0 B11R2.1 BrC1=C2N=CC=CC2=NS1 CS-0088101 [0,0,0,0,0,0|3,1,0]=4 1 B11R2.1 BrC1=CNC2=CN=CC=C12 CS-W006182 [0,0,0,0,0,0|4,0,0]=4 2 B11R2.1 BrC1=COC2=C1C=NC=C2 CS-0087976 [0,0,0,0,0,0|4,0,0]=4 3 B11R2.1 BrC1=COC2=C1N=CC=C2 CS-0060633 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 BrC1=CSC2=CC=CN=C12 CS-0051430 [0,0,0,0,0,0|4,0,0]=4 5 B11R2.1 BrC1=NOC2=CC=CC=C21 CS-0112728 [0,0,0,0,0,0|3,0,0]=3 6 B11R2.1 CC1=CNC2=C1C=NC=C2 CS-0051267 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.1 CC1=NN=C2C=CC=CN12 CS-0085153 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.1 CC1=NNC2=CC=NC=C21 CS-0051271 [0,0,0,0,0,0|4,0,0]=4 9 B11R2.1 C[N+]1=CSC2=CC=CC=C21 CS-0112720 [0,0,0,0,0,0|4,0,0]=4 10 B11R2.1 ClC1=CNC2=C1C=CC=C2 CS-0005541 [0,0,0,0,0,0|3,0,0]=3 11 B11R2.1 ClC1=NN=C2C=CC=CN12 CS-0051427 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.1 IC1=C2C=CC=CN2N=C1 CS-0088111 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.1 IC1=CN=C2C=CC=CN12 CS-0084902 [0,0,0,0,0,0|4,0,0]=4 14 B11R2.1 NC1=CNC2=CN=CC=C12 CS-0092062 [0,0,0,0,0,0|4,0,0]=4 15 B11R2.1 NC1=CSC2=NC=CC=C12 CS-0084843 [0,0,0,0,0,0|4,0,0]=4 16 B11R2.1 NC1CCC2=CC=NC=C21 CS-0077310 [0,0,0,0,0,0|3,0,1]=4 17 B11R2.1 NC1CCC2=NC=CC=C21 CS-0084861 [0,0,0,0,0,0|3,0,1]=4 18 B11R2.1 NN1N=CC2=CC=CC=C21 CS-0060586 [0,0,0,0,0,0|3,0,1]=4 19 B11R2.1 O=C1COC2=C1C=NC=C2 CS-0087986 [0,0,0,0,0,0|3,0,0]=3 20 B11R2.1 O=C1NC=C2C=CC=CN12 CS-0029727 [0,0,0,0,0,0|2,0,1]=3 21 B11R2.1 O=C1NCC2=C1C=CN=C2 CS-0098692 [0,0,0,0,0,0|2,0,0]=2 22 B11R2.1 O=C1NCC2=C1CC=CC2 CS-0052182 [0,0,0,0,0,0|1,0,2]=3 23 B11R2.1 O=C1NCC2=CC=NC=C12 CS-0052557 [0,0,0,0,0,0|2,0,0]=2 24 B11R2.1 O=C1SSC2=CC=CC=C12 CS-0112260 [0,0,0,0,0,0|1,1,0]=2 25 B11R2.1 OC1CCC2=C1C=CC=N2 CS-0060663 [0,0,0,0,0,0|2,0,2]=4 26 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 CS-0069940 [0,0,0,0,0,0|2,0,2]=4 27 B11R2.1 O[C@H]1CCC2=C1C=CN=C2 CS-0069933 [0,0,0,0,0,0|2,0,2]=4 28 B11R2.1 S=C1NN=C2C=CC=CN12 CS-0085157 [0,0,0,0,0,0|3,1,0]=4 29 B10R2.7 C1=CC2=C(C=CO2)C=N1 CS-0084800 [1,0,0,0,0,0|3,0,0]=4 30 B10R2.7 C1=CC2=C(C=N1)CCO2 CS-0091894 [1,0,0,0,0,0|3,0,0]=4 31 B10R2.7 C1=CC2=C(C=N1)CNC2 CS-D0313 [1,0,0,0,0,0|2,0,1]=4 32 B10R2.7 C1=CC2=C(CNC2)N=C1 CS-W005091 [1,0,0,0,0,0|2,0,1]=4 33 B12R2.1 BrCC1=NOC2=C1C=CC=C2 CS-0085292 [0,1,0,0,0,0|3,0,0]=4 34 B12R2.1 O=CC1=NNC2=NC=CC=C12 CS-0052519 [0,1,0,0,0,0|3,0,0]=4 35 B12R2.1 OCC1=NNC2=CC=CC=C21 CS-0052546 [0,1,0,0,0,0|2,0,1]=4 36 B12R2.18 CN1N=C2C=CC=CC2=C1Br CS-0051481 [0,1,0,0,0,0|3,0,0]=4 37 B12R2.18 O=C1CC2=CC=CC=C2C1=O CS-W014296 [0,1,0,0,0,0|1,0,0]=2 38 B12R2.132 BrC1=CC2=C(C=C1)NN=C2Br CS-0085356 [0,1,0,0,0,0|3,0,0]=4 39 B12R2.132 CC1=CC2=C(C=C1)CCC2=O CS-W014350 [0,1,0,0,0,0|1,0,0]=2 40 B12R2.132 CC1=CC2=C(I)NN=C2C=C1 CS-0037305 [0,1,0,0,0,0|3,0,0]=4 41 B12R2.132 CC1=CC=C2COB(O)C2=C1 CS-0093708 [0,1,0,0,0,0|1,0,1]=3 42 B12R2.132 CC1=CC=C2NN=C(Br)C2=C1 CS-0088130 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.132 CC1=CNC2=CC=C(Cl)C=C12 CS-0050527 [0,1,0,0,0,0|3,0,0]=4 44 B12R2.132 CC1=NNC2=C1C=C(Cl)C=C2 CS-0088031 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.132 ClC1=CC2=C(C=C1)NN=C2Cl CS-0085369 [0,1,0,0,0,0|3,0,0]=4 46 B12R2.132 ClC1=NNC2=CC=C(Br)C=C21 CS-0050603 [0,1,0,0,0,0|3,0,0]=4 47 B12R2.132 N=C1NNC2=C1C=C(F)C=C2 CS-0060649 [0,1,0,0,0,0|3,0,0]=4 48 B12R2.132 NC1=CC2=C(C=C1)NN=C2Cl CS-0051423 [0,1,0,0,0,0|3,0,0]=4 49 B12R2.132 NC1=CC2=C(C=C1)NN=C2I CS-0051329 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.132 NC1=CC=C2COB(O)C2=C1 CS-0078609 [0,1,0,0,0,0|1,0,1]=3 51 B12R2.132 NC1=CC=C2COB(O)C2=C1 CS-0100861 [0,1,0,0,0,0|1,0,1]=3 52 B12R2.132 NC1=CC=C2COC(=O)C2=C1 CS-0036733 [0,1,0,0,0,0|0,0,0]=1 53 B12R2.132 NC1=CC=C2CSC(=O)C2=C1 CS-0093507 [0,1,0,0,0,0|0,1,0]=2 54 B12R2.132 NC1=NNC2=C1C=C(Cl)C=C2 CS-0085350 [0,1,0,0,0,0|3,0,0]=4 55 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 CS-0053332 [0,1,0,0,0,0|2,0,1]=4 56 B12R2.132 O=C1NC=C2C=CC(Br)=CN12 CS-0100755 [0,1,0,0,0,0|2,0,1]=4 57 B12R2.132 O=C1NCC2=C1C=C(Br)N=C2 CS-0099944 [0,1,0,0,0,0|2,0,0]=3 58 B12R2.132 O=C1NCC2=C1C=C(Cl)C=C2 CS-0082122 [0,1,0,0,0,0|1,0,0]=2 59 B12R2.132 O=C1NCC2=C1C=C(Cl)N=C2 CS-0100307 [0,1,0,0,0,0|2,0,0]=3 60 B12R2.132 O=C1NCC2=C1C=C(I)C=C2 CS-0096365 [0,1,0,0,0,0|1,0,0]=2 61 B12R2.132 O=C1NNC2=C1C=C(I)C=C2 CS-D0093 [0,1,0,0,0,0|2,0,0]=3 62 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 CS-B1580 [0,1,0,0,0,0|2,0,0]=3 63 B12R2.132 OB1OCC2=CC=C(Cl)C=C12 CS-0078613 [0,1,0,0,0,0|1,0,1]=3 64 B12R2.132 OB1OCC2=CC=C(S)C=C12 CS-0079300 [0,1,0,0,0,0|1,0,1]=3 65 B12R2.196 BrC1=CC=CC2=C1NN=C2I CS-0050084 [0,1,0,0,0,0|3,0,0]=4 66 B12R2.196 CC1=C2C=CC=C(Br)C2=NN1 CS-0037244 [0,1,0,0,0,0|3,0,0]=4 67 B12R2.196 CC1=C2COB(O)C2=CC=C1 CS-0078585 [0,1,0,0,0,0|1,0,1]=3 68 B12R2.196 CC1=NOC2=C1C=CC=C2Br CS-0106925 [0,1,0,0,0,0|3,0,0]=4 69 B12R2.196 ClC1=NNC2=C(Br)C=CC=C12 CS-0050088 [0,1,0,0,0,0|3,0,0]=4 70 B12R2.196 ClC1=NOC2=C1C=CC=C2Br CS-0098086 [0,1,0,0,0,0|3,0,0]=4 71 B12R2.196 FC1=C2SC=C(Br)C2=CC=C1 CS-0107669 [0,1,0,0,0,0|3,0,0]=4 72 B12R2.196 NC1=C2COB(O)C2=CC=C1 CS-0078592 [0,1,0,0,0,0|1,0,1]=3 73 B12R2.196 NC1=C2COC(=O)C2=CC=C1 CS-0064854 [0,1,0,0,0,0|0,0,0]=1 74 B12R2.196 NC1=CC=CC2=C1NN=C2Cl CS-0051422 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.196 NC1CCC2=C1C=CC=C2Br CS-0051005 [0,1,0,0,0,0|2,0,1]=4 76 B12R2.196 NC1CCC2=C1C=CC=C2F CS-0104995 [0,1,0,0,0,0|2,0,1]=4 77 B12R2.196 N[C@H]1CCC2=C1C=CC=C2F CS-0060662 [0,1,0,0,0,0|2,0,1]=4 78 B12R2.196 O=C1COC2=C(F)C=CC=C12 CS-0106328 [0,1,0,0,0,0|2,0,0]=3 79 B12R2.196 O=C1NCC2=C1C=CC=C2F CS-0062221 [0,1,0,0,0,0|1,0,0]=2 80 B12R2.196 O=C1NN=C2C(Cl)=CC=CN12 CS-0084377 [0,1,0,0,0,0|3,0,0]=4 81 B12R2.196 OC1=NNC2=C1C=CC=C2F CS-0036919 [0,1,0,0,0,0|2,0,1]=4 82 B12R2.196 O[C@H]1CCC2=C1C=CC=C2Br CS-0047467 [0,1,0,0,0,0|1,0,2]=4 83 B12R2.203 BrC1=CC=CC2=C1C(I)=NN2 CS-0053829 [0,1,0,0,0,0|3,0,0]=4 84 B12R2.203 CC1=C2B(O)OCC2=CC=C1 CS-0078584 [0,1,0,0,0,0|1,0,1]=3 85 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 CS-0061213 [0,1,0,0,0,0|1,0,0]=2 86 B12R2.203 CC1=C2C(Br)=CC=CC2=NN1 CS-0038555 [0,1,0,0,0,0|3,0,0]=4 87 B12R2.203 CC1=CNC2=C1C(N)=CC=C2 CS-0051277 [0,1,0,0,0,0|3,0,0]=4 88 B12R2.203 NC1=C2B(O)OCC2=CC=C1 CS-0078590 [0,1,0,0,0,0|1,0,1]=3 89 B12R2.203 NC1=C2C(=O)CCC2=CC=C1 CS-0001936 [0,1,0,0,0,0|1,0,0]=2 90 B12R2.203 NC1=C2C(=O)NCC2=CC=C1 CS-0050115 [0,1,0,0,0,0|1,0,0]=2 91 B12R2.203 NC1=CC=CC2=C1C(Br)=NN2 CS-0088072 [0,1,0,0,0,0|3,0,0]=4 92 B12R2.203 NC1=CC=CC2=C1C(Cl)=NN2 CS-0051424 [0,1,0,0,0,0|3,0,0]=4 93 B12R2.203 NC1=CC=CC2=C1C(I)=NN2 CS-0051330 [0,1,0,0,0,0|3,0,0]=4 94 B12R2.203 O=C1COC2=C1C(I)=CC=C2 CS-0111717 [0,1,0,0,0,0|2,0,0]=3 95 B12R2.203 O=C1COC2=CC=CC(O)=C12 CS-0106453 [0,1,0,0,0,0|2,0,0]=3 96 B12R2.203 O=C1NCC2=NC=CC(Br)=C12 CS-0078947 [0,1,0,0,0,0|2,0,0]=3 97 B12R2.203 OB1OCC2=CC=CC(F)=C12 CS-0093707 [0,1,0,0,0,0|1,0,1]=3 98 B12R2.612 CC1=CC=C2B(O)OCC2=C1 CS-0078582 [0,1,0,0,0,0|1,0,1]=3 99 B12R2.612 CC1=CNC2=C1C=CC(Br)=C2 CS-0050274 [0,1,0,0,0,0|3,0,0]=4 100 B12R2.612 CC1=CNC2=C1C=CC(N)=C2 CS-0051276 [0,1,0,0,0,0|3,0,0]=4 101 B12R2.612 CC1=CNC2=C1C=CC(O)=C2 CS-0051275 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.612 CC1=NNC2=C1C=CC(N)=C2 CS-0058667 [0,1,0,0,0,0|3,0,0]=4 103 B12R2.612 CC1=NNC2=CC(I)=CC=C21 CS-0050186 [0,1,0,0,0,0|3,0,0]=4 104 B12R2.612 CC1=NOC2=C1C=CC(Br)=C2 CS-0085338 [0,1,0,0,0,0|3,0,0]=4 105 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 CS-0085325 [0,1,0,0,0,0|3,0,0]=4 106 B12R2.612 ClC1=CC2=C(C=C1)C(I)=NN2 CS-0062452 [0,1,0,0,0,0|3,0,0]=4 107 B12R2.612 ClC1=CNC2=C1C=CC(Br)=C2 CS-0029649 [0,1,0,0,0,0|3,0,0]=4 108 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NN2 CS-0051405 [0,1,0,0,0,0|3,0,0]=4 109 B12R2.612 NC1=CC2=C(C=C1)C(Br)=NN2 CS-0060657 [0,1,0,0,0,0|3,0,0]=4 110 B12R2.612 NC1=CC2=C(C=C1)C(I)=NN2 CS-0051328 [0,1,0,0,0,0|3,0,0]=4 111 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 CS-0038777 [0,1,0,0,0,0|2,0,1]=4 112 B12R2.612 NC1=CC=C2B(O)OCC2=C1 CS-0078594 [0,1,0,0,0,0|1,0,1]=3 113 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 CS-W008688 [0,1,0,0,0,0|1,0,0]=2 114 B12R2.612 NC1=CC=C2C(=O)COC2=C1 CS-0104549 [0,1,0,0,0,0|2,0,0]=3 115 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 CS-0104999 [0,1,0,0,0,0|2,0,1]=4 116 B12R2.612 O=C1COC2=CC(F)=CC=C12 CS-0105957 [0,1,0,0,0,0|2,0,0]=3 117 B12R2.612 O=C1CSC2=CC(Br)=CC=C12 CS-0101747 [0,1,0,0,0,0|2,0,0]=3 118 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 CS-D0305 [0,1,0,0,0,0|1,0,0]=2 119 B12R2.612 OB1OCC2=C1C=CC(O)=C2 CS-0052741 [0,1,0,0,0,0|1,0,1]=3 120 B12R2.612 OC1=NSC2=C1C=CC(F)=C2 CS-0060655 [0,1,0,0,0,0|2,0,1]=4 121 B12R2.2028 CC1NC(=O)C2=CC=CC=C21 CS-0058508 [0,1,0,0,0,0|1,0,0]=2 122 B12R2.2028 CC1OB(O)C2=CC=CC=C21 CS-0078583 [0,1,0,0,0,0|1,0,1]=3 123 