0 B10R1.21 CCNCCN1C=CN=C1 AMY9025 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.21 CNCCCN1C=CN=C1 AM805930 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.21 OCCNCC1=CN=CS1 AM91912 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.21 OCCNCC1=CSC=C1 AM101510 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.12 CCCCC1=CCC=C1 AMY2875 [1,0,0,0,0,0|1,0,1]=3 5 B9R1.12 CCCCC1=NC=CN1 AM20100246 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.12 CCCCC1=NN=CO1 AM20120369 [1,0,0,0,0,0|2,1,0]=4 7 B9R1.12 CNCCC1=CC=CS1 AMY21331 [1,0,0,0,0,0|1,0,0]=2 8 B9R1.12 NCCSC1=CC=CS1 AM100980 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.12 OCCSC1=CC=CS1 AM100947 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.4 CCCCCCC1=CSC=C1 AM84585 [0,1,0,0,0,0|2,0,0]=3 11 B11R1.25 COC(=O)CCC1=CC=CN1 AM62723 [0,1,0,0,0,0|2,0,1]=4 12 B11R1.27 OCCNCC1=CN=C(Cl)S1 AM91488 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.29 CNCCC(=O)C1=CC=CS1 AM101117 [0,1,0,0,0,0|1,0,1]=3 14 B11R1.29 CNCC[C@H](O)C1=CC=CS1 AMY18525 [0,1,0,0,0,0|1,0,0]=2 15 B11R1.29 C[C@H](NCCO)C1=NC=CS1 AM91132 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.29 O=C(CCCCl)C1=CC=CS1 AMY32213 [0,1,0,0,0,0|1,0,1]=3 17 B11R1.30 CN(CCN)CC1=CC=CO1 AM101215 [0,1,0,0,0,0|2,1,0]=4 18 B11R1.30 CN(CCN)CC1=CN=CS1 AM94652 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.30 CN(CCO)CC1=CC=CO1 AM100367 [0,1,0,0,0,0|2,1,0]=4 20 B11R1.30 CN(CCO)CC1=CN=CS1 AM93213 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.30 N[C@@H](CCO)CC1=CSC=C1 AM98453 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.30 OCC[C@H](O)CC1=CSC=C1 AM99482 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.180 CC1=C(CNCCO)SC=C1 AM101418 [0,1,0,0,0,0|2,0,0]=3 24 B11R2.2 C1=CSC(C2OCCO2)=C1 AMY27143 [0,0,0,1,0,0|2,0,0]=3 25 B11R2.2 C1=CSC(N2CCCC2)=N1 AM87030 [0,0,0,1,0,0|2,0,0]=3 26 B11R2.2 C1=NNC(C2CCCC2)=C1 AMY5085 [0,0,0,1,0,0|2,0,0]=3 27 B11R2.2 C1=NNC=C1C2CCCC2 AMY11939 [0,0,0,1,0,0|3,0,0]=4 28 B11R2.18 C1=CC2=C(CNCCC2)S1 AMY23539 [0,0,0,1,0,0|1,0,0]=2 29 B11R2.18 C1=CN2CCNCCC2=N1 AM804566 [0,0,0,1,0,0|3,0,0]=4 30 B11R2.106 C[C@@H]1NCCN2C=CC=C12 AM20100709 [0,0,0,1,0,0|3,0,0]=4 31 B11R2.106 O=C1CCCC2=C1C=CN2 AM803187 [0,0,0,1,0,0|2,0,1]=4 32 B11R2.106 O=C1CCCC2=C1C=CO2 AM20090009 [0,0,0,1,0,0|1,1,1]=4 