0 B6R0.6 C#CCCCCC SBB067441 [0,0,0,0,0,0|1,0,3]=4 1 B6R0.6 C=CCCCCBr SBB054740 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.6 C=CCCCCC SBB059882 [0,0,0,0,0,0|1,0,2]=3 3 B6R0.6 C=CCOCCO SBB060194 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.6 CCCCCC#N SBB060051 [0,0,0,0,0,0|1,0,3]=4 5 B6R0.6 CCCCCCBr SBB059934 [0,0,0,0,0,0|1,0,3]=4 6 B6R0.6 CCCCCCCl SBB059952 [0,0,0,0,0,0|1,0,3]=4 7 B6R0.6 CCCCCCN SBB059984 [0,0,0,0,0,0|1,0,3]=4 8 B6R0.6 CCCCCCO SBB059899 [0,0,0,0,0,0|0,0,4]=4 9 B6R0.6 CCCCCOC SBB061300 [0,0,0,0,0,0|2,0,2]=4 10 B6R0.6 CCCCNC=O SBB060026 [0,0,0,0,0,0|1,0,2]=3 11 B6R0.6 CCCCOC=O SBB060300 [0,0,0,0,0,0|1,0,2]=3 12 B6R0.6 CCCCSCC SBB061178 [0,0,0,0,0,0|2,0,2]=4 13 B6R0.6 CCCNCCC SBB059762 [0,0,0,0,0,0|2,0,2]=4 14 B6R0.6 CCCOCCO SBB061379 [0,0,0,0,0,0|1,0,3]=4 15 B6R0.6 CCCSCCC SBB061017 [0,0,0,0,0,0|2,0,2]=4 16 B6R0.6 CCCSCCO SBB058605 [0,0,0,0,0,0|1,0,3]=4 17 B6R0.6 CCC\C=C\C=O SBB067097 [0,0,0,0,0,0|0,0,2]=2 18 B6R0.6 CCNCCC#N SBB006528 [0,0,0,0,0,0|2,0,2]=4 19 B6R0.6 CCOCCC#N SBB067181 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.6 CCOCCCN SBB028180 [0,0,0,0,0,0|2,0,2]=4 21 B6R0.6 CC\C=C/CCO SBB007739 [0,0,0,0,0,0|0,0,2]=2 22 B5R0.2 BrC\C=C\CBr SBB059946 [1,0,0,0,0,0|2,0,0]=3 23 B5R0.2 CCC#CCO SBB009120 [1,0,0,0,0,0|0,0,3]=4 24 B5R0.2 CCCCCBr SBB059933 [1,0,0,0,0,0|1,0,2]=4 25 B5R0.2 CCCCCCl SBB059951 [1,0,0,0,0,0|1,0,2]=4 26 B5R0.2 CCNNCC SBB069584 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.2 CCOCCBr SBB008332 [1,0,0,0,0,0|2,0,1]=4 28 B5R0.2 CCOCCCl SBB061015 [1,0,0,0,0,0|2,0,1]=4 29 B5R0.2 CCOCCN SBB072161 [1,0,0,0,0,0|2,0,1]=4 30 B5R0.2 CCSCCN SBB017894 [1,0,0,0,0,0|2,0,1]=4 31 B5R0.2 ClC\C=C\CCl SBB060216 [1,0,0,0,0,0|2,0,0]=3 32 B7R0.1 C=CCCCCCC SBB059884 [0,1,0,0,0,0|1,0,2]=4 33 B7R0.1 C=CCSCCCC SBB058522 [0,1,0,0,0,0|1,0,2]=4 34 B7R0.1 CCCCCOC=O SBB060301 [0,1,0,0,0,0|0,0,2]=3 35 B7R0.1 C\C=C\CCCCC SBB059885 [0,1,0,0,0,0|1,0,2]=4 36 B7R0.1 N#CC\C=C\CC#N