0 B10R0.71 C(C=O)=CCCCCCCC CS-W016267 [0,0,0,0,0,0|0,0,2]=2 1 B10R0.71 CCCCCC=C=CCCO CS-1173691 [0,0,0,0,0,0|0,0,4]=4 2 B10R0.71 CCCCC\C=C\C=C\C=O CS-W014343 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.45 CC\C=C/CC\C=C\C=O CS-0185742 [1,0,0,0,0,0|0,0,3]=4 4 B11R0.40 CCCCCC\C=C\C(=O)OC CS-0152302 [0,1,0,0,0,0|2,0,1]=4 5 B11R0.148 CCCCCCC\C=C\C(=O)O CS-0534 [0,1,0,0,0,0|0,0,2]=3 6 B11R1.4 CCCCCCC1=CC=CS1 CS-W020022 [0,0,0,1,0,0|0,1,1]=3 7 B11R1.4 CCCCCCC1=CSC=C1 CS-W004388 [0,0,0,1,0,0|2,0,1]=4 8 B11R1.17 BrCCCC1=CC=CC=C1Br CS-0217098 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.17 CCCCC1=CC=CC=C1N CS-0313034 [0,0,0,1,0,0|1,0,1]=3 10 B11R1.17 CCCOC1=CC=CC=C1Br CS-0192013 [0,0,0,1,0,0|2,0,1]=4 11 B11R1.17 CCCOC1=CC=CC=C1N CS-0216358 [0,0,0,1,0,0|2,0,1]=4 12 B11R1.17 CCCOC1=CC=CC=C1N CS-0449840 [0,0,0,1,0,0|2,0,1]=4 13 B11R1.17 COCCC1=CC=CC=C1O CS-0150181 [0,0,0,1,0,0|1,0,2]=4 14 B11R1.17 OCCCC1=CC=CC=C1Br CS-W021756 [0,0,0,1,0,0|2,0,1]=4 15 B11R1.17 OCCCC1=CC=CC=C1Cl CS-0208633 [0,0,0,1,0,0|2,0,1]=4 16 B11R1.28 BrCCCCC1=CC=CC=C1 CS-W014977 [0,0,0,1,0,0|2,0,0]=3 17 B11R1.28 BrCCCOC1=CC=CC=C1 CS-0030579 [0,0,0,1,0,0|3,0,0]=4 18 B11R1.28 BrCCOCC1=CC=CC=C1 CS-W007388 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.28 CCCCCC1=CC=CC=N1 CS-W018168 [0,0,0,1,0,0|1,0,0]=2 20 B11R1.28 CCCCCC1=CC=NC=C1 CS-0182155 [0,0,0,1,0,0|2,0,0]=3 21 B11R1.28 CCCNCC1=CC=CC=C1 CS-0152067 [0,0,0,1,0,0|2,0,0]=3 22 B11R1.28 CCOCCC1=CC=CC=N1 CS-W018112 [0,0,0,1,0,0|2,0,0]=3 23 B11R1.28 ClCCCCC1=CC=CC=C1 CS-0128930 [0,0,0,1,0,0|2,0,0]=3 24 B11R1.28 ClCCOCC1=CC=CC=C1 CS-W017668 [0,0,0,1,0,0|3,0,0]=4 25 B11R1.28 NCCCOC1=CC=CC=C1 CS-0046980 [0,0,0,1,0,0|3,0,0]=4 26 B11R1.28 NCCNCC1=CC=CC=C1 CS-W010968 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.28 NCCOCC1=CC=CC=C1 CS-W003291 [0,0,0,1,0,0|3,0,0]=4 28 B11R1.28 NCCOCC1=CC=CC=C1 CS-W018620 [0,0,0,1,0,0|3,0,0]=4 29 B11R1.28 NCCSCC1=CC=CC=C1 CS-0270108 [0,0,0,1,0,0|3,0,0]=4 