B12R2.2028 O=C1CC(O)C2=C1C=CC=C2 CS-0113155 [0,1,0,0,0,0|1,0,0]=2 124 B12R2.2403 CC1(C)NCC2=CC=CC=C21 CS-0052761 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.15 CC(ON)C1=CC=CC=C1 CS-0080699 [0,0,1,0,0,0|2,0,1]=4 126 B10R1.15 CCC(Br)C1=CC=CC=C1 CS-0037459 [0,0,1,0,0,0|2,0,1]=4 127 B10R1.15 COC(=N)C1=CC=CC=C1 CS-0037087 [0,0,1,0,0,0|1,0,0]=2 128 B10R1.15 COC(=O)C1=CC=NC=N1 CS-0036314 [0,0,1,0,0,0|2,0,0]=3 129 B10R1.15 O=C(CF)C1=CC=CC=C1 CS-0037091 [0,0,1,0,0,0|2,0,0]=3 130 B10R1.17 C=COCC1=CC=CC=C1 CS-0049793 [0,0,1,0,0,0|1,0,0]=2 131 B10R1.17 O=CCSC1=CC=CC=C1 CS-0102366 [0,0,1,0,0,0|2,0,0]=3 132 B10R1.17 O=CNCC1=CC=CC=C1 CS-0009966 [0,0,1,0,0,0|1,0,0]=2 133 B10R1.20 C#CC1=C(CO)C=CC=N1 CS-0035639 [0,0,1,0,0,0|2,0,1]=4 134 B10R1.20 CNC1=C(C=O)C=CC=N1 CS-0061781 [0,0,1,0,0,0|3,0,0]=4 135 B10R1.20 COC1=CN=CC=C1C=O CS-W005812 [0,0,1,0,0,0|3,0,0]=4 136 B10R1.20 OCC1=C(CO)C=NC=C1 CS-0052985 [0,0,1,0,0,0|1,0,2]=4 137 B10R1.20 OCC1=C(CO)C=NC=C1 CS-0052986 [0,0,1,0,0,0|1,0,2]=4 138 B10R1.20 OCC1=C(CO)N=CC=C1 CS-0060368 [0,0,1,0,0,0|1,0,2]=4 139 B10R1.20 OCC1=C(CO)N=CC=C1 CS-0060369 [0,0,1,0,0,0|1,0,2]=4 140 B10R1.61 C=C(C)C1=C(Br)C=CC=C1 CS-0060836 [0,0,1,0,0,0|3,0,0]=4 141 B10R1.61 CC(=O)C1=CC=NC=C1N CS-0060851 [0,0,1,0,0,0|3,0,0]=4 142 B10R1.61 CC(=O)C1=NC=CC=C1C CS-0092057 [0,0,1,0,0,0|2,0,0]=3 143 B10R1.61 CC(=O)C1=NC=CC=C1Cl CS-0052888 [0,0,1,0,0,0|3,0,0]=4 144 B10R1.61 CC(=O)C1=NC=CC=C1O CS-W019613 [0,0,1,0,0,0|3,0,0]=4 145 B10R1.61 CC(=O)C1=NC=NC=C1C CS-0102215 [0,0,1,0,0,0|3,0,0]=4 146 B10R1.61 CC1=C(C(N)=O)C=CC=N1 CS-0061159 [0,0,1,0,0,0|2,0,0]=3 147 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] CS-0051266 [0,0,1,0,0,0|2,0,1]=4 148 B10R1.61 CC1=CC=NC=C1C(N)=O CS-0061336 [0,0,1,0,0,0|2,0,0]=3 149 B10R1.61 CC1=CC=NC=C1[N+](=O)[O-] CS-W002247 [0,0,1,0,0,0|2,0,1]=4 150 B10R1.61 C[C@@H](O)C1=CC=CC=C1F CS-0085730 [0,0,1,0,0,0|2,0,1]=4 151 B10R1.61 C[C@H](O)C1=CC=CC=C1N CS-0093936 [0,0,1,0,0,0|2,0,1]=4 152 B10R1.61 NC(=O)C1=C(N)C=CN=C1 CS-W018959 [0,0,1,0,0,0|3,0,0]=4 153 B10R1.61 NC(=O)C1=CC=CN=C1Cl CS-0030384 [0,0,1,0,0,0|3,0,0]=4 154 B10R1.61 NC(=O)C1=CC=CN=C1O CS-0081575 [0,0,1,0,0,0|3,0,0]=4 155 B10R1.61 NC1=CC=CN=C1C(=O)O CS-W002358 [0,0,1,0,0,0|2,0,0]=3 156 B10R1.61 O=C(O)C1=NC=NC=C1F CS-0050473 [0,0,1,0,0,0|3,0,0]=4 157 B10R2.32 O=C1CCC2=C1NN=C2 CS-0094639 [0,0,0,0,1,0|3,0,0]=4 158 B10R2.32 O=C1CCC2=C1OC=C2 CS-0088988 [0,0,0,0,1,0|2,0,0]=3 159 B10R2.32 O=C1CCC2=C1OC=N2 CS-0094637 [0,0,0,0,1,0|3,0,0]=4 160 B10R2.32 O=C1CCN2N=CC=C12 CS-0068330 [0,0,0,0,1,0|3,0,0]=4 161 B12R2.24 CC1=NC2=CC=CC=C2C=N1 CS-0099614 [0,0,0,0,0,1|2,0,1]=4 162 B12R2.24 IC1=CC2=CC=CC=C2N=C1 CS-0103668 [0,0,0,0,0,1|3,0,0]=4 163 B12R2.24 NC1=CC2=C(C=CC=C2)N=N1 CS-0060744 [0,0,0,0,0,1|3,0,0]=4 164 B12R2.24 NC1=NC=C2C=CC=CC2=N1 CS-W009159 [0,0,0,0,0,1|2,0,1]=4 165 B12R2.24 O=C1C=CC2=C(N=CC=C2)N1 CS-0052753 [0,0,0,0,0,1|2,0,1]=4 166 B12R2.24 O=C1CCC2=C(C=CC=N2)C1 CS-0102419 [0,0,0,0,0,1|2,0,0]=3 167 B12R2.24 O=C1CCC2=CC=CN=C2N1 CS-0052759 [0,0,0,0,0,1|2,0,0]=3 168 B12R2.24 O=C1CCC2=CN=CC=C2N1 CS-0052760 [0,0,0,0,0,1|2,0,0]=3 169 B12R2.24 O=C1CNC2=NC=CC=C2N1 CS-0091720 [0,0,0,0,0,1|3,0,0]=4 170 B12R2.24 O=C1CSC2=CC=CC=C2N1 CS-0085251 [0,0,0,0,0,1|2,0,0]=3 171 B12R2.24 O=C1N=CC2=CC=CC=C2N1 CS-0085121 [0,0,0,0,0,1|1,0,1]=3 172 B12R2.1081 CC1=NC=NC2=CC=CC=C21 CS-0085114 [0,0,0,0,0,1|2,0,1]=4 173 B12R2.1081 CC1CNCC2=C1C=CC=C2 CS-0038270 [0,0,0,0,0,1|2,0,1]=4 174 B12R2.1081 CC1CNCC2=CC=CC=C21 CS-0036832 [0,0,0,0,0,1|2,0,1]=4 175 B12R2.1081 FC1=NC=NC2=CC=CC=C21 CS-0085126 [0,0,0,0,0,1|2,0,1]=4 176 B12R2.1081 NC1CCCC2=CC=CC=C21 CS-W007739 [0,0,0,0,0,1|2,0,1]=4 177 B12R2.1081 NC1COCC2=CC=CC=C21 CS-0018940 [0,0,0,0,0,1|1,0,1]=3 178 B12R2.1081 N[C@@H]1CCOC2=C1C=CC=C2 CS-0060637 [0,0,0,0,0,1|2,0,1]=4 179 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 CS-0005279 [0,0,0,0,0,1|2,0,1]=4 180 B12R2.1081 O=C1C=CNC2=C1C=CN=C2 CS-0052727 [0,0,0,0,0,1|2,0,1]=4 181 B12R2.1081 O=C1C=CNC2=CC=NC=C12 CS-0060296 [0,0,0,0,0,1|2,0,1]=4 182 B12R2.1081 O=C1C=COC2=CC=CC=C12 CS-W005942 [0,0,0,0,0,1|1,0,1]=3 183 B12R2.1081 O=C1C=CSC2=CC=CC=C12 CS-0081199 [0,0,0,0,0,1|1,0,1]=3 184 B12R2.1081 O=C1CCCC2=CN=CC=C12 CS-0060783 [0,0,0,0,0,1|2,0,0]=3 185 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS-W005292 [0,0,0,0,0,1|1,0,0]=2 186 B12R2.1081 O=C1NCCC2=C1N=CC=C2 CS-W019035 [0,0,0,0,0,1|2,0,0]=3 187 B12R2.1081 