0 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,0,0,0,0,0|0,0,4]=4 1 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [0,0,0,0,0,0|1,0,3]=4 2 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [0,0,0,0,0,0|1,0,3]=4 3 B11R1.3 C=C(C)c1cnc(cn1)CO 271570a_100000694244_100012002382 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.3 C=C(C)c1ncc(cn1)CO 271570a_100000694244_100009855073 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.3 CC(=O)C1CCC(CC1)CO 1458a_100011217856_200000210301 [0,0,0,0,0,0|1,0,2]=3 6 B11R1.3 CC(=O)N1CCC(CC1)CO 240690a_100000738675_100015343762 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.3 CC(=O)N1CCC(CC1)CO 527a_100000738675_100103153847 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.3 CCN1CCC(CC1)C(=O)C 1458a_100015186486_200000210301 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.3 CCN1CCC(CC1)C(=O)[13CH3] 1458a_100015186486_200025704644 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)C 1458a_100000709782_200000210301 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100000709782_200025704644 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.3 CN(C)C1CCC(CC1)CO 270004a_100102631434_100000062911 [0,0,0,0,0,0|1,0,3]=4 13 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 2230a_100009831571_200000210301 [0,0,0,0,0,0|1,0,3]=4 14 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 269982a_100009831571_200000210301 [0,0,0,0,0,0|1,0,3]=4 15 B11R1.3 CN(C)[C@H]1CC[C@@H](CC1)CO 34a_100009831571_200000210301 [0,0,0,0,0,0|1,0,3]=4 16 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 2230a_100009831571_200025704644 [0,0,0,0,0,0|1,0,3]=4 17 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 269982a_100009831571_200025704644 [0,0,0,0,0,0|1,0,3]=4 18 B11R1.3 CN([13CH3])[C@H]1CC[C@@H](CC1)CO 34a_100009831571_200025704644 [0,0,0,0,0,0|1,0,3]=4 19 B11R1.3 [13CH3]C(=O)C1CCC(CC1)CO 1458a_100011217856_200025704644 [0,0,0,0,0,0|1,0,2]=3 20 B10R1.3 CNC1CCC(CC1)CO 270004a_106832991635_100000062911 [1,0,0,0,0,0|1,0,2]=4 21 B10R1.3 CN[C@H]1CC[C@@H](CC1)CO 34a_100009821084_200000210301 [1,0,0,0,0,0|1,0,2]=4 22 B10R1.3 [13CH3]N[C@H]1CC[C@@H](CC1)CO 34a_100009821084_200025704644 [1,0,0,0,0,0|1,0,2]=4 23 B10R1.13 C=C1CCC(CC1)C(=O)C 1458a_200000138047_200000210301 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.13 C=C1CCC(CC1)C(=O)[13CH3] 1458a_200000138047_200025704644 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.13 CC(=O)C1CCC(=O)NC1 1458a_100000740907_200000210301 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.13 CC(=O)C1CCC(CC1)C 1458a_100000070787_200011216234 [1,0,0,0,0,0|1,0,2]=4 28 B10R1.13 CC(=O)C1CCC(CC1)O 1458a_100000743365_200000210301 [1,0,0,0,0,0|1,0,2]=4 29 B10R1.13 CC(=O)C1CCN(CC1)C 1458a_100000743488_200000210301 [1,0,0,0,0,0|2,0,1]=4 30 B10R1.13 CC(=O)N1CC=C(CC1)C 11a_100000693516_100015343762 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.13 CC(=O)N1CC=C(CC1)C 1626a_100000693516_100015343762 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.13 CC(=O)N1CC=C(CC1)C 240690a_100000693516_100015343762 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.13 CC(=O)N1CC=C(CC1)C 527a_100000693516_100103153847 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_200000210301 [1,0,0,0,0,0|1,0,2]=4 35 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [1,0,0,0,0,0|1,0,0]=2 36 B10R1.13 CC1=CCN(CC1)C(C)C 2230a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 37 B10R1.13 CC1=CCN(CC1)C(C)C 269982a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 38 B10R1.13 CC1=CCN(CC1)C(C)C 34a_100000693516_100000210206 [1,0,0,0,0,0|1,0,2]=4 39 B10R1.13 CN1CCC(CC1)C(=O)[13CH3] 1458a_100000743488_200025704644 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815934_200025704644 [1,0,0,0,0,0|1,0,2]=4 41 B10R1.13 [13CH3]C(=O)C1CCC(=O)NC1 1458a_100000740907_200025704644 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.13 [13CH3]C(=O)C1CCC(CC1)O 1458a_100000743365_200025704644 [1,0,0,0,0,0|1,0,2]=4 43 B12R1.5 CCC(=O)C1CCC(CC1)CO 1458a_100011217856_100000210202 [0,1,0,0,0,0|1,0,2]=4 44 B12R1.5 CNC(=O)C1CCC(CC1)CO 1626a_100102657272_100011217856 [0,1,0,0,0,0|1,0,2]=4 45 B12R1.5 CNC(=O)C1CCC(CC1)CO 240690a_100102657272_100011217856 [0,1,0,0,0,0|1,0,2]=4 46 B12R1.5 O=C(CF)C1CCC(CC1)CO 1458a_100011217856_100015361967 [0,1,0,0,0,0|1,0,2]=4 47 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 269862a_106832991636_100015429263 [0,1,0,0,0,0|1,0,0]=2 48 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 270004a_106832991635_100015429263 [0,1,0,0,0,0|1,0,0]=2 49 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 34a_100015330809_200000210301 [0,1,0,0,0,0|0,0,0]=1 50 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 7a_100015330809_200000210301 [0,1,0,0,0,0|0,0,0]=1 51 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 34a_100015330809_200025704644 [0,1,0,0,0,0|0,0,0]=1 52 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 7a_100015330809_200025704644 [0,1,0,0,0,0|0,0,0]=1 53 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)C 1458a_200016138351_200000210301 [0,1,0,0,0,0|0,0,2]=3 54 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)[13CH3] 