0 B9R0.37 CCC(CC)C(=O)OCCl D93086 [0,0,0,0,0,0|1,0,0]=1 1 B9R0.37 CCN(CC)C(=O)CC#N F11682 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.37 CCOC(=O)C(C=O)C=O 39194 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.37 CCOC(=O)C(CBr)CBr AB9223 [0,0,0,0,0,0|2,0,0]=2 4 B9R0.37 CCOC(=O)[C@@H](C#N)CC AB11285 [0,0,0,0,0,0|1,0,1]=2 5 B8R0.3 C=C(CBr)C(=O)OCC 60939 [1,0,0,0,0,0|1,0,2]=4 6 B8R0.3 C=C(CO)C(=O)OCC 35200 [1,0,0,0,0,0|1,0,2]=4 7 B8R0.3 CCCC(=O)N(C)OC F19920 [1,0,0,0,0,0|3,0,0]=4 8 B8R0.3 CCOC(=O)C(=O)CBr 23027 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.3 CCOC(=O)C(=O)CC RB3244 [1,0,0,0,0,0|1,0,1]=3 10 B8R0.3 CCOC(=O)C(=O)NC W11374 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.3 CCOC(=O)[C@@H](Br)CBr AB2839 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.3 CCOC(=O)[C@@H](Br)CC D70575 [1,0,0,0,0,0|1,0,0]=2 13 B8R0.3 CCOC(=O)[C@@H](C)C=O O11759 [1,0,0,0,0,0|1,0,1]=3 14 B8R0.3 CCOC(=O)[C@@H](Cl)C=O 52355 [1,0,0,0,0,0|2,0,1]=4 15 B8R0.3 CCOC(=O)[C@@H](N)CC 29271 [1,0,0,0,0,0|1,0,0]=2 16 B8R0.3 CCOC(=O)[C@@H](N)CC 90200 [1,0,0,0,0,0|1,0,0]=2 17 B8R0.3 CCOC(=O)[C@@H](N)CC D84487 [1,0,0,0,0,0|1,0,0]=2 18 B8R0.3 CCOC(=O)[C@@H](N)CO FD3048 [1,0,0,0,0,0|2,0,0]=3 19 B8R0.3 CCOC(=O)[C@@H](N)CO FD3050 [1,0,0,0,0,0|2,0,0]=3 20 B8R0.3 CCOC(=O)[C@@H](N)CO FD3052 [1,0,0,0,0,0|2,0,0]=3 21 B8R0.3 CCOC(=O)[C@@H](N)CS AT20237 [1,0,0,0,0,0|2,0,0]=3 22 B8R0.3 CCOC(=O)[C@@H](N)CS D70639 [1,0,0,0,0,0|2,0,0]=3 23 B8R0.3 CCOC(=O)[C@H](C)C#N 23129 [1,0,0,0,0,0|1,0,1]=3 24 B8R0.3 C\C=C(/C)C(=O)OCC D94746 [1,0,0,0,0,0|0,0,2]=3 25 B8R0.11 CCCCN(CC)CC D94767 [1,0,0,0,0,0|2,0,1]=4 26 B8R0.11 CCCC[C@H](CC)CBr D77662 [1,0,0,0,0,0|2,0,1]=4 27 B8R0.11 CCCC[C@H](CC)CCl D89423 [1,0,0,0,0,0|2,0,1]=4 28 B8R0.11 CCCC[C@H](CC)CN D90440 [1,0,0,0,0,0|2,0,1]=4 29 B8R0.11 CCCC[C@H](CC)CO D72516 [1,0,0,0,0,0|2,0,1]=4 30 B8R0.11 CCCC[C@H](CC)CS D90586 [1,0,0,0,0,0|2,0,1]=4 31 B8R0.20 CCN(CC)C(=O)CCl F14859 [1,0,0,0,0,0|2,0,0]=3 32 B8R0.20 CCN(CC)C(=O)CO W17359 [1,0,0,0,0,0|2,0,0]=3 33 B8R0.20 COC(=O)C(CBr)CBr 