0 B8R0.8 C=C(C)C(=O)OCCN SY063537 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.8 CCCCC(N)C(=O)O SY038236 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.8 CCCC[C@@H](N)C(=O)O SY062052 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.8 CCCC[C@H](N)C(=O)O SY036145 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.8 CSCC[C@@H](N)C(=O)O SY004418 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.8 NCCCC(N)C(=O)O SY005810 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.8 NCCC[C@@H](N)C(=O)O SY007936 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.8 NCCC[C@H](N)C(=O)O SY005520 [0,0,0,0,0,0|3,0,1]=4 8 B8R0.8 NCCC[C@H](N)C(=O)O SY066991 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.8 N[C@@H](CCCO)C(=O)O SY269711 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.3 C#CCCC(=O)OC SY057491 [1,0,0,0,0,0|1,0,2]=4 11 B7R0.3 C=CC(=O)NCCN SY032050 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.3 C=CC(=O)OCCCl SY226312 [1,0,0,0,0,0|2,0,1]=4 13 B7R0.3 CCC(=O)OCCO SY301488 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.3 CCCCC(=O)NN SY078868 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.3 CCCCN(C)CC SY311327 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.3 CNC(=O)CCCO SY126228 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.3 CNCCC(=O)NC SY029107 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.3 CNCCC(=O)OC SY019690 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.3 COC(=O)CCC#N SY012328 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.3 COC(=O)CCCBr SY011922 [1,0,0,0,0,0|2,0,0]=3 21 B7R0.3 COC(=O)CCCI SY110660 [1,0,0,0,0,0|2,0,0]=3 22 B7R0.3 COC(=O)CCCN SY058513 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.3 COC(=O)CCCO SY268958 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.4 CC(=O)OCCCCl SY106444 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.4 CCCCCC(N)=O SY051726 [1,0,0,0,0,0|1,0,1]=3 26 B7R0.4 CCCCC[N+](=O)[O-] SY266558 [1,0,0,0,0,0|2,0,1]=4 27 B7R0.4 CCCOCC(=O)O SY025048 [1,0,0,0,0,0|2,0,1]=4 28 B7R0.4 CCOC=CC(=O)O SY030136 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.4 CNCCCC(=O)O SY032531 [1,0,0,0,0,0|2,0,1]=4 30 B7R0.4 