1458a_200016138351_200025704644 [0,1,0,0,0,0|0,0,2]=3 55 B10R0.77 C=C(C)CCNC(CC)CC 2230a_100000199018_100000730704 [0,0,1,0,0,0|2,0,1]=4 56 B10R0.77 C=C(C)CCNC(CO)CO 2230a_100000759517_100000730704 [0,0,1,0,0,0|2,0,1]=4 57 B10R0.77 C=C(C)CCN[C@@H](CC)CO 2230a_100000709445_100000730704 [0,0,1,0,0,0|1,0,1]=3 58 B10R0.77 C=C(C)CCOC(CC)CC 7a_100000688536_100000730704 [0,0,1,0,0,0|2,0,1]=4 59 B10R0.77 C=C(C)CCSC(CC)CC 62a_100000210505_100000730704 [0,0,1,0,0,0|2,0,1]=4 60 B10R0.77 C=C(C)CCSC(CC)CC 62a_100000730704_100000210505 [0,0,1,0,0,0|2,0,1]=4 61 B10R0.77 C=C[C@@H](CO)NCCC(=C)C 2230a_100016989147_100000730704 [0,0,1,0,0,0|1,0,2]=4 62 B10R0.77 C=C[C@@H](CO)NCCC(=C)C 34a_100016989147_100000730704 [0,0,1,0,0,0|1,0,2]=4 63 B10R0.82 C=C(C)C(C)NCC(C)CO 269862a_100000744482_100011216138 [0,0,1,0,0,0|1,0,2]=4 64 B10R0.82 C=C(C)C(C)NC[C@@H](F)CO 269862a_100015665980_100011216138 [0,0,1,0,0,0|2,0,1]=4 65 B10R0.82 C=C(C)C(C)NC[C@H](O)CO 269862a_100020644852_100011216138 [0,0,1,0,0,0|2,0,1]=4 66 B10R0.82 CC(=O)C(C)COC(C)CO 34a_100000032740_100012180447 [0,0,1,0,0,0|2,0,1]=4 67 B10R0.82 CC(=O)C(C)COC(C)CO 7a_100000032740_100012180447 [0,0,1,0,0,0|2,0,1]=4 68 B10R1.31 C=C(C)c1ccc(o1)CO 271570a_100000694244_100000246276 [0,0,0,0,1,0|1,0,2]=4 69 B10R1.31 C=C(C)c1ccc(s1)CO 271570a_100000694244_100000246291 [0,0,0,0,1,0|1,0,2]=4 70 B10R1.31 C=C(C)c1csc(c1)CO 271570a_100000694244_100000238369 [0,0,0,0,1,0|1,0,2]=4 71 B10R1.31 C=C(C)c1nc(cs1)CO 271570a_100000694244_100009816749 [0,0,0,0,1,0|2,0,1]=4 72 B10R1.31 C=C(C)c1ncc(s1)CO 271570a_100000694244_100009816753 [0,0,0,0,1,0|2,0,1]=4 73 B10R1.31 CC(=O)N1CCC(C1)CO 240690a_100000748654_100015343762 [0,0,0,0,1,0|2,0,1]=4 74 B10R1.31 CC(=O)N1CCC(C1)CO 527a_100000748654_100103153847 [0,0,0,0,1,0|2,0,1]=4 75 B10R1.31 CCN1CCC(C1)C(=O)C 1458a_100103286618_200000210301 [0,0,0,0,1,0|3,0,0]=4 76 B10R1.31 CCN1CCC(C1)C(=O)[13CH3] 1458a_100103286618_200025704644 [0,0,0,0,1,0|3,0,0]=4 77 B12R1.4 C=C(C)CN1CCC(CC1)CO 2230a_100000738675_100000748629 [0,0,0,0,0,1|1,0,2]=4 78 B12R1.4 C=C(C)CN1CCC(CC1)CO 269982a_100000738675_100000748629 [0,0,0,0,0,1|1,0,2]=4 79 B12R1.4 C=C(C)CN1CCC(CC1)CO 34a_100000738675_100000748629 [0,0,0,0,0,1|1,0,2]=4 80 B12R1.4 CC(=O)N[C@H]1CC[C@@H](CC1)CO 240690a_100009821084_100015343762 [0,0,0,0,0,1|1,0,2]=4 81 B12R1.4 CC(=O)N[C@H]1CC[C@@H](CC1)CO 527a_100009821084_100103153847 [0,0,0,0,0,1|1,0,2]=4 82 B9R0.1 C=C(C)CCNC(C)CC 2230a_100000209981_100000730704 [1,0,1,0,0,0|1,0,1]=4 83 B9R0.1 C=C(C)CCN[C@H](C)CO 2230a_100000737577_100000730704 [1,0,1,0,0,0|1,0,1]=4 84 B9R0.1 C=C(C)CCOC(C)CC 34a_100000764851_100011215416 [1,0,1,0,0,0|1,0,1]=4 85 B9R0.1 C=C(C)CCOC(C)CC 7a_100000210228_100000730704 [1,0,1,0,0,0|1,0,1]=4 86 B9R0.1 C=C(C)CCOC(C)CO 34a_100000764851_100012180447 [1,0,1,0,0,0|1,0,1]=4 87 B9R0.1 C=C(C)CCSC(C)CC 62a_100000730704_100000758301 [1,0,1,0,0,0|1,0,1]=4 88 B9R0.1 C=C(C)CCSC(C)CC 62a_100000758301_100000730704 [1,0,1,0,0,0|1,0,1]=4 89 B9R0.1 C=C(C)CCSC(C)CO 62a_100012180447_100000730704 [1,0,1,0,0,0|1,0,1]=4 90 B9R0.1 C=C(C)CCS[C@H](C)CO 62a_100000730704_100016084084 [1,0,1,0,0,0|1,0,1]=4 91 B9R0.1 C=C(C)CCS[C@H](C)CO 62a_100016084084_100000730704 [1,0,1,0,0,0|1,0,1]=4 92 B9R0.1 C=C(C)CNCC(C)CO 34a_100000744482_100000748629 [1,0,1,0,0,0|1,0,1]=4 93 B9R0.1 C=C(C)COC[C@@H](C)CO 34a_100000210245_100000059175 [1,0,1,0,0,0|1,0,1]=4 94 B9R0.1 C=C(C)CSC[C@@H](C)CO 62a_100000059175_100000211660 [1,0,1,0,0,0|1,0,1]=4 95 B9R0.1 C=C(C)CSC[C@@H](C)CO 62a_100000748629_100000059175 [1,0,1,0,0,0|1,0,1]=4 96 B9R0.1 CC(=O)CCCC(=O)CO 1458a_100000210174_100011215641 [1,0,1,0,0,0|2,0,0]=4 97 B9R0.50 C=CCCN[C@@H](CC)CO 2230a_100000709445_100000754431 [1,0,1,0,0,0|1,0,1]=4 98 B9R0.7 C=C(C)C(=O)CC=C(C)C 1458a_100000185857_100000761012 [1,0,1,0,0,0|1,0,1]=4 99 B9R0.7 C=C(C)CCC(=O)C(=C)C 1458a_100000185857_100000730704 [1,0,1,0,0,0|1,0,1]=4 100 B9R0.7 C=C(C)CCC(C)N(C)C 270004a_100102631434_100011215600 [1,0,1,0,0,0|1,0,1]=4 101 B9R0.7 C=C(C)COC(C)C(=O)C 34a_100000212229_100000748629 [1,0,1,0,0,0|2,0,0]=4 102 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100000748629_100009814033 [1,0,1,0,0,0|2,0,0]=4 103 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100009814033_100000211660 [1,0,1,0,0,0|2,0,0]=4 104 B9R0.24 C=CC(C)COC(C)CO 34a_100011215527_100012180447 [1,0,1,0,0,0|1,0,1]=4 105 B9R0.24 C=CC(C)COC(C)CO 7a_100011215527_100012180447 [1,0,1,0,0,0|1,0,1]=4 106 B9R0.47 C=C(C)C(C)NCCCO 269862a_100000182051_100011216138 [1,0,1,0,0,0|1,0,1]=4 107 B9R1.1 CCN1CC=C(CC1)C 2230a_100000693516_100000210202 [2,0,0,0,0,0|1,0,1]=4 108 B9R1.1 CCN1CC=C(CC1)C 269982a_100000693516_100000204670 [2,0,0,0,0,0|1,0,1]=4 109 B9R1.1 CCN1CC=C(CC1)C 34a_100000693516_100000210202 [2,0,0,0,0,0|1,0,1]=4 110 B9R1.6 CC(=O)N1CC=CCC1 11a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 111 B9R1.6 CC(=O)N1CC=CCC1 1626a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 112 B9R1.6 CC(=O)N1CC=CCC1 240690a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 113 B9R1.6 CC(=O)N1CC=CCC1 527a_100000698166_100103153847 [2,0,0,0,0,0|2,0,0]=4 114 B9R1.6 CC(=O)[C@H]1CC=CCC1 1458a_100009820709_200000210301 [2,0,0,0,0,0|1,0,0]=3 115 B9R1.6 [13CH3]C(=O)[C@H]1CC=CCC1 1458a_100009820709_200025704644 [2,0,0,0,0,0|1,0,0]=3 116 B11R0.45 C=C(C)CCNC(CC)COC 2230a_100000757820_100000730704 [0,1,1,0,0,0|1,0,1]=4 117 B11R0.45 C=C(C)CCNC(CO)COC 2230a_100000724102_100000730704 [0,1,1,0,0,0|1,0,1]=4 118 B11R0.45 C=C(C)CCNC(CO)COC 34a_100000724102_100000730704 [0,1,1,0,0,0|1,0,1]=4 119 B11R0.45 C=C(C)CCN[C@H](CO)CCC 2230a_100000732646_100000730704 [0,1,1,0,0,0|1,0,1]=4 120 B11R0.45 C=C(C)CCN[C@H](CO)CCC 34a_100000732646_100000730704 [0,1,1,0,0,0|1,0,1]=4 121 B11R0.45 C=C(C)CCOC(CC)COC 7a_200011214946_100000730704 [0,1,1,0,0,0|1,0,1]=4 122 B11R0.171 C=C(C)CCC(=O)C(CC)CC 1458a_100000211163_100000730704 [0,1,1,0,0,0|1,0,1]=4 123 B11R0.171 C=C(C)CCC(=O)C(CC)CC 1458a_200000688413_100000210505 [0,1,1,0,0,0|1,0,1]=4 124 B11R0.171 C=C(C)CCC(=O)N(CC)CC 11a_100000724800_200000688413 [0,1,1,0,0,0|2,0,0]=4 125 B11R0.171 C=C(C)CCC(=O)N(CC)CC 1626a_100000724800_200000688413 [0,1,1,0,0,0|2,0,0]=4 126 B11R0.171 C=C(C)CCC(=O)N(CC)CC 240690a_100000724800_200000688413 [0,1,1,0,0,0|2,0,0]=4 127 B11R0.171 C=C(C)CCC(=O)N(CC)CC 527a_100000724800_200000688413 [0,1,1,0,0,0|2,0,0]=4 128 B11R0.273 C=C(C)CCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000730704 [0,1,1,0,0,0|1,0,1]=4 129 B11R0.273 C=C(C)CCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000730704 [0,1,1,0,0,0|1,0,1]=4 130 B11R0.273 C=C(C)CCN[C@@H](CO)C(C)C 2230a_100011830312_100000730704 [0,1,1,0,0,0|1,0,1]=4 131 B11R0.273 C=C(C)CCN[C@@H](CO)C(C)C 34a_100011830312_100000730704 [0,1,1,0,0,0|1,0,1]=4 132 B11R0.273 C=C(C)CCN[C@H](CO)[C@@H](C)O 2230a_100015196842_100000730704 [0,1,1,0,0,0|1,0,1]=4 133 B11R0.273 C=C(C)CCN[C@H](CO)[C@@H](C)O 34a_100015196842_100000730704 [0,1,1,0,0,0|1,0,1]=4 134 B11R0.120 COC(=O)C(C)CCC(=O)CO 1458a_100000210174_100000034942 [0,1,1,0,0,0|2,0,0]=4 135 B11R1.21 CC(=O)C1CCN(C(=O)C1)C 1458a_100000043916_200000210301 [1,1,0,0,0,0|2,0,0]=4 136 B11R1.21 CN1CCC(CC1=O)C(=O)[13CH3] 1458a_100000043916_200025704644 [1,1,0,0,0,0|2,0,0]=4 137 B11R1.22 C=CC(=O)N1CC=C(CC1)C 1626a_100000693516_100000185746 [1,1,0,0,0,0|2,0,0]=4 138 B11R1.22 C=CC(=O)N1CC=C(CC1)C 240690a_100000693516_200121576911 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.22 C=CC(C)N1CC=C(CC1)C 269982a_100000693516_100011215867 [1,1,0,0,0,0|1,0,1]=4 140 B11R1.22 CC1=CCC(CC1)C(=O)CF 1458a_100000137427_100015361967 [1,1,0,0,0,0|1,0,0]=3 141 B11R1.22 CC1=CCN(CC1)C(=O)CO 240690a_100000693516_100000210174 [1,1,0,0,0,0|2,0,0]=4 142 B11R1.22 CC1=CCN(CC1)C(=O)CO 527a_100000693516_100000210174 [1,1,0,0,0,0|2,0,0]=4 143 B11R1.22 CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210202 [1,1,0,0,0,0|1,0,0]=3 