0 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [0,0,0,0,0,0|0,0,4]=4 1 B11R1.3 C=C(C)c1ccc(cn1)C=O 271570a_100000694244_100000766901 [0,0,0,0,0,0|1,0,3]=4 2 B11R1.3 C=C(C)c1ccc(nc1)C=O 271570a_100000694244_100000754260 [0,0,0,0,0,0|1,0,3]=4 3 B11R1.3 C=C(C)c1ccc(nn1)C=O 271570a_100000694244_100000044651 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.3 C=C(C)c1cnc(cn1)C=O 271570a_100000694244_100012001714 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.3 C=C(C)c1ncc(cn1)C=O 271570a_100000694244_100000070856 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.13 C=C1CCC(CC1)C(=O)C 1458a_200000138047_200000210301 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.13 C=C1CCC(CC1)C(=O)[13CH3] 1458a_200000138047_200025704644 [1,0,0,0,0,0|1,0,1]=3 8 B10R1.13 C=C1CCC(CC1)N(C)C 270004a_100102631434_100010272673 [1,0,0,0,0,0|1,0,2]=4 9 B10R1.13 C=C1CCN(CC1)C(=O)C 11a_100000752442_100015343762 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.13 C=C1CCN(CC1)C(=O)C 1626a_100000752442_100015343762 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 C=C1CCN(CC1)C(=O)C 240690a_100000752442_100015343762 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.13 C=C1CCN(CC1)C(=O)C 527a_100000752442_100103153847 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [1,0,0,0,0,0|1,0,1]=3 14 B10R1.13 CC(=O)C1CCC(=O)NC1 1458a_100000740907_200000210301 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 CC(=O)N1CC=C(CC1)C 11a_100000693516_100015343762 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.13 CC(=O)N1CC=C(CC1)C 1626a_100000693516_100015343762 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.13 CC(=O)N1CC=C(CC1)C 240690a_100000693516_100015343762 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.13 CC(=O)N1CC=C(CC1)C 527a_100000693516_100103153847 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [1,0,0,0,0,0|1,0,1]=3 20 B10R1.13 [13CH3]C(=O)C1CCC(=O)NC1 1458a_100000740907_200025704644 [1,0,0,0,0,0|2,0,0]=3 21 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 269862a_106832991636_100015429263 [0,1,0,0,0,0|1,0,1]=3 22 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 270004a_106832991635_100015429263 [0,1,0,0,0,0|1,0,1]=3 23 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 34a_100015330809_200000210301 [0,1,0,0,0,0|0,0,2]=3 24 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 7a_100015330809_200000210301 [0,1,0,0,0,0|0,0,2]=3 25 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 34a_100015330809_200025704644 [0,1,0,0,0,0|0,0,2]=3 26 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 7a_100015330809_200025704644 [0,1,0,0,0,0|0,0,2]=3 27 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)C 