0 B15R1.86 C#Cc1ccccc1C(=O)CCC(C)C 1458a_100011243808_100000210312 [0,0,0,0,0,0|2,0,1]=3 1 B15R1.86 C#Cc1ccccc1C(=O)CCC(C)O 1458a_100011243808_100012276601 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.86 C#Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100011243808 [0,0,0,0,0,0|2,0,1]=3 3 B15R1.86 C#Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100011243808 [0,0,0,0,0,0|3,0,1]=4 4 B15R1.86 C#Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100011243808 [0,0,0,0,0,0|3,0,1]=4 5 B15R1.86 C=C(C)CCC(=O)c1ccccc1CC 1458a_100000689120_100000730704 [0,0,0,0,0,0|2,0,2]=4 6 B15R1.86 C=C(C)CCC(=O)c1ccccc1OC 1458a_100000185835_100000730704 [0,0,0,0,0,0|2,0,2]=4 7 B15R1.86 C=C(C)CCC(=O)c1ccccc1SC 1458a_100000183967_100000730704 [0,0,0,0,0,0|2,0,2]=4 8 B15R1.86 C=C(C)CNC(=O)c1ccccc1CC 11a_100000765925_100000689120 [0,0,0,0,0,0|2,0,2]=4 9 B15R1.86 C=C(C)CNC(=O)c1ccccc1CC 1626a_100000765925_100000689120 [0,0,0,0,0,0|2,0,2]=4 10 B15R1.86 C=C(C)CNC(=O)c1ccccc1CC 240690a_100000765925_100000689120 [0,0,0,0,0,0|2,0,2]=4 11 B15R1.86 C=C(C)CNC(=O)c1ccccc1CC 527a_100000765925_100000689120 [0,0,0,0,0,0|2,0,2]=4 12 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 11a_100000765925_100000185835 [0,0,0,0,0,0|2,0,2]=4 13 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 1626a_100000765925_100000185835 [0,0,0,0,0,0|2,0,2]=4 14 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 240690a_100000765925_100000185835 [0,0,0,0,0,0|2,0,2]=4 15 B15R1.86 C=C(C)CNC(=O)c1ccccc1OC 527a_100000765925_100000185835 [0,0,0,0,0,0|2,0,2]=4 16 B15R1.86 C=C(C)CNC(=O)c1ccccc1SC 11a_100000765925_100000183967 [0,0,0,0,0,0|2,0,2]=4 17 B15R1.86 C=C(C)CNC(=O)c1ccccc1SC 1626a_100000765925_100000183967 [0,0,0,0,0,0|2,0,2]=4 18 B15R1.86 C=C(C)CNC(=O)c1ccccc1SC 240690a_100000765925_100000183967 [0,0,0,0,0,0|2,0,2]=4 19 B15R1.86 C=C(C)CNC(=O)c1ccccc1SC 527a_100000765925_100000183967 [0,0,0,0,0,0|2,0,2]=4 20 B15R1.86 C=Cc1ccccc1C(=O)CCC(C)C 1458a_100011830265_100000210312 [0,0,0,0,0,0|2,0,1]=3 21 B15R1.86 C=Cc1ccccc1C(=O)CCC(C)O 1458a_100011830265_100012276601 [0,0,0,0,0,0|3,0,1]=4 22 B15R1.86 C=Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100011830265 [0,0,0,0,0,0|2,0,1]=3 23 B15R1.86 C=Cc1ccccc1C(=O)NCC(C)C 271570a_100011290941_200000155729 [0,0,0,0,0,0|2,0,1]=3 24 B15R1.86 C=Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100011830265 [0,0,0,0,0,0|3,0,1]=4 25 B15R1.86 C=Cc1ccccc1C(=O)OCC(=O)C 271570a_100011290941_201991511838 [0,0,0,0,0,0|2,0,2]=4 26 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_200025704644_201991511838 [0,0,0,0,0,0|2,0,1]=3 27 B15R1.86 CC(=O)COC(=O)c1ccccc1S[13CH3] 62a_201991511838_200025704644 [0,0,0,0,0,0|2,0,1]=3 28 B15R1.86 CC(C)CCC(=O)c1ccccc1C#N 1458a_100000742908_100000210312 [0,0,0,0,0,0|3,0,0]=3 29 B15R1.86 CC(C)CCC(=O)c1ccccc1CO 1458a_100011301526_100000210312 [0,0,0,0,0,0|3,0,0]=3 