64019 [1,0,0,0,0,0|2,0,0]=3 34 B8R0.20 COC(=O)C(OC)OC 39412 [1,0,0,0,0,0|2,0,0]=3 35 B10R0.33 CCOC(=O)[C@@H](C#N)CC#N 35727 [0,1,0,0,0,0|1,0,2]=4 36 B10R0.101 CCOC(=O)[C@@H](C#N)C(C)=O I10196 [0,1,0,0,0,0|1,0,2]=4 37 B10R0.101 CCOC(=O)[C@@H](C#N)C(C)C W12765 [0,1,0,0,0,0|1,0,1]=3 38 B10R0.101 CCOC(=O)[C@@H](CC)C(C)=O O11754 [0,1,0,0,0,0|0,0,1]=2 39 B10R0.130 CCOC(=O)C(Br)(CC)CC C13923 [0,1,0,0,0,0|0,0,0]=1 40 B10R0.130 CCOC(=O)C(C)(CC)CC D92942 [0,1,0,0,0,0|0,0,0]=1 41 B10R1.11 CCNC(=O)[C@@H]1CCCN1 73274 [0,0,0,1,0,0|2,0,0]=3 42 B10R1.11 CCOC(=O)C1CC=CC1 H11362 [0,0,0,1,0,0|0,0,2]=3 43 B10R1.11 CCOC(=O)[C@@H]1CCCN1 73266 [0,0,0,1,0,0|1,0,0]=2 44 B10R1.11 CCOC(=O)[C@@H]1CCCN1 F10609 [0,0,0,1,0,0|1,0,0]=2 45 B10R1.11 CCOC(=O)[C@@H]1CCCO1 F19887 [0,0,0,1,0,0|1,0,0]=2 46 B10R1.11 CCOC(=O)[C@@H]1CSCN1 F17226 [0,0,0,1,0,0|2,0,0]=3 47 B10R1.11 CCOC(=O)[C@H]1CCNC1 23797 [0,0,0,1,0,0|1,0,0]=2 48 B10R1.11 CCOC(=O)[C@H]1CCNC1 90547 [0,0,0,1,0,0|1,0,0]=2 49 B10R1.11 CCOC(=O)[C@H]1CCNC1 90548 [0,0,0,1,0,0|1,0,0]=2 50 B10R1.405 CCOC(=O)C1(C#N)CC1 11063 [0,0,0,1,0,0|1,0,1]=3 51 B10R1.405 CCOC(=O)C1(CN)CC1 29520 [0,0,0,1,0,0|1,0,0]=2 52 B10R1.405 CCOC(=O)C1(CN)CC1 82504 [0,0,0,1,0,0|1,0,0]=2 53 B7R0.5 CC(C)C(=O)OCBr D94295 [2,0,0,0,0,0|1,0,0]=3 54 B7R0.5 CC(C)C(=O)OCCl P11842 [2,0,0,0,0,0|1,0,0]=3 55 B7R0.5 CCCC(=O)C(C)C D91358 [2,0,0,0,0,0|1,0,0]=3 56 B7R0.5 CCOC(=O)C(C)=O D72526 [2,0,0,0,0,0|1,0,1]=4 57 B7R0.5 CCOC(=O)C(F)F FD2077 [2,0,0,0,0,0|2,0,0]=4 58 B7R0.5 CCOC(=O)N(C)C A10839 [2,0,0,0,0,0|1,0,0]=3 59 B7R0.5 CCOC(=O)[C@@H](F)Br 76577 [2,0,0,0,0,0|2,0,0]=4 60 B7R0.5 CCOC(=O)[C@@H](F)Cl 76578 [2,0,0,0,0,0|2,0,0]=4 61 B7R0.5 CCOC(=O)[C@H](C)Br D96513 [2,0,0,0,0,0|1,0,0]=3 62 B7R0.5 CCOC(=O)[C@H](C)F 28664 [2,0,0,0,0,0|1,0,0]=3 63 B7R0.5 CCOC(=O)[C@H](C)F AT11657 [2,0,0,0,0,0|1,0,0]=3 64 B7R0.5 CCOC(=O)[C@H](C)I D90599 [2,0,0,0,0,0|1,0,0]=3 65 B7R0.5 CCOC(=O)[C@H](C)N 75100 [2,0,0,0,0,0|1,0,0]=3 66 B7R0.5 CCOC(=O)[C@H](C)N FD21011 [2,0,0,0,0,0|1,0,0]=3 67 B7R0.5 CCOC(=O)[C@H](C)N FD21071 [2,0,0,0,0,0|1,0,0]=3 