1458a_200016138351_200000210301 [0,1,0,0,0,0|0,0,0]=1 28 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)[13CH3] 1458a_200016138351_200025704644 [0,1,0,0,0,0|0,0,0]=1 29 B12R1.256 CC(=O)C1CCN(CC1)C(=O)C 1458a_100000194564_200000210301 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.256 CC(=O)C1CCN(CC1)C(=O)N 1458a_100000199043_200000210301 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.256 CC(=O)N1CCC(CC1)C(=O)[13CH3] 1458a_100000194564_200025704644 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.256 [13CH3]C(=O)C1CCN(CC1)C(=O)N 1458a_100000199043_200025704644 [0,1,0,0,0,0|2,0,1]=4 33 B10R0.77 C=C(C)CCOC(C=O)C=O 34a_100000764851_100000736813 [0,0,1,0,0,0|2,0,1]=4 34 B10R0.77 C=C(C)CCSC(C=O)C=O 62a_100000730704_100000736813 [0,0,1,0,0,0|2,0,1]=4 35 B10R0.77 C=C(C)CCSC(C=O)C=O 62a_100000736813_100000730704 [0,0,1,0,0,0|2,0,1]=4 36 B10R0.77 C=CC(CC)OCCC(=C)C 34a_100000766422_100000730704 [0,0,1,0,0,0|2,0,1]=4 37 B10R0.77 C=CC(CC)OCCC(=C)C 7a_100000766422_100000730704 [0,0,1,0,0,0|2,0,1]=4 38 B10R1.31 C=C(C)c1cc(c[nH]1)C=O 271570a_100000694244_100009882863 [0,0,0,0,1,0|1,0,2]=4 39 B10R1.31 C=C(C)c1cc(cs1)C=O 271570a_100000694244_100000737087 [0,0,0,0,1,0|1,0,2]=4 40 B10R1.31 C=C(C)c1ccc(o1)C=O 271570a_100000694244_100000185145 [0,0,0,0,1,0|1,0,2]=4 41 B10R1.31 C=C(C)c1ccc(s1)C=O 271570a_100000694244_100000179771 [0,0,0,0,1,0|1,0,2]=4 42 B10R1.31 C=C(C)c1coc(c1)C=O 271570a_100000694244_100000747035 [0,0,0,0,1,0|1,0,2]=4 43 B10R1.31 C=C(C)c1csc(c1)C=O 271570a_100000694244_100000211722 [0,0,0,0,1,0|1,0,2]=4 44 B10R1.31 C=C(C)c1nc(cs1)C=O 271570a_100000694244_100009816748 [0,0,0,0,1,0|2,0,1]=4 45 B10R1.31 C=C(C)c1ncc(s1)C=O 271570a_100000694244_100009814069 [0,0,0,0,1,0|2,0,1]=4 46 B9R0.1 C=C(C)CNCC(=O)NC 2230a_100000693194_100000748629 [1,0,1,0,0,0|2,0,0]=4 47 B9R0.1 C=C(C)CNNC(=O)CC 22a_100000729518_100000210414 [1,0,1,0,0,0|2,0,0]=4 48 B9R0.1 C=C(C)COCC(=O)CC 34a_100000725409_100000748629 [1,0,1,0,0,0|1,0,1]=4 49 B9R0.1 C=C(C)COCC(=O)NC 34a_100000210245_100000183359 [1,0,1,0,0,0|2,0,0]=4 50 B9R0.1 C=C(C)COCC(=O)NC 34a_100000750040_100000748629 [1,0,1,0,0,0|2,0,0]=4 51 B9R0.1 C=C(C)COCC(=O)OC 34a_100000210245_100000747449 [1,0,1,0,0,0|2,0,0]=4 52 B9R0.1 C=C(C)CSCC(=O)CC 62a_100000747405_100000211660 [1,0,1,0,0,0|1,0,1]=4 53 B9R0.1 C=C(C)CSCC(=O)CC 62a_100000748629_100000747405 [1,0,1,0,0,0|1,0,1]=4 54 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000183359_100000211660 [1,0,1,0,0,0|2,0,0]=4 55 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000748629_100000183359 [1,0,1,0,0,0|2,0,0]=4 56 B9R0.1 C=C(C)CSCC(=O)OC 62a_100000747449_100000211660 [1,0,1,0,0,0|2,0,0]=4 57 B9R0.1 C=C(C)CSCC(=O)OC 62a_100000748629_100000747449 [1,0,1,0,0,0|2,0,0]=4 