0 B10R0.4 CC(=O)OCCCCCC=C CSC000037147 [0,0,0,0,0,0|2,0,2]=4 1 B10R0.4 CCCCCCCNC(=O)C CSC009862821 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.4 CCCCCCCNC(=O)N CSC009878357 [0,0,0,0,0,0|2,0,0]=2 3 B10R0.4 CCCCCCCOC(=O)C CSC000036323 [0,0,0,0,0,0|2,0,0]=2 4 B10R0.4 CCCCOCCOC(=O)C CSC000032999 [0,0,0,0,0,0|3,0,0]=3 5 B10R0.4 COCCOCCOC(=O)C CSC000062832 [0,0,0,0,0,0|4,0,0]=4 6 B9R0.2 CCCCCCCC(=O)N CSC011216093 [1,0,0,0,0,0|1,0,0]=2 7 B9R0.2 CCCCCCOC(=O)C CSC000032130 [1,0,0,0,0,0|2,0,0]=3 8 B9R0.2 CCOCCCNC(=O)C CSC000161218 [1,0,0,0,0,0|3,0,0]=4 9 B9R0.45 CCCCCCSCCO CSC011304839 [1,0,0,0,0,0|1,0,1]=3 10 B9R0.45 CSCCCCCCSC CSC000036278 [1,0,0,0,0,0|3,0,0]=4 11 B11R0.40 CCCCCCCCC(=O)NN CSC011203378 [0,1,0,0,0,0|1,0,0]=2 12 B11R0.40 CCCCCCCCC(=O)OC CSC011215467 [0,1,0,0,0,0|0,0,0]=1 13 B11R0.40 CCCCCCCOC(=O)CC CSC000054044 [0,1,0,0,0,0|2,0,0]=3 14 B11R0.46 CCCCNC(=O)CCC(=O)O CSC000199522 [0,1,0,0,0,0|1,0,1]=3 15 B11R0.46 CCCCNC(=O)NCC(=O)O CSC011205310 [0,1,0,0,0,0|2,0,1]=4 16 B11R0.46 CCCCOC(=O)CCC(=O)C CSC011212340 [0,1,0,0,0,0|2,0,1]=4 17 B11R0.46 COCCNC(=O)CCC(=O)O CSC011309817 [0,1,0,0,0,0|2,0,1]=4 18 B11R0.148 CCCCCCCCCC(=O)N CSC011216713 [0,1,0,0,0,0|1,0,0]=2 19 B11R0.148 CCOCCOCCOC(=O)C CSC000032835 [0,1,0,0,0,0|3,0,0]=4 20 B11R0.159 CCCCCCCNS(=O)(=O)C CSC009866289 [0,1,0,0,0,0|2,0,1]=4 21 B11R0.176 CCCC(=O)OCCCC(=O)C CSC000031040 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.53 CC(=O)N1CCCCC1CN CSC011552701 [0,0,0,1,0,0|3,0,0]=4 23 B11R1.53 CCC1CCCCN1C(=O)N CSC000748989 [0,0,0,1,0,0|2,0,0]=3 24 B11R1.53 CCN1CCOCC1C(=O)N CSC009986905 [0,0,0,1,0,0|3,0,0]=4 25 B11R1.57 CC(=O)NC1CCCC1CN CSC011781717 [0,0,0,1,0,0|3,0,0]=4 26 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1O CSC013036222 [0,0,0,1,0,0|3,0,0]=4 27 B11R1.86 CC(=O)N[C@H]1CCCC[C@@H]1O CSC013036315 [0,0,0,1,0,0|3,0,0]=4 28 B11R1.86 CC(O)CN1CCCCC1C CSC000242616 [0,0,0,1,0,0|2,0,1]=4 29 B11R1.86 CC1CCCCC1CC(=O)N CSC000055404 [0,0,0,1,0,0|1,0,0]=2 30 B11R1.86 CC1CCCCC1NC(=O)N CSC000184843 [0,0,0,1,0,0|2,0,0]=3 31 B11R1.86 CC1CCCCN1CC(=C)C CSC046267867 [0,0,0,1,0,0|3,0,0]=4 32 B11R1.86 CC1CCCCN1CC(=O)C CSC000180633 [0,0,0,1,0,0|2,0,0]=3 33 B11R1.86 CC1CCCCN1CC(=O)N