COCCCC(=O)O SY045907 [1,0,0,0,0,0|2,0,1]=4 31 B7R0.4 NC(=O)CCCCBr SY253590 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.4 NC(=O)CCCCCl SY184285 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 NCCCCC(=O)O SY002964 [1,0,0,0,0,0|2,0,1]=4 34 B7R0.4 NCCCCC(N)=O SY247757 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.4 O=C(Cl)CCCCF SY270893 [1,0,0,0,0,0|2,0,1]=4 36 B7R0.4 O=C(O)CCCCCl SY051600 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.4 O=C(O)CCCCS SY141369 [1,0,0,0,0,0|2,0,1]=4 38 B7R0.4 O=C([O-])CCCCO SY019284 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.5 CC(=O)C(C)CCBr SY247638 [1,0,0,0,0,0|2,0,1]=4 40 B7R0.5 CC(C)C(=O)CCN SY263226 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.5 CCCC(=O)C(N)=O SY251044 [1,0,0,0,0,0|1,0,0]=2 42 B7R0.5 CCCC(N)C(=O)O SY035722 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.5 CCCC(O)C(N)=O SY251045 [1,0,0,0,0,0|1,0,2]=4 44 B7R0.5 CCCN(C)C(=O)Cl SY042518 [1,0,0,0,0,0|3,0,0]=4 45 B7R0.5 CCC[C@@H](N)C(=O)O SY019949 [1,0,0,0,0,0|2,0,1]=4 46 B7R0.5 CCC[C@H](N)C(=O)O SY001938 [1,0,0,0,0,0|2,0,1]=4 47 B7R0.5 CCNC(=O)[C@H](C)N SY297093 [1,0,0,0,0,0|2,0,1]=4 48 B7R0.5 CCNC(=O)[C@H](C)N SY297094 [1,0,0,0,0,0|2,0,1]=4 49 B7R0.5 CCOC(=O)C(=O)O SY257067 [1,0,0,0,0,0|2,0,0]=3 50 B7R0.5 CCOC(=O)C(=O)[O-] SY057863 [1,0,0,0,0,0|2,0,0]=3 51 B7R0.5 CCOC(=O)C(C)N SY004290 [1,0,0,0,0,0|2,0,1]=4 52 B7R0.5 CCOC(=O)C(N)=O SY047037 [1,0,0,0,0,0|2,0,0]=3 53 B7R0.5 CCOC(=O)C(N)=S SY004302 [1,0,0,0,0,0|2,1,0]=4 54 B7R0.5 CCOC(=O)[C@@H](C)N SY021480 [1,0,0,0,0,0|2,0,1]=4 55 B7R0.5 CCOC(=O)[C@@H](C)O SY030456 [1,0,0,0,0,0|1,0,2]=4 56 B7R0.5 CNCC(=O)N(C)C SY139333 [1,0,0,0,0,0|3,0,0]=4 57 B9R0.8 CCCCC(Br)C(=O)OC SY052225 [0,1,0,0,0,0|1,0,1]=3 58 B9R0.8 CCCOC(=O)C(O)CO SY284785 [0,1,0,0,0,0|1,0,2]=4 59 B9R0.8 CNC(=O)C(Br)CCCBr SY045971 [0,1,0,0,0,0|2,0,1]=4 60 B9R0.8 COC(=O)[C@@H](N)CCCN SY066394 [0,1,0,0,0,0|2,0,1]=4 61 B9R0.8 COC(=O)[C@H](N)CCSC SY066424 [0,1,0,0,0,0|2,0,1]=4 62 B9R0.13 CCCCC(OC)C(=O)O SY057659 [0,1,0,0,0,0|1,0,2]=4 63 B9R0.47 C=C(C)C(=O)NCCCN SY017925 [0,1,0,0,0,0|2,0,0]=3 64 B9R0.47 CCCCOC(=O)[C@H](C)N SY030056 [0,1,0,0,0,0|1,0,1]=3 65 B9R0.47 CCSCC[C@H](N)C(=O)O