58 B9R0.1 C=CC(=O)CCCC(=O)C 1458a_100000185746_100011215641 [1,0,1,0,0,0|1,0,1]=4 59 B9R0.1 CCC(=O)CCCC(=O)C 1458a_100000210414_100011215641 [1,0,1,0,0,0|1,0,1]=4 60 B9R0.1 CNC(=O)CCCC(=O)C 1458a_100000070787_100000741757 [1,0,1,0,0,0|2,0,0]=4 61 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000070787_100011218270 [1,0,1,0,0,0|2,0,0]=4 62 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000239890_200000210301 [1,0,1,0,0,0|2,0,0]=4 63 B9R0.1 COC(=O)CCCC(=O)[13CH3] 1458a_100000239890_200025704644 [1,0,1,0,0,0|2,0,0]=4 64 B9R0.7 CC(=O)SC[C@@H](C)C(=O)C 1458a_200015407212_200000210301 [1,0,1,0,0,0|2,0,0]=4 65 B9R0.7 CC(=O)SC[C@@H](C)C(=O)[13CH3] 1458a_200015407212_200025704644 [1,0,1,0,0,0|2,0,0]=4 66 B9R1.1 C=C1CCC(CC1)NC 270004a_106832991635_100010272673 [2,0,0,0,0,0|1,0,1]=4 67 B9R1.1 CNC1CCC(=O)NC1 2230a_100000748762_200000210301 [2,0,0,0,0,0|2,0,0]=4 68 B9R1.1 CNC1CCC(=O)NC1 34a_100000748762_200000210301 [2,0,0,0,0,0|2,0,0]=4 69 B9R1.1 COC1CCC(=O)CC1 34a_100000764474_200000210301 [2,0,0,0,0,0|1,0,1]=4 70 B9R1.1 COC1CCC(=O)CC1 7a_100000764474_200000210301 [2,0,0,0,0,0|1,0,1]=4 71 B9R1.1 COC1CCC(=O)NC1 34a_100000079199_200000210301 [2,0,0,0,0,0|2,0,0]=4 72 B9R1.1 [13CH3]NC1CCC(=O)NC1 2230a_100000748762_200025704644 [2,0,0,0,0,0|2,0,0]=4 73 B9R1.1 [13CH3]NC1CCC(=O)NC1 34a_100000748762_200025704644 [2,0,0,0,0,0|2,0,0]=4 74 B9R1.1 [13CH3]OC1CCC(=O)CC1 34a_100000764474_200025704644 [2,0,0,0,0,0|1,0,1]=4 75 B9R1.1 [13CH3]OC1CCC(=O)CC1 7a_100000764474_200025704644 [2,0,0,0,0,0|1,0,1]=4 76 B9R1.1 [13CH3]OC1CCC(=O)NC1 34a_100000079199_200025704644 [2,0,0,0,0,0|2,0,0]=4 77 B9R1.6 CC(=O)N1CC=CCC1 11a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 78 B9R1.6 CC(=O)N1CC=CCC1 1626a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 79 B9R1.6 CC(=O)N1CC=CCC1 240690a_100000698166_100015343762 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.6 CC(=O)N1CC=CCC1 527a_100000698166_100103153847 [2,0,0,0,0,0|2,0,0]=4 81 B9R1.6 CC(=O)[C@H]1CC=CCC1 1458a_100009820709_200000210301 [2,0,0,0,0,0|1,0,0]=3 82 B9R1.6 [13CH3]C(=O)[C@H]1CC=CCC1 1458a_100009820709_200025704644 [2,0,0,0,0,0|1,0,0]=3 83 B11R0.273 C=C(C)CCNC(CC)C(=O)N 2230a_100000733705_100000730704 [0,1,1,0,0,0|1,0,1]=4 84 B11R0.273 C=C(C)CCNC(CC)C(=O)N 34a_100000733705_100000730704 [0,1,1,0,0,0|1,0,1]=4 85 B11R0.273 C=C(C)CCN[C@H](CC)C(=O)O 269956a_100000747097_100000730704 [0,1,1,0,0,0|1,0,1]=4 86 B11R0.273 C=C(C)CCOC(CC)C(=O)N 34a_100000764851_100000750255 [0,1,1,0,0,0|1,0,1]=4 87 B11R0.273 C=C(C)CCSC(CC)C(=O)N 62a_100000730704_100000750255 [0,1,1,0,0,0|1,0,1]=4 88 B11R0.273 C=C(C)CCSC(CC)C(=O)N 62a_100000750255_100000730704 [0,1,1,0,0,0|1,0,1]=4 89 B11R1.21 CC(=O)C1CCC(=O)N(C1)C 