,0,0]=4 145 B11R1.37 COC1=C(C=O)C=C(Br)C=C1 CS-M0570 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.37 COC1=CC=C(Cl)C=C1C=O CS-W017675 [0,1,1,0,0,0|2,0,0]=4 147 B11R1.37 COC1=CC=C(O)C=C1C=O CS-W006530 [0,1,1,0,0,0|2,0,0]=4 148 B11R1.37 N#CC1=C(C=O)C=CC(Cl)=C1 CS-W018964 [0,1,1,0,0,0|1,0,1]=4 149 B11R1.37 N#CC1=CC(F)=CC=C1C=O CS-0045055 [0,1,1,0,0,0|1,0,1]=4 150 B11R1.53 COC1=CC=CC=C1C(N)=O CS-0006716 [0,1,1,0,0,0|2,0,0]=4 151 B11R1.53 O=CC1=CC=CC=C1[N+](=O)[O-] CS-W007454 [0,1,1,0,0,0|1,0,1]=4 152 B11R1.53 O=[N+]([O-])C1=CC=CC=C1CO CS-W016285 [0,1,1,0,0,0|1,0,0]=3 153 B11R1.265 COC1=CC=CC(Br)=C1C=O CS-W020432 [0,1,1,0,0,0|2,0,0]=4 154 B11R1.265 COC1=CC=CC(F)=C1C=O CS-M0642 [0,1,1,0,0,0|2,0,0]=4 155 B11R1.156 CC(=O)C1=C(C)C=CC=C1O CS-W021205 [0,1,1,0,0,0|1,0,0]=3 156 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl CS-W008361 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F CS-0043763 [0,1,1,0,0,0|2,0,0]=4 158 B11R1.156 CC(=O)C1=C(O)C=CC=C1Cl CS-W019885 [0,1,1,0,0,0|2,0,0]=4 159 B11R1.156 CC1=C(B(O)O)C(F)=CC=C1 CS-0107586 [0,1,1,0,0,0|1,0,1]=4 160 B11R1.156 CC1=CC=CC(C)=C1C(=O)O CS-W017744 [0,1,1,0,0,0|0,0,0]=2 161 B11R1.156 O=C(O)C1=C(F)C=CC=C1F CS-M0554 [0,1,1,0,0,0|1,0,0]=3 162 B11R1.156 O=C(O)C1=C(F)C=NC=C1F CS-W018710 [0,1,1,0,0,0|2,0,0]=4 163 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F CS-W017577 [0,1,1,0,0,0|2,0,0]=4 164 B11R1.159 CC1=C(Br)C(C(=O)O)=CC=C1 CS-W007601 [0,1,1,0,0,0|1,0,0]=3 165 B11R1.159 CC1=C(F)C=CC=C1C(=O)O CS-W009095 [0,1,1,0,0,0|0,0,0]=2 166 B11R1.159 CC1=C(I)C=CC=C1[N+](=O)[O-] CS-0041327 [0,1,1,0,0,0|1,0,1]=4 167 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1Br CS-W014875 [0,1,1,0,0,0|1,0,1]=4 168 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N CS-M0044 [0,1,1,0,0,0|1,0,1]=4 169 B11R1.159 CC1=CC=CC(C(=O)O)=C1C CS-M0913 [0,1,1,0,0,0|0,0,0]=2 170 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 CS-M0574 [0,1,1,0,0,0|2,0,0]=4 171 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 CS-W005002 [0,1,1,0,0,0|1,0,0]=3 172 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 CS-W017482 [0,1,1,0,0,0|1,0,0]=3 173 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 CS-W016334 [0,1,1,0,0,0|1,0,0]=3 174 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 CS-M1008 [0,1,1,0,0,0|2,0,0]=4 175 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 CS-W018050 [0,1,1,0,0,0|2,0,0]=4 176 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1F CS-0094504 [0,1,1,0,0,0|2,0,0]=4 177 B11R1.166 CC(=O)C1=CC=C(O)C=C1C CS-W010970 [0,1,1,0,0,0|1,0,0]=3 178 B11R1.166 CC1=CC(Br)=CC=C1C(=O)O CS-W004863 [0,1,1,0,0,0|0,0,0]=2 179 B11R1.166 CC1=CC(Br)=CC=C1[N+](=O)[O-] CS-W000606 [0,1,1,0,0,0|1,0,1]=4 180 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 CS-W007777 [0,1,1,0,0,0|1,0,1]=4 181 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O