0 B11R1.166 CC(C)N1CCN(CC1=O)C 2230a_100000698735_200000210301 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.166 CC(C)N1CCN(CC1=O)C 269982a_100000698735_200000210301 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.166 CC(C)N1CCN(CC1=O)C 34a_100000698735_200000210301 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 2230a_100000698735_200025704644 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 269982a_100000698735_200025704644 [0,0,0,0,0,0|2,0,1]=3 5 B11R1.166 CC(C)N1CCN(CC1=O)[13CH3] 34a_100000698735_200025704644 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 CC(=O)C1CCC(CC1)C 1458a_100000070787_200011216234 [1,0,0,0,0,0|1,0,2]=4 7 B10R1.13 CC(=O)N1CCC(CC1)C 240690a_100000188429_100015343762 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.13 CC(=O)N1CCC(CC1)C 527a_100000188429_100103153847 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C 1458a_100009815934_200000210301 [1,0,0,0,0,0|1,0,2]=4 10 B10R1.13 CC1CCC(CC1)N(C)C 269982a_100102631434_200011216234 [1,0,0,0,0,0|1,0,2]=4 11 B10R1.13 CC1CCC(CC1)N(C)C 270004a_100102631434_100000185489 [1,0,0,0,0,0|1,0,2]=4 12 B10R1.13 CC1CCN(CC1)C(C)C 2230a_100000188429_100000210206 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.13 CC1CCN(CC1)C(C)C 269982a_100000188429_100000210206 [1,0,0,0,0,0|1,0,2]=4 14 B10R1.13 CC1CCN(CC1)C(C)C 34a_100000188429_100000210206 [1,0,0,0,0,0|1,0,2]=4 15 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)[13CH3] 1458a_100009815934_200025704644 [1,0,0,0,0,0|1,0,2]=4 16 B10R1.25 CCN1CCN(CC1=O)C 2230a_100000701330_200000210301 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.25 CCN1CCN(CC1=O)C 269982a_100000701330_200000210301 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.25 CCN1CCN(CC1=O)[13CH3] 2230a_100000701330_200025704644 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.25 CCN1CCN(CC1=O)[13CH3] 269982a_100000701330_200025704644 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.61 CC(=O)C1CCCCC1=O 1458a_100000070787_100000204591 [1,0,0,0,0,0|1,0,1]=3 21 B10R1.61 CC(=O)C1CCCNC1=O 1458a_100000070787_100000687798 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.61 CC(=O)C1CCCNC1=O 1458a_100000087122_200000210301 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.61 CC(=O)C1COCCC1=O 1458a_100000070787_100012180262 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.61 CN(C)C1CCCCC1=O 269982a_100102631434_100000204591 [1,0,0,0,0,0|1,0,1]=3 25 B10R1.61 CN(C)C1CCCNC1=O 2230a_100102631434_100000687798 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.61 CN(C)C1CCCNC1=O 269982a_100102631434_100000687798 [1,0,0,0,0,0|2,0,1]=4 27 B10R1.61 [13CH3]C(=O)C1CCCNC1=O 1458a_100000087122_200025704644 [1,0,0,0,0,0|2,0,1]=4 28 B12R1.452 CC(C)N1CCN(CC1=O)CF 269982a_100000698735_100015361967 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.452 CC(C)N1CCN(CC1=O)CF 34a_100000698735_100015361967 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.452 CCN1CCN(C(=O)C1)C(C)C 2230a_100000698735_100000210202 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.452 CCN1CCN(C(=O)C1)C(C)C 269982a_100000698735_100000204670 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.452 CCN1CCN(C(=O)C1)C(C)C 34a_100000698735_100000210202 [0,1,0,0,0,0|2,0,1]=4 33 B10R0.3 C#CCC(C)OCC=C(C)C 34a_100000685586_100000761012 [0,0,1,0,0,0|2,0,1]=4 34 B10R0.3 C#CCC(C)OCC=C(C)C 7a_100000685586_100000761012 [0,0,1,0,0,0|2,0,1]=4 35 B10R0.3 C#CCN(C)CCC=C(C)C 2230a_100000225692_100011217483 [0,0,1,0,0,0|2,0,1]=4 36 B10R0.3 C#CCN(C)CCC=C(C)C 34a_100000225692_100011217483 [0,0,1,0,0,0|2,0,1]=4 37 B10R0.3 C/C=C/C(C)OCC=C(C)C 34a_200102604097_100000761012 [0,0,1,0,0,0|2,0,1]=4 38 B10R0.3 C=CCC(=O)CCC=C(C)C 1458a_100000210193_100011217483 [0,0,1,0,0,0|2,0,1]=4 39 B10R0.3 C=CCN(C)CCC=C(C)C 2230a_100000225617_100011217483 [0,0,1,0,0,0|2,0,0]=3 40 B10R0.3 C=CCN(C)CCC=C(C)C 269982a_100000225617_100011217483 [0,0,1,0,0,0|2,0,0]=3 41 B10R0.3 C=CC[C@@H](C)OCC=C(C)C 34a_100000731007_100000761012 [0,0,1,0,0,0|2,0,0]=3 42 B10R0.3 C=CC[C@@H](C)OCC=C(C)C 7a_100000731007_100000761012 [0,0,1,0,0,0|2,0,0]=3 43 B10R0.3 CC(=CCCC(C)OCF)C 34a_100102619829_100015361967 [0,0,1,0,0,0|2,0,1]=4 44 B10R0.3 CC(=CCCC(C)OCF)C 7a_100102619829_100015361967 [0,0,1,0,0,0|2,0,1]=4 45 B10R0.3 CC(=CCCN(C)CC#N)C 2230a_100000748184_100011217483 [0,0,1,0,0,0|2,0,1]=4 46 B10R0.3 CC(=CCCN(C)CCO)C 2230a_100000210263_100011217483 [0,0,1,0,0,0|1,0,2]=4 47 B10R0.3 CC(=CCCN(C)CCO)C 269982a_100000210263_100011217483 [0,0,1,0,0,0|1,0,2]=4 48 B10R0.3 CC(=CCNC(C)CCO)C 34a_100000718196_100009893172 [0,0,1,0,0,0|1,0,2]=4 49 B10R0.3 CC(=CCN[C@@H](C)CC#N)C 2230a_100016994482_100000761012 [0,0,1,0,0,0|2,0,1]=4 50 B10R0.3 CC(=CCN[C@H](C)CCO)C 2230a_100000706166_100000761012 [0,0,1,0,0,0|1,0,2]=4 51 B10R0.3 CC(=CCN[C@H](C)CCO)C 34a_100000706166_100000761012 [0,0,1,0,0,0|1,0,2]=4 52 B10R0.3 CC(=CCOC(C)CCBr)C 34a_100012276601_100000761012 [0,0,1,0,0,0|2,0,1]=4 53 B10R0.3 CC(=CCOC(C)CCO)C 34a_100000753907_100009893172 [0,0,1,0,0,0|1,0,2]=4 54 B10R0.3 CC(=CCSC(C)CC#N)C 62a_100000761012_100009813641 [0,0,1,0,0,0|2,0,1]=4 55 B10R0.3 CC(=CCSC(C)CC#N)C 62a_100009813641_100000761012 [0,0,1,0,0,0|2,0,1]=4 56 B10R0.3 CC(=CCSC(C)CCO)C 62a_100000761012_100009893172 [0,0,1,0,0,0|1,0,2]=4 57 B10R0.3 CC(=CCSC(C)CCO)C 62a_100009893172_100000761012 [0,0,1,0,0,0|1,0,2]=4 58 B10R0.3 CCCC(C)NCC=C(C)C 2230a_100000741246_100000761012 [0,0,1,0,0,0|2,0,1]=4 59 B10R0.3 CCCC(C)NCC=C(C)C 270004a_100000718196_100000211909 [0,0,1,0,0,0|2,0,1]=4 60 B10R0.3 CCCC(C)NCC=C(C)C 34a_100000718196_100000766640 [0,0,1,0,0,0|2,0,1]=4 61 B10R0.3 CCCC(C)OCC=C(C)C 34a_100000753907_100000766640 [0,0,1,0,0,0|2,0,1]=4 62 B10R0.3 CCCC(C)OCC=C(C)C 34a_100000764384_100000761012 [0,0,1,0,0,0|2,0,1]=4 63 B10R0.3 CCCC(C)OCC=C(C)C 7a_100000764384_100000761012 [0,0,1,0,0,0|2,0,1]=4 64 B10R0.3 CCCC(C)SCC=C(C)C 62a_100000761012_100000766640 [0,0,1,0,0,0|2,0,1]=4 65 B10R0.3 CCCC(C)SCC=C(C)C 62a_100000766640_100000761012 [0,0,1,0,0,0|2,0,1]=4 66 B10R0.3 CCCN(C)CCC=C(C)C 2230a_100000747261_100011217483 [0,0,1,0,0,0|2,0,1]=4 67 B10R0.3 CCCN(C)CCC=C(C)C 269982a_100000747261_100011217483 [0,0,1,0,0,0|2,0,1]=4 68 B10R0.3 CCNC(C)CCC=C(C)C 270004a_100015525214_100000765506 [0,0,1,0,0,0|2,0,1]=4 69 B10R0.3 CCOC(C)CCC=C(C)C 34a_100102619829_100000210202 [0,0,1,0,0,0|2,0,1]=4 70 B10R0.3 CCOC(C)CCC=C(C)C 7a_100102619829_100000210202 [0,0,1,0,0,0|2,0,1]=4 71 B10R0.3 CN(C)CCCN(C)CC=O 269982a_100000225831_200015260668 [0,0,1,0,0,0|2,0,1]=4 72 B10R0.3 CNCC(C)CCC=C(C)C 270004a_106832991635_100000033009 [0,0,1,0,0,0|2,0,0]=3 73 B10R0.3 COCC(C)NCC=C(C)C 270004a_100000718196_100000749346 [0,0,1,0,0,0|3,0,0]=4 74 B10R0.3 COCC(C)NCC=C(C)C 34a_100000718196_100000765312 [0,0,1,0,0,0|3,0,0]=4 75 B10R0.3 COCC(C)OCC=C(C)C 34a_100000753907_100000765312 [0,0,1,0,0,0|3,0,0]=4 76 B10R0.3 COCC(C)SCC=C(C)C 62a_100000761012_100000765312 [0,0,1,0,0,0|3,0,0]=4 77 B10R0.3 COCC(C)SCC=C(C)C 62a_100000765312_100000761012 [0,0,1,0,0,0|3,0,0]=4 78 B10R0.3 COC[C@@H](C)NCC=C(C)C 2230a_100000764878_100000761012 [0,0,1,0,0,0|3,0,0]=4 79 B10R0.3 COC[C@@H](C)OCC=C(C)C 34a_100011934205_100000761012 [0,0,1,0,0,0|3,0,0]=4 80 B10R0.3 CSCC(C)NCC=C(C)C 270004a_100000718196_100011216314 [0,0,1,0,0,0|3,0,0]=4 81 B10R0.13 CC(=O)C(C)C(=O)CC(C)C 1458a_100000210554_100000179758 [0,0,1,0,0,0|1,0,1]=3 82 B10R0.13 CC(=O)C(C)C(=O)CN(C)C 1458a_100000750896_100000179758 [0,0,1,0,0,0|2,0,1]=4 83 B10R0.13 CC(=O)C(C)C(=O)C[C@@H](C)O 1458a_100011933948_100000179758 [0,0,1,0,0,0|2,0,1]=4 84 B10R0.13 CC(=O)C(C)C(=O)C[S+](C)C 1458a_200159257847_100000179758 [0,0,1,0,0,0|2,0,1]=4 85 B10R0.13 CC(=O)C(C)C(=O)NC(C)C 1458a_100000070787_100000195394 [0,0,1,0,0,0|2,0,1]=4 86 B10R0.13 CC(C)CC(=O)C(=O)N(C)C 1458a_100011218876_100000210624 [0,0,1,0,0,0|2,0,0]=3 87 B10R0.13 CC(C)CC(=O)C(C)C(=O)N 1458a_100000210554_100000702099 [0,0,1,0,0,0|2,0,1]=4 88 B10R0.13 CC(C)CC(=O)C(C)C(C)C 1458a_100000755409_100000210624 [0,0,1,0,0,0|0,0,2]=3 89 B10R0.13 CC(C)CC(=O)N(C)C(C)C 11a_200000211004_100000210554 [0,0,1,0,0,0|1,0,1]=3 90 B10R0.13 CC(C)CC(=O)N(C)C(C)C 1626a_200000211004_100000210554 [0,0,1,0,0,0|1,0,1]=3 91 B10R0.13 CC(C)CC(=O)N(C)C(C)C 240690a_200000211004_100000210554 [0,0,1,0,0,0|1,0,1]=3 92 B10R0.13 CC(C)CC(=O)N(C)C(C)C 527a_200000211004_100000210554 [0,0,1,0,0,0|1,0,1]=3 93 B10R0.13 CC(C)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210624 [0,0,1,0,0,0|1,0,1]=3 94 B10R0.13 CC(C)CC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210624 [0,0,1,0,0,0|1,0,2]=4 95 B10R0.13 CC(C)N(C)C(=O)CN(C)C 11a_200000211004_100000750896 [0,0,1,0,0,0|2,0,1]=4 96 B10R0.13 CC(C)N(C)C(=O)CN(C)C 2230a_100102631434_100000230190 [0,0,1,0,0,0|2,0,1]=4 97 B10R0.13 CC(C)N(C)C(=O)CN(C)C 240690a_200000211004_100000750896 [0,0,1,0,0,0|2,0,1]=4 98 B10R0.13 CC(C)N(C)C(=O)CN(C)C 269982a_100102631434_100000230190 [0,0,1,0,0,0|2,0,1]=4 99 B10R0.13 CC(C)N(C)C(=O)CN(C)C 527a_200000211004_100000750896 [0,0,1,0,0,0|2,0,1]=4 100 B10R0.13 CC(C)N(C)C(=O)C[C@@H](C)O 240690a_200000211004_100011933948 [0,0,1,0,0,0|2,0,1]=4 101 B10R0.13 CC(C)N(C)C(=O)C[S+](C)C 11a_200000211004_200159257847 [0,0,1,0,0,0|2,0,1]=4 102 B10R0.13 CC(C)N(C)C(=O)C[S+](C)C 1626a_200000211004_200159257847 [0,0,1,0,0,0|2,0,1]=4 103 B10R0.13 CC(C)N(C)C(=O)C[S+](C)C 240690a_200000211004_200159257847 [0,0,1,0,0,0|2,0,1]=4 104 B10R0.13 CC(C)N(C)C(=O)C[S+](C)C 527a_200000211004_200159257847 [0,0,1,0,0,0|2,0,1]=4 105 B10R0.13 CC(C)NC(=O)C(=O)C(C)C 1458a_100011220036_100000210206 [0,0,1,0,0,0|2,0,1]=4 106 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 1626a_100102631434_100011220036 [0,0,1,0,0,0|3,0,0]=4 107 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 1626a_100138425928_100011218876 [0,0,1,0,0,0|3,0,0]=4 108 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 240690a_100102631434_100011220036 [0,0,1,0,0,0|3,0,0]=4 109 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 240690a_100138425928_100011218876 [0,0,1,0,0,0|3,0,0]=4 110 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 527a_100102631434_100011220036 [0,0,1,0,0,0|3,0,0]=4 111 B10R0.13 CC(C)NC(=O)C(=O)N(C)C 527a_100138425928_100011218876 [0,0,1,0,0,0|3,0,0]=4 112 B10R0.13 CC(C)NC(=O)C(C)C(C)C 11a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 113 B10R0.13 CC(C)NC(=O)C(C)C(C)C 1626a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 114 B10R0.13 CC(C)NC(=O)C(C)C(C)C 240690a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 115 B10R0.13 CC(C)NC(=O)C(C)C(C)C 527a_100138425928_100000755409 [0,0,1,0,0,0|1,0,2]=4 116 B10R0.13 CC(C)NC(=O)C(C)N(C)C 2230a_100102631434_100000195394 [0,0,1,0,0,0|2,0,1]=4 117 B10R0.13 CC(C)NC(=O)C(C)N(C)C 269982a_100102631434_100000195394 [0,0,1,0,0,0|2,0,1]=4 118 B10R0.13 CC(C)NC(=O)N(C)C(C)C 2708a_100138425928_200000211004 [0,0,1,0,0,0|2,0,1]=4 119 B10R0.13 CC(C)NC(=O)N(C)C(C)C 273464a_100138425928_200000211004 [0,0,1,0,0,0|2,0,1]=4 120 B10R0.13 CC(C)NC(=O)[C@H](C)N(C)C 240690a_100138425928_100009822176 [0,0,1,0,0,0|2,0,1]=4 121 B10R0.13 CC(C)NC(=O)[C@H](C)N(C)C 527a_100138425928_100009822176 [0,0,1,0,0,0|2,0,1]=4 122 B10R0.13 CC(O)CC(=O)C(=O)N(C)C 1458a_100011218876_100011218427 [0,0,1,0,0,0|3,0,0]=4 123 B10R0.13 CC(O)CC(=O)C(C)C(C)C 1458a_100000755409_100011218427 [0,0,1,0,0,0|1,0,2]=4 124 B10R0.13 CC(O)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100011218427 [0,0,1,0,0,0|2,0,1]=4 125 B10R0.17 CC(=O)N(CCCO)C(C)C 240690a_100000182298_100015343762 [0,0,1,0,0,0|2,0,1]=4 126 B10R0.17 CC(=O)N(CCCO)C(C)C 527a_100000182298_100103153847 [0,0,1,0,0,0|2,0,1]=4 127 B10R0.17 CCCCC(C(=O)C)C(=O)N 1458a_100000070787_100000748834 [0,0,1,0,0,0|2,0,1]=4 128 B10R0.17 CCCCC(C(=O)N)N(C)C 2230a_100102631434_100000748834 [0,0,1,0,0,0|2,0,1]=4 129 B10R0.17 CCCCC(C(=O)N)N(C)C 269982a_100102631434_100000748834 [0,0,1,0,0,0|2,0,1]=4 130 B10R0.17 CCCCN(C(=O)C)C(C)C 11a_100000207398_100015343762 [0,0,1,0,0,0|1,0,1]=3 131 B10R0.17 CCCCN(C(=O)C)C(C)C 1626a_100000207398_100015343762 [0,0,1,0,0,0|1,0,1]=3 132 B10R0.17 CCCCN(C(=O)C)C(C)C 240690a_100000207398_100015343762 [0,0,1,0,0,0|1,0,1]=3 133 B10R0.17 CCCCN(C(=O)C)C(C)C 527a_100000207398_100103153847 [0,0,1,0,0,0|1,0,1]=3 134 B10R0.17 CCCSC(C(=O)C)C(=O)C 62a_100000210303_100000210371 [0,0,1,0,0,0|2,0,1]=4 135 B10R0.17 CCCSC(C(=O)C)C(=O)C 62a_100000210371_100000210303 [0,0,1,0,0,0|2,0,1]=4 136 B10R0.17 COCCN(C(=O)C)C(C)C 11a_200000223778_100015343762 [0,0,1,0,0,0|2,0,1]=4 137 B10R0.17 COCCN(C(=O)C)C(C)C 1626a_200000223778_100015343762 [0,0,1,0,0,0|2,0,1]=4 138 B10R0.17 COCCN(C(=O)C)C(C)C 240690a_200000223778_100015343762 [0,0,1,0,0,0|2,0,1]=4 139 B10R0.17 COCCN(C(=O)C)C(C)C 527a_200000223778_100103153847 [0,0,1,0,0,0|2,0,1]=4 140 B10R0.44 C#CC(C)NC(=O)C=C(C)C 11a_100000707721_100000211388 [0,0,1,0,0,0|1,0,2]=4 141 B10R0.44 C#CC(C)NC(=O)C=C(C)C 1626a_100000707721_100000211388 [0,0,1,0,0,0|1,0,2]=4 142 B10R0.44 C#CC(C)NC(=O)C=C(C)C 240690a_100000707721_100000211388 [0,0,1,0,0,0|1,0,2]=4 143 B10R0.44 C=C(C)CC(=O)CC(C)CC 1458a_100000708755_100000748629 [0,0,1,0,0,0|0,0,2]=3 144 B10R0.44 C=C(C)CC(=O)CC(O)CC 1458a_100011667805_100000748629 [0,0,1,0,0,0|1,0,2]=4 145 B10R0.44 C=C(C)CC(=O)CN(C)CC 1458a_100116209913_100000748629 [0,0,1,0,0,0|1,0,2]=4 146 B10R0.44 C=C(F)CC(=O)CC(C)CC 1458a_100000708755_100009893438 [0,0,1,0,0,0|1,0,2]=4 147 B10R0.44 CC(=CC(=O)C[C@@H](C)CO)C 1458a_100000211388_100000059175 [0,0,1,0,0,0|1,0,0]=2 148 B10R0.44 CC(=CC(=O)C[C@@H](C)CO)Cl 1458a_200042562850_100000059175 [0,0,1,0,0,0|2,0,0]=3 149 B10R0.44 CC(=CC(=O)C[C@@H](C)CO)I 1458a_100025716642_100000059175 [0,0,1,0,0,0|2,0,0]=3 150 B10R0.44 CC(=CC(=O)NC(C)C#N)C 11a_100000737613_100000211388 [0,0,1,0,0,0|2,0,1]=4 151 B10R0.44 CC(=CC(=O)NC(C)C#N)C 1626a_100000737613_100000211388 [0,0,1,0,0,0|2,0,1]=4 152 B10R0.44 CC(=CC(=O)N[C@H](C)CF)C 11a_100102880703_100000211388 [0,0,1,0,0,0|2,0,0]=3 153 B10R0.44 CC(=CC(=O)N[C@H](C)CF)C 1626a_100102880703_100000211388 [0,0,1,0,0,0|2,0,0]=3 154 B10R0.44 CC(=CC(=O)N[C@H](C)CF)C 240690a_100102880703_100000211388 [0,0,1,0,0,0|2,0,0]=3 155 B10R0.44 CC(=CC(=O)N[C@H](C)CF)Cl 11a_100102880703_200042562850 [0,0,1,0,0,0|3,0,0]=4 156 B10R0.44 CC(=CC(=O)N[C@H](C)CF)Cl 1626a_100102880703_200042562850 [0,0,1,0,0,0|3,0,0]=4 157 B10R0.44 CC(=CC(=O)N[C@H](C)CF)Cl 240690a_100102880703_200042562850 [0,0,1,0,0,0|3,0,0]=4 158 B10R0.44 CC(=CC(=O)N[C@H](C)CF)I 11a_100102880703_100025716642 [0,0,1,0,0,0|3,0,0]=4 159 B10R0.44 CC(=CC(=O)N[C@H](C)CF)I 1626a_100102880703_100025716642 [0,0,1,0,0,0|3,0,0]=4 160 B10R0.44 CC(=CC(=O)N[C@H](C)CO)C 240690a_100000737577_100000211388 [0,0,1,0,0,0|2,0,0]=3 161 B10R0.44 CC(=CC(=O)N[C@H](C)CO)Cl 240690a_100000737577_200042562850 [0,0,1,0,0,0|3,0,0]=4 162 B10R0.44 CC(C)CC(=O)C[C@@H](C)CO 1458a_100000210554_100000059175 [0,0,1,0,0,0|1,0,2]=4 163 B10R0.44 CCC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000747405 [0,0,1,0,0,0|1,0,1]=3 164 B10R0.44 CCC(=O)CC(=O)C=C(C)Cl 1458a_200042562850_100000747405 [0,0,1,0,0,0|2,0,1]=4 165 B10R0.44 CCC(=O)CC(=O)C=C(C)I 1458a_100025716642_100000747405 [0,0,1,0,0,0|2,0,1]=4 166 B10R0.44 CCC(C)CC(=O)C=C(C)C 1458a_100000211388_100000748023 [0,0,1,0,0,0|0,0,0]=1 167 B10R0.44 CCC(C)CC(=O)C=C(C)Cl 1458a_200042562850_100000748023 [0,0,1,0,0,0|1,0,0]=2 168 B10R0.44 CCC(C)CC(=O)C=C(C)I 1458a_100025716642_100000748023 [0,0,1,0,0,0|1,0,0]=2 169 B10R0.44 CCC(C)CC(=O)C=C(Cl)Cl 1458a_100000137448_100000748023 [0,0,1,0,0,0|2,0,0]=3 170 B10R0.44 CCC(C)CC(=O)CC(=O)N 1458a_100000708755_100000187820 [0,0,1,0,0,0|2,0,1]=4 171 B10R0.44 CCC(C)CC(=O)CC(=O)N 1458a_100134613110_100000748023 [0,0,1,0,0,0|2,0,1]=4 172 B10R0.44 CCC(C)CC(=O)CC(=O)[O-] 1458a_100000708755_100020667443 [0,0,1,0,0,0|2,0,1]=4 173 B10R0.44 CCC(C)CC(=O)CC(C)C 1458a_100000210554_100000748023 [0,0,1,0,0,0|0,0,2]=3 174 B10R0.44 CCC(C)CC(=O)CC(C)C 1458a_100000708755_100000210624 [0,0,1,0,0,0|0,0,2]=3 175 B10R0.44 CCC(C)CC(=O)CC(C)O 1458a_100000708755_100011218427 [0,0,1,0,0,0|1,0,2]=4 176 B10R0.44 CCC(C)CC(=O)CN(C)C 1458a_100000750896_100000748023 [0,0,1,0,0,0|1,0,1]=3 177 B10R0.44 CCC(C)CC(=O)C[C@@H](C)O 1458a_100011933948_100000748023 [0,0,1,0,0,0|1,0,2]=4 178 B10R0.44 CCC(C)CC(=O)C[S+](C)C 1458a_200159257847_100000748023 [0,0,1,0,0,0|1,0,1]=3 179 B10R0.44 CCC(C)CC(=O)NC(C)C 11a_100138425928_100000708755 [0,0,1,0,0,0|1,0,1]=3 180 B10R0.44 CCC(C)CC(=O)NC(C)C 1626a_100138425928_100000708755 [0,0,1,0,0,0|1,0,1]=3 181 B10R0.44 CCC(C)CC(=O)NC(C)C 240690a_100138425928_100000708755 [0,0,1,0,0,0|1,0,1]=3 182 B10R0.44 CCC(C)CC(=O)NC(C)C 527a_100138425928_100000708755 [0,0,1,0,0,0|1,0,1]=3 183 B10R0.44 CCC(C)NC(=O)C=C(C)C 11a_100000209981_100000211388 [0,0,1,0,0,0|1,0,0]=2 184 B10R0.44 CCC(C)NC(=O)C=C(C)C 1626a_100000209981_100000211388 [0,0,1,0,0,0|1,0,0]=2 185 B10R0.44 CCC(C)NC(=O)C=C(C)C 240690a_100000209981_100000211388 [0,0,1,0,0,0|1,0,0]=2 186 B10R0.44 CCC(C)NC(=O)C=C(C)Cl 11a_100000209981_200042562850 [0,0,1,0,0,0|2,0,0]=3 187 B10R0.44 CCC(C)NC(=O)C=C(C)Cl 1626a_100000209981_200042562850 [0,0,1,0,0,0|2,0,0]=3 188 B10R0.44 CCC(C)NC(=O)C=C(C)Cl 240690a_100000209981_200042562850 [0,0,1,0,0,0|2,0,0]=3 189 B10R0.44 CCC(C)NC(=O)C=C(C)I 11a_100000209981_100025716642 [0,0,1,0,0,0|2,0,0]=3 190 B10R0.44 CCC(C)NC(=O)C=C(C)I 1626a_100000209981_100025716642 [0,0,1,0,0,0|2,0,0]=3 191 B10R0.44 CCC(C)NC(=O)C=C(Cl)Cl 1626a_100000209981_100000137448 [0,0,1,0,0,0|3,0,0]=4 192 B10R0.44 CCC(C)NC(=O)C=C(Cl)Cl 240690a_100000209981_100000137448 [0,0,1,0,0,0|3,0,0]=4 193 B10R0.44 CCC(C)NC(=O)CC(=O)C 1458a_100000070787_100000182745 [0,0,1,0,0,0|2,0,1]=4 194 B10R0.44 CCC(C)NC(=O)CC(C)C 11a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 195 B10R0.44 CCC(C)NC(=O)CC(C)C 1626a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 196 B10R0.44 CCC(C)NC(=O)CC(C)C 240690a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 197 B10R0.44 CCC(C)NC(=O)CC(C)C 527a_100000209981_100000210554 [0,0,1,0,0,0|1,0,2]=4 198 B10R0.44 CCC(C)NC(=O)CN(C)C 11a_100000209981_100000750896 [0,0,1,0,0,0|2,0,1]=4 199 B10R0.44 CCC(C)NC(=O)CN(C)C 2230a_100102631434_100000182745 [0,0,1,0,0,0|2,0,1]=4 200 B10R0.44 CCC(C)NC(=O)CN(C)C 240690a_100000209981_100000750896 [0,0,1,0,0,0|2,0,1]=4 201 B10R0.44 CCC(C)NC(=O)CN(C)C 269982a_100102631434_100000182745 [0,0,1,0,0,0|2,0,1]=4 202 B10R0.44 CCC(C)NC(=O)CN(C)C 527a_100000209981_100000750896 [0,0,1,0,0,0|2,0,1]=4 203 B10R0.44 CCC(C)NC(=O)C[S+](C)C 11a_100000209981_200159257847 [0,0,1,0,0,0|2,0,1]=4 204 B10R0.44 CCC(C)NC(=O)C[S+](C)C 1626a_100000209981_200159257847 [0,0,1,0,0,0|2,0,1]=4 205 B10R0.44 CCC(C)NC(=O)C[S+](C)C 240690a_100000209981_200159257847 [0,0,1,0,0,0|2,0,1]=4 206 B10R0.44 CCC(C)NC(=O)C[S+](C)C 527a_100000209981_200159257847 [0,0,1,0,0,0|2,0,1]=4 207 B10R0.44 CCC(C)NC(=O)NC(C)C 2708a_100000209981_100138425928 [0,0,1,0,0,0|2,0,1]=4 208 B10R0.44 CCC(C)NC(=O)NC(C)C 2708a_100138425928_100000209981 [0,0,1,0,0,0|2,0,1]=4 209 B10R0.44 CCC(C)NC(=O)NC(C)C 273464a_100138425928_100000209981 [0,0,1,0,0,0|2,0,1]=4 210 B10R0.44 CCC(C)NC(=O)NC(C)C 512a_100000209981_100138425928 [0,0,1,0,0,0|2,0,1]=4 211 B10R0.44 CCC(C)NC(=O)NC(C)C 512a_100138425928_100000209981 [0,0,1,0,0,0|2,0,1]=4 212 B10R0.44 CCC(C)OC(C)C=C(C)C 34a_100000717055_100011215416 [0,0,1,0,0,0|2,0,1]=4 213 B10R0.44 CCC(O)CC(=O)C=C(C)C 1458a_100000211388_100011218378 [0,0,1,0,0,0|1,0,0]=2 214 B10R0.44 CCC(O)CC(=O)C=C(C)Cl 1458a_200042562850_100011218378 [0,0,1,0,0,0|2,0,0]=3 215 B10R0.44 CCC(O)CC(=O)C=C(C)I 1458a_100025716642_100011218378 [0,0,1,0,0,0|2,0,0]=3 216 B10R0.44 CCC(O)CC(=O)C=C(Cl)Cl 1458a_100000137448_100011218378 [0,0,1,0,0,0|3,0,0]=4 217 B10R0.44 CCC(O)CC(=O)CC(C)C 1458a_100000210554_100011218378 [0,0,1,0,0,0|1,0,2]=4 218 B10R0.44 CCC(O)CC(=O)CC(C)C 1458a_100011667805_100000210624 [0,0,1,0,0,0|1,0,2]=4 219 B10R0.44 CCC(O)CC(=O)CN(C)C 1458a_100000750896_100011218378 [0,0,1,0,0,0|2,0,1]=4 220 B10R0.44 CCC(O)CC(=O)C[S+](C)C 1458a_200159257847_100011218378 [0,0,1,0,0,0|2,0,1]=4 221 B10R0.44 CCC(O)CC(=O)NC(C)C 1626a_100138425928_100011667805 [0,0,1,0,0,0|2,0,1]=4 222 B10R0.44 CCC(O)CC(=O)NC(C)C 240690a_100138425928_100011667805 [0,0,1,0,0,0|2,0,1]=4 223 B10R0.44 CCN(C)CC(=O)CC(C)C 1458a_100116209913_100000210624 [0,0,1,0,0,0|1,0,2]=4 224 B10R0.44 CCN(C)CC(=O)NC(=O)C 269982a_100000225621_100000183797 [0,0,1,0,0,0|3,0,0]=4 225 B10R0.44 CCN(C)CC(=O)NC(C)C 2230a_100000168146_100000210202 [0,0,1,0,0,0|2,0,1]=4 226 B10R0.44 CCN(C)CC(=O)NC(C)C 2230a_100000225621_100000183996 [0,0,1,0,0,0|2,0,1]=4 227 B10R0.44 CCN(C)CC(=O)NC(C)C 240690a_100138425928_100116209913 [0,0,1,0,0,0|2,0,1]=4 228 B10R0.44 CCN(C)CC(=O)NC(C)C 269982a_100000168146_100000204670 [0,0,1,0,0,0|2,0,1]=4 229 B10R0.44 CCN(C)CC(=O)NC(C)C 269982a_100000225621_100000183996 [0,0,1,0,0,0|2,0,1]=4 230 B10R0.44 CCN(C)CC(=O)NC(C)C 527a_100138425928_100116209913 [0,0,1,0,0,0|2,0,1]=4 231 B10R0.44 CCN(C)CC(=O)OC(C)C 2230a_100000225621_100011215430 [0,0,1,0,0,0|2,0,1]=4 232 B10R0.44 CCN(C)CC(=O)OC(C)C 269982a_100000225621_100011215430 [0,0,1,0,0,0|2,0,1]=4 233 B10R0.44 CC[C@H](C)CC(=O)C=C(C)C 1458a_100000211388_100009816398 [0,0,1,0,0,0|0,0,0]=1 234 B10R0.44 CC[C@H](C)CC(=O)C=C(C)Cl 1458a_200042562850_100009816398 [0,0,1,0,0,0|1,0,0]=2 235 B10R0.44 CC[C@H](C)CC(=O)C=C(C)I 1458a_100025716642_100009816398 [0,0,1,0,0,0|1,0,0]=2 236 B10R0.44 CC[C@H](C)CC(=O)C=C(Cl)Cl 1458a_100000137448_100009816398 [0,0,1,0,0,0|2,0,0]=3 237 B10R0.44 CC[C@H](C)CC(=O)CC(=O)N 1458a_100134613110_100009816398 [0,0,1,0,0,0|2,0,1]=4 238 B10R0.44 CC[C@H](C)CC(=O)CC(C)C 1458a_100000210554_100009816398 [0,0,1,0,0,0|0,0,2]=3 239 B10R0.44 CC[C@H](C)CC(=O)CN(C)C 1458a_100000750896_100009816398 [0,0,1,0,0,0|1,0,1]=3 240 B10R0.44 CC[C@H](C)CC(=O)C[C@@H](C)O 1458a_100011933948_100009816398 [0,0,1,0,0,0|1,0,2]=4 241 B10R0.44 CC[C@H](C)CC(=O)C[S+](C)C 1458a_200159257847_100009816398 [0,0,1,0,0,0|1,0,1]=3 242 B10R0.44 CNC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000183359 [0,0,1,0,0,0|2,0,1]=4 243 B10R0.44 COC(=O)CC(=O)C=C(C)C 1458a_100000211388_100000747449 [0,0,1,0,0,0|2,0,1]=4 244 B10R0.44 C[C@@H](CO)CC(=O)C=C(Cl)Cl 1458a_100000137448_100000059175 [0,0,1,0,0,0|3,0,0]=4 245 B10R0.44 C[C@@H](CO)CC(=O)CN(C)C 1458a_100000750896_100000059175 [0,0,1,0,0,0|2,0,1]=4 246 B10R0.44 C[C@@H](CO)CC(=O)C[S+](C)C 1458a_200159257847_100000059175 [0,0,1,0,0,0|2,0,1]=4 247 B10R0.101 CC(=C(C#N)C(=O)CCF)C 1458a_100000137542_100011217306 [0,0,1,0,0,0|2,0,1]=4 248 B10R0.101 CC(=C(C#N)C(=O)CCO)C 1458a_100000137542_100000211926 [0,0,1,0,0,0|2,0,1]=4 249 B10R0.101 CCC(C(=O)CCF)N(C)C 1458a_100000689100_100011217306 [0,0,1,0,0,0|2,0,1]=4 250 B10R0.101 CCC(C(=O)CCO)N(C)C 1458a_100000689100_100000211926 [0,0,1,0,0,0|2,0,1]=4 251 B10R0.101 CCCC(=O)C(=C(C)C)C#N 1458a_100000137542_100000210303 [0,0,1,0,0,0|1,0,1]=3 252 B10R0.101 CCCC(=O)C(CC)C(=O)N 1458a_100000211992_100000750255 [0,0,1,0,0,0|2,0,1]=4 253 B10R0.101 CCCC(=O)C(CC)N(C)C 1458a_100000689100_100000210303 [0,0,1,0,0,0|1,0,1]=3 254 B10R0.101 CCCC(=O)N(CC)C(C)C 11a_100000223864_100000211992 [0,0,1,0,0,0|1,0,1]=3 255 B10R0.101 CCCC(=O)N(CC)C(C)C 1626a_100000223864_100000211992 [0,0,1,0,0,0|1,0,1]=3 256 B10R0.101 CCCC(=O)N(CC)C(C)C 240690a_100000223864_100000211992 [0,0,1,0,0,0|1,0,1]=3 257 B10R0.101 CCCC(=O)N(CC)C(C)C 527a_100000223864_100000211992 [0,0,1,0,0,0|1,0,1]=3 258 B10R0.101 CCN(C(=O)CCO)C(C)C 240690a_100000223864_100011216618 [0,0,1,0,0,0|2,0,1]=4 259 B10R0.101 CCN(C(=O)CNC)C(C)C 2230a_106832991635_100011282762 [0,0,1,0,0,0|2,0,1]=4 260 B10R0.101 CCN(C(=O)CNC)C(C)C 34a_100102657272_100011282762 [0,0,1,0,0,0|2,0,1]=4 261 B10R0.101 CCN(C(=O)CNC)C(C)C 7a_106832991635_100011282762 [0,0,1,0,0,0|2,0,1]=4 262 B10R0.101 CCN(C(=O)COC)C(C)C 11a_100000223864_100000210968 [0,0,1,0,0,0|2,0,1]=4 263 B10R0.101 CCN(C(=O)COC)C(C)C 1626a_100000223864_100000210968 [0,0,1,0,0,0|2,0,1]=4 264 B10R0.101 CCN(C(=O)COC)C(C)C 240690a_100000223864_100000210968 [0,0,1,0,0,0|2,0,1]=4 265 B10R0.101 CCN(C(=O)COC)C(C)C 34a_100138415774_100011282762 [0,0,1,0,0,0|2,0,1]=4 266 B10R0.101 CCN(C(=O)COC)C(C)C 527a_100000223864_100000210968 [0,0,1,0,0,0|2,0,1]=4 267 B10R0.101 CCN(C(=O)CSC)C(C)C 11a_100000223864_100000184570 [0,0,1,0,0,0|2,0,1]=4 268 B10R0.101 CCN(C(=O)CSC)C(C)C 1626a_100000223864_100000184570 [0,0,1,0,0,0|2,0,1]=4 269 B10R0.101 CCN(C(=O)CSC)C(C)C 240690a_100000223864_100000184570 [0,0,1,0,0,0|2,0,1]=4 270 B10R0.101 CCN(C(=O)CSC)C(C)C 527a_100000223864_100000184570 [0,0,1,0,0,0|2,0,1]=4 271 B10R0.101 CCN(C(=O)CSC)C(C)C 62a_100011282762_200000210301 [0,0,1,0,0,0|2,0,1]=4 272 B10R0.101 CCN(C(=O)CSC)C(C)C 62a_200000210301_100011282762 [0,0,1,0,0,0|2,0,1]=4 273 B10R0.101 CCN(C(=O)CS[13CH3])C(C)C 62a_100011282762_200025704644 [0,0,1,0,0,0|2,0,1]=4 274 B10R0.101 CCN(C(=O)CS[13CH3])C(C)C 62a_200025704644_100011282762 [0,0,1,0,0,0|2,0,1]=4 275 B10R0.101 CCNC(=O)C(CC)N(C)C 240690a_100015525214_100000689100 [0,0,1,0,0,0|2,0,1]=4 276 B10R0.101 CCNC(=O)C(CC)N(C)C 527a_100015525214_100000689100 [0,0,1,0,0,0|2,0,1]=4 277 B10R0.101 CCNC(=O)N(CC)C(C)C 2708a_100015525214_100000223864 [0,0,1,0,0,0|2,0,1]=4 278 B10R0.101 CCNC(=O)N(CC)C(C)C 273464a_100015525214_100000223864 [0,0,1,0,0,0|2,0,1]=4 279 B10R0.101 CCOC(=O)C(CC)C(=O)C 1458a_100000070787_100000212269 [0,0,1,0,0,0|2,0,1]=4 280 B10R0.101 CCOC(=O)C(CC)N(C)C 2230a_100102631434_100000212269 [0,0,1,0,0,0|2,0,1]=4 281 B10R0.101 CCOC(=O)C(CC)N(C)C 269982a_100102631434_100000212269 [0,0,1,0,0,0|2,0,1]=4 282 B10R1.59 CC(=O)C1CC(OC1=O)C 1458a_100000070787_200000216747 [0,0,0,0,1,0|2,0,1]=4 283 B10R1.59 CC1CC(C(=O)O1)N(C)C 2230a_100102631434_200000216747 [0,0,0,0,1,0|2,0,1]=4 284 B10R1.59 CC1CC(C(=O)O1)N(C)C 269982a_100102631434_200000216747 [0,0,0,0,1,0|2,0,1]=4 285 B10R1.194 CC(=O)C1CCN(C1=O)C 1458a_100000070787_100000755940 [0,0,0,0,1,0|2,0,1]=4 286 B10R1.194 CC(=O)C1CCN(C1=O)C 1458a_100000137746_200000210301 [0,0,0,0,1,0|2,0,1]=4 287 B10R1.194 CN1CCC(C1=O)C(=O)[13CH3] 1458a_100000137746_200025704644 [0,0,0,0,1,0|2,0,1]=4 288 B10R1.194 CN1CCC(C1=O)N(C)C 2230a_100102631434_100000755940 [0,0,0,0,1,0|2,0,1]=4 289 B10R1.194 CN1CCC(C1=O)N(C)C 269982a_100102631434_100000755940 [0,0,0,0,1,0|2,0,1]=4 290 B12R1.233 CC(C)CN1CCN(CC1=O)C 2230a_100000708136_200000210301 [0,0,0,0,0,1|2,0,1]=4 291 B12R1.233 CC(C)CN1CCN(CC1=O)C 269982a_100000708136_200000210301 [0,0,0,0,0,1|2,0,1]=4 292 B12R1.233 CC(C)CN1CCN(CC1=O)C 34a_100000708136_200000210301 [0,0,0,0,0,1|2,0,1]=4 293 B12R1.233 CC(C)CN1CCN(CC1=O)[13CH3] 2230a_100000708136_200025704644 [0,0,0,0,0,1|2,0,1]=4 294 B12R1.233 CC(C)CN1CCN(CC1=O)[13CH3] 269982a_100000708136_200025704644 [0,0,0,0,0,1|2,0,1]=4 295 B12R1.233 CC(C)CN1CCN(CC1=O)[13CH3] 34a_100000708136_200025704644 [0,0,0,0,0,1|2,0,1]=4 296 B9R0.1 C=CC(C)OCC=C(C)C 34a_100000695699_100000761012 [1,0,1,0,0,0|1,0,1]=4 297 B9R0.1 C=CC(C)SCC=C(C)C 62a_100011215867_100000761012 [1,0,1,0,0,0|1,0,1]=4 298 B9R0.1 CC(=CCCC(C)O[13CH3])C 34a_100102619829_200025704644 [1,0,1,0,0,0|1,0,1]=4 299 B9R0.1 CC(=CCCC(C)O[13CH3])C 7a_100102619829_200025704644 [1,0,1,0,0,0|1,0,1]=4 300 B9R0.1 CC(=CCNC(C)CO)C 34a_100000718196_100012180447 [1,0,1,0,0,0|1,0,1]=4 301 B9R0.1 CC(=CCN[C@H](C)CO)C 2230a_100000737577_100000761012 [1,0,1,0,0,0|1,0,1]=4 302 B9R0.1 CC(=CCOC(C)CF)C 34a_100016041109_100000761012 [1,0,1,0,0,0|2,0,0]=4 303 B9R0.1 CC(=CCOC(C)CF)C 7a_100016041109_100000761012 [1,0,1,0,0,0|2,0,0]=4 304 B9R0.1 CC(=CCOC(C)CN)C 34a_100000210904_100000761012 [1,0,1,0,0,0|2,0,0]=4 305 B9R0.1 CC(=CCOC(C)CO)C 34a_100000753907_100012180447 [1,0,1,0,0,0|1,0,1]=4 306 B9R0.1 CC(=CCSC(C)CO)C 62a_100012180447_100000761012 [1,0,1,0,0,0|1,0,1]=4 307 B9R0.1 CC(=CCS[C@H](C)CO)C 62a_100000761012_100016084084 [1,0,1,0,0,0|1,0,1]=4 308 B9R0.1 CC(=CCS[C@H](C)CO)C 62a_100016084084_100000761012 [1,0,1,0,0,0|1,0,1]=4 309 B9R0.1 CCC(C)NCC=C(C)C 2230a_100000209981_100000761012 [1,0,1,0,0,0|1,0,1]=4 310 B9R0.1 CCC(C)NCC=C(C)C 34a_100000718196_100011215416 [1,0,1,0,0,0|1,0,1]=4 311 B9R0.1 CCC(C)OCC=C(C)C 34a_100000753907_100011215416 [1,0,1,0,0,0|1,0,1]=4 312 B9R0.1 CCC(C)OCC=C(C)C 7a_100000210228_100000761012 [1,0,1,0,0,0|1,0,1]=4 313 B9R0.1 CCC(C)SCC=C(C)C 62a_100000758301_100000761012 [1,0,1,0,0,0|1,0,1]=4 314 B9R0.1 CCC(C)SCC=C(C)C 62a_100000761012_100000758301 [1,0,1,0,0,0|1,0,1]=4 315 B9R0.1 CCN(C)CCC=C(C)C 2230a_100000225621_100011217483 [1,0,1,0,0,0|1,0,1]=4 316 B9R0.1 CCN(C)CCC=C(C)C 269982a_100000225621_100011217483 [1,0,1,0,0,0|1,0,1]=4 317 B9R0.1 CNC(C)CCC=C(C)C 270004a_106832991635_100000765506 [1,0,1,0,0,0|1,0,1]=4 318 B9R0.1 COC(C)CCC=C(C)C 34a_100102619829_200000210301 [1,0,1,0,0,0|1,0,1]=4 319 B9R0.1 COC(C)CCC=C(C)C 7a_100102619829_200000210301 [1,0,1,0,0,0|1,0,1]=4 320 B9R0.2 C=CCCNCC=C(C)C 2230a_100015191253_100000761012 [1,0,1,0,0,0|2,0,0]=4 321 B9R0.2 C=CCCNCC=C(C)C 34a_100000718196_100000754431 [1,0,1,0,0,0|2,0,0]=4 322 B9R0.2 C=CCCOCC=C(C)C 34a_100000753907_100000754431 [1,0,1,0,0,0|2,0,0]=4 323 B9R0.2 C=CCCOCC=C(C)C 34a_100011205117_100000761012 [1,0,1,0,0,0|2,0,0]=4 324 B9R0.2 C=CCCSCC=C(C)C 62a_100000754431_100000761012 [1,0,1,0,0,0|2,0,0]=4 325 B9R0.2 C=CCCSCC=C(C)C 62a_100000761012_100000754431 [1,0,1,0,0,0|2,0,0]=4 326 B9R0.2 C=CCNCCC=C(C)C 2230a_100020586998_100011217483 [1,0,1,0,0,0|2,0,0]=4 327 B9R0.2 C=CCOCCC=C(C)C 34a_200000210373_100011217483 [1,0,1,0,0,0|2,0,0]=4 328 B9R0.2 C=CCSCCC=C(C)C 62a_100000210623_100011217483 [1,0,1,0,0,0|2,0,0]=4 329 B9R0.2 C=CCSCCC=C(C)C 62a_100011217483_100000210623 [1,0,1,0,0,0|2,0,0]=4 330 B9R0.2 CC(=CCCSCC=O)C 62a_100011217483_200015260668 [1,0,1,0,0,0|1,0,0]=3 331 B9R0.2 CC(=CCCSCC=O)C 62a_200015260668_100011217483 [1,0,1,0,0,0|1,0,0]=3 332 B9R0.2 CC(C)NCCCCC=O 2230a_100138425928_100000139335 [1,0,1,0,0,0|1,0,1]=4 333 B9R0.2 CC(C)SCCCCC=O 62a_100000139335_100000210206 [1,0,1,0,0,0|1,0,1]=4 334 B9R0.2 CC(C)SCCCCC=O 62a_100000210206_100000139335 [1,0,1,0,0,0|1,0,1]=4 335 B9R0.2 CN(C)CCCCCC=O 2230a_100102631434_100000139337 [1,0,1,0,0,0|1,0,1]=4 336 B9R0.2 CN(C)CCCCCC=O 269982a_100102631434_100000139337 [1,0,1,0,0,0|1,0,1]=4 337 B9R0.5 C=CC[C@@H](C)OC/C=C/C 34a_100000731007_100102629194 [1,0,1,0,0,0|2,0,0]=4 338 B9R0.5 C=CC[C@@H](C)OC/C=C/C 7a_100000731007_100102629194 [1,0,1,0,0,0|2,0,0]=4 339 B9R0.5 C=CC[C@@H](C)OCC=CC 34a_100000731007_100000070051 [1,0,1,0,0,0|2,0,0]=4 340 B9R0.5 C=CC[C@@H](C)OCC=CC 7a_100000731007_100000070051 [1,0,1,0,0,0|2,0,0]=4 341 B9R0.6 CCCC(=O)C(=O)N(C)C 1458a_100011218876_100000210303 [1,0,1,0,0,0|2,0,0]=4 342 B9R0.6 CCCC(=O)C(C)C(=O)C 1458a_100000211992_100000179758 [1,0,1,0,0,0|1,0,1]=4 343 B9R0.6 CCCC(=O)C(C)C(C)C 1458a_100000755409_100000210303 [1,0,1,0,0,0|0,0,2]=4 344 B9R0.6 CCCC(=O)N(C)C(C)C 11a_200000211004_100000211992 [1,0,1,0,0,0|1,0,1]=4 345 B9R0.6 CCCC(=O)N(C)C(C)C 1626a_200000211004_100000211992 [1,0,1,0,0,0|1,0,1]=4 346 B9R0.6 CCCC(=O)N(C)C(C)C 240690a_200000211004_100000211992 [1,0,1,0,0,0|1,0,1]=4 347 B9R0.6 CCCC(=O)N(C)C(C)C 527a_200000211004_100000211992 [1,0,1,0,0,0|1,0,1]=4 348 B9R0.6 CCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210303 [1,0,1,0,0,0|1,0,1]=4 349 B9R0.7 C=C(C)C(=O)CCC(C)C 1458a_100000185857_100000210312 [1,0,1,0,0,0|0,0,1]=3 350 B9R0.7 C=C(C)C(=O)CCC(C)O 1458a_100000185857_100012276601 [1,0,1,0,0,0|1,0,1]=4 351 B9R0.7 C=C(C)C(=O)NCC(C)C 11a_100000210953_100000185857 [1,0,1,0,0,0|1,0,1]=4 352 B9R0.7 C=C(C)C(=O)NCC(C)C 1626a_100000210953_100000185857 [1,0,1,0,0,0|1,0,1]=4 353 B9R0.7 CC(=O)C(=O)CNC(C)C 34a_100138425928_100011261029 [1,0,1,0,0,0|2,0,0]=4 354 B9R0.7 CC(=O)C(=O)COC(C)C 34a_100000212225_100011261029 [1,0,1,0,0,0|2,0,0]=4 355 B9R0.7 CC(=O)C(=O)CSC(C)C 62a_100000210206_100011261029 [1,0,1,0,0,0|2,0,0]=4 356 B9R0.7 CC(=O)C(=O)CSC(C)C 62a_100011261029_100000210206 [1,0,1,0,0,0|2,0,0]=4 357 B9R0.7 CC(=O)C(=O)NCC(C)C 1458a_200011297155_200000210301 [1,0,1,0,0,0|2,0,0]=4 358 B9R0.7 CC(C)C(=O)CC[S+](C)C 1458a_100009452791_100000210206 [1,0,1,0,0,0|1,0,1]=4 359 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000181311_100000210206 [1,0,1,0,0,0|0,0,1]=3 360 B9R0.7 CC(C)CCC(=O)C(C)C 1458a_100000210198_100000210312 [1,0,1,0,0,0|0,0,1]=3 361 B9R0.7 CC(C)CCC(=O)C(C)F 1458a_100000062450_100000210312 [1,0,1,0,0,0|1,0,1]=4 362 B9R0.7 CC(C)CCC(=O)N(C)C 11a_100102631434_100000181311 [1,0,1,0,0,0|1,0,0]=3 363 B9R0.7 CC(C)CCC(=O)N(C)C 1626a_100102631434_100000181311 [1,0,1,0,0,0|1,0,0]=3 364 B9R0.7 CC(C)CCC(=O)N(C)C 240690a_100102631434_100000181311 [1,0,1,0,0,0|1,0,0]=3 365 B9R0.7 CC(C)CCC(=O)N(C)C 527a_100102631434_100000181311 [1,0,1,0,0,0|1,0,0]=3 366 B9R0.7 CC(C)CCC(=O)[C@@H](C)O 1458a_100000717761_100000210312 [1,0,1,0,0,0|1,0,1]=4 367 B9R0.7 CC(C)CCC(=O)[C@H](C)O 1458a_217856618621_100000210312 [1,0,1,0,0,0|1,0,1]=4 368 B9R0.7 CC(C)CNC(=O)C(=O)[13CH3] 1458a_200011297155_200025704644 [1,0,1,0,0,0|2,0,0]=4 369 B9R0.7 CC(C)CNC(=O)C(C)C 11a_100000210953_100000210198 [1,0,1,0,0,0|1,0,1]=4 370 B9R0.7 CC(C)CNC(=O)C(C)C 1626a_100000210953_100000210198 [1,0,1,0,0,0|1,0,1]=4 371 B9R0.7 CC(C)CNC(=O)C(C)C 240690a_100000210953_100000210198 [1,0,1,0,0,0|1,0,1]=4 372 B9R0.7 CC(C)CNC(=O)C(C)C 527a_100000210953_100000210198 [1,0,1,0,0,0|1,0,1]=4 373 B9R0.7 CC(C)CNC(=O)N(C)C 2708a_100000210953_100102631434 [1,0,1,0,0,0|2,0,0]=4 374 B9R0.7 CC(C)NCC(=O)C(C)C 2230a_100138425928_100000753385 [1,0,1,0,0,0|1,0,1]=4 375 B9R0.7 CC(C)NCC(=O)C(C)C 34a_100138425928_100000753385 [1,0,1,0,0,0|1,0,1]=4 376 B9R0.7 CC(C)NCC(=O)N(C)C 2230a_100015183351_100000210206 [1,0,1,0,0,0|2,0,0]=4 377 B9R0.7 CC(C)NCC(=O)N(C)C 2230a_100138425928_100000185267 [1,0,1,0,0,0|2,0,0]=4 378 B9R0.7 CC(C)NCC(=O)N(C)C 34a_100138425928_100000692301 [1,0,1,0,0,0|2,0,0]=4 379 B9R0.7 CC(C)OCC(=O)C(C)C 1458a_100000745533_100000210206 [1,0,1,0,0,0|1,0,1]=4 380 B9R0.7 CC(C)OCC(=O)C(C)C 34a_100000212225_100000753385 [1,0,1,0,0,0|1,0,1]=4 381 B9R0.7 CC(C)OCC(=O)N(C)C 11a_100102631434_100000745533 [1,0,1,0,0,0|2,0,0]=4 382 B9R0.7 CC(C)OCC(=O)N(C)C 1626a_100102631434_100000745533 [1,0,1,0,0,0|2,0,0]=4 383 B9R0.7 CC(C)OCC(=O)N(C)C 240690a_100102631434_100000745533 [1,0,1,0,0,0|2,0,0]=4 384 B9R0.7 CC(C)OCC(=O)N(C)C 34a_100000212225_100000692301 [1,0,1,0,0,0|2,0,0]=4 385 B9R0.7 CC(C)OCC(=O)N(C)C 527a_100102631434_100000745533 [1,0,1,0,0,0|2,0,0]=4 386 B9R0.7 CC(C)SCC(=O)C(C)C 1458a_100000241585_100000210206 [1,0,1,0,0,0|1,0,1]=4 387 B9R0.7 CC(C)SCC(=O)C(C)C 62a_100000210206_100000753385 [1,0,1,0,0,0|1,0,1]=4 388 B9R0.7 CC(C)SCC(=O)C(C)C 62a_100000753385_100000210206 [1,0,1,0,0,0|1,0,1]=4 389 B9R0.7 CC(C)SCC(=O)N(C)C 11a_100102631434_100000241585 [1,0,1,0,0,0|2,0,0]=4 390 B9R0.7 CC(C)SCC(=O)N(C)C 1626a_100102631434_100000241585 [1,0,1,0,0,0|2,0,0]=4 391 B9R0.7 CC(C)SCC(=O)N(C)C 240690a_100102631434_100000241585 [1,0,1,0,0,0|2,0,0]=4 392 B9R0.7 CC(C)SCC(=O)N(C)C 527a_100102631434_100000241585 [1,0,1,0,0,0|2,0,0]=4 393 B9R0.7 CC(C)SCC(=O)N(C)C 62a_100000210206_100000692301 [1,0,1,0,0,0|2,0,0]=4 394 B9R0.7 CC(C)SCC(=O)N(C)C 62a_100000692301_100000210206 [1,0,1,0,0,0|2,0,0]=4 395 B9R0.7 CC(O)CCC(=O)C(C)C 1458a_100000210198_100012276601 [1,0,1,0,0,0|1,0,1]=4 396 B9R0.7 CC(O)CCC(=O)N(C)C 1626a_100102631434_100000718519 [1,0,1,0,0,0|2,0,0]=4 397 B9R0.7 CN(C)C(=O)CC[S+](C)C 11a_100102631434_100009452791 [1,0,1,0,0,0|2,0,0]=4 398 B9R0.7 CN(C)C(=O)CC[S+](C)C 1626a_100102631434_100009452791 [1,0,1,0,0,0|2,0,0]=4 399 B9R0.7 CN(C)C(=O)CC[S+](C)C 240690a_100102631434_100009452791 [1,0,1,0,0,0|2,0,0]=4 400 B9R0.7 CN(C)CCC(=O)N(C)C 11a_100102631434_100000689311 [1,0,1,0,0,0|2,0,0]=4 401 B9R0.7 CN(C)CCC(=O)N(C)C 2230a_100102631434_100000737620 [1,0,1,0,0,0|2,0,0]=4 402 B9R0.7 CN(C)CCC(=O)N(C)C 240690a_100102631434_100000689311 [1,0,1,0,0,0|2,0,0]=4 403 B9R0.7 CN(C)CCC(=O)N(C)C 269982a_100102631434_100000737620 [1,0,1,0,0,0|2,0,0]=4 404 B9R0.7 CN(C)CCC(=O)N(C)C 527a_100102631434_100000689311 [1,0,1,0,0,0|2,0,0]=4 405 B9R0.23 C/C=C(\C)/C(=O)CC(C)C 1458a_100020587367_100000210624 [1,0,1,0,0,0|0,0,0]=2 406 B9R0.23 C/C=C(\C)/C(=O)CC(C)O 1458a_100020587367_100011218427 [1,0,1,0,0,0|1,0,0]=3 407 B9R0.23 C/C=C(\C)/C(=O)CC(F)F 1458a_100020587367_100011934356 [1,0,1,0,0,0|2,0,0]=4 408 B9R0.23 C/C=C(\C)/C(=O)NC(C)C 11a_100138425928_100020587367 [1,0,1,0,0,0|1,0,0]=3 409 B9R0.23 C/C=C(\C)/C(=O)NC(C)C 1626a_100138425928_100020587367 [1,0,1,0,0,0|1,0,0]=3 410 B9R0.23 C=C(C)CC(=O)/C(=C/C)/C 1458a_100020587367_100000748629 [1,0,1,0,0,0|0,0,2]=4 411 B9R0.23 C=CC(C)C(=O)CC(C)C 1458a_100011216780_100000210624 [1,0,1,0,0,0|0,0,2]=4 412 B9R0.23 CCC(C)C(=O)CC(C)C 1458a_100000210554_100000758301 [1,0,1,0,0,0|0,0,2]=4 413 B9R0.23 CCC(C)C(=O)CC(C)C 1458a_100011192722_100000210624 [1,0,1,0,0,0|0,0,2]=4 414 B9R0.23 CCN(C)C(=O)CC(C)C 11a_100000225621_100000210554 [1,0,1,0,0,0|1,0,1]=4 415 B9R0.23 CCN(C)C(=O)CC(C)C 1626a_100000225621_100000210554 [1,0,1,0,0,0|1,0,1]=4 416 B9R0.23 CCN(C)C(=O)CC(C)C 240690a_100000225621_100000210554 [1,0,1,0,0,0|1,0,1]=4 417 B9R0.23 CCN(C)C(=O)CC(C)C 527a_100000225621_100000210554 [1,0,1,0,0,0|1,0,1]=4 418 B9R0.23 CNC(=O)C(=O)CC(C)C 1458a_100011218921_100000210624 [1,0,1,0,0,0|2,0,0]=4 419 B9R0.23 COC(C)C(=O)CC(C)C 1458a_100000743197_100000210624 [1,0,1,0,0,0|1,0,1]=4 420 B9R0.23 CSC(C)C(=O)CC(C)C 1458a_100000149566_100000210624 [1,0,1,0,0,0|1,0,1]=4 421 B9R0.53 C=C(C)CC(=O)C=C(C)C 1458a_100000211388_100000748629 [1,0,1,0,0,0|0,0,2]=4 422 B9R0.53 C=C(C)CC(=O)CC(C)C 1458a_100000210554_100000748629 [1,0,1,0,0,0|0,0,2]=4 423 B9R0.53 CC(=CC(=O)CC(C)C)C 1458a_100000211388_100000210624 [1,0,1,0,0,0|0,0,0]=2 424 B9R0.53 CC(=CC(=O)CC(C)C)Cl 1458a_200042562850_100000210624 [1,0,1,0,0,0|1,0,0]=3 425 B9R0.53 CC(=CC(=O)CC(C)C)I 1458a_100025716642_100000210624 [1,0,1,0,0,0|1,0,0]=3 426 B9R0.53 CC(=CC(=O)CC(C)O)C 1458a_100000211388_100011218427 [1,0,1,0,0,0|1,0,0]=3 427 B9R0.53 CC(=CC(=O)CC(C)O)Cl 1458a_200042562850_100011218427 [1,0,1,0,0,0|2,0,0]=4 428 B9R0.53 CC(=CC(=O)CC(C)O)I 1458a_100025716642_100011218427 [1,0,1,0,0,0|2,0,0]=4 429 B9R0.53 CC(=CC(=O)CC(F)F)C 1458a_100000211388_100011934356 [1,0,1,0,0,0|2,0,0]=4 430 B9R0.53 CC(=CC(=O)NC(C)C)C 11a_100138425928_100000211388 [1,0,1,0,0,0|1,0,0]=3 431 B9R0.53 CC(=CC(=O)NC(C)C)C 1626a_100138425928_100000211388 [1,0,1,0,0,0|1,0,0]=3 432 B9R0.53 CC(=CC(=O)NC(C)C)C 240690a_100138425928_100000211388 [1,0,1,0,0,0|1,0,0]=3 433 B9R0.53 CC(=CC(=O)NC(C)C)Cl 11a_100138425928_200042562850 [1,0,1,0,0,0|2,0,0]=4 434 B9R0.53 CC(=CC(=O)NC(C)C)Cl 1626a_100138425928_200042562850 [1,0,1,0,0,0|2,0,0]=4 435 B9R0.53 CC(=CC(=O)NC(C)C)Cl 240690a_100138425928_200042562850 [1,0,1,0,0,0|2,0,0]=4 436 B9R0.53 CC(=CC(=O)NC(C)C)I 11a_100138425928_100025716642 [1,0,1,0,0,0|2,0,0]=4 437 B9R0.53 CC(=CC(=O)NC(C)C)I 1626a_100138425928_100025716642 [1,0,1,0,0,0|2,0,0]=4 438 B9R0.53 CC(C)CC(=O)C=C(Cl)Cl 1458a_100000137448_100000210624 [1,0,1,0,0,0|2,0,0]=4 439 B9R0.53 CC(C)CC(=O)CC(C)C 1458a_100000210554_100000210624 [1,0,1,0,0,0|0,0,2]=4 440 B9R0.53 CC(C)CC(=O)CN(C)C 1458a_100000750896_100000210624 [1,0,1,0,0,0|1,0,1]=4 441 B9R0.53 CC(C)CC(=O)C[S+](C)C 1458a_200159257847_100000210624 [1,0,1,0,0,0|1,0,1]=4 442 B9R0.53 CC(C)CC(=O)NC(C)C 11a_100138425928_100000210554 [1,0,1,0,0,0|1,0,1]=4 443 B9R0.53 CC(C)CC(=O)NC(C)C 1626a_100138425928_100000210554 [1,0,1,0,0,0|1,0,1]=4 444 B9R0.53 CC(C)CC(=O)NC(C)C 240690a_100138425928_100000210554 [1,0,1,0,0,0|1,0,1]=4 445 B9R0.53 CC(C)CC(=O)NC(C)C 527a_100138425928_100000210554 [1,0,1,0,0,0|1,0,1]=4 446 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000070787_200011216223 [1,0,1,0,0,0|0,0,2]=4 447 B9R0.13 CCCCC(CC)C(=O)C 1458a_100000211130_200000210301 [1,0,1,0,0,0|0,0,2]=4 448 B9R0.13 CCCCC(CC)C(=O)[13CH3] 1458a_100000211130_200025704644 [1,0,1,0,0,0|0,0,2]=4 449 B9R0.13 CCCCN(CC)C(=O)C 11a_100000207695_100015343762 [1,0,1,0,0,0|1,0,1]=4 450 B9R0.13 CCCCN(CC)C(=O)C 1626a_100000207695_100015343762 [1,0,1,0,0,0|1,0,1]=4 451 B9R0.13 CCCCN(CC)C(=O)C 240690a_100000207695_100015343762 [1,0,1,0,0,0|1,0,1]=4 452 B9R0.13 CCCCN(CC)C(=O)C 527a_100000207695_100103153847 [1,0,1,0,0,0|1,0,1]=4 453 B9R0.33 CCCN(C(=O)C)C(C)C 11a_106256033942_100015343762 [1,0,1,0,0,0|1,0,1]=4 454 B9R0.33 CCCN(C(=O)C)C(C)C 1626a_106256033942_100015343762 [1,0,1,0,0,0|1,0,1]=4 455 B9R0.33 CCCN(C(=O)C)C(C)C 240690a_106256033942_100015343762 [1,0,1,0,0,0|1,0,1]=4 456 B9R0.33 CCCN(C(=O)C)C(C)C 527a_106256033942_100103153847 [1,0,1,0,0,0|1,0,1]=4 457 B9R0.4 C#CCCC(=O)C=C(C)C 1458a_100000211388_100000753159 [1,0,1,0,0,0|0,0,2]=4 458 B9R0.4 C/C=C/CC(=O)C=C(C)C 1458a_100000211388_100102629194 [1,0,1,0,0,0|0,0,2]=4 459 B9R0.4 C=C(C)CC(=O)CCCC 1458a_100000210183_100000748629 [1,0,1,0,0,0|0,0,2]=4 460 B9R0.4 C=CCCC(=O)C=C(C)C 1458a_100000211388_100000754431 [1,0,1,0,0,0|0,0,2]=4 461 B9R0.4 CC#CCC(=O)C=C(C)C 1458a_100000211388_100000748600 [1,0,1,0,0,0|0,0,2]=4 462 B9R0.4 CC(=CC(=O)CCC#N)C 1458a_100000211388_100011215226 [1,0,1,0,0,0|1,0,1]=4 463 B9R0.4 CC(=CC(=O)CCCF)C 1458a_100000211388_100011934791 [1,0,1,0,0,0|1,0,0]=3 464 B9R0.4 CC(=CC(=O)CCCF)Cl 1458a_200042562850_100011934791 [1,0,1,0,0,0|2,0,0]=4 465 B9R0.4 CC(=CC(=O)CCCF)I 1458a_100025716642_100011934791 [1,0,1,0,0,0|2,0,0]=4 466 B9R0.4 CC(=CC(=O)CCCO)C 1458a_100000211388_100011215043 [1,0,1,0,0,0|1,0,0]=3 467 B9R0.4 CC(=CC(=O)CCCO)Cl 1458a_200042562850_100011215043 [1,0,1,0,0,0|2,0,0]=4 468 B9R0.4 CC(=CC(=O)CCCO)I 1458a_100025716642_100011215043 [1,0,1,0,0,0|2,0,0]=4 469 B9R0.4 CC(=CC(=O)NCCF)C 11a_100000724931_100000211388 [1,0,1,0,0,0|2,0,0]=4 470 B9R0.4 CC(=CC(=O)NCCF)C 1626a_100000724931_100000211388 [1,0,1,0,0,0|2,0,0]=4 471 B9R0.4 CC(=CC(=O)NCCF)C 240690a_100000724931_100000211388 [1,0,1,0,0,0|2,0,0]=4 472 B9R0.4 CC(=CC(=O)NCCO)C 240690a_100000210304_100000211388 [1,0,1,0,0,0|2,0,0]=4 473 B9R0.4 CC=CCC(=O)C=C(C)C 1458a_100000211388_100000070051 [1,0,1,0,0,0|0,0,2]=4 474 B9R0.4 CCCCC(=O)C=C(C)C 1458a_100000211388_100000210211 [1,0,1,0,0,0|0,0,0]=2 475 B9R0.4 CCCCC(=O)C=C(C)Cl 1458a_200042562850_100000210211 [1,0,1,0,0,0|1,0,0]=3 476 B9R0.4 CCCCC(=O)C=C(C)I 1458a_100025716642_100000210211 [1,0,1,0,0,0|1,0,0]=3 477 B9R0.4 CCCCC(=O)C=C(Cl)Cl 1458a_100000137448_100000210211 [1,0,1,0,0,0|2,0,0]=4 478 B9R0.4 CCCCC(=O)CC(C)C 1458a_100000210183_100000210624 [1,0,1,0,0,0|0,0,2]=4 479 B9R0.4 CCCCC(=O)CC(C)C 1458a_100000210554_100000210211 [1,0,1,0,0,0|0,0,2]=4 480 B9R0.4 CCCCC(=O)CN(C)C 1458a_100000750896_100000210211 [1,0,1,0,0,0|1,0,1]=4 481 B9R0.4 CCCCC(=O)C[S+](C)C 1458a_200159257847_100000210211 [1,0,1,0,0,0|1,0,1]=4 482 B9R0.4 CCCCC(=O)NC(C)C 11a_100138425928_100000210183 [1,0,1,0,0,0|1,0,1]=4 483 B9R0.4 CCCCC(=O)NC(C)C 1626a_100138425928_100000210183 [1,0,1,0,0,0|1,0,1]=4 484 B9R0.4 CCCCC(=O)NC(C)C 240690a_100138425928_100000210183 [1,0,1,0,0,0|1,0,1]=4 485 B9R0.4 CCCCC(=O)NC(C)C 527a_100138425928_100000210183 [1,0,1,0,0,0|1,0,1]=4 486 B9R0.4 CCCNC(=O)C=C(C)C 11a_100020643023_100000211388 [1,0,1,0,0,0|1,0,0]=3 487 B9R0.4 CCCNC(=O)C=C(C)C 1626a_100020643023_100000211388 [1,0,1,0,0,0|1,0,0]=3 488 B9R0.4 CCCNC(=O)C=C(C)C 240690a_100020643023_100000211388 [1,0,1,0,0,0|1,0,0]=3 489 B9R0.4 CCCNC(=O)C=C(C)Cl 11a_100020643023_200042562850 [1,0,1,0,0,0|2,0,0]=4 490 B9R0.4 CCCNC(=O)C=C(C)Cl 1626a_100020643023_200042562850 [1,0,1,0,0,0|2,0,0]=4 491 B9R0.4 CCCNC(=O)C=C(C)Cl 240690a_100020643023_200042562850 [1,0,1,0,0,0|2,0,0]=4 492 B9R0.4 CCCNC(=O)C=C(C)I 11a_100020643023_100025716642 [1,0,1,0,0,0|2,0,0]=4 493 B9R0.4 CCCNC(=O)C=C(C)I 1626a_100020643023_100025716642 [1,0,1,0,0,0|2,0,0]=4 494 B9R0.4 CCNNC(=O)C=C(C)C 22a_100000756455_100000211388 [1,0,1,0,0,0|2,0,0]=4 495 B9R0.4 COCCC(=O)C=C(C)C 1458a_100000211388_100000233755 [1,0,1,0,0,0|1,0,0]=3 496 B9R0.4 COCCC(=O)C=C(C)Cl 