O=C1NN=CC2=C1C=CN=C2 CS-0106966 [0,0,0,0,0,1|2,0,1]=4 188 B12R2.1081 O=C1NN=CC2=C1C=NC=C2 CS-0106967 [0,0,0,0,0,1|2,0,1]=4 189 B12R2.1081 O=C1NN=NC2=CC=CC=C12 CS-0084775 [0,0,0,0,0,1|2,0,0]=3 190 B12R2.1081 O=C1OC=NC2=CC=CC=C12 CS-0046535 [0,0,0,0,0,1|0,0,1]=2 191 B12R2.1081 OB1OCCC2=CC=CC=C12 CS-0100855 [0,0,0,0,0,1|1,0,1]=3 192 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 CS-0088124 [0,0,0,0,0,1|2,0,1]=4 193 B12R2.1081 S=C1NC=NC2=C1C=CC=C2 CS-0084769 [0,0,0,0,0,1|1,1,1]=4 194 B12R2.1081 S=C1NN=CC2=C1C=CC=C2 CS-0090901 [0,0,0,0,0,1|1,1,1]=4 195 B9R1.6 C=C(C)C1=NC=CC=C1 CS-0059949 [1,0,1,0,0,0|2,0,0]=4 196 B9R1.6 CC(=O)C1=CC=NN=C1 CS-W018948 [1,0,1,0,0,0|2,0,0]=4 197 B9R1.6 O=C([O-])C1=CC=CC=C1 CS-0035271 [1,0,1,0,0,0|0,0,1]=3 198 B9R1.8 C#CCC1=CC=CC=C1 CS-0112571 [1,0,1,0,0,0|1,0,1]=4 199 B9R1.8 CNCC1=CC=CC=C1 CS-W007426 [1,0,1,0,0,0|1,0,1]=4 200 B9R1.15 C=CC1=CC=CC=C1C CS-0110436 [1,0,1,0,0,0|1,0,0]=3 201 B9R1.15 CC1=CN=CC=C1CO CS-0053354 [1,0,1,0,0,0|1,0,1]=4 202 B9R1.15 NC1=CC=CN=C1CO CS-0112972 [1,0,1,0,0,0|2,0,0]=4 203 B9R1.15 NCC1=CC=CC=C1O CS-0080161 [1,0,1,0,0,0|1,0,1]=4 204 B9R1.15 NCC1=CC=CC=C1O CS-D1655 [1,0,1,0,0,0|1,0,1]=4 205 B9R1.15 NCC1=CC=CNC1=O CS-0109597 [1,0,1,0,0,0|2,0,0]=4 206 B9R1.15 O=CC1=C(Br)C=CN=C1 CS-0050961 [1,0,1,0,0,0|2,0,0]=4 207 B9R1.15 O=CC1=C(Cl)C=CN=C1 CS-0018845 [1,0,1,0,0,0|2,0,0]=4 208 B9R1.15 OCC1=C(F)C=CN=C1 CS-0053199 [1,0,1,0,0,0|2,0,0]=4 209 B9R1.15 OCC1=CN=CC=C1Cl CS-0036917 [1,0,1,0,0,0|2,0,0]=4 210 B11R1.16 NCCC(=O)C1=CC=CC=C1 CS-0105553 [0,1,1,0,0,0|1,0,0]=3 211 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 CS-0096272 [0,1,1,0,0,0|2,0,0]=4 212 B11R1.22 COC(=O)C1=CN=C(C)C=N1 CS-0038852 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.22 COC(=O)C1=CN=C(C)N=C1 CS-0029749 [0,1,1,0,0,0|2,0,0]=4 214 B11R1.22 COC(=O)C1=CN=C(N)C=N1 CS-0049007 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.22 COC(=O)C1=NC=C(N)C=N1 CS-0049005 [0,1,1,0,0,0|2,0,0]=4 216 B11R1.22 COC(=O)C1=NC=C(N)C=N1 CS-0049006 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS-0100867 [0,1,1,0,0,0|2,0,0]=4 218 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS-W002314 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 CS-0060232 [0,1,1,0,0,0|2,0,0]=4 220 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 CS-B1075 [0,1,1,0,0,0|2,0,0]=4 221 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 CS-0062429 [0,1,1,0,0,0|2,0,0]=4 222 B11R1.23 CCC(=O)C1=NC=CC(Cl)=C1 CS-0061426 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 CS-0036168 [0,1,1,0,0,0|1,0,0]=3 224 B11R1.23 COC(=O)C1=CC(C)=CN=N1 CS-0048967 [0,1,1,0,0,0|2,0,0]=4 225 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 CS-0039014 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.23 COC(=O)C1=NC(C)=CC=N1 CS-0049026 [0,1,1,0,0,0|2,0,0]=4 227 B11R1.23 COC(=O)C1=NC=CC(I)=C1 CS-W006997 [0,1,1,0,0,0|1,0,0]=3 228 B11R1.23 COC(=O)C1=NC=NC(C)=C1 CS-0048923 [0,1,1,0,0,0|2,0,0]=4 229 B11R1.23 COC(=O)C1=NC=NC(N)=C1 CS-0048951 [0,1,1,0,0,0|2,0,0]=4 230 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 CS-0062065 [0,1,1,0,0,0|2,0,0]=4 231 B11R1.36 C=C(C1=CC=CC=C1)C(C)C CS-0037106 [0,1,1,0,0,0|2,0,0]=4 232 B11R1.222 CC1=CC=CC=C1C(=O)NN CS-0096270 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.222 CCC(=O)C1=C(Br)C=CC=C1 CS-0038403 [0,1,1,0,0,0|1,0,0]=3 234 B11R1.222 CCC(=O)C1=CC=CC=C1Cl CS-B1195 [0,1,1,0,0,0|1,0,0]=3 235 B11R1.222 CNC(=O)C1=NC=CC=C1C CS-0091298 [0,1,1,0,0,0|2,0,0]=4 236 B11R1.222 COC(=O)C1=C(C)C=NC=C1 CS-0049071 [0,1,1,0,0,0|1,0,0]=3 237 B11R1.222 COC(=O)C1=C(C)C=NN=C1 CS-0048966 [0,1,1,0,0,0|2,0,0]=4 238 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 CS-0107308 [0,1,1,0,0,0|1,0,0]=3 239 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 CS-0111580 [0,1,1,0,0,0|1,0,0]=3 240 B11R1.222 COC(=O)C1=CC=COC1=O CS-0091175 [0,1,1,0,0,0|1,0,0]=3 241 B11R1.222 COC(=O)C1=NC=CC=C1C CS-0037427 [0,1,1,0,0,0|1,0,0]=3 242 B11R1.222 COC(=O)C1=NC=CN=C1F CS-0049096 [0,1,1,0,0,0|2,0,0]=4 243 B11R1.222 N#CC(=O)C1=CC=CC=C1F CS-0108811 [0,1,1,0,0,0|2,0,0]=4 244 B11R1.222 O=C(NO)C1=CC=CC=C1Br CS-0108617 [0,1,1,0,0,0|2,0,0]=4 245 B11R1.1 C(C=O)=CC1=CC=C(Br)C=C1 CS-W015068 [0,1,1,0,0,0|1,0,1]=4 246 B11R1.1 O=CCCC1=CC=C(O)C=C1 CS-0001404 [0,1,1,0,0,0|1,0,0]=3 247 B11R1.24 CC1=CC(CCC=O)=CC=C1 CS-B1501 [0,1,1,0,0,0|1,0,0]=3 248 B11R1.24 O=C\C=C\C1=CC=CC(Cl)=C1 