0 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [0,0,0,0,0,0|0,0,4]=4 1 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.13 C=C(C)c1ccc(nn1)C 271570a_100000694244_100011450037 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.13 C=C(C)c1cnc(cn1)C 271570a_100000694244_100011999403 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.13 C=C(C)c1ncc(cn1)C 271570a_100000694244_100011825175 [0,0,0,0,0,0|2,0,2]=4 6 B10R1.13 C=C1CCC(CC1)C(=O)C 1458a_200000138047_200000210301 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.13 C=C1CCC(CC1)C(=O)[13CH3] 1458a_200000138047_200025704644 [0,0,0,0,0,0|1,0,2]=3 8 B10R1.13 C=C1CCC(CC1)N(C)C 270004a_100102631434_100010272673 [0,0,0,0,0,0|1,0,3]=4 9 B10R1.13 C=C1CCN(CC1)C(=O)C 11a_100000752442_100015343762 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.13 C=C1CCN(CC1)C(=O)C 1626a_100000752442_100015343762 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.13 C=C1CCN(CC1)C(=O)C 240690a_100000752442_100015343762 [0,0,0,0,0,0|2,0,2]=4 12 B10R1.13 C=C1CCN(CC1)C(=O)C 527a_100000752442_100103153847 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.13 CC(=O)C1CCC(=O)NC1 1458a_100000740907_200000210301 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.13 CC(=O)C1CCC(CC1)C 1458a_100000070787_200011216234 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.13 CC(=O)C1CCC(CC1)O 1458a_100000743365_200000210301 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.13 CC(=O)C1CCN(CC1)C 1458a_100000743488_200000210301 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.13 CC(=O)N1CC=C(CC1)C 11a_100000693516_100015343762 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.13 CC(=O)N1CC=C(CC1)C 1626a_100000693516_100015343762 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 CC(=O)N1CC=C(CC1)C 240690a_100000693516_100015343762 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.13 CC(=O)N1CC=C(CC1)C 527a_100000693516_100103153847 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 CC(=O)N1CCC(CC1)C 240690a_100000188429_100015343762 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.13 CC(=O)N1CCC(CC1)C 527a_100000188429_100103153847 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.13 CC(=O)N1CCN(CC1)C 11a_100000188432_100015343762 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.13 CC(=O)N1CCN(CC1)C 2230a_100000210354_200000210301 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.13 CC(=O)N1CCN(CC1)C 240690a_100000188432_100015343762 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.13 CC(=O)N1CCN(CC1)C 269982a_100000210354_200000210301 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.13 CC(=O)N1CCN(CC1)C 527a_100000188432_100103153847 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.13 CC(=O)N1CCN(CC1)[13CH3] 2230a_100000210354_200025704644 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.13 CC(=O)N1CCN(CC1)[13CH3] 269982a_100000210354_200025704644 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_200000210301 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.13 CC(C)C1CCN(CC1)C 2230a_100000762885_200000210301 [0,0,0,0,0,0|1,0,3]=4 33 B10R1.13 CC(C)C1CCN(CC1)C 269982a_100000762885_200000210301 [0,0,0,0,0,0|1,0,3]=4 34 B10R1.13 CC(C)C1CCN(CC1)C 34a_100000762885_200000210301 [0,0,0,0,0,0|1,0,3]=4 35 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 2230a_100000762885_200025704644 [0,0,0,0,0,0|1,0,3]=4 36 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 269982a_100000762885_200025704644 [0,0,0,0,0,0|1,0,3]=4 37 B10R1.13 CC(C)C1CCN(CC1)[13CH3] 34a_100000762885_200025704644 [0,0,0,0,0,0|1,0,3]=4 38 B10R1.13 CC(O)C1CCN(CC1)C 2230a_100011728446_200000210301 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.13 CC(O)C1CCN(CC1)C 269982a_100011728446_200000210301 [0,0,0,0,0,0|2,0,2]=4 40 B10R1.13 CC(O)C1CCN(CC1)C 34a_100011728446_200000210301 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 2230a_100011728446_200025704644 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 269982a_100011728446_200025704644 [0,0,0,0,0,0|2,0,2]=4 43 B10R1.13 CC(O)C1CCN(CC1)[13CH3] 34a_100011728446_200025704644 [0,0,0,0,0,0|2,0,2]=4 44 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [0,0,0,0,0,0|1,0,0]=1 45 B10R1.13 CC1=CCN(CC1)C(C)C 2230a_100000693516_100000210206 [0,0,0,0,0,0|1,0,2]=3 46 B10R1.13 CC1=CCN(CC1)C(C)C 269982a_100000693516_100000210206 [0,0,0,0,0,0|1,0,2]=3 47 B10R1.13 CC1=CCN(CC1)C(C)C 34a_100000693516_100000210206 [0,0,0,0,0,0|1,0,2]=3 48 B10R1.13 CC1CCC(CC1)N(C)C 269982a_100102631434_200011216234 [0,0,0,0,0,0|1,0,3]=4 49 B10R1.13 CC1CCC(CC1)N(C)C 270004a_100102631434_100000185489 [0,0,0,0,0,0|1,0,3]=4 50 B10R1.13 CN(C)C1CCN(CC1)[13CH3] 2230a_100011226131_200025704644 [0,0,0,0,0,0|2,0,2]=4 51 B10R1.13 CN(C)C1CCN(CC1)[13CH3] 269982a_100011226131_200025704644 [0,0,0,0,0,0|2,0,2]=4 52 B10R1.13 CN1CCC(CC1)C(=O)N 2230a_100000210938_200000210301 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.13 CN1CCC(CC1)C(=O)N 269982a_100000210938_200000210301 [0,0,0,0,0,0|3,0,1]=4 54 B10R1.13 CN1CCC(CC1)C(=O)N 34a_100000210938_200000210301 [0,0,0,0,0,0|3,0,1]=4 55 B10R1.13 CN1CCC(CC1)C(=O)O 269956a_100000210459_200000210301 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.13 CN1CCC(CC1)C(=O)[13CH3] 1458a_100000743488_200025704644 [0,0,0,0,0,0|2,0,1]=3 57 B10R1.13 CN1CCC(CC1)C(=S)N 2230a_200011935123_200000210301 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.13 CN1CCC(CC1)C(=S)N 269982a_200011935123_200000210301 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.13 CN1CCC(CC1)N(C)C 2230a_100011226131_200000210301 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.13 CN1CCC(CC1)N(C)C 2230a_100025768347_200000210301 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100011226131_200000210301 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100025768347_200000210301 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.13 CN1CCC(CC1)N(C)C 269982a_100102631434_100011215917 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.13 CN1CCC(CC1)N(C)C 270004a_100102631434_100000210137 [0,0,0,0,0,0|2,0,2]=4 65 B10R1.13 CN1CCC(CC1)N(C)[13CH3] 2230a_100025768347_200025704644 [0,0,0,0,0,0|2,0,2]=4 66 B10R1.13 CN1CCC(CC1)N(C)[13CH3] 269982a_100025768347_200025704644 [0,0,0,0,0,0|2,0,2]=4 67 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815934_200025704644 [0,0,0,0,0,0|1,0,2]=3 68 B10R1.13 [13CH3]C(=O)C1CCC(=O)NC1 1458a_100000740907_200025704644 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.13 [13CH3]C(=O)C1CCC(CC1)O 1458a_100000743365_200025704644 [0,0,0,0,0,0|2,0,2]=4 70 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 2230a_100000210938_200025704644 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 269982a_100000210938_200025704644 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.13 [13CH3]N1CCC(CC1)C(=O)N 34a_100000210938_200025704644 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.13 [13CH3]N1CCC(CC1)C(=O)O 269956a_100000210459_200025704644 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.13 [13CH3]N1CCC(CC1)C(=S)N 2230a_200011935123_200025704644 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.13 [13CH3]N1CCC(CC1)C(=S)N 269982a_200011935123_200025704644 [0,0,0,0,0,0|3,0,1]=4 76 B9R1.1 C=C1CCC(CC1)NC 270004a_106832991635_100010272673 [1,0,0,0,0,0|1,0,2]=4 77 B9R1.1 CC1=CCN(CC1)CF 269982a_100000693516_100015361967 [1,0,0,0,0,0|2,0,1]=4 78 B9R1.1 CC1=CCN(CC1)CF 34a_100000693516_100015361967 [1,0,0,0,0,0|2,0,1]=4 79 B9R1.1 CC1CCC(CC1)O[13CH3] 34a_100000210714_200025704644 [1,0,0,0,0,0|1,0,2]=4 80 B9R1.1 CC1CCC(CC1)O[13CH3] 7a_100000210714_200025704644 [1,0,0,0,0,0|1,0,2]=4 81 B9R1.1 CC1CCC(CC1)S[13CH3] 62a_200025704644_200011216234 [1,0,0,0,0,0|1,0,2]=4 82 B9R1.1 CCC1CCN(CC1)C 2230a_100000754474_200000210301 [1,0,0,0,0,0|1,0,2]=4 83 B9R1.1 CCC1CCN(CC1)C 269982a_100000754474_200000210301 [1,0,0,0,0,0|1,0,2]=4 84 B9R1.1 CCC1CCN(CC1)C 34a_100000754474_200000210301 [1,0,0,0,0,0|1,0,2]=4 85 B9R1.1 CCC1CCN(CC1)[13CH3] 2230a_100000754474_200025704644 [1,0,0,0,0,0|1,0,2]=4 86 B9R1.1 CCC1CCN(CC1)[13CH3] 269982a_100000754474_200025704644 [1,0,0,0,0,0|1,0,2]=4 87 B9R1.1 CCC1CCN(CC1)[13CH3] 34a_100000754474_200025704644 [1,0,0,0,0,0|1,0,2]=4 88 B9R1.1 CCN1CC=C(CC1)C 2230a_100000693516_100000210202 [1,0,0,0,0,0|1,0,1]=3 89 B9R1.1 CCN1CC=C(CC1)C 269982a_100000693516_100000204670 [1,0,0,0,0,0|1,0,1]=3 90 B9R1.1 CCN1CC=C(CC1)C 34a_100000693516_100000210202 [1,0,0,0,0,0|1,0,1]=3 91 B9R1.1 CN1CCC(CC1)S[13CH3] 62a_200025704644_100011215917 [1,0,0,0,0,0|2,0,1]=4 92 B9R1.1 CNC1CCC(=O)NC1 2230a_100000748762_200000210301 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 CNC1CCC(=O)NC1 34a_100000748762_200000210301 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.1 CNC1CCC(CC1)C 270004a_106832991635_100000185489 [1,0,0,0,0,0|1,0,2]=4 95 B9R1.1 CNC1CCC(CC1)C 34a_100102657272_200011216234 [1,0,0,0,0,0|1,0,2]=4 96 B9R1.1 CNC1CCN(CC1)C 270004a_106832991635_100000210137 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_200000210301 [1,0,0,0,0,0|1,0,2]=4 98 B9R1.1 CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_200000210301 [1,0,0,0,0,0|1,0,2]=4 99 B9R1.1 COC1CCC(=O)CC1 34a_100000764474_200000210301 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.1 COC1CCC(=O)CC1 7a_100000764474_200000210301 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.1 COC1CCC(=O)NC1 34a_100000079199_200000210301 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.1 COC1CCC(CC1)C 34a_100000210714_200000210301 [1,0,0,0,0,0|1,0,2]=4 103 B9R1.1 COC1CCC(CC1)C 34a_100138415774_200011216234 [1,0,0,0,0,0|1,0,2]=4 104 B9R1.1 COC1CCC(CC1)C 7a_100000210714_200000210301 [1,0,0,0,0,0|1,0,2]=4 105 B9R1.1 COC1CCN(CC1)C 2230a_100000234800_200000210301 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.1 COC1CCN(CC1)C 269982a_100000234800_200000210301 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.1 COC1CCN(CC1)C 34a_100000234800_200000210301 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.1 COC1CCN(CC1)[13CH3] 2230a_100000234800_200025704644 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.1 COC1CCN(CC1)[13CH3] 269982a_100000234800_200025704644 [1,0,0,0,0,0|2,0,1]=4 110 B9R1.1 COC1CCN(CC1)[13CH3] 34a_100000234800_200025704644 [1,0,0,0,0,0|2,0,1]=4 111 B9R1.1 CSC1CCC(CC1)C 62a_200000210301_200011216234 [1,0,0,0,0,0|1,0,2]=4 112 B9R1.1 CSC1CCN(CC1)C 2230a_100015202541_200000210301 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.1 CSC1CCN(CC1)C 269982a_100015202541_200000210301 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.1 CSC1CCN(CC1)C 34a_100015202541_200000210301 [1,0,0,0,0,0|2,0,1]=4 115 B9R1.1 CSC1CCN(CC1)C 62a_200000210301_100011215917 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.1 CSC1CCN(CC1)[13CH3] 2230a_100015202541_200025704644 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.1 