SY101955 [0,1,0,0,0,0|2,0,1]=4 66 B9R0.47 NCCCCC(N)C(=O)O SY006120 [0,1,0,0,0,0|2,0,1]=4 67 B9R0.47 NCCCC[C@@H](N)C(=O)O SY007003 [0,1,0,0,0,0|2,0,1]=4 68 B9R0.47 NCCCC[C@@H](N)C(=O)O SY279831 [0,1,0,0,0,0|2,0,1]=4 69 B9R0.47 NCCCC[C@H](N)C(=O)O SY006447 [0,1,0,0,0,0|2,0,1]=4 70 B9R0.47 NCCCC[C@H](N)C(=O)O SY018594 [0,1,0,0,0,0|2,0,1]=4 71 B9R0.47 NCCCC[C@H](N)C(=O)O SY030505 [0,1,0,0,0,0|2,0,1]=4 72 B9R0.47 NCCCC[C@H](N)C(=O)O SY036176 [0,1,0,0,0,0|2,0,1]=4 73 B9R1.5 CN1CCNCCC1=O SY040462 [0,0,0,1,0,0|3,0,0]=4 74 B9R1.5 CN1CCNCCC1=O SY066105 [0,0,0,1,0,0|3,0,0]=4 75 B9R1.5 C[C@@H]1NCCCNC1=O SY271664 [0,0,0,1,0,0|2,0,1]=4 76 B9R1.5 C[C@H]1NCCCNC1=O SY267163 [0,0,0,1,0,0|2,0,1]=4 77 B9R1.5 NC1CCCCNC1=O SY005802 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.5 N[C@@H]1CCCCNC1=O SY005803 [0,0,0,1,0,0|2,0,1]=4 79 B9R1.5 N[C@@H]1CCCCNC1=O SY030978 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.5 O=C1CCCCCC1=O SY274002 [0,0,0,1,0,0|0,0,0]=1 81 B9R1.6 CC(=O)C1CCCCC1 SY013522 [0,0,0,1,0,0|1,0,1]=3 82 B9R1.6 CC(=O)C1CCNCC1 SY022101 [0,0,0,1,0,0|2,0,1]=4 83 B9R1.6 CC(=O)C1CCOCC1 SY023117 [0,0,0,1,0,0|2,0,1]=4 84 B9R1.6 CC(=O)N1CCCCC1 SY106654 [0,0,0,1,0,0|2,0,0]=3 85 B9R1.6 CC(=O)N1CCCNC1 SY263178 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.6 CC(=O)N1CCNCC1 SY003405 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.6 CC(=O)N1CCOCC1 SY040633 [0,0,0,1,0,0|3,0,0]=4 88 B9R1.6 NC(=O)C1CCCCN1 SY036410 [0,0,0,1,0,0|2,0,1]=4 89 B9R1.6 O=C(Cl)N1CCCCC1 SY046056 [0,0,0,1,0,0|3,0,0]=4 90 B9R1.6 O=C(O)C1=CCCCC1 SY027515 [0,0,0,1,0,0|2,0,0]=3 91 B9R1.6 O=C(O)C1=CCCCO1 SY003243 [0,0,0,1,0,0|1,0,2]=4 92 B9R1.6 O=C(O)C1=CCNCC1 SY012592 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.6 O=C(O)C1=COCCC1 SY027895 [0,0,0,1,0,0|3,0,0]=4 94 B9R1.6 O=C(O)C1CCCCN1 SY002975 [0,0,0,1,0,0|2,0,1]=4 95 B9R1.6 O=C(O)C1CCCCO1 SY003244 [0,0,0,1,0,0|1,0,2]=4 96 B9R1.6 O=C(O)[C@@H]1CCCCN1 SY003076 [0,0,0,1,0,0|2,0,1]=4 97 B9R1.6 O=C(O)[C@@H]1CCCCO1 SY100445 [0,0,0,1,0,0|1,0,2]=4 98 B9R1.6 O=C(O)[C@H]1CCCCN1 SY003075 [0,0,0,1,0,0|2,0,1]=4 99 B9R1.6 O=C([O-])C1CCCCN1 SY267299 [0,0,0,1,0,0|2,0,1]=4 100 B9R1.23 CN1CC(CCl)CC1=O SY246993 [0,0,0,1,0,0|3,0,0]=4 