CS-0091222 [0,1,1,0,0,0|1,0,1]=4 249 B11R1.91 NC(=O)CCC1=CC=CC=C1 CS-0037177 [0,1,1,0,0,0|1,0,0]=3 250 B11R1.91 O=C(O)CCC1=CC=CC=N1 CS-0060616 [0,1,1,0,0,0|2,0,0]=4 251 B11R1.37 CC1=CC=C(C=O)C(C#N)=C1 CS-W021698 [0,1,1,0,0,0|1,0,1]=4 252 B11R1.37 COC1=CC(N)=CC=C1CO CS-0112710 [0,1,1,0,0,0|2,0,0]=4 253 B11R1.37 COC1=CC=C(I)C=C1C=O CS-0110027 [0,1,1,0,0,0|2,0,0]=4 254 B11R1.37 N#CC1=CC(N)=CC=C1CO CS-0100367 [0,1,1,0,0,0|1,0,1]=4 255 B11R1.41 COC1=CC=CC=C1CC=O CS-W021065 [0,1,1,0,0,0|2,0,0]=4 256 B11R1.41 N#CC1=CC=CC=C1CON CS-0080669 [0,1,1,0,0,0|1,0,1]=4 257 B11R1.41 OCCC1=CC=CC=C1CO CS-0099732 [0,1,1,0,0,0|0,0,2]=4 258 B11R1.53 C=CC1=CC=CC=C1B(O)O CS-W016344 [0,1,1,0,0,0|2,0,0]=4 259 B11R1.53 CCC1=NC=CC=C1C(=O)O CS-W019286 [0,1,1,0,0,0|2,0,0]=4 260 B11R1.53 CN(C)C1=CC=CC=C1C=O CS-0062404 [0,1,1,0,0,0|2,0,0]=4 261 B11R1.53 N#CC1=CC=CC=C1C(=O)O CS-0112283 [0,1,1,0,0,0|1,0,1]=4 262 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] CS-0100001 [0,1,1,0,0,0|2,0,0]=4 263 B11R1.53 NCC1=CC=CC=C1[N+](=O)[O-] CS-0108771 [0,1,1,0,0,0|2,0,0]=4 264 B11R1.53 O=C(O)C1=CC=CN=C1CO CS-0112632 [0,1,1,0,0,0|1,0,0]=3 265 B11R1.53 O=C(O)C1=NC=CC=C1CO CS-0112784 [0,1,1,0,0,0|1,0,0]=3 266 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 CS-0050845 [0,1,1,0,0,0|1,0,1]=4 267 B11R1.53 O=CC1=C(C(F)F)C=CN=C1 CS-0100045 [0,1,1,0,0,0|2,0,0]=4 268 B11R1.156 CC1=C(C(N)=O)C(Cl)=CC=C1 CS-0034828 [0,1,1,0,0,0|1,0,0]=3 269 B11R1.156 CC1=C([N+](=O)[O-])C(N)=CC=C1 CS-W021963 [0,1,1,0,0,0|1,0,1]=4 270 B11R1.156 CC1=NC=CC(C)=C1C(=O)O CS-0089820 [0,1,1,0,0,0|1,0,0]=3 271 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F CS-0040140 [0,1,1,0,0,0|2,0,0]=4 272 B11R1.156 O=C(O)C1=C(Br)N=CC=C1Cl CS-0107135 [0,1,1,0,0,0|2,0,0]=4 273 B11R1.159 CC(=O)C1=CC=CC(Br)=C1Cl CS-0105739 [0,1,1,0,0,0|2,0,0]=4 274 B11R1.159 CC(=O)C1=CC=CC(C)=C1N CS-0061143 [0,1,1,0,0,0|2,0,0]=4 275 B11R1.159 CC1=C(C(N)=O)C=CC=C1F CS-0061158 [0,1,1,0,0,0|1,0,0]=3 276 B11R1.159 NC(=O)C1=C(N)C(F)=CC=C1 CS-0062057 [0,1,1,0,0,0|2,0,0]=4 277 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 CS-0060697 [0,1,1,0,0,0|2,0,0]=4 278 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 CS-W005695 [0,1,1,0,0,0|1,0,0]=3 279 B11R1.159 O=C(O)C1=C(O)C(Cl)=NC=C1 CS-0112271 [0,1,1,0,0,0|2,0,0]=4 280 B11R1.159 O=C(O)C1=CC=CC(I)=C1Cl CS-0102026 [0,1,1,0,0,0|1,0,0]=3 281 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 CS-0038878 [0,1,1,0,0,0|2,0,0]=4 282 B11R1.166 CC(=O)C1=CC=C(O)C=C1N CS-0088238 [0,1,1,0,0,0|2,0,0]=4 283 B11R1.166 CC1=CC=C(C(N)=O)C(O)=C1 CS-0084853 [0,1,1,0,0,0|2,0,0]=4 284 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 CS-0051359 [0,1,1,0,0,0|2,0,0]=4 285 B11R1.166 NC(=O)C1=C(F)C=C(N)C=C1 CS-0038662 [0,1,1,0,0,0|2,0,0]=4 286 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1O CS-0037776 [0,1,1,0,0,0|2,0,0]=4 287 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 CS-W017641 [0,1,1,0,0,0|1,0,0]=3 288 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O CS-0051546 [0,1,1,0,0,0|2,0,0]=4 289 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O CS-W018949 [0,1,1,0,0,0|2,0,0]=4 290 B11R1.166 NC1=CC(F)=CN=C1C(=O)O CS-0051545 [0,1,1,0,0,0|2,0,0]=4 291 B11R1.166 NC1=CC=C(C(=O)O)C(Cl)=N1 CS-0100833 [0,1,1,0,0,0|2,0,0]=4 292 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 CS-0037965 [0,1,1,0,0,0|1,0,0]=3 293 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br CS-0022361 [0,1,1,0,0,0|2,0,0]=4 294 B11R1.166 O=C(O)C1=CC=C(I)C=C1O CS-0103689 [0,1,1,0,0,0|1,0,0]=3 295 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br CS-0060141 [0,1,1,0,0,0|2,0,0]=4 296 B11R1.166 O=C(O)C1=CN=C(O)C=C1O CS-0060146 [0,1,1,0,0,0|2,0,0]=4 297 B11R1.166 O=C(O)C1=NC=C(Br)C=C1O CS-0106543 [0,1,1,0,0,0|2,0,0]=4 298 B11R1.167 CC(=O)C1=C(C)C=CC(Cl)=C1 CS-0061174 [0,1,1,0,0,0|1,0,0]=3 299 B11R1.167 CC(=O)C1=C(F)C=CC(I)=C1 CS-0060839 [0,1,1,0,0,0|2,0,0]=4 300 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=N1 CS-W008654 [0,1,1,0,0,0|1,0,0]=3 301 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 CS-0050272 [0,1,1,0,0,0|1,0,0]=3 302 B11R1.167 CC1=C(C(C)O)C=C(Cl)C=C1 CS-0061175 [0,1,1,0,0,0|1,0,1]=4 303 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 CS-0061251 [0,1,1,0,0,0|2,0,0]=4 304 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 CS-0050683 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.167 