CSC1CCN(CC1)[13CH3] 269982a_100015202541_200025704644 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.1 CSC1CCN(CC1)[13CH3] 34a_100015202541_200025704644 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 2230a_100020625639_200025704644 [1,0,0,0,0,0|1,0,2]=4 120 B9R1.1 C[C@H]1CC[C@@H](CC1)N[13CH3] 34a_100020625639_200025704644 [1,0,0,0,0,0|1,0,2]=4 121 B9R1.1 [13CH3]NC1CCC(=O)NC1 2230a_100000748762_200025704644 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.1 [13CH3]NC1CCC(=O)NC1 34a_100000748762_200025704644 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.1 [13CH3]OC1CCC(=O)CC1 34a_100000764474_200025704644 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.1 [13CH3]OC1CCC(=O)CC1 7a_100000764474_200025704644 [1,0,0,0,0,0|2,0,1]=4 125 B9R1.1 [13CH3]OC1CCC(=O)NC1 34a_100000079199_200025704644 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.6 CC(=O)C1C=CCCC1 1458a_100000070787_100000751183 [1,0,0,0,0,0|1,0,2]=4 127 B9R1.6 CC(=O)C1CCCCC1 1458a_100000070787_100000210327 [1,0,0,0,0,0|1,0,2]=4 128 B9R1.6 CC(=O)C1CCCCC1 1458a_100000210647_200000210301 [1,0,0,0,0,0|1,0,2]=4 129 B9R1.6 CC(=O)C1CCCOC1 1458a_100000070787_100000693364 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.6 CC(=O)C1CCCOC1 1458a_100000741522_200000210301 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.6 CC(=O)C1CCOCC1 1458a_100000070787_100011324220 [1,0,0,0,0,0|2,0,1]=4 132 B9R1.6 CC(=O)C1CCOCC1 1458a_100000195482_200000210301 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.6 CC(=O)C1CCSCC1 1458a_100000755232_200000210301 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.6 CC(=O)N1CC=CCC1 11a_100000698166_100015343762 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.6 CC(=O)N1CC=CCC1 1626a_100000698166_100015343762 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.6 CC(=O)N1CC=CCC1 240690a_100000698166_100015343762 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.6 CC(=O)N1CC=CCC1 527a_100000698166_100103153847 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.6 CC(=O)[C@H]1CC=CCC1 1458a_100009820709_200000210301 [1,0,0,0,0,0|1,0,0]=2 139 B9R1.6 CC(C)N1CC=CCC1 2230a_100000698166_100000210206 [1,0,0,0,0,0|1,0,2]=4 140 B9R1.6 CC(C)N1CC=CCC1 269982a_100000698166_100000210206 [1,0,0,0,0,0|1,0,2]=4 141 B9R1.6 CC(C)N1CC=CCC1 34a_100000698166_100000210206 [1,0,0,0,0,0|1,0,2]=4 142 B9R1.6 [13CH3]C(=O)C1CCCCC1 1458a_100000210647_200025704644 [1,0,0,0,0,0|1,0,2]=4 143 B9R1.6 [13CH3]C(=O)C1CCCOC1 1458a_100000741522_200025704644 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.6 [13CH3]C(=O)C1CCOCC1 1458a_100000195482_200025704644 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.6 [13CH3]C(=O)C1CCSCC1 1458a_100000755232_200025704644 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.6 [13CH3]C(=O)[C@H]1CC=CCC1 1458a_100009820709_200025704644 [1,0,0,0,0,0|1,0,0]=2 147 B11R1.3 CC(=O)C1CCC(CC1)CO 1458a_100011217856_200000210301 [0,1,0,0,0,0|1,0,2]=4 148 B11R1.3 CCN1CCC(CC1)C(=O)C 1458a_100015186486_200000210301 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.3 CCN1CCC(CC1)C(=O)[13CH3] 1458a_100015186486_200025704644 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)C 1458a_100000709782_200000210301 [0,1,0,0,0,0|1,0,2]=4 151 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100000709782_200025704644 [0,1,0,0,0,0|1,0,2]=4 152 B11R1.3 COC1CCC(CC1)C(=O)C 1458a_100011215563_200000210301 [0,1,0,0,0,0|1,0,2]=4 153 B11R1.3 COC1CCC(CC1)C(=O)[13CH3] 1458a_100011215563_200025704644 [0,1,0,0,0,0|1,0,2]=4 154 B11R1.3 [13CH3]C(=O)C1CCC(CC1)CO 1458a_100011217856_200025704644 [0,1,0,0,0,0|1,0,2]=4 155 B11R1.19 CC1=CCN(CC1)C(C)(C)C 269982a_100000693516_100000210625 [0,1,0,0,0,0|1,0,2]=4 156 B11R1.19 CC1=CCN(CC1)C(C)(C)C 34a_100000693516_100000210625 [0,1,0,0,0,0|1,0,2]=4 157 B11R1.19 CC1=CCN(CC1)S(=O)(=O)C 40a_100000693516_100000738038 [0,1,0,0,0,0|3,0,0]=4 158 B11R1.21 CC(=O)C1CCC(=O)N(C1)C 1458a_100011430921_200000210301 [0,1,0,0,0,0|3,0,0]=4 159 B11R1.21 CC(=O)C1CCN(C(=O)C1)C 1458a_100000043916_200000210301 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.21 CC(=O)N1CCN(C(=O)C1)C 11a_100000187256_100015343762 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.21 CC(=O)N1CCN(C(=O)C1)C 1626a_100000187256_100015343762 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.21 CC(=O)N1CCN(C(=O)C1)C 240690a_100000187256_100015343762 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.21 CC(=O)N1CCN(C(=O)C1)C 527a_100000187256_100103153847 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.21 CN1CC(CCC1=O)C(=O)[13CH3] 1458a_100011430921_200025704644 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.21 CN1CCC(CC1=O)C(=O)[13CH3] 1458a_100000043916_200025704644 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.22 C#CC(C)N1CC=C(CC1)C 34a_100000693516_200000035995 [0,1,0,0,0,0|1,0,2]=4 167 B11R1.22 C=C1CCC(CC1)C(=O)CC 1458a_200000138047_100000210202 [0,1,0,0,0,0|1,0,2]=4 168 B11R1.22 C=C1CCC(CC1)C(=O)CF 1458a_200000138047_100015361967 [0,1,0,0,0,0|1,0,2]=4 169 B11R1.22 C=C1CCC(CC1)C(=O)NC 11a_106832991635_200000138047 [0,1,0,0,0,0|1,0,2]=4 170 B11R1.22 C=C1CCC(CC1)C(=O)NC 1626a_100102657272_200000138047 [0,1,0,0,0,0|1,0,2]=4 171 B11R1.22 C=C1CCC(CC1)C(=O)NC 240690a_100102657272_200000138047 [0,1,0,0,0,0|1,0,2]=4 172 B11R1.22 C=C1CCC(CC1)C(=O)NC 527a_100102657272_200000138047 [0,1,0,0,0,0|1,0,2]=4 173 B11R1.22 C=CC(=O)C1CCC(CC1)C 1458a_100000185746_200011216234 [0,1,0,0,0,0|1,0,2]=4 174 B11R1.22 C=CC(=O)N1CC=C(CC1)C 1626a_100000693516_100000185746 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.22 C=CC(=O)N1CC=C(CC1)C 240690a_100000693516_200121576911 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.22 C=CC(C)N1CC=C(CC1)C 269982a_100000693516_100011215867 [0,1,0,0,0,0|1,0,1]=3 177 B11R1.22 CC1=CCC(CC1)C(=O)CF 1458a_100000137427_100015361967 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.22 CC1=CCN(CC1)C(=O)CO 240690a_100000693516_100000210174 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.22 CC1=CCN(CC1)C(=O)CO 527a_100000693516_100000210174 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.22 CC1=CCN(CC1)C(C)C#N 2230a_100000693516_100000184139 [0,1,0,0,0,0|1,0,2]=4 181 B11R1.22 CC1=CCN(CC1)C(C)C#N 269982a_100000693516_100000703298 [0,1,0,0,0,0|1,0,2]=4 182 B11R1.22 CC1=CCN(CC1)C(C)CO 2230a_100000693516_100012180447 [0,1,0,0,0,0|1,0,2]=4 183 B11R1.22 CC1=CCN(CC1)C(C)CO 34a_100000693516_100012180447 [0,1,0,0,0,0|1,0,2]=4 184 B11R1.22 CC1=CCN(CC1)[C@H](C)CO 269982a_100000693516_100016084084 [0,1,0,0,0,0|1,0,2]=4 185 B11R1.22 CC1CCC(CC1)C(=O)CO 1458a_100000210174_200011216234 [0,1,0,0,0,0|1,0,2]=4 186 B11R1.22 CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210202 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.22 CCC(=O)C1CCC(=O)NC1 1458a_100000740907_100000210202 [0,1,0,0,0,0|3,0,0]=4 188 B11R1.22 CCC(=O)C1CCC(CC1)C 1458a_100000210414_200011216234 [0,1,0,0,0,0|1,0,2]=4 189 B11R1.22 CCC(=O)C1CCN(CC1)C 1458a_100000743488_100000210202 [0,1,0,0,0,0|2,0,1]=4 190 B11R1.22 CCC(=O)N1CC=C(CC1)C 11a_100000693516_100000210414 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.22 CCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000210414 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.22 CCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000210414 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.22 CCC(=O)N1CC=C(CC1)C 527a_100000693516_100000210414 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.22 CCC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_100000210202 [0,1,0,0,0,0|1,0,2]=4 195 B11R1.22 CCC(C)N1CC=C(CC1)C 2230a_100000693516_100000758301 [0,1,0,0,0,0|1,0,2]=4 196 B11R1.22 CCC(C)N1CC=C(CC1)C 269982a_100000693516_100000758301 [0,1,0,0,0,0|1,0,2]=4 197 B11R1.22 CCC(C)N1CC=C(CC1)C 34a_100000693516_100011215416 [0,1,0,0,0,0|1,0,2]=4 198 B11R1.22 CN1CCC(CC1)C(=O)CF 1458a_100000743488_100015361967 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.22 CNC(=O)C1CC=C(CC1)C 11a_106832991635_100000137427 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.22 CNC(=O)C1CC=C(CC1)C 1626a_100102657272_100000137427 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.22 CNC(=O)C1CC=C(CC1)C 240690a_100102657272_100000137427 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.22 CNC(=O)C1CC=C(CC1)C 527a_100102657272_100000137427 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.22 CNC(=O)C1CCC(=O)NC1 11a_106832991635_100000740907 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.22 CNC(=O)C1CCC(=O)NC1 1626a_100102657272_100000740907 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.22 CNC(=O)C1CCC(=O)NC1 240690a_100102657272_100000740907 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.22 CNC(=O)C1CCC(=O)NC1 527a_100102657272_100000740907 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.22 CNC(=O)C1CCN(CC1)C 2230a_100000746005_200000210301 [0,1,0,0,0,0|2,0,1]=4 208 B11R1.22 CNC(=O)C1CCN(CC1)C 240690a_100102657272_100000743488 [0,1,0,0,0,0|2,0,1]=4 209 B11R1.22 CNC(=O)C1CCN(CC1)C 269982a_100000746005_200000210301 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.22 CNC(=O)C1CCN(CC1)C 34a_100000746005_200000210301 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.22 CNC(=O)C1CCN(CC1)C 527a_100102657272_100000743488 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 2230a_100000746005_200025704644 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 269982a_100000746005_200025704644 [0,1,0,0,0,0|2,0,1]=4 214 B11R1.22 CNC(=O)C1CCN(CC1)[13CH3] 34a_100000746005_200025704644 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.22 CNC(=O)N1CC=C(CC1)C 2708a_100102657272_100000693516 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.22 CNC(=O)N1CC=C(CC1)C 273464a_100102657272_100000693516 [0,1,0,0,0,0|2,0,0]=3 217 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 11a_106832991635_100009815934 [0,1,0,0,0,0|1,0,2]=4 218 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 1626a_100102657272_100009815934 [0,1,0,0,0,0|1,0,2]=4 219 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 240690a_100102657272_100009815934 [0,1,0,0,0,0|1,0,2]=4 220 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)C 527a_100102657272_100009815934 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.22 CNC(C)C1CC=C(CC1)C 269862a_106832991636_100000073480 [0,1,0,0,0,0|0,0,2]=3 222 B11R1.22 CNC(C)C1CC=C(CC1)C 270004a_106832991635_100000073480 [0,1,0,0,0,0|0,0,2]=3 223 B11R1.22 COC(=O)C1CCN(CC1)C 2230a_100000212072_200000210301 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.22 COC(=O)C1CCN(CC1)C 269982a_100000212072_200000210301 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.22 COC(=O)C1CCN(CC1)[13CH3] 2230a_100000212072_200025704644 [0,1,0,0,0,0|2,0,1]=4 226 B11R1.22 COC(=O)C1CCN(CC1)[13CH3] 