30 B11R1.28 OCCCCC1=CC=CC=C1 CS-W018137 [0,0,0,1,0,0|2,0,0]=3 31 B11R1.28 OCCCCC1=CC=NC=C1 CS-0028752 [0,0,0,1,0,0|3,0,0]=4 32 B11R1.28 OCCCCC1=CN=CC=C1 CS-0158352 [0,0,0,1,0,0|3,0,0]=4 33 B11R1.28 OCCCOC1=CC=CC=C1 CS-0128791 [0,0,0,1,0,0|3,0,0]=4 34 B11R1.28 OCCNCC1=CC=CC=C1 CS-W018111 [0,0,0,1,0,0|3,0,0]=4 35 B11R1.28 OCCOCC1=CC=CC=C1 CS-W007853 [0,0,0,1,0,0|3,0,0]=4 36 B11R1.28 OCCSCC1=CC=CC=C1 CS-0207458 [0,0,0,1,0,0|3,0,0]=4 37 B11R1.41 CCOC1=CC=CC=C1C=O CS-W018149 [0,0,0,1,0,0|1,0,2]=4 38 B11R1.41 O=CC1=CC=CC=C1CCBr CS-0171418 [0,0,0,1,0,0|1,0,2]=4 39 B8R0.4 CCCCCCCC=O CS-0138976 [2,0,0,0,0,0|0,0,2]=4 40 B8R0.4 CCCCC\C=C\C=O CS-0200283 [2,0,0,0,0,0|0,0,0]=2 41 B8R0.4 CCCCC\C=C\CO CS-0152366 [2,0,0,0,0,0|0,0,2]=4 42 B10R0.74 C=CC(=O)OCCCCCC CS-0167366 [1,1,0,0,0,0|1,0,1]=4 43 B10R0.74 CCCCC\C=C\C(=O)OC CS-0097187 [1,1,0,0,0,0|1,0,1]=4 44 B10R0.91 C=CCOC(=O)CCCCC CS-W014336 [1,1,0,0,0,0|1,0,1]=4 45 B12R0.234 O=C(O)\C=C\CCCCCCCO CS-0016772 [0,2,0,0,0,0|0,0,2]=4 46 B12R0.234 O=C(O)\C=C\CCCCCCCO CS-0648816 [0,2,0,0,0,0|0,0,2]=4 47 B10R1.4 CCCC1=CC=CC=C1N CS-0152410 [1,0,0,1,0,0|1,0,1]=4 48 B10R1.4 CCCC1=CC=CC=C1O CS-0236906 [1,0,0,1,0,0|0,0,2]=4 49 B10R1.17 BrCCCC1=CC=CC=C1 CS-0015315 [1,0,0,1,0,0|1,0,1]=4 50 B10R1.17 CCCCC1=CC=NC=C1 CS-0186972 [1,0,0,1,0,0|1,0,1]=4 51 B10R1.17 CCCC[N+]1=CC=CC=C1 CS-W010048 [1,0,0,1,0,0|1,0,0]=3 52 B10R1.17 CCCC[N+]1=CC=CC=C1 CS-W013103 [1,0,0,1,0,0|1,0,0]=3 53 B10R1.17 CCCC[N+]1=CC=CC=C1 CS-W014862 [1,0,0,1,0,0|1,0,0]=3 54 B10R1.17 CCCC[N+]1=CC=CC=C1 CS-W017638 [1,0,0,1,0,0|1,0,0]=3 55 B10R1.17 CCNCC1=CC=CC=C1 CS-W013340 [1,0,0,1,0,0|1,0,1]=4 56 B10R1.17 CCOCC1=CC=CC=C1 CS-W018329 [1,0,0,1,0,0|1,0,1]=4 57 B10R1.17 ClCCCC1=CC=CC=C1 CS-W016261 [1,0,0,1,0,0|1,0,1]=4 58 B10R1.17 ICCCC1=CC=CC=C1 CS-0187748 [1,0,0,1,0,0|1,0,1]=4 59 B10R1.17 NCCCC1=NC=CC=C1 CS-0006435 [1,0,0,1,0,0|2,0,0]=4 60 B10R1.17 OCCCC1=CC=CC=C1 CS-0015960 [1,0,0,1,0,0|1,0,1]=4 61 B10R1.17 OCCCC1=CC=CC=N1 