CS-W003405 [0,1,1,0,0,0|1,0,0]=3 182 B11R1.166 CC1=CC(N)=C(C(=N)O)C=C1 CS-W005470 [0,1,1,0,0,0|2,0,0]=4 183 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 CS-W004921 [0,1,1,0,0,0|1,0,0]=3 184 B11R1.166 CC1=CC(O)=CC=C1C(=O)O CS-W016305 [0,1,1,0,0,0|0,0,0]=2 185 B11R1.166 CC1=CC=C(C(=O)O)C(I)=C1 CS-0041338 [0,1,1,0,0,0|1,0,0]=3 186 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 CS-W009192 [0,1,1,0,0,0|1,0,0]=3 187 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 CS-W019810 [0,1,1,0,0,0|1,0,0]=3 188 B11R1.166 NC1=NC(Br)=CC=C1C(=O)O CS-W008862 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 CS-W013226 [0,1,1,0,0,0|1,0,0]=3 190 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 CS-W017485 [0,1,1,0,0,0|1,0,0]=3 191 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 CS-W008018 [0,1,1,0,0,0|1,0,0]=3 192 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 CS-W019669 [0,1,1,0,0,0|2,0,0]=4 193 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O CS-W008739 [0,1,1,0,0,0|1,0,0]=3 194 B11R1.166 O=C(O)C1=CC=C(I)C=C1Br CS-W019733 [0,1,1,0,0,0|1,0,0]=3 195 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br CS-W007187 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 CS-0041764 [0,1,1,0,0,0|2,0,0]=4 197 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 CS-D0882 [0,1,1,0,0,0|2,0,0]=4 198 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 CS-0028281 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 CS-W004713 [0,1,1,0,0,0|2,0,0]=4 200 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 CS-W007851 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.167 CC(=O)C1=CC(F)=CC=C1Br CS-0019646 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 CS-W018147 [0,1,1,0,0,0|0,0,0]=2 203 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 CS-W008213 [0,1,1,0,0,0|1,0,0]=3 204 B11R1.167 CC1=CC(C(=O)O)=C(Cl)N=C1 CS-W017642 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 CS-W002036 [0,1,1,0,0,0|1,0,0]=3 206 B11R1.167 CC1=CC=C(Cl)C=C1C(=O)O CS-W020714 [0,1,1,0,0,0|0,0,0]=2 207 B11R1.167 CC1=CC=C(F)C=C1B(O)O CS-0007620 [0,1,1,0,0,0|1,0,1]=4 208 B11R1.167 CC1=CC=C(F)C=C1C(=O)O CS-W020687 [0,1,1,0,0,0|0,0,0]=2 209 B11R1.167 CC1=CC=C(F)C=C1[N+](=O)[O-] CS-W016254 [0,1,1,0,0,0|1,0,1]=4 210 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 CS-0005514 [0,1,1,0,0,0|2,0,0]=4 211 B11R1.167 N=C(O)C1=C(N)C=CC(F)=C1 CS-W005552 [0,1,1,0,0,0|2,0,0]=4 212 B11R1.167 NC(=O)C1=C(O)C=CC(Cl)=C1 CS-W017643 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.167 NC1=CC=C(Cl)C=C1C(=O)O CS-W020077 [0,1,1,0,0,0|1,0,0]=3 214 B11R1.167 NC1=CC=C(F)C=C1C(=O)O CS-W019755 [0,1,1,0,0,0|1,0,0]=3 215 B11R1.167 NC1=CC=C(O)C=C1C(=O)O CS-W002035 [0,1,1,0,0,0|1,0,0]=3 216 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=N1 CS-W005193 