SBB072379 [0,1,0,0,0,0|1,0,2]=4 37 B7R0.3 C=C(CC)CCCC SBB060475 [0,1,0,0,0,0|1,0,2]=4 38 B7R0.3 C=CC(O)CCCC SBB008778 [0,1,0,0,0,0|1,0,2]=4 39 B7R0.3 C=CCNC(=O)CCl SBB085845 [0,1,0,0,0,0|3,0,0]=4 40 B7R0.3 CCC(=O)OCCCl SBB060315 [0,1,0,0,0,0|2,0,1]=4 41 B7R0.4 CCCC#CC(=O)O SBB009091 [0,1,0,0,0,0|0,0,3]=4 42 B7R0.4 CCCCCC(=O)Cl SBB060011 [0,1,0,0,0,0|0,0,2]=3 43 B7R0.4 CCCCCC(=O)O SBB053586 [0,1,0,0,0,0|0,0,2]=3 44 B7R0.4 CCCCCC(C)=O SBB061125 [0,1,0,0,0,0|0,0,2]=3 45 B7R0.4 CCCCCC(N)=O SBB061056 [0,1,0,0,0,0|0,0,2]=3 46 B7R0.4 CCCCOC(N)=O SBB060819 [0,1,0,0,0,0|1,0,2]=4 47 B7R0.4 CCC\C=C\C(=O)O SBB009088 [0,1,0,0,0,0|0,0,2]=3 48 B7R0.4 CCOCCC(=O)O SBB053607 [0,1,0,0,0,0|1,0,1]=3 49 B7R0.4 C\C=C\C=C\C(=O)O SBB060282 [0,1,0,0,0,0|0,0,2]=3 50 B7R0.4 NCCCCC(=O)O SBB061559 [0,1,0,0,0,0|1,0,2]=4 51 B7R0.4 O=C(O)CCCCBr SBB061343 [0,1,0,0,0,0|1,0,2]=4 52 B7R0.4 O=C(O)CCCCCl SBB061215 [0,1,0,0,0,0|1,0,2]=4 53 B7R0.4 OC(=O)C\C=C/CC SBB006610 [0,1,0,0,0,0|0,0,0]=1 54 B7R0.7 CCCC(=O)CCC SBB060386 [0,1,0,0,0,0|1,0,2]=4 55 B7R0.7 CCNC(=O)CC#N SBB000040 [0,1,0,0,0,0|2,0,1]=4 56 B7R0.7 CCOC(=O)CC#N SBB040821 [0,1,0,0,0,0|2,0,1]=4 57 B7R0.7 CCOC(=O)CCBr SBB070739 [0,1,0,0,0,0|2,0,1]=4 58 B7R0.7 CCOC(=O)CCN SBB004038 [0,1,0,0,0,0|2,0,1]=4 59 B7R0.7 CCOC(=O)CNN SBB021976 [0,1,0,0,0,0|3,0,0]=4 60 B7R0.7 CCOC(=O)CNN SBB054137 [0,1,0,0,0,0|3,0,0]=4 61 B7R0.7 C\C=C\C(=O)OCC SBB061219 [0,1,0,0,0,0|2,0,1]=4 62 B7R0.7 N(C)CC(=O)OCC SBB004039 [0,1,0,0,0,0|3,0,0]=4 63 B7R1.1 BrCC1=CSC=C1 SBB070721 [0,0,0,1,0,0|3,0,0]=4 64 B7R1.1 BrCC1=CSC=N1 SBB054932 [0,0,0,1,0,0|3,0,0]=4 65 B7R1.1 C(=O)C1=CSC=C1 SBB004320 [0,0,0,1,0,0|1,0,2]=4 66 B7R1.1 CCN1C=CC=N1 SBB020346 [0,0,0,1,0,0|2,0,1]=4 67 B7R1.1 CCN1C=CN=C1 SBB045396 [0,0,0,1,0,0|3,0,0]=4 68 B7R1.1 CSC1=CC=CS1 SBB085766 [0,0,0,1,0,0|1,1,1]=4 69 B7R1.1 CSC1=CSC=C1 SBB055747 [0,0,0,1,0,0|3,0,0]=4 70 B7R1.1 ClCC1=CSC=N1 SBB054935 [0,0,0,1,0,0|3,0,0]=4 71 B7R1.1 NCC1=CC=CO1 SBB004376 [0,0,0,1,0,0|1,0,2]=4 