101 B9R1.23 CN1CC(CN)CC1=O SY097444 [0,0,0,1,0,0|3,0,0]=4 102 B9R1.23 CN1CC(CO)CC1=O SY097443 [0,0,0,1,0,0|3,0,0]=4 103 B9R1.35 CC(=O)N1CCC(N)C1 SY005627 [0,0,0,1,0,0|3,0,0]=4 104 B9R1.35 CC(=O)N1CCC(O)C1 SY012351 [0,0,0,1,0,0|3,0,0]=4 105 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SY005003 [0,0,0,1,0,0|3,0,0]=4 106 B9R1.35 CC(=O)N1CC[C@H](O)C1 SY005004 [0,0,0,1,0,0|3,0,0]=4 107 B9R1.40 CC1(C)CCCCC1=O SY031867 [0,0,0,1,0,0|1,0,1]=3 108 B9R1.40 CC1(C)CCCOC1=O SY254133 [0,0,0,1,0,0|2,0,1]=4 109 B9R1.40 CC1(C)CNCCC1=O SY031977 [0,0,0,1,0,0|2,0,1]=4 110 B9R1.69 CC1CN(C)CCC1=O SY009715 [0,0,0,1,0,0|2,0,1]=4 111 B9R1.69 CN1CC(N)CCC1=O SY020379 [0,0,0,1,0,0|3,0,0]=4 112 B9R1.69 CN1CCC(N)CC1=O SY029828 [0,0,0,1,0,0|3,0,0]=4 113 B9R1.110 C[C@@H](C(=O)O)C1CCC1 SY299884 [0,0,0,1,0,0|2,0,1]=4 114 B9R1.110 C[C@H](C(=O)O)C1CCC1 SY299883 [0,0,0,1,0,0|2,0,1]=4 115 B9R1.110 NC(C(=O)O)C1CCC1 SY097683 [0,0,0,1,0,0|2,0,1]=4 116 B9R1.110 O=C(O)C(=O)N1CCC1 SY272363 [0,0,0,1,0,0|2,0,0]=3 117 B9R1.112 CN(C)C(=O)NC1CC1 SY279823 [0,0,0,1,0,0|3,0,0]=4 118 B9R1.112 N[C@@H](CC1CC1)C(=O)O SY035270 [0,0,0,1,0,0|2,0,1]=4 119 B9R1.112 N[C@H](CC1CC1)C(=O)O SY021328 [0,0,0,1,0,0|2,0,1]=4 120 B9R1.163 NC1(C(=O)O)CCCC1 SY002601 [0,0,0,1,0,0|2,0,1]=4 121 B9R1.163 O=C(O)C1(F)CCCC1 SY039481 [0,0,0,1,0,0|2,0,1]=4 122 B9R1.163 O=C(O)C1(O)CCCC1 SY031777 [0,0,0,1,0,0|1,0,2]=4 123 B9R0.4 CC(=O)CC(=O)NCCO SY264230 [0,0,0,0,0,1|2,0,0]=3 124 B9R0.4 CCCCC(C)OC(=O)Cl SY250032 [0,0,0,0,0,1|2,0,1]=4 125 B9R0.4 CCCCC(N)CC(=O)O SY013375 [0,0,0,0,0,1|2,0,1]=4 126 B9R0.4 CCCC[C@H](C)CC(=O)O SY253397 [0,0,0,0,0,1|2,0,1]=4 127 B6R0.1 CCC(=O)COC SY190908 [2,0,0,0,0,0|1,0,1]=4 128 B6R0.1 CCCC(=O)NN SY060413 [2,0,0,0,0,0|2,0,0]=4 129 B6R0.1 CNC(=O)CCO SY083761 [2,0,0,0,0,0|2,0,0]=4 130 B6R0.1 COC(=O)CCBr SY002337 [2,0,0,0,0,0|2,0,0]=4 131 B6R0.1 COC(=O)CCN SY004831 [2,0,0,0,0,0|2,0,0]=4 132 B6R0.1 COC(=O)CCO SY008913 [2,0,0,0,0,0|2,0,0]=4 133 B6R0.4 CC(=O)CCCO SY002852 [2,0,0,0,0,0|1,0,0]=3 134 B6R0.4 CC(=O)NCCN SY313725 [2,0,0,0,0,0|2,0,0]=4 135 B6R0.4 CCCCC(=N)N SY020380 [2,0,0,0,0,0|2,0,0]=4 136 B6R0.4 CCCCC(=N)N SY020382 [2,0,0,0,0,0|2,0,0]=4 137 B6R0.4 CCCOC(N)=O SY114484 [2,0,0,0,0,0|2,0,0]=4 