CC1=CC=C(Br)C=C1C(N)=O CS-0061324 [0,1,1,0,0,0|1,0,0]=3 306 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 CS-0051542 [0,1,1,0,0,0|2,0,0]=4 307 B11R1.167 NC(=O)C1=CC(N)=CC=C1F CS-0046121 [0,1,1,0,0,0|2,0,0]=4 308 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=C1 CS-0051543 [0,1,1,0,0,0|2,0,0]=4 309 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=N1 CS-0083218 [0,1,1,0,0,0|2,0,0]=4 310 B11R1.167 NC1=CC=C(N)C(C(=O)O)=C1 CS-0113090 [0,1,1,0,0,0|1,0,0]=3 311 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 CS-0050688 [0,1,1,0,0,0|2,0,0]=4 312 B11R1.167 NC1=NC=C(F)C=C1C(=O)O CS-0052054 [0,1,1,0,0,0|2,0,0]=4 313 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 CS-W014777 [0,1,1,0,0,0|1,0,0]=3 314 B11R1.167 O=C(O)C1=C(Br)C=NC(Br)=C1 CS-D0434 [0,1,1,0,0,0|2,0,0]=4 315 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 CS-W016245 [0,1,1,0,0,0|1,0,0]=3 316 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S CS-0041775 [0,1,1,0,0,0|1,0,0]=3 317 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F CS-W000432 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O CS-W006688 [0,1,1,0,0,0|2,0,0]=4 319 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 CS-0053490 [1,1,0,0,0,0|2,0,0]=4 320 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 CS-0053438 [1,1,0,0,0,0|2,0,0]=4 321 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 CS-0088486 [1,1,0,0,0,0|2,0,0]=4 322 B11R2.36 BrC1=CC2=C(C=C1)C=NO2 CS-W005194 [1,1,0,0,0,0|2,0,0]=4 323 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 CS-W019162 [1,1,0,0,0,0|1,0,0]=3 324 B11R2.36 CC1=CC2=C(C=C1)C=NN2 CS-0045049 [1,1,0,0,0,0|2,0,0]=4 325 B11R2.36 CC1=CC=C2CCNC2=C1 CS-0061332 [1,1,0,0,0,0|2,0,0]=4 326 B11R2.36 ClC1=CC=C2OCCC2=C1 CS-0060211 [1,1,0,0,0,0|2,0,0]=4 327 B11R2.36 FC1=CC2=C(C=C1)COC2 CS-0094677 [1,1,0,0,0,0|0,0,1]=3 328 B11R2.36 FC1=CC2=NON=C2C=C1 CS-0086143 [1,1,0,0,0,0|2,0,0]=4 329 B11R2.36 NC1=CC2=C(C=C1)CCN2 CS-0105947 [1,1,0,0,0,0|2,0,0]=4 330 B11R2.36 NC1=CC2=C(C=C1)CNC2 CS-0092035 [1,1,0,0,0,0|1,0,1]=4 331 B11R2.36 NC1=CC=C2CCCC2=C1 CS-0088459 [1,1,0,0,0,0|1,0,1]=4 332 B11R2.36 NC1=CC=C2OCCC2=C1 CS-B1174 [1,1,0,0,0,0|2,0,0]=4 333 B11R2.36 OC1=CC2=C(C=C1)CNC2 CS-0055008 [1,1,0,0,0,0|1,0,1]=4 334 B11R2.36 OC1=CC2=C(C=CS2)C=C1 CS-0060429 [1,1,0,0,0,0|2,0,0]=4 335 B11R2.36 OC1=CC=C2OC=CC2=C1 CS-W004630 [1,1,0,0,0,0|2,0,0]=4 336 B11R2.36 OC1=CN=C2COCC2=C1 CS-0069881 [1,1,0,0,0,0|1,0,1]=4 337 B11R2.106 BrC1=CC=CC2=C1COC2 CS-0060666 [1,1,0,0,0,0|0,0,1]=3 338 B11R2.106 ClC1=C2C=COC2=CC=C1 CS-0096258 [1,1,0,0,0,0|2,0,0]=4 339 B11R2.106 ClC1=CC=CC2=C1CC=C2 CS-0082116 [1,1,0,0,0,0|1,0,0]=3 340 B11R2.106 ClC1=CC=CC2=C1NC=C2 CS-W020039 [1,1,0,0,0,0|2,0,0]=4 341 B11R2.106 ClC1=CC=CC2=C1SN=C2 CS-0093693 [1,1,0,0,0,0|2,0,0]=4 342 B11R2.106 FC1=C2C=CSC2=CC=C1 CS-0060379 [1,1,0,0,0,0|2,0,0]=4 343 B11R2.106 FC1=C2CCNC2=CC=C1 CS-0060380 [1,1,0,0,0,0|2,0,0]=4 344 B11R2.106 IC1=CC=CC2=C1NN=C2 CS-0050017 [1,1,0,0,0,0|2,0,0]=4 345 B11R2.106 NC1=CC=CC2=C1CCC2 CS-0069588 [1,1,0,0,0,0|1,0,1]=4 346 B11R2.106 NC1=CC=CC2=C1CCN2 CS-0105948 [1,1,0,0,0,0|2,0,0]=4 347 B11R2.106 NC1=CC=CC2=NON=C12 CS-0100989 [1,1,0,0,0,0|2,0,0]=4 348 B11R2.106 OC1=CC=CC2=C1C=CN2 CS-D1727 [1,1,0,0,0,0|2,0,0]=4 349 B11R2.60 CN1C=CC2=C1CCC2=O CS-0052472 [0,1,0,0,1,0|2,0,0]=4 350 B13R2.32 CN1C(=O)CNC2=C1C=CC=C2 CS-0102222 [0,1,0,0,0,1|2,0,0]=4 351 B13R2.57 O=CC1=NC2=CC=CC=C2C=N1 CS-0085133 [0,1,0,0,0,1|1,0,1]=4 352 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 CS-0043921 [0,1,0,0,0,1|2,0,0]=4 353 B13R2.155 CC1=CC=C2OCC(=O)NC2=C1 CS-0085207 [0,1,0,0,0,1|2,0,0]=4 354 B13R2.155 NC1=CC=C2CCC(=O)NC2=C1 CS-W018595 [0,1,0,0,0,1|1,0,0]=3 355 B13R2.155 NC1=CC=C2OCC(=O)NC2=C1 CS-0085219 [0,1,0,0,0,1|2,0,0]=4 356 B13R2.155 O=C1C=CC2=CC=C(Cl)C=C2O1 CS-0098292 [0,1,0,0,0,1|1,0,1]=4 357 B13R2.155 O=C1C=CC2=CC=C(F)C=C2N1 CS-0050033 [0,1,0,0,0,1|1,0,1]=4 358 B13R2.155 O=C1CC2=C(C=CC(O)=C2)CN1 CS-0080683 [0,1,0,0,0,1|1,0,0]=3 359 B13R2.155 O=C1CCC2=C(C=C(Br)C=N2)C1 CS-0102384 [0,1,0,0,0,1|2,0,0]=4 360 B13R2.155 O=C1CCC2=CC=C(Cl)C=C2N1 CS-W022535 [0,1,0,0,0,1|1,0,0]=3 361 B13R2.155 O=C1COC2=CC=C(Br)C=C2C1 CS-0100344 [0,1,0,0,0,1|2,0,0]=4 362 B13R2.155 O=C1COC2=CC=C(Cl)C=C2N1 CS-0085228 [0,1,0,0,0,1|2,0,0]=4 363 B13R2.155 O=C1COC2=CC=C(F)C=C2N1 CS-0088120 [0,1,0,0,0,1|2,0,0]=4 364 B13R2.155 O=C1COC2=CC=C(O)C=C2N1 CS-0085208 [0,1,0,0,0,1|2,0,0]=4 