1458a_200042562850_100000233755 [1,0,1,0,0,0|2,0,0]=4 497 B9R0.4 COCCC(=O)C=C(C)I 1458a_100025716642_100000233755 [1,0,1,0,0,0|2,0,0]=4 498 B9R0.4 CSCCC(=O)C=C(C)C 1458a_100000211388_100000751147 [1,0,1,0,0,0|1,0,0]=3 499 B9R0.4 CSCCC(=O)C=C(C)Cl 1458a_200042562850_100000751147 [1,0,1,0,0,0|2,0,0]=4 500 B9R0.4 CSCCC(=O)C=C(C)I 1458a_100025716642_100000751147 [1,0,1,0,0,0|2,0,0]=4 501 B9R0.34 C=CCC(=O)CC(C)CC 1458a_100000210193_100000748023 [1,0,1,0,0,0|0,0,2]=4 502 B9R0.34 C=CCC(=O)CC(C)CC 1458a_100000708755_100000210623 [1,0,1,0,0,0|0,0,2]=4 503 B9R0.34 C=CCC(=O)C[C@@H](C)CC 1458a_100000210193_100009816398 [1,0,1,0,0,0|0,0,2]=4 504 B9R0.34 CC#CC(=O)CC(C)CC 1458a_100000763181_100000748023 [1,0,1,0,0,0|0,0,2]=4 505 B9R0.34 CC#CC(=O)C[C@@H](C)CC 1458a_100000763181_100009816398 [1,0,1,0,0,0|0,0,2]=4 506 B9R0.34 CC=CC(=O)CC(=O)CC 1458a_100000210699_100000747405 [1,0,1,0,0,0|1,0,1]=4 507 B9R0.34 CC=CC(=O)CC(C)CC 1458a_100000210699_100000748023 [1,0,1,0,0,0|0,0,0]=2 508 B9R0.34 CC=CC(=O)CC(O)CC 1458a_100000210699_100011218378 [1,0,1,0,0,0|1,0,0]=3 509 B9R0.34 CC=CC(=O)C[C@@H](C)CC 1458a_100000210699_100009816398 [1,0,1,0,0,0|0,0,0]=2 510 B9R0.34 CC=CC(=O)C[C@@H](C)CO 1458a_100000210699_100000059175 [1,0,1,0,0,0|1,0,0]=3 511 B9R0.34 CC=CC(=O)NC(C)CC 11a_100000209981_100000210699 [1,0,1,0,0,0|1,0,0]=3 512 B9R0.34 CC=CC(=O)NC(C)CC 1626a_100000209981_100000210699 [1,0,1,0,0,0|1,0,0]=3 513 B9R0.34 CC=CC(=O)NC(C)CC 240690a_100000209981_100000210699 [1,0,1,0,0,0|1,0,0]=3 514 B9R0.34 CC=CC(=O)N[C@H](C)CF 11a_100102880703_100000210699 [1,0,1,0,0,0|2,0,0]=4 515 B9R0.34 CC=CC(=O)N[C@H](C)CF 1626a_100102880703_100000210699 [1,0,1,0,0,0|2,0,0]=4 516 B9R0.34 CC=CC(=O)N[C@H](C)CF 240690a_100102880703_100000210699 [1,0,1,0,0,0|2,0,0]=4 517 B9R0.34 CC=CC(=O)N[C@H](C)CO 240690a_100000737577_100000210699 [1,0,1,0,0,0|2,0,0]=4 518 B9R0.34 CCC(C)CC(=O)C=CBr 1458a_100016273825_100000748023 [1,0,1,0,0,0|1,0,0]=3 519 B9R0.34 CCC(C)CC(=O)C=CCl 1458a_200016279998_100000748023 [1,0,1,0,0,0|1,0,0]=3 520 B9R0.34 CCC(C)CC(=O)C=CI 1458a_100016256311_100000748023 [1,0,1,0,0,0|1,0,0]=3 521 B9R0.34 CCC(C)CC(=O)COC 1458a_100000210968_100000748023 [1,0,1,0,0,0|1,0,1]=4 522 B9R0.34 CCC(C)CC(=O)CSC 1458a_100000184570_100000748023 [1,0,1,0,0,0|1,0,1]=4 523 B9R0.34 CCC(C)CC(=O)NNC 22a_100016993582_100000708755 [1,0,1,0,0,0|2,0,0]=4 524 B9R0.34 CCC(C)NC(=O)C=CBr 1626a_100000209981_100016273825 [1,0,1,0,0,0|2,0,0]=4 525 B9R0.34 CCC(C)NC(=O)C=CBr 240690a_100000209981_100016273825 [1,0,1,0,0,0|2,0,0]=4 526 B9R0.34 CCC(C)NC(=O)C=CCl 11a_100000209981_200016279998 [1,0,1,0,0,0|2,0,0]=4 527 B9R0.34 CCC(C)NC(=O)C=CCl 1626a_100000209981_200016279998 [1,0,1,0,0,0|2,0,0]=4 528 B9R0.34 CCC(C)NC(=O)C=CCl 240690a_100000209981_200016279998 [1,0,1,0,0,0|2,0,0]=4 529 B9R0.34 CCC(C)NC(=O)C=CI 1626a_100000209981_100016256311 [1,0,1,0,0,0|2,0,0]=4 530 B9R0.34 CCC(O)CC(=O)C=CBr 1458a_100016273825_100011218378 [1,0,1,0,0,0|2,0,0]=4 531 B9R0.34 CCC(O)CC(=O)C=CCl 1458a_200016279998_100011218378 [1,0,1,0,0,0|2,0,0]=4 532 B9R0.34 CCC(O)CC(=O)C=CI 1458a_100016256311_100011218378 [1,0,1,0,0,0|2,0,0]=4 533 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000211992_100000748023 [1,0,1,0,0,0|0,0,2]=4 534 B9R0.34 CCCC(=O)CC(C)CC 1458a_100000708755_100000210303 [1,0,1,0,0,0|0,0,2]=4 535 B9R0.34 CCCC(=O)C[C@@H](C)CC 1458a_100000211992_100009816398 [1,0,1,0,0,0|0,0,2]=4 536 B9R0.34 CCNC(=O)CC(C)CC 11a_100015525214_100000708755 [1,0,1,0,0,0|1,0,1]=4 537 B9R0.34 CCNC(=O)CC(C)CC 240690a_100015525214_100000708755 [1,0,1,0,0,0|1,0,1]=4 538 B9R0.34 CCNC(=O)CC(C)CC 527a_100015525214_100000708755 [1,0,1,0,0,0|1,0,1]=4 539 B9R0.34 CC[C@H](C)CC(=O)C=CBr 1458a_100016273825_100009816398 [1,0,1,0,0,0|1,0,0]=3 540 B9R0.34 CC[C@H](C)CC(=O)C=CCl 1458a_200016279998_100009816398 [1,0,1,0,0,0|1,0,0]=3 541 B9R0.34 CC[C@H](C)CC(=O)C=CI 1458a_100016256311_100009816398 [1,0,1,0,0,0|1,0,0]=3 542 B9R0.34 CC[C@H](C)CC(=O)COC 1458a_100000210968_100009816398 [1,0,1,0,0,0|1,0,1]=4 543 B9R0.34 CC[C@H](C)CC(=O)CSC 1458a_100000184570_100009816398 [1,0,1,0,0,0|1,0,1]=4 544 B9R0.34 C[C@@H](CO)CC(=O)C=CBr 1458a_100016273825_100000059175 [1,0,1,0,0,0|2,0,0]=4 545 B9R0.34 C[C@@H](CO)CC(=O)C=CCl 1458a_200016279998_100000059175 [1,0,1,0,0,0|2,0,0]=4 546 B9R0.34 C[C@@H](CO)CC(=O)C=CI 1458a_100016256311_100000059175 [1,0,1,0,0,0|2,0,0]=4 547 B9R0.29 CCC(=O)C(=C(C)C)C#N 1458a_100000137542_100000210202 [1,0,1,0,0,0|1,0,1]=4 548 B9R0.29 CCC(=O)C(CC)N(C)C 1458a_100000689100_100000210202 [1,0,1,0,0,0|1,0,1]=4 549 B9R0.29 CCC(=O)N(CC)C(C)C 11a_100000223864_100000210414 [1,0,1,0,0,0|1,0,1]=4 550 B9R0.29 CCC(=O)N(CC)C(C)C 1626a_100000223864_100000210414 [1,0,1,0,0,0|1,0,1]=4 551 B9R0.29 CCC(=O)N(CC)C(C)C 240690a_100000223864_100000210414 [1,0,1,0,0,0|1,0,1]=4 552 B9R0.29 CCC(=O)N(CC)C(C)C 527a_100000223864_100000210414 [1,0,1,0,0,0|1,0,1]=4 553 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211163_100000210303 [1,0,1,0,0,0|0,0,2]=4 554 B9R0.37 CCCC(=O)C(CC)CC 1458a_100000211992_100000210505 [1,0,1,0,0,0|0,0,2]=4 555 B9R0.37 CCCC(=O)C(CC)OC 1458a_100000747056_100000210303 [1,0,1,0,0,0|1,0,1]=4 556 B9R0.37 CCCC(=O)N(CC)CC 11a_100000724800_100000211992 [1,0,1,0,0,0|1,0,1]=4 557 B9R0.37 CCCC(=O)N(CC)CC 1626a_100000724800_100000211992 [1,0,1,0,0,0|1,0,1]=4 558 B9R0.37 CCCC(=O)N(CC)CC 240690a_100000724800_100000211992 [1,0,1,0,0,0|1,0,1]=4 559 B9R0.37 CCCC(=O)N(CC)CC 527a_100000724800_100000211992 [1,0,1,0,0,0|1,0,1]=4 560 B9R1.6 CC(=O)C1=CCCCC1 1458a_100000765259_200000210301 [2,0,0,0,0,0|1,0,0]=3 561 B9R1.6 CC(=O)C1=CCCCO1 1458a_100000764163_200000210301 [2,0,0,0,0,0|2,0,0]=4 562 B9R1.6 CC(=O)C1=COCCC1 1458a_100000749935_200000210301 [2,0,0,0,0,0|2,0,0]=4 563 B9R1.6 [13CH3]C(=O)C1=CCCCC1 1458a_100000765259_200025704644 [2,0,0,0,0,0|1,0,0]=3 564 B9R1.6 [13CH3]C(=O)C1=CCCCO1 1458a_100000764163_200025704644 [2,0,0,0,0,0|2,0,0]=4 565 B9R1.6 [13CH3]C(=O)C1=COCCC1 1458a_100000749935_200025704644 [2,0,0,0,0,0|2,0,0]=4 566 B9R1.15 CNC1CCCCC1=O 34a_100102657272_100000754470 [2,0,0,0,0,0|1,0,1]=4 567 B9R1.15 CNC1CCCCC1=O 7a_106832991635_100000204591 [2,0,0,0,0,0|1,0,1]=4 568 B9R1.15 COC1CCCCC1=O 34a_100011214950_200000210301 [2,0,0,0,0,0|1,0,1]=4 569 B9R1.15 COC1CCCCC1=O 34a_100138415774_100000754470 [2,0,0,0,0,0|1,0,1]=4 570 B9R1.15 CSC1CCCCC1=O 62a_100000204591_200000210301 [2,0,0,0,0,0|1,0,1]=4 571 B9R1.15 CSC1CCCCC1=O 62a_200000210301_100000204591 [2,0,0,0,0,0|1,0,1]=4 572 B9R1.15 [13CH3]OC1CCCCC1=O 34a_100011214950_200025704644 [2,0,0,0,0,0|1,0,1]=4 573 B9R1.15 [13CH3]SC1CCCCC1=O 62a_100000204591_200025704644 [2,0,0,0,0,0|1,0,1]=4 574 B9R1.15 [13CH3]SC1CCCCC1=O 62a_200025704644_100000204591 [2,0,0,0,0,0|1,0,1]=4 575 B9R1.69 CN1CCN(C(=O)C1)C 2230a_100000187256_200000210301 [2,0,0,0,0,0|2,0,0]=4 576 B9R1.69 CN1CCN(C(=O)C1)C 269982a_100000187256_200000210301 [2,0,0,0,0,0|2,0,0]=4 577 B9R1.69 CN1CCN(CC1=O)[13CH3] 2230a_100000187256_200025704644 [2,0,0,0,0,0|2,0,0]=4 578 B9R1.69 CN1CCN(CC1=O)[13CH3] 269982a_100000187256_200025704644 [2,0,0,0,0,0|2,0,0]=4 579 B11R0.6 C=C(C)CN(C)CCC=C(C)C 2230a_100000225649_100011217483 [0,1,1,0,0,0|2,0,0]=4 580 B11R0.6 C=C(C)CN(C)CCC=C(C)C 269982a_100000225649_100011217483 [0,1,1,0,0,0|2,0,0]=4 581 B11R0.6 CC(=CCCC(=CC(=O)[13CH3])C)C 1458a_100016995320_200025704644 [0,1,1,0,0,0|0,0,2]=4 582 B11R0.6 CC(=CCCC(=O)CC(=O)N)C 1458a_100134613110_100011217483 [0,1,1,0,0,0|1,0,1]=4 583 B11R0.6 CC(=CCCC(C)CC(=O)[13CH3])C 1458a_100000043202_200025704644 [0,1,1,0,0,0|0,0,0]=2 584 B11R0.6 CC(=CCCC(C)CN(C)C)C 270004a_100102631434_100000033009 [0,1,1,0,0,0|2,0,0]=4 585 B11R0.6 CC(=CCCN(C)CC(=O)N)C 2230a_100000739694_100011217483 [0,1,1,0,0,0|1,0,0]=3 586 B11R0.6 CC(=CCCN(C)CC(=O)O)C 269956a_100000746989_100011217483 [0,1,1,0,0,0|1,0,0]=3 587 B11R0.6 CC(=O)C=C(C)CCC=C(C)C 1458a_100016995320_200000210301 [0,1,1,0,0,0|0,0,2]=4 588 B11R0.6 CC(=O)CC(C)CCC=C(C)C 1458a_100000043202_200000210301 [0,1,1,0,0,0|0,0,0]=2 589 B11R0.6 CC(=O)OC(C)SCC=C(C)C 62a_100000761012_100009818208 [0,1,1,0,0,0|2,0,0]=4 590 B11R0.6 CC(=O)OC(C)SCC=C(C)C 62a_100009818208_100000761012 [0,1,1,0,0,0|2,0,0]=4 591 B11R0.45 C=CC[C@H](CO)NCC=C(C)C 2230a_100020615467_100000761012 [0,1,1,0,0,0|2,0,0]=4 592 B11R0.59 C=CCC(C)C(=O)CC=C(C)C 1458a_100011216819_100000761012 [0,1,1,0,0,0|1,0,1]=4 593 B11R0.104 C=CCC(C)(C)OCC=C(C)C 7a_100011995686_100000761012 [0,1,1,0,0,0|2,0,0]=4 594 B11R0.145 C=C[C@@H](C)[C@@H](C)OCC=C(C)C 34a_100015455354_100000761012 [0,1,1,0,0,0|2,0,0]=4 595 B11R0.145 C=C[C@@H](C)[C@@H](C)OCC=C(C)C 7a_100015455354_100000761012 [0,1,1,0,0,0|2,0,0]=4 596 B11R0.147 C#CCOC(C)CCC=C(C)C 34a_100102619829_100000184674 [0,1,1,0,0,0|1,0,1]=4 597 B11R0.147 C#CCOC(C)CCC=C(C)C 7a_100102619829_100000038162 [0,1,1,0,0,0|1,0,1]=4 598 B11R0.147 C=CCCC(C)NCC=C(C)C 270004a_100000718196_100000762624 [0,1,1,0,0,0|2,0,0]=4 599 B11R0.147 C=CCCC(C)OCC=C(C)C 34a_100000765329_100000761012 [0,1,1,0,0,0|2,0,0]=4 600 B11R0.147 C=CCCC(C)OCC=C(C)C 7a_100000765329_100000761012 [0,1,1,0,0,0|2,0,0]=4 601 B11R0.147 C=CCCN(C)CCC=C(C)C 2230a_100020639649_100011217483 [0,1,1,0,0,0|2,0,0]=4 602 B11R0.147 C=CCCN(C)CCC=C(C)C 269982a_100020639649_100011217483 [0,1,1,0,0,0|2,0,0]=4 603 B11R0.147 C=CCNC(C)CCC=C(C)C 270004a_100020586998_100000765506 [0,1,1,0,0,0|1,0,0]=3 604 B11R0.147 C=CCOC(C)CCC=C(C)C 34a_100102619829_100015514636 [0,1,1,0,0,0|1,0,0]=3 605 B11R0.147 C=CCOC(C)CCC=C(C)C 7a_100102619829_100015514636 [0,1,1,0,0,0|1,0,0]=3 606 B11R0.147 CC(=CCCC(C)CCO[13CH3])C 34a_100000017536_200025704644 [0,1,1,0,0,0|0,0,2]=4 607 B11R0.147 CC(=CCCC(C)CCO[13CH3])C 7a_100000017536_200025704644 [0,1,1,0,0,0|0,0,2]=4 608 B11R0.147 CC(=CCCC(C)CCS[13CH3])C 62a_100009814015_200025704644 [0,1,1,0,0,0|0,1,1]=4 609 B11R0.147 CC(=CCCC(C)CCS[13CH3])C 62a_200025704644_100009814015 [0,1,1,0,0,0|0,1,1]=4 610 B11R0.147 CC(=CCCC(C)NCCO)C 270004a_100000210304_100000765506 [0,1,1,0,0,0|0,0,2]=4 611 B11R0.147 CC(=CCCC(C)OCC#N)C 7a_100102619829_100011215382 [0,1,1,0,0,0|1,0,1]=4 612 B11R0.147 CC(=CCCC(C)OCC=O)C 34a_100102619829_200009817547 [0,1,1,0,0,0|0,0,0]=2 613 B11R0.147 CC(=CCCC(C)OCC=O)C 7a_100102619829_200015260668 [0,1,1,0,0,0|0,0,0]=2 614 B11R0.147 CC(=CCCC(C)OCCF)C 34a_100102619829_100011217306 [0,1,1,0,0,0|1,0,1]=4 615 B11R0.147 CC(=CCCC(C)OCCF)C 7a_100102619829_100011217306 [0,1,1,0,0,0|1,0,1]=4 616 B11R0.147 CC(=CCCC(C)OCCO)C 34a_100102619829_100000211926 [0,1,1,0,0,0|0,0,2]=4 617 B11R0.147 CC(=CCCC(C)OCCO)C 7a_100102619829_100000211926 [0,1,1,0,0,0|0,0,2]=4 618 B11R0.147 CC(C)CCCC(C)NCC=O 2230a_100000210607_200015260668 [0,1,1,0,0,0|0,0,2]=4 619 B11R0.147 CC(C)CCCC(C)OCC=O 34a_200011218570_200009817547 [0,1,1,0,0,0|0,0,2]=4 620 B11R0.147 CC(C)CCCC(C)OCC=O 7a_200011218570_200015260668 [0,1,1,0,0,0|0,0,2]=4 621 B11R0.147 CCCNC(C)CCC=C(C)C 270004a_100020643023_100000765506 [0,1,1,0,0,0|1,0,1]=4 622 B11R0.147 CCCOC(C)CCC=C(C)C 34a_100102619829_100000210303 [0,1,1,0,0,0|1,0,1]=4 623 B11R0.147 CCCOC(C)CCC=C(C)C 7a_100102619829_100000210303 [0,1,1,0,0,0|1,0,1]=4 624 B11R0.147 CCNCC(C)CCC=C(C)C 270004a_100015525214_100000033009 [0,1,1,0,0,0|1,0,1]=4 625 B11R0.147 CNCCC(C)CCC=C(C)C 2230a_106832991635_100009814015 [0,1,1,0,0,0|1,0,1]=4 626 B11R0.147 CNCCC(C)CCC=C(C)C 269862a_106832991636_100000212096 [0,1,1,0,0,0|1,0,1]=4 627 B11R0.147 CNCCC(C)CCC=C(C)C 270004a_106832991635_100000212096 [0,1,1,0,0,0|1,0,1]=4 628 B11R0.147 CNCCC(C)CCC=C(C)C 34a_100102657272_100009814015 [0,1,1,0,0,0|1,0,1]=4 629 B11R0.147 CNCCC(C)CCC=C(C)C 7a_106832991635_100009814015 [0,1,1,0,0,0|1,0,1]=4 630 B11R0.147 COCCC(C)CCC=C(C)C 34a_100000017536_200000210301 [0,1,1,0,0,0|0,0,2]=4 631 B11R0.147 COCCC(C)CCC=C(C)C 34a_100138415774_100009814015 [0,1,1,0,0,0|0,0,2]=4 632 B11R0.147 COCCC(C)CCC=C(C)C 7a_100000017536_200000210301 [0,1,1,0,0,0|0,0,2]=4 633 B11R0.147 CSCCC(C)CCC=C(C)C 62a_100009814015_200000210301 [0,1,1,0,0,0|0,1,1]=4 634 B11R0.147 CSCCC(C)CCC=C(C)C 62a_200000210301_100009814015 [0,1,1,0,0,0|0,1,1]=4 635 B11R0.147 CSCOC(C)CCC=C(C)C 34a_100102619829_100011218213 [0,1,1,0,0,0|2,0,0]=4 636 B11R0.51 CC(C)CC(=O)N(C)C(C)(C)C 11a_100011215553_100000210554 [0,1,1,0,0,0|1,0,1]=4 637 B11R0.51 CC(C)CC(=O)N(C)C(C)(C)C 1626a_100011215553_100000210554 [0,1,1,0,0,0|1,0,1]=4 638 B11R0.51 CC(C)CC(=O)N(C)C(C)(C)C 240690a_100011215553_100000210554 [0,1,1,0,0,0|1,0,1]=4 639 B11R0.52 CC(C)CC(=O)C(C)(C)N(C)C 1458a_100000688961_100000210624 [0,1,1,0,0,0|1,0,1]=4 640 B11R0.63 CC(C)CC(=O)N(C)C(C)CO 240690a_100000693034_100000210554 [0,1,1,0,0,0|1,0,1]=4 641 B11R0.63 CC(C)CC(=O)N(C)C(C)CO 527a_100000693034_100000210554 [0,1,1,0,0,0|1,0,1]=4 642 B11R0.63 CCC(=O)C(C)C(=O)CC(C)C 1458a_100000210554_100000742827 [0,1,1,0,0,0|1,0,1]=4 643 B11R0.63 CCC(C)N(C)C(=O)CC(C)C 11a_100000741768_100000210554 [0,1,1,0,0,0|1,0,1]=4 644 B11R0.63 CCC(C)N(C)C(=O)CC(C)C 1626a_100000741768_100000210554 [0,1,1,0,0,0|1,0,1]=4 645 B11R0.63 CCC(C)N(C)C(=O)CC(C)C 240690a_100000741768_100000210554 [0,1,1,0,0,0|1,0,1]=4 646 B11R0.63 CCC(C)N(C)C(=O)CC(C)C 527a_100000741768_100000210554 [0,1,1,0,0,0|1,0,1]=4 647 B11R0.63 CCN(C)C(C)C(=O)CC(C)C 1458a_100011281945_100000210624 [0,1,1,0,0,0|1,0,1]=4 648 B11R0.63 CNC(=O)C(C)C(=O)CC(C)C 1458a_100000210554_100000209862 [0,1,1,0,0,0|1,0,1]=4 649 B11R0.63 COC(=O)C(C)C(=O)CC(C)C 1458a_100000210554_100000211248 [0,1,1,0,0,0|1,0,1]=4 650 B11R0.63 COC(=O)C(C)C(=O)CC(C)C 1458a_100012027023_100000210624 [0,1,1,0,0,0|1,0,1]=4 651 B11R0.92 CC(C)C(C)C(=O)C[C@@H](C)CO 1458a_100000755409_100000059175 [0,1,1,0,0,0|0,0,2]=4 652 B11R0.92 CCC(C)CC(=O)C(=O)N(C)C 1458a_100011218876_100000748023 [0,1,1,0,0,0|2,0,0]=4 653 B11R0.92 CCC(C)CC(=O)C(C)C(=O)C 1458a_100000708755_100000179758 [0,1,1,0,0,0|1,0,1]=4 654 B11R0.92 CCC(C)CC(=O)C(C)C(C)C 1458a_100000755409_100000748023 [0,1,1,0,0,0|0,0,2]=4 655 B11R0.92 CCC(C)CC(=O)N(C)C(C)C 11a_200000211004_100000708755 [0,1,1,0,0,0|1,0,1]=4 656 B11R0.92 CCC(C)CC(=O)N(C)C(C)C 1626a_200000211004_100000708755 [0,1,1,0,0,0|1,0,1]=4 657 B11R0.92 CCC(C)CC(=O)N(C)C(C)C 240690a_200000211004_100000708755 [0,1,1,0,0,0|1,0,1]=4 658 B11R0.92 CCC(C)CC(=O)N(C)C(C)C 527a_200000211004_100000708755 [0,1,1,0,0,0|1,0,1]=4 659 B11R0.92 CCC(C)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100000748023 [0,1,1,0,0,0|1,0,1]=4 660 B11R0.92 CC[C@H](C)CC(=O)C(=O)N(C)C 1458a_100011218876_100009816398 [0,1,1,0,0,0|2,0,0]=4 661 B11R0.92 CC[C@H](C)CC(=O)C(C)C(C)C 1458a_100000755409_100009816398 [0,1,1,0,0,0|0,0,2]=4 662 B11R0.92 CC[C@H](C)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100009816398 [0,1,1,0,0,0|1,0,1]=4 663 B11R0.92 C[C@@H](CO)CC(=O)C(=O)N(C)C 1458a_100011218876_100000059175 [0,1,1,0,0,0|2,0,0]=4 664 B11R0.92 C[C@@H](CO)CC(=O)[C@H](C)N(C)C 1458a_100009822176_100000059175 [0,1,1,0,0,0|1,0,1]=4 665 B11R0.206 CC(=O)C(C)C(=O)C(C)C(C)C 1458a_100000755409_100000179758 [0,1,1,0,0,0|1,0,1]=4 666 B11R0.206 CC(=O)C(C)C(=O)[C@H](O)C(C)C 1458a_100000691806_100000179758 [0,1,1,0,0,0|1,0,1]=4 667 B11R0.206 CC(C)C(C)C(=O)N(C)C(C)C 11a_200000211004_100000755409 [0,1,1,0,0,0|1,0,1]=4 668 B11R0.206 CC(C)C(C)C(=O)N(C)C(C)C 1626a_200000211004_100000755409 [0,1,1,0,0,0|1,0,1]=4 669 B11R0.206 CC(C)C(C)C(=O)N(C)C(C)C 240690a_200000211004_100000755409 [0,1,1,0,0,0|1,0,1]=4 670 B11R0.206 CC(C)C(C)C(=O)N(C)C(C)C 527a_200000211004_100000755409 [0,1,1,0,0,0|1,0,1]=4 671 B11R0.206 CC(C)[C@@H](O)C(=O)N(C)C(C)C 240690a_200000211004_100000691806 [0,1,1,0,0,0|1,0,1]=4 672 B11R0.282 CC(=C(C#N)C(=O)CC(C)C)C 1458a_100000137542_100000210624 [0,1,1,0,0,0|0,0,1]=3 673 B11R0.282 CC(=C(C#N)C(=O)CC(C)O)C 1458a_100000137542_100011218427 [0,1,1,0,0,0|1,0,1]=4 674 B11R0.282 CCC(C(=O)CC(C)C)N(C)C 1458a_100000689100_100000210624 [0,1,1,0,0,0|1,0,1]=4 675 B11R0.282 CCN(C(=O)CC(C)C)C(C)C 11a_100000223864_100000210554 [0,1,1,0,0,0|1,0,1]=4 676 B11R0.282 CCN(C(=O)CC(C)C)C(C)C 1626a_100000223864_100000210554 [0,1,1,0,0,0|1,0,1]=4 677 B11R0.282 CCN(C(=O)CC(C)C)C(C)C 240690a_100000223864_100000210554 [0,1,1,0,0,0|1,0,1]=4 678 B11R0.282 CCN(C(=O)CC(C)C)C(C)C 527a_100000223864_100000210554 [0,1,1,0,0,0|1,0,1]=4 679 B11R0.308 CC(=O)C(C)C(=O)CC(C)(C)C 1458a_100000211214_100000179758 [0,1,1,0,0,0|1,0,1]=4 680 B11R0.308 CC(=O)C(C)C(=O)CC(C)(C)O 1458a_100000693243_100000179758 [0,1,1,0,0,0|1,0,1]=4 681 B11R0.308 CC(C)N(C)C(=O)CC(C)(C)C 11a_200000211004_100000211214 [0,1,1,0,0,0|1,0,1]=4 682 B11R0.308 CC(C)N(C)C(=O)CC(C)(C)C 1626a_200000211004_100000211214 [0,1,1,0,0,0|1,0,1]=4 683 B11R0.308 CC(C)N(C)C(=O)CC(C)(C)C 240690a_200000211004_100000211214 [0,1,1,0,0,0|1,0,1]=4 684 B11R0.308 CC(C)N(C)C(=O)CC(C)(C)C 527a_200000211004_100000211214 [0,1,1,0,0,0|1,0,1]=4 685 B11R0.308 CC(C)N(C)C(=O)CC(C)(C)O 527a_200000211004_100000693243 [0,1,1,0,0,0|1,0,1]=4 686 B11R0.153 CC(=O)N(CCCCO)C(C)C 240690a_100011521146_100015343762 [0,1,1,0,0,0|1,0,1]=4 687 B11R0.153 CCCCCN(C(=O)C)C(C)C 11a_100000223497_100015343762 [0,1,1,0,0,0|1,0,1]=4 688 B11R0.153 CCCCCN(C(=O)C)C(C)C 1626a_100000223497_100015343762 [0,1,1,0,0,0|1,0,1]=4 689 B11R0.153 CCCCCN(C(=O)C)C(C)C 240690a_100000223497_100015343762 [0,1,1,0,0,0|1,0,1]=4 690 B11R0.153 CCCCCN(C(=O)C)C(C)C 527a_100000223497_100103153847 [0,1,1,0,0,0|1,0,1]=4 691 B11R0.153 CCCCSC(C(=O)C)C(=O)C 62a_100000210211_100000210371 [0,1,1,0,0,0|1,0,1]=4 692 B11R0.153 CCCCSC(C(=O)C)C(=O)C 62a_100000210371_100000210210 [0,1,1,0,0,0|1,0,1]=4 693 B11R0.167 CCCCC(C(=O)C)C(=O)OC 1458a_100000070787_100000750740 [0,1,1,0,0,0|1,0,1]=4 694 B11R0.167 CCCCC(C(=O)OC)N(C)C 2230a_100102631434_100000750740 [0,1,1,0,0,0|1,0,1]=4 695 B11R0.167 CCCCC(C(=O)OC)N(C)C 269982a_100102631434_100000750740 [0,1,1,0,0,0|1,0,1]=4 696 B11R0.167 CCCCN(C(=O)C)C(C)CC 11a_100000207357_100015343762 [0,1,1,0,0,0|1,0,1]=4 697 B11R0.167 CCCCN(C(=O)C)C(C)CC 1626a_100000207357_100015343762 [0,1,1,0,0,0|1,0,1]=4 698 B11R0.167 CCCCN(C(=O)C)C(C)CC 240690a_100000207357_100015343762 [0,1,1,0,0,0|1,0,1]=4 699 B11R0.167 CCCCN(C(=O)C)C(C)CC 527a_100000207357_100103153847 [0,1,1,0,0,0|1,0,1]=4 700 B11R0.167 CCCCN(C(=O)CC)C(C)C 11a_100000207398_100000210414 [0,1,1,0,0,0|1,0,1]=4 701 B11R0.167 CCCCN(C(=O)CC)C(C)C 1626a_100000207398_100000210414 [0,1,1,0,0,0|1,0,1]=4 702 B11R0.167 CCCCN(C(=O)CC)C(C)C 240690a_100000207398_100000210414 [0,1,1,0,0,0|1,0,1]=4 703 B11R0.167 CCCCN(C(=O)CC)C(C)C 527a_100000207398_100000210414 [0,1,1,0,0,0|1,0,1]=4 704 B11R0.167 CCCCN(C(=O)CO)C(C)C 240690a_100000207398_100000210174 [0,1,1,0,0,0|1,0,1]=4 705 B11R0.167 CCCCN(C(=O)CO)C(C)C 527a_100000207398_100000210174 [0,1,1,0,0,0|1,0,1]=4 706 B11R0.167 CCCCN(C(=O)NC)C(C)C 2708a_100102657272_100000207398 [0,1,1,0,0,0|1,0,1]=4 707 B11R0.167 CCCCN(C(=O)NC)C(C)C 273464a_100102657272_100000207398 [0,1,1,0,0,0|1,0,1]=4 708 B11R0.19 CC(=CC(=O)NC(CO)CO)C 240690a_100000759517_100000211388 [0,1,1,0,0,0|2,0,0]=4 709 B11R0.19 CCC(CC)CC(=O)C=C(C)C 1458a_100000211388_100011215472 [0,1,1,0,0,0|0,0,0]=2 710 B11R0.19 CCC(CC)CC(=O)C=C(C)Cl 1458a_200042562850_100011215472 [0,1,1,0,0,0|1,0,0]=3 711 B11R0.19 CCC(CC)CC(=O)C=C(C)I 1458a_100025716642_100011215472 [0,1,1,0,0,0|1,0,0]=3 712 B11R0.19 CCC(CC)CC(=O)C=C(Cl)Cl 1458a_100000137448_100011215472 [0,1,1,0,0,0|2,0,0]=4 713 B11R0.19 CCC(CC)CC(=O)CC(C)C 1458a_100000210554_100011215472 [0,1,1,0,0,0|0,0,2]=4 714 B11R0.19 CCC(CC)CC(=O)CN(C)C 1458a_100000750896_100011215472 [0,1,1,0,0,0|1,0,1]=4 715 B11R0.19 CCC(CC)CC(=O)C[S+](C)C 1458a_200159257847_100011215472 [0,1,1,0,0,0|1,0,1]=4 716 B11R0.19 CCC(CC)NC(=O)C=C(C)C 11a_100000199018_100000211388 [0,1,1,0,0,0|1,0,0]=3 717 B11R0.19 CCC(CC)NC(=O)C=C(C)C 1626a_100000199018_100000211388 [0,1,1,0,0,0|1,0,0]=3 718 B11R0.19 CCC(CC)NC(=O)C=C(C)C 240690a_100000199018_100000211388 [0,1,1,0,0,0|1,0,0]=3 719 B11R0.19 CCC(CC)NC(=O)C=C(C)Cl 11a_100000199018_200042562850 [0,1,1,0,0,0|2,0,0]=4 720 B11R0.19 CCC(CC)NC(=O)C=C(C)Cl 1626a_100000199018_200042562850 [0,1,1,0,0,0|2,0,0]=4 721 B11R0.19 CCC(CC)NC(=O)C=C(C)Cl 240690a_100000199018_200042562850 [0,1,1,0,0,0|2,0,0]=4 722 B11R0.19 CCC(CC)NC(=O)C=C(C)I 11a_100000199018_100025716642 [0,1,1,0,0,0|2,0,0]=4 723 B11R0.19 CCC(CC)NC(=O)C=C(C)I 1626a_100000199018_100025716642 [0,1,1,0,0,0|2,0,0]=4 724 B11R0.19 CC[C@@H](CO)NC(=O)C=C(C)C 240690a_100000709445_100000211388 [0,1,1,0,0,0|1,0,0]=3 725 B11R0.19 CC[C@@H](CO)NC(=O)C=C(C)Cl 240690a_100000709445_200042562850 [0,1,1,0,0,0|2,0,0]=4 726 B11R0.19 COC(CC(=O)C=C(C)C)OC 1458a_100000211388_100000751394 [0,1,1,0,0,0|1,0,0]=3 727 B11R0.19 COC(CC(=O)C=C(C)Cl)OC 1458a_200042562850_100000751394 [0,1,1,0,0,0|2,0,0]=4 728 B11R0.19 COC(CC(=O)C=C(C)I)OC 1458a_100025716642_100000751394 [0,1,1,0,0,0|2,0,0]=4 729 B11R0.33 CC(=CC(=O)CC(=O)C(C)C)C 1458a_100000211388_100000753385 [0,1,1,0,0,0|1,0,1]=4 730 B11R0.33 CC(=CC(=O)NC(C)C(C)C)C 11a_100000211541_100000211388 [0,1,1,0,0,0|1,0,0]=3 731 B11R0.33 CC(=CC(=O)NC(C)C(C)C)C 1626a_100000211541_100000211388 [0,1,1,0,0,0|1,0,0]=3 732 B11R0.33 CC(=CC(=O)NC(C)C(C)C)C 240690a_100000211541_100000211388 [0,1,1,0,0,0|1,0,0]=3 733 B11R0.33 CC(=CC(=O)NC(C)C(C)C)Cl 11a_100000211541_200042562850 [0,1,1,0,0,0|2,0,0]=4 734 B11R0.33 CC(=CC(=O)NC(C)C(C)C)Cl 1626a_100000211541_200042562850 [0,1,1,0,0,0|2,0,0]=4 735 B11R0.33 CC(=CC(=O)NC(C)C(C)C)Cl 240690a_100000211541_200042562850 [0,1,1,0,0,0|2,0,0]=4 736 B11R0.33 CC(=CC(=O)NC(C)C(C)C)I 11a_100000211541_100025716642 [0,1,1,0,0,0|2,0,0]=4 737 B11R0.33 CC(=CC(=O)NC(C)C(C)C)I 1626a_100000211541_100025716642 [0,1,1,0,0,0|2,0,0]=4 738 B11R0.110 CCC(=CC(=O)CC(C)CC)C 1458a_100020758463_100000748023 [0,1,1,0,0,0|0,0,0]=2 739 B11R0.110 CCC(=CC(=O)CC(O)CC)C 1458a_100020758463_100011218378 [0,1,1,0,0,0|1,0,0]=3 740 B11R0.110 CCC(=CC(=O)C[C@@H](C)CC)C 1458a_100020758463_100009816398 [0,1,1,0,0,0|0,0,0]=2 741 B11R0.110 CCC(=CC(=O)C[C@@H](C)CO)C 1458a_100020758463_100000059175 [0,1,1,0,0,0|1,0,0]=3 742 B11R0.110 CCC(=CC(=O)NC(C)CC)C 11a_100000209981_100020758463 [0,1,1,0,0,0|1,0,0]=3 743 B11R0.110 CCC(=CC(=O)NC(C)CC)C 1626a_100000209981_100020758463 [0,1,1,0,0,0|1,0,0]=3 744 B11R0.110 CCC(=CC(=O)NC(C)CC)C 240690a_100000209981_100020758463 [0,1,1,0,0,0|1,0,0]=3 745 B11R0.110 CCC(=CC(=O)N[C@H](C)CF)C 11a_100102880703_100020758463 [0,1,1,0,0,0|2,0,0]=4 746 B11R0.110 CCC(=CC(=O)N[C@H](C)CF)C 1626a_100102880703_100020758463 [0,1,1,0,0,0|2,0,0]=4 747 B11R0.110 CCC(=CC(=O)N[C@H](C)CF)C 240690a_100102880703_100020758463 [0,1,1,0,0,0|2,0,0]=4 748 B11R0.110 CCC(=CC(=O)N[C@H](C)CO)C 240690a_100000737577_100020758463 [0,1,1,0,0,0|2,0,0]=4 749 B11R0.110 CCC(=O)CC(=O)C=C(C)CC 1458a_100020758463_100000747405 [0,1,1,0,0,0|1,0,1]=4 750 B11R0.110 CCC(=O)CC(=O)CC(C)CC 1458a_100000708755_100000747405 [0,1,1,0,0,0|1,0,1]=4 751 B11R0.110 CCC(C)CC(=O)CC(=O)NC 1458a_100000708755_100000183359 [0,1,1,0,0,0|1,0,1]=4 752 B11R0.110 CCC(C)CC(=O)CC(=O)OC 1458a_100000211351_100000748023 [0,1,1,0,0,0|1,0,1]=4 753 B11R0.110 CCC(C)CC(=O)CC(=O)OC 1458a_100000708755_100000747449 [0,1,1,0,0,0|1,0,1]=4 754 B11R0.110 CCC(C)CC(=O)CC(C)CC 1458a_100000708755_100000748023 [0,1,1,0,0,0|0,0,2]=4 755 B11R0.110 CCC(C)CC(=O)CN(C)CC 1458a_100116209913_100000748023 [0,1,1,0,0,0|1,0,1]=4 756 B11R0.110 CCC(C)CC(=O)C[C@@H](C)CC 1458a_100000708755_100009816398 [0,1,1,0,0,0|0,0,2]=4 757 B11R0.110 CCC(C)CC(=O)C[C@@H](C)CO 1458a_100000708755_100000059175 [0,1,1,0,0,0|0,0,2]=4 758 B11R0.110 CCC(C)CC(=O)NC(C)CC 11a_100000209981_100000708755 [0,1,1,0,0,0|1,0,1]=4 759 B11R0.110 CCC(C)CC(=O)NC(C)CC 1626a_100000209981_100000708755 [0,1,1,0,0,0|1,0,1]=4 760 B11R0.110 CCC(C)CC(=O)NC(C)CC 240690a_100000209981_100000708755 [0,1,1,0,0,0|1,0,1]=4 761 B11R0.110 CCC(C)CC(=O)NC(C)CC 527a_100000209981_100000708755 [0,1,1,0,0,0|1,0,1]=4 762 B11R0.110 CCC(C)CC(=O)N[C@H](C)CF 11a_100102880703_100000708755 [0,1,1,0,0,0|1,0,1]=4 763 B11R0.110 CCC(C)CC(=O)N[C@H](C)CF 1626a_100102880703_100000708755 [0,1,1,0,0,0|1,0,1]=4 764 B11R0.110 CCC(C)CC(=O)N[C@H](C)CF 240690a_100102880703_100000708755 [0,1,1,0,0,0|1,0,1]=4 765 B11R0.110 CCC(C)CC(=O)N[C@H](C)CF 527a_100102880703_100000708755 [0,1,1,0,0,0|1,0,1]=4 766 B11R0.110 CCC(C)CC(=O)N[C@H](C)CO 240690a_100000737577_100000708755 [0,1,1,0,0,0|1,0,1]=4 767 B11R0.110 CCC(C)CC(=O)N[C@H](C)CO 527a_100000737577_100000708755 [0,1,1,0,0,0|1,0,1]=4 768 B11R0.110 CC[C@H](C)CC(=O)CC(=O)OC 1458a_100000211351_100009816398 [0,1,1,0,0,0|1,0,1]=4 769 B11R0.110 CC[C@H](C)CC(=O)CN(C)CC 1458a_100116209913_100009816398 [0,1,1,0,0,0|1,0,1]=4 770 B11R0.119 CCC(C)CC(=O)CC(C)(C)C 1458a_100000211214_100000748023 [0,1,1,0,0,0|0,0,2]=4 771 B11R0.119 CCC(C)CC(=O)CC(C)(C)O 1458a_100000693243_100000748023 [0,1,1,0,0,0|0,0,2]=4 772 B11R0.119 CCC(C)CC(=O)C[N+](C)(C)C 1458a_100000033712_100000748023 [0,1,1,0,0,0|1,0,1]=4 773 B11R0.119 CCC(C)CC(=O)C[Si](C)(C)C 1458a_100000708755_100000233785 [0,1,1,0,0,0|0,1,1]=4 774 B11R0.119 CCC(C)CC(=O)C[Si](C)(C)C 1458a_100011218504_100000748023 [0,1,1,0,0,0|0,1,1]=4 775 B11R0.119 CCC(C)CC(=O)NC(C)(C)C 11a_100000715429_100000708755 [0,1,1,0,0,0|1,0,1]=4 776 B11R0.119 CCC(C)CC(=O)NC(C)(C)C 1626a_100000715429_100000708755 [0,1,1,0,0,0|1,0,1]=4 777 B11R0.119 CCC(C)CC(=O)NC(C)(C)C 240690a_100000715429_100000708755 [0,1,1,0,0,0|1,0,1]=4 778 B11R0.119 CCC(C)CC(=O)NC(C)(C)C 527a_100000715429_100000708755 [0,1,1,0,0,0|1,0,1]=4 779 B11R0.119 CC[C@H](C)CC(=O)CC(C)(C)C 1458a_100000211214_100009816398 [0,1,1,0,0,0|0,0,2]=4 780 B11R0.119 CC[C@H](C)CC(=O)CC(C)(C)O 1458a_100000693243_100009816398 [0,1,1,0,0,0|0,0,2]=4 781 B11R0.119 CC[C@H](C)CC(=O)C[N+](C)(C)C 1458a_100000033712_100009816398 [0,1,1,0,0,0|1,0,1]=4 782 B11R0.119 CC[C@H](C)CC(=O)C[Si](C)(C)C 1458a_100011218504_100009816398 [0,1,1,0,0,0|0,1,1]=4 783 B11R0.300 C=C(C)CC(=O)CC(C)(C)CC 1458a_200000763500_100000748629 [0,1,1,0,0,0|0,0,2]=4 784 B11R0.300 C=C(C)CC(=O)CC(C)(O)CC 1458a_200011219800_100000748629 [0,1,1,0,0,0|0,0,2]=4 785 B11R0.300 CC(=CC(=O)NC(C)(C)CO)C 240690a_100000210608_100000211388 [0,1,1,0,0,0|2,0,0]=4 786 B11R0.300 CCC(C)(C)CC(=O)CC(C)C 1458a_200000763500_100000210624 [0,1,1,0,0,0|0,0,2]=4 787 B11R0.300 CCC(C)(C)CC(=O)NC(C)C 11a_100138425928_200000763500 [0,1,1,0,0,0|1,0,1]=4 788 B11R0.300 CCC(C)(C)CC(=O)NC(C)C 1626a_100138425928_200000763500 [0,1,1,0,0,0|1,0,1]=4 789 B11R0.300 CCC(C)(C)CC(=O)NC(C)C 240690a_100138425928_200000763500 [0,1,1,0,0,0|1,0,1]=4 790 B11R0.300 CCC(C)(C)CC(=O)NC(C)C 527a_100138425928_200000763500 [0,1,1,0,0,0|1,0,1]=4 791 B11R0.300 CCC(C)(C)NC(=O)C=C(C)C 11a_100000211385_100000211388 [0,1,1,0,0,0|1,0,0]=3 792 B11R0.300 CCC(C)(C)NC(=O)C=C(C)C 1626a_100000211385_100000211388 [0,1,1,0,0,0|1,0,0]=3 793 B11R0.300 CCC(C)(C)NC(=O)C=C(C)C 240690a_100000211385_100000211388 [0,1,1,0,0,0|1,0,0]=3 794 B11R0.300 CCC(C)(C)NC(=O)C=C(C)Cl 11a_100000211385_200042562850 [0,1,1,0,0,0|2,0,0]=4 795 B11R0.300 CCC(C)(C)NC(=O)C=C(C)Cl 1626a_100000211385_200042562850 [0,1,1,0,0,0|2,0,0]=4 796 B11R0.300 CCC(C)(C)NC(=O)C=C(C)Cl 240690a_100000211385_200042562850 [0,1,1,0,0,0|2,0,0]=4 797 B11R0.300 CCC(C)(C)NC(=O)C=C(C)I 11a_100000211385_100025716642 [0,1,1,0,0,0|2,0,0]=4 798 B11R0.300 CCC(C)(C)NC(=O)C=C(C)I 1626a_100000211385_100025716642 [0,1,1,0,0,0|2,0,0]=4 799 B11R0.300 CCC(C)(O)CC(=O)CC(C)C 1458a_200011219800_100000210624 [0,1,1,0,0,0|0,0,2]=4 800 B11R0.300 CCC(C)(O)CC(=O)NC(C)C 240690a_100138425928_200011219800 [0,1,1,0,0,0|1,0,1]=4 801 B11R0.300 CCC(C)(O)CC(=O)NC(C)C 527a_100138425928_200011219800 [0,1,1,0,0,0|1,0,1]=4 802 B11R0.7 CCCC(=O)N(CC)C(C)(C)C 11a_100011200764_100000211992 [0,1,1,0,0,0|1,0,1]=4 803 B11R0.7 CCCC(=O)N(CC)C(C)(C)C 1626a_100011200764_100000211992 [0,1,1,0,0,0|1,0,1]=4 804 B11R0.7 CCCC(=O)N(CC)C(C)(C)C 240690a_100011200764_100000211992 [0,1,1,0,0,0|1,0,1]=4 805 B11R0.53 CCCC(=O)C(CC)C(=O)OC 1458a_100000211992_100000235869 [0,1,1,0,0,0|1,0,1]=4 806 B11R0.53 CCCC(=O)C(CC)N(C)CC 1458a_100011345578_100000210303 [0,1,1,0,0,0|1,0,1]=4 807 B11R0.53 CCCC(=O)N(CC)C(C)CC 11a_100000732650_100000211992 [0,1,1,0,0,0|1,0,1]=4 808 B11R0.53 CCCC(=O)N(CC)C(C)CC 1626a_100000732650_100000211992 [0,1,1,0,0,0|1,0,1]=4 809 B11R0.53 CCCC(=O)N(CC)C(C)CC 240690a_100000732650_100000211992 [0,1,1,0,0,0|1,0,1]=4 810 B11R0.53 CCCC(=O)N(CC)C(C)CC 527a_100000732650_100000211992 [0,1,1,0,0,0|1,0,1]=4 811 B11R0.53 CCCC(=O)N(CC)C(C)CO 240690a_100000731049_100000211992 [0,1,1,0,0,0|1,0,1]=4 812 B11R0.53 CCCC(=O)N(CC)C(C)CO 527a_100000731049_100000211992 [0,1,1,0,0,0|1,0,1]=4 813 B11R0.57 CCCC(=O)C(SCC)C(C)C 1458a_100000750736_100000210303 [0,1,1,0,0,0|0,0,2]=4 814 B11R0.57 CCCC(=O)N(CCC)C(C)C 11a_106256033942_100000211992 [0,1,1,0,0,0|1,0,1]=4 815 B11R0.57 CCCC(=O)N(CCC)C(C)C 1626a_106256033942_100000211992 [0,1,1,0,0,0|1,0,1]=4 816 B11R0.57 CCCC(=O)N(CCC)C(C)C 240690a_106256033942_100000211992 [0,1,1,0,0,0|1,0,1]=4 817 B11R0.57 CCCC(=O)N(CCC)C(C)C 527a_106256033942_100000211992 [0,1,1,0,0,0|1,0,1]=4 818 B11R0.57 CCCC(=O)N(CCO)C(C)C 240690a_100000224655_100000211992 [0,1,1,0,0,0|1,0,1]=4 819 B11R0.238 CC(=C(C#N)C(=O)CCCF)C 1458a_100000137542_100011934791 [0,1,1,0,0,0|1,0,1]=4 820 B11R0.238 CC(=C(C#N)C(=O)CCCO)C 1458a_100000137542_100011215043 [0,1,1,0,0,0|1,0,1]=4 821 B11R0.238 CCC(C(=O)CCCF)N(C)C 