138 B6R0.4 CNCCC(=O)O SY005345 [2,0,0,0,0,0|1,0,1]=4 139 B6R0.4 CNCCC(=O)O SY112486 [2,0,0,0,0,0|1,0,1]=4 140 B6R0.4 COCCC(=O)O SY028921 [2,0,0,0,0,0|1,0,1]=4 141 B6R0.4 CO\C=C\C(C)=O SY029615 [2,0,0,0,0,0|1,0,1]=4 142 B6R0.4 NCCCC(N)=O SY174709 [2,0,0,0,0,0|2,0,0]=4 143 B6R0.4 O=C(O)CCCBr SY001501 [2,0,0,0,0,0|1,0,1]=4 144 B6R0.6 C\C=C\CCCO SY066633 [2,0,0,0,0,0|1,0,0]=3 145 B6R0.6 O=CCCCCCl SY024458 [2,0,0,0,0,0|1,0,1]=4 146 B6R0.6 O=CCCCCO SY047027 [2,0,0,0,0,0|1,0,1]=4 147 B6R0.6 O=CNCCCO SY261924 [2,0,0,0,0,0|2,0,0]=4 148 B6R0.3 CCC(=O)C(=O)O SY011034 [2,0,0,0,0,0|1,0,0]=3 149 B6R0.3 CCC(=O)N(C)C SY036870 [2,0,0,0,0,0|2,0,0]=4 150 B8R0.1 CCOC(=O)CCCI SY014641 [1,1,0,0,0,0|1,0,1]=4 151 B8R0.1 CCOC(=O)CCCN SY015028 [1,1,0,0,0,0|1,0,1]=4 152 B8R0.1 CCOC(=O)CCCO SY263197 [1,1,0,0,0,0|1,0,1]=4 153 B8R0.1 CCOC(=O)CCNC SY019659 [1,1,0,0,0,0|1,0,1]=4 154 B8R0.3 CNC(=O)C(Br)CCBr SY300500 [1,1,0,0,0,0|2,0,0]=4 155 B8R0.3 CNCC(Br)C(=O)OC SY290771 [1,1,0,0,0,0|2,0,0]=4 156 B8R0.3 CNC[C@H](N)C(=O)OC SY248365 [1,1,0,0,0,0|2,0,0]=4 157 B8R0.3 COC(=O)C(Br)CCBr SY017663 [1,1,0,0,0,0|2,0,0]=4 158 B8R0.6 C#CCCCC(=O)OC SY275105 [1,1,0,0,0,0|1,0,1]=4 159 B8R0.6 CCC\C=C\C(=O)OC SY015809 [1,1,0,0,0,0|1,0,1]=4 160 B8R0.6 CCNCCC(=O)OC SY019881 [1,1,0,0,0,0|1,0,0]=3 161 B8R0.6 CNCCCC(=O)NN SY289472 [1,1,0,0,0,0|2,0,0]=4 162 B8R0.6 COC(=O)CCCC#N SY025759 [1,1,0,0,0,0|1,0,1]=4 163 B8R0.6 COC(=O)CCCC=O SY056793 [1,1,0,0,0,0|1,0,1]=4 164 B8R0.6 COC(=O)CCCCBr SY013898 [1,1,0,0,0,0|1,0,0]=3 165 B8R0.6 COC(=O)CCCCN SY117564 [1,1,0,0,0,0|1,0,0]=3 166 B8R0.6 COCCCC(=O)OC SY096667 [1,1,0,0,0,0|1,0,0]=3 167 B8R0.9 C=CC(=O)NCC(C)O SY261906 [1,1,0,0,0,0|1,0,1]=4 168 B8R0.9 CCC(=O)NCC(C)C SY034683 [1,1,0,0,0,0|1,0,1]=4 169 B8R0.9 COC(=O)CCC(C)=O SY048239 [1,1,0,0,0,0|1,0,1]=4 170 B8R0.19 CCC(=O)CC(=O)OC SY007180 [1,1,0,0,0,0|1,0,1]=4 171 B8R0.19 COC(=O)C[C@H](O)CO SY018663 [1,1,0,0,0,0|2,0,0]=4 172 B8R0.5 CCCC(C)OC(=O)Cl SY285574 [1,1,0,0,0,0|2,0,0]=4 173 B8R0.7 CC(=O)OCCCCBr SY048653 [1,1,0,0,0,0|1,0,0]=3 174 B8R0.7 CC(=O)OCCCCO SY294143 [1,1,0,0,0,0|1,0,0]=3 175 B8R0.7 CC(=O)SCCCCN SY290150 [1,1,0,0,0,0|1,0,0]=3 176 B8R0.7 CCCCOCC(=O)O SY002472 [1,1,0,0,0,0|1,0,1]=4 