72 B7R1.1 NCC1=CC=CS1 SBB004315 [0,0,0,1,0,0|1,1,1]=4 73 B7R1.1 NCC1=CN=CS1 SBB047473 [0,0,0,1,0,0|2,1,0]=4 74 B7R1.1 NCC1=CSC=C1 SBB079179 [0,0,0,1,0,0|3,0,0]=4 75 B7R1.1 NCC1=CSC=N1 SBB047472 [0,0,0,1,0,0|3,0,0]=4 76 B7R1.1 O=CC1=CC=CN1 SBB004389 [0,0,0,1,0,0|1,0,2]=4 77 B7R1.1 O=CC1=CC=CN1 SBB004390 [0,0,0,1,0,0|1,0,2]=4 78 B7R1.1 O=CC1=CC=CO1 SBB004386 [0,0,0,1,0,0|1,0,2]=4 79 B7R1.1 O=CC1=CC=CS1 SBB004321 [0,0,0,1,0,0|1,0,2]=4 80 B7R1.1 O=CC1=CNC=C1 SBB052279 [0,0,0,1,0,0|1,0,2]=4 81 B7R1.1 O=CC1=COC=C1 SBB004385 [0,0,0,1,0,0|1,0,2]=4 82 B7R1.1 O=CC1=NNC=C1 SBB052310 [0,0,0,1,0,0|2,0,1]=4 83 B7R1.1 O=CC1CCCC1 SBB069481 [0,0,0,1,0,0|0,0,2]=3 84 B7R1.1 O=CC1CCOC1 SBB052278 [0,0,0,1,0,0|1,0,1]=3 85 B7R1.1 OCC1=CC=CO1 SBB004373 [0,0,0,1,0,0|1,0,2]=4 86 B7R1.1 OCC1=CC=CS1 SBB058563 [0,0,0,1,0,0|1,1,1]=4 87 B7R1.1 OCC1=CN=CS1 SBB066375 [0,0,0,1,0,0|2,1,0]=4 88 B7R1.1 OCC1=CNC=N1 SBB004207 [0,0,0,1,0,0|3,0,0]=4 89 B7R1.1 OCC1=CNC=N1 SBB054821 [0,0,0,1,0,0|3,0,0]=4 90 B7R1.1 OCC1=CSC=C1 SBB004309 [0,0,0,1,0,0|3,0,0]=4 91 B7R1.1 OCC1=CSC=N1 SBB066562 [0,0,0,1,0,0|3,0,0]=4 92 B7R1.1 SCC1=CC=CO1 SBB004308 [0,0,0,1,0,0|1,0,2]=4 93 B7R1.3 BrC1C=CCCC1 SBB007864 [0,0,0,1,0,0|2,0,1]=4 94 B7R1.3 CC1CC=CCC1 SBB060473 [0,0,0,1,0,0|1,0,1]=3 95 B7R1.3 O=C1C=CC=NN1 SBB005360 [0,0,0,1,0,0|2,0,1]=4 96 B7R1.3 O=C1C=CCCC1 SBB008209 [0,0,0,1,0,0|0,0,2]=3 97 B7R1.3 O=C1CCCCC1 SBB060074 [0,0,0,1,0,0|0,0,2]=3 98 B7R1.3 O=C1CCCCO1 SBB060349 [0,0,0,1,0,0|1,0,2]=4 99 B7R1.3 O=C1CCOCC1 SBB049627 [0,0,0,1,0,0|1,0,1]=3 100 B7R1.3 O=C1CCSCC1 SBB048121 [0,0,0,1,0,0|1,0,1]=3 101 B7R1.3 O=C1CNCCN1 SBB000034 [0,0,0,1,0,0|2,0,1]=4 102 B7R1.3 O=C1N=CC=CN1 SBB004216 [0,0,0,1,0,0|2,0,1]=4 103 B7R1.4 CC1=C(Br)SC=C1 SBB089226 [0,0,0,1,0,0|2,0,1]=4 104 B7R1.4 CC1=NC=CN1C SBB040829 [0,0,0,1,0,0|3,0,0]=4 105 B7R1.4 CN1C=CN=C1Br SBB054456 [0,0,0,1,0,0|3,0,0]=4 106 B7R1.4 CN1C=CN=C1I SBB093949 [0,0,0,1,0,0|3,0,0]=4 107 B7R1.4 CN1C=CN=C1S SBB041060 [0,0,0,1,0,0|2,1,0]=4 