CS-W000430 [1,0,0,1,0,0|2,0,0]=4 62 B10R1.20 CCC1=CC=CC=C1C=O CS-W007787 [1,0,0,1,0,0|0,0,2]=4 63 B10R1.21 CCCCCC1=CC=CO1 CS-0119428 [1,0,0,1,0,0|0,0,1]=3 64 B10R1.21 CCCCCC1=CC=CS1 CS-0128837 [1,0,0,1,0,0|0,1,0]=3 65 B12R1.8 BrCCCCCC1=CC=CC=C1 CS-0186084 [0,1,0,1,0,0|1,0,0]=3 66 B12R1.8 BrCCCCOC1=CC=CC=C1 CS-B0148 [0,1,0,1,0,0|2,0,0]=4 67 B12R1.8 BrCCCOCC1=CC=CC=C1 CS-W001590 [0,1,0,1,0,0|2,0,0]=4 68 B12R1.8 CCCCC#CC1=CC=CC=C1 CS-0152398 [0,1,0,1,0,0|1,0,1]=4 69 B12R1.8 CCCCCC[N+]1=CC=CC=C1 CS-0152323 [0,1,0,1,0,0|1,0,1]=4 70 B12R1.8 CCCCCC[N+]1=CC=CC=C1 CS-0378406 [0,1,0,1,0,0|1,0,1]=4 71 B12R1.8 CCCCCNC1=CC=CC=C1 CS-0152133 [0,1,0,1,0,0|1,0,0]=3 72 B12R1.8 NCCCCCC1=CC=CC=C1 CS-0096226 [0,1,0,1,0,0|1,0,0]=3 73 B12R1.8 NCCCNCC1=CC=CC=C1 CS-W022916 [0,1,0,1,0,0|2,0,0]=4 74 B12R1.8 OCCCNCC1=CC=CC=C1 CS-0067773 [0,1,0,1,0,0|2,0,0]=4 75 B12R1.8 OCCCOCC1=CC=CC=C1 CS-W004789 [0,1,0,1,0,0|2,0,0]=4 76 B12R1.121 CCCOC1=CC=CC=C1C=O CS-0084129 [0,1,0,1,0,0|0,0,2]=4 77 B12R1.267 OCCCCC1=CC=CC=C1Br CS-0139680 [0,1,0,1,0,0|1,0,1]=4 78 B12R1.372 CCCCCCC1=C(Br)SC=C1 CS-W008453 [0,1,0,1,0,0|1,0,1]=4 79 B12R1.28 CCCCOC1=CC(O)=CC=C1 CS-0113117 [0,1,0,1,0,0|1,0,1]=4 80 B12R1.28 NCCCCC1=CC=CC(Br)=C1 CS-0530533 [0,1,0,1,0,0|2,0,0]=4 81 B12R1.32 CCCC(=O)CC1=CC=CC=C1 CS-W016112 [0,1,0,1,0,0|1,0,1]=4 82 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 CS-0431735 [0,1,0,1,0,0|2,0,0]=4 83 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 CS-0669236 [0,1,0,1,0,0|2,0,0]=4 84 B12R1.69 CCCCC1=C(O)C=C(O)C=C1 CS-7786 [0,1,0,1,0,0|0,0,2]=4 85 B12R1.1 CCCCCC1=CC=C(Br)C=C1 CS-W010418 [0,1,0,1,0,0|1,0,0]=3 86 B12R1.1 CCCCCC1=CC=C(N)C=C1 CS-0159210 [0,1,0,1,0,0|1,0,0]=3 87 B12R1.1 CCCCCC1=CC=C(O)C=C1 CS-W010828 [0,1,0,1,0,0|1,0,0]=3 88 B12R1.1 CCCCOC1=CC=C(N)C=C1 CS-0152083 [0,1,0,1,0,0|2,0,0]=4 89 B12R1.1 CCCCOC1=CC=C(O)C=C1 CS-0000206 [0,1,0,1,0,0|2,0,0]=4 90 B12R1.1 FC1=CC=C(CCCCCl)C=C1 CS-0042392 [0,1,0,1,0,0|2,0,0]=4 91 B12R1.1 