177 B8R0.7 NC(=O)CCCCCBr SY103908 [1,1,0,0,0,0|1,0,1]=4 178 B8R0.7 NC(=O)CCCCCO SY247977 [1,1,0,0,0,0|1,0,1]=4 179 B8R0.7 NCCCCCC(=O)O SY003109 [1,1,0,0,0,0|1,0,1]=4 180 B8R0.7 NCCCCCC(N)=O SY247974 [1,1,0,0,0,0|1,0,1]=4 181 B8R0.7 O=C(O)CCCCCCl SY053214 [1,1,0,0,0,0|1,0,1]=4 182 B8R0.7 O=C(O)CCCCCO SY032043 [1,1,0,0,0,0|1,0,1]=4 183 B8R0.7 O=C([O-])CCCCCO SY121174 [1,1,0,0,0,0|1,0,1]=4 184 B8R0.21 CCCCOS(C)(=O)=O SY058921 [1,1,0,0,0,0|2,0,0]=4 185 B8R0.28 CC(=O)CCCC(C)=O SY253771 [1,1,0,0,0,0|0,0,2]=4 186 B8R0.28 CC(=O)CCCN(C)C SY147772 [1,1,0,0,0,0|1,0,1]=4 187 B8R0.28 CC(C)CCOC(=O)Cl SY032117 [1,1,0,0,0,0|2,0,0]=4 188 B8R0.15 CCCC(=NO)C(N)=O SY251064 [1,1,0,0,0,0|1,0,1]=4 189 B8R0.23 CC(C)NC(=O)C(=O)O SY026403 [1,1,0,0,0,0|2,0,0]=4 190 B10R0.6 CC(=O)CC(=O)OCCC#N SY047108 [0,1,0,0,0,1|1,0,1]=4 191 B10R0.18 C#CCCC(=O)CC(=O)OC SY103833 [0,1,0,0,0,1|0,0,2]=4 192 B10R0.18 COCCC(=O)CC(=O)OC SY003567 [0,1,0,0,0,1|1,0,0]=3 193 B10R0.32 CCOC(=O)C(=O)CC(C)=O SY005313 [0,1,0,0,0,1|1,0,1]=4 194 B10R0.96 CC(=O)CC(=O)OCC(C)C SY052364 [0,1,0,0,0,1|1,0,0]=3 195 B10R0.57 CNC(=O)[C@@H](N)CCC(C)C SY290103 [0,2,0,0,0,0|1,0,1]=4 196 B10R0.83 COC(=O)C(N)CCCCO SY028578 [0,2,0,0,0,0|1,0,1]=4 197 B8R1.1 CCC1CCC(=O)O1 SY015382 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.1 O=C1CC(CBr)CN1 SY205276 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.1 O=C1CC(CO)CN1 SY008749 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.2 O=CC1CCCCN1 SY239012 [1,0,0,1,0,0|1,0,1]=4 201 B8R1.3 CC1C=CC(=O)CC1 SY100224 [1,0,0,1,0,0|0,0,1]=3 202 B8R1.3 CC1CNC(=O)CO1 SY032981 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.3 NC1CCC(=O)CC1 SY017243 [1,0,0,1,0,0|1,0,1]=4 204 B8R1.3 NC1CCC(=O)NC1 SY022821 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.3 N[C@@H]1CCC(=O)NC1 SY036453 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.3 O=C1CCC(Br)CC1 SY275581 [1,0,0,1,0,0|1,0,1]=4 207 B8R1.3 O=C1CCC(O)CC1 SY005938 [1,0,0,1,0,0|1,0,1]=4 208 B8R1.3 O=C1CCC(O)CN1 SY034611 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.3 O=C1CC[C@H](O)CN1 SY107535 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.5 BrC1=C(Br)CCCC1 SY272424 [1,0,0,1,0,0|2,0,0]=4 211 