269982a_100000212072_200025704644 [0,1,0,0,0,0|2,0,1]=4 227 B11R1.22 COC(C)N1CC=C(CC1)C 269982a_100000693516_100009879195 [0,1,0,0,0,0|1,0,2]=4 228 B11R1.22 C[C@H]1CC[C@@H](CC1)C(=O)CF 1458a_100009815934_100015361967 [0,1,0,0,0,0|1,0,2]=4 229 B11R1.22 O=C1CCC(CN1)C(=O)CF 1458a_100000740907_100015361967 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.220 CC(=O)C1(CCN(CC1)C)O 1458a_100015186493_200000210301 [0,1,0,0,0,0|2,0,1]=4 231 B11R1.220 CN1CCC(CC1)(O)C(=O)[13CH3] 1458a_100015186493_200025704644 [0,1,0,0,0,0|2,0,1]=4 232 B9R0.1 C=C(Br)CCOC(C)CC 34a_100009813270_100011215416 [0,0,1,0,0,0|2,0,1]=4 233 B9R0.1 C=C(C)CCNC(C)CC 2230a_100000209981_100000730704 [0,0,1,0,0,0|1,0,1]=3 234 B9R0.1 C=C(C)CCN[C@H](C)CO 2230a_100000737577_100000730704 [0,0,1,0,0,0|2,0,1]=4 235 B9R0.1 C=C(C)CCOC(C)CC 34a_100000764851_100011215416 [0,0,1,0,0,0|1,0,1]=3 236 B9R0.1 C=C(C)CCOC(C)CC 7a_100000210228_100000730704 [0,0,1,0,0,0|1,0,1]=3 237 B9R0.1 C=C(C)CCOC(C)CF 34a_100016041109_100000730704 [0,0,1,0,0,0|2,0,1]=4 238 B9R0.1 C=C(C)CCOC(C)CF 7a_100016041109_100000730704 [0,0,1,0,0,0|2,0,1]=4 239 B9R0.1 C=C(C)CCOC(C)CN 34a_100000210904_100000730704 [0,0,1,0,0,0|2,0,1]=4 240 B9R0.1 C=C(C)CCOC(C)CO 34a_100000764851_100012180447 [0,0,1,0,0,0|2,0,1]=4 241 B9R0.1 C=C(C)CCSC(C)CC 62a_100000730704_100000758301 [0,0,1,0,0,0|1,0,1]=3 242 B9R0.1 C=C(C)CCSC(C)CC 62a_100000758301_100000730704 [0,0,1,0,0,0|1,0,1]=3 243 B9R0.1 C=C(C)CCSC(C)CO 62a_100012180447_100000730704 [0,0,1,0,0,0|2,0,1]=4 244 B9R0.1 C=C(C)CCSC(C)OC 62a_100000730704_100009879195 [0,0,1,0,0,0|2,0,1]=4 245 B9R0.1 C=C(C)CCSC(C)OC 62a_100009879195_100000730704 [0,0,1,0,0,0|2,0,1]=4 246 B9R0.1 C=C(C)CCS[C@H](C)CO 62a_100000730704_100016084084 [0,0,1,0,0,0|2,0,1]=4 247 B9R0.1 C=C(C)CCS[C@H](C)CO 62a_100016084084_100000730704 [0,0,1,0,0,0|2,0,1]=4 248 B9R0.1 C=C(C)CNCC(=O)NC 2230a_100000693194_100000748629 [0,0,1,0,0,0|3,0,0]=4 249 B9R0.1 C=C(C)CNCC(C)CC 2230a_100020588543_100000748629 [0,0,1,0,0,0|1,0,2]=4 250 B9R0.1 C=C(C)CNC[C@@H](C)OC 2230a_100020591295_100000748629 [0,0,1,0,0,0|2,0,1]=4 251 B9R0.1 C=C(C)CNNC(=O)CC 22a_100000729518_100000210414 [0,0,1,0,0,0|3,0,0]=4 252 B9R0.1 C=C(C)COCC(=O)CC 34a_100000725409_100000748629 [0,0,1,0,0,0|2,0,1]=4 253 B9R0.1 C=C(C)COCC(=O)NC 34a_100000210245_100000183359 [0,0,1,0,0,0|3,0,0]=4 254 B9R0.1 C=C(C)COCC(=O)NC 34a_100000750040_100000748629 [0,0,1,0,0,0|3,0,0]=4 255 B9R0.1 C=C(C)COCC(=O)OC 34a_100000210245_100000747449 [0,0,1,0,0,0|3,0,0]=4 256 B9R0.1 C=C(C)COCC(C)CC 34a_100000210245_100000748023 [0,0,1,0,0,0|1,0,2]=4 257 B9R0.1 C=C(C)COCC(C)OC 34a_100000690652_100000748629 [0,0,1,0,0,0|2,0,1]=4 258 B9R0.1 C=C(C)COC[C@@H](C)CC 34a_100000210245_100009816398 [0,0,1,0,0,0|1,0,2]=4 259 B9R0.1 C=C(C)COC[C@@H](C)CC 7a_100009816381_100000748629 [0,0,1,0,0,0|1,0,2]=4 260 B9R0.1 C=C(C)CSCC(=O)CC 62a_100000747405_100000211660 [0,0,1,0,0,0|2,0,1]=4 261 B9R0.1 C=C(C)CSCC(=O)CC 62a_100000748629_100000747405 [0,0,1,0,0,0|2,0,1]=4 262 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000183359_100000211660 [0,0,1,0,0,0|3,0,0]=4 263 B9R0.1 C=C(C)CSCC(=O)NC 62a_100000748629_100000183359 [0,0,1,0,0,0|3,0,0]=4 264 B9R0.1 C=C(C)CSCC(=O)OC 62a_100000747449_100000211660 [0,0,1,0,0,0|3,0,0]=4 265 B9R0.1 C=C(C)CSCC(=O)OC 62a_100000748629_100000747449 [0,0,1,0,0,0|3,0,0]=4 266 B9R0.1 C=C(C)CSCC(C)CC 62a_100000748023_100000211660 [0,0,1,0,0,0|1,0,2]=4 267 B9R0.1 C=C(C)CSCC(C)CC 62a_100000748629_100000748023 [0,0,1,0,0,0|1,0,2]=4 268 B9R0.1 C=C(C)CSC[C@@H](C)CC 62a_100000748629_100009816398 [0,0,1,0,0,0|1,0,2]=4 269 B9R0.1 C=C(C)CSC[C@@H](C)CC 62a_100009816398_100000211660 [0,0,1,0,0,0|1,0,2]=4 270 B9R0.1 C=CC(=O)CCCC(=O)C 1458a_100000185746_100011215641 [0,0,1,0,0,0|2,0,1]=4 271 B9R0.1 C=CC(C)COCC(=C)C 34a_100011215527_100000748629 [0,0,1,0,0,0|1,0,2]=4 272 B9R0.1 C=CC(C)COCC(=C)C 7a_100011215527_100000748629 [0,0,1,0,0,0|1,0,2]=4 273 B9R0.1 C=CC(C)OCCC(=C)C 34a_100000695699_100000730704 [0,0,1,0,0,0|1,0,2]=4 274 B9R0.1 C=CC(C)SCCC(=C)C 62a_100011215867_100000730704 [0,0,1,0,0,0|1,0,2]=4 275 B9R0.1 CCC(=O)CCCC(=O)C 1458a_100000210414_100011215641 [0,0,1,0,0,0|2,0,1]=4 276 B9R0.1 CCC(C)OCCC(=O)C 34a_100000759926_100011215416 [0,0,1,0,0,0|2,0,1]=4 277 B9R0.1 CCC(C)OCCC(=O)C 7a_100000210228_100000053229 [0,0,1,0,0,0|2,0,1]=4 278 B9R0.1 CCC(C)OCCC(=O)C 7a_100000759926_100000758301 [0,0,1,0,0,0|2,0,1]=4 279 B9R0.1 CCC(C)SCCC(=O)C 62a_100000053229_100000758301 [0,0,1,0,0,0|2,0,1]=4 280 B9R0.1 CCC(C)SCCC(=O)C 62a_100000758301_100000053229 [0,0,1,0,0,0|2,0,1]=4 281 B9R0.1 CCN(C)CCCC(=O)C 1458a_100000070787_100015186262 [0,0,1,0,0,0|2,0,1]=4 282 B9R0.1 CCN(C)CCCC(=O)C 269982a_100000225621_100011215641 [0,0,1,0,0,0|2,0,1]=4 283 B9R0.1 CNC(=O)CCCC(=O)C 1458a_100000070787_100000741757 [0,0,1,0,0,0|3,0,0]=4 284 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000070787_100011218270 [0,0,1,0,0,0|3,0,0]=4 285 B9R0.1 COC(=O)CCCC(=O)C 1458a_100000239890_200000210301 [0,0,1,0,0,0|3,0,0]=4 286 B9R0.1 COC(=O)CCCC(=O)[13CH3] 1458a_100000239890_200025704644 [0,0,1,0,0,0|3,0,0]=4 287 B9R0.7 C=C(C)C(=O)CC=C(C)C 1458a_100000185857_100000761012 [0,0,1,0,0,0|1,0,1]=3 288 B9R0.7 C=C(C)C(C)NCC(C)C 269862a_100000210953_100011216138 [0,0,1,0,0,0|1,0,2]=4 289 B9R0.7 C=C(C)C(C)NCC(C)O 269862a_100000210904_100011216138 [0,0,1,0,0,0|2,0,1]=4 290 B9R0.7 C=C(C)CCC(=O)C(=C)C 1458a_100000185857_100000730704 [0,0,1,0,0,0|1,0,1]=3 291 B9R0.7 C=C(C)CCC(C)N(C)C 270004a_100102631434_100011215600 [0,0,1,0,0,0|1,0,1]=3 292 B9R0.7 C=C(C)CCN(C)C(C)C 269982a_200000211004_100000730704 [0,0,1,0,0,0|1,0,2]=4 293 B9R0.7 C=C(C)CNC(=O)C(=C)C 11a_100000765925_100000185857 [0,0,1,0,0,0|2,0,1]=4 294 B9R0.7 C=C(C)CNC(=O)C(=C)C 1626a_100000765925_100000185857 [0,0,1,0,0,0|2,0,1]=4 295 B9R0.7 C=C(C)CNC(C)C(C)C 2230a_100000211541_100000748629 [0,0,1,0,0,0|1,0,2]=4 296 B9R0.7 C=C(C)CN[C@@H](C)C(=O)O 269956a_100000743915_100000748629 [0,0,1,0,0,0|3,0,0]=4 297 B9R0.7 C=C(C)CN[C@H](C)C(=O)N 2230a_100000119354_100000748629 [0,0,1,0,0,0|3,0,0]=4 298 B9R0.7 C=C(C)CN[C@H](C)C(=O)N 34a_100000119354_100000748629 [0,0,1,0,0,0|3,0,0]=4 299 B9R0.7 C=C(C)COC(C)C(=O)C 34a_100000212229_100000748629 [0,0,1,0,0,0|2,0,0]=3 300 B9R0.7 C=C(C)COC(C)C(=O)N 34a_100000210245_100000702099 [0,0,1,0,0,0|3,0,0]=4 301 B9R0.7 C=C(C)COC(C)C(C)C 7a_100000748068_100000748629 [0,0,1,0,0,0|1,0,2]=4 302 B9R0.7 C=C(C)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000748629 [0,0,1,0,0,0|3,0,0]=4 303 B9R0.7 C=C(C)CO[C@H](C)C(=O)N 34a_100000731257_100000748629 [0,0,1,0,0,0|3,0,0]=4 304 B9R0.7 C=C(C)CO[C@H](C)C(=O)N 7a_100000731257_100000748629 [0,0,1,0,0,0|3,0,0]=4 305 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100000748629_100009814033 [0,0,1,0,0,0|2,0,0]=3 306 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100009814033_100000211660 [0,0,1,0,0,0|2,0,0]=3 307 B9R0.7 C=C(C)CSC(C)C(=O)N 62a_100000702099_100000211660 [0,0,1,0,0,0|3,0,0]=4 308 B9R0.7 C=C(C)CSC(C)C(=O)N 62a_100000748629_100000702099 [0,0,1,0,0,0|3,0,0]=4 309 B9R0.7 C=C(F)COC(C)C(=O)C 34a_100000212229_100009893438 [0,0,1,0,0,0|3,0,0]=4 310 B9R0.7 C=C(F)CSC(C)C(=O)C 62a_100000042424_100009814033 [0,0,1,0,0,0|3,0,0]=4 311 B9R0.7 C=C(F)CSC(C)C(=O)C 62a_100009814033_100000042424 [0,0,1,0,0,0|3,0,0]=4 312 B9R0.7 CC(=CCN(C)C(C)C)C 269982a_200000211004_100000761012 [0,0,1,0,0,0|1,0,2]=4 313 B9R0.7 CC(=O)C(C)CCC(C)C 1458a_100000070787_100011261404 [0,0,1,0,0,0|1,0,2]=4 314 B9R0.7 CC(=O)C(C)COC(C)C 34a_100000032740_100000210206 [0,0,1,0,0,0|2,0,1]=4 315 B9R0.7 CC(=O)C(C)COC(C)C 7a_100000032740_100000210206 [0,0,1,0,0,0|2,0,1]=4 316 B9R0.7 CC(=O)CCN(C)C(=O)C 1458a_100011216537_200000210301 [0,0,1,0,0,0|3,0,0]=4 317 B9R0.7 CC(=O)N(C)CCC(=O)[13CH3] 1458a_100011216537_200025704644 [0,0,1,0,0,0|3,0,0]=4 318 B9R0.7 CC(=O)SC[C@@H](C)C(=O)C 1458a_200015407212_200000210301 [0,0,1,0,0,0|3,0,0]=4 319 B9R0.7 CC(=O)SC[C@@H](C)C(=O)[13CH3] 1458a_200015407212_200025704644 [0,0,1,0,0,0|3,0,0]=4 320 B9R0.13 C/C=C/CN(CC)C(C)C 269982a_100000223864_100102629194 [0,0,1,0,0,0|1,0,2]=4 321 B9R0.13 CC=CCN(CC)C(C)C 2230a_100000223864_100000070051 [0,0,1,0,0,0|1,0,2]=4 322 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000070787_200011216223 [0,0,1,0,0,0|1,0,2]=4 323 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000211130_200000210301 [0,0,1,0,0,0|1,0,2]=4 324 B9R0.13 CCCCC(CC)C(=O)[13CH3] 1458a_100000211130_200025704644 [0,0,1,0,0,0|1,0,2]=4 325 B11R2.34 CC1=CCN(CC1)C2CC2 269982a_100000693516_100000211595 [0,0,0,1,0,0|1,0,2]=4 326 B11R2.34 CC1=CCN(CC1)C2CC2 34a_100000693516_100000211595 [0,0,0,1,0,0|1,0,2]=4 327 B9R1.35 C=C(C)c1cc([nH]n1)C 271570a_100000694244_100015199547 [0,0,0,0,1,0|2,0,1]=4 328 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [0,0,0,0,1,0|1,0,2]=4 329 B9R1.35 C=C(C)c1cc(ns1)C 271570a_100000694244_100009815735 [0,0,0,0,1,0|2,0,1]=4 330 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [0,0,0,0,1,0|1,0,2]=4 331 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [0,0,0,0,1,0|1,0,2]=4 332 B9R1.35 C=C(C)c1nc(c[nH]1)C 271570a_100000694244_100161115468 [0,0,0,0,1,0|2,0,1]=4 333 B9R1.35 C=C(C)c1nc(cs1)C 271570a_100000694244_100011291629 [0,0,0,0,1,0|2,0,1]=4 334 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [0,0,0,0,1,0|2,0,1]=4 335 B9R1.35 CC(=O)C1CC(=NO1)C 1458a_100000763720_200000210301 [0,0,0,0,1,0|3,0,0]=4 336 B9R1.35 CC(=O)C1CCC(=O)N1 1458a_100000210400_200000210301 [0,0,0,0,1,0|3,0,0]=4 337 B9R1.35 CC(=O)C1CCC(C1)O 1458a_100000688591_200000210301 [0,0,0,0,1,0|2,0,1]=4 338 B9R1.35 CC(=O)C1CCN(C1)C 1458a_100000739633_200000210301 [0,0,0,0,1,0|2,0,0]=3 339 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [0,0,0,0,1,0|3,0,0]=4 340 B9R1.35 CC(=O)N1CC[C@H](C1)C 11a_100016987628_100015343762 [0,0,0,0,1,0|2,0,1]=4 341 B9R1.35 CC(=O)N1CC[C@H](C1)C 240690a_100016987628_100015343762 [0,0,0,0,1,0|2,0,1]=4 342 B9R1.35 CC(=O)N1CC[C@H](C1)C 527a_100016987628_100103153847 [0,0,0,0,1,0|2,0,1]=4 343 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [0,0,0,0,1,0|3,0,0]=4 344 B9R1.35 CC1=NOC(C1)C(=O)[13CH3] 1458a_100000763720_200025704644 [0,0,0,0,1,0|3,0,0]=4 345 B9R1.35 CC1CCC(C1)N(C)C 270004a_100102631434_100011215218 [0,0,0,0,1,0|1,0,2]=4 346 B9R1.35 CN(C)[C@H]1CCN(C1)[13CH3] 2230a_100016988096_200025704644 [0,0,0,0,1,0|2,0,1]=4 347 B9R1.35 CN(C)[C@H]1CCN(C1)[13CH3] 269982a_100016988096_200025704644 [0,0,0,0,1,0|2,0,1]=4 348 B9R1.35 CN1CCC(C1)C(=O)N 2230a_100000752358_200000210301 [0,0,0,0,1,0|3,0,0]=4 349 B9R1.35 CN1CCC(C1)C(=O)N 269982a_100000752358_200000210301 [0,0,0,0,1,0|3,0,0]=4 350 B9R1.35 CN1CCC(C1)C(=O)N 34a_100000752358_200000210301 [0,0,0,0,1,0|3,0,0]=4 351 B9R1.35 CN1CCC(C1)C(=O)[13CH3] 1458a_100000739633_200025704644 [0,0,0,0,1,0|2,0,0]=3 352 B9R1.35 CN1CCC(C1)N(C)C 2230a_103436538152_200000210301 [0,0,0,0,1,0|2,0,1]=4 353 B9R1.35 CN1CCC(C1)N(C)C 269982a_100102631434_200012183744 [0,0,0,0,1,0|2,0,1]=4 354 B9R1.35 CN1CCC(C1)N(C)C 269982a_103436538152_200000210301 [0,0,0,0,1,0|2,0,1]=4 355 B9R1.35 CN1CCC(C1)N(C)[13CH3] 2230a_103436538152_200025704644 [0,0,0,0,1,0|2,0,1]=4 356 B9R1.35 CN1CCC(C1)N(C)[13CH3] 269982a_103436538152_200025704644 [0,0,0,0,1,0|2,0,1]=4 357 B9R1.35 CN1CC[C@@H](C1)N(C)C 2230a_100016988096_200000210301 [0,0,0,0,1,0|2,0,1]=4 358 B9R1.35 CN1CC[C@@H](C1)N(C)C 269982a_100016988096_200000210301 [0,0,0,0,1,0|2,0,1]=4 359 B9R1.35 [13CH3]C(=O)C1CCC(=O)N1 1458a_100000210400_200025704644 [0,0,0,0,1,0|3,0,0]=4 360 B9R1.35 [13CH3]C(=O)C1CCC(C1)O 1458a_100000688591_200025704644 [0,0,0,0,1,0|2,0,1]=4 361 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [0,0,0,0,1,0|3,0,0]=4 362 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [0,0,0,0,1,0|3,0,0]=4 363 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 2230a_100000752358_200025704644 [0,0,0,0,1,0|3,0,0]=4 364 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 269982a_100000752358_200025704644 [0,0,0,0,1,0|3,0,0]=4 365 B9R1.35 [13CH3]N1CCC(C1)C(=O)N 34a_100000752358_200025704644 [0,0,0,0,1,0|3,0,0]=4 366 B11R1.20 C=C(C)CN1CC=C(CC1)C 2230a_100000693516_100000748629 [0,0,0,0,0,1|1,0,0]=2 367 B11R1.20 C=C(C)CN1CC=C(CC1)C 269982a_100000693516_100000748629 [0,0,0,0,0,1|1,0,0]=2 368 B11R1.20 C=C(C)CN1CC=C(CC1)C 34a_100000693516_100000748629 [0,0,0,0,0,1|1,0,0]=2 369 B11R1.20 C=C(C)CN1CCC(=C)CC1 2230a_100000752442_100000748629 [0,0,0,0,0,1|1,0,2]=4 370 B11R1.20 C=C(C)CN1CCC(=C)CC1 269982a_100000752442_100000748629 [0,0,0,0,0,1|1,0,2]=4 371 B11R1.20 C=C(C)CN1CCC(=C)CC1 34a_100000752442_100000748629 [0,0,0,0,0,1|1,0,2]=4 372 B11R1.20 C=C(C)CN1CCC(CC1)C 2230a_100000188429_100000748629 [0,0,0,0,0,1|1,0,2]=4 373 B11R1.20 C=C(C)CN1CCC(CC1)C 269982a_100000188429_100000748629 [0,0,0,0,0,1|1,0,2]=4 374 B11R1.20 C=C(C)CN1CCC(CC1)C 34a_100000188429_100000748629 [0,0,0,0,0,1|1,0,2]=4 375 B11R1.20 C=C(C)CN1CCN(CC1)C 2230a_100000188432_100000748629 [0,0,0,0,0,1|2,0,1]=4 376 B11R1.20 C=C(C)CN1CCN(CC1)C 2230a_200011218452_200000210301 [0,0,0,0,0,1|2,0,1]=4 377 B11R1.20 C=C(C)CN1CCN(CC1)C 269982a_100000188432_100000748629 [0,0,0,0,0,1|2,0,1]=4 378 B11R1.20 C=C(C)CN1CCN(CC1)C 269982a_200011218452_200000210301 [0,0,0,0,0,1|2,0,1]=4 379 B11R1.20 C=C(C)CN1CCN(CC1)[13CH3] 2230a_200011218452_200025704644 [0,0,0,0,0,1|2,0,1]=4 380 B11R1.20 C=C(C)CN1CCN(CC1)[13CH3] 269982a_200011218452_200025704644 [0,0,0,0,0,1|2,0,1]=4 381 B11R1.20 C=C(F)CN1CC=C(CC1)C 2230a_100000693516_100009893438 [0,0,0,0,0,1|2,0,0]=3 382 B11R1.20 C=C(F)CN1CC=C(CC1)C 269982a_100000693516_100009893438 [0,0,0,0,0,1|2,0,0]=3 383 B11R1.20 C=C(F)CN1CC=C(CC1)C 34a_100000693516_100009893438 [0,0,0,0,0,1|2,0,0]=3 384 B11R1.20 CC(=O)CC1CCC(CC1)C 1458a_100011215564_200000210301 [0,0,0,0,0,1|1,0,2]=4 385 B11R1.20 CC(=O)CC1CCN(CC1)C 1458a_100000700355_200000210301 [0,0,0,0,0,1|2,0,1]=4 386 B11R1.20 CC(=O)NC1CCC(=O)NC1 11a_100000748762_100015343762 [0,0,0,0,0,1|3,0,0]=4 387 B11R1.20 CC(=O)NC1CCC(=O)NC1 1626a_100000748762_100015343762 [0,0,0,0,0,1|3,0,0]=4 388 B11R1.20 CC(=O)NC1CCC(=O)NC1 240690a_100000748762_100015343762 [0,0,0,0,0,1|3,0,0]=4 389 B11R1.20 CC(=O)NC1CCC(=O)NC1 527a_100000748762_100103153847 [0,0,0,0,0,1|3,0,0]=4 390 B11R1.20 CC(=O)NC1CCN(CC1)C 11a_100000198570_100015343762 [0,0,0,0,0,1|2,0,1]=4 391 B11R1.20 CC(=O)NC1CCN(CC1)C 2230a_100000747453_200000210301 [0,0,0,0,0,1|2,0,1]=4 392 B11R1.20 CC(=O)NC1CCN(CC1)C 240690a_100000198570_100015343762 [0,0,0,0,0,1|2,0,1]=4 393 B11R1.20 CC(=O)NC1CCN(CC1)C 269982a_100000747453_200000210301 [0,0,0,0,0,1|2,0,1]=4 394 B11R1.20 CC(=O)NC1CCN(CC1)C 527a_100000198570_100103153847 [0,0,0,0,0,1|2,0,1]=4 395 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 2230a_100000747453_200025704644 [0,0,0,0,0,1|2,0,1]=4 396 B11R1.20 CC(=O)NC1CCN(CC1)[13CH3] 269982a_100000747453_200025704644 [0,0,0,0,0,1|2,0,1]=4 397 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 1626a_100020625639_100015343762 [0,0,0,0,0,1|1,0,2]=4 398 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 240690a_100020625639_100015343762 [0,0,0,0,0,1|1,0,2]=4 399 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C 527a_100020625639_100103153847 [0,0,0,0,0,1|1,0,2]=4 400 B11R1.20 CC1=CCN(CC1)CC(=O)N 2230a_100000693516_100000747473 [0,0,0,0,0,1|3,0,0]=4 401 B11R1.20 CC1=CCN(CC1)CC(=O)N 269982a_100000693516_100000187820 [0,0,0,0,0,1|3,0,0]=4 402 B11R1.20 CC1=CCN(CC1)CC(=O)N 34a_100000693516_100000187820 [0,0,0,0,0,1|3,0,0]=4 403 B11R1.20 CC1=CCN(CC1)CC(=O)[O-] 269982a_100000693516_100020667443 [0,0,0,0,0,1|3,0,0]=4 404 B11R1.20 CC1=CCN(CC1)CC(=O)[O-] 34a_100000693516_100020667443 [0,0,0,0,0,1|3,0,0]=4 405 B11R1.20 CC1=CCN(CC1)CC(C)C 2230a_100000693516_100000210760 [0,0,0,0,0,1|1,0,2]=4 406 B11R1.20 CC1=CCN(CC1)CC(C)C 269982a_100000693516_100000210624 [0,0,0,0,0,1|1,0,2]=4 407 B11R1.20 CC1=CCN(CC1)CC(C)C 270004a_100000693516_100000210432 [0,0,0,0,0,1|1,0,2]=4 408 B11R1.20 CC1=CCN(CC1)CC(C)C 34a_100000693516_100000210624 [0,0,0,0,0,1|1,0,2]=4 409 B11R1.20 CC1=CCN(CC1)CC(C)O 2230a_100000693516_100011218427 [0,0,0,0,0,1|2,0,1]=4 410 B11R1.20 CC1=CCN(CC1)CC(C)O 269982a_100000693516_100011218427 [0,0,0,0,0,1|2,0,1]=4 411 B11R1.20 CC1=CCN(CC1)CC(C)O 34a_100000693516_100011218427 [0,0,0,0,0,1|2,0,1]=4 412 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 2230a_100000693516_100009817552 [0,0,0,0,0,1|2,0,1]=4 413 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 269982a_100000693516_100009817552 [0,0,0,0,0,1|2,0,1]=4 414 B11R1.20 CC1=CCN(CC1)C[C@@H](C)O 34a_100000693516_100009817552 [0,0,0,0,0,1|2,0,1]=4 415 B11R1.20 CC1CCC(CC1)CC(=O)[13CH3] 1458a_100011215564_200025704644 [0,0,0,0,0,1|1,0,2]=4 416 B11R1.20 CN1CCC(CC1)CC(=O)[13CH3] 1458a_100000700355_200025704644 [0,0,0,0,0,1|2,0,1]=4 417 B8R0.6 C=CCCCC(=O)C=C 1458a_100000185746_100000757094 [1,0,1,0,0,0|1,0,1]=4 418 B8R0.6 C=CCCCC(=O)CC 1458a_100000210414_100000757094 [1,0,1,0,0,0|1,0,1]=4 419 B8R0.6 C=CCCCC(=O)CC 1458a_100000766728_100000210202 [1,0,1,0,0,0|1,0,1]=4 420 B8R0.6 C=CCCCC(=O)NC 11a_106832991635_100000766728 [1,0,1,0,0,0|2,0,0]=4 421 B8R0.6 C=CCCCC(=O)NC 1626a_100102657272_100000766728 [1,0,1,0,0,0|2,0,0]=4 422 B8R0.6 C=CCCCC(=O)NC 240690a_100102657272_100000766728 [1,0,1,0,0,0|2,0,0]=4 423 B8R0.6 C=CCCCC(=O)NC 527a_100102657272_100000766728 [1,0,1,0,0,0|2,0,0]=4 424 B8R0.6 C=CCCCN(C)CC 2230a_100000225621_100011713584 [1,0,1,0,0,0|1,0,1]=4 425 B8R0.6 C=CCCCN(C)CC 269982a_100000225621_100000757094 [1,0,1,0,0,0|1,0,1]=4 426 B8R0.6 C=CCCNC(=O)CC 11a_100015191253_100000210414 [1,0,1,0,0,0|2,0,0]=4 427 B8R0.6 C=CCCNC(=O)CC 1626a_100015191253_100000210414 [1,0,1,0,0,0|2,0,0]=4 428 B8R0.6 C=CCCNC(=O)CC 240690a_100015191253_100000210414 [1,0,1,0,0,0|2,0,0]=4 429 B8R0.6 C=CCCNC(=O)CC 527a_100015191253_100000210414 [1,0,1,0,0,0|2,0,0]=4 430 B8R0.6 C=CCCNC(C)CC 2230a_100000209981_100000754431 [1,0,1,0,0,0|1,0,1]=4 431 B8R0.6 C=CCCNC(C)CC 2230a_100015191253_100000758301 [1,0,1,0,0,0|1,0,1]=4 432 B8R0.6 C=CCCOC(C)CC 34a_100011205117_100011215416 [1,0,1,0,0,0|1,0,1]=4 433 B8R0.6 C=CCCOC(C)CC 7a_100000210228_100000754431 [1,0,1,0,0,0|1,0,1]=4 434 B8R0.6 C=CCCSC(C)CC 62a_100000754431_100000758301 [1,0,1,0,0,0|1,0,1]=4 435 B8R0.6 C=CCCSC(C)CC 62a_100000758301_100000754431 [1,0,1,0,0,0|1,0,1]=4 436 B8R0.7 C/C=C/COCC(=O)C 34a_100000211253_100102629194 [1,0,1,0,0,0|2,0,0]=4 437 B8R0.7 C=C(C)CCOCCC 34a_100000210258_100000730704 [1,0,1,0,0,0|1,0,1]=4 438 B8R0.7 C=C(C)CCOCCC 34a_100000764851_100000210303 [1,0,1,0,0,0|1,0,1]=4 439 B8R0.7 C=C(C)CCSCCC 62a_100000210303_100000730704 [1,0,1,0,0,0|1,0,1]=4 440 B8R0.7 C=C(C)CCSCCC 62a_100000730704_100000210303 [1,0,1,0,0,0|1,0,1]=4 441 B8R0.7 C=C(C)COC/C=C/C 34a_100000210245_100102629194 [1,0,1,0,0,0|1,0,0]=3 442 B8R0.7 C=C(C)COC/C=C/C 34a_100016270725_100000748629 [1,0,1,0,0,0|1,0,0]=3 443 B8R0.7 C=C(C)COCC=CC 34a_100000210245_100000070051 [1,0,1,0,0,0|1,0,0]=3 444 B8R0.7 C=C(C)CSC/C=C/C 62a_100000748629_100102629194 [1,0,1,0,0,0|1,0,0]=3 445 B8R0.7 C=C(C)CSC/C=C/C 62a_100102629194_100000211660 [1,0,1,0,0,0|1,0,0]=3 446 B8R0.7 C=C(C)CSCC=CC 62a_100000070051_100000211660 [1,0,1,0,0,0|1,0,0]=3 447 B8R0.7 C=C(C)CSCC=CC 62a_100000748629_100000070051 [1,0,1,0,0,0|1,0,0]=3 448 B8R0.7 C=C(F)COC/C=C/C 34a_100016270725_100009893438 [1,0,1,0,0,0|2,0,0]=4 449 B8R0.7 C=C(F)COC/C=C/C 34a_200010262243_100102629194 [1,0,1,0,0,0|2,0,0]=4 450 B8R0.7 C=C(F)COCC=CC 34a_200010262243_100000070051 [1,0,1,0,0,0|2,0,0]=4 451 B8R0.7 C=C(F)CSC/C=C/C 62a_100000042424_100102629194 [1,0,1,0,0,0|2,0,0]=4 452 B8R0.7 C=C(F)CSC/C=C/C 62a_100102629194_100000042424 [1,0,1,0,0,0|2,0,0]=4 453 B8R0.7 C=C(F)CSCC=CC 62a_100000042424_100000070051 [1,0,1,0,0,0|2,0,0]=4 454 B8R0.7 C=C(F)CSCC=CC 62a_100000070051_100000042424 [1,0,1,0,0,0|2,0,0]=4 455 B8R0.7 CC/C=C\CCC(=O)C 1458a_100000070787_100015370543 [1,0,1,0,0,0|1,0,0]=3 456 B8R0.7 CC/C=C\CCN(C)C 2230a_100102631434_100015370543 [1,0,1,0,0,0|1,0,1]=4 457 B8R0.7 CC/C=C\CCN(C)C 269982a_100102631434_100015370543 [1,0,1,0,0,0|1,0,1]=4 458 B8R0.7 CC=CCOCC(=O)C 34a_100000211253_100000070051 [1,0,1,0,0,0|2,0,0]=4 459 B8R0.28 C=C(C)CCNC(C)C 2230a_100138425928_100000730704 [1,0,1,0,0,0|1,0,1]=4 460 B8R0.28 C=C(C)CCNC(C)C 34a_100138425928_100000730704 [1,0,1,0,0,0|1,0,1]=4 461 B8R0.28 C=C(C)CCOC(C)C 34a_100000212225_100000730704 [1,0,1,0,0,0|1,0,1]=4 462 B8R0.28 C=C(C)CCOC(C)C 34a_100000764851_100000210206 [1,0,1,0,0,0|1,0,1]=4 463 B8R0.28 C=C(C)CCSC(C)C 62a_100000210206_100000730704 [1,0,1,0,0,0|1,0,1]=4 464 B8R0.28 C=C(C)CCSC(C)C 62a_100000730704_100000210206 [1,0,1,0,0,0|1,0,1]=4 465 B8R0.28 C=C(C)CNCC(C)C 2230a_100000210953_100000748629 [1,0,1,0,0,0|1,0,1]=4 466 B8R0.28 C=C(C)CNCC(C)C 34a_100000210953_100000748629 [1,0,1,0,0,0|1,0,1]=4 467 B8R0.28 C=C(C)COCC(=C)C 34a_100000210245_100000748629 [1,0,1,0,0,0|1,0,0]=3 468 B8R0.28 C=C(C)COCC(=C)F 34a_100000210245_100009893438 [1,0,1,0,0,0|2,0,0]=4 469 B8R0.28 C=C(C)COCC(=C)F 34a_200010262243_100000748629 [1,0,1,0,0,0|2,0,0]=4 470 B8R0.28 C=C(C)COCC(=O)C 34a_100000211253_100000748629 [1,0,1,0,0,0|2,0,0]=4 471 B8R0.28 C=C(C)COCC(C)C 34a_100000210245_100000210624 [1,0,1,0,0,0|1,0,1]=4 472 B8R0.28 C=C(C)COCC(C)C 34a_100000210257_100000748629 [1,0,1,0,0,0|1,0,1]=4 473 B8R0.28 C=C(C)CSCC(=C)C 62a_100000748629_100000211660 [1,0,1,0,0,0|1,0,0]=3 474 B8R0.28 C=C(C)CSCC(=C)F 62a_100000042424_100000211660 [1,0,1,0,0,0|2,0,0]=4 475 B8R0.28 C=C(C)CSCC(=C)F 62a_100000748629_100000042424 [1,0,1,0,0,0|2,0,0]=4 476 B8R0.28 C=C(C)CSCC(C)C 62a_100000210624_100000211660 [1,0,1,0,0,0|1,0,1]=4 477 B8R0.28 C=C(C)CSCC(C)C 62a_100000748629_100000210760 [1,0,1,0,0,0|1,0,1]=4 478 B8R0.28 CC(=CCCN(C)C)C 2230a_100102631434_100011217483 [1,0,1,0,0,0|1,0,1]=4 479 B8R0.28 CC(=CCCN(C)C)C 269982a_100102631434_100011217483 [1,0,1,0,0,0|1,0,1]=4 480 B8R0.28 CC(=O)CCC=C(C)C 1458a_100000070787_100011217483 [1,0,1,0,0,0|1,0,0]=3 481 B8R0.28 CC(=O)CCCC(=O)C 1458a_100000070787_100011215641 [1,0,1,0,0,0|2,0,0]=4 482 B8R0.28 CC(=O)CCCC(C)C 1458a_100000070787_100011214892 [1,0,1,0,0,0|1,0,1]=4 483 B8R0.28 CC(=O)CCCC(C)C 1458a_100011216857_200000210301 [1,0,1,0,0,0|1,0,1]=4 484 B8R0.28 CC(=O)CCCN(C)C 1458a_100000070787_100000695564 [1,0,1,0,0,0|2,0,0]=4 485 B8R0.28 CC(=O)CCCN(C)C 269982a_100102631434_100011215641 [1,0,1,0,0,0|2,0,0]=4 486 B8R0.28 CC(=O)NCC=C(C)C 11a_100000718196_100015343762 [1,0,1,0,0,0|2,0,0]=4 487 B8R0.28 CC(=O)NCC=C(C)C 1626a_100000718196_100015343762 [1,0,1,0,0,0|2,0,0]=4 488 B8R0.28 CC(=O)NCC=C(C)C 527a_100000718196_100103153847 [1,0,1,0,0,0|2,0,0]=4 489 B8R0.28 CC(C)CCCC(=O)[13CH3] 1458a_100011216857_200025704644 [1,0,1,0,0,0|1,0,1]=4 490 B8R0.8 C=C(C)C(=O)C/C=C/C 1458a_100000185857_100102629194 [1,0,1,0,0,0|1,0,1]=4 491 B8R0.8 C=C(C)C(=O)CC=CC 1458a_100000185857_100000070051 [1,0,1,0,0,0|1,0,1]=4 492 B8R0.8 C=C(C)C(C)NCCC 269862a_100020643023_100011216138 [1,0,1,0,0,0|1,0,1]=4 493 B8R0.8 C=CCCC(=O)C(=C)C 1458a_100000185857_100000754431 [1,0,1,0,0,0|1,0,1]=4 494 B8R0.8 C=CCCC(C)N(C)C 270004a_100102631434_100000762624 [1,0,1,0,0,0|1,0,1]=4 495 B8R0.8 C=CCCN(C)C(=O)C 11a_100020639649_100015343762 [1,0,1,0,0,0|2,0,0]=4 496 B8R0.8 C=CCCN(C)C(=O)C 1626a_100020639649_100015343762 [1,0,1,0,0,0|2,0,0]=4 497 B8R0.8 C=CCCN(C)C(=O)C 240690a_100020639649_100015343762 [1,0,1,0,0,0|2,0,0]=4 498 B8R0.8 C=CCCN(C)C(=O)C 527a_100020639649_100103153847 [1,0,1,0,0,0|2,0,0]=4 499 B8R0.8 C=CCNC(C)C(=O)C 2230a_100020586998_100009814033 [1,0,1,0,0,0|2,0,0]=4 500 B8R0.8 C=CCOC(C)C(=O)C 34a_100000212229_100015514636 [1,0,1,0,0,0|2,0,0]=4 501 B8R0.8 C=CCSC(C)C(=O)C 1458a_100000230602_200000210301 [1,0,1,0,0,0|2,0,0]=4 502 B8R0.8 C=CCSC(C)C(=O)C 62a_100000210623_100009814033 [1,0,1,0,0,0|2,0,0]=4 503 B8R0.8 C=CCSC(C)C(=O)C 62a_100009814033_100000210623 [1,0,1,0,0,0|2,0,0]=4 504 B8R0.8 C=CCSC(C)C(=O)[13CH3] 1458a_100000230602_200025704644 [1,0,1,0,0,0|2,0,0]=4 505 B8R0.8 CCCCC(C)C(=O)C 1458a_100000070787_200011215066 [1,0,1,0,0,0|1,0,1]=4 506 B8R0.8 CCCCC(C)C(=O)C 1458a_100000725509_200000210301 [1,0,1,0,0,0|1,0,1]=4 507 B8R0.8 CCCCC(C)C(=O)[13CH3] 1458a_100000725509_200025704644 [1,0,1,0,0,0|1,0,1]=4 508 B8R0.9 C=C(C)CCC(C)NC 270004a_106832991635_100011215600 [1,0,1,0,0,0|1,0,0]=3 509 B8R0.9 C=C(C)CCN(C)CC 2230a_100000225621_100000730704 [1,0,1,0,0,0|1,0,1]=4 510 B8R0.9 C=C(C)CCN(C)CC 269982a_100000225621_100000730704 [1,0,1,0,0,0|1,0,1]=4 511 B8R0.9 C=C(C)CNC(C)CC 2230a_100000209981_100000748629 [1,0,1,0,0,0|1,0,1]=4 512 B8R0.9 C=C(C)COC(C)CC 34a_100000210245_100011215416 [1,0,1,0,0,0|1,0,1]=4 513 B8R0.9 C=C(C)COC(C)CC 7a_100000210228_100000748629 [1,0,1,0,0,0|1,0,1]=4 514 B8R0.9 C=C(C)CSC(C)CC 62a_100000748629_100000758301 [1,0,1,0,0,0|1,0,1]=4 515 B8R0.9 C=C(C)CSC(C)CC 62a_100000758301_100000211660 [1,0,1,0,0,0|1,0,1]=4 516 B8R0.9 C=C(C)CSC(C)OC 62a_100000748629_100009879195 [1,0,1,0,0,0|2,0,0]=4 517 B8R0.9 C=C(C)CSC(C)OC 62a_100009879195_100000211660 [1,0,1,0,0,0|2,0,0]=4 518 B8R0.9 C=CC(=O)CC=C(C)C 1458a_100000185746_100000761012 [1,0,1,0,0,0|1,0,1]=4 519 B8R0.9 C=CC(=O)CCC(=C)C 1458a_100000185746_100000730704 [1,0,1,0,0,0|1,0,1]=4 520 B8R0.9 C=CC(C)COC(C)C 34a_100011215527_100000210206 [1,0,1,0,0,0|1,0,1]=4 521 B8R0.9 C=CC(C)COC(C)C 7a_100011215527_100000210206 [1,0,1,0,0,0|1,0,1]=4 522 B8R0.9 C=CC(C)OCC(=C)C 34a_100000695699_100000748629 [1,0,1,0,0,0|1,0,0]=3 523 B8R0.9 C=CC(C)OCC(=C)F 34a_100000695699_100009893438 [1,0,1,0,0,0|2,0,0]=4 524 B8R0.9 C=CC(C)SCC(=C)C 62a_100011215867_100000211660 [1,0,1,0,0,0|1,0,0]=3 525 B8R0.9 C=CC(C)SCC(=C)F 62a_100011215867_100000042424 [1,0,1,0,0,0|2,0,0]=4 526 B8R0.9 CCC(C)CCC(=O)C 1458a_100000701222_200000210301 [1,0,1,0,0,0|1,0,1]=4 527 B8R0.9 CCC(C)CCC(=O)[13CH3] 1458a_100000701222_200025704644 [1,0,1,0,0,0|1,0,1]=4 528 B8R0.9 CCN(C)CC=C(C)C 2230a_100000225621_100000761012 [1,0,1,0,0,0|1,0,1]=4 529 B8R0.9 CCN(C)CC=C(C)C 269982a_100000225621_100000761012 [1,0,1,0,0,0|1,0,1]=4 530 B8R0.11 C/C=C/CN(CC)CC 269956a_100000042499_100102629194 [1,0,1,0,0,0|1,0,1]=4 531 B8R0.11 C/C=C/CN(CC)CC 269982a_100000724800_100102629194 [1,0,1,0,0,0|1,0,1]=4 532 B8R0.11 CC=CCN(CC)CC 2230a_100000724800_100000070051 [1,0,1,0,0,0|1,0,1]=4 533 B8R0.15 CCCC(CC)C(=O)C 1458a_100000070787_100011219200 [1,0,1,0,0,0|1,0,1]=4 534 B8R0.15 CCCC(CC)C(=O)C 1458a_100011416436_200000210301 [1,0,1,0,0,0|1,0,1]=4 535 B8R0.15 CCCC(CC)C(=O)[13CH3] 1458a_100011416436_200025704644 [1,0,1,0,0,0|1,0,1]=4 536 B8R1.2 CCN1CC=CCC1 2230a_100000698166_100000210202 [2,0,0,0,0,0|1,0,1]=4 537 B8R1.2 CCN1CC=CCC1 269982a_100000698166_100000204670 [2,0,0,0,0,0|1,0,1]=4 538 B8R1.2 CCN1CC=CCC1 34a_100000698166_100000210202 [2,0,0,0,0,0|1,0,1]=4 539 B8R1.2 COC1CC=CCC1 34a_100000073881_200000210301 [2,0,0,0,0,0|1,0,0]=3 540 B8R1.2 [13CH3]OC1CC=CCC1 34a_100000073881_200025704644 [2,0,0,0,0,0|1,0,0]=3 541 B8R1.3 CC1=CCN(CC1)C 2230a_100000693516_200000210301 [2,0,0,0,0,0|1,0,0]=3 542 B8R1.3 CC1=CCN(CC1)C 269982a_100000693516_200000210301 [2,0,0,0,0,0|1,0,0]=3 543 B8R1.3 CC1=CCN(CC1)C 34a_100000693516_200000210301 [2,0,0,0,0,0|1,0,0]=3 544 B8R1.3 CC1=CCN(CC1)[13CH3] 2230a_100000693516_200025704644 [2,0,0,0,0,0|1,0,0]=3 545 B8R1.3 CC1=CCN(CC1)[13CH3] 269982a_100000693516_200025704644 [2,0,0,0,0,0|1,0,0]=3 546 B8R1.3 CC1=CCN(CC1)[13CH3] 34a_100000693516_200025704644 [2,0,0,0,0,0|1,0,0]=3 547 B8R1.3 CC1CCN(CC1)C 2230a_100000188429_200000210301 [2,0,0,0,0,0|1,0,1]=4 548 B8R1.3 CC1CCN(CC1)C 269982a_100000188429_200000210301 [2,0,0,0,0,0|1,0,1]=4 549 B8R1.3 CC1CCN(CC1)C 34a_100000188429_200000210301 [2,0,0,0,0,0|1,0,1]=4 550 B8R1.3 CC1CCN(CC1)[13CH3] 2230a_100000188429_200025704644 [2,0,0,0,0,0|1,0,1]=4 551 B8R1.3 CC1CCN(CC1)[13CH3] 269982a_100000188429_200025704644 [2,0,0,0,0,0|1,0,1]=4 552 B8R1.3 CC1CCN(CC1)[13CH3] 34a_100000188429_200025704644 [2,0,0,0,0,0|1,0,1]=4 553 B10R0.3 C=C(C)CCNC(C)CCC 2230a_100000741246_100000730704 [0,1,1,0,0,0|1,0,1]=4 554 B10R0.3 C=C(C)CCN[C@H](C)CCO 2230a_100000706166_100000730704 [0,1,1,0,0,0|1,0,1]=4 555 B10R0.3 C=C(C)CCN[C@H](C)CCO 34a_100000706166_100000730704 [0,1,1,0,0,0|1,0,1]=4 556 B10R0.3 C=C(C)CCN[C@H](C)COC 2230a_100000764878_100000730704 [0,1,1,0,0,0|1,0,1]=4 557 B10R0.3 C=C(C)CCOC(C)/C=C/C 34a_200102604097_100000730704 [0,1,1,0,0,0|1,0,1]=4 558 B10R0.3 C=C(C)CCOC(C)CCBr 34a_100012276601_100000730704 [0,1,1,0,0,0|1,0,1]=4 559 B10R0.3 C=C(C)CCOC(C)CCC 34a_100000764384_100000730704 [0,1,1,0,0,0|1,0,1]=4 560 B10R0.3 C=C(C)CCOC(C)CCC 34a_100000764851_100000766640 [0,1,1,0,0,0|1,0,1]=4 561 B10R0.3 C=C(C)CCOC(C)CCC 7a_100000764384_100000730704 [0,1,1,0,0,0|1,0,1]=4 562 B10R0.3 C=C(C)CCOC(C)CCO 34a_100000764851_100009893172 [0,1,1,0,0,0|1,0,1]=4 563 B10R0.3 C=C(C)CCOC(C)COC 34a_100000764851_100000765312 [0,1,1,0,0,0|1,0,1]=4 564 B10R0.3 C=C(C)CCO[C@H](C)COC 34a_100011934205_100000730704 [0,1,1,0,0,0|1,0,1]=4 565 B10R0.3 C=C(C)CCSC(C)CCC 62a_100000730704_100000766640 [0,1,1,0,0,0|1,0,1]=4 566 B10R0.3 C=C(C)CCSC(C)CCC 62a_100000766640_100000730704 [0,1,1,0,0,0|1,0,1]=4 567 B10R0.3 C=C(C)CCSC(C)CCO 62a_100000730704_100009893172 [0,1,1,0,0,0|1,0,1]=4 568 B10R0.3 C=C(C)CCSC(C)CCO 62a_100009893172_100000730704 [0,1,1,0,0,0|1,0,1]=4 569 B10R0.3 C=C(C)CCSC(C)COC 62a_100000730704_100000765312 [0,1,1,0,0,0|1,0,1]=4 570 B10R0.3 C=C(C)CCSC(C)COC 62a_100000765312_100000730704 [0,1,1,0,0,0|1,0,1]=4 571 B10R0.3 CC=CC(=O)CCCC(=O)C 1458a_100000210699_100011215641 [0,1,1,0,0,0|2,0,0]=4 572 B10R0.44 C=C(C)CC(=O)C=C(C)CC 1458a_100020758463_100000748629 [0,1,1,0,0,0|0,0,1]=3 573 B10R0.44 C=C(F)CC(=O)C=C(C)CC 1458a_100020758463_100009893438 [0,1,1,0,0,0|1,0,1]=4 574 B10R0.57 C=C(C)CCC(=O)/C(=C/C)/C 1458a_100020587367_100000730704 [0,1,1,0,0,0|0,0,1]=3 575 B10R0.57 C=C(C)CCC(=O)C(=O)NC 1458a_100011218921_100000730704 [0,1,1,0,0,0|2,0,0]=4 576 B10R0.57 C=C(C)CCC(=O)C(C)CC 1458a_100011192722_100000730704 [0,1,1,0,0,0|0,0,1]=3 577 B10R0.57 C=C(C)CCC(=O)C(C)CC 1458a_200000688413_100000758301 [0,1,1,0,0,0|0,0,1]=3 578 B10R0.57 C=C(C)CCC(=O)C(C)OC 1458a_100000743197_100000730704 [0,1,1,0,0,0|1,0,1]=4 579 B10R0.57 C=C(C)CCC(=O)C(C)SC 1458a_100000149566_100000730704 [0,1,1,0,0,0|1,0,1]=4 580 B10R0.57 C=C(C)CCC(=O)C(O)CC 1458a_100011196387_100000730704 [0,1,1,0,0,0|1,0,1]=4 581 B10R0.57 C=C(C)CCC(=O)N(C)CC 11a_100000225621_200000688413 [0,1,1,0,0,0|1,0,0]=3 582 B10R0.57 C=C(C)CCC(=O)N(C)CC 1626a_100000225621_200000688413 [0,1,1,0,0,0|1,0,0]=3 583 B10R0.57 C=C(C)CCC(=O)N(C)CC 240690a_100000225621_200000688413 [0,1,1,0,0,0|1,0,0]=3 584 B10R0.57 C=C(C)CCC(=O)N(C)CC 527a_100000225621_200000688413 [0,1,1,0,0,0|1,0,0]=3 585 B10R0.57 C=C(C)CCN(C)C(C)CC 2230a_100000741768_100000730704 [0,1,1,0,0,0|1,0,1]=4 586 B10R0.57 C=C(C)CCN(C)C(C)CC 269982a_100000741768_100000730704 [0,1,1,0,0,0|1,0,1]=4 587 B10R0.57 C=C(C)CNC(=O)/C(=C/C)/C 11a_100000765925_100020587367 [0,1,1,0,0,0|1,0,1]=4 588 B10R0.57 C=C(C)CNC(=O)/C(=C/C)/C 1626a_100000765925_100020587367 [0,1,1,0,0,0|1,0,1]=4 589 B10R0.57 C=C(C)CNC(=O)C(C)CC 11a_100000765925_100011192722 [0,1,1,0,0,0|1,0,1]=4 590 B10R0.57 C=C(C)CNC(=O)C(C)CC 1626a_100000765925_100011192722 [0,1,1,0,0,0|1,0,1]=4 591 B10R0.57 C=C(C)CNC(=O)C(C)CC 240690a_100000765925_100011192722 [0,1,1,0,0,0|1,0,1]=4 592 B10R0.57 C=C(C)CNC(=O)C(C)CC 527a_100000765925_100011192722 [0,1,1,0,0,0|1,0,1]=4 593 B10R0.57 C=C(C)CNC(=O)N(C)CC 2708a_100000765925_100000225621 [0,1,1,0,0,0|2,0,0]=4 594 B10R0.57 C=C(C)CNC(=O)N(C)CC 273464a_100000765925_100000225621 [0,1,1,0,0,0|2,0,0]=4 595 B10R0.65 C=C(C)CCNC(C)(C)CC 2230a_100000211385_100000730704 [0,1,1,0,0,0|1,0,1]=4 596 B10R0.65 C=C(C)CCOC(C)(C)CC 7a_100000210230_100000730704 [0,1,1,0,0,0|1,0,1]=4 597 B10R0.65 C=C(C)CCSC(C)(C)CC 62a_100000032637_100000730704 [0,1,1,0,0,0|1,0,1]=4 598 B10R0.65 C=C(C)CCSC(C)(C)CC 62a_100000730704_100000032637 [0,1,1,0,0,0|1,0,1]=4 599 B10R0.77 C=C(C)CCNC(CC)CC 2230a_100000199018_100000730704 [0,1,1,0,0,0|1,0,1]=4 600 B10R0.77 C=C(C)CCN[C@@H](CC)CO 2230a_100000709445_100000730704 [0,1,1,0,0,0|1,0,1]=4 601 B10R0.77 C=C(C)CCOC(CC)CC 7a_100000688536_100000730704 [0,1,1,0,0,0|1,0,1]=4 602 B10R0.77 C=C(C)CCSC(CC)CC 62a_100000210505_100000730704 [0,1,1,0,0,0|1,0,1]=4 603 B10R0.77 C=C(C)CCSC(CC)CC 62a_100000730704_100000210505 [0,1,1,0,0,0|1,0,1]=4 604 B10R0.98 C=C(C)C(=O)CCCC(=O)C 1458a_100000185857_100011215641 [0,1,1,0,0,0|2,0,0]=4 605 B10R0.98 C=C(C)CCNC(C)C(C)C 2230a_100000211541_100000730704 [0,1,1,0,0,0|1,0,1]=4 606 B10R0.98 C=C(C)CCOC(C)C(=O)C 34a_100000212229_100000730704 [0,1,1,0,0,0|1,0,1]=4 607 B10R0.98 C=C(C)CCOC(C)C(C)C 7a_100000748068_100000730704 [0,1,1,0,0,0|1,0,1]=4 608 B10R0.98 C=C(C)CCSC(C)C(=O)C 62a_100000730704_100009814033 [0,1,1,0,0,0|1,0,1]=4 609 B10R0.98 C=C(C)CCSC(C)C(=O)C 62a_100009814033_100000730704 [0,1,1,0,0,0|1,0,1]=4 610 B10R0.98 C=C(C)COCC(=O)C(=O)C 