33 B11R2.106 O=C1CCCC2=C1C=CS2 AM9876 [0,0,0,1,0,0|1,0,1]=3 34 B11R2.106 O[C@H]1CCCC2=C1C=CO2 AM20110205 [0,0,0,1,0,0|1,1,0]=3 35 B11R2.191 OC[C@H]1CCC2=NC=CN21 AM806448 [0,0,0,1,0,0|3,0,0]=4 36 B11R2.385 C1=COC(CNC2CC2)=C1 AM101328 [0,0,0,1,0,0|1,1,0]=3 37 B11R2.385 C1=NC=C(CNC2CC2)S1 AM101602 [0,0,0,1,0,0|2,0,0]=3 38 B11R1.28 BrCCCCC1=CC=CC=C1 AMY28672 [0,0,0,0,0,1|2,0,0]=3 39 B11R1.28 BrCCCOC1=CC=CC=C1 AM20060682 [0,0,0,0,0,1|3,0,0]=4 40 B11R1.28 BrCCCOC1=CN=CC=C1 AM86222 [0,0,0,0,0,1|3,0,0]=4 41 B11R1.28 BrCCOCC1=CC=CC=C1 AM86611 [0,0,0,0,0,1|3,0,0]=4 42 B11R1.28 ClCCOCC1=CC=CC=C1 AMY10010 [0,0,0,0,0,1|3,0,0]=4 43 B11R1.28 ICCOCC1=CC=CC=C1 AMY37651 [0,0,0,0,0,1|3,0,0]=4 44 B11R1.28 N#CCCCC1=CC=CC=C1 AMY3893 [0,0,0,0,0,1|2,0,1]=4 45 B11R1.28 NCCCOC1=CC=CC=C1 AMY4758 [0,0,0,0,0,1|3,0,0]=4 46 B11R1.28 NCCNCC1=CC=CC=C1 AM807114 [0,0,0,0,0,1|3,0,0]=4 47 B11R1.28 NCCOCC1=CC=CC=C1 AM20060431 [0,0,0,0,0,1|3,0,0]=4 48 B11R1.28 NCCOCC1=CC=CC=C1 AMY9281 [0,0,0,0,0,1|3,0,0]=4 49 B11R1.28 OCCCCC1=CC=CC=C1 AM20040203 [0,0,0,0,0,1|2,0,0]=3 50 B11R1.28 OCCCCC1=CN=CC=C1 AMY9009 [0,0,0,0,0,1|2,0,0]=3 51 B11R1.28 OCCCCC1=NC=CC=C1 AMY2408 [0,0,0,0,0,1|2,0,0]=3 52 B11R1.28 OCCCNC1=NC=CC=C1 AM20050914 [0,0,0,0,0,1|3,0,0]=4 53 B11R1.28 OCCCOC1=CC=CC=C1 AM20040871 [0,0,0,0,0,1|3,0,0]=4 54 B11R1.28 OCCNCC1=CC=CC=C1 AM86241 [0,0,0,0,0,1|3,0,0]=4 55 B11R1.28 OCCNCC1=CC=NC=C1 AM101163 [0,0,0,0,0,1|3,0,0]=4 56 B11R1.28 OCCNCC1=CN=CC=C1 AM101164 [0,0,0,0,0,1|3,0,0]=4 57 B11R1.28 OCCNCC1=NC=CC=C1 AM101110 [0,0,0,0,0,1|3,0,0]=4 58 B11R1.28 OCCNCC1=NC=CN=C1 AM100471 [0,0,0,0,0,1|3,0,0]=4 59 B11R1.28 OCCOCC1=CC=CC=C1 AM20040881 [0,0,0,0,0,1|3,0,0]=4 60 B8R1.8 CCCC1=NC=CN1 AM20100251 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.8 CCCC1=NNC=C1 AMY6454 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.8 CNCC1=CC=CS1 AM20100421 [2,0,0,0,0,0|1,0,0]=3 63 B8R1.8 CNCC1=CN=CS1 AM10485 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.8 CNCC1=CN=CS1 AM803037 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.8 N#CCC1=CC=CS1 AMY23238 [2,0,0,0,0,0|1,0,1]=4 66 B8R1.8 NCCC1=CC=CN1 AMY32066 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.8 NCCC1=CC=CO1 AM20080071 [2,0,0,0,0,0|1,1,0]=4 68 B8R1.8 NCCC1=CC=CS1 AM803664 [2,0,0,0,0,0|1,0,0]=3 69 B8R1.8 OCCC1=CC=CS1 