1458a_100000689100_100011934791 [0,1,1,0,0,0|1,0,1]=4 822 B11R0.238 CCC(C(=O)CCCO)N(C)C 1458a_100000689100_100011215043 [0,1,1,0,0,0|1,0,1]=4 823 B11R0.238 CCC(C(=O)CCOC)N(C)C 1458a_100000689100_100000233755 [0,1,1,0,0,0|1,0,1]=4 824 B11R0.238 CCC(C(=O)CCSC)N(C)C 1458a_100000689100_100000751147 [0,1,1,0,0,0|1,0,1]=4 825 B11R0.238 CCCCC(=O)C(=C(C)C)C#N 1458a_100000137542_100000210211 [0,1,1,0,0,0|1,0,1]=4 826 B11R0.238 CCCCC(=O)C(CC)N(C)C 1458a_100000689100_100000210211 [0,1,1,0,0,0|1,0,1]=4 827 B11R0.238 CCCCC(=O)N(CC)C(C)C 11a_100000223864_100000210183 [0,1,1,0,0,0|1,0,1]=4 828 B11R0.238 CCCCC(=O)N(CC)C(C)C 1626a_100000223864_100000210183 [0,1,1,0,0,0|1,0,1]=4 829 B11R0.238 CCCCC(=O)N(CC)C(C)C 240690a_100000223864_100000210183 [0,1,1,0,0,0|1,0,1]=4 830 B11R0.238 CCCCC(=O)N(CC)C(C)C 527a_100000223864_100000210183 [0,1,1,0,0,0|1,0,1]=4 831 B11R0.238 CCCNC(=O)C(CC)C(=O)C 1458a_100000070787_200011763335 [0,1,1,0,0,0|1,0,1]=4 832 B11R0.238 CCCNC(=O)C(CC)N(C)C 2230a_100102631434_200011763335 [0,1,1,0,0,0|1,0,1]=4 833 B11R0.238 CCCNC(=O)C(CC)N(C)C 240690a_100020643023_100000689100 [0,1,1,0,0,0|1,0,1]=4 834 B11R0.238 CCCNC(=O)C(CC)N(C)C 269982a_100102631434_200011763335 [0,1,1,0,0,0|1,0,1]=4 835 B11R0.238 CCCNC(=O)C(CC)N(C)C 527a_100020643023_100000689100 [0,1,1,0,0,0|1,0,1]=4 836 B11R0.238 CCCNC(=O)N(CC)C(C)C 2708a_100020643023_100000223864 [0,1,1,0,0,0|1,0,1]=4 837 B11R0.238 CCCNC(=O)N(CC)C(C)C 273464a_100020643023_100000223864 [0,1,1,0,0,0|1,0,1]=4 838 B11R0.238 CCN(C(=O)CCOC)C(C)C 11a_100000223864_100000749529 [0,1,1,0,0,0|1,0,1]=4 839 B11R0.238 CCN(C(=O)CCOC)C(C)C 1626a_100000223864_100000749529 [0,1,1,0,0,0|1,0,1]=4 840 B11R0.238 CCN(C(=O)CCOC)C(C)C 240690a_100000223864_100000749529 [0,1,1,0,0,0|1,0,1]=4 841 B11R0.238 CCN(C(=O)CCOC)C(C)C 527a_100000223864_100000749529 [0,1,1,0,0,0|1,0,1]=4 842 B11R0.238 CCN(C(=O)CCSC)C(C)C 11a_100000223864_100000174002 [0,1,1,0,0,0|1,0,1]=4 843 B11R0.238 CCN(C(=O)CCSC)C(C)C 1626a_100000223864_100000174002 [0,1,1,0,0,0|1,0,1]=4 844 B11R0.238 CCN(C(=O)CCSC)C(C)C 240690a_100000223864_100000174002 [0,1,1,0,0,0|1,0,1]=4 845 B11R0.238 CCN(C(=O)CCSC)C(C)C 527a_100000223864_100000174002 [0,1,1,0,0,0|1,0,1]=4 846 B11R0.238 CCNCC(=O)N(CC)C(C)C 2230a_100015525214_100011282762 [0,1,1,0,0,0|1,0,1]=4 847 B11R0.238 CCOCC(=O)N(CC)C(C)C 11a_100000223864_100000211967 [0,1,1,0,0,0|1,0,1]=4 848 B11R0.238 CCOCC(=O)N(CC)C(C)C 1626a_100000223864_100000211967 [0,1,1,0,0,0|1,0,1]=4 849 B11R0.238 CCOCC(=O)N(CC)C(C)C 240690a_100000223864_100000211967 [0,1,1,0,0,0|1,0,1]=4 850 B11R0.238 CCOCC(=O)N(CC)C(C)C 34a_100121572206_100011282762 [0,1,1,0,0,0|1,0,1]=4 851 B11R0.238 CCOCC(=O)N(CC)C(C)C 527a_100000223864_100000211967 [0,1,1,0,0,0|1,0,1]=4 852 B11R0.238 CCSCC(=O)N(CC)C(C)C 11a_100000223864_100000230394 [0,1,1,0,0,0|1,0,1]=4 853 B11R0.238 CCSCC(=O)N(CC)C(C)C 1626a_100000223864_100000230394 [0,1,1,0,0,0|1,0,1]=4 854 B11R0.238 CCSCC(=O)N(CC)C(C)C 240690a_100000223864_100000230394 [0,1,1,0,0,0|1,0,1]=4 855 B11R0.238 CCSCC(=O)N(CC)C(C)C 527a_100000223864_100000230394 [0,1,1,0,0,0|1,0,1]=4 856 B11R0.238 CCSCC(=O)N(CC)C(C)C 62a_100000210202_100011282762 [0,1,1,0,0,0|1,0,1]=4 857 B11R0.238 CCSCC(=O)N(CC)C(C)C 62a_100011282762_100000210202 [0,1,1,0,0,0|1,0,1]=4 858 B11R0.238 COCCC(=O)C(=C(C)C)C#N 1458a_100000137542_100000233755 [0,1,1,0,0,0|1,0,1]=4 859 B11R0.238 CSCCC(=O)C(=C(C)C)C#N 1458a_100000137542_100000751147 [0,1,1,0,0,0|1,0,1]=4 860 B11R0.278 CCC(C)C(=O)C(=C(C)C)C#N 1458a_100000137542_100000758301 [0,1,1,0,0,0|1,0,1]=4 861 B11R0.278 CCC(C)C(=O)C(CC)N(C)C 1458a_100000689100_100000758301 [0,1,1,0,0,0|1,0,1]=4 862 B11R0.278 CCC(C)C(=O)N(CC)C(C)C 11a_100000223864_100011192722 [0,1,1,0,0,0|1,0,1]=4 863 B11R0.278 CCC(C)C(=O)N(CC)C(C)C 1626a_100000223864_100011192722 [0,1,1,0,0,0|1,0,1]=4 864 B11R0.278 CCC(C)C(=O)N(CC)C(C)C 240690a_100000223864_100011192722 [0,1,1,0,0,0|1,0,1]=4 865 B11R0.278 CCC(C)C(=O)N(CC)C(C)C 527a_100000223864_100011192722 [0,1,1,0,0,0|1,0,1]=4 866 B11R0.278 CCC(O)C(=O)N(CC)C(C)C 240690a_100000223864_100011196387 [0,1,1,0,0,0|1,0,1]=4 867 B11R1.22 COC(=O)C1=CCN(CC1)C 2230a_100020587139_200000210301 [1,1,0,0,0,0|2,0,0]=4 868 B11R1.22 COC(=O)C1=CCN(CC1)C 269982a_100020587139_200000210301 [1,1,0,0,0,0|2,0,0]=4 869 B11R1.22 COC(=O)C1=CCN(CC1)[13CH3] 2230a_100020587139_200025704644 [1,1,0,0,0,0|2,0,0]=4 870 B11R1.22 COC(=O)C1=CCN(CC1)[13CH3] 269982a_100020587139_200025704644 [1,1,0,0,0,0|2,0,0]=4 871 B11R1.222 CCC(=O)C1CCCCC1=O 1458a_100000210414_100000204591 [1,1,0,0,0,0|1,0,1]=4 872 B11R1.222 CCN(C)C1CCCCC1=O 269982a_100000225621_100000204591 [1,1,0,0,0,0|1,0,1]=4 873 B11R1.222 O=C(CO)C1CCCCC1=O 1458a_100000210174_100000204591 [1,1,0,0,0,0|1,0,1]=4 874 B11R1.50 CC(C)N1CC(CC1=O)N[13CH3] 2230a_100000749498_200025704644 [0,1,0,0,1,0|1,0,1]=4 875 B11R1.50 CC(C)N1CC(CC1=O)N[13CH3] 34a_100000749498_200025704644 [0,1,0,0,1,0|1,0,1]=4 876 B11R1.50 CNC1CC(=O)N(C1)C(C)C 2230a_100000749498_200000210301 [0,1,0,0,1,0|1,0,1]=4 877 B11R1.50 CNC1CC(=O)N(C1)C(C)C 34a_100000749498_200000210301 [0,1,0,0,1,0|1,0,1]=4 878 B13R1.3411 CN(C)CC1=C(CC(CC1)(C)C)Cl 270004a_100102631434_200010631677 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.154 C=C1CC(C1)NCC=C(C)C 2230a_100132301982_100000761012 [0,0,1,1,0,0|2,0,0]=4 880 B11R1.154 CC(=CCSC1CC(=O)C1)C 62a_100009894365_100000761012 [0,0,1,1,0,0|1,0,0]=3 881 B11R1.172 CC(=CCCN1CC=CC1)C 269982a_100015195280_100011217483 [0,0,1,1,0,0|2,0,0]=4 882 B11R1.172 CC(=CCNC1CC=CC1)C 2230a_100015188752_100000761012 [0,0,1,1,0,0|2,0,0]=4 883 B11R1.141 CC(C)CC(=O)C1CCC1=O 1458a_100000210554_100009892977 [0,0,1,1,0,0|1,0,1]=4 884 B11R1.141 CC(C)CC(=O)N1CCC1C 11a_100000755817_100000210554 [0,0,1,1,0,0|1,0,1]=4 885 B11R1.141 CC(C)CC(=O)N1CCC1C 240690a_100000755817_100000210554 [0,0,1,1,0,0|1,0,1]=4 886 B11R1.141 CC(C)CC(=O)N1CCC1C 527a_100000755817_100000210554 [0,0,1,1,0,0|1,0,1]=4 887 B11R1.149 CC(=O)C(C)C(=O)C1CC1C 1458a_100000211227_100000179758 [0,0,1,1,0,0|1,0,1]=4 888 B11R1.149 CC1CC1C(=O)N(C)C(C)C 11a_200000211004_100000211227 [0,0,1,1,0,0|1,0,1]=4 889 B11R1.149 CC1CC1C(=O)N(C)C(C)C 1626a_200000211004_100000211227 [0,0,1,1,0,0|1,0,1]=4 890 B11R1.149 CC1CC1C(=O)N(C)C(C)C 527a_200000211004_100000211227 [0,0,1,1,0,0|1,0,1]=4 891 B11R1.503 CC(=O)C(C)C(=O)CC1CC1 1458a_100000738066_100000179758 [0,0,1,1,0,0|1,0,1]=4 892 B11R1.503 CC(C)C(C)C(=O)CC1CC1 1458a_100000755409_100000742324 [0,0,1,1,0,0|0,0,2]=4 893 B11R1.503 CC(C)N(C)C(=O)CC1CC1 11a_200000211004_100000738066 [0,0,1,1,0,0|1,0,1]=4 894 B11R1.503 CC(C)N(C)C(=O)CC1CC1 1626a_200000211004_100000738066 [0,0,1,1,0,0|1,0,1]=4 895 B11R1.503 CC(C)N(C)C(=O)CC1CC1 240690a_200000211004_100000738066 [0,0,1,1,0,0|1,0,1]=4 896 B11R1.503 CC(C)N(C)C(=O)CC1CC1 527a_200000211004_100000738066 [0,0,1,1,0,0|1,0,1]=4 897 B11R1.503 CN(C)C(=O)C(=O)CC1CC1 1458a_100011218876_100000742324 [0,0,1,1,0,0|2,0,0]=4 898 B11R1.503 C[C@@H](C(=O)CC1CC1)N(C)C 1458a_100009822176_100000742324 [0,0,1,1,0,0|1,0,1]=4 899 B11R1.719 CC(C)CC(=O)N(C)C1CC1 11a_100000226674_100000210554 [0,0,1,1,0,0|1,0,1]=4 900 B11R1.719 CC(C)CC(=O)N(C)C1CC1 1626a_100000226674_100000210554 [0,0,1,1,0,0|1,0,1]=4 901 B11R1.719 CC(C)CC(=O)N(C)C1CC1 240690a_100000226674_100000210554 [0,0,1,1,0,0|1,0,1]=4 902 B11R1.719 CC(C)CC(=O)N(C)C1CC1 527a_100000226674_100000210554 [0,0,1,1,0,0|1,0,1]=4 903 B11R1.1263 CC(C)CC(=O)[C@H]1CC1(C)C 1458a_100000692687_100000210624 [0,0,1,1,0,0|0,0,2]=4 904 B11R1.143 CC(=O)C1CCCCCC1=O 1458a_100000070787_100000243696 [0,0,1,1,0,0|1,0,1]=4 905 B11R1.143 CC(=O)C1CCCCCN1C 1458a_100015187800_200000210301 [0,0,1,1,0,0|1,0,1]=4 906 B11R1.143 CN(C)C1CCCCCC1=O 269982a_100102631434_100000243696 [0,0,1,1,0,0|1,0,1]=4 907 B11R1.143 CN1CCCCCC1C(=O)[13CH3] 1458a_100015187800_200025704644 [0,0,1,1,0,0|1,0,1]=4 908 B11R1.465 CCCCc1c([nH][nH]c1=O)C 271570a_100020621405_100000686169 [0,0,1,1,0,0|2,0,0]=4 909 B11R1.465 CCCCc1c(n[nH]c1C)C 271570a_100020621405_100000238710 [0,0,1,1,0,0|2,0,0]=4 910 B11R1.465 CCCCc1c(noc1C)C 271570a_100020621405_100000694658 [0,0,1,1,0,0|1,0,1]=4 911 B11R1.1381 CC(=O)N(CC1CC1)C(C)C 11a_100000738798_100015343762 [0,0,1,1,0,0|1,0,1]=4 912 B11R1.1381 CC(=O)N(CC1CC1)C(C)C 1626a_100000738798_100015343762 [0,0,1,1,0,0|1,0,1]=4 913 B11R1.1381 CC(=O)N(CC1CC1)C(C)C 240690a_100000738798_100015343762 [0,0,1,1,0,0|1,0,1]=4 914 B11R1.1381 CC(=O)N(CC1CC1)C(C)C 527a_100000738798_100103153847 [0,0,1,1,0,0|1,0,1]=4 915 B11R1.106 CC(=CC(=O)N[C@@H]1C[C@@H]1F)C 240690a_100015190264_100000211388 [0,0,1,1,0,0|2,0,0]=4 916 B11R1.106 CC(=CC(=O)N[C@@H]1C[C@H]1F)C 11a_100025746932_100000211388 [0,0,1,1,0,0|2,0,0]=4 917 B11R1.106 CC(=CC(=O)N[C@@H]1C[C@H]1F)C 1626a_100025746932_100000211388 [0,0,1,1,0,0|2,0,0]=4 918 B11R1.106 CC(=CC(=O)N[C@@H]1C[C@H]1F)C 240690a_100025746932_100000211388 [0,0,1,1,0,0|2,0,0]=4 919 B11R1.198 CCC(C)CC(=O)CC1CC1 1458a_100000708755_100000742324 [0,0,1,1,0,0|0,0,2]=4 920 B11R1.198 CCC(C)CC(=O)CC1CC1 1458a_100000738066_100000748023 [0,0,1,1,0,0|0,0,2]=4 921 B11R1.198 CCC(C)CC(=O)NC1CC1 1626a_100000212008_100000708755 [0,0,1,1,0,0|1,0,1]=4 922 B11R1.198 CCC(C)CC(=O)NC1CC1 240690a_100000212008_100000708755 [0,0,1,1,0,0|1,0,1]=4 923 B11R1.198 CCC(C)CC(=O)NC1CC1 527a_100000212008_100000708755 [0,0,1,1,0,0|1,0,1]=4 924 B11R1.198 CC[C@H](C)CC(=O)CC1CC1 1458a_100000738066_100009816398 [0,0,1,1,0,0|0,0,2]=4 925 B11R1.257 C=C(C)CC(=O)C1CC1CC 1458a_200011661523_100000748629 [0,0,1,1,0,0|0,0,2]=4 926 B11R1.257 CCC1CC1C(=O)CC(C)C 1458a_200011661523_100000210624 [0,0,1,1,0,0|0,0,2]=4 927 B11R1.257 CCC1CC1C(=O)NC(C)C 11a_100138425928_200011661523 [0,0,1,1,0,0|1,0,1]=4 928 B11R1.257 CCC1CC1C(=O)NC(C)C 1626a_100138425928_200011661523 [0,0,1,1,0,0|1,0,1]=4 929 B11R1.257 CCC1CC1C(=O)NC(C)C 240690a_100138425928_200011661523 [0,0,1,1,0,0|1,0,1]=4 930 B11R1.257 CCC1CC1C(=O)NC(C)C 527a_100138425928_200011661523 [0,0,1,1,0,0|1,0,1]=4 931 B11R1.484 C=C(C)CC(=O)CC1CCC1 1458a_100000763092_100000748629 [0,0,1,1,0,0|0,0,2]=4 932 B11R1.484 CC(=CC(=O)CC1CCC1)C 1458a_100000211388_100000763275 [0,0,1,1,0,0|0,0,0]=2 933 B11R1.484 CC(=CC(=O)CC1CCC1)Cl 1458a_200042562850_100000763275 [0,0,1,1,0,0|1,0,0]=3 934 B11R1.484 CC(=CC(=O)CC1CCC1)I 1458a_100025716642_100000763275 [0,0,1,1,0,0|1,0,0]=3 935 B11R1.484 CC(=CC(=O)CC1CCO1)C 1458a_100000211388_100000103362 [0,0,1,1,0,0|1,0,0]=3 936 B11R1.484 CC(=CC(=O)CC1CCO1)Cl 1458a_200042562850_100000103362 [0,0,1,1,0,0|2,0,0]=4 937 B11R1.484 CC(=CC(=O)CC1CCO1)I 1458a_100025716642_100000103362 [0,0,1,1,0,0|2,0,0]=4 938 B11R1.484 CC(=CC(=O)CC1COC1)C 1458a_100000211388_100010264016 [0,0,1,1,0,0|1,0,0]=3 939 B11R1.484 CC(=CC(=O)CC1COC1)Cl 1458a_200042562850_100010264016 [0,0,1,1,0,0|2,0,0]=4 940 B11R1.484 CC(=CC(=O)CC1COC1)I 1458a_100025716642_100010264016 [0,0,1,1,0,0|2,0,0]=4 941 B11R1.484 CC(=CC(=O)NC1CCC1)C 11a_100000749019_100000211388 [0,0,1,1,0,0|1,0,0]=3 942 B11R1.484 CC(=CC(=O)NC1CCC1)C 1626a_100000749019_100000211388 [0,0,1,1,0,0|1,0,0]=3 943 B11R1.484 CC(=CC(=O)NC1CCC1)C 240690a_100000749019_100000211388 [0,0,1,1,0,0|1,0,0]=3 944 B11R1.484 CC(=CC(=O)NC1CCC1)Cl 11a_100000749019_200042562850 [0,0,1,1,0,0|2,0,0]=4 945 B11R1.484 CC(=CC(=O)NC1CCC1)Cl 1626a_100000749019_200042562850 [0,0,1,1,0,0|2,0,0]=4 946 B11R1.484 CC(=CC(=O)NC1CCC1)Cl 240690a_100000749019_200042562850 [0,0,1,1,0,0|2,0,0]=4 947 B11R1.484 CC(=CC(=O)NC1CCC1)I 11a_100000749019_100025716642 [0,0,1,1,0,0|2,0,0]=4 948 B11R1.484 CC(=CC(=O)NC1CCC1)I 1626a_100000749019_100025716642 [0,0,1,1,0,0|2,0,0]=4 949 B11R1.484 CC(=CC(=O)NC1COC1)C 11a_100016991112_100000211388 [0,0,1,1,0,0|2,0,0]=4 950 B11R1.484 CC(=CC(=O)NC1COC1)C 1626a_100016991112_100000211388 [0,0,1,1,0,0|2,0,0]=4 951 B11R1.484 CC(=CC(=O)NC1COC1)C 240690a_100016991112_100000211388 [0,0,1,1,0,0|2,0,0]=4 952 B11R1.484 CC(=CC(=O)NC1CSC1)C 11a_100016994217_100000211388 [0,0,1,1,0,0|2,0,0]=4 953 B11R1.484 CC(=CC(=O)NC1CSC1)C 1626a_100016994217_100000211388 [0,0,1,1,0,0|2,0,0]=4 954 B11R1.484 CC(=CC(=O)NC1CSC1)C 240690a_100016994217_100000211388 [0,0,1,1,0,0|2,0,0]=4 955 B11R1.484 CC(C)CC(=O)CC1CCC1 1458a_100000210554_100000763275 [0,0,1,1,0,0|0,0,2]=4 956 B11R1.484 CC(C)CC(=O)CC1CCC1 1458a_100000763092_100000210624 [0,0,1,1,0,0|0,0,2]=4 957 B11R1.484 CC(C)NC(=O)CC1CCC1 11a_100138425928_100000763092 [0,0,1,1,0,0|1,0,1]=4 958 B11R1.484 CC(C)NC(=O)CC1CCC1 1626a_100138425928_100000763092 [0,0,1,1,0,0|1,0,1]=4 959 B11R1.484 CC(C)NC(=O)CC1CCC1 240690a_100138425928_100000763092 [0,0,1,1,0,0|1,0,1]=4 960 B11R1.484 CC(C)NC(=O)CC1CCC1 527a_100138425928_100000763092 [0,0,1,1,0,0|1,0,1]=4 961 B11R1.484 CN(C)CC(=O)CC1CCC1 1458a_100000750896_100000763275 [0,0,1,1,0,0|1,0,1]=4 962 B11R1.484 C[S+](C)CC(=O)CC1CCC1 1458a_200159257847_100000763275 [0,0,1,1,0,0|1,0,1]=4 963 B11R1.484 O=C(C=C(Cl)Cl)CC1CCC1 1458a_100000137448_100000763275 [0,0,1,1,0,0|2,0,0]=4 964 B11R1.728 C=C(C)CC(=O)CC1(CC1)C 1458a_100000112800_100000748629 [0,0,1,1,0,0|0,0,2]=4 965 B11R1.728 CC(=CC(=O)CC1(CO1)C)C 1458a_100000211388_100000760498 [0,0,1,1,0,0|1,0,0]=3 966 B11R1.728 CC(=CC(=O)CC1(CO1)C)Cl 1458a_200042562850_100000760498 [0,0,1,1,0,0|2,0,0]=4 967 B11R1.728 CC(=CC(=O)CC1(CO1)C)I 1458a_100025716642_100000760498 [0,0,1,1,0,0|2,0,0]=4 968 B11R1.728 CC(=CC(=O)NC1(CC1)C)C 11a_100000757604_100000211388 [0,0,1,1,0,0|1,0,0]=3 969 B11R1.728 CC(=CC(=O)NC1(CC1)C)C 1626a_100000757604_100000211388 [0,0,1,1,0,0|1,0,0]=3 970 B11R1.728 CC(=CC(=O)NC1(CC1)C)C 240690a_100000757604_100000211388 [0,0,1,1,0,0|1,0,0]=3 971 B11R1.728 CC(=CC(=O)NC1(CC1)C)Cl 11a_100000757604_200042562850 [0,0,1,1,0,0|2,0,0]=4 972 B11R1.728 CC(=CC(=O)NC1(CC1)C)Cl 1626a_100000757604_200042562850 [0,0,1,1,0,0|2,0,0]=4 973 B11R1.728 CC(=CC(=O)NC1(CC1)C)Cl 240690a_100000757604_200042562850 [0,0,1,1,0,0|2,0,0]=4 974 B11R1.728 CC(=CC(=O)NC1(CC1)C)I 11a_100000757604_100025716642 [0,0,1,1,0,0|2,0,0]=4 975 B11R1.728 CC(=CC(=O)NC1(CC1)C)I 1626a_100000757604_100025716642 [0,0,1,1,0,0|2,0,0]=4 976 B11R1.728 CC(C)CC(=O)CC1(CC1)C 1458a_100000112800_100000210624 [0,0,1,1,0,0|0,0,2]=4 977 B11R1.728 CC(C)NC(=O)CC1(CC1)C 11a_100138425928_100000112800 [0,0,1,1,0,0|1,0,1]=4 978 B11R1.728 CC(C)NC(=O)CC1(CC1)C 1626a_100138425928_100000112800 [0,0,1,1,0,0|1,0,1]=4 979 B11R1.728 CC(C)NC(=O)CC1(CC1)C 240690a_100138425928_100000112800 [0,0,1,1,0,0|1,0,1]=4 980 B11R1.728 CC(C)NC(=O)CC1(CC1)C 527a_100138425928_100000112800 [0,0,1,1,0,0|1,0,1]=4 981 B11R1.815 CCC(C)CC(=O)C1CC1C 1458a_100000211227_100000748023 [0,0,1,1,0,0|0,0,2]=4 982 B11R1.815 CC[C@H](C)CC(=O)C1CC1C 