365 B13R2.155 O=C1CSC2=CC=C(Br)C=C2N1 CS-0100698 [0,1,0,0,0,1|2,0,0]=4 366 B13R2.162 CC1=CC=CC2=C1NC(=O)CC2 CS-0096484 [0,1,0,0,0,1|1,0,0]=3 367 B13R2.162 NC1=C2NC(=O)COC2=CC=C1 CS-0085226 [0,1,0,0,0,1|2,0,0]=4 368 B13R2.162 NC1=CC=CC2=C1NC(=O)CC2 CS-0102431 [0,1,0,0,0,1|1,0,0]=3 369 B13R2.162 O=C1C=CC2=CC=CC(Br)=C2N1 CS-0067354 [0,1,0,0,0,1|1,0,1]=4 370 B13R2.162 O=C1C=NC2=C(N1)C(Br)=CC=C2 CS-0036265 [0,1,0,0,0,1|2,0,0]=4 371 B13R2.162 O=C1CCC2=C(N1)C(F)=CC=C2 CS-0062061 [0,1,0,0,0,1|1,0,0]=3 372 B13R2.162 O=C1CCC2=C(N1)C(O)=CC=C2 CS-0102444 [0,1,0,0,0,1|1,0,0]=3 373 B13R2.162 O=C1COC2=CC=CC(O)=C2N1 CS-0085212 [0,1,0,0,0,1|2,0,0]=4 374 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 CS-0046639 [0,1,0,0,0,1|1,0,1]=4 375 B13R2.328 O=C1CC(=O)C2=C(C=CC=C2)N1 CS-0104588 [0,1,0,0,0,1|1,0,1]=4 376 B13R2.328 O=C1NC(=O)C2=CC=CC=C2S1 CS-0067861 [0,1,0,0,0,1|1,0,1]=4 377 B13R2.369 CC1NC2=CC=CC=C2NC1=O CS-0051283 [0,1,0,0,0,1|2,0,0]=4 378 B13R2.369 CC1SC2=CC=CC=C2NC1=O CS-0100720 [0,1,0,0,0,1|2,0,0]=4 379 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O CS-0099008 [0,1,0,0,0,1|1,0,1]=4 380 B13R2.369 O=C1NC2=CC=CC=C2CC1O CS-0060600 [0,1,0,0,0,1|1,0,0]=3 381 B13R2.369 O=C1NC2=CC=CC=C2N=C1Cl CS-0051425 [0,1,0,0,0,1|2,0,0]=4 382 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CC2 CS-0096486 [0,1,0,0,0,1|1,0,0]=3 383 B13R2.3683 CC1=CC=C2NC(=O)CSC2=C1 CS-0094323 [0,1,0,0,0,1|2,0,0]=4 384 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 CS-0085211 [0,1,0,0,0,1|2,0,0]=4 385 B13R2.3683 O=C1C=C2C=CC(Cl)=CC2=CN1 CS-0082149 [0,1,0,0,0,1|1,0,1]=4 386 B13R2.3683 O=C1CCC2=C(N=CC(F)=C2)N1 CS-0088354 [0,1,0,0,0,1|2,0,0]=4 387 B13R2.3683 O=C1COC2=CC(F)=CC=C2N1 CS-0085229 [0,1,0,0,0,1|2,0,0]=4 388 B13R2.3683 O=C1COC2=CC(O)=CC=C2N1 CS-0085209 [0,1,0,0,0,1|2,0,0]=4 389 B13R2.3683 O=C1CSC2=CC(Br)=CC=C2N1 CS-0094329 [0,1,0,0,0,1|2,0,0]=4 390 B13R2.3683 O=C1CSC2=CC(O)=CC=C2N1 CS-0099613 [0,1,0,0,0,1|2,0,0]=4 391 B13R2.5179 NC1=C2OCC(=O)NC2=CC=C1 CS-0085216 [0,1,0,0,0,1|2,0,0]=4 392 B13R2.5179 O=C1CC2=C(CN1)C(Br)=CC=C2 CS-0062216 [0,1,0,0,0,1|1,0,0]=3 393 B13R2.5179 O=C1CCC2=C(N=CC=C2F)N1 CS-0050492 [0,1,0,0,0,1|2,0,0]=4 394 B13R2.5179 O=C1COC2=C(Br)C=CC=C2N1 CS-0085232 [0,1,0,0,0,1|2,0,0]=4 395 B13R2.5179 O=C1COC2=C(O)C=CC=C2N1 CS-0088117 [0,1,0,0,0,1|2,0,0]=4 396 B13R2.5179 O=C1NC2=CC=CC(Br)=C2CO1 CS-0098276 [0,1,0,0,0,1|0,0,0]=2 397 B13R2.342 CC1=C2CCCC(=O)C2=CC=C1 CS-0061215 [0,1,0,0,0,1|1,0,0]=3 398 B13R2.342 CC1=C2N=NNC(=O)C2=CC=C1 CS-0083086 [0,1,0,0,0,1|2,0,0]=4 399 B13R2.342 CC1=C2SC=CC(=O)C2=CC=C1 CS-0081202 [0,1,0,0,0,1|1,0,1]=4 400 B13R2.342 NC1=CC=CC2=C1N=CNC2=O CS-0084856 [0,1,0,0,0,1|1,0,1]=4 401 B13R2.342 O=C1CCNC2=C1C=CC=C2O CS-0102407 [0,1,0,0,0,1|1,0,0]=3 402 B13R2.342 O=C1N=NNC2=C1C=CC=C2Cl CS-0087964 [0,1,0,0,0,1|2,0,0]=4 403 B13R2.371 O=C1CNC(=O)C2=CC=CC=C12 CS-0062217 [0,1,0,0,0,1|1,0,0]=3 404 B13R2.1613 O\N=C1/CCOC2=CC=CC=C21 CS-0047589 [0,1,0,0,0,1|1,0,1]=4 405 B13R2.3122 O=S1(=O)NCNC2=CC=CC=C21 CS-0079316 [0,1,0,0,0,1|2,0,0]=4 406 B13R2.4818 CC1=CC=CC2=C1C(=O)CCN2 CS-0037919 [0,1,0,0,0,1|1,0,0]=3 407 B13R2.4818 CC1=CC=CC2=C1C(=O)NC=N2 CS-0084754 [0,1,0,0,0,1|1,0,1]=4 408 B13R2.4818 CC1=CC=NC2=C1C(=O)CCN2 CS-0036016 [0,1,0,0,0,1|2,0,0]=4 409 B13R2.4818 NC1=CC=CC2=C1C(=O)NC=N2 CS-0084854 [0,1,0,0,0,1|1,0,1]=4 410 B13R2.4818 O=C1CCCC2=C1C(Cl)=CC=C2 CS-0060624 [0,1,0,0,0,1|1,0,0]=3 411 B13R2.4818 O=C1CCCC2=C1C(O)=CC=C2 CS-0113178 [0,1,0,0,0,1|1,0,0]=3 412 B13R2.4818 O=C1CCOC2=C1C(Cl)=CC=C2 CS-0061695 [0,1,0,0,0,1|1,0,0]=3 413 B13R2.4818 O=C1NC=CC2=C1C(Cl)=CC=C2 CS-0104708 [0,1,0,0,0,1|1,0,1]=4 414 B13R2.4818 O=C1NN=CC2=C1C(Cl)=CC=C2 CS-0112569 [0,1,0,0,0,1|1,0,1]=4 415 B13R2.4818 O=C1NN=NC2=CC=CC(Cl)=C12 CS-0083083 [0,1,0,0,0,1|2,0,0]=4 416 B13R2.4818 O=C1NN=NC2=CC=CC(F)=C12 CS-0083080 [0,1,0,0,0,1|2,0,0]=4 417 B13R2.9 O=CC1=CNC2=C1C=CC=C2Cl CS-W006403 [0,2,0,0,0,0|2,0,0]=4 418 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 CS-0038171 [0,2,0,0,0,0|1,0,0]=3 419 B13R2.72 O=C(O)C1=C2C=CC=CC2=NS1 CS-0100832 [0,2,0,0,0,0|1,1,0]=4 420 B13R2.72 O=C(O)C1NCC2=C1C=CC=C2 CS-0113082 [0,2,0,0,0,0|1,0,1]=4 421 B13R2.2136 CC1=CC2=C(C=C1)CC\C2=N\O CS-0035881 [0,2,0,0,0,0|1,0,1]=4 422 B13R2.2136 CC1=CC2=C(C=C1)NC=C2C=O CS-W022408 [0,2,0,0,0,0|2,0,0]=4 423 B13R2.2136 CC1=CC2=C(C=C1)NN=C2C=O CS-0085361 [0,2,0,0,0,0|2,0,0]=4 424 B13R2.2931 NCC1OB(O)C2=CC=CC=C21 