34a_100000210245_100011261029 [0,1,1,0,0,0|2,0,0]=4 611 B10R0.98 C=C(C)COCC(C)C(=O)C 34a_100000032740_100000748629 [0,1,1,0,0,0|1,0,1]=4 612 B10R0.98 C=C(C)COCC(C)C(=O)C 7a_100000032740_100000748629 [0,1,1,0,0,0|1,0,1]=4 613 B10R0.98 C=C(C)CSCC(=O)C(=O)C 62a_100000748629_100011261029 [0,1,1,0,0,0|2,0,0]=4 614 B10R0.98 C=C(C)CSCC(=O)C(=O)C 62a_100011261029_100000211660 [0,1,1,0,0,0|2,0,0]=4 615 B10R0.13 C=C(C)CN(C)C(C)C(=O)C 2230a_100000225649_100009814033 [0,1,1,0,0,0|2,0,0]=4 616 B10R0.13 C=C(C)CN(C)C(C)C(=O)C 269982a_100000225649_100009814033 [0,1,1,0,0,0|2,0,0]=4 617 B10R0.13 CC(=O)C(C)C(=O)C=C(C)C 1458a_100000211388_100000179758 [0,1,1,0,0,0|1,0,1]=4 618 B10R0.43 C=C(C)COC(C)(C)C(=O)C 34a_100000747739_100000748629 [0,1,1,0,0,0|2,0,0]=4 619 B10R0.43 C=C(C)COC(C)(C)C(=O)C 7a_100000747739_100000748629 [0,1,1,0,0,0|2,0,0]=4 620 B10R0.43 C=C(C)CSC(C)(C)C(=O)C 62a_100000075568_100000211660 [0,1,1,0,0,0|2,0,0]=4 621 B10R0.43 C=C(C)CSC(C)(C)C(=O)C 62a_100000748629_100000075568 [0,1,1,0,0,0|2,0,0]=4 622 B10R0.84 CC(=CCC(N[13CH3])C(=O)O)C 269956a_100102631519_200025704644 [0,1,1,0,0,0|2,0,0]=4 623 B10R0.84 CNC(CC=C(C)C)C(=O)O 269956a_100102631519_200000210301 [0,1,1,0,0,0|2,0,0]=4 624 B10R0.86 C/C=C/CNC(CC)C(=O)N 34a_100000733705_100102629194 [0,1,1,0,0,0|2,0,0]=4 625 B10R0.86 C/C=C/CN[C@@H](CC)[C@@H](C)O 34a_100161114882_100102629194 [0,1,1,0,0,0|1,0,1]=4 626 B10R0.86 C/C=C/CN[C@H](CC)C(=O)O 269956a_100000747097_100102629194 [0,1,1,0,0,0|2,0,0]=4 627 B10R0.86 C/C=C/COC(CC)C(=O)N 34a_100016270725_100000750255 [0,1,1,0,0,0|2,0,0]=4 628 B10R0.86 C/C=C/COC(CC)C(C)C 34a_100011218073_100102629194 [0,1,1,0,0,0|0,0,2]=4 629 B10R0.86 C/C=C/COC(CC)C(C)C 7a_100011218073_100102629194 [0,1,1,0,0,0|0,0,2]=4 630 B10R0.86 C/C=C/CSC(CC)C(=O)N 62a_100000750255_100102629194 [0,1,1,0,0,0|2,0,0]=4 631 B10R0.86 C/C=C/CSC(CC)C(=O)N 62a_100102629194_100000750255 [0,1,1,0,0,0|2,0,0]=4 632 B10R0.86 CC=CCNC(CC)C(=O)N 2230a_100000733705_100000070051 [0,1,1,0,0,0|2,0,0]=4 633 B10R0.86 CC=CCNC(CC)C(=O)N 34a_100000733705_100000070051 [0,1,1,0,0,0|2,0,0]=4 634 B10R0.86 CC=CCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000070051 [0,1,1,0,0,0|1,0,1]=4 635 B10R0.86 CC=CCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000070051 [0,1,1,0,0,0|1,0,1]=4 636 B10R0.86 CC=CCOC(CC)C(C)C 34a_100011218073_100000070051 [0,1,1,0,0,0|0,0,2]=4 637 B10R0.86 CC=CCOC(CC)C(C)C 7a_100011218073_100000070051 [0,1,1,0,0,0|0,0,2]=4 638 B10R0.86 CC=CCSC(CC)C(=O)N 62a_100000070051_100000750255 [0,1,1,0,0,0|2,0,0]=4 639 B10R0.86 CC=CCSC(CC)C(=O)N 62a_100000750255_100000070051 [0,1,1,0,0,0|2,0,0]=4 640 B10R1.1 C=CCN1CC=C(CC1)C 2230a_100000693516_100000210623 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.1 C=CCN1CC=C(CC1)C 269982a_100000693516_100000210623 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.1 C=CCN1CC=C(CC1)C 34a_100000693516_100015514636 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.1 CC1=CCN(CC1)CC=O 2230a_100000693516_200015260668 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.1 CC1=CCN(CC1)CC=O 269982a_100000693516_200015260668 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.1 CC1=CCN(CC1)CC=O 34a_100000693516_200009817547 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.1 CC1=CCN(CC1)CCF 2230a_100000693516_100011217306 [1,1,0,0,0,0|1,0,1]=4 647 B10R1.1 CC1=CCN(CC1)CCF 269982a_100000693516_100011217306 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.1 CC1=CCN(CC1)CCF 34a_100000693516_100011217306 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.1 CC1=CCN(CC1)CCO 2230a_100000693516_100000211926 [1,1,0,0,0,0|1,0,1]=4 650 B10R1.1 CC1=CCN(CC1)CCO 269982a_100000693516_100000211926 [1,1,0,0,0,0|1,0,1]=4 651 B10R1.1 CC1=CCN(CC1)CCO 34a_100000693516_100000211926 [1,1,0,0,0,0|1,0,1]=4 652 B10R1.1 CCCN1CC=C(CC1)C 2230a_100000693516_100000210303 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.1 CCCN1CC=C(CC1)C 269982a_100000693516_100000210303 [1,1,0,0,0,0|1,0,1]=4 654 B10R1.1 CCCN1CC=C(CC1)C 34a_100000693516_100000210303 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.1 COCN1CC=C(CC1)C 2230a_100000693516_100000766300 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.1 COCN1CC=C(CC1)C 269982a_100000693516_100000766300 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.1 CSCN1CC=C(CC1)C 2230a_100000693516_100011218213 [1,1,0,0,0,0|1,0,1]=4 658 B10R1.1 CSCN1CC=C(CC1)C 269982a_100000693516_100011218213 [1,1,0,0,0,0|1,0,1]=4 659 B10R1.1 CSCN1CC=C(CC1)C 34a_100000693516_100011218213 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.176 CN1CCC(CC1=O)N[13CH3] 2230a_100000126938_200025704644 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.176 CN1CCC(CC1=O)N[13CH3] 34a_100000126938_200025704644 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.176 CNC1CCN(C(=O)C1)C 2230a_100000126938_200000210301 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.176 CNC1CCN(C(=O)C1)C 34a_100000126938_200000210301 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.15 C=CC(=O)N1CC=CCC1 1626a_100000698166_100000185746 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.15 C=CC(=O)N1CC=CCC1 240690a_100000698166_200121576911 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.15 C=CC(C)N1CC=CCC1 269982a_100000698166_100011215867 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.15 CCC(=O)N1CC=CCC1 11a_100000698166_100000210414 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.15 CCC(=O)N1CC=CCC1 1626a_100000698166_100000210414 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.15 CCC(=O)N1CC=CCC1 240690a_100000698166_100000210414 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.15 CCC(=O)N1CC=CCC1 527a_100000698166_100000210414 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.15 CCC(=O)[C@H]1CC=CCC1 1458a_100009820709_100000210202 [1,1,0,0,0,0|1,0,0]=3 672 B10R1.15 CNC(=O)N1CC=CCC1 2708a_100102657272_100000698166 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.15 CNC(=O)N1CC=CCC1 273464a_100102657272_100000698166 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.15 CNC(=O)[C@H]1CC=CCC1 11a_106832991635_100009820709 [1,1,0,0,0,0|1,0,0]=3 675 B10R1.15 CNC(=O)[C@H]1CC=CCC1 1626a_100102657272_100009820709 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.15 CNC(=O)[C@H]1CC=CCC1 240690a_100102657272_100009820709 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.15 CNC(=O)[C@H]1CC=CCC1 527a_100102657272_100009820709 [1,1,0,0,0,0|1,0,0]=3 678 B10R1.15 O=C(CF)[C@H]1CC=CCC1 1458a_100009820709_100015361967 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.15 O=C(CO)N1CC=CCC1 240690a_100000698166_100000210174 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.15 O=C(CO)N1CC=CCC1 527a_100000698166_100000210174 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.113 CC(=O)C1CCNC(=O)C1 1458a_100000132800_200000210301 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.113 CC(=O)N1CCC=C(C1)C 11a_100000725631_100015343762 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.113 CC(=O)N1CCC=C(C1)C 1626a_100000725631_100015343762 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.113 CC(=O)N1CCC=C(C1)C 240690a_100000725631_100015343762 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.113 CC(=O)N1CCC=C(C1)C 527a_100000725631_100103153847 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.113 [13CH3]C(=O)C1CCNC(=O)C1 1458a_100000132800_200025704644 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.14 CCC(=O)C1CCN(C1)C 1458a_100000739633_100000210202 [0,1,0,0,1,0|2,0,0]=4 688 B10R1.14 CN1CCC(C1)C(=O)CF 1458a_100000739633_100015361967 [0,1,0,0,1,0|2,0,0]=4 689 B10R1.14 CNC(=O)C1CCN(C1)C 2230a_100020588580_200000210301 [0,1,0,0,1,0|2,0,0]=4 690 B10R1.14 CNC(=O)C1CCN(C1)C 240690a_100102657272_100000739633 [0,1,0,0,1,0|2,0,0]=4 691 B10R1.14 CNC(=O)C1CCN(C1)C 269982a_100020588580_200000210301 [0,1,0,0,1,0|2,0,0]=4 692 B10R1.14 CNC(=O)C1CCN(C1)C 34a_100020588580_200000210301 [0,1,0,0,1,0|2,0,0]=4 693 B10R1.14 CNC(=O)C1CCN(C1)C 527a_100102657272_100000739633 [0,1,0,0,1,0|2,0,0]=4 694 B10R1.14 CNC(=O)C1CCN(C1)[13CH3] 2230a_100020588580_200025704644 [0,1,0,0,1,0|2,0,0]=4 695 B10R1.14 CNC(=O)C1CCN(C1)[13CH3] 269982a_100020588580_200025704644 [0,1,0,0,1,0|2,0,0]=4 696 B10R1.14 CNC(=O)C1CCN(C1)[13CH3] 34a_100020588580_200025704644 [0,1,0,0,1,0|2,0,0]=4 697 B10R1.14 COC(=O)[C@@H]1CCN(C1)C 2230a_100016989057_200000210301 [0,1,0,0,1,0|2,0,0]=4 698 B10R1.14 COC(=O)[C@@H]1CCN(C1)C 269982a_100016989057_200000210301 [0,1,0,0,1,0|2,0,0]=4 699 B10R1.14 COC(=O)[C@@H]1CCN(C1)[13CH3] 2230a_100016989057_200025704644 [0,1,0,0,1,0|2,0,0]=4 700 B10R1.14 COC(=O)[C@@H]1CCN(C1)[13CH3] 269982a_100016989057_200025704644 [0,1,0,0,1,0|2,0,0]=4 701 B10R1.31 CCN1CCC(C1)C(=O)C 1458a_100103286618_200000210301 [0,1,0,0,1,0|2,0,0]=4 702 B10R1.31 CCN1CCC(C1)C(=O)[13CH3] 1458a_100103286618_200025704644 [0,1,0,0,1,0|2,0,0]=4 703 B10R1.58 CC(=O)C1CC(=O)N(C1)C 1458a_100000187535_200000210301 [0,1,0,0,1,0|2,0,0]=4 704 B10R1.58 CN1CC(CC1=O)C(=O)[13CH3] 1458a_100000187535_200025704644 [0,1,0,0,1,0|2,0,0]=4 705 B10R1.194 CC(=O)C1CCN(C1=O)C 1458a_100000070787_100000755940 [0,1,0,0,1,0|2,0,0]=4 706 B10R1.194 CC(=O)C1CCN(C1=O)C 1458a_100000137746_200000210301 [0,1,0,0,1,0|2,0,0]=4 707 B10R1.194 CN1CCC(C1=O)C(=O)[13CH3] 1458a_100000137746_200025704644 [0,1,0,0,1,0|2,0,0]=4 708 B10R1.470 CC(=O)C1(CCN(C1)C)C 1458a_100011814562_200000210301 [0,1,0,0,1,0|2,0,0]=4 709 B10R1.470 CN1CCC(C1)(C)C(=O)[13CH3] 1458a_100011814562_200025704644 [0,1,0,0,1,0|2,0,0]=4 710 B12R1.19 C=C(C)CN1CCN(C(=O)C1)C 2230a_100000187256_100000748629 [0,1,0,0,0,1|2,0,0]=4 711 B12R1.19 C=C(C)CN1CCN(C(=O)C1)C 269982a_100000187256_100000748629 [0,1,0,0,0,1|2,0,0]=4 712 B12R1.19 CC(=O)NC1CCN(C(=O)C1)C 11a_100000126938_100015343762 [0,1,0,0,0,1|2,0,0]=4 713 B12R1.19 CC(=O)NC1CCN(C(=O)C1)C 1626a_100000126938_100015343762 [0,1,0,0,0,1|2,0,0]=4 714 B12R1.19 CC(=O)NC1CCN(C(=O)C1)C 240690a_100000126938_100015343762 [0,1,0,0,0,1|2,0,0]=4 715 B12R1.19 CC(=O)NC1CCN(C(=O)C1)C 527a_100000126938_100103153847 [0,1,0,0,0,1|2,0,0]=4 716 B12R1.20 C=C(Br)C(=O)N1CC=C(CC1)C 11a_100000693516_100009813364 [0,1,0,0,0,1|2,0,0]=4 717 B12R1.20 C=C(Br)C(=O)N1CC=C(CC1)C 1626a_100000693516_100009813364 [0,1,0,0,0,1|2,0,0]=4 718 B12R1.20 C=C(C)C(=O)C1CCC(CC1)C 1458a_100000185857_200011216234 [0,1,0,0,0,1|0,0,2]=4 719 B12R1.20 C=C(C)C(=O)N1CC=C(CC1)C 11a_100000693516_100000185857 [0,1,0,0,0,1|1,0,0]=3 720 B12R1.20 C=C(C)C(=O)N1CC=C(CC1)C 1626a_100000693516_100000185857 [0,1,0,0,0,1|1,0,0]=3 721 B12R1.20 C=C(Cl)C(=O)N1CC=C(CC1)C 11a_100000693516_100000039160 [0,1,0,0,0,1|2,0,0]=4 722 B12R1.20 C=C(Cl)C(=O)N1CC=C(CC1)C 1626a_100000693516_100000039160 [0,1,0,0,0,1|2,0,0]=4 723 B12R1.20 C=C(F)C(=O)N1CC=C(CC1)C 11a_100000693516_100000036797 [0,1,0,0,0,1|2,0,0]=4 724 B12R1.20 C=C(F)C(=O)N1CC=C(CC1)C 