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 CS-W013225 [0,1,1,0,0,0|1,0,0]=3 218 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 CS-W007855 [0,1,1,0,0,0|1,0,0]=3 219 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 CS-W018013 [0,1,1,0,0,0|1,0,0]=3 220 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 CS-W008197 [0,1,1,0,0,0|1,0,0]=3 221 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=C1 CS-B0860 [0,1,1,0,0,0|2,0,0]=4 222 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl CS-D1733 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl CS-D0157 [0,1,1,0,0,0|2,0,0]=4 224 B11R1.167 O=C(O)C1=CC(I)=CC=C1O CS-0075700 [0,1,1,0,0,0|1,0,0]=3 225 B11R1.167 O=C(O)C1=CC(O)=CC=C1Br CS-W018588 [0,1,1,0,0,0|1,0,0]=3 226 B11R2.10 CC1=CC2=CC=CC=C2N1 CS-W007556 [1,1,0,0,0,0|2,0,0]=4 227 B11R2.10 O=C1CC2=C(C=CC=C2)C1 CS-W020518 [1,1,0,0,0,0|1,0,1]=4 228 B11R2.36 BrC1=CC2=CNN=C2C=C1 CS-M2951 [1,1,0,0,0,0|2,0,0]=4 229 B11R2.36 CC1=CC2=C(C=CN2)C=C1 CS-W007349 [1,1,0,0,0,0|2,0,0]=4 230 B11R2.36 ClC1=CC=C2NC=CC2=C1 CS-W007384 [1,1,0,0,0,0|2,0,0]=4 231 B11R2.36 FC1=CC=C2CNCC2=C1 CS-W005402 [1,1,0,0,0,0|1,0,1]=4 232 B11R2.36 NC1=CC2=C(C=C1)COC2 CS-W021280 [1,1,0,0,0,0|0,0,1]=3 233 B11R2.36 NC1=CC=C2NC=CC2=C1 CS-W007509 [1,1,0,0,0,0|2,0,0]=4 234 B11R2.36 OC1=CC=C2NN=CC2=C1 CS-D0862 [1,1,0,0,0,0|2,0,0]=4 235 B11R2.106 ClC1=CC=CC2=C1C=NN2 CS-M0440 [1,1,0,0,0,0|2,0,0]=4 236 B11R2.106 FC1=CC=CC2=C1C=NN2 CS-D0834 [1,1,0,0,0,0|2,0,0]=4 237 B11R2.106 FC1=CC=CC2=C1NC=C2 CS-W007613 [1,1,0,0,0,0|2,0,0]=4 238 B11R2.106 NC1=C2C=NNC2=CC=C1 CS-0007645 [1,1,0,0,0,0|2,0,0]=4 239 B11R2.106 NC1=C2CCOC2=CC=C1 CS-W018648 [1,1,0,0,0,0|2,0,0]=4 240 B13R2.57 O=CC1=CC=C2C=CC=CC2=C1 CS-D1121 [0,1,0,0,0,1|1,0,1]=4 241 B13R2.155 O=C1C=C2C=C(Br)C=CC2=CN1 CS-W009202 [0,1,0,0,0,1|1,0,1]=4 242 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)N1 CS-W019815 [0,1,0,0,0,1|1,0,1]=4 243 B13R2.155 O=C1CCC2=C(C=C(Br)C=C2)C1 CS-B0104 [0,1,0,0,0,1|1,0,0]=3 244 B13R2.162 O=C1C=CC2=C(N1)C(O)=CC=C2 CS-D1708 [0,1,0,0,0,1|1,0,1]=4 245 B13R2.162 O=C1CCC2=C(C1)C(Br)=CC=C2 CS-B0106 [0,1,0,0,0,1|1,0,0]=3 246 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 CS-W006004 [0,1,0,0,0,1|1,0,1]=4 247 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 CS-M0780 [0,1,0,0,0,1|0,0,1]=3 248 B13R2.3683 O=C1C=CC2=CC(Cl)=CC=C2N1 CS-W017247 [0,1,0,0,0,1|1,0,1]=4 249 B13R2.3683 O=C1C=NC2=C(C=CC(Br)=C2)N1 CS-W005675 [0,1,0,0,0,1|2,0,0]=4 250 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)N1 CS-D1588 [0,1,0,0,0,1|1,0,0]=3 251 B13R2.3683 O=C1CCC2=C(C=CC(I)=C2)N1 CS-0105113 [0,1,0,0,0,1|1,0,0]=3 252 B13R2.3683 O=C1CNC2=CC(Br)=CC=C2N1 CS-0047641 [0,1,0,0,0,1|2,0,0]=4 253 B13R2.5179 O=C1C=C2C=CC=C(Cl)C2=CN1 CS-0105280 [0,1,0,0,0,1|1,0,1]=4 254 B13R2.342 O=C1CCCC2=C1C=CC=C2Br CS-W004788 [0,1,0,0,0,1|1,0,0]=3 255 B13R2.342 O=C1CCCC2=C1C=CC=C2F