30 B15R1.86 CC(C)CCC(=O)c1ccccc1I=O 1458a_100000032414_100000210312 [0,0,0,0,0,0|3,0,0]=3 31 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 11a_100000210953_100000742908 [0,0,0,0,0,0|3,0,0]=3 32 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 1626a_100000210953_100000742908 [0,0,0,0,0,0|3,0,0]=3 33 B15R1.86 CC(C)CNC(=O)c1ccccc1C#N 527a_100000210953_100000742908 [0,0,0,0,0,0|3,0,0]=3 34 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 1626a_100000210953_100000032414 [0,0,0,0,0,0|3,0,0]=3 35 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 240690a_100000210953_100000032414 [0,0,0,0,0,0|3,0,0]=3 36 B15R1.86 CC(C)CNC(=O)c1ccccc1I=O 527a_100000210953_100000032414 [0,0,0,0,0,0|3,0,0]=3 37 B15R1.86 CC(C)CNC(=O)c1ccccc1N[13CH3] 2230a_100000180285_200025704644 [0,0,0,0,0,0|1,0,0]=1 38 B15R1.86 CC(C)CNC(=O)c1ccccc1N[13CH3] 34a_100000180285_200025704644 [0,0,0,0,0,0|1,0,0]=1 39 B15R1.86 CC(C)CNC(=O)c1ccccc1S[13CH3] 62a_200000155729_200025704644 [0,0,0,0,0,0|2,0,0]=2 40 B15R1.86 CC(C)CNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000155729 [0,0,0,0,0,0|2,0,0]=2 41 B15R1.86 CC(C)COC(=O)c1ccccc1O[13CH3] 34a_100000005792_200025704644 [0,0,0,0,0,0|1,0,0]=1 42 B15R1.86 CC(C)COC(=O)c1ccccc1O[13CH3] 7a_100000005792_200025704644 [0,0,0,0,0,0|1,0,0]=1 43 B15R1.86 CC(C)NNC(=O)c1ccccc1C#N 22a_100000741168_100000742908 [0,0,0,0,0,0|4,0,0]=4 44 B15R1.86 CC(C)NNC(=O)c1ccccc1I=O 22a_100000741168_100000032414 [0,0,0,0,0,0|4,0,0]=4 45 B15R1.86 CC(O)CCC(=O)c1ccccc1C#N 1458a_100000742908_100012276601 [0,0,0,0,0,0|4,0,0]=4 46 B15R1.86 CC(O)CCC(=O)c1ccccc1CO 1458a_100011301526_100012276601 [0,0,0,0,0,0|4,0,0]=4 47 B15R1.86 CC(O)CCC(=O)c1ccccc1I=O 1458a_100000032414_100012276601 [0,0,0,0,0,0|4,0,0]=4 48 B15R1.86 CC(O)CNC(=O)c1ccccc1C#N 11a_100000210904_100000742908 [0,0,0,0,0,0|4,0,0]=4 49 B15R1.86 CC(O)CNC(=O)c1ccccc1C#N 527a_100000210904_100000742908 [0,0,0,0,0,0|4,0,0]=4 50 B15R1.86 CC(O)CNC(=O)c1ccccc1I=O 240690a_100000210904_100000032414 [0,0,0,0,0,0|4,0,0]=4 51 B15R1.86 CC(O)CNC(=O)c1ccccc1I=O 527a_100000210904_100000032414 [0,0,0,0,0,0|4,0,0]=4 52 B15R1.86 CCc1ccccc1C(=O)CC=C(C)C 1458a_100000689120_100000761012 [0,0,0,0,0,0|2,0,2]=4 53 B15R1.86 CCc1ccccc1C(=O)CCC(C)C 1458a_100000689120_100000210312 [0,0,0,0,0,0|2,0,0]=2 54 B15R1.86 CCc1ccccc1C(=O)CCC(C)O 1458a_100000689120_100012276601 [0,0,0,0,0,0|3,0,0]=3 55 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000689120 [0,0,0,0,0,0|2,0,0]=2 56 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000689120 [0,0,0,0,0,0|2,0,0]=2 57 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000689120 [0,0,0,0,0,0|2,0,0]=2 58 B15R1.86 CCc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000689120 [0,0,0,0,0,0|2,0,0]=2 59 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000689120 [0,0,0,0,0,0|3,0,0]=3 60 