1458a_100011430921_200000210301 [1,1,0,0,0,0|2,0,0]=4 90 B11R1.21 CN1CC(CCC1=O)C(=O)[13CH3] 1458a_100011430921_200025704644 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.22 C=C1CCC(CC1)C(=O)CC 1458a_200000138047_100000210202 [1,1,0,0,0,0|1,0,1]=4 92 B11R1.22 C=C1CCC(CC1)C(=O)CF 1458a_200000138047_100015361967 [1,1,0,0,0,0|1,0,1]=4 93 B11R1.22 C=C1CCC(CC1)C(=O)NC 11a_106832991635_200000138047 [1,1,0,0,0,0|1,0,1]=4 94 B11R1.22 C=C1CCC(CC1)C(=O)NC 1626a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 95 B11R1.22 C=C1CCC(CC1)C(=O)NC 240690a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 96 B11R1.22 C=C1CCC(CC1)C(=O)NC 527a_100102657272_200000138047 [1,1,0,0,0,0|1,0,1]=4 97 B11R1.22 CC1=CCC(CC1)C(=O)CF 1458a_100000137427_100015361967 [1,1,0,0,0,0|1,0,1]=4 98 B11R1.22 CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210202 [1,1,0,0,0,0|1,0,1]=4 99 B11R1.22 CCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210202 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.22 CNC(=O)C1CC=C(CC1)C 11a_106832991635_100000137427 [1,1,0,0,0,0|1,0,1]=4 101 B11R1.22 CNC(=O)C1CC=C(CC1)C 1626a_100102657272_100000137427 [1,1,0,0,0,0|1,0,1]=4 102 B11R1.22 CNC(=O)C1CC=C(CC1)C 240690a_100102657272_100000137427 [1,1,0,0,0,0|1,0,1]=4 103 B11R1.22 CNC(=O)C1CC=C(CC1)C 527a_100102657272_100000137427 [1,1,0,0,0,0|1,0,1]=4 104 B11R1.22 CNC(=O)C1CCC(=O)NC1 11a_106832991635_100000740907 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.22 CNC(=O)C1CCC(=O)NC1 1626a_100102657272_100000740907 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.22 CNC(=O)C1CCC(=O)NC1 240690a_100102657272_100000740907 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.22 CNC(=O)C1CCC(=O)NC1 527a_100102657272_100000740907 [1,1,0,0,0,0|2,0,0]=4 108 B11R1.22 O=C1CCC(CN1)C(=O)CF 1458a_100000740907_100015361967 [1,1,0,0,0,0|2,0,0]=4 109 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)CC 1458a_200016138351_100000210202 [0,2,0,0,0,0|0,0,0]=2 110 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)CF 1458a_200016138351_100015361967 [0,2,0,0,0,0|0,0,0]=2 111 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 11a_106832991635_200016138351 [0,2,0,0,0,0|0,0,0]=2 112 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 1626a_100102657272_200016138351 [0,2,0,0,0,0|0,0,0]=2 113 B13R1.537 C=C(C)[C@@H]1CC=C(CC1)C(=O)NC 240690a_100102657272_200016138351 [0,2,0,0,0,0|0,0,0]=2 114 B13R1.537 COC(=O)C1=CCN(CC1)C(=O)C 11a_100020587139_100015343762 [0,2,0,0,0,0|2,0,0]=4 115 B13R1.537 COC(=O)C1=CCN(CC1)C(=O)C 1626a_100020587139_100015343762 [0,2,0,0,0,0|2,0,0]=4 116 B13R1.537 COC(=O)C1=CCN(CC1)C(=O)C 240690a_100020587139_100015343762 [0,2,0,0,0,0|2,0,0]=4 117 B13R1.537 COC(=O)C1=CCN(CC1)C(=O)C 