B8R1.5 CC1COCCC1=O SY023092 [1,0,0,1,0,0|1,0,1]=4 212 B8R1.5 CN1CCNCC1=O SY025326 [1,0,0,1,0,0|2,0,0]=4 213 B8R1.5 CN1CCNCC1=O SY025555 [1,0,0,1,0,0|2,0,0]=4 214 B8R1.5 O=C1CCCCC1=O SY018311 [1,0,0,1,0,0|0,0,0]=2 215 B8R1.5 O=C1CCCCC1Cl SY038921 [1,0,0,1,0,0|1,0,1]=4 216 B8R1.22 O=C1C=CCCCC1 SY041083 [1,0,0,1,0,0|0,0,1]=3 217 B8R1.22 O=C1CCCCNC1 SY040205 [1,0,0,1,0,0|1,0,1]=4 218 B8R1.22 O=C1CCCNCC1 SY017922 [1,0,0,1,0,0|1,0,1]=4 219 B8R1.22 O=C1CCCOCC1 SY036485 [1,0,0,1,0,0|1,0,1]=4 220 B8R1.22 O=C1CCNCCN1 SY019808 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.22 O=C1CCNCCN1 SY075066 [1,0,0,1,0,0|2,0,0]=4 222 B8R1.22 O=C1CCOCCN1 SY029460 [1,0,0,1,0,0|2,0,0]=4 223 B8R1.22 O=C1CNCCCN1 SY032801 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.38 CNC(=O)C1CNC1 SY156287 [1,0,0,1,0,0|2,0,0]=4 225 B8R1.38 COC(=N)C1CCC1 SY300137 [1,0,0,1,0,0|2,0,0]=4 226 B8R1.38 COC(=O)C1CCN1 SY013593 [1,0,0,1,0,0|2,0,0]=4 227 B8R1.38 COC(=O)C1CNC1 SY015501 [1,0,0,1,0,0|2,0,0]=4 228 B8R1.38 COC(=O)C1COC1 SY099187 [1,0,0,1,0,0|2,0,0]=4 229 B8R1.50 CN1C(=O)CCC1O SY040014 [1,0,0,1,0,0|2,0,0]=4 230 B8R1.4 CC1CCCC(=O)N1 SY033090 [1,0,0,1,0,0|1,0,1]=4 231 B8R1.4 CC1CCCC(=O)O1 SY048899 [1,0,0,1,0,0|1,0,1]=4 232 B8R1.4 CC1CCNC(=O)C1 SY033089 [1,0,0,1,0,0|1,0,0]=3 233 B8R1.4 CN1CCCC(=O)C1 SY023480 [1,0,0,1,0,0|1,0,1]=4 234 B8R1.4 C[C@@H]1CC(=O)CCN1 SY259242 [1,0,0,1,0,0|1,0,1]=4 235 B8R1.4 C[C@H]1CC(=O)CCN1 SY234011 [1,0,0,1,0,0|1,0,1]=4 236 B8R1.4 C[C@H]1CCCC(=O)C1 SY290780 [1,0,0,1,0,0|0,0,1]=3 237 B8R1.4 NC1CCNC(=O)C1 SY098707 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.4 O=C1CC(O)CCN1 SY029027 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.4 O=C1C[C@H](O)CCN1 SY238615 [1,0,0,1,0,0|2,0,0]=4 240 B8R1.7 CC(=O)C1CCCC1 SY035519 [1,0,0,1,0,0|0,0,1]=3 241 B8R1.7 O=C(O)C1=CCCC1 SY027520 [1,0,0,1,0,0|1,0,1]=4 242 B8R1.34 O=C(O)C=C1CCC1 SY042126 [1,0,0,1,0,0|1,0,1]=4 243 B8R1.34 O=C(O)CC1CCC1 SY011888 [1,0,0,1,0,0|1,0,1]=4 244 B8R1.35 O=C(Cl)OCC1CC1 SY248050 [1,0,0,1,0,0|2,0,0]=4 245 B8R1.35 O=C(O)C=CC1CC1 SY263204 [1,0,0,1,0,0|1,0,1]=4 246 B8R1.35 O=C(O)CCC1CC1 SY042777 [1,0,0,1,0,0|1,0,1]=4 247 B8R1.54 CC(Br)C(=O)C1CC1 SY034182 [1,0,0,1,0,0|1,0,1]=4 