CSC000174848 [0,0,0,1,0,0|2,0,0]=3 34 B11R1.86 C[C@@H]1COCCN1CC(=O)N CSC015632764 [0,0,0,1,0,0|3,0,0]=4 35 B11R1.86 NC(=O)N[C@@H]1CCCC[C@H]1O CSC012282429 [0,0,0,1,0,0|3,0,0]=4 36 B11R1.86 NC(=O)N[C@H]1CCCC[C@@H]1O CSC012281937 [0,0,0,1,0,0|3,0,0]=4 37 B11R1.86 N[C@H]1CCCC[C@@H]1NC(=O)N [0,0,0,1,0,0|3,0,0]=4 38 B11R1.90 CC(=O)NCC1CCCC1O CSC012367623 [0,0,0,1,0,0|3,0,0]=4 39 B11R1.90 CN1CCCC1CNC(=O)N CSC011528812 [0,0,0,1,0,0|3,0,0]=4 40 B11R1.91 CC(=O)NCC1CCCCC1 CSC000159420 [0,0,0,1,0,0|2,0,0]=3 41 B11R1.91 CC(=O)NCC1CCCNC1 CSC011207013 [0,0,0,1,0,0|3,0,0]=4 42 B11R1.91 CC(=O)NCC1CCNCC1 CSC011206997 [0,0,0,1,0,0|3,0,0]=4 43 B11R1.91 CC(=O)OCC1CCCCC1 CSC000000618 [0,0,0,1,0,0|2,0,0]=3 44 B11R1.91 CC(=O)OCC1CCCCO1 CSC000006128 [0,0,0,1,0,0|3,0,0]=4 45 B11R1.91 CC(O)CSC1CCCCC1 CSC011366878 [0,0,0,1,0,0|2,0,1]=4 46 B11R1.91 NC(=O)CCC1CCCCC1 CSC000162346 [0,0,0,1,0,0|1,0,0]=2 47 B11R1.91 NC(=O)CCC1CCNCC1 CSC000695769 [0,0,0,1,0,0|2,0,0]=3 48 B11R1.91 NC(=O)CSC1CCCCC1 CSC000149379 [0,0,0,1,0,0|2,0,0]=3 49 B11R1.91 NC(=O)NCC1CCCCO1 CSC011512277 [0,0,0,1,0,0|3,0,0]=4 50 B11R1.91 NC(=O)NCC1CCCSC1 CSC015335565 [0,0,0,1,0,0|3,0,0]=4 51 B11R1.91 NC(=O)NCC1CCSCC1 CSC011991091 [0,0,0,1,0,0|3,0,0]=4 52 B11R1.143 CC1CCSCCN1C(=O)N CSC016019756 [0,0,0,1,0,0|3,0,0]=4 53 B11R1.193 CNCC1CCCN1C(=O)C CSC012662834 [0,0,0,1,0,0|3,0,0]=4 54 B11R1.193 CSCC1CCCN1C(=O)N CSC015948896 [0,0,0,1,0,0|3,0,0]=4 55 B11R1.742 CC(=O)NC1CCCCCC1 CSC000161067 [0,0,0,1,0,0|2,0,0]=3 56 B11R1.742 CC(O)CN1CCCCCC1 CSC011366126 [0,0,0,1,0,0|2,0,1]=4 57 B11R1.742 NC(=O)CC1CCCCCC1 CSC012282423 [0,0,0,1,0,0|1,0,0]=2 58 B11R1.742 NC(=O)NC1CCCCCC1 CSC000238987 [0,0,0,1,0,0|2,0,0]=3 59 B8R0.4 CCCCCCCSC CSC000033844 [2,0,0,0,0,0|1,0,1]=4 60 B8R0.4 CCCCCCSCC CSC000073868 [2,0,0,0,0,0|1,0,1]=4 61 B8R0.4 CCCCCSCCO CSC011215970 [2,0,0,0,0,0|1,0,0]=3 62 B8R0.4 CCCCSCCCC CSC000025195 [2,0,0,0,0,0|1,0,1]=4 63 B8R0.4 CCSCCOCCO CSC011409966 [2,0,0,0,0,0|2,0,0]=4 64 B8R0.4 CSCCCCCCO CSC012179070 [2,0,0,0,0,0|1,0,0]=3 65 B10R0.74 CCCCCCCC(=O)NN CSC000181853 [1,1,0,0,0,0|1,0,0]=3 66 B10R0.74 CCCCCCCC(=O)OC CSC011217195 [1,1,0,0,0,0|0,0,0]=2 67 B10R0.74 CCCCCCNC(=O)NC CSC000235370 [1,1,0,0,0,0|2,0,0]=4 68 