68 B7R0.5 CCOC(=O)[C@H](C)O 35087 [2,0,0,0,0,0|1,0,0]=3 69 B7R0.5 CCOC(=O)[C@H](C)S D81899 [2,0,0,0,0,0|1,0,0]=3 70 B7R0.7 C=CCC(=O)OCC 74919 [2,0,0,0,0,0|0,0,2]=4 71 B7R0.7 CC#CC(=O)OCC 33793 [2,0,0,0,0,0|0,0,2]=4 72 B7R0.7 CCCC(=O)OCCl F20378 [2,0,0,0,0,0|1,0,0]=3 73 B7R0.7 CCNC(=O)NCC F11262 [2,0,0,0,0,0|2,0,0]=4 74 B7R0.7 CCOC(=O)CCBr F11254 [2,0,0,0,0,0|1,0,0]=3 75 B7R0.7 CCOC(=O)CCCl D89381 [2,0,0,0,0,0|1,0,0]=3 76 B7R0.7 CCOC(=O)CCI 23721 [2,0,0,0,0,0|1,0,0]=3 77 B7R0.7 CCOC(=O)CCN AC7506 [2,0,0,0,0,0|1,0,0]=3 78 B7R0.7 CCOC(=O)CCO 30936 [2,0,0,0,0,0|1,0,0]=3 79 B7R0.7 CCOC(=O)CCS D87716 [2,0,0,0,0,0|1,0,0]=3 80 B7R0.7 CCOC(=O)CNC 73271 [2,0,0,0,0,0|1,0,0]=3 81 B7R0.7 CCOC(=O)CNN 35068 [2,0,0,0,0,0|2,0,0]=4 82 B7R0.7 CCOC(=O)COC F11239 [2,0,0,0,0,0|1,0,0]=3 83 B7R0.7 CCOC(=O)CSC I10203 [2,0,0,0,0,0|1,0,0]=3 84 B7R0.7 CCOC(=O)OCC D97668 [2,0,0,0,0,0|1,0,0]=3 85 B7R0.7 CCOC(=O)OCCl 23781 [2,0,0,0,0,0|2,0,0]=4 86 B7R0.7 CCO[PH](=O)OCC 28436 [2,0,0,0,0,0|2,0,0]=4 87 B7R0.7 [C-]#[N+]CC(=O)OCC 23174 [2,0,0,0,0,0|1,0,1]=4 88 B7R0.10 CCC(=O)C(=O)CC D90906 [2,0,0,0,0,0|1,0,1]=4 89 B7R0.10 CCC(=O)C(=O)OC F16310 [2,0,0,0,0,0|1,0,1]=4 90 B7R0.10 CCC(=O)N(C)OC AR3350 [2,0,0,0,0,0|2,0,0]=4 91 B7R0.10 CCC(=O)[C@@H](O)CC D92050 [2,0,0,0,0,0|1,0,0]=3 92 B7R0.10 CC[C@H](Br)C(=O)OC H11989 [2,0,0,0,0,0|1,0,0]=3 93 B7R0.10 CC[C@H](N)C(=O)OC 63264 [2,0,0,0,0,0|1,0,0]=3 94 B7R0.10 CC[C@H](N)C(=O)OC F11947 [2,0,0,0,0,0|1,0,0]=3 95 B7R0.10 CC[C@H](N)C(=O)OC H10859 [2,0,0,0,0,0|1,0,0]=3 96 B7R0.10 CC[C@H](O)C(=O)OC D94650 [2,0,0,0,0,0|1,0,0]=3 97 B7R0.10 CN[C@@H](C)C(=O)OC D84599 [2,0,0,0,0,0|1,0,0]=3 98 B7R0.10 CN[C@@H](C)C(=O)OC FD21060 [2,0,0,0,0,0|1,0,0]=3 99 B7R0.10 COC(=O)[C@@H](Br)CBr AB2902 [2,0,0,0,0,0|2,0,0]=4 100 B7R0.10 COC(=O)[C@@H](Br)CO D84458 [2,0,0,0,0,0|2,0,0]=4 101 B7R0.10 COC(=O)[C@@H](C)CBr D70325 [2,0,0,0,0,0|1,0,0]=3 102 B7R0.10 COC(=O)[C@@H](C)CN E72583 [2,0,0,0,0,0|1,0,0]=3 103 B7R0.10 COC(=O)[C@@H](C)CO F12962 [2,0,0,0,0,0|1,0,0]=3 104 B7R0.10 COC(=O)[C@@H](C)CO TD8064 [2,0,0,0,0,0|1,0,0]=3 105 B7R0.10 COC(=O)[C@@H](F)CO 36756 [2,0,0,0,0,0|2,0,0]=4 106 B7R0.10 COC(=O)[C@@H](N)CCl FD3091 [2,0,0,0,0,0|2,0,0]=4 107 B7R0.10 COC(=O)[C@@H](N)CCl O11861 [2,0,0,0,0,0|2,0,0]=4 108 B7R0.10 COC(=O)[C@@H](N)CN D83300 [2,0,0,0,0,0|2,0,0]=4 109 B7R0.10 COC(=O)[C@@H](N)CO 20054 [2,0,0,0,0,0|2,0,0]=4 110 B7R0.10 COC(=O)[C@@H](N)CO 20056 [2,0,0,0,0,0|2,0,0]=4 111 B7R0.10 COC(=O)[C@@H](N)CO 39397 [2,0,0,0,0,0|2,0,0]=4 112 B7R0.10 COC(=O)[C@@H](N)CO AB7436 [2,0,0,0,0,0|2,0,0]=4 113 B7R0.10 COC(=O)[C@@H](N)CS 27842 [2,0,0,0,0,0|2,0,0]=4 114 B7R0.10 COC(=O)[C@@H](N)CS FD21234 [2,0,0,0,0,0|2,0,0]=4 115 B7R0.10 COC(=O)[C@@H](N)CS H10905 [2,0,0,0,0,0|2,0,0]=4 116 B7R0.10 COC(=O)[C@@H](O)CO 24991 [2,0,0,0,0,0|2,0,0]=4 117 B7R0.10 COC(=O)[C@H](C)OC AT18834 [2,0,0,0,0,0|1,0,0]=3 118 B7R0.15 CCC(CC)C(=O)[O-] RB3137 [2,0,0,0,0,0|0,0,1]=3 119 B7R0.15 CCC(CC)C(C)=O N12324 [2,0,0,0,0,0|0,0,0]=2 120 B7R0.15 CCN(CC)C(C)=O H11276 [2,0,0,0,0,0|1,0,0]=3 121 B7R0.15 CCN(CC)C(N)=O D89884 [2,0,0,0,0,0|2,0,0]=4 122 B7R0.15 CN[C@@H](CO)C(=O)O D97539 [2,0,0,0,0,0|2,0,0]=4 123 B7R0.15 O=C(O)C(CBr)CBr S10906 [2,0,0,0,0,0|2,0,0]=4 124 B9R0.6 CCOC(=O)C(=O)C(C)C 76551 [1,1,0,0,0,0|1,0,1]=4 125 B9R0.6 CCOC(=O)[C@@H](Br)C(C)=O D97591 [1,1,0,0,0,0|1,0,1]=4 126 B9R0.6 CCOC(=O)[C@@H](Br)C(C)C 33249 [1,1,0,0,0,0|1,0,0]=3 127 B9R0.6 CCOC(=O)[C@@H](C)C(C)=O F11259 [1,1,0,0,0,0|0,0,1]=3 128 B9R0.6 CCOC(=O)[C@@H](Cl)C(C)=O D77847 [1,1,0,0,0,0|1,0,1]=4 129 B9R0.6 CCOC(=O)[C@@H](F)C(C)=O AT18756 [1,1,0,0,0,0|1,0,1]=4 130 B9R0.6 CCOC(=O)[C@@H](N)C(C)C D82384 [1,1,0,0,0,0|1,0,0]=3 131 B9R0.6 CCOC(=O)[C@@H](N)C(C)C F16291 [1,1,0,0,0,0|1,0,0]=3 132 B9R0.6 CCOC(=O)[C@@H](N)C(C)C I11507 [1,1,0,0,0,0|1,0,0]=3 133 B9R0.6 CCOC(=O)[C@@H](N)[C@@H](C)O AB10194 [1,1,0,0,0,0|1,0,0]=3 134 B9R0.6 CCOC(=O)[C@H](C)[N+](=O)[O-] D74922 [1,1,0,0,0,0|2,0,0]=4 135 B9R0.8 CCCOC(=O)[C@@H](C)CC D92159 [1,1,0,0,0,0|0,0,0]=2 136 B9R0.19 CCOC(=O)C(C)(C)C#N 30607 [1,1,0,0,0,0|1,0,1]=4 137 B9R0.19 CCOC(=O)C(C)(C)CN 54140 [1,1,0,0,0,0|1,0,0]=3 138 B9R0.19 