108 B7R1.4 CN1CCCC1=O SBB060297 [0,0,0,1,0,0|1,0,2]=4 109 B7R1.24 C1=CC=CCC=C1 SBB061185 [0,0,0,1,0,0|1,0,2]=4 110 B7R1.24 C1=CCCCCC1 SBB059889 [0,0,0,1,0,0|1,0,1]=3 111 B4R0.2 CCCCBr SBB059930 [2,0,0,0,0,0|1,0,1]=4 112 B4R0.2 C\C=C\CC SBB059879 [2,0,0,0,0,0|0,0,0]=2 113 B4R0.2 Cl\C=C/CCl SBB061393 [2,0,0,0,0,0|2,0,0]=4 114 B4R0.2 [NH2+](CC)CC SBB059849 [2,0,0,0,0,0|1,0,1]=4 115 B6R0.1 C=CC(=O)OCC SBB060348 [1,1,0,0,0,0|1,0,1]=4 116 B6R0.1 CCCC(=O)CC SBB061496 [1,1,0,0,0,0|0,0,2]=4 117 B6R0.1 CCNC(=O)CBr SBB051008 [1,1,0,0,0,0|2,0,0]=4 118 B6R0.1 CCNC(=O)CCl SBB008200 [1,1,0,0,0,0|2,0,0]=4 119 B6R0.1 CCOC(=O)CBr SBB060995 [1,1,0,0,0,0|2,0,0]=4 120 B6R0.1 CCOC(=O)CC SBB060312 [1,1,0,0,0,0|1,0,1]=4 121 B6R0.1 C\C=C\C(=O)OC SBB061218 [1,1,0,0,0,0|2,0,0]=4 122 B6R0.1 [NH3+]CC(=O)OCC SBB056599 [1,1,0,0,0,0|2,0,0]=4 123 B6R0.4 C=CCCC(=O)O SBB061214 [1,1,0,0,0,0|0,0,2]=4 124 B6R0.4 C=CCCC(C)=O SBB009089 [1,1,0,0,0,0|0,0,2]=4 125 B6R0.4 CC(C)COC=O SBB061244 [1,1,0,0,0,0|1,0,1]=4 126 B6R0.4 CCC#CC(C)=O SBB009086 [1,1,0,0,0,0|0,0,2]=4 127 B6R0.4 CCCCC(=O)O SBB053585 [1,1,0,0,0,0|0,0,1]=3 128 B6R0.4 CCCCC(C)=O SBB061262 [1,1,0,0,0,0|0,0,1]=3 129 B6R0.4 CCCCC(N)=O SBB028169 [1,1,0,0,0,0|0,0,1]=3 130 B6R0.4 CCCNC(N)=O SBB028174 [1,1,0,0,0,0|1,0,1]=4 131 B6R0.4 CCCOC(C)=O SBB060305 [1,1,0,0,0,0|1,0,1]=4 132 B6R0.4 CCCOC(N)=O SBB000036 [1,1,0,0,0,0|1,0,1]=4 133 B6R0.4 CCOCC(=O)O SBB069120 [1,1,0,0,0,0|1,0,0]=3 134 B6R0.4 CCSCC(=O)O SBB047288 [1,1,0,0,0,0|1,0,0]=3 135 B6R0.4 CC\C=C\C(=O)O SBB061994 [1,1,0,0,0,0|0,0,0]=2 136 B6R0.4 CNCCC(N)=O SBB080375 [1,1,0,0,0,0|1,0,1]=4 137 B6R0.4 NCCCC(=O)O SBB028179 [1,1,0,0,0,0|1,0,1]=4 138 B6R0.4 O=C(Cl)CCCCl SBB060894 [1,1,0,0,0,0|1,0,1]=4 139 B6R0.4 O=C(O)CCCBr SBB065986 [1,1,0,0,0,0|1,0,1]=4 140 B8R0.1 C=CCOC(=O)CCC SBB061324 [0,2,0,0,0,0|1,0,1]=4 141 B8R0.1 CCOC(=O)CNC=O SBB067158 [0,2,0,0,0,0|1,0,0]=3 142 B8R0.4 CCCCCCCC=O SBB059871 [0,2,0,0,0,0|0,0,2]=4 143 B8R0.4 CCCCCCNC=O