1458a_100000211227_100009816398 [0,0,1,1,0,0|0,0,2]=4 983 B11R1.199 CCCC(=O)C1CCCC1=O 1458a_100000211992_100000211823 [0,0,1,1,0,0|1,0,1]=4 984 B11R1.199 CCCC(=O)C1CCCC1C 1458a_100000690547_100000210303 [0,0,1,1,0,0|0,0,2]=4 985 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000211992 [0,0,1,1,0,0|1,0,1]=4 986 B11R1.199 CCCC(=O)N1CCC[C@@H]1C 527a_100020605311_100000211992 [0,0,1,1,0,0|1,0,1]=4 987 B11R1.199 CCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000211992 [0,0,1,1,0,0|1,0,1]=4 988 B11R1.199 CCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000211992 [0,0,1,1,0,0|1,0,1]=4 989 B11R1.199 CCCC(=O)N1CCC[C@H]1C 527a_100015189458_100000211992 [0,0,1,1,0,0|1,0,1]=4 990 B11R1.199 CCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100000210303 [0,0,1,1,0,0|1,0,1]=4 991 B11R1.823 CCCC(=O)N(CC)C1CC1 11a_100000738653_100000211992 [0,0,1,1,0,0|1,0,1]=4 992 B11R1.823 CCCC(=O)N(CC)C1CC1 1626a_100000738653_100000211992 [0,0,1,1,0,0|1,0,1]=4 993 B11R1.823 CCCC(=O)N(CC)C1CC1 240690a_100000738653_100000211992 [0,0,1,1,0,0|1,0,1]=4 994 B11R1.823 CCCC(=O)N(CC)C1CC1 527a_100000738653_100000211992 [0,0,1,1,0,0|1,0,1]=4 995 B11R1.835 CCCC(=O)C1(CC1)C(=O)C 1458a_100000211992_100000086384 [0,0,1,1,0,0|1,0,1]=4 996 B11R1.835 CCCC(=O)C1(CC1)N(C)C 1458a_200012027079_100000210303 [0,0,1,1,0,0|1,0,1]=4 997 B11R1.1021 CCN(C(=O)C1CC1)C(C)C 11a_100000223864_100000210395 [0,0,1,1,0,0|1,0,1]=4 998 B11R1.1021 CCN(C(=O)C1CC1)C(C)C 1626a_100000223864_100000210395 [0,0,1,1,0,0|1,0,1]=4 999 B11R1.1021 CCN(C(=O)C1CC1)C(C)C 240690a_100000223864_100000210395 [0,0,1,1,0,0|1,0,1]=4 1000 B11R1.1021 CCN(C(=O)C1CC1)C(C)C 527a_100000223864_100000210395 [0,0,1,1,0,0|1,0,1]=4 1001 B9R0.48 C=CCN(C)CC=C(C)C 2230a_100000225617_100000761012 [0,0,1,0,1,0|2,0,0]=4 1002 B9R0.48 C=CCN(C)CC=C(C)C 269982a_100000225617_100000761012 [0,0,1,0,1,0|2,0,0]=4 1003 B9R0.48 CC(C)CCN(C)CC=O 2230a_100000742789_200015260668 [0,0,1,0,1,0|1,0,1]=4 1004 B9R0.48 CC(C)CCN(C)CC=O 269982a_100000742789_200015260668 [0,0,1,0,1,0|1,0,1]=4 1005 B9R0.48 CN(C)CCN(C)CC=O 269982a_100000225618_200015260668 [0,0,1,0,1,0|2,0,0]=4 1006 B9R0.79 CC(=O)C(C)C(=O)C(C)C 1458a_100000070787_100009893295 [0,0,1,0,1,0|1,0,1]=4 1007 B9R0.79 CC(=O)C(C)C(=O)C(C)C 1458a_100000210198_100000179758 [0,0,1,0,1,0|1,0,1]=4 1008 B9R0.79 CC(C)C(=O)C(=O)N(C)C 1458a_100011218876_100000210206 [0,0,1,0,1,0|2,0,0]=4 1009 B9R0.79 CC(C)C(=O)C(C)C(C)C 1458a_100000755409_100000210206 [0,0,1,0,1,0|0,0,2]=4 1010 B9R0.79 CC(C)C(=O)C(C)N(C)C 2230a_100102631434_100009893295 [0,0,1,0,1,0|1,0,1]=4 1011 B9R0.79 CC(C)C(=O)C(C)N(C)C 269982a_100102631434_100009893295 [0,0,1,0,1,0|1,0,1]=4 1012 B9R0.79 CC(C)C(=O)N(C)C(C)C 11a_200000211004_100000210198 [0,0,1,0,1,0|1,0,1]=4 1013 B9R0.79 CC(C)C(=O)N(C)C(C)C 1626a_200000211004_100000210198 [0,0,1,0,1,0|1,0,1]=4 1014 B9R0.79 CC(C)C(=O)N(C)C(C)C 240690a_200000211004_100000210198 [0,0,1,0,1,0|1,0,1]=4 1015 B9R0.79 CC(C)C(=O)N(C)C(C)C 527a_200000211004_100000210198 [0,0,1,0,1,0|1,0,1]=4 1016 B9R0.79 CC(C)C(=O)[C@H](C)N(C)C 1458a_100009822176_100000210206 [0,0,1,0,1,0|1,0,1]=4 1017 B9R0.42 C=C(C)C(=O)CC(C)CC 1458a_100000185857_100000748023 [0,0,1,0,1,0|0,0,1]=3 1018 B9R0.42 C=C(C)C(=O)CC(O)CC 1458a_100000185857_100011218378 [0,0,1,0,1,0|1,0,1]=4 1019 B9R0.42 C=C(C)C(=O)C[C@@H](C)CC 1458a_100000185857_100009816398 [0,0,1,0,1,0|0,0,1]=3 1020 B9R0.42 C=C(C)C(=O)C[C@@H](C)CO 1458a_100000185857_100000059175 [0,0,1,0,1,0|1,0,1]=4 1021 B9R0.42 C=C(C)C(=O)NC(C)CC 11a_100000209981_100000185857 [0,0,1,0,1,0|1,0,1]=4 1022 B9R0.42 C=C(C)C(=O)NC(C)CC 1626a_100000209981_100000185857 [0,0,1,0,1,0|1,0,1]=4 1023 B9R0.42 CC(C)C(=O)C[C@@H](C)CO 1458a_100000210198_100000059175 [0,0,1,0,1,0|1,0,1]=4 1024 B9R0.42 CCC(C)CC(=O)C(C)C 1458a_100000210198_100000748023 [0,0,1,0,1,0|0,0,1]=3 1025 B9R0.42 CCC(C)CC(=O)C(C)C 1458a_100000708755_100000210206 [0,0,1,0,1,0|0,0,1]=3 1026 B9R0.42 CCC(C)CC(=O)C(C)F 1458a_100000062450_100000748023 [0,0,1,0,1,0|1,0,1]=4 1027 B9R0.42 CCC(C)CC(=O)N(C)C 11a_100102631434_100000708755 [0,0,1,0,1,0|1,0,0]=3 1028 B9R0.42 CCC(C)CC(=O)N(C)C 1626a_100102631434_100000708755 [0,0,1,0,1,0|1,0,0]=3 1029 B9R0.42 CCC(C)CC(=O)N(C)C 240690a_100102631434_100000708755 [0,0,1,0,1,0|1,0,0]=3 1030 B9R0.42 CCC(C)CC(=O)N(C)C 527a_100102631434_100000708755 [0,0,1,0,1,0|1,0,0]=3 1031 B9R0.42 CCC(C)CC(=O)[C@@H](C)O 1458a_100000717761_100000748023 [0,0,1,0,1,0|1,0,1]=4 1032 B9R0.42 CCC(C)CC(=O)[C@H](C)O 1458a_217856618621_100000748023 [0,0,1,0,1,0|1,0,1]=4 1033 B9R0.42 CCC(C)NC(=O)C(=O)C 1458a_200011297154_200000210301 [0,0,1,0,1,0|2,0,0]=4 1034 B9R0.42 CCC(C)NC(=O)C(=O)[13CH3] 1458a_200011297154_200025704644 [0,0,1,0,1,0|2,0,0]=4 1035 B9R0.42 CCC(C)NC(=O)C(C)C 11a_100000209981_100000210198 [0,0,1,0,1,0|1,0,1]=4 1036 B9R0.42 CCC(C)NC(=O)C(C)C 1626a_100000209981_100000210198 [0,0,1,0,1,0|1,0,1]=4 1037 B9R0.42 CCC(C)NC(=O)C(C)C 240690a_100000209981_100000210198 [0,0,1,0,1,0|1,0,1]=4 1038 B9R0.42 CCC(C)NC(=O)C(C)C 527a_100000209981_100000210198 [0,0,1,0,1,0|1,0,1]=4 1039 B9R0.42 CCC(C)NC(=O)N(C)C 2708a_100000209981_100102631434 [0,0,1,0,1,0|2,0,0]=4 1040 B9R0.42 CCC(O)CC(=O)C(C)C 1458a_100000210198_100011218378 [0,0,1,0,1,0|1,0,1]=4 1041 B9R0.42 CCC(O)CC(=O)C(C)C 1458a_100011667805_100000210206 [0,0,1,0,1,0|1,0,1]=4 1042 B9R0.42 CCC(O)CC(=O)N(C)C 1626a_100102631434_100011667805 [0,0,1,0,1,0|2,0,0]=4 1043 B9R0.42 CCC(O)CC(=O)N(C)C 240690a_100102631434_100011667805 [0,0,1,0,1,0|2,0,0]=4 1044 B9R0.42 CCN(C)CC(=O)C(=O)C 269982a_100000225621_100011261029 [0,0,1,0,1,0|2,0,0]=4 1045 B9R0.42 CCN(C)CC(=O)C(C)C 1458a_100116209913_100000210206 [0,0,1,0,1,0|1,0,1]=4 1046 B9R0.42 CCN(C)CC(=O)C(C)C 2230a_100000225621_100000753385 [0,0,1,0,1,0|1,0,1]=4 1047 B9R0.42 CCN(C)CC(=O)C(C)C 269982a_100000225621_100000753385 [0,0,1,0,1,0|1,0,1]=4 1048 B9R0.42 CCN(C)CC(=O)N(C)C 2230a_100000185065_100000210202 [0,0,1,0,1,0|2,0,0]=4 1049 B9R0.42 CCN(C)CC(=O)N(C)C 2230a_100000225621_100000185267 [0,0,1,0,1,0|2,0,0]=4 1050 B9R0.42 CCN(C)CC(=O)N(C)C 240690a_100102631434_100116209913 [0,0,1,0,1,0|2,0,0]=4 1051 B9R0.42 CCN(C)CC(=O)N(C)C 269982a_100000225621_100000185267 [0,0,1,0,1,0|2,0,0]=4 1052 B9R0.42 CCN(C)CC(=O)N(C)C 527a_100102631434_100116209913 [0,0,1,0,1,0|2,0,0]=4 1053 B9R0.42 CC[C@H](C)CC(=O)C(C)C 1458a_100000210198_100009816398 [0,0,1,0,1,0|0,0,1]=3 1054 B9R0.42 CC[C@H](C)CC(=O)C(C)F 1458a_100000062450_100009816398 [0,0,1,0,1,0|1,0,1]=4 1055 B9R0.42 CC[C@H](C)CC(=O)[C@@H](C)O 1458a_100000717761_100009816398 [0,0,1,0,1,0|1,0,1]=4 1056 B9R0.42 CC[C@H](C)CC(=O)[C@H](C)O 1458a_217856618621_100009816398 [0,0,1,0,1,0|1,0,1]=4 1057 B9R1.35 CC(=O)N1CC[C@H](C1)C 11a_100016987628_100015343762 [1,0,0,0,1,0|2,0,0]=4 1058 B9R1.35 CC(=O)N1CC[C@H](C1)C 240690a_100016987628_100015343762 [1,0,0,0,1,0|2,0,0]=4 1059 B9R1.35 CC(=O)N1CC[C@H](C1)C 527a_100016987628_100103153847 [1,0,0,0,1,0|2,0,0]=4 1060 B9R1.35 CC(C)N1CC[C@H](C1)C 2230a_100016987628_100000210206 [1,0,0,0,1,0|1,0,1]=4 1061 B9R1.35 CC(C)N1CC[C@H](C1)C 269982a_100016987628_100000210206 [1,0,0,0,1,0|1,0,1]=4 1062 B9R1.35 CC(C)N1CC[C@H](C1)C 34a_100016987628_100000210206 [1,0,0,0,1,0|1,0,1]=4 1063 B9R1.35 CC1CCC(C1)N(C)C 270004a_100102631434_100011215218 [1,0,0,0,1,0|1,0,1]=4 1064 B9R1.41 CC(=O)C1CCCC1=O 1458a_100000070787_100000211823 [1,0,0,0,1,0|1,0,1]=4 1065 B9R1.41 CN(C)C1CCCC1=O 2230a_100102631434_100000211823 [1,0,0,0,1,0|1,0,1]=4 1066 B9R1.41 CN(C)C1CCCC1=O 269982a_100102631434_100000211823 [1,0,0,0,1,0|1,0,1]=4 1067 B11R0.176 C#CCC(C)OCCC=C(C)C 34a_100000685586_100011217483 [0,0,1,0,0,1|1,0,1]=4 1068 B11R0.176 C#CCC(C)OCCC=C(C)C 7a_100000685586_100011217483 [0,0,1,0,0,1|1,0,1]=4 1069 B11R0.176 C/C=C/C(C)OCCC=C(C)C 34a_200102604097_100011217483 [0,0,1,0,0,1|1,0,1]=4 1070 B11R0.176 C=CCC(C)COCC=C(C)C 34a_100009832082_100000761012 [0,0,1,0,0,1|1,0,0]=3 1071 B11R0.176 C=CCC(C)COCC=C(C)C 7a_100009832082_100000761012 [0,0,1,0,0,1|1,0,0]=3 1072 B11R0.176 C=CC[C@@H](C)OCCC=C(C)C 34a_100000731007_100011217483 [0,0,1,0,0,1|1,0,0]=3 1073 B11R0.176 C=CC[C@@H](C)OCCC=C(C)C 7a_100000731007_100011217483 [0,0,1,0,0,1|1,0,0]=3 1074 B11R0.176 C=CC[C@@H](N)COCC=C(C)C 34a_100020615467_100000761012 [0,0,1,0,0,1|2,0,0]=4 1075 B11R0.176 CC(=CCCN[C@@H](C)CC#N)C 2230a_100016994482_100011217483 [0,0,1,0,0,1|1,0,1]=4 1076 B11R0.176 CC(=CCCN[C@H](C)CCO)C 2230a_100000706166_100011217483 [0,0,1,0,0,1|0,0,2]=4 1077 B11R0.176 CC(=CCCN[C@H](C)CCO)C 34a_100000706166_100011217483 [0,0,1,0,0,1|0,0,2]=4 1078 B11R0.176 CC(=CCCOC(C)CCBr)C 34a_100012276601_100011217483 [0,0,1,0,0,1|1,0,1]=4 1079 B11R0.176 CC(=CCCSC(C)CC#N)C 62a_100009813641_100011217483 [0,0,1,0,0,1|1,0,1]=4 1080 B11R0.176 CC(=CCCSC(C)CC#N)C 62a_100011217483_100009813641 [0,0,1,0,0,1|1,0,1]=4 1081 B11R0.176 CC(=CCCSC(C)CCO)C 62a_100009893172_100011217483 [0,0,1,0,0,1|0,0,2]=4 1082 B11R0.176 CC(=CCCSC(C)CCO)C 62a_100011217483_100009893172 [0,0,1,0,0,1|0,0,2]=4 1083 B11R0.176 CC(=CCOCC(C)CCN)C 34a_106354213184_100000761012 [0,0,1,0,0,1|1,0,1]=4 1084 B11R0.176 CCCC(C)CNCC=C(C)C 270004a_100000718196_100000243154 [0,0,1,0,0,1|1,0,1]=4 1085 B11R0.176 CCCC(C)CNCC=C(C)C 34a_100000718196_100011216630 [0,0,1,0,0,1|1,0,1]=4 1086 B11R0.176 CCCC(C)COCC=C(C)C 34a_100000688023_100000761012 [0,0,1,0,0,1|1,0,1]=4 1087 B11R0.176 CCCC(C)COCC=C(C)C 34a_100000753907_100011216630 [0,0,1,0,0,1|1,0,1]=4 1088 B11R0.176 CCCC(C)COCC=C(C)C 7a_100000688023_100000761012 [0,0,1,0,0,1|1,0,1]=4 1089 B11R0.176 CCCC(C)CSCC=C(C)C 62a_100000761012_100011216630 [0,0,1,0,0,1|1,0,1]=4 1090 B11R0.176 CCCC(C)CSCC=C(C)C 62a_100011216630_100000761012 [0,0,1,0,0,1|1,0,1]=4 1091 B11R0.176 CCCC(C)NCCC=C(C)C 2230a_100000741246_100011217483 [0,0,1,0,0,1|1,0,1]=4 1092 B11R0.176 CCCC(C)OCCC=C(C)C 34a_100000764384_100011217483 [0,0,1,0,0,1|1,0,1]=4 1093 B11R0.176 CCCC(C)OCCC=C(C)C 7a_100000764384_100011217483 [0,0,1,0,0,1|1,0,1]=4 1094 B11R0.176 CCCC(C)SCCC=C(C)C 62a_100000766640_100011217483 [0,0,1,0,0,1|1,0,1]=4 1095 B11R0.176 CCCC(C)SCCC=C(C)C 62a_100011217483_100000766640 [0,0,1,0,0,1|1,0,1]=4 1096 B11R0.176 COCC(C)SCCC=C(C)C 62a_100000765312_100011217483 [0,0,1,0,0,1|2,0,0]=4 1097 B11R0.176 COCC(C)SCCC=C(C)C 62a_100011217483_100000765312 [0,0,1,0,0,1|2,0,0]=4 1098 B11R0.176 COC[C@@H](C)NCCC=C(C)C 2230a_100000764878_100011217483 [0,0,1,0,0,1|2,0,0]=4 1099 B11R0.176 COC[C@@H](C)OCCC=C(C)C 34a_100011934205_100011217483 [0,0,1,0,0,1|2,0,0]=4 1100 B11R0.149 C=C(C)CN(C)C(=O)CC(C)C 11a_100000225649_100000210554 [0,0,1,0,0,1|1,0,1]=4 1101 B11R0.149 C=C(C)CN(C)C(=O)CC(C)C 1626a_100000225649_100000210554 [0,0,1,0,0,1|1,0,1]=4 1102 B11R0.149 C=C(C)CN(C)C(=O)CC(C)C 527a_100000225649_100000210554 [0,0,1,0,0,1|1,0,1]=4 1103 B11R0.149 CC(=O)N[C@H](C)C(=O)CC(C)C 1458a_100011504603_100000210624 [0,0,1,0,0,1|1,0,1]=4 1104 B11R0.149 CC(=O)OC(C)C(=O)CC(C)C 1458a_100000210554_100009818208 [0,0,1,0,0,1|1,0,1]=4 1105 B11R0.149 CC(=O)O[C@@H](C)C(=O)CC(C)C 1458a_100009816467_100000210624 [0,0,1,0,0,1|1,0,1]=4 1106 B11R0.149 CC(C)CC(=O)C(=O)NC(C)C 1458a_100011220036_100000210624 [0,0,1,0,0,1|1,0,1]=4 1107 B11R0.149 CC(C)CC(=O)C(C)CC(C)C 1458a_100000210554_100000731052 [0,0,1,0,0,1|0,0,2]=4 1108 B11R0.149 CC(C)CC(=O)C(C)CN(C)C 1458a_200015186601_100000210624 [0,0,1,0,0,1|1,0,1]=4 1109 B11R0.149 CC(C)CC(=O)N(C)CC(C)C 11a_100000747067_100000210554 [0,0,1,0,0,1|1,0,1]=4 1110 B11R0.149 CC(C)CC(=O)N(C)CC(C)C 1626a_100000747067_100000210554 [0,0,1,0,0,1|1,0,1]=4 1111 B11R0.149 CC(C)CC(=O)N(C)CC(C)C 240690a_100000747067_100000210554 [0,0,1,0,0,1|1,0,1]=4 1112 B11R0.149 CC(C)CC(=O)N(C)CC(C)C 527a_100000747067_100000210554 [0,0,1,0,0,1|1,0,1]=4 1113 B11R0.173 CC(=O)C(C)C(=O)CCC(C)C 1458a_100000181311_100000179758 [0,0,1,0,0,1|1,0,1]=4 1114 B11R0.173 CC(=O)C(C)C(=O)COC(C)C 1458a_100000745533_100000179758 [0,0,1,0,0,1|1,0,1]=4 1115 B11R0.173 CC(=O)C(C)C(=O)CSC(C)C 1458a_100000241585_100000179758 [0,0,1,0,0,1|1,0,1]=4 1116 B11R0.173 CC(=O)C(C)C(=O)NCC(C)C 1458a_100000070787_100000230289 [0,0,1,0,0,1|1,0,1]=4 1117 B11R0.173 CC(C)CCC(=O)C(=O)N(C)C 1458a_100011218876_100000210312 [0,0,1,0,0,1|2,0,0]=4 1118 B11R0.173 CC(C)CCC(=O)C(C)C(C)C 1458a_100000755409_100000210312 [0,0,1,0,0,1|0,0,2]=4 1119 B11R0.173 CC(C)CCC(=O)N(C)C(C)C 11a_200000211004_100000181311 [0,0,1,0,0,1|1,0,1]=4 1120 B11R0.173 CC(C)CCC(=O)N(C)C(C)C 1626a_200000211004_100000181311 [0,0,1,0,0,1|1,0,1]=4 1121 B11R0.173 CC(C)CCC(=O)N(C)C(C)C 240690a_200000211004_100000181311 [0,0,1,0,0,1|1,0,1]=4 1122 B11R0.173 CC(C)CCC(=O)N(C)C(C)C 527a_200000211004_100000181311 [0,0,1,0,0,1|1,0,1]=4 1123 B11R0.173 CC(C)CCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210312 [0,0,1,0,0,1|1,0,1]=4 1124 B11R0.173 CC(C)CNC(=O)C(=O)C(C)C 1458a_200011297155_100000210206 [0,0,1,0,0,1|1,0,1]=4 1125 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 1626a_100000210953_100011218876 [0,0,1,0,0,1|2,0,0]=4 1126 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 1626a_100102631434_200011297155 [0,0,1,0,0,1|2,0,0]=4 1127 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 240690a_100000210953_100011218876 [0,0,1,0,0,1|2,0,0]=4 1128 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 240690a_100102631434_200011297155 [0,0,1,0,0,1|2,0,0]=4 1129 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 527a_100000210953_100011218876 [0,0,1,0,0,1|2,0,0]=4 1130 B11R0.173 CC(C)CNC(=O)C(=O)N(C)C 527a_100102631434_200011297155 [0,0,1,0,0,1|2,0,0]=4 1131 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 11a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 1132 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 1626a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 1133 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 240690a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 1134 B11R0.173 CC(C)CNC(=O)C(C)C(C)C 527a_100000210953_100000755409 [0,0,1,0,0,1|0,0,2]=4 1135 B11R0.173 CC(C)CNC(=O)C(C)N(C)C 2230a_100102631434_100000230289 [0,0,1,0,0,1|1,0,1]=4 1136 B11R0.173 CC(C)CNC(=O)C(C)N(C)C 269982a_100102631434_100000230289 [0,0,1,0,0,1|1,0,1]=4 1137 B11R0.173 CC(C)CNC(=O)N(C)C(C)C 2708a_100000210953_200000211004 [0,0,1,0,0,1|1,0,1]=4 1138 B11R0.173 CC(C)CNC(=O)N(C)C(C)C 273464a_100000210953_200000211004 [0,0,1,0,0,1|1,0,1]=4 1139 B11R0.173 CC(C)CNC(=O)[C@H](C)N(C)C 240690a_100000210953_100009822176 [0,0,1,0,0,1|1,0,1]=4 1140 B11R0.173 CC(C)CNC(=O)[C@H](C)N(C)C 527a_100000210953_100009822176 [0,0,1,0,0,1|1,0,1]=4 1141 B11R0.173 CC(C)NCC(=O)N(C)C(C)C 2230a_100138425928_100000230190 [0,0,1,0,0,1|1,0,1]=4 