NCCCCC1=CC=C(Cl)C=C1 CS-0059809 [0,1,0,1,0,0|2,0,0]=4 92 B12R1.7 CCCCCCC1=CC=C(Br)S1 CS-W014115 [0,1,0,1,0,0|0,1,1]=4 93 B12R1.382 CCCOC1=CC=CC(C=O)=C1 CS-0206870 [0,1,0,1,0,0|1,0,1]=4 94 B12R1.30 CCCCC(=O)C1=CC=CC=C1 CS-W010853 [0,1,0,1,0,0|1,0,1]=4 95 B12R1.30 CCCCC(N)C1=CC=NC=C1 CS-0149940 [0,1,0,1,0,0|2,0,0]=4 96 B12R1.30 CNCCC(O)C1=CC=CC=C1 CS-0010500 [0,1,0,1,0,0|2,0,0]=4 97 B12R1.30 NC(CCCO)C1=CC=CC=C1 CS-0028348 [0,1,0,1,0,0|2,0,0]=4 98 B12R1.30 OCCCC(O)C1=CC=CC=C1 CS-0911446 [0,1,0,1,0,0|2,0,0]=4 99 B12R1.567 NCCCCN1C(=O)C=CC1=O CS-0158353 [0,1,0,1,0,0|2,0,0]=4 100 B12R1.567 NCCCCN1C(=O)C=CC1=O CS-0527143 [0,1,0,1,0,0|2,0,0]=4 101 B12R1.252 CC(C)CNCC1=CC=CC=C1 CS-0116902 [0,1,0,1,0,0|2,0,0]=4 102 B12R1.252 CC(C)OCCC1=NC=CC=C1 CS-0101421 [0,1,0,1,0,0|2,0,0]=4 103 B12R1.252 CC(O)COCC1=CC=CC=C1 CS-W017858 [0,1,0,1,0,0|2,0,0]=4 104 B12R1.252 O=C(O)\C=C\CN1CCCCC1 CS-0120306 [0,1,0,1,0,0|1,0,1]=4 105 B12R1.252 [C@@H](C)(O)COCC1=CC=CC=C1 CS-W017736 [0,1,0,1,0,0|2,0,0]=4 106 B12R1.252 [C@H](C)(O)COCC1=CC=CC=C1 CS-W017860 [0,1,0,1,0,0|2,0,0]=4 107 B12R2.2 C1=CC=C(C2CCCN2)C=C1 CS-W008926 [0,0,0,2,0,0|2,0,0]=4 108 B12R2.2 C1=CC=C(C2CCCN2)N=C1 CS-0210807 [0,0,0,2,0,0|2,0,0]=4 109 B12R2.2 C1=CC=C(C2CCNC2)C=C1 CS-0046245 [0,0,0,2,0,0|2,0,0]=4 110 B12R2.2 C1=CC=C(C2CCNC2)C=C1 CS-W002828 [0,0,0,2,0,0|2,0,0]=4 111 B12R2.2 C1=CC=C(N2CCCC2)C=C1 CS-0156106 [0,0,0,2,0,0|2,0,0]=4 112 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 CS-0042556 [0,0,0,2,0,0|2,0,0]=4 113 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 CS-W021168 [0,0,0,2,0,0|2,0,0]=4 114 B12R2.2 C1=CC=C([C@@H]2CCCN2)N=C1 CS-0197844 [0,0,0,2,0,0|2,0,0]=4 115 B12R2.2 C1=CC=C([C@@H]2CCNC2)C=C1 CS-0038202 [0,0,0,2,0,0|2,0,0]=4 116 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 CS-0156600 [0,0,0,2,0,0|2,0,0]=4 117 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 CS-W006442 [0,0,0,2,0,0|2,0,0]=4 118 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 