1626a_100000693516_100000036797 [0,1,0,0,0,1|2,0,0]=4 725 B12R1.20 CC(=O)C(C)N1CC=C(CC1)C 2230a_100000693516_100009814033 [0,1,0,0,0,1|2,0,0]=4 726 B12R1.20 CC(=O)C(C)N1CC=C(CC1)C 269982a_100000693516_100009814033 [0,1,0,0,0,1|2,0,0]=4 727 B12R1.20 CC1=CCC(CC1)C(=O)C(C)C 1458a_100000137427_100000210206 [0,1,0,0,0,1|0,0,2]=4 728 B12R1.20 CC1=CCC(CC1)C(=O)N(C)C 11a_100102631434_100000137427 [0,1,0,0,0,1|1,0,1]=4 729 B12R1.20 CC1=CCC(CC1)C(=O)N(C)C 1626a_100102631434_100000137427 [0,1,0,0,0,1|1,0,1]=4 730 B12R1.20 CC1=CCC(CC1)C(=O)N(C)C 240690a_100102631434_100000137427 [0,1,0,0,0,1|1,0,1]=4 731 B12R1.20 CC1=CCC(CC1)C(=O)N(C)C 527a_100102631434_100000137427 [0,1,0,0,0,1|1,0,1]=4 732 B12R1.20 CC1=CCC(CC1)C(C)N(C)C 270004a_100102631434_100000073480 [0,1,0,0,0,1|1,0,1]=4 733 B12R1.49 C=C(C#N)CN1CC=C(CC1)C 2230a_100000693516_100000694840 [0,1,0,0,0,1|1,0,1]=4 734 B12R1.49 C=C(C#N)CN1CC=C(CC1)C 269982a_100000693516_100000694840 [0,1,0,0,0,1|1,0,1]=4 735 B12R1.49 C=C(C#N)CN1CC=C(CC1)C 34a_100000693516_100000694840 [0,1,0,0,0,1|1,0,1]=4 736 B12R1.49 CCC(=O)CN1CC=C(CC1)C 269982a_100000693516_100000747405 [0,1,0,0,0,1|2,0,0]=4 737 B12R1.49 CNC(=O)CN1CC=C(CC1)C 2230a_100000693516_100000183359 [0,1,0,0,0,1|2,0,0]=4 738 B12R1.49 CNC(=O)CN1CC=C(CC1)C 269982a_100000693516_100000183359 [0,1,0,0,0,1|2,0,0]=4 739 B12R1.49 CNC(=O)CN1CC=C(CC1)C 34a_100000693516_100000183359 [0,1,0,0,0,1|2,0,0]=4 740 B12R1.49 COC(=O)CN1CC=C(CC1)C 2230a_100000693516_100000747449 [0,1,0,0,0,1|2,0,0]=4 741 B12R1.49 COC(=O)CN1CC=C(CC1)C 269982a_100000693516_100000747449 [0,1,0,0,0,1|2,0,0]=4 742 B12R1.49 COC(=O)CN1CC=C(CC1)C 34a_100000693516_100000747449 [0,1,0,0,0,1|2,0,0]=4 743 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 269862a_106832991636_100015429263 [0,2,0,0,0,0|0,0,0]=2 744 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CNC 270004a_106832991635_100015429263 [0,2,0,0,0,0|0,0,0]=2 745 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 34a_100015330809_200000210301 [0,2,0,0,0,0|0,0,0]=2 746 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)COC 7a_100015330809_200000210301 [0,2,0,0,0,0|0,0,0]=2 747 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 34a_100015330809_200025704644 [0,2,0,0,0,0|0,0,0]=2 748 B12R1.113 C=C(C)[C@@H]1CC=C(CC1)CO[13CH3] 7a_100015330809_200025704644 [0,2,0,0,0,0|0,0,0]=2 749 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)C 1458a_200016138351_200000210301 [0,2,0,0,0,0|0,0,0]=2 750 B12R1.256 C=C(C)[C@@H]1CC=C(CC1)C(=O)[13CH3] 1458a_200016138351_200025704644 [0,2,0,0,0,0|0,0,0]=2 751 B12R1.3825 C=C(C)C1CCC(CC1)(C)OC 34a_100009994050_200000210301 [0,2,0,0,0,0|0,0,2]=4 752 B12R1.3825 C=C(C)C1CCC(CC1)(C)OC 7a_100009994050_200000210301 [0,2,0,0,0,0|0,0,2]=4 753 B12R1.3825 C=C(C)C1CCC(CC1)(C)O[13CH3] 34a_100009994050_200025704644 [0,2,0,0,0,0|0,0,2]=4 754 B12R1.3825 C=C(C)C1CCC(CC1)(C)O[13CH3] 7a_100009994050_200025704644 [0,2,0,0,0,0|0,0,2]=4 755 B12R1.3825 C=C(C)[C@H]1C=C[C@@](CC1)(C)OC 34a_100015729468_200000210301 [0,2,0,0,0,0|0,0,2]=4 756 B12R1.3825 C=C(C)[C@H]1C=C[C@@](CC1)(C)OC 7a_100015729468_200000210301 [0,2,0,0,0,0|0,0,2]=4 757 B12R1.3825 C=C(C)[C@H]1C=C[C@@](CC1)(C)O[13CH3] 34a_100015729468_200025704644 [0,2,0,0,0,0|0,0,2]=4 758 B12R1.3825 C=C(C)[C@H]1C=C[C@@](CC1)(C)O[13CH3] 7a_100015729468_200025704644 [0,2,0,0,0,0|0,0,2]=4 759 B12R1.9 CC1=CC[C@H](CC1)C(C)(C)O[13CH3] 34a_100015539799_200025704644 [0,2,0,0,0,0|0,0,2]=4 760 B12R1.9 CC1=CC[C@H](CC1)C(C)(C)O[13CH3] 7a_100015539799_200025704644 [0,2,0,0,0,0|0,0,2]=4 761 B12R1.9 COC(C)(C)[C@@H]1CC=C(CC1)C 34a_100015539799_200000210301 [0,2,0,0,0,0|0,0,2]=4 762 B12R1.9 COC(C)(C)[C@@H]1CC=C(CC1)C 7a_100015539799_200000210301 [0,2,0,0,0,0|0,0,2]=4 763 B12R1.56 C=C(C)C1CC=C(C(C1)OC)C 34a_100000038928_200000210301 [0,2,0,0,0,0|0,0,0]=2 764 B12R1.56 C=C(C)C1CC=C(C(C1)OC)C 7a_100000038928_200000210301 [0,2,0,0,0,0|0,0,0]=2 765 B12R1.56 C=C(C)C1CC=C(C(C1)O[13CH3])C 34a_100000038928_200025704644 [0,2,0,0,0,0|0,0,0]=2 766 B12R1.56 C=C(C)C1CC=C(C(C1)O[13CH3])C 7a_100000038928_200025704644 [0,2,0,0,0,0|0,0,0]=2 767 B12R1.56 C=C(C)[C@@H]1CC[C@H](C(C1)NC)C 269862a_106832991636_100015799859 [0,2,0,0,0,0|0,0,2]=4 768 B12R1.56 C=C(C)[C@@H]1CC[C@H](C(C1)NC)C 270004a_106832991635_100015799859 [0,2,0,0,0,0|0,0,2]=4 769 B12R1.367 CCC(=O)C1CCN(C(=O)C1)C 1458a_100000043916_100000210202 [0,2,0,0,0,0|2,0,0]=4 770 B12R1.367 CN1CCC(CC1=O)C(=O)CF 1458a_100000043916_100015361967 [0,2,0,0,0,0|2,0,0]=4 771 B12R1.367 CNC(=O)C1CCN(C(=O)C1)C 11a_106832991635_100000043916 [0,2,0,0,0,0|2,0,0]=4 772 B12R1.367 CNC(=O)C1CCN(C(=O)C1)C 1626a_100102657272_100000043916 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.367 CNC(=O)C1CCN(C(=O)C1)C 240690a_100102657272_100000043916 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.367 CNC(=O)C1CCN(C(=O)C1)C 527a_100102657272_100000043916 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.16 C#CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000184674 [0,2,0,0,0,0|1,0,0]=3 776 B12R1.16 C#CCC(=O)N1CC=C(CC1)C 1626a_100000693516_100011220946 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.16 C#CCC(=O)N1CC=C(CC1)C 527a_100000693516_100011220946 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.16 C=CCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210623 [0,2,0,0,0,0|1,0,0]=3 779 B12R1.16 C=CCC(=O)N1CC=C(CC1)C 11a_100000693516_100000210193 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.16 C=CCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000210193 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.16 C=CCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000210193 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.16 C=CCC(=O)N1CC=C(CC1)C 527a_100000693516_100000210193 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.16 CC1=CCC(CC1)C(=O)CC#N 1458a_100000137427_100011214920 [0,2,0,0,0,0|1,0,0]=3 784 B12R1.16 CC1=CCC(CC1)C(=O)CCF 1458a_100000137427_100011217306 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.16 CC1=CCC(CC1)C(=O)CCO 1458a_100000137427_100000211926 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.16 CC1=CCN(CC1)C(=O)C=CBr 1626a_100000693516_100016273825 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.16 CC1=CCN(CC1)C(=O)C=CBr 240690a_100000693516_100016273825 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.16 CC1=CCN(CC1)C(=O)C=CCl 11a_100000693516_200016279998 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.16 CC1=CCN(CC1)C(=O)C=CCl 1626a_100000693516_200016279998 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.16 CC1=CCN(CC1)C(=O)C=CCl 240690a_100000693516_200016279998 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.16 CC1=CCN(CC1)C(=O)C=CI 1626a_100000693516_100016256311 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.16 CC1=CCN(CC1)C(=O)CC#N 1626a_100000693516_100051588842 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.16 CC1=CCN(CC1)C(=O)CC#N 240690a_100000693516_100051588842 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.16 CC1=CCN(CC1)C(=O)CCO 240690a_100000693516_100011216618 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.16 CC=CC(=O)N1CC=C(CC1)C 11a_100000693516_100000210699 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.16 CC=CC(=O)N1CC=C(CC1)C 1626a_100000693516_100000210699 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.16 CC=CC(=O)N1CC=C(CC1)C 240690a_100000693516_100000210699 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.16 CCCC(=O)C1CC=C(CC1)C 1458a_100000137427_100000210303 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.16 CCCC(=O)N1CC=C(CC1)C 11a_100000693516_100000211992 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.16 CCCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000211992 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.16 CCCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000211992 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.16 CCCC(=O)N1CC=C(CC1)C 527a_100000693516_100000211992 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.16 CCNC(=O)C1CC=C(CC1)C 11a_100015525214_100000137427 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.16 CCNC(=O)C1CC=C(CC1)C 240690a_100015525214_100000137427 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.16 CCNC(=O)C1CC=C(CC1)C 527a_100015525214_100000137427 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.16 CCNC(=O)N1CC=C(CC1)C 2708a_100015525214_100000693516 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.16 CCNC(=O)N1CC=C(CC1)C 273464a_100015525214_100000693516 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.16 CCNC(C)C1CC=C(CC1)C 269862a_100015525214_100000073480 [0,2,0,0,0,0|0,0,2]=4 809 B12R1.16 CCNC(C)C1CC=C(CC1)C 270004a_100015525214_100000073480 [0,2,0,0,0,0|0,0,2]=4 810 B12R1.16 CNNC(=O)C1CC=C(CC1)C 22a_100016993582_100000137427 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.16 COCC(=O)N1CC=C(CC1)C 11a_100000693516_100000210968 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.16 COCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000210968 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.16 COCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000210968 [0,2,0,0,0,0|2,0,0]=4 814 B12R1.16 COCC(=O)N1CC=C(CC1)C 527a_100000693516_100000210968 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.16 CSCC(=O)N1CC=C(CC1)C 11a_100000693516_100000184570 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.16 CSCC(=O)N1CC=C(CC1)C 1626a_100000693516_100000184570 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.16 CSCC(=O)N1CC=C(CC1)C 240690a_100000693516_100000184570 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.16 CSCC(=O)N1CC=C(CC1)C 527a_100000693516_100000184570 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1OC)C 34a_100016197468_200000210301 [0,2,0,0,0,0|0,0,2]=4 820 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1OC)C 7a_100016197468_200000210301 [0,2,0,0,0,0|0,0,2]=4 821 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1O[13CH3])C 34a_100016197468_200025704644 [0,2,0,0,0,0|0,0,2]=4 822 B12R1.57 C=C(C)[C@@H]1CC[C@H](C[C@H]1O[13CH3])C 7a_100016197468_200025704644 [0,2,0,0,0,0|0,0,2]=4 823 B12R1.3824 C=C(C)C1(CC=C(CC1)C)OC 34a_200011068618_200000210301 [0,2,0,0,0,0|0,0,0]=2 824 B12R1.3824 C=C(C)C1(CC=C(CC1)C)OC 7a_200011068618_200000210301 [0,2,0,0,0,0|0,0,0]=2 825 B12R1.3824 C=C(C)C1(CC=C(CC1)C)O[13CH3] 34a_200011068618_200025704644 [0,2,0,0,0,0|0,0,0]=2 826 B12R1.3824 C=C(C)C1(CC=C(CC1)C)O[13CH3] 7a_200011068618_200025704644 [0,2,0,0,0,0|0,0,0]=2 827 B12R1.3824 CC1=CC[C@@](CC1)(O[13CH3])C(C)C 34a_100015801551_200025704644 [0,2,0,0,0,0|0,0,2]=4 828 B12R1.3824 CC1=CC[C@@](CC1)(O[13CH3])C(C)C 7a_100015801551_200025704644 [0,2,0,0,0,0|0,0,2]=4 829 B12R1.3824 CO[C@]1(CC=C(CC1)C)C(C)C 34a_100015801551_200000210301 [0,2,0,0,0,0|0,0,2]=4 830 