AM82007 [2,0,0,0,0,0|1,0,0]=3 70 B10R0.71 C=C\C=C\CCCCCCO AMY32027 [0,1,1,0,0,0|1,0,1]=4 71 B10R1.11 CNCC(=O)C1=CC=CS1 AM101645 [1,1,0,0,0,0|1,0,1]=4 72 B10R1.11 CSCC(=O)C1=CC=CS1 AM20100098 [1,1,0,0,0,0|1,0,1]=4 73 B10R1.11 N[C@@H](CCO)C1=CC=CS1 AM101138 [1,1,0,0,0,0|1,0,0]=3 74 B10R1.11 O=C(CCCl)C1=CC=CS1 AMY31394 [1,1,0,0,0,0|1,0,1]=4 75 B10R1.11 OCC[C@H](O)C1=CC=CS1 AM90636 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.11 O[C@@H](CCCl)C1=CC=CS1 AM20080694 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.16 CCCCC1=NN=C(N)S1 AMY3830 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.16 CCNCC1=CN=C(Cl)S1 AM91113 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.16 CCOCC1=CN=C(Cl)S1 AM91124 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.66 CC(C)NCC1=CC=CO1 AM100322 [1,1,0,0,0,0|1,1,0]=4 81 B10R1.66 CC(C)NCC1=CN=CS1 AM101605 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.66 CC(C)NCC1=CN=CS1 AM98022 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.66 O=C(O)CCC1=CC=CS1 AMY37950 [1,1,0,0,0,0|1,0,1]=4 84 B12R1.1 CCCCCC1=CC=C(Br)C=C1 AMY8640 [0,1,0,0,0,1|1,0,0]=3 85 B12R1.1 CCCCOC1=CC=C(O)C=C1 AMY8990 [0,1,0,0,0,1|2,0,0]=4 86 B12R1.1 CNCCCC1=CC=C(Br)C=C1 AM87374 [0,1,0,0,0,1|2,0,0]=4 87 B12R1.1 FC1=CC=C(CCCCCl)C=C1 AM83059 [0,1,0,0,0,1|2,0,0]=4 88 B12R1.1 NCCCCC1=CC=C(O)C=C1 AMY14336 [0,1,0,0,0,1|2,0,0]=4 89 B12R1.8 BrCCCOCC1=CC=CC=C1 AM20060664 [0,1,0,0,0,1|2,0,0]=4 90 B12R1.8 CNCCCOC1=CC=CC=C1 AM807189 [0,1,0,0,0,1|2,0,0]=4 91 B12R1.28 CCCCCC1=CC=CC(O)=C1 AMY27384 [0,1,0,0,0,1|1,0,0]=3 92 B12R1.30 CCCCC(=O)C1=CC=CC=C1 AM20020075 [0,1,0,0,0,1|1,0,1]=4 93 B12R1.30 OCCC[C@H](O)C1=CC=CC=C1 AM10014 [0,1,0,0,0,1|2,0,0]=4 94 B12R1.32 CCCC(=O)CC1=CC=CC=C1 AMY23646 [0,1,0,0,0,1|1,0,1]=4 95 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 AMY19224 [0,1,0,0,0,1|2,0,0]=4 96 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 AMY37532 [0,1,0,0,0,1|2,0,0]=4 97 B12R1.35 O=C(CNCCO)C1=CC=CS1 AM91190 [0,2,0,0,0,0|1,0,1]=4 98 B12R1.51 CCOC(=O)CSC1=CC=CS1 AM101319 [0,2,0,0,0,0|1,0,1]=4 99 B12R1.372 CCCCCCC1=C(Br)SC=C1 AM20100644 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.15 COC(=O)C[C@H](O)C1=CC=CS1 AM100284 [0,2,0,0,0,0|1,0,1]=4 101 B12R1.54 CC(C)NCC(=O)C1=CC=CS1 AM101280 [0,2,0,0,0,0|1,0,1]=4 102 B12R1.54 