CS-B0543 [0,1,0,0,0,1|1,0,0]=3 256 B13R2.342 O=C1NCCC2=C1C=CC=C2Br CS-W006085 [0,1,0,0,0,1|1,0,0]=3 257 B13R2.371 O=C1NN=C(Br)C2=C1C=CC=C2 CS-0041952 [0,1,0,0,0,1|1,0,1]=4 258 B13R2.1613 O=CC1=CN=CC2=CC=CC=C21 CS-W008375 [0,1,0,0,0,1|1,0,1]=4 259 B13R2.4818 O=C1N=CNC2=C1C(F)=CC=C2 CS-0036373 [0,1,0,0,0,1|1,0,1]=4 260 B13R2.72 CC(=O)N1CCC2=CC=CC=C21 CS-W010870 [0,2,0,0,0,0|2,0,0]=4 261 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 CS-W008166 [0,2,0,0,0,0|2,0,0]=4 262 B13R2.72 O=[N+]([O-])C1=CNC2=CC=CC=C21 CS-W005280 [0,2,0,0,0,0|2,0,0]=4 263 B13R2.135 CC1=C(C=O)C2=CC=CC=C2N1 CS-W007520 [0,2,0,0,0,0|2,0,0]=4 264 B13R2.2136 O=CC1=CNC2=C1C=C(F)C=C2 CS-W008994 [0,2,0,0,0,0|2,0,0]=4 265 B13R2.2136 O=CC1=CNC2=C1C=C(O)C=C2 CS-W022389 [0,2,0,0,0,0|2,0,0]=4 266 B13R2.2931 CN1N=C(C=O)C2=C1C=CC=C2 CS-W021348 [0,2,0,0,0,0|2,0,0]=4 267 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O CS-W010873 [0,2,0,0,0,0|2,0,0]=4 268 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O CS-W007383 [0,2,0,0,0,0|2,0,0]=4 269 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O CS-W007549 [0,2,0,0,0,0|2,0,0]=4 270 B13R2.3028 O=C1NC2=C(C=C(I)C=C2)C1=O CS-0041245 [0,2,0,0,0,0|2,0,0]=4 271 B13R2.3085 NN1C(=O)C2=CC=CC=C2C1=O CS-W004962 [0,2,0,0,0,0|1,0,1]=4 272 B13R2.3085 O=C1C2=CC=CC=C2C(=O)N1O CS-W008848 [0,2,0,0,0,0|1,0,1]=4 273 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O CS-W009274 [0,2,0,0,0,0|2,0,0]=4 274 B13R2.4856 O=C1NC2=C(C1=O)C(Br)=CC=C2 CS-W008631 [0,2,0,0,0,0|2,0,0]=4 275 B13R2.3742 O=C1CCC2=C(Cl)C=C(Cl)C=C12 CS-0042853 [0,2,0,0,0,0|1,0,0]=3 276 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 CS-W019466 [0,2,0,0,0,0|0,0,1]=3 277 B13R2.5187 O=C1OC(=O)C2=C1C=CC(F)=C2 CS-W016065 [0,2,0,0,0,0|0,0,1]=3 278 B13R2.5187 O=C1OC(=O)C2=C1C=CC(O)=C2 CS-W022391 [0,2,0,0,0,0|0,0,1]=3 279 B13R2.11634 O=C1CCC2=CC(F)=C(F)C=C12 CS-B0436 [0,2,0,0,0,0|1,0,0]=3 280 B13R2.573 COC1=CC=CC2=C1CNC2=O CS-W022207 [0,2,0,0,0,0|1,0,0]=3 281 B13R2.5151 CC1=CC=C(Br)C2=C1C(=O)CC2 CS-0101678 [0,2,0,0,0,0|1,0,0]=3 282 B13R2.11642 O=C1CCC2=CC(Br)=CC(F)=C12 CS-0033646 [0,2,0,0,0,0|1,0,0]=3 283 B13R2.12159 O=C1OS(=O)(=O)C2=CC=CC=C12 CS-0066044 [0,2,0,0,0,0|1,0,0]=3 284 B9R1.11 COC(=O)C1=CSC=C1 CS-W007570 [0,0,1,0,1,0|1,0,0]=3 285 B9R1.41 CC1=C(C(=O)O)C=CN1 CS-0038738 [0,0,1,0,1,0|1,0,0]=3 286 B9R1.41 CN1N=CC=C1C(=O)O CS-D1713 [0,0,1,0,1,0|2,0,0]=4 287 B9R1.41 O=C(O)C1=C(Cl)C=CS1 CS-0043862 [0,0,1,0,1,0|2,0,0]=4 288 B9R1.41 O=C(O)C1=CSC=C1Br CS-D0118 [0,0,1,0,1,0|2,0,0]=4 289 B11R1.86 CC(=O)CC1=CC=CC=C1Br CS-W007949 [0,0,1,0,0,1|2,0,0]=4 290 B11R1.86 CC(=O)NC1=CC=CC=C1N CS-W008938 [0,0,1,0,0,1|2,0,0]=4 291 B11R1.86 CC1=CC=CC=C1CC(=O)O CS-W018151 [0,0,1,0,0,1|0,0,0]=2 292 B11R1.86 O=C(O)CC1=C(Cl)N=CC=C1 CS-0043768 [0,0,1,0,0,1|2,0,0]=4 293 B11R1.86 O=C(O)CC1=CC=CC=C1F CS-W020118 [0,0,1,0,0,1|1,0,0]=3