B10R0.74 CCOCCSCC(=O)OC CSC000001124 [1,1,0,0,0,0|2,0,0]=4 69 B10R0.78 CCCCC(=O)NCC(=O)O CSC000205572 [1,1,0,0,0,0|1,0,1]=4 70 B10R0.97 CC(=O)NCCCCC(=O)O CSC011593336 [1,1,0,0,0,0|1,0,1]=4 71 B10R0.71 CCCCCCCSCCO CSC011304838 [1,1,0,0,0,0|0,0,1]=3 72 B10R0.71 CCCCSCCOCCO CSC011409991 [1,1,0,0,0,0|1,0,1]=4 73 B12R0.2 CCCNC(=O)CC(C)CC(=O)O CSC011778250 [0,2,0,0,0,0|1,0,1]=4 74 B12R0.44 CC(C)CCNC(=O)CCC(=O)O CSC000199397 [0,2,0,0,0,0|1,0,1]=4 75 B12R0.1 CCCCCCCCC(=O)OCC CSC011218606 [0,2,0,0,0,0|0,0,0]=2 76 B12R0.1 CCCCCCCCS(=O)CCO CSC009995003 [0,2,0,0,0,0|1,0,0]=3 77 B12R0.183 COC(=O)CCCCCC(=O)OC CSC000032064 [0,2,0,0,0,0|1,0,1]=4 78 B12R0.248 CCCCCCCCCC(=O)NN CSC011221126 [0,2,0,0,0,0|1,0,0]=3 79 B12R0.248 CCCCCCCCCC(=O)OC CSC011215519 [0,2,0,0,0,0|0,0,0]=2 80 B12R0.248 CCCCCCCCOC(=O)CC CSC000054043 [0,2,0,0,0,0|1,0,0]=3 81 B12R0.248 CCCCCCCSCC(=O)OC CSC000048336 [0,2,0,0,0,0|0,0,0]=2 82 B12R0.251 CCCCCCCOC(=O)C(C)C CSC000053816 [0,2,0,0,0,0|2,0,0]=4 83 B12R0.98 CSCCC(C)N(C)CCC(=O)O CSC012954040 [0,2,0,0,0,0|2,0,0]=4 84 B12R0.255 CSCCCCC(=O)NCC(=O)O CSC019889757 [0,2,0,0,0,0|1,0,1]=4 85 B12R0.255 CSCCCNC(=O)CCC(=O)O CSC011957421 [0,2,0,0,0,0|1,0,1]=4 86 B12R0.645 CCCCCS(=O)(=O)NCC(=O)O CSC010439251 [0,2,0,0,0,0|2,0,0]=4 87 B12R0.277 CCCC(=O)NCCSCC(=O)O CSC012905717 [0,2,0,0,0,0|1,0,1]=4 88 B12R0.233 CCCSCC(=O)NCCC(=O)O CSC012904872 [0,2,0,0,0,0|1,0,1]=4 89 B12R0.234 CCCCCCCCCOC(=O)C CSC000210669 [0,2,0,0,0,0|1,0,0]=3 90 B12R0.234 CCCCCCCCSCC(=O)N CSC046179943 [0,2,0,0,0,0|1,0,0]=3 91 B12R0.172 CCCS(=O)(=O)NCCCC(=O)O CSC000165800 [0,2,0,0,0,0|2,0,0]=4 92 B10R1.18 CC(=O)CN1CCCCC1 CSC000180294 [1,0,0,1,0,0|2,0,0]=4 93 B10R1.18 CC(=O)NC1CCCCC1 CSC000158227 [1,0,0,1,0,0|2,0,0]=4 94 B10R1.18 CC(=O)OC1CCCCC1 CSC000026541 [1,0,0,1,0,0|2,0,0]=4 95 B10R1.18 NC(=O)CC1CCCCO1 CSC000725203 [1,0,0,1,0,0|2,0,0]=4 96 B10R1.18 NC(=O)OC1CCCCC1 CSC000123476 [1,0,0,1,0,0|2,0,0]=4 97 B10R1.39 CCC1CCCN1C(=O)N CSC011386413 [1,0,0,1,0,0|2,0,0]=4 98 B10R1.39 CCC1NCCC1C(=O)N CSC015706231 [1,0,0,1,0,0|2,0,0]=4 99 B10R1.39 CCN1CCC[C@H]1C(=O)N CSC015708101 [1,0,0,1,0,0|2,0,0]=4 100 B10R1.61 CC1CCCCN1C(=O)N CSC000238911 [1,0,0,1,0,0|2,0,0]=4 101 B10R1.61 CC1NCCCC1C(=O)N