CN(C)CCC(=O)C1=CC=CS1 AMY8711 [0,2,0,0,0,0|1,0,1]=4 103 B12R1.54 CN(C)CC[C@H](O)C1=CC=CS1 AMY22671 [0,2,0,0,0,0|1,0,0]=3 104 B12R1.54 CN(C)CC[C@H](O)C1=CC=CS1 AMY22764 [0,2,0,0,0,0|1,0,0]=3 105 B12R1.55 CCC[C@H](Br)C(=O)C1=CC=CS1 AMY39929 [0,2,0,0,0,0|0,0,1]=3 106 B12R1.318 CC1=C(CN(C)CCN)SC=C1 AM91426 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.318 CC1=C(CN(C)CCO)SC=C1 AM93608 [0,2,0,0,0,0|2,0,0]=4 108 B10R2.7 C1=CC2=C(CCNC2)S1 AM20090376 [1,0,0,1,0,0|1,0,0]=3 109 B10R2.7 C1=CC2=C(CCNC2)S1 AM20090735 [1,0,0,1,0,0|1,0,0]=3 110 B10R2.7 C1=CC2=C(CNCC2)S1 AMY15210 [1,0,0,1,0,0|1,0,0]=3 111 B10R2.7 C1=CN2CCCCC2=N1 AM90258 [1,0,0,1,0,0|2,0,0]=4 112 B10R2.7 C1=CN2CCNCC2=C1 AMY21418 [1,0,0,1,0,0|2,0,0]=4 113 B10R2.7 C1=NNC2=C1CCCC2 AM85312 [1,0,0,1,0,0|2,0,0]=4 114 B10R2.32 O=C1CCC2=C1C=CS2 AM20100390 [1,0,0,1,0,0|1,0,1]=4 115 B10R2.193 C1=CN(CC2CC2)N=C1 AM90042 [1,0,0,1,0,0|2,0,0]=4 116 B12R2.1 NC[C@H]1CCC2=C1C=CC=C2 AM20040696 [0,0,0,1,0,1|2,0,0]=4 117 B12R2.2 C1=CC(N2CCCC2)=CC=N1 AM20050997 [0,0,0,1,0,1|2,0,0]=4 118 B12R2.2 C1=CC([C@@H]2CCCN2)=CC=N1 AMY5558 [0,0,0,1,0,1|2,0,0]=4 119 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 AM20050516 [0,0,0,1,0,1|2,0,0]=4 120 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 AM9376 [0,0,0,1,0,1|2,0,0]=4 121 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 AM9385 [0,0,0,1,0,1|2,0,0]=4 122 B12R2.2 C1=CC=C([C@@H]2CCCO2)C=C1 AM20030084 [0,0,0,1,0,1|2,0,0]=4 123 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 AMY34424 [0,0,0,1,0,1|2,0,0]=4 124 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 AMY4366 [0,0,0,1,0,1|2,0,0]=4 125 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AM20080739 [0,0,0,1,0,1|2,0,0]=4 126 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AMY14405 [0,0,0,1,0,1|2,0,0]=4 127 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 AMY40580 [0,0,0,1,0,1|2,0,0]=4 128 B12R2.2 C1=CC=C([C@H]2CCOC2)C=C1 AM20030124 [0,0,0,1,0,1|2,0,0]=4 129 B12R2.2 C1=CN=C(N2CCCC2)C=C1 AM87056 [0,0,0,1,0,1|2,0,0]=4 130 B12R2.2 C1=CN=CC([C@@H]2CCCN2)=C1 AM20061865 [0,0,0,1,0,1|2,0,0]=4 131 B12R2.41 C1=CC2=C(C=C1)CCNCC2 AMY22742 [0,0,0,1,0,1|2,0,0]=4 132 B12R2.41 C1=CC2=C(C=C1)CCNCC2 AMY27290 [0,0,0,1,0,1|2,0,0]=4 133 B12R2.41 C1=CC2=C(C=C1)CNCCC2 AMY21062 [0,0,0,1,0,1|2,0,0]=4 134 