SBB061175 [0,2,0,0,0,0|0,0,2]=4 144 B8R0.4 CCCCCCOC=O SBB060302 [0,2,0,0,0,0|0,0,2]=4 145 B8R0.4 CCCCC\C=C\C=O SBB068337 [0,2,0,0,0,0|0,0,2]=4 146 B8R0.6 CCCCCC(=O)CC SBB060388 [0,2,0,0,0,0|0,0,2]=4 147 B8R0.6 CCCCCC(=O)NN SBB021010 [0,2,0,0,0,0|0,0,2]=4 148 B8R0.6 CCCCCC(=O)NO SBB008093 [0,2,0,0,0,0|0,0,2]=4 149 B8R0.6 CCCCCC(=O)OC SBB060591 [0,2,0,0,0,0|0,0,2]=4 150 B8R0.6 CCNCCC(=O)NN SBB046550 [0,2,0,0,0,0|1,0,1]=4 151 B8R0.6 CCOCCC(=O)NN SBB079954 [0,2,0,0,0,0|1,0,1]=4 152 B8R0.6 C\C=C\C=C\C(=O)NO SBB008191 [0,2,0,0,0,0|0,0,2]=4 153 B8R0.7 CCCCCCC(=O)Cl SBB060012 [0,2,0,0,0,0|0,0,2]=4 154 B8R0.7 CCCCCCC(=O)O SBB053587 [0,2,0,0,0,0|0,0,2]=4 155 B8R0.7 CCCCCCC(C)=O SBB060387 [0,2,0,0,0,0|0,0,2]=4 156 B8R0.7 CCCCCOC(C)=O SBB060027 [0,2,0,0,0,0|0,0,2]=4 157 B8R0.7 CCCCSCC(=O)O SBB061205 [0,2,0,0,0,0|0,0,2]=4 158 B8R0.7 CCCNCCC(N)=O SBB116773 [0,2,0,0,0,0|0,0,2]=4 159 B8R0.7 CCOCCOC(C)=O SBB061000 [0,2,0,0,0,0|1,0,1]=4 160 B8R0.7 COCCOCC(=O)O SBB008497 [0,2,0,0,0,0|1,0,1]=4 161 B8R0.7 NC(=O)CCNCCO SBB116776 [0,2,0,0,0,0|1,0,1]=4 162 B8R0.7 NCCCCCC(=O)O SBB015068 [0,2,0,0,0,0|0,0,2]=4 163 B8R0.7 O=C(O)CCCCCBr SBB065783 [0,2,0,0,0,0|0,0,2]=4 164 B8R0.7 O=C(O)CCNCCO SBB079386 [0,2,0,0,0,0|1,0,1]=4 165 B8R0.3 CCOC(=O)C(Cl)C=O SBB054117 [0,2,0,0,0,0|1,0,0]=3 166 B8R0.8 CCCCC(Br)C(=O)O SBB069524 [0,2,0,0,0,0|0,0,2]=4 167 B8R0.8 CCCCC(C)C(=O)O SBB072714 [0,2,0,0,0,0|0,0,2]=4 168 B8R0.8 CCCCC(N)C(C)=O SBB014561 [0,2,0,0,0,0|0,0,2]=4 169 B8R0.8 CCCC[C@H](N)C(=O)O SBB065920 [0,2,0,0,0,0|0,0,2]=4 170 B8R0.9 CCC(=O)CCC(=O)O SBB072628 [0,2,0,0,0,0|0,0,1]=3 171 B8R0.9 CNC(=O)CCC(=O)O SBB007999 [0,2,0,0,0,0|1,0,1]=4 172 B8R0.9 COC(=O)CCC(=O)O SBB061270 [0,2,0,0,0,0|1,0,1]=4 173 B8R0.9 COC(=O)\C=C\C(=O)O SBB065854 [0,2,0,0,0,0|1,0,1]=4 174 B8R0.9 NCC(=O)CCC(=O)O SBB003880 [0,2,0,0,0,0|1,0,1]=4 175 B8R0.9 NCC(=O)CCC(=O)O SBB071696 [0,2,0,0,0,0|1,0,1]=4 176 B8R0.9 NCC(=O)NCC(=O)O SBB067231 [0,2,0,0,0,0|2,0,0]=4 177 B8R0.9 OC(=O)\C=C/C(=O)NC