CS-0093703 [0,2,0,0,0,0|1,0,1]=4 425 B13R2.3028 CN1CC2=C(C=C(N)C=C2)C1=O CS-0050345 [0,2,0,0,0,0|1,0,0]=3 426 B13R2.4825 CC1CC2=C(C=CC=C2Cl)C1=O CS-0100703 [0,2,0,0,0,0|1,0,0]=3 427 B13R2.4825 CN1CC2=C(Br)C=CC=C2C1=O CS-0038551 [0,2,0,0,0,0|1,0,0]=3 428 B13R2.4825 CN1CC2=C(C=CN=C2Cl)C1=O CS-0095900 [0,2,0,0,0,0|2,0,0]=4 429 B13R2.4825 CN1CC2=C(N)C=CC=C2C1=O CS-0051050 [0,2,0,0,0,0|1,0,0]=3 430 B13R2.4825 O=C1NC2=C(C=CC=C2I)C1=O CS-0060628 [0,2,0,0,0,0|2,0,0]=4 431 B13R2.4856 CC1=CC=CC2=C1C(=O)C(=O)N2 CS-0088455 [0,2,0,0,0,0|2,0,0]=4 432 B13R2.4856 CN1CC2=CC=CC(N)=C2C1=O CS-0050114 [0,2,0,0,0,0|1,0,0]=3 433 B13R2.4856 O=C1NC2=CC=CC(I)=C2C1=O CS-0108793 [0,2,0,0,0,0|2,0,0]=4 434 B13R2.5190 CN1CC2=C(C=CC(N)=C2)C1=O CS-0050685 [0,2,0,0,0,0|1,0,0]=3 435 B13R2.669 C=CC1=CC=C2COB(O)C2=C1 CS-0079303 [0,2,0,0,0,0|1,0,1]=4 436 B13R2.669 COC1=CC=C2COB(O)C2=C1 CS-0078615 [0,2,0,0,0,0|1,0,1]=4 437 B13R2.669 N#CC1=CC=C2COB(O)C2=C1 CS-0078617 [0,2,0,0,0,0|1,0,1]=4 438 B13R2.669 O=CC1=CC=C2COB(O)C2=C1 CS-0079304 [0,2,0,0,0,0|1,0,1]=4 439 B13R2.669 OCC1=CC=C2COB(O)C2=C1 CS-0079301 [0,2,0,0,0,0|1,0,1]=4 440 B13R2.3742 O=C1COC2=C(F)C=C(Br)C=C12 CS-0091972 [0,2,0,0,0,0|2,0,0]=4 441 B13R2.3790 CC1=C2C(=O)CCC2=CC=C1Cl CS-0035762 [0,2,0,0,0,0|1,0,0]=3 442 B13R2.5187 CC1NC(=O)C2=CC(Br)=CC=C21 CS-0058509 [0,2,0,0,0,0|1,0,0]=3 443 B13R2.5187 CC1NC(=O)C2=CC(F)=CC=C21 CS-0058510 [0,2,0,0,0,0|1,0,0]=3 444 B13R2.5187 CC1NC(=O)C2=CC=C(Cl)C=C21 CS-0058507 [0,2,0,0,0,0|1,0,0]=3 445 B13R2.5187 O=C1N=C(O)C2=C1C=C(O)C=C2 CS-W006520 [0,2,0,0,0,0|1,0,1]=4 446 B13R2.11634 CC1=C(Cl)N=C2CNC(=O)C2=C1 CS-0069872 [0,2,0,0,0,0|2,0,0]=4 447 B13R2.11634 CC1=CC2=C(C=C1Br)CCC2=O CS-0036005 [0,2,0,0,0,0|1,0,0]=3 448 B13R2.11634 O=C1CCC2=C1C=C(O)C(O)=C2 CS-B1192 [0,2,0,0,0,0|1,0,0]=3 449 B13R2.573 COC1=CC=CC2=C1COC2=O CS-0094318 [0,2,0,0,0,0|0,0,0]=2 450 B13R2.4857 NC1=CC=CC2=C1C(=O)OC2=O CS-0060629 [0,2,0,0,0,0|0,0,1]=3 451 B13R2.5151 NC1=CC=C(Br)C2=C1C(=O)NC2 CS-0107286 [0,2,0,0,0,0|1,0,0]=3 452 B13R2.5151 O=C1CCC2=C1C(Br)=CC=C2Cl CS-0060078 [0,2,0,0,0,0|1,0,0]=3 453 B13R2.5151 O=C1CCC2=C1C(S)=CC=C2F CS-0099882 [0,2,0,0,0,0|1,0,0]=3 454 B13R2.5180 CC1=C2CCC(=O)C2=CC=C1Br CS-0036004 [0,2,0,0,0,0|1,0,0]=3 455 B13R2.5180 CC1=C2COC(=O)C2=CC=C1Br CS-0058102 [0,2,0,0,0,0|0,0,0]=2 456 B13R2.5180 CC1=CC=C2C(=O)NCC2=C1N CS-0038435 [0,2,0,0,0,0|1,0,0]=3 457 B13R2.5180 O=C1CCC2=C(F)C(Cl)=CC=C12 CS-0060294 [0,2,0,0,0,0|1,0,0]=3 458 B13R2.5180 O=C1CCC2=C1C=CC(F)=C2F CS-W009081 [0,2,0,0,0,0|1,0,0]=3 459 B13R2.582 C=CC1=C2B(O)OCC2=CC=C1 CS-0092849 [0,2,0,0,0,0|1,0,1]=4 460 B13R2.582 O=CC1=C2B(O)OCC2=CC=C1 CS-0100851 [0,2,0,0,0,0|1,0,1]=4 461 B13R2.11642 CC1=CC(C)=C2C(=O)CCC2=C1 CS-0061253 [0,2,0,0,0,0|1,0,0]=3 462 B13R2.11642 O=C1COC2=CC(O)=CC(O)=C12 CS-0060207 [0,2,0,0,0,0|2,0,0]=4 463 B13R2.2130 COC1=CC=C2B(O)OCC2=C1 CS-0078596 [0,2,0,0,0,0|1,0,1]=4 464 B13R2.2130 COC1=CC=C2C(=O)OCC2=C1 CS-0036954 [0,2,0,0,0,0|0,0,0]=2 465 B13R2.2130 N#CC1=CC=C2B(O)OCC2=C1 CS-0100853 [0,2,0,0,0,0|1,0,1]=4 466 B13R2.2130 NCC1=CC=C2B(O)OCC2=C1 CS-0093698 [0,2,0,0,0,0|1,0,1]=4 467 B13R2.2130 OCC1=CC=C2B(O)OCC2=C1 CS-0079302 [0,2,0,0,0,0|1,0,1]=4 468 B13R2.3108 CC1(C)OCC2=C1C=CC(N)=C2 CS-0104529 [0,2,0,0,0,0|1,0,1]=4 469 B13R2.3108 O=S1(=O)CCC2=CC(O)=CC=C21 CS-0096948 [0,2,0,0,0,0|2,0,0]=4 470 B13R2.12159 CC1(C)NC(=O)C2=CC=CC=C21 CS-0051620 [0,2,0,0,0,0|1,0,0]=3 471 B9R0.46 C=COCCOC(=O)C=C CS-0106275 [0,0,2,0,0,0|1,0,1]=4 472 B11R2.20 C1=CC=C2CONCC2=C1 CS-0079743 [0,0,1,1,0,0|2,0,0]=4 473 B9R1.11 COC(=O)C1=CC=CS1 CS-0038500 [0,0,1,0,1,0|1,0,0]=3 474 B9R1.41 CC1=C(C(=O)O)ON=C1 CS-0085284 [0,0,1,0,1,0|2,0,0]=4 475 B9R1.41 NC1=C(C(=O)O)C=CO1 CS-0112432 [0,0,1,0,1,0|2,0,0]=4 476 B9R1.41 NC1=C(C(=O)O)C=CS1 CS-0060720 [0,0,1,0,1,0|2,0,0]=4 477 B9R1.41 O=C(O)C1=C(O)C=CS1 CS-0096798 [0,0,1,0,1,0|2,0,0]=4 478 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 CS-0084722 [0,0,1,0,0,1|2,0,0]=4 479 B11R1.86 CC(=O)NC1=CC=CC=C1Br CS-0089804 [0,0,1,0,0,1|2,0,0]=4 480 B11R1.86 CC(=O)NC1=NC=CC=C1C CS-0092042 [0,0,1,0,0,1|2,0,0]=4 481 B11R1.86 O=C(O)CC1=NC=CC=C1Br CS-0052285 [0,0,1,0,0,1|2,0,0]=4 482 B11R1.86 O=C(O)CC1=NC=CC=C1O CS-0052280 [0,0,1,0,0,1|2,0,0]=4 483 B13R2.33 O=C1CNC2=CC=CC=C2CN1 CS-0067386 [0,0,0,0,0,2|1,0,0]=3 484 B13R2.163 O=C1CNCC2=CC=CC=C2N1 CS-0067387 [0,0,0,0,0,2|1,0,0]=3 485 B13R2.5252 O=C1CCCOC2=CC=CC=C12 CS-0006412 [0,0,0,0,0,2|1,0,0]=3