CCOC(=O)C(C)(C)CN D95025 [1,1,0,0,0,0|1,0,0]=3 139 B9R0.19 CCOC(=O)C(C)(C)CO A11089 [1,1,0,0,0,0|1,0,0]=3 140 B9R0.19 CCOC(=O)C(F)(F)CBr D79192 [1,1,0,0,0,0|2,0,0]=4 141 B9R0.19 CCOC(=O)C(F)(F)CN 32241 [1,1,0,0,0,0|2,0,0]=4 142 B9R0.35 C=CC[C@H](C)C(=O)OCC D90556 [1,1,0,0,0,0|0,0,1]=3 143 B9R0.35 CCCC(=O)C(=O)OCC 34423 [1,1,0,0,0,0|1,0,1]=4 144 B9R0.35 CCCC(=O)[C@@H](O)CCC D88723 [1,1,0,0,0,0|2,0,0]=4 145 B9R0.35 CCC[C@H](Br)C(=O)OCC H11305 [1,1,0,0,0,0|1,0,0]=3 146 B9R0.35 CCC[C@H](N)C(=O)OCC 64698 [1,1,0,0,0,0|1,0,0]=3 147 B9R0.35 CCC[C@H](O)C(=O)OCC D90546 [1,1,0,0,0,0|1,0,0]=3 148 B9R0.35 CCOC(=N)C(=O)OCC 36102 [1,1,0,0,0,0|1,0,1]=4 149 B9R0.35 CCOC(=O)[C@@H](Br)CCBr AB1432 [1,1,0,0,0,0|1,0,0]=3 150 B9R0.35 CCOC(=O)[C@H](Cl)OCC F20949 [1,1,0,0,0,0|1,0,0]=3 151 B9R0.29 COC(=O)[C@@H](OC)C(C)=O I11234 [1,1,0,0,0,0|1,0,1]=4 152 B9R0.69 CCC(N)(CC)C(=O)OC 20959 [1,1,0,0,0,0|0,0,0]=2 153 B9R0.69 COC(=O)C(C)(OC)OC O11855 [1,1,0,0,0,0|2,0,0]=4 154 B11R0.61 CCCC(CCC)C(=O)OCC D97543 [0,2,0,0,0,0|0,0,0]=2 155 B11R0.61 CCOC(=O)C(OCC)OCC 39379 [0,2,0,0,0,0|0,0,0]=2 156 B11R0.191 CCCC[C@H](C#N)C(=O)OCC D93234 [0,2,0,0,0,0|1,0,1]=4 157 B11R0.191 CCCC[C@H](CC)C(=O)OCC C74530 [0,2,0,0,0,0|0,0,0]=2 158 B9R1.5 CN1CCCCCC1=O F20350 [1,0,0,1,0,0|2,0,0]=4 159 B9R1.5 N[C@H]1CCCCNC1=O 36347 [1,0,0,1,0,0|2,0,0]=4 160 B9R1.5 N[C@H]1CCCCNC1=O 52018 [1,0,0,1,0,0|2,0,0]=4 161 B9R1.5 N[C@H]1CCCCNC1=O A56019 [1,0,0,1,0,0|2,0,0]=4 162 B9R1.5 N[C@H]1CCCCNC1=O A56021 [1,0,0,1,0,0|2,0,0]=4 163 B9R1.5 N[C@H]1CCCCNC1=O Y10023 [1,0,0,1,0,0|2,0,0]=4 164 B9R1.15 CC[C@@H]1NCCNC1=O 60848 [1,0,0,1,0,0|2,0,0]=4 165 B9R1.15 CC[C@H]1CCCCC1=O D97760 [1,0,0,1,0,0|1,0,0]=3 166 B9R1.15 CO[C@H]1CCCCC1=O P19682 [1,0,0,1,0,0|2,0,0]=4 167 B9R1.73 CCOC(=O)C1CCC1 11047 [1,0,0,1,0,0|0,0,0]=2 168 B9R1.73 CCOC(=O)C1CNC1 60712 [1,0,0,1,0,0|1,0,0]=3 169 B9R1.74 CCOC(=O)C1(Br)CC1 95835 [1,0,0,1,0,0|1,0,0]=3 170 B9R1.74 CCOC(=O)C1(C)CC1 F14047 [1,0,0,1,0,0|0,0,0]=2 171 B9R1.74 CCOC(=O)C1(N)CC1 83037 [1,0,0,1,0,0|1,0,0]=3 172 B9R1.74 CCOC(=O)C1(N)CC1 