SBB005847 [0,2,0,0,0,0|1,0,1]=4 178 B8R0.11 C(=O)\C(=C\CCC)CC SBB008156 [0,2,0,0,0,0|0,0,2]=4 179 B8R0.11 CCCCC(C=O)CC SBB060148 [0,2,0,0,0,0|0,0,2]=4 180 B8R0.5 CCCC(C)CC(=O)O SBB061321 [0,2,0,0,0,0|0,0,2]=4 181 B8R0.5 CCOC(=O)CC(=N)N SBB010259 [0,2,0,0,0,0|2,0,0]=4 182 B8R0.5 CCOC(=O)CC(=O)Cl SBB056440 [0,2,0,0,0,0|1,0,0]=3 183 B8R0.5 CCOC(=O)CC(=O)O SBB066094 [0,2,0,0,0,0|1,0,0]=3 184 B8R0.5 CCOC(=O)CC(C)=O SBB040867 [0,2,0,0,0,0|1,0,0]=3 185 B8R0.28 CC(=O)\C=C\C=C(C)C SBB008066 [0,2,0,0,0,0|0,0,2]=4 186 B8R0.28 CC(C)CCCC(=O)O SBB072713 [0,2,0,0,0,0|0,0,2]=4 187 B6R1.1 C1=COCCC1 SBB060381 [1,0,0,1,0,0|0,0,2]=4 188 B6R1.2 CC1=CN=CS1 SBB055804 [1,0,0,1,0,0|1,1,0]=4 189 B6R1.2 CN1C=CC=N1 SBB013729 [1,0,0,1,0,0|2,0,0]=4 190 B6R1.2 CN1C=CN=C1 SBB007574 [1,0,0,1,0,0|2,0,0]=4 191 B6R1.2 O=C1C=CCO1 SBB040281 [1,0,0,1,0,0|1,0,0]=3 192 B6R1.2 O=C1CCCC1 SBB040835 [1,0,0,1,0,0|0,0,1]=3 193 B6R1.2 O=C1CCCN1 SBB060296 [1,0,0,1,0,0|1,0,1]=4 194 B6R1.2 O=C1CCNN1 SBB007977 [1,0,0,1,0,0|2,0,0]=4 195 B6R1.2 O=C1CCSC1 SBB007947 [1,0,0,1,0,0|1,0,0]=3 196 B6R1.2 O=C1NC=CN1 SBB071638 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.2 C(=O)N1CCCCC1 SBB004316 [0,1,0,1,0,0|0,0,2]=4 198 B8R1.2 C(=O)N1CCNCC1 SBB027307 [0,1,0,1,0,0|1,0,1]=4 199 B8R1.2 C(=O)N1CCOCC1 SBB007670 [0,1,0,1,0,0|1,0,1]=4 200 B8R1.2 C=CC1CC=CCC1 SBB059892 [0,1,0,1,0,0|1,0,0]=3 201 B8R1.2 CCC1=CC=CC=C1 SBB040891 [0,1,0,1,0,0|1,0,1]=4 202 B8R1.2 CCC1=CC=CC=N1 SBB060373 [0,1,0,1,0,0|1,0,1]=4 203 B8R1.2 CCC1=CC=NC=C1 SBB061128 [0,1,0,1,0,0|1,0,1]=4 204 B8R1.2 CCC1=CN=CC=C1 SBB060374 [0,1,0,1,0,0|1,0,1]=4 205 B8R1.2 COC1C=CCCC1 SBB060461 [0,1,0,1,0,0|1,0,1]=4 206 B8R1.2 N#CC1CC=CCC1 SBB007998 [0,1,0,1,0,0|1,0,1]=4 207 B8R1.2 O=CC1=CCCOC1 SBB018863 [0,1,0,1,0,0|0,0,2]=4 208 B8R1.2 O=CC1CC=CCC1 SBB068360 [0,1,0,1,0,0|0,0,0]=2 209 B8R1.2 O=CC1CCNCC1 SBB052337 [0,1,0,1,0,0|0,0,2]=4 210 B8R1.2 O=CC1CCOCC1 SBB052321 [0,1,0,1,0,0|0,0,2]=4 211 B8R1.2 OCC1CC=CCC1 