144 B11R1.22 CCC(=O)N1CC=C(CC1)C 11a_100000693516_100000210414 [1,1,0,0,0,0|2,0,0]=4 145 B11R1.22 CCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000210414 [1,1,0,0,0,0|2,0,0]=4 146 B11R1.22 CCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000210414 [1,1,0,0,0,0|2,0,0]=4 147 B11R1.22 CCC(=O)N1CC=C(CC1)C 527a_100000693516_100000210414 [1,1,0,0,0,0|2,0,0]=4 148 B11R1.22 CNC(=O)C1CC=C(CC1)C 11a_106832991635_100000137427 [1,1,0,0,0,0|1,0,0]=3 149 B11R1.22 CNC(=O)C1CC=C(CC1)C 1626a_100102657272_100000137427 [1,1,0,0,0,0|1,0,0]=3 150 B11R1.22 CNC(=O)C1CC=C(CC1)C 240690a_100102657272_100000137427 [1,1,0,0,0,0|1,0,0]=3 151 B11R1.22 CNC(=O)C1CC=C(CC1)C 527a_100102657272_100000137427 [1,1,0,0,0,0|1,0,0]=3 152 B11R1.22 CNC(=O)N1CC=C(CC1)C 2708a_100102657272_100000693516 [1,1,0,0,0,0|2,0,0]=4 153 B11R1.22 CNC(=O)N1CC=C(CC1)C 273464a_100102657272_100000693516 [1,1,0,0,0,0|2,0,0]=4 154 B11R1.22 CNC(C)C1CC=C(CC1)C 269862a_106832991636_100000073480 [1,1,0,0,0,0|0,0,2]=4 155 B11R1.22 CNC(C)C1CC=C(CC1)C 270004a_106832991635_100000073480 [1,1,0,0,0,0|0,0,2]=4 156 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)CC 1458a_200016138351_100000210202 [0,2,0,0,0,0|1,0,0]=3 157 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)CF 1458a_200016138351_100015361967 [0,2,0,0,0,0|1,0,0]=3 158 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 11a_106832991635_200016138351 [0,2,0,0,0,0|0,0,2]=4 159 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 1626a_100102657272_200016138351 [0,2,0,0,0,0|0,0,2]=4 160 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 240690a_100102657272_200016138351 [0,2,0,0,0,0|0,0,2]=4 161 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)CNCC 269862a_100015525214_100015429263 [0,2,0,0,0,0|1,0,0]=3 162 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)CNCC 270004a_100015525214_100015429263 [0,2,0,0,0,0|1,0,0]=3 163 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCC 34a_100015330809_100000210202 [0,2,0,0,0,0|0,0,0]=2 164 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCC 7a_100015330809_100000210202 [0,2,0,0,0,0|0,0,0]=2 165 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCF 34a_100015330809_100015361967 [0,2,0,0,0,0|0,0,0]=2 166 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCF 7a_100015330809_100015361967 [0,2,0,0,0,0|0,0,0]=2 167 B11R1.172 C=C(C)CCN[C@@H]1CCOC1 2230a_200015188469_100000730704 [0,0,1,1,0,0|1,0,1]=4 168 B11R1.172 C=C(C)CCN[C@H]1CCOC1 2230a_100015188467_100000730704 [0,0,1,1,0,0|1,0,1]=4 169 B11R1.172 C=C(C)CCN[C@H]1CCOC1 34a_100015188467_100000730704 [0,0,1,1,0,0|1,0,1]=4 170 B11R1.172 C=C(C)CCOC1CCOC1 34a_100000764851_100000690089 [0,0,1,1,0,0|1,0,1]=4 171 B11R1.172 C=C(C)CCO[C@H]1CCOC1 34a_100000717292_100000730704 [0,0,1,1,0,0|1,0,1]=4 172 B11R1.172 C=C(C)CCSC1CCOC1 62a_100000730704_100000690089 [0,0,1,1,0,0|1,0,1]=4 173 B11R1.223 O=C(CO)CCC1CCC1=O 1458a_100000210174_200016118888 [0,0,1,1,0,0|2,0,0]=4 174 B13R2.4143 CC1([C@H]2CC=C([C@@H]1C2)CO[13CH3])C 34a_100009814963_200025704644 [0,1,0,1,0,0|0,0,2]=4 175 B13R2.4143 CC1([C@H]2CC=C([C@@H]1C2)CO[13CH3])C 7a_100009814963_200025704644 [0,1,0,1,0,0|0,0,2]=4 176 B13R2.4143 COCC1=CC[C@H]2C[C@@H]1C2(C)C 34a_100009814963_200000210301 [0,1,0,1,0,0|0,0,2]=4 177 B13R2.4143 COCC1=CC[C@H]2C[C@@H]1C2(C)C 7a_100009814963_200000210301 [0,1,0,1,0,0|0,0,2]=4 178 B9R0.43 C=C(C)CCN(CC)CC 2230a_100000724800_100000730704 [0,0,1,0,1,0|2,0,0]=4 179 B9R0.43 C=C(C)CCN(CC)CC 269956a_100000042499_100000730704 [0,0,1,0,1,0|2,0,0]=4 180 B9R0.43 C=C(C)CCN(CC)CC 269982a_100000724800_100000730704 [0,0,1,0,1,0|2,0,0]=4 181 B9R0.43 C=C(C)CN[C@@H](CC)CO 2230a_100000709445_100000748629 [0,0,1,0,1,0|1,0,1]=4 182 B9R0.42 C=C(C)C(C)N[C@H](C)CO 269862a_100000737577_100011216138 [0,0,1,0,1,0|1,0,1]=4 183 B9R1.35 CC(=O)C1CCC(C1)O 1458a_100000688591_200000210301 [1,0,0,0,1,0|1,0,1]=4 184 B9R1.35 CC(=O)C1CCN(C1)C 1458a_100000739633_200000210301 [1,0,0,0,1,0|2,0,0]=4 185 B9R1.35 CN1CCC(C1)C(=O)[13CH3] 1458a_100000739633_200025704644 [1,0,0,0,1,0|2,0,0]=4 186 B9R1.35 [13CH3]C(=O)C1CCC(C1)O 1458a_100000688591_200025704644 [1,0,0,0,1,0|1,0,1]=4 187 B9R1.95 CC(=O)C1CC(C1)CO 1458a_206645079618_200000210301 [0,0,0,0,2,0|1,0,1]=4 188 B9R1.95 [13CH3]C(=O)C1CC(C1)CO 1458a_206645079618_200025704644 [0,0,0,0,2,0|1,0,1]=4 189 B11R0.109 C=C(C)C(C)NCCC(C)CO 269862a_106354213184_100011216138 [0,0,1,0,0,1|0,0,2]=4 190 B11R0.77 C=C(C)CN(CC)C/C=C\CC 2230a_100000211296_100103147603 [0,0,1,0,0,1|2,0,0]=4 191 B11R0.77 C=C(C)CN(CC)C/C=C\CC 269982a_100000211296_100103147603 [0,0,1,0,0,1|2,0,0]=4 192 B11R1.20 C=C(C)CN1CC=C(CC1)C 2230a_100000693516_100000748629 [1,0,0,0,0,1|1,0,0]=3 193 B11R1.20 C=C(C)CN1CC=C(CC1)C 269982a_100000693516_100000748629 [1,0,0,0,0,1|1,0,0]=3 194 B11R1.20 C=C(C)CN1CC=C(CC1)C 34a_100000693516_100000748629 [1,0,0,0,0,1|1,0,0]=3 195 B11R1.20 C=C(F)CN1CC=C(CC1)C 2230a_100000693516_100009893438 [1,0,0,0,0,1|2,0,0]=4 196 B11R1.20 C=C(F)CN1CC=C(CC1)C 269982a_100000693516_100009893438 [1,0,0,0,0,1|2,0,0]=4 197 B11R1.20 C=C(F)CN1CC=C(CC1)C 34a_100000693516_100009893438 [1,0,0,0,0,1|2,0,0]=4 198 B13R1.3 C=C(C)CN[C@H]1CC[C@@H](CC1)CO 34a_100009821084_100000748629 [0,0,0,0,0,2|0,0,2]=4