248 B8R1.54 O=C(O)C(=O)C1CC1 SY057726 [1,0,0,1,0,0|1,0,0]=3 249 B10R1.16 CCCCC1CCC(=O)O1 SY015123 [0,0,0,1,0,1|1,0,1]=4 250 B10R1.18 CC(=O)CC1CCCCC1 SY106383 [0,0,0,1,0,1|1,0,1]=4 251 B10R1.18 CC(=O)NC1CCCCC1 SY269916 [0,0,0,1,0,1|1,0,1]=4 252 B10R1.18 O=C(O)CC1=CCCCC1 SY106338 [0,0,0,1,0,1|2,0,0]=4 253 B10R1.61 CC(=O)C1=C(Br)CCCC1 SY266549 [0,0,0,1,0,1|1,0,0]=3 254 B10R1.61 CC(=O)C1CCCCC1=O SY039226 [0,0,0,1,0,1|0,0,0]=2 255 B10R1.61 O=C(O)C1=C(Br)CCCC1 SY266274 [0,0,0,1,0,1|2,0,0]=4 256 B10R1.130 CCCC1NC(=O)OC1=O SY225153 [0,0,0,1,0,1|1,0,0]=3 257 B10R1.130 CCC[C@@H]1NC(=O)OC1=O SY225261 [0,0,0,1,0,1|1,0,0]=3 258 B10R1.130 CCC[C@H]1NC(=O)OC1=O SY225262 [0,0,0,1,0,1|1,0,0]=3 259 B10R1.130 COCC1NC(=O)NC1=O SY273057 [0,0,0,1,0,1|2,0,0]=4 260 B10R1.130 COC[C@@H]1NC(=O)OC1=O SY295062 [0,0,0,1,0,1|2,0,0]=4 261 B10R1.130 COC[C@H]1NC(=O)OC1=O SY225268 [0,0,0,1,0,1|2,0,0]=4 262 B10R1.13 CC(=O)N1CCC(N)CC1 SY005622 [0,1,0,1,0,0|2,0,0]=4 263 B10R1.13 CC(=O)N1CCC(N)CC1 SY022645 [0,1,0,1,0,0|2,0,0]=4 264 B10R1.15 COC(=O)C1=CCCCC1 SY057598 [0,1,0,1,0,0|1,0,0]=3 265 B10R1.15 COC(=O)C1=CCCNC1 SY040268 [0,1,0,1,0,0|2,0,0]=4 266 B10R1.15 COC(=O)C1=CCNCC1 SY023222 [0,1,0,1,0,0|2,0,0]=4 267 B10R1.15 COC(=O)C1=CNCCC1 SY027256 [0,1,0,1,0,0|2,0,0]=4 268 B10R1.15 COC(=O)C1=COCCC1 SY027899 [0,1,0,1,0,0|2,0,0]=4 269 B10R1.15 COC(=O)C1CCCCN1 SY021148 [0,1,0,1,0,0|1,0,1]=4 270 B10R1.15 COC(=O)C1CCCCN1 SY023681 [0,1,0,1,0,0|1,0,1]=4 271 B10R1.15 COC(=O)C1CCCCO1 SY005329 [0,1,0,1,0,0|0,0,2]=4 272 B10R1.15 COC(=O)[C@@H]1CCCCN1 SY030915 [0,1,0,1,0,0|1,0,1]=4 273 B10R1.15 COC(=O)[C@H]1CCCCN1 SY066252 [0,1,0,1,0,0|1,0,1]=4 274 B10R1.15 O=C(CCl)N1CCCCC1 SY064187 [0,1,0,1,0,0|2,0,0]=4 275 B10R1.19 N#CC1CCCCCC1=O SY251081 [0,1,0,1,0,0|1,0,1]=4 276 B10R1.30 CC1CCC(Cl)=C(C=O)C1 SY264269 [0,1,0,1,0,0|1,0,0]=3 277 B10R1.411 COC(=O)C1(N)CCCC1 SY017501 [0,1,0,1,0,0|1,0,1]=4 278 B10R1.113 CC(=O)N1CCCC(N)C1 SY006435 [0,1,0,1,0,0|2,0,0]=4 279 B10R1.363 CC(=O)C1(C)CCCCC1 SY028480 [0,1,0,1,0,0|1,0,1]=4 280 B10R1.363 CC(=O)C1(O)CCCCC1 SY031489 [0,1,0,1,0,0|0,0,2]=4 281 B10R2.19 NC12CCC(CC1=O)C2 SY262131 [0,0,0,2,0,0|1,0,1]=4 282 B10R0.78 CCCCC(=N)NCC(=O)O SY300206 [0,0,0,0,0,2|2,0,0]=4