0 B9R0.35 CCOC(=O)C(=O)OCC AMY37179 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.35 CCOC(=O)[C@@H](N)CCO AMY38418 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.1 CCC#CC(=O)OCC AMY1274 [1,0,0,0,0,0|1,0,2]=4 3 B8R0.1 CCOC(=O)CCCBr AM84904 [1,0,0,0,0,0|2,0,1]=4 4 B8R0.1 CCOC(=O)CCCN AM808169 [1,0,0,0,0,0|2,0,1]=4 5 B8R0.1 CCOC(=O)CCCO AMY4323 [1,0,0,0,0,0|2,0,1]=4 6 B8R0.1 CCOC(=O)\C=C\CBr AMF0008 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.1 CCOCC(=O)OCC AMY4116 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.3 C=C(CBr)C(=O)OCC AMY39543 [1,0,0,0,0,0|3,0,0]=4 9 B8R0.3 CCCC(=O)N(C)OC AM90018 [1,0,0,0,0,0|3,0,0]=4 10 B8R0.3 CCC[C@H](N)C(=O)OC AM82602 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.3 CCOC(=O)C(=O)CBr AMY866 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.3 CCOC(=O)C(=O)CC AM20080427 [1,0,0,0,0,0|1,0,0]=2 13 B10R0.19 CCCCC(=O)C(=O)OCC AM85828 [0,1,0,0,0,0|1,0,0]=2 14 B10R0.19 CCCCC(=O)[C@@H](C)CCC AMY19310 [0,1,0,0,0,0|1,0,1]=3 15 B10R0.19 CCOC(=O)[C@@H](N)CCCN AM82631 [0,1,0,0,0,0|2,0,1]=4 16 B10R0.19 CCOC(=O)[C@@H](N)CCSC AM81985 [0,1,0,0,0,0|2,0,1]=4 17 B10R0.19 CCOC(=O)[C@@H](N)CCSC AM81986 [0,1,0,0,0,0|2,0,1]=4 18 B10R0.32 CCOC(=O)C(=O)CC(C)=O AM85846 [0,1,0,0,0,0|1,0,1]=3 19 B10R0.32 CCOC(=O)C(=O)CC(C)C AM85684 [0,1,0,0,0,0|1,0,0]=2 20 B10R0.32 CCOC(=O)[C@@H](N)CC(C)C AM81878 [0,1,0,0,0,0|2,0,1]=4 21 B10R0.32 CCOC(=O)[C@@H](N)CC(C)C AM81879 [0,1,0,0,0,0|2,0,1]=4 22 B10R0.32 CCOC(=O)[C@@H](O)CC(C)C AMY22057 [0,1,0,0,0,0|1,0,2]=4 23 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC AMY28715 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.2 CN1C(=O)CCC[C@@H]1CN AMY35058 [0,0,0,1,0,0|3,0,0]=4 25 B10R1.2 CN1CCC[C@H](CO)C1=O AMY16162 [0,0,0,1,0,0|3,0,0]=4 26 B10R1.4 NCCN1CCCCC1=O AM806192 [0,0,0,1,0,0|3,0,0]=4 27 B10R1.7 O=C1NCCCCC[C@@H]1Cl AMY2428 [0,0,0,1,0,0|2,0,1]=4 28 B10R1.11 CCOC(=O)C1=CCCC1 AM802851 [0,0,0,1,0,0|2,0,0]=3 29 B10R1.11 CCOC(=O)[C@@H]1CCCN1 AM82198 [0,0,0,1,0,0|2,0,1]=4 30 B10R1.11 CCOC(=O)[C@@H]1CCCN1 AM82199 [0,0,0,1,0,0|2,0,1]=4 31 B10R1.11 CCOC(=O)[C@@H]1CCCO1 AM9878 [0,0,0,1,0,0|1,0,2]=4 32 B10R1.212 CCOC(=O)C(C)=C1CC1 AM806695 [0,0,0,1,0,0|2,0,1]=4 