SBB054865 [0,1,0,1,0,0|0,0,2]=4 212 B8R1.5 CC1=CC=CNC1=O SBB040120 [0,1,0,1,0,0|0,0,2]=4 213 B8R1.5 CC1CCCCC1=O SBB058517 [0,1,0,1,0,0|0,0,2]=4 214 B8R1.5 CC1NCCNC1=O SBB080100 [0,1,0,1,0,0|1,0,1]=4 215 B8R1.5 CC1SCCNC1=O SBB111924 [0,1,0,1,0,0|1,0,1]=4 216 B8R1.5 O=C1CCCCC1Cl SBB061548 [0,1,0,1,0,0|0,0,2]=4 217 B8R1.8 CCCC1=CC=CS1 SBB073407 [0,1,0,1,0,0|0,1,1]=4 218 B8R1.8 CNCC1=CC=CO1 SBB079004 [0,1,0,1,0,0|0,0,2]=4 219 B8R1.8 NCCC1=CC=CO1 SBB013333 [0,1,0,1,0,0|0,0,2]=4 220 B8R1.8 NCCC1=CC=CS1 SBB013250 [0,1,0,1,0,0|0,1,1]=4 221 B8R1.8 NCCC1=CC=CS1 SBB013650 [0,1,0,1,0,0|0,1,1]=4 222 B8R1.8 NCCC1=CNC=N1 SBB003722 [0,1,0,1,0,0|2,0,0]=4 223 B8R1.8 NCCC1=CNC=N1 SBB012708 [0,1,0,1,0,0|2,0,0]=4 224 B8R1.8 NCCC1=CSC=C1 SBB109999 [0,1,0,1,0,0|2,0,0]=4 225 B8R1.8 OCCC1=CC=CS1 SBB062831 [0,1,0,1,0,0|0,1,1]=4 226 B8R1.11 C(=O)C1=NC=CN1C SBB004338 [0,1,0,1,0,0|1,0,1]=4 227 B8R1.11 CC1=C(C=O)C=CO1 SBB052277 [0,1,0,1,0,0|0,0,2]=4 228 B8R1.11 CC1=C(C=O)SC=C1 SBB040199 [0,1,0,1,0,0|0,0,2]=4 229 B8R1.11 CCC1=CNN=C1N SBB069760 [0,1,0,1,0,0|2,0,0]=4 230 B8R1.11 CN1C=CC=C1C=O SBB040239 [0,1,0,1,0,0|0,0,2]=4 231 B8R1.11 CN1C=NC=C1C=O SBB010122 [0,1,0,1,0,0|1,0,1]=4 232 B8R1.11 CN1N=CC=C1C=O SBB017366 [0,1,0,1,0,0|1,0,1]=4 233 B8R1.22 O=C1CCCCCC1 SBB060075 [0,1,0,1,0,0|0,0,2]=4 234 B8R1.22 O=C1CCCCCN1 SBB058658 [0,1,0,1,0,0|0,0,2]=4 235 B8R1.22 O=C1CCNCCN1 SBB056241 [0,1,0,1,0,0|1,0,1]=4 236 B8R1.49 C1=CCCC=CCC1 SBB059891 [0,1,0,1,0,0|1,0,0]=3 237 B8R1.49 C1=CCCCCCC1 SBB059890 [0,1,0,1,0,0|1,0,1]=4 238 B8R1.1 C(=O)C1=CC=C(C)S1 SBB004249 [0,1,0,1,0,0|0,0,2]=4 239 B8R1.1 CC1=CC=C(C=O)O1 SBB040222 [0,1,0,1,0,0|0,0,2]=4 240 B8R1.1 CCC1=CC(Br)=CS1 SBB073295 [0,1,0,1,0,0|0,1,1]=4 241 B8R1.1 CN1C=CC(C=O)=N1 SBB020577 [0,1,0,1,0,0|1,0,1]=4 242 B8R1.1 N[C@@H]1C=C[C@H](CO)C1 SBB054869 [0,1,0,1,0,0|0,0,2]=4 243 B8R1.3 CC1=NNC(=O)CC1 SBB043888 [0,1,0,1,0,0|2,0,0]=4 244 B8R1.3 CN1CCC(=O)CC1 SBB080527 [0,1,0,1,0,0|1,0,1]=4 245 B8R1.3 O=C1CCC(=O)CC1 