1142 B11R0.173 CC(C)NCC(=O)N(C)C(C)C 34a_100138425928_100000230190 [0,0,1,0,0,1|1,0,1]=4 1143 B11R0.173 CC(C)OCC(=O)N(C)C(C)C 11a_200000211004_100000745533 [0,0,1,0,0,1|1,0,1]=4 1144 B11R0.173 CC(C)OCC(=O)N(C)C(C)C 1626a_200000211004_100000745533 [0,0,1,0,0,1|1,0,1]=4 1145 B11R0.173 CC(C)OCC(=O)N(C)C(C)C 240690a_200000211004_100000745533 [0,0,1,0,0,1|1,0,1]=4 1146 B11R0.173 CC(C)OCC(=O)N(C)C(C)C 34a_100000212225_100000230190 [0,0,1,0,0,1|1,0,1]=4 1147 B11R0.173 CC(C)OCC(=O)N(C)C(C)C 527a_200000211004_100000745533 [0,0,1,0,0,1|1,0,1]=4 1148 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 11a_200000211004_100000241585 [0,0,1,0,0,1|1,0,1]=4 1149 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 1626a_200000211004_100000241585 [0,0,1,0,0,1|1,0,1]=4 1150 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 240690a_200000211004_100000241585 [0,0,1,0,0,1|1,0,1]=4 1151 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 527a_200000211004_100000241585 [0,0,1,0,0,1|1,0,1]=4 1152 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 62a_100000210206_100000230190 [0,0,1,0,0,1|1,0,1]=4 1153 B11R0.173 CC(C)SCC(=O)N(C)C(C)C 62a_100000230190_100000210206 [0,0,1,0,0,1|1,0,1]=4 1154 B11R0.160 CCCCC(NC(=O)C)C(=O)C 1458a_100000194794_200000210301 [0,0,1,0,0,1|1,0,1]=4 1155 B11R0.160 CCCCC(NC(=O)C)C(=O)[13CH3] 1458a_100000194794_200025704644 [0,0,1,0,0,1|1,0,1]=4 1156 B11R0.93 C=C(C)CCC(=O)CC(C)CC 1458a_100000708755_100000730704 [0,0,1,0,0,1|0,0,2]=4 1157 B11R0.93 C=C(C)CCC(=O)CC(C)CC 1458a_200000688413_100000748023 [0,0,1,0,0,1|0,0,2]=4 1158 B11R0.93 C=C(C)CCC(=O)C[C@@H](C)CC 1458a_200000688413_100009816398 [0,0,1,0,0,1|0,0,2]=4 1159 B11R0.93 C=C(C)CNC(=O)CC(C)CC 11a_100000765925_100000708755 [0,0,1,0,0,1|0,0,2]=4 1160 B11R0.93 C=C(C)CNC(=O)CC(C)CC 1626a_100000765925_100000708755 [0,0,1,0,0,1|0,0,2]=4 1161 B11R0.93 C=C(C)CNC(=O)CC(C)CC 240690a_100000765925_100000708755 [0,0,1,0,0,1|0,0,2]=4 1162 B11R0.93 C=C(C)CNC(=O)CC(C)CC 527a_100000765925_100000708755 [0,0,1,0,0,1|0,0,2]=4 1163 B11R0.93 C=CC(C)CC(=O)CC=C(C)C 1458a_100011934298_100000761012 [0,0,1,0,0,1|0,0,2]=4 1164 B11R0.93 CC(=CCC(=O)C[C@@H](C)CO)C 1458a_100011220947_100000059175 [0,0,1,0,0,1|1,0,0]=3 1165 B11R0.93 CC(=CCC(=O)N[C@H](C)CF)C 11a_100102880703_100011220947 [0,0,1,0,0,1|2,0,0]=4 1166 B11R0.93 CC(=CCC(=O)N[C@H](C)CF)C 1626a_100102880703_100011220947 [0,0,1,0,0,1|2,0,0]=4 1167 B11R0.93 CC(=CCC(=O)N[C@H](C)CF)C 240690a_100102880703_100011220947 [0,0,1,0,0,1|2,0,0]=4 1168 B11R0.93 CC(=CCC(=O)N[C@H](C)CF)C 527a_100102880703_100011220947 [0,0,1,0,0,1|2,0,0]=4 1169 B11R0.93 CC(=CCC(=O)N[C@H](C)CO)C 240690a_100000737577_100011220947 [0,0,1,0,0,1|2,0,0]=4 1170 B11R0.93 CC(=CCC(=O)N[C@H](C)CO)C 527a_100000737577_100011220947 [0,0,1,0,0,1|2,0,0]=4 1171 B11R0.93 CC(C)C=CC(=O)C[C@@H](C)CO 1458a_100016268746_100000059175 [0,0,1,0,0,1|1,0,1]=4 1172 B11R0.93 CCC(=CC(=O)CC=C(C)C)C 1458a_100020758463_100000761012 [0,0,1,0,0,1|0,0,2]=4 1173 B11R0.93 CCC(=O)CC(=O)CC=C(C)C 1458a_100011220947_100000747405 [0,0,1,0,0,1|1,0,1]=4 1174 B11R0.93 CCC(C)CC(=O)C=CC(C)C 1458a_100016268746_100000748023 [0,0,1,0,0,1|0,0,1]=3 1175 B11R0.93 CCC(C)CC(=O)CC=C(C)C 1458a_100000708755_100000761012 [0,0,1,0,0,1|0,0,0]=2 1176 B11R0.93 CCC(C)CC(=O)CC=C(C)C 1458a_100011220947_100000748023 [0,0,1,0,0,1|0,0,0]=2 1177 B11R0.93 CCC(C)CC(=O)CCC(C)C 1458a_100000181311_100000748023 [0,0,1,0,0,1|0,0,2]=4 1178 B11R0.93 CCC(C)CC(=O)CCC(C)C 1458a_100000708755_100000210312 [0,0,1,0,0,1|0,0,2]=4 1179 B11R0.93 CCC(C)CC(=O)CC[S+](C)C 1458a_100009452791_100000748023 [0,0,1,0,0,1|1,0,1]=4 1180 B11R0.93 CCC(C)CC(=O)CNC(=O)C 1458a_100000194580_100000748023 [0,0,1,0,0,1|1,0,1]=4 1181 B11R0.93 CCC(C)CC(=O)COC(=O)C 1458a_100000183556_100000748023 [0,0,1,0,0,1|1,0,1]=4 1182 B11R0.93 CCC(C)CC(=O)COC(C)C 1458a_100000745533_100000748023 [0,0,1,0,0,1|0,0,2]=4 1183 B11R0.93 CCC(C)CC(=O)CSC(=O)C 1458a_100000049016_100000748023 [0,0,1,0,0,1|1,0,1]=4 1184 B11R0.93 CCC(C)CC(=O)CSC(C)C 1458a_100000241585_100000748023 [0,0,1,0,0,1|0,0,2]=4 1185 B11R0.93 CCC(C)CC(=O)NCC(C)C 11a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 1186 B11R0.93 CCC(C)CC(=O)NCC(C)C 1626a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 1187 B11R0.93 CCC(C)CC(=O)NCC(C)C 240690a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 1188 B11R0.93 CCC(C)CC(=O)NCC(C)C 527a_100000210953_100000708755 [0,0,1,0,0,1|0,0,2]=4 1189 B11R0.93 CCC(C)CC(=O)NNC(=O)C 22a_100000189765_100000708755 [0,0,1,0,0,1|2,0,0]=4 1190 B11R0.93 CCC(C)CC(=O)NNC(C)C 22a_100000741168_100000708755 [0,0,1,0,0,1|1,0,1]=4 1191 B11R0.93 CCC(C)CN(C)CC=C(C)C 2230a_100000753921_100000761012 [0,0,1,0,0,1|2,0,0]=4 1192 B11R0.93 CCC(C)CN(C)CC=C(C)C 269982a_100000753921_100000761012 [0,0,1,0,0,1|2,0,0]=4 1193 B11R0.93 CCC(C)NC(=O)C=CC(C)C 11a_100000209981_100016268746 [0,0,1,0,0,1|1,0,1]=4 1194 B11R0.93 CCC(C)NC(=O)C=CC(C)C 1626a_100000209981_100016268746 [0,0,1,0,0,1|1,0,1]=4 1195 B11R0.93 CCC(C)NC(=O)C=CC(C)C 240690a_100000209981_100016268746 [0,0,1,0,0,1|1,0,1]=4 1196 B11R0.93 CCC(C)NC(=O)CC=C(C)C 11a_100000209981_100011220947 [0,0,1,0,0,1|1,0,0]=3 1197 B11R0.93 CCC(C)NC(=O)CC=C(C)C 1626a_100000209981_100011220947 [0,0,1,0,0,1|1,0,0]=3 1198 B11R0.93 CCC(C)NC(=O)CC=C(C)C 240690a_100000209981_100011220947 [0,0,1,0,0,1|1,0,0]=3 1199 B11R0.93 CCC(C)NC(=O)CC=C(C)C 527a_100000209981_100011220947 [0,0,1,0,0,1|1,0,0]=3 1200 B11R0.93 CCC(O)CC(=O)C=CC(C)C 1458a_100016268746_100011218378 [0,0,1,0,0,1|1,0,1]=4 1201 B11R0.93 CCC(O)CC(=O)CC=C(C)C 1458a_100011220947_100011218378 [0,0,1,0,0,1|1,0,0]=3 1202 B11R0.93 CCC(O)CC(=O)CC=C(C)C 1458a_100011667805_100000761012 [0,0,1,0,0,1|1,0,0]=3 1203 B11R0.93 CCN(C)CC(=O)CC=C(C)C 1458a_100116209913_100000761012 [0,0,1,0,0,1|1,0,0]=3 1204 B11R0.93 CC[C@H](C)CC(=O)C=CC(C)C 1458a_100016268746_100009816398 [0,0,1,0,0,1|0,0,1]=3 1205 B11R0.93 CC[C@H](C)CC(=O)CC=C(C)C 1458a_100011220947_100009816398 [0,0,1,0,0,1|0,0,0]=2 1206 B11R0.93 CC[C@H](C)CC(=O)CCC(C)C 1458a_100000181311_100009816398 [0,0,1,0,0,1|0,0,2]=4 1207 B11R0.93 CC[C@H](C)CC(=O)CC[S+](C)C 1458a_100009452791_100009816398 [0,0,1,0,0,1|1,0,1]=4 1208 B11R0.93 CC[C@H](C)CC(=O)CNC(=O)C 1458a_100000194580_100009816398 [0,0,1,0,0,1|1,0,1]=4 1209 B11R0.93 CC[C@H](C)CC(=O)COC(=O)C 1458a_100000183556_100009816398 [0,0,1,0,0,1|1,0,1]=4 1210 B11R0.93 CC[C@H](C)CC(=O)COC(C)C 1458a_100000745533_100009816398 [0,0,1,0,0,1|0,0,2]=4 1211 B11R0.93 CC[C@H](C)CC(=O)CSC(=O)C 1458a_100000049016_100009816398 [0,0,1,0,0,1|1,0,1]=4 1212 B11R0.93 CC[C@H](C)CC(=O)CSC(C)C 1458a_100000241585_100009816398 [0,0,1,0,0,1|0,0,2]=4 1213 B11R0.107 C=C(C)CC(=O)CCC(C)CC 1458a_100000701222_100000748629 [0,0,1,0,0,1|0,0,2]=4 1214 B11R0.107 CC(=CC(=O)NCC(C)CO)C 240690a_100000744482_100000211388 [0,0,1,0,0,1|1,0,0]=3 1215 B11R0.107 CC(=CC(=O)NCC(C)CO)Cl 240690a_100000744482_200042562850 [0,0,1,0,0,1|2,0,0]=4 1216 B11R0.107 CC(=CC(=O)NC[C@@H](F)CO)C 240690a_100015665980_100000211388 [0,0,1,0,0,1|2,0,0]=4 1217 B11R0.107 CC(=CC(=O)NC[C@H](O)CO)C 240690a_100020644852_100000211388 [0,0,1,0,0,1|2,0,0]=4 1218 B11R0.107 CCC(C)CCC(=O)CC(C)C 1458a_100000701222_100000210624 [0,0,1,0,0,1|0,0,2]=4 1219 B11R0.107 CCC(C)CCC(=O)NC(C)C 11a_100138425928_100000701222 [0,0,1,0,0,1|1,0,1]=4 1220 B11R0.107 CCC(C)CCC(=O)NC(C)C 1626a_100138425928_100000701222 [0,0,1,0,0,1|1,0,1]=4 1221 B11R0.107 CCC(C)CCC(=O)NC(C)C 240690a_100138425928_100000701222 [0,0,1,0,0,1|1,0,1]=4 1222 B11R0.107 CCC(C)CCC(=O)NC(C)C 527a_100138425928_100000701222 [0,0,1,0,0,1|1,0,1]=4 1223 B11R0.107 CCC(C)CNC(=O)C=C(C)C 11a_100020588543_100000211388 [0,0,1,0,0,1|0,0,0]=2 1224 B11R0.107 CCC(C)CNC(=O)C=C(C)C 1626a_100020588543_100000211388 [0,0,1,0,0,1|0,0,0]=2 1225 B11R0.107 CCC(C)CNC(=O)C=C(C)C 240690a_100020588543_100000211388 [0,0,1,0,0,1|0,0,0]=2 1226 B11R0.107 CCC(C)CNC(=O)C=C(C)Cl 11a_100020588543_200042562850 [0,0,1,0,0,1|1,0,0]=3 1227 B11R0.107 CCC(C)CNC(=O)C=C(C)Cl 1626a_100020588543_200042562850 [0,0,1,0,0,1|1,0,0]=3 1228 B11R0.107 CCC(C)CNC(=O)C=C(C)Cl 240690a_100020588543_200042562850 [0,0,1,0,0,1|1,0,0]=3 1229 B11R0.107 CCC(C)CNC(=O)C=C(C)I 11a_100020588543_100025716642 [0,0,1,0,0,1|1,0,0]=3 1230 B11R0.107 CCC(C)CNC(=O)C=C(C)I 1626a_100020588543_100025716642 [0,0,1,0,0,1|1,0,0]=3 1231 B11R0.107 CCC(C)CNC(=O)C=C(Cl)Cl 1626a_100020588543_100000137448 [0,0,1,0,0,1|2,0,0]=4 1232 B11R0.107 CCC(C)CNC(=O)C=C(Cl)Cl 240690a_100020588543_100000137448 [0,0,1,0,0,1|2,0,0]=4 1233 B11R0.107 CCC(C)CNC(=O)CC(C)C 11a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 1234 B11R0.107 CCC(C)CNC(=O)CC(C)C 1626a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 1235 B11R0.107 CCC(C)CNC(=O)CC(C)C 240690a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 1236 B11R0.107 CCC(C)CNC(=O)CC(C)C 527a_100020588543_100000210554 [0,0,1,0,0,1|0,0,2]=4 1237 B11R0.107 CCC(C)CNC(=O)CN(C)C 11a_100020588543_100000750896 [0,0,1,0,0,1|1,0,1]=4 1238 B11R0.107 CCC(C)CNC(=O)CN(C)C 240690a_100020588543_100000750896 [0,0,1,0,0,1|1,0,1]=4 1239 B11R0.107 CCC(C)CNC(=O)CN(C)C 527a_100020588543_100000750896 [0,0,1,0,0,1|1,0,1]=4 1240 B11R0.107 CCC(C)CNC(=O)C[S+](C)C 11a_100020588543_200159257847 [0,0,1,0,0,1|1,0,1]=4 1241 B11R0.107 CCC(C)CNC(=O)C[S+](C)C 1626a_100020588543_200159257847 [0,0,1,0,0,1|1,0,1]=4 1242 B11R0.107 CCC(C)CNC(=O)C[S+](C)C 240690a_100020588543_200159257847 [0,0,1,0,0,1|1,0,1]=4 1243 B11R0.107 CCC(C)CNC(=O)C[S+](C)C 527a_100020588543_200159257847 [0,0,1,0,0,1|1,0,1]=4 1244 B11R0.107 CCC(C)CNC(=O)NC(C)C 2708a_100020588543_100138425928 [0,0,1,0,0,1|1,0,1]=4 1245 B11R0.107 CCC(C)CNC(=O)NC(C)C 2708a_100138425928_100020588543 [0,0,1,0,0,1|1,0,1]=4 1246 B11R0.107 CCC(C)CNC(=O)NC(C)C 273464a_100138425928_100020588543 [0,0,1,0,0,1|1,0,1]=4 1247 B11R0.107 CCC(C)CNC(=O)NC(C)C 512a_100020588543_100138425928 [0,0,1,0,0,1|1,0,1]=4 1248 B11R0.107 CCC(C)CNC(=O)NC(C)C 512a_100138425928_100020588543 [0,0,1,0,0,1|1,0,1]=4 1249 B11R0.107 CCC(C)COC(C)C=C(C)C 34a_100000717055_100000748023 [0,0,1,0,0,1|1,0,1]=4 1250 B11R0.107 CCC(C)NCC(=O)NC(C)C 2230a_100000168517_100000758301 [0,0,1,0,0,1|1,0,1]=4 1251 B11R0.107 CCC(C)NCC(=O)NC(C)C 2230a_100000209981_100000183996 [0,0,1,0,0,1|1,0,1]=4 1252 B11R0.107 CCC(C)NCC(=O)OC(C)C 2230a_100000209981_100011215430 [0,0,1,0,0,1|1,0,1]=4 1253 B11R0.107 CCC(C)NNC(=O)C=C(C)C 22a_100000718999_100000211388 [0,0,1,0,0,1|1,0,0]=3 1254 B11R0.107 CCC(C)NNC(=O)C=C(C)Cl 22a_100000718999_200042562850 [0,0,1,0,0,1|2,0,0]=4 1255 B11R0.107 CCC(C)OCC(=O)NC(=O)C 7a_100000210228_100000183797 [0,0,1,0,0,1|2,0,0]=4 1256 B11R0.107 CCC(C)OCC(=O)NC(C)C 7a_100000210228_100000183996 [0,0,1,0,0,1|1,0,1]=4 1257 B11R0.107 CCC(C)OCC(=O)OC(C)C 7a_100000210228_100011215430 [0,0,1,0,0,1|1,0,1]=4 1258 B11R0.107 CCC(C)SCC(=O)NC(=O)C 62a_100000758301_100000183797 [0,0,1,0,0,1|2,0,0]=4 1259 B11R0.107 CCC(C)SCC(=O)NC(C)C 62a_100000183996_100000758301 [0,0,1,0,0,1|1,0,1]=4 1260 B11R0.107 CCC(C)SCC(=O)NC(C)C 62a_100000758301_100000183996 [0,0,1,0,0,1|1,0,1]=4 1261 B11R0.107 CCC(C)SCC(=O)OC(C)C 62a_100000758301_100011215430 [0,0,1,0,0,1|1,0,1]=4 1262 B11R0.107 CCC(C)SCC(=O)OC(C)C 62a_100011215430_100000758301 [0,0,1,0,0,1|1,0,1]=4 1263 B11R0.107 CCC(O)CNC(=O)C=C(C)C 11a_100011218483_100000211388 [0,0,1,0,0,1|1,0,0]=3 1264 B11R0.107 CCC(O)CNC(=O)C=C(C)C 240690a_100011218483_100000211388 [0,0,1,0,0,1|1,0,0]=3 1265 B11R0.107 CCC(O)CNC(=O)C=C(C)Cl 11a_100011218483_200042562850 [0,0,1,0,0,1|2,0,0]=4 1266 B11R0.107 CCC(O)CNC(=O)C=C(C)Cl 240690a_100011218483_200042562850 [0,0,1,0,0,1|2,0,0]=4 1267 B11R0.107 CCC(O)CNC(=O)C=C(C)I 11a_100011218483_100025716642 [0,0,1,0,0,1|2,0,0]=4 1268 B11R0.107 CC[C@H](C)COC(C)C=C(C)C 34a_100000717055_100009816398 [0,0,1,0,0,1|1,0,1]=4 1269 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)C 11a_100020591295_100000211388 [0,0,1,0,0,1|1,0,0]=3 1270 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)C 1626a_100020591295_100000211388 [0,0,1,0,0,1|1,0,0]=3 1271 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)C 240690a_100020591295_100000211388 [0,0,1,0,0,1|1,0,0]=3 1272 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)Cl 11a_100020591295_200042562850 [0,0,1,0,0,1|2,0,0]=4 1273 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)Cl 1626a_100020591295_200042562850 [0,0,1,0,0,1|2,0,0]=4 1274 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)Cl 240690a_100020591295_200042562850 [0,0,1,0,0,1|2,0,0]=4 1275 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)I 11a_100020591295_100025716642 [0,0,1,0,0,1|2,0,0]=4 1276 B11R0.107 CO[C@H](C)CNC(=O)C=C(C)I 1626a_100020591295_100025716642 [0,0,1,0,0,1|2,0,0]=4 1277 B11R0.55 CCCC(=O)CN(CC)C(C)C 2230a_100000223864_100000747444 [0,0,1,0,0,1|1,0,1]=4 1278 B11R0.55 CCCC(=O)CN(CC)C(C)C 269982a_100000223864_100000747444 [0,0,1,0,0,1|1,0,1]=4 1279 B11R0.55 CCCC(=O)NC(CC)C(C)C 11a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 1280 B11R0.55 CCCC(=O)NC(CC)C(C)C 1626a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 1281 B11R0.55 CCCC(=O)NC(CC)C(C)C 240690a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 1282 B11R0.55 CCCC(=O)NC(CC)C(C)C 527a_100000745074_100000211992 [0,0,1,0,0,1|0,0,2]=4 1283 B11R0.56 C=C(C)CN(CC)C(=O)CCC 11a_100000211296_100000211992 [0,0,1,0,0,1|1,0,1]=4 1284 B11R0.56 C=C(C)CN(CC)C(=O)CCC 1626a_100000211296_100000211992 [0,0,1,0,0,1|1,0,1]=4 1285 B11R0.56 C=C(C)CN(CC)C(=O)CCC 527a_100000211296_100000211992 [0,0,1,0,0,1|1,0,1]=4 1286 B11R0.56 CCCC(=O)C(CC)NC(=O)C 1458a_100000195128_100000210303 [0,0,1,0,0,1|1,0,1]=4 1287 B11R0.56 CCCC(=O)N(CC)CC(C)C 11a_100000738554_100000211992 [0,0,1,0,0,1|1,0,1]=4 1288 B11R0.56 CCCC(=O)N(CC)CC(C)C 1626a_100000738554_100000211992 [0,0,1,0,0,1|1,0,1]=4 1289 B11R0.56 CCCC(=O)N(CC)CC(C)C 240690a_100000738554_100000211992 [0,0,1,0,0,1|1,0,1]=4 1290 B11R0.56 CCCC(=O)N(CC)CC(C)C 527a_100000738554_100000211992 [0,0,1,0,0,1|1,0,1]=4 1291 B11R1.20 CC(=O)C=C1CCC(CC1)C 1458a_100000756110_200000210301 [1,0,0,0,0,1|1,0,1]=4 1292 B11R1.20 CC1CCC(=CC(=O)[13CH3])CC1 1458a_100000756110_200025704644 [1,0,0,0,0,1|1,0,1]=4 1293 B11R1.86 CC(C)NC1CCCCC1=O 34a_100138425928_100000754470 [1,0,0,0,0,1|0,0,2]=4 1294 B11R1.86 CC(C)OC1CCCCC1=O 34a_100000212225_100000754470 [1,0,0,0,0,1|0,0,2]=4 1295 B11R1.86 CC(C)OC1CCCCC1=O 34a_100011214950_100000210206 [1,0,0,0,0,1|0,0,2]=4 1296 B11R1.86 CC(C)SC1CCCCC1=O 62a_100000204591_100000210206 [1,0,0,0,0,1|0,0,2]=4 1297 B11R1.86 CC(C)SC1CCCCC1=O 62a_100000210206_100000204591 [1,0,0,0,0,1|0,0,2]=4