527a_100020587139_100103153847 [0,2,0,0,0,0|2,0,0]=4 118 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)CNCC 269862a_100015525214_100015429263 [0,2,0,0,0,0|1,0,1]=4 119 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)CNCC 270004a_100015525214_100015429263 [0,2,0,0,0,0|1,0,1]=4 120 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCC 34a_100015330809_100000210202 [0,2,0,0,0,0|0,0,2]=4 121 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCC 7a_100015330809_100000210202 [0,2,0,0,0,0|0,0,2]=4 122 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCF 34a_100015330809_100015361967 [0,2,0,0,0,0|0,0,2]=4 123 B13R1.74 C=C(C)[C@@H]1CC=C(CC1)COCF 7a_100015330809_100015361967 [0,2,0,0,0,0|0,0,2]=4 124 B11R1.161 C=C(C)CCOC1CCC1=O 34a_100000764851_100009892977 [0,0,1,1,0,0|1,0,1]=4 125 B11R1.161 C=C(C)CCSC1CCC1=O 62a_100000730704_100009892977 [0,0,1,1,0,0|1,0,1]=4 126 B11R1.161 C=C(C)CCSC1CCC1=O 62a_100009892977_100000730704 [0,0,1,1,0,0|1,0,1]=4 127 B13R2.430 CC(=O)C1CCc2[nH]cnc2C1 1458a_100015190355_200000210301 [0,1,0,1,0,0|2,0,0]=4 128 B13R2.430 [13CH3]C(=O)C1CCc2[nH]cnc2C1 1458a_100015190355_200025704644 [0,1,0,1,0,0|2,0,0]=4 129 B13R2.13764 CC(=O)C1=CCC2CC1C2(C)C 1458a_100009834949_200000210301 [0,1,0,1,0,0|0,0,2]=4 130 B13R2.13764 CC1(C2CC=C(C1C2)C(=O)[13CH3])C 1458a_100009834949_200025704644 [0,1,0,1,0,0|0,0,2]=4 131 B9R1.35 CC(=O)C1CCC(=O)N1 1458a_100000210400_200000210301 [1,0,0,0,1,0|2,0,0]=4 132 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [1,0,0,0,1,0|2,0,0]=4 133 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [1,0,0,0,1,0|2,0,0]=4 134 B9R1.35 [13CH3]C(=O)C1CCC(=O)N1 1458a_100000210400_200025704644 [1,0,0,0,1,0|2,0,0]=4 135 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [1,0,0,0,1,0|2,0,0]=4 136 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [1,0,0,0,1,0|2,0,0]=4 137 B11R1.20 C=C(C)CN1CC=C(CC1)C 2230a_100000693516_100000748629 [1,0,0,0,0,1|1,0,1]=4 138 B11R1.20 C=C(C)CN1CC=C(CC1)C 269982a_100000693516_100000748629 [1,0,0,0,0,1|1,0,1]=4 139 B11R1.20 C=C(C)CN1CC=C(CC1)C 34a_100000693516_100000748629 [1,0,0,0,0,1|1,0,1]=4 140 B11R1.20 C=C(C)CN1CCC(=C)CC1 2230a_100000752442_100000748629 [1,0,0,0,0,1|1,0,1]=4 141 B11R1.20 C=C(C)CN1CCC(=C)CC1 269982a_100000752442_100000748629 [1,0,0,0,0,1|1,0,1]=4 142 B11R1.20 C=C(C)CN1CCC(=C)CC1 34a_100000752442_100000748629 [1,0,0,0,0,1|1,0,1]=4 143 B11R1.20 CC(=O)NC1CCC(=O)NC1 11a_100000748762_100015343762 [1,0,0,0,0,1|2,0,0]=4 144 B11R1.20 CC(=O)NC1CCC(=O)NC1 1626a_100000748762_100015343762 [1,0,0,0,0,1|2,0,0]=4 145 B11R1.20 CC(=O)NC1CCC(=O)NC1 240690a_100000748762_100015343762 [1,0,0,0,0,1|2,0,0]=4 146 B11R1.20 CC(=O)NC1CCC(=O)NC1 527a_100000748762_100103153847 [1,0,0,0,0,1|2,0,0]=4