33 B10R1.212 CN(C(=O)CCN)C1CC1 AM806424 [0,0,0,1,0,0|3,0,0]=4 34 B10R1.401 CCOC(=O)C1(Br)CCC1 AMY23810 [0,0,0,1,0,0|2,0,1]=4 35 B10R0.2 CCC\C(N)=C\C(=O)OCC AMY39750 [0,0,0,0,0,1|2,0,0]=3 36 B10R0.2 CCOC(=N)CC(=O)OCC AMY32481 [0,0,0,0,0,1|3,0,0]=4 37 B10R0.2 CCOC(=O)CC(=O)OCC AMY37124 [0,0,0,0,0,1|2,0,0]=3 38 B10R0.2 CCOC(=O)NC(=O)CC#N AMY861 [0,0,0,0,0,1|2,0,1]=4 39 B10R0.2 CCOC(=O)\C=C(/N)OCC AM10152 [0,0,0,0,0,1|3,0,0]=4 40 B7R0.3 CCCOC(=O)CC AMY21939 [2,0,0,0,0,0|1,0,0]=3 41 B7R0.7 CCCC(=O)CCC AMY3807 [2,0,0,0,0,0|0,0,0]=2 42 B7R0.7 CCCC(N)CCC AMY3864 [2,0,0,0,0,0|1,0,1]=4 43 B7R0.7 CCCC(O)CCC AMY23531 [2,0,0,0,0,0|0,0,2]=4 44 B7R0.7 CCNC(=O)NCC AMY25735 [2,0,0,0,0,0|2,0,0]=4 45 B7R0.7 CCOC(=O)CCN AM803889 [2,0,0,0,0,0|2,0,0]=4 46 B7R0.7 CCOC(=O)CCO AMY20483 [2,0,0,0,0,0|2,0,0]=4 47 B7R0.7 CCOC(=O)CNC AM82644 [2,0,0,0,0,0|2,0,0]=4 48 B7R0.7 CCOC(=O)CNC AMY3815 [2,0,0,0,0,0|2,0,0]=4 49 B7R0.7 CCOC(=O)COC AMY3969 [2,0,0,0,0,0|2,0,0]=4 50 B7R0.7 CCOC(=O)CSC AMY33462 [2,0,0,0,0,0|2,0,0]=4 51 B7R0.7 CCOC(=O)OCC AMY11101 [2,0,0,0,0,0|2,0,0]=4 52 B7R0.7 O=C(CCCl)CCCl AMY9352 [2,0,0,0,0,0|2,0,0]=4 53 B7R0.5 CCCC(=O)C(=O)O AMY6081 [2,0,0,0,0,0|1,0,0]=3 54 B7R0.5 CCOC(=O)C(C)=O AMY40824 [2,0,0,0,0,0|1,0,0]=3 55 B7R0.5 CCOC(=O)C(N)=O AM20100509 [2,0,0,0,0,0|2,0,0]=4 56 B7R0.10 COC(=O)C(=O)CBr AMY30900 [2,0,0,0,0,0|2,0,0]=4 57 B7R0.10 COC(=O)C(=O)OC AMY37133 [2,0,0,0,0,0|2,0,0]=4 58 B9R0.4 CCCCC(=O)CC(C)C AMY19268 [1,1,0,0,0,0|0,0,1]=3 59 B9R0.5 CCOC(=O)CCCCBr AM20080354 [1,1,0,0,0,0|1,0,1]=4 60 B9R0.5 CCO\C=C\C(=O)OCC AMY9319 [1,1,0,0,0,0|1,0,1]=4 61 B9R0.5 CCO\N=C\C(=O)OCC AMY13649 [1,1,0,0,0,0|2,0,0]=4 62 B9R0.18 CCCNC(=O)NCCC AMY853 [1,1,0,0,0,0|1,0,0]=3 63 B9R0.66 CCCSS(=O)(=O)CCC AMY21457 [1,1,0,0,0,0|2,0,0]=4 64 B9R0.6 CCOC(=O)C(=O)[C@H](C)Br AMY202100100 [1,1,0,0,0,0|1,0,0]=3 65 B9R0.23 COC(=O)C(=O)CC(C)=O AMY3225 [1,1,0,0,0,0|1,0,1]=4 66 B11R0.1 CCOC(=O)CC(=O)CC(C)C AM20090520 [0,1,0,0,0,1|1,0,0]=3 67 B11R0.177 C=C(C(=O)OCC)C(=O)OCC AMY23765 [0,1,0,0,0,1|2,0,0]=4 68 B11R0.177 CCOC(=O)C(=O)C(=O)OCC AMY601 [0,1,0,0,0,1|2,0,0]=4 69 B11R0.177 CCOC(=O)C(Br)C(=O)OCC AMY4081 [0,1,0,0,0,1|2,0,0]=4 70 B11R0.177 CCOC(=O)C(C)C(=O)OCC