B12R1.3824 CO[C@]1(CC=C(CC1)C)C(C)C 7a_100015801551_200000210301 [0,2,0,0,0,0|0,0,2]=4 831 B10R1.117 C=C(C)CCN1CCC1C 269982a_100000755817_100000730704 [0,0,1,1,0,0|1,0,1]=4 832 B10R1.117 C=C(C)CCN1CCC1C 34a_100000755817_100000730704 [0,0,1,1,0,0|1,0,1]=4 833 B10R1.127 C=C(C)CCNC1CCC1 2230a_100000749019_100000730704 [0,0,1,1,0,0|1,0,1]=4 834 B10R1.127 C=C(C)CCNC1CCC1 34a_100000749019_100000730704 [0,0,1,1,0,0|1,0,1]=4 835 B10R1.127 C=C(C)CCOC1CCC1 34a_100000748187_100000730704 [0,0,1,1,0,0|1,0,1]=4 836 B10R1.127 C=C(C)CCOC1CCC1 34a_100000764851_100000749161 [0,0,1,1,0,0|1,0,1]=4 837 B10R1.127 C=C(C)CCSC1CCC1 62a_100000730704_100000749161 [0,0,1,1,0,0|1,0,1]=4 838 B10R1.150 C=C1CC(C1)NC(=O)CC 11a_100132301982_100000210414 [0,0,1,1,0,0|2,0,0]=4 839 B10R1.150 C=C1CC(C1)NC(=O)CC 1626a_100132301982_100000210414 [0,0,1,1,0,0|2,0,0]=4 840 B10R1.150 C=C1CC(C1)NC(=O)CC 527a_100132301982_100000210414 [0,0,1,1,0,0|2,0,0]=4 841 B10R1.150 C=C1CC(C1)NC(C)CC 2230a_100132301982_100000758301 [0,0,1,1,0,0|1,0,1]=4 842 B10R1.350 C=C(C)CCNC1(CC1)C 2230a_100000757604_100000730704 [0,0,1,1,0,0|1,0,1]=4 843 B10R1.350 C=C(C)CCOC1(CC1)C 7a_100011725673_100000730704 [0,0,1,1,0,0|1,0,1]=4 844 B8R0.23 C=C(C)CC(=O)C(=C)C 1458a_100000185857_100000748629 [0,0,1,0,1,0|1,0,1]=4 845 B8R0.23 C=C(C)CN(C)C(=O)C 11a_100000225649_100015343762 [0,0,1,0,1,0|2,0,0]=4 846 B8R0.23 C=C(C)CN(C)C(=O)C 1626a_100000225649_100015343762 [0,0,1,0,1,0|2,0,0]=4 847 B8R0.23 C=C(C)CN(C)C(=O)C 527a_100000225649_100103153847 [0,0,1,0,1,0|2,0,0]=4 848 B8R0.23 CC(=O)C(C)CC(C)C 1458a_100000070787_100000731052 [0,0,1,0,1,0|1,0,1]=4 849 B8R0.23 CC(=O)C(C)CN(C)C 1458a_200015186601_200000210301 [0,0,1,0,1,0|2,0,0]=4 850 B8R0.23 CC(CN(C)C)C(=O)[13CH3] 1458a_200015186601_200025704644 [0,0,1,0,1,0|2,0,0]=4 851 B8R1.1 CC1CCC(C1)O[13CH3] 34a_100000698185_200025704644 [1,0,0,0,1,0|1,0,1]=4 852 B8R1.1 CN1CCC(C1)S[13CH3] 62a_200025704644_200012183744 [1,0,0,0,1,0|2,0,0]=4 853 B8R1.1 CNC1CCC(C1)C 270004a_106832991635_100011215218 [1,0,0,0,1,0|1,0,1]=4 854 B8R1.1 CNC1CCN(C1)C 7a_106832991635_200012183744 [1,0,0,0,1,0|2,0,0]=4 855 B8R1.1 COC1CCC(=O)C1 34a_100012614533_200000210301 [1,0,0,0,1,0|2,0,0]=4 856 B8R1.1 COC1CCC(C1)C 34a_100000698185_200000210301 [1,0,0,0,1,0|1,0,1]=4 857 B8R1.1 CO[C@@H]1CCN(C1)C 2230a_100000766984_200000210301 [1,0,0,0,1,0|2,0,0]=4 858 B8R1.1 CO[C@@H]1CCN(C1)C 269982a_100000766984_200000210301 [1,0,0,0,1,0|2,0,0]=4 859 B8R1.1 CO[C@@H]1CCN(C1)[13CH3] 2230a_100000766984_200025704644 [1,0,0,0,1,0|2,0,0]=4 860 B8R1.1 CO[C@@H]1CCN(C1)[13CH3] 269982a_100000766984_200025704644 [1,0,0,0,1,0|2,0,0]=4 861 B8R1.1 CSC1CCN(C1)C 62a_200000210301_200012183744 [1,0,0,0,1,0|2,0,0]=4 862 B8R1.1 [13CH3]OC1CCC(=O)C1 34a_100012614533_200025704644 [1,0,0,0,1,0|2,0,0]=4 863 B8R1.7 CC(=O)C1CC=CC1 1458a_100000759439_200000210301 [1,0,0,0,1,0|1,0,0]=3 864 B8R1.7 CC(=O)C1CCCC1 1458a_100000070787_100000179811 [1,0,0,0,1,0|1,0,1]=4 865 B8R1.7 CC(=O)C1CCCC1 1458a_100000210718_200000210301 [1,0,0,0,1,0|1,0,1]=4 866 B8R1.7 CC(=O)C1CCOC1 1458a_100000070787_100000690089 [1,0,0,0,1,0|2,0,0]=4 867 B8R1.7 CC(=O)C1CCOC1 1458a_100011219752_200000210301 [1,0,0,0,1,0|2,0,0]=4 868 B8R1.7 CC(=O)N1CC=CC1 1626a_100015195280_100015343762 [1,0,0,0,1,0|2,0,0]=4 869 B8R1.7 CC(=O)N1CC=CC1 240690a_100015195280_100015343762 [1,0,0,0,1,0|2,0,0]=4 870 B8R1.7 [13CH3]C(=O)C1CC=CC1 1458a_100000759439_200025704644 [1,0,0,0,1,0|1,0,0]=3 871 B8R1.7 [13CH3]C(=O)C1CCCC1 1458a_100000210718_200025704644 [1,0,0,0,1,0|1,0,1]=4 872 B8R1.7 [13CH3]C(=O)C1CCOC1 1458a_100011219752_200025704644 [1,0,0,0,1,0|2,0,0]=4 873 B8R1.23 C=C1CC(C1)C(=O)C 1458a_100000065620_200000210301 [0,0,0,0,2,0|1,0,1]=4 874 B8R1.23 C=C1CC(C1)C(=O)[13CH3] 1458a_100000065620_200025704644 [0,0,0,0,2,0|1,0,1]=4 875 B8R1.23 CC(=O)C1CC(C1)C 1458a_100000686124_200000210301 [0,0,0,0,2,0|1,0,1]=4 876 B8R1.23 CC(=O)C1CN(C1)C 1458a_100012002723_200000210301 [0,0,0,0,2,0|2,0,0]=4 877 B8R1.23 CC1CC(C1)C(=O)[13CH3] 1458a_100000686124_200025704644 [0,0,0,0,2,0|1,0,1]=4 878 B8R1.23 CN1CC(C1)C(=O)[13CH3] 1458a_100012002723_200025704644 [0,0,0,0,2,0|2,0,0]=4 879 B8R1.31 CC(=O)C1CCC1=O 1458a_100000070787_100009892977 [0,0,0,0,2,0|2,0,0]=4 880 B10R0.55 C#C/C(=C\COCC(=C)C)/C 34a_100016990848_100000748629 [0,0,1,0,0,1|0,0,2]=4 881 B10R0.55 C=C(C)CCNCC(=O)NC 2230a_100000693194_100000730704 [0,0,1,0,0,1|2,0,0]=4 882 B10R0.55 C=C(C)CCNCC(C)CC 2230a_100020588543_100000730704 [0,0,1,0,0,1|0,0,2]=4 883 B10R0.55 C=C(C)CCNC[C@@H](C)OC 2230a_100020591295_100000730704 [0,0,1,0,0,1|1,0,1]=4 884 B10R0.55 C=C(C)CCOCC(=O)CC 34a_100000725409_100000730704 [0,0,1,0,0,1|1,0,1]=4 885 B10R0.55 C=C(C)CCOCC(=O)NC 34a_100000750040_100000730704 [0,0,1,0,0,1|2,0,0]=4 886 B10R0.55 C=C(C)CCOCC(=O)NC 34a_100000764851_100000183359 [0,0,1,0,0,1|2,0,0]=4 887 B10R0.55 C=C(C)CCOCC(=O)OC 34a_100000764851_100000747449 [0,0,1,0,0,1|2,0,0]=4 888 B10R0.55 C=C(C)CCOCC(C)CC 34a_100000764851_100000748023 [0,0,1,0,0,1|0,0,2]=4 889 B10R0.55 C=C(C)CCOCC(C)OC 34a_100000690652_100000730704 [0,0,1,0,0,1|1,0,1]=4 890 B10R0.55 C=C(C)CCOC[C@@H](C)CC 34a_100000764851_100009816398 [0,0,1,0,0,1|0,0,2]=4 891 B10R0.55 C=C(C)CCOC[C@@H](C)CC 7a_100009816381_100000730704 [0,0,1,0,0,1|0,0,2]=4 892 B10R0.55 C=C(C)CCSCC(=O)CC 62a_100000730704_100000747405 [0,0,1,0,0,1|1,0,1]=4 893 B10R0.55 C=C(C)CCSCC(=O)CC 62a_100000747405_100000730704 [0,0,1,0,0,1|1,0,1]=4 894 B10R0.55 C=C(C)CCSCC(=O)NC 62a_100000183359_100000730704 [0,0,1,0,0,1|2,0,0]=4 895 B10R0.55 C=C(C)CCSCC(=O)NC 62a_100000730704_100000183359 [0,0,1,0,0,1|2,0,0]=4 896 B10R0.55 C=C(C)CCSCC(=O)OC 62a_100000730704_100000747449 [0,0,1,0,0,1|2,0,0]=4 897 B10R0.55 C=C(C)CCSCC(=O)OC 62a_100000747449_100000730704 [0,0,1,0,0,1|2,0,0]=4 898 B10R0.55 C=C(C)CCSCC(C)CC 62a_100000730704_100000748023 [0,0,1,0,0,1|0,0,2]=4 899 B10R0.55 C=C(C)CCSCC(C)CC 62a_100000748023_100000730704 [0,0,1,0,0,1|0,0,2]=4 900 B10R0.55 C=C(C)CCSC[C@@H](C)CC 62a_100000730704_100009816398 [0,0,1,0,0,1|0,0,2]=4 901 B10R0.55 C=C(C)CCSC[C@@H](C)CC 62a_100009816398_100000730704 [0,0,1,0,0,1|0,0,2]=4 902 B10R0.55 C=C(C)CNCCC(=O)NC 2230a_100000738227_100000748629 [0,0,1,0,0,1|2,0,0]=4 903 B10R0.55 C=C(C)CNCCC(=O)NC 34a_100000738227_100000748629 [0,0,1,0,0,1|2,0,0]=4 904 B10R0.55 C=C(C)CNCCC(C)CC 2230a_100020591266_100000748629 [0,0,1,0,0,1|0,0,2]=4 905 B10R0.55 C=C(C)COCCC(=O)NC 34a_100000210245_100012179268 [0,0,1,0,0,1|2,0,0]=4 906 B10R0.55 C=C(C)COCCC(=O)NC 34a_100000754576_100000748629 [0,0,1,0,0,1|2,0,0]=4 907 B10R0.55 C=C(C)COCCC(=O)OC 34a_100000210245_100000742370 [0,0,1,0,0,1|2,0,0]=4 908 B10R0.55 C=C(C)COCCC(C)CC 7a_100011215188_100000748629 [0,0,1,0,0,1|0,0,2]=4 909 B10R0.55 C=C(C)COCCC(C)OC 7a_100000764861_100000748629 [0,0,1,0,0,1|1,0,1]=4 910 B10R0.55 C=C(C)CSCCC(=O)NC 62a_100000737683_100000211660 [0,0,1,0,0,1|2,0,0]=4 911 B10R0.55 C=C(C)CSCCC(=O)NC 62a_100000748629_100000737683 [0,0,1,0,0,1|2,0,0]=4 912 B10R0.55 C=C(C)CSCCC(=O)OC 62a_100000204255_100000211660 [0,0,1,0,0,1|2,0,0]=4 913 B10R0.55 C=C(C)CSCCC(=O)OC 62a_100000748629_100000204255 [0,0,1,0,0,1|2,0,0]=4 914 B10R0.55 C=CC(C)COCCC(=C)C 34a_100011215527_100000730704 [0,0,1,0,0,1|0,0,2]=4 915 B10R0.55 C=CC(C)COCCC(=C)C 7a_100011215527_100000730704 [0,0,1,0,0,1|0,0,2]=4 916 B10R0.96 C=C(C)CC(=O)CC=C(C)C 1458a_100011220947_100000748629 [0,0,1,0,0,1|1,0,1]=4 917 B10R0.96 C=C(C)CCC(=O)CC(=C)C 1458a_200000688413_100000748629 [0,0,1,0,0,1|1,0,1]=4 918 B10R0.96 C=C(C)CCN(C)CC(=C)C 2230a_100000225649_100000730704 [0,0,1,0,0,1|1,0,0]=3 919 B10R0.96 C=C(C)CCN(C)CC(=C)C 269982a_100000225649_100000730704 [0,0,1,0,0,1|1,0,0]=3 920 B10R0.96 C=C(C)CN(C)CC=C(C)C 2230a_100000225649_100000761012 [0,0,1,0,0,1|1,0,0]=3 921 B10R0.96 C=C(C)CN(C)CC=C(C)C 269982a_100000225649_100000761012 [0,0,1,0,0,1|1,0,0]=3 922 B10R0.96 C=C(C)CN(C)CCC(=O)C 269982a_100000225649_100000053229 [0,0,1,0,0,1|2,0,0]=4 923 B10R0.96 C=C(C)COC(C)C=C(C)C 34a_100000717055_100000748629 [0,0,1,0,0,1|1,0,1]=4 924 B10R0.96 C=C(C)CSC(C)OC(=O)C 62a_100000748629_100009818208 [0,0,1,0,0,1|2,0,0]=4 925 B10R0.96 C=C(C)CSC(C)OC(=O)C 62a_100009818208_100000211660 [0,0,1,0,0,1|2,0,0]=4 926 B10R0.87 C=C(C)CN(CC)C/C=C/C 269982a_100000211296_100102629194 [0,0,1,0,0,1|1,0,0]=3 927 B10R0.87 C=C(C)CN(CC)CC=CC 2230a_100000211296_100000070051 [0,0,1,0,0,1|1,0,0]=3 928 B10R1.18 C=C(C)CN1CC=CCC1 2230a_100000698166_100000748629 [1,0,0,0,0,1|1,0,0]=3 929 B10R1.18 C=C(C)CN1CC=CCC1 269982a_100000698166_100000748629 [1,0,0,0,0,1|1,0,0]=3 930 B10R1.18 C=C(C)CN1CC=CCC1 34a_100000698166_100000748629 [1,0,0,0,0,1|1,0,0]=3 931 B10R1.18 C=C(F)CN1CC=CCC1 2230a_100000698166_100009893438 [1,0,0,0,0,1|2,0,0]=4 932 B10R1.18 C=C(F)CN1CC=CCC1 269982a_100000698166_100009893438 [1,0,0,0,0,1|2,0,0]=4 933 B10R1.18 C=C(F)CN1CC=CCC1 34a_100000698166_100009893438 [1,0,0,0,0,1|2,0,0]=4 934 B10R1.18 CC(C)OC1CC=CCC1 34a_100000073881_100000210206 [1,0,0,0,0,1|0,0,2]=4 935 B10R1.18 CN(C)CC1CC=CCC1 270004a_100102631434_100000189434 [1,0,0,0,0,1|1,0,1]=4 936 B12R1.21 C=C(C)CCN1CC=C(CC1)C 2230a_100000693516_100000730704 [0,0,0,0,0,2|1,0,0]=3 937 B12R1.21 C=C(C)CCN1CC=C(CC1)C 269982a_100000693516_100000730704 [0,0,0,0,0,2|1,0,0]=3 938 B12R1.21 C=C(C)CCN1CC=C(CC1)C 34a_100000693516_100000730704 [0,0,0,0,0,2|1,0,0]=3 939 B12R1.21 C=C(C)CNC1CCC(=O)NC1 2230a_100000748762_100000748629 [0,0,0,0,0,2|2,0,0]=4 940 B12R1.21 C=C(C)CNC1CCC(=O)NC1 34a_100000748762_100000748629 [0,0,0,0,0,2|2,0,0]=4 941 B12R1.21 C=C(C)CN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000748629 [0,0,0,0,0,2|0,0,2]=4 942 B12R1.21 C=C(C)CN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000748629 [0,0,0,0,0,2|0,0,2]=4 943 B12R1.21 C=C(C)COC1CCC(=O)CC1 34a_100000764474_100000748629 [0,0,0,0,0,2|1,0,1]=4 944 B12R1.21 C=C(C)COC1CCC(=O)CC1 7a_100000764474_100000748629 [0,0,0,0,0,2|1,0,1]=4 945 B12R1.21 C=C(C)COC1CCC(=O)NC1 34a_100000079199_100000748629 [0,0,0,0,0,2|2,0,0]=4 946 B12R1.21 C=C(C)COC1CCC(CC1)C 34a_100000210245_200011216234 [0,0,0,0,0,2|0,0,2]=4 947 B12R1.21 C=C(C)COC1CCC(CC1)C 34a_100000210714_100000748629 [0,0,0,0,0,2|0,0,2]=4 948 B12R1.21 C=C(C)COC1CCC(CC1)C 7a_100000210714_100000748629 [0,0,0,0,0,2|0,0,2]=4 949 B12R1.21 C=C(C)CSC1CCC(CC1)C 62a_100000748629_200011216234 [0,0,0,0,0,2|0,0,2]=4 950 B12R1.21 C=C(C)CSC1CCN(CC1)C 62a_100000748629_100011215917 [0,0,0,0,0,2|1,0,1]=4 951 B12R1.21 CC(=CCN1CC=C(CC1)C)C 2230a_100000693516_100000761012 [0,0,0,0,0,2|1,0,1]=4 952 B12R1.21 CC(=CCN1CC=C(CC1)C)C 269982a_100000693516_100000761012 [0,0,0,0,0,2|1,0,1]=4 953 B12R1.21 CC(=CCN1CC=C(CC1)C)C 34a_100000693516_100000761012 [0,0,0,0,0,2|1,0,1]=4 954 B12R1.21 CC(=O)CCN1CC=C(CC1)C 269982a_100000693516_100000053229 [0,0,0,0,0,2|2,0,0]=4 955 B12R1.21 CC(=O)OCN1CC=C(CC1)C 269982a_100000693516_100000076356 [0,0,0,0,0,2|2,0,0]=4 956 B12R1.21 CC(=O)OCN1CC=C(CC1)C 34a_100000693516_100009813279 [0,0,0,0,0,2|2,0,0]=4