CSC012079615 [1,0,0,1,0,0|2,0,0]=4 102 B10R1.61 CC1OCCCC1C(=O)N CSC016159393 [1,0,0,1,0,0|2,0,0]=4 103 B10R1.66 NC(=O)CCC1CCCC1 CSC000162258 [1,0,0,1,0,0|1,0,0]=3 104 B10R1.66 NC(=O)COC1CCCC1 CSC011347441 [1,0,0,1,0,0|2,0,0]=4 105 B10R1.348 CC(=O)N1CCCCCC1 CSC000157747 [1,0,0,1,0,0|2,0,0]=4 106 B10R1.348 NC(=O)C1CCCCCC1 CSC011707493 [1,0,0,1,0,0|1,0,0]=3 107 B10R1.4 CC1CCCCN1CCO CSC011305533 [1,0,0,1,0,0|1,0,1]=4 108 B10R1.17 CCSCC1CCCCO1 CSC015326925 [1,0,0,1,0,0|1,0,1]=4 109 B10R1.17 OCCSC1CCCCC1 CSC011304845 [1,0,0,1,0,0|1,0,1]=4 110 B12R1.107 CN(CC(=O)O)C1CCCCC1 CSC046177201 [0,1,0,1,0,0|1,0,0]=3 111 B12R1.438 CCC1CCCC(C1)NC(=O)C CSC012142909 [0,1,0,1,0,0|2,0,0]=4 112 B12R1.1392 CC(=O)NC1CCCCCCC1 CSC000160966 [0,1,0,1,0,0|1,0,0]=3 113 B12R1.1392 NC(=O)NC1CCCCCCC1 CSC000238964 [0,1,0,1,0,0|1,0,0]=3 114 B12R1.226 CC1CCCC(C1)CNC(=O)C CSC011466721 [0,1,0,1,0,0|2,0,0]=4 115 B12R1.226 CC1CCCN(C1)CCC(=O)O CSC025718150 [0,1,0,1,0,0|1,0,0]=3 116 B12R1.391 CC1(CCCCC1CC(=O)N)C CSC016162106 [0,1,0,1,0,0|1,0,0]=3 117 B12R1.392 CC(O)CC1CCCN1C(=O)C CSC012594064 [0,1,0,1,0,0|2,0,0]=4 118 B12R1.924 CC(=O)NCC1CCCC1(C)C CSC015968451 [0,1,0,1,0,0|2,0,0]=4 119 B12R1.27 CNC(=O)CCC1CCCNC1 CSC011533958 [0,1,0,1,0,0|2,0,0]=4 120 B12R1.27 COC(=O)CCN1CCOCC1 CSC000177612 [0,1,0,1,0,0|2,0,0]=4 121 B12R1.27 COC(=O)CSC1CCCCC1 CSC000173156 [0,1,0,1,0,0|1,0,0]=3 122 B12R1.27 NNC(=O)CCC1CCCCC1 CSC000186192 [0,1,0,1,0,0|1,0,0]=3 123 B12R1.77 CCC1CCCCC1C(=O)NC CSC015914215 [0,1,0,1,0,0|1,0,0]=3 124 B12R1.353 CNC(=O)NCC1CCCC1C CSC014234560 [0,1,0,1,0,0|2,0,0]=4 125 B12R1.371 CCC(=O)NC1CCCCC1C CSC000161644 [0,1,0,1,0,0|2,0,0]=4 126 B12R1.371 CNC(=O)CC1CCCCC1C CSC015366596 [0,1,0,1,0,0|1,0,0]=3 127 B12R1.371 CNC(=O)NC1CCCCC1C CSC000235251 [0,1,0,1,0,0|2,0,0]=4 128 B12R1.371 COC(=O)CN1CCCCC1C CSC000227854 [0,1,0,1,0,0|1,0,0]=3 129 B12R1.371 OCC(=O)N[C@@H]1CCCC[C@H]1O CSC015480343 [0,1,0,1,0,0|2,0,0]=4 130 B12R1.371 OCC(=O)N[C@H]1CCCC[C@@H]1O CSC016157977 [0,1,0,1,0,0|2,0,0]=4 131 B12R1.477 COC(=O)CCCN1CCCC1 CSC011293840 [0,1,0,1,0,0|1,0,0]=3 132 B12R1.1659 COC(=O)C1CCCCCCC1 CSC012181116 [0,1,0,1,0,0|0,0,0]=2 133 B12R1.1748 CCC(=O)NC1CCCCCC1 CSC000161071 [0,1,0,1,0,0|2,0,0]=4 134 