AMY4051 [0,1,0,0,0,1|2,0,0]=4 71 B11R0.177 CCOC(=O)C(F)C(=O)OCC AM20100635 [0,1,0,0,0,1|2,0,0]=4 72 B11R0.177 CCOC(=O)C(N)C(=O)OCC AMY10715 [0,1,0,0,0,1|2,0,0]=4 73 B11R0.155 CCCCCC(=O)C(=O)OCC AM85553 [0,2,0,0,0,0|1,0,0]=3 74 B11R0.58 CCOC(=O)C(=O)[C@@H](Cl)C(C)=O AM80996 [0,2,0,0,0,0|1,0,1]=4 75 B11R0.186 CCOC(=O)C(=O)OC(C)(C)C AMY3696 [0,2,0,0,0,0|2,0,0]=4 76 B9R1.2 O=C1CCC[C@@H](CO)N1 AMY16344 [1,0,0,1,0,0|2,0,0]=4 77 B9R1.2 O=C1CCC[C@H](CO)C1 AMY18909 [1,0,0,1,0,0|1,0,1]=4 78 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16343 [1,0,0,1,0,0|2,0,0]=4 79 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16345 [1,0,0,1,0,0|2,0,0]=4 80 B9R1.8 NCCC1=CCCCC1 AMY14247 [1,0,0,1,0,0|2,0,0]=4 81 B9R1.15 CO[C@H]1CCCNC1=O AM20090301 [1,0,0,1,0,0|2,0,0]=4 82 B9R1.33 NCCN1CCCC1=O AMY19233 [1,0,0,1,0,0|2,0,0]=4 83 B9R1.33 O=C1CCCN1CCBr AM20210013 [1,0,0,1,0,0|2,0,0]=4 84 B9R1.49 CN1CCCC(=O)CC1 AM20090140 [1,0,0,1,0,0|1,0,1]=4 85 B9R1.50 O=C1CCCCCCC1 AMY3996 [1,0,0,1,0,0|0,0,1]=3 86 B9R1.50 O=C1CCCCCCN1 AM20100621 [1,0,0,1,0,0|1,0,0]=3 87 B9R1.69 CC1CC(=O)CCC1O AM806654 [1,0,0,1,0,0|1,0,1]=4 88 B9R1.73 CCOC(=O)C1CCC1 AM20070593 [1,0,0,1,0,0|1,0,1]=4 89 B9R1.73 O=C(CCCl)N1CCC1 AM806404 [1,0,0,1,0,0|2,0,0]=4 90 B9R1.75 CCOC(=O)C=C1CC1 AMY37969 [1,0,0,1,0,0|1,0,1]=4 91 B9R1.75 CCOC(=O)CC1CC1 AMY4002 [1,0,0,1,0,0|1,0,1]=4 92 B9R1.100 CCCNC(=O)C1CC1 AMY790 [1,0,0,1,0,0|1,0,0]=3 93 B9R1.11 COC(=O)C1=CCCC1 AM20090313 [1,0,0,1,0,0|2,0,0]=4 94 B9R1.132 CCC1=C(O)C(=O)CC1 AM84771 [1,0,0,1,0,0|0,0,2]=4 95 B11R1.30 CCOC(=O)C=C1CCCC1 AMY32158 [0,0,0,1,0,1|2,0,0]=4 96 B11R1.199 CCOC(=O)[C@@H]1CCCC1=O AM20100487 [0,0,0,1,0,1|1,0,0]=3 97 B11R1.199 CCOC(=O)[C@@H]1CCNC1=O AMY10123 [0,0,0,1,0,1|2,0,0]=4 98 B11R1.199 CCOC(=O)[C@@H]1CSCC1=O AMY32120 [0,0,0,1,0,1|2,0,0]=4 99 B11R1.334 CCOC(=O)CC(=O)C1CC1 AM20090284 [0,0,0,1,0,1|1,0,0]=3 100 B11R1.464 CCC1C(=O)NC(=O)NC1Cl AMY30698 [0,0,0,1,0,1|2,0,0]=4 101 B11R1.16 CCOC(=O)C1=CCCCC1 AMY31886 [0,1,0,1,0,0|2,0,0]=4 102 B11R1.16 CCOC(=O)C1=CCNCC1 AMY32015 [0,1,0,1,0,0|2,0,0]=4 103 B11R0.62 CCOC(=O)\C=C/C(=O)OCC AMY3405 [0,0,0,0,0,2|2,0,0]=4 104 B11R0.62 CCOC(=O)\C=C\C(=O)OCC AMY18090 [0,0,0,0,0,2|2,0,0]=4