CS-W019085 [0,0,0,2,0,0|2,0,0]=4 119 B12R2.2 C1=CN=C(C2CCNC2)C=C1 CS-0028223 [0,0,0,2,0,0|2,0,0]=4 120 B12R2.2 C1=CSC(N2CCCCC2)=C1 CS-0333691 [0,0,0,2,0,0|1,1,0]=4 121 B12R2.41 C1=CC=C2CCNCCC2=C1 CS-0139564 [0,0,0,2,0,0|2,0,0]=4 122 B12R2.41 C1=CC=C2NCCCCC2=C1 CS-0149007 [0,0,0,2,0,0|1,0,1]=4 123 B12R2.41 C1=CC=C2NCCCCC2=C1 CS-W005435 [0,0,0,2,0,0|1,0,1]=4 124 B12R2.41 C1=CN=C2CCCCCC2=C1 CS-0043610 [0,0,0,2,0,0|1,0,0]=3 125 B12R2.24 CC1CCC2=CC=CC=C2N1 CS-W019554 [0,0,0,2,0,0|1,0,1]=4 126 B12R2.1081 BrC1=CC=CC2=C1CCCC2 CS-0159081 [0,0,0,2,0,0|1,0,1]=4 127 B12R2.1081 CC1CCNC2=C1C=CC=C2 CS-0019301 [0,0,0,2,0,0|2,0,0]=4 128 B12R2.1081 CC1NCCC2=CC=CC=C21 CS-W002686 [0,0,0,2,0,0|2,0,0]=4 129 B12R2.1081 NC1CCCC2=C1C=CC=C2 CS-0131597 [0,0,0,2,0,0|2,0,0]=4 130 B12R2.1081 NC1CCCC2=CC=CC=C21 CS-W007739 [0,0,0,2,0,0|2,0,0]=4 131 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 CS-W007717 [0,0,0,2,0,0|2,0,0]=4 132 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 CS-0357434 [0,0,0,2,0,0|2,0,0]=4 133 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 CS-W008303 [0,0,0,2,0,0|2,0,0]=4 134 B12R2.1081 O=C1CCCC2=C1C=CC=C2 CS-0226151 [0,0,0,2,0,0|0,0,2]=4 135 B12R2.1081 O=C1CCCC2=C1C=CC=N2 CS-0006841 [0,0,0,2,0,0|1,0,1]=4 136 B12R2.1081 OC1=C2CCCCC2=CC=C1 CS-0132457 [0,0,0,2,0,0|0,0,2]=4 137 B12R2.1081 OC1CCCC2=CC=CC=C21 CS-W004317 [0,0,0,2,0,0|2,0,0]=4 138 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 CS-0079970 [0,0,0,2,0,0|2,0,0]=4 139 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 CS-0079961 [0,0,0,2,0,0|2,0,0]=4 140 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 CS-W007269 [0,0,0,2,0,0|0,0,2]=4 141 B12R2.27 OCC1CC1C2=CC=CC=C2 CS-0156344 [0,0,0,2,0,0|2,0,0]=4 142 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 CS-0156270 [0,0,0,2,0,0|2,0,0]=4 143 B12R2.18 CC1CC2=CC=CC=C2C1=O CS-W018228 [0,0,0,2,0,0|0,0,2]=4 144 B12R2.2048 O=CC1=CC=CC=C1C2CC2 CS-0112242 [0,0,0,2,0,0|0,0,2]=4