FD1022 [1,0,0,1,0,0|1,0,0]=3 173 B9R1.74 CCOC(=O)C1(O)CC1 70470 [1,0,0,1,0,0|1,0,0]=3 174 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1F CS3357 [1,0,0,1,0,0|1,0,0]=3 175 B9R1.27 CCC1C(=O)CCC1=O A10931 [1,0,0,1,0,0|1,0,1]=4 176 B9R1.190 COC(=O)C1(C#N)CC1 82610 [1,0,0,1,0,0|1,0,1]=4 177 B11R1.15 CCOC(=O)N1CCC(=O)C1 28479 [0,1,0,1,0,0|1,0,1]=4 178 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 34526 [0,1,0,1,0,0|1,0,1]=4 179 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 39406 [0,1,0,1,0,0|1,0,1]=4 180 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 71075 [0,1,0,1,0,0|1,0,1]=4 181 B11R1.15 CCOC(=O)[C@@H]1CNC(=O)C1 64862 [0,1,0,1,0,0|1,0,1]=4 182 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](F)CN1 37993 [0,1,0,1,0,0|1,0,0]=3 183 B11R1.15 CCOC(=O)[C@@H]1C[C@@H](O)CN1 FD21744 [0,1,0,1,0,0|1,0,0]=3 184 B11R1.15 CCOC(=O)[C@H]1CCC(=O)C1 20312 [0,1,0,1,0,0|0,0,1]=3 185 B11R1.16 CCNC(=O)[C@H]1CCCNC1 W15273 [0,1,0,1,0,0|1,0,0]=3 186 B11R1.16 CCOC(=O)C1CCNCC1 F14112 [0,1,0,1,0,0|0,0,0]=2 187 B11R1.16 CCOC(=O)C1CCNCC1 P20835 [0,1,0,1,0,0|0,0,0]=2 188 B11R1.16 CCOC(=O)C1CCOCC1 30966 [0,1,0,1,0,0|0,0,0]=2 189 B11R1.16 CCOC(=O)C1SCCCS1 D89899 [0,1,0,1,0,0|1,0,0]=3 190 B11R1.16 CCOC(=O)N1CCCCC1 20551 [0,1,0,1,0,0|1,0,0]=3 191 B11R1.16 CCOC(=O)N1CCNCC1 78221 [0,1,0,1,0,0|1,0,0]=3 192 B11R1.16 CCOC(=O)[C@@H]1CCC=CO1 P10339 [0,1,0,1,0,0|0,0,2]=4 193 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 29023 [0,1,0,1,0,0|0,0,0]=2 194 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 60949 [0,1,0,1,0,0|0,0,0]=2 195 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 60950 [0,1,0,1,0,0|0,0,0]=2 196 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 C13687 [0,1,0,1,0,0|0,0,0]=2 197 B11R1.16 CCOC(=O)[C@@H]1CNCCN1 26454 [0,1,0,1,0,0|1,0,0]=3 198 B11R1.16 CCOC(=O)[C@@H]1CNCCO1 S11343 [0,1,0,1,0,0|1,0,0]=3 199 B11R1.16 CCOC(=O)[C@@H]1COCCN1 77677 [0,1,0,1,0,0|1,0,0]=3 200 B11R1.16 CCOC(=O)[C@@H]1COCCN1 AC2331 [0,1,0,1,0,0|1,0,0]=3 201 B11R1.16 CCOC(=O)[C@@H]1CSCCN1 66702 [0,1,0,1,0,0|1,0,0]=3 202 B11R1.16 CCOC(=O)[C@H]1CCCNC1 11177 [0,1,0,1,0,0|0,0,0]=2 203 B11R1.16 CCOC(=O)[C@H]1CCCNC1 20042 [0,1,0,1,0,0|0,0,0]=2 204 B11R1.16 CCOC(=O)[C@H]1CCCNC1 23876 [0,1,0,1,0,0|0,0,0]=2 205 B11R1.16 CCOC(=O)[C@H]1CCCNC1 38517 [0,1,0,1,0,0|0,0,0]=2 206 B11R1.16 CCOC(=O)[C@H]1CCCNC1 49557 [0,1,0,1,0,0|0,0,0]=2 207 B11R1.16 CCOC(=O)[C@H]1CCCNC1 49559 [0,1,0,1,0,0|0,0,0]=2 208 B11R1.16 CCOC(=O)[C@H]1CCCNC1 60919 [0,1,0,1,0,0|0,0,0]=2 209 B11R1.16 CCOC(=O)[C@H]1CCCNC1 AR2228 [0,1,0,1,0,0|0,0,0]=2 210 B11R1.16 CCOC(=O)[C@H]1CCCNC1 C10795 [0,1,0,1,0,0|0,0,0]=2 211 B11R1.16 CCOC(=O)[C@H]1CCCOC1 F52662 [0,1,0,1,0,0|0,0,0]=2 212 B11R1.16 CCOC(=S)N1CCCCC1 D84112 [0,1,0,1,0,0|1,1,0]=4 213 B11R1.199 CCOC(=O)C1=C(N)CCC1 AT23521 [0,1,0,1,0,0|0,0,2]=4 214 B11R1.199 CCOC(=O)C1CCCC1N D75786 [0,1,0,1,0,0|0,0,0]=2 215 B11R1.199 CCOC(=O)[C@@H]1CCCC1=O TD8086 [0,1,0,1,0,0|0,0,1]=3 216 B11R1.199 CCOC(=O)[C@@H]1CCOC1=O D82353 [0,1,0,1,0,0|1,0,1]=4 217 B11R1.199 CCOC(=O)[C@@H]1CNCC1=O 36549 [0,1,0,1,0,0|1,0,1]=4 218 B11R1.199 CCOC(=O)[C@@H]1COCC1=O 72464 [0,1,0,1,0,0|1,0,1]=4 219 B11R1.199 CCOC(=O)[C@@H]1CSCC1=O 69818 [0,1,0,1,0,0|1,0,1]=4 220 B11R1.831 CCOC(=O)C1(CO)CCC1 F31331 [0,1,0,1,0,0|1,0,0]=3 221 B11R1.31 CON(C)C(=O)C1CCCC1 72326 [0,1,0,1,0,0|2,0,0]=4 222 B11R1.381 CCN1CCCC[C@H](N)C1=O 60756 [0,1,0,1,0,0|2,0,0]=4 223 B11R1.381 CCN1CCCC[C@H](N)C1=O 66025 [0,1,0,1,0,0|2,0,0]=4 224 B11R1.166 CC1=CC(=O)[C@H](C(C)C)CC1 D92155 [0,1,0,1,0,0|1,0,1]=4 225 B11R1.166 CC1CCC(C(C)C)C(=O)C1 E70428 [0,1,0,1,0,0|1,0,0]=3 226 B11R1.835 CCOC(=O)C1(C(=O)O)CC1 F31334 [0,1,0,1,0,0|1,0,1]=4 227 B11R2.202 O=C1OC(=O)[C@@H]2CCC[C@H]12 AT11428 [0,0,0,2,0,0|1,0,1]=4 228 B9R0.34 CCOC(=O)CC(=O)CC 28527 [1,0,0,0,0,1|1,0,1]=4 229 B9R0.34 CCOC(=O)C[C@H](O)CCl 23033 [1,0,0,0,0,1|2,0,0]=4 230 B9R0.34 CCOC(=O)C[C@H](O)CCl 23075 [1,0,0,0,0,1|2,0,0]=4 231 B9R0.34 CCOC(=O)\C=C(/C)NC AC7636 [1,0,0,0,0,1|1,0,1]=4 232 B11R0.9 CCOC(=O)NCC(OC)OC AB3743 [0,0,0,0,0,2|2,0,0]=4 233 B11R0.9 CCOC(=O)\C=C\C(OC)OC A11340 [0,0,0,0,0,2|2,0,0]=4