SBB059391 [0,1,0,1,0,0|0,0,1]=3 246 B8R1.3 O=C1CCC(O)CC1 SBB056283 [0,1,0,1,0,0|0,0,2]=4 247 B8R1.3 O=C1CNC(=O)CN1 SBB079702 [0,1,0,1,0,0|2,0,0]=4 248 B8R1.50 CC1C(=O)CCC1=O SBB060744 [0,1,0,1,0,0|0,0,1]=3 249 B8R1.50 CN1C(=O)CN=C1S SBB032287 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.50 CN1C(=O)CNC1=S SBB046300 [0,1,0,1,0,0|2,0,0]=4 251 B8R1.50 CN1C(=O)CSC1=S SBB023537 [0,1,0,1,0,0|2,0,0]=4 252 B8R1.50 O=C1COC(=O)C1Cl SBB059534 [0,1,0,1,0,0|2,0,0]=4 253 B8R1.4 CC1=CC(=O)CCC1 SBB007736 [0,1,0,1,0,0|0,0,2]=4 254 B8R1.4 CC1=CC(=O)NC=C1 SBB004346 [0,1,0,1,0,0|1,0,1]=4 255 B8R1.4 CC1=CC=CC(=O)N1 SBB004345 [0,1,0,1,0,0|0,0,2]=4 256 B8R1.4 CC1=CC=NC(=O)N1 SBB004102 [0,1,0,1,0,0|1,0,1]=4 257 B8R1.4 NC1=CC(=O)CCC1 SBB028190 [0,1,0,1,0,0|0,0,2]=4 258 B8R1.4 O=C1CCCC(=O)C1 SBB061546 [0,1,0,1,0,0|0,0,1]=3 259 B8R1.4 O=C1CCCC(=O)O1 SBB060010 [0,1,0,1,0,0|1,0,1]=4 260 B8R1.4 O=C1CCNC(=O)N1 SBB007702 [0,1,0,1,0,0|2,0,0]=4 261 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [0,1,0,1,0,0|0,0,2]=4 262 B8R1.7 CC(N)C1=CC=CS1 SBB028228 [0,1,0,1,0,0|0,1,1]=4 263 B8R1.7 NC(=O)C1CCCN1 SBB004067 [0,1,0,1,0,0|1,0,1]=4 264 B8R1.7 NC(=O)[C@@H]1CCCN1 SBB006531 [0,1,0,1,0,0|1,0,1]=4 265 B8R1.7 O=C(O)C1C=CCN1 SBB053088 [0,1,0,1,0,0|1,0,0]=3 266 B8R1.7 O=C(O)C1CC=CC1 SBB008010 [0,1,0,1,0,0|0,0,2]=4 267 B8R1.7 O=C(O)C1CCCC1 SBB065782 [0,1,0,1,0,0|0,0,2]=4 268 B8R1.7 O=C(O)C1CCCO1 SBB004298 [0,1,0,1,0,0|1,0,1]=4 269 B8R1.7 O=C(O)C1CCNC1 SBB053378 [0,1,0,1,0,0|1,0,1]=4 270 B8R1.7 O=C(O)C1CCNC1 SBB069272 [0,1,0,1,0,0|1,0,1]=4 271 B8R1.7 O=C(O)C1CCOC1 SBB053083 [0,1,0,1,0,0|1,0,1]=4 272 B8R1.7 O=C(O)[C@H]1CCCN1 SBB006712 [0,1,0,1,0,0|1,0,1]=4 273 B8R1.7 O=C(O)[C@H]1CCNC1 SBB065825 [0,1,0,1,0,0|1,0,1]=4 274 B8R1.34 O=C(O)CC1CCC1 SBB050298 [0,1,0,1,0,0|0,0,2]=4 275 B8R1.18 CC1=CC(=O)C(C)O1 SBB055769 [0,1,0,1,0,0|1,0,1]=4 276 B8R1.18 CC1=NN(C)C(=O)C1 SBB055838 [0,1,0,1,0,0|2,0,0]=4 277 B8R1.18 CC1SC(=N)NC1=O SBB039661 [0,1,0,1,0,0|2,0,0]=4