B12R1.1748 CNC(=O)CC1CCCCCC1 CSC012651756 [0,1,0,1,0,0|1,0,0]=3 135 B12R1.1748 CNC(=O)CC1CCCNCC1 CSC015248807 [0,1,0,1,0,0|2,0,0]=4 136 B12R1.1748 CNC(=O)NC1CCCCCC1 CSC000235309 [0,1,0,1,0,0|2,0,0]=4 137 B12R1.1748 COC(=O)CN1CCCCCC1 CSC000223722 [0,1,0,1,0,0|1,0,0]=3 138 B12R1.43 OC(=O)C(=O)NC1CCCCC1 CSC011297149 [0,1,0,1,0,0|1,0,1]=4 139 B12R1.124 CC1CCCCN1C(=O)C(=O)O CSC011297153 [0,1,0,1,0,0|1,0,1]=4 140 B12R1.2197 OC(=O)C(=O)N1CCCCCC1 CSC011297163 [0,1,0,1,0,0|1,0,1]=4 141 B12R1.54 OC(=O)CCC(=O)N1CCCC1 CSC000187315 [0,1,0,1,0,0|1,0,1]=4 142 B12R1.3110 CC(=O)NCC1(CCCCC1)C CSC012768579 [0,1,0,1,0,0|2,0,0]=4 143 B12R1.21 CC1CCC(CC1)CNC(=O)C CSC011466729 [0,1,0,1,0,0|2,0,0]=4 144 B12R1.21 CC1CCN(CC1)CCC(=O)O CSC000740328 [0,1,0,1,0,0|1,0,0]=3 145 B12R1.368 CCC(=O)N1CCCC1C(=O)O CSC000194913 [0,1,0,1,0,0|1,0,1]=4 146 B12R1.368 CCC(=O)N1CCC[C@@H]1C(=O)O CSC011790441 [0,1,0,1,0,0|1,0,1]=4 147 B12R1.368 CCC(=O)N1CCC[C@H]1C(=O)O CSC011417223 [0,1,0,1,0,0|1,0,1]=4 148 B12R1.1020 CC1CCCC(CC1)NC(=O)C CSC013883875 [0,1,0,1,0,0|2,0,0]=4 149 B12R1.125 CC1CCCCC1CNC(=O)C CSC011500032 [0,1,0,1,0,0|1,0,0]=3 150 B12R1.125 CC1CCCCN1CCC(=O)O CSC000727554 [0,1,0,1,0,0|0,0,0]=2 151 B12R1.125 CC1COCCC1CNC(=O)C CSC015246556 [0,1,0,1,0,0|2,0,0]=4 152 B12R1.252 CC(=O)NCCC1CCNCC1 CSC011370063 [0,1,0,1,0,0|2,0,0]=4 153 B12R1.252 CC(=O)OCCC1CCCCC1 CSC009881819 [0,1,0,1,0,0|1,0,0]=3 154 B12R1.252 CC(O)CNCC1CCCCC1 CSC000202053 [0,1,0,1,0,0|1,0,1]=4 155 B12R1.252 NC(=O)CCCC1CCCCC1 CSC000162275 [0,1,0,1,0,0|1,0,0]=3 156 B12R1.75 CCC1CCCCC1NC(=O)C CSC011265613 [0,1,0,1,0,0|1,0,0]=3 157 B12R1.75 CCC1CCCCN1CC(C)O CSC011366229 [0,1,0,1,0,0|1,0,1]=4 158 B12R1.75 CCC1CCCCN1C[C@H](C)O CSC013227944 [0,1,0,1,0,0|1,0,1]=4 159 B12R1.255 CC(=O)NCCCN1CCCC1 CSC000207323 [0,1,0,1,0,0|2,0,0]=4 160 B12R1.283 CC(=O)N1CCCCC1CCN CSC011917731 [0,1,0,1,0,0|2,0,0]=4 161 B12R1.283 CC(=O)N1CCCCC1CCO CSC011241323 [0,1,0,1,0,0|2,0,0]=4 162 B12R1.283 CCCN1CCCCC1C(C)O CSC021905944 [0,1,0,1,0,0|1,0,1]=4 163 B12R2.1365 NC(=O)N1C2CCC1CCC2 CSC016092221 [0,0,0,2,0,0|2,0,0]=4 164 B12R2.1392 NC(=O)C1CC2CCC1CC2 CSC009978441 [0,0,0,2,0,0|1,0,0]=3 165 B12R2.1362 NC(=O)N1CCC2C1CCC2 CSC015220631 [0,0,0,2,0,0|2,0,0]=4