B12R2.41 C1=CC2=C(C=C1)CNCCC2 AMY22927 [0,0,0,1,0,1|2,0,0]=4 135 B12R2.41 C1=CC2=C(C=C1)NCCCC2 AM20050541 [0,0,0,1,0,1|2,0,0]=4 136 B12R2.1081 Br[C@H]1CCCC2=C1C=CC=C2 AMY6140 [0,0,0,1,0,1|2,0,0]=4 137 B12R2.1081 C[C@@H]1NCCC2=C1C=CC=C2 AM803958 [0,0,0,1,0,1|2,0,0]=4 138 B12R2.1081 C[C@H]1CCNC2=C1C=CC=C2 AM803444 [0,0,0,1,0,1|2,0,0]=4 139 B12R2.1081 C[C@H]1CNCC2=C1C=CC=C2 AM802926 [0,0,0,1,0,1|2,0,0]=4 140 B12R2.1081 I[C@H]1CCCC2=C1C=CC=C2 AMY6142 [0,0,0,1,0,1|2,0,0]=4 141 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 AM20060563 [0,0,0,1,0,1|2,0,0]=4 142 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 AM20060829 [0,0,0,1,0,1|2,0,0]=4 143 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 AM62763 [0,0,0,1,0,1|2,0,0]=4 144 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 AM62765 [0,0,0,1,0,1|2,0,0]=4 145 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 AM62766 [0,0,0,1,0,1|2,0,0]=4 146 B12R2.1081 N[C@H]1CCCC2=C1C=CN=C2 AMY32592 [0,0,0,1,0,1|2,0,0]=4 147 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 AM9304 [0,0,0,1,0,1|2,0,0]=4 148 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 AMY13712 [0,0,0,1,0,1|2,0,0]=4 149 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 AMY13785 [0,0,0,1,0,1|2,0,0]=4 150 B12R2.1081 N[C@H]1CCCC2=NC=CC=C21 AMY33882 [0,0,0,1,0,1|2,0,0]=4 151 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 AMY5940 [0,0,0,1,0,1|2,0,0]=4 152 B12R2.1081 O[C@H]1CCCC2=CC=CN=C21 AM803224 [0,0,0,1,0,1|2,0,0]=4 153 B12R2.2057 C1=CC(CNC2CC2)=CC=N1 AM90766 [0,0,0,1,0,1|2,0,0]=4 154 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 AM91881 [0,0,0,1,0,1|2,0,0]=4 155 B12R2.2057 C1=CN=C(CNC2CC2)C=C1 AM100863 [0,0,0,1,0,1|2,0,0]=4 156 B12R2.2057 C1=CN=C(CNC2CC2)C=N1 AM90614 [0,0,0,1,0,1|2,0,0]=4 157 B12R2.2057 C1=CN=CC(CNC2CC2)=C1 AM90768 [0,0,0,1,0,1|2,0,0]=4 158 B12R2.229 F[C@H]1CCNCC2=C1SC=C2 AM806238 [0,1,0,1,0,0|1,0,0]=3 159 B12R2.6 BrC1=CN=C(N2CCCC2)S1 AM87449 [0,1,0,1,0,0|2,0,0]=4 160 B12R2.6 NC1=CC(C2CCCC2)=NN1 AMY21501 [0,1,0,1,0,0|2,0,0]=4 161 B12R2.6 NC1=CC(C2CCCC2)=NO1 AM806378 [0,1,0,1,0,0|2,0,0]=4 162 B12R2.2298 ClC1=NC=C(CNC2CC2)S1 AM91611 [0,1,0,1,0,0|2,0,0]=4 163 B12R2.2298 ClC1=NC=C(CNC2CC2)S1 AM93415 [0,1,0,1,0,0|2,0,0]=4 164 B12R2.2074 C[C@H](NC1CC1)C2=NC=CS2 AM91133 [0,1,0,1,0,0|2,0,0]=4