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000689120 [0,0,0,0,0,0|3,0,0]=3 61 B15R1.86 CCc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000689120 [0,0,0,0,0,0|3,0,0]=3 62 B15R1.86 CCc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000689120 [0,0,0,0,0,0|4,0,0]=4 63 B15R1.86 CCc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000689120 [0,0,0,0,0,0|4,0,0]=4 64 B15R1.86 CCc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000689120 [0,0,0,0,0,0|4,0,0]=4 65 B15R1.86 CCc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000689120 [0,0,0,0,0,0|4,0,0]=4 66 B15R1.86 CCc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000689120 [0,0,0,0,0,0|3,0,0]=3 67 B15R1.86 CNc1ccccc1C(=NNC(C)C)C 4a_100000741168_100000020593 [0,0,0,0,0,0|3,0,0]=3 68 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_200000210301 [0,0,0,0,0,0|1,0,0]=1 69 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 27a_100102657272_200000155729 [0,0,0,0,0,0|1,0,0]=1 70 B15R1.86 CNc1ccccc1C(=O)NCC(C)C 34a_100000180285_200000210301 [0,0,0,0,0,0|1,0,0]=1 71 B15R1.86 COc1ccccc1C(=NNC(C)C)C 4a_100000741168_100000173324 [0,0,0,0,0,0|4,0,0]=4 72 B15R1.86 COc1ccccc1C(=O)CC=C(C)C 1458a_100000185835_100000761012 [0,0,0,0,0,0|2,0,2]=4 73 B15R1.86 COc1ccccc1C(=O)CCC(C)C 1458a_100000185835_100000210312 [0,0,0,0,0,0|2,0,0]=2 74 B15R1.86 COc1ccccc1C(=O)CCC(C)O 1458a_100000185835_100012276601 [0,0,0,0,0,0|3,0,0]=3 75 B15R1.86 COc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000195505 [0,0,0,0,0,0|3,0,0]=3 76 B15R1.86 COc1ccccc1C(=O)COC(C)C 34a_100000212225_100000195505 [0,0,0,0,0,0|3,0,0]=3 77 B15R1.86 COc1ccccc1C(=O)CSC(C)C 62a_100000195505_100000210206 [0,0,0,0,0,0|3,0,0]=3 78 B15R1.86 COc1ccccc1C(=O)NCC(=O)C 1458a_100000183908_200000210301 [0,0,0,0,0,0|3,0,1]=4 79 B15R1.86 COc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000183908_200025704644 [0,0,0,0,0,0|3,0,1]=4 80 B15R1.86 COc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000185835 [0,0,0,0,0,0|2,0,0]=2 81 B15R1.86 COc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000185835 [0,0,0,0,0,0|2,0,0]=2 82 B15R1.86 COc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000185835 [0,0,0,0,0,0|2,0,0]=2 83 B15R1.86 COc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000185835 [0,0,0,0,0,0|2,0,0]=2 84 B15R1.86 COc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000185835 [0,0,0,0,0,0|3,0,0]=3 85 B15R1.86 COc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000185835 [0,0,0,0,0,0|3,0,0]=3 86 B15R1.86 COc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000185835 [0,0,0,0,0,0|3,0,0]=3 87 B15R1.86 COc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000185835 [0,0,0,0,0,0|4,0,0]=4 88 B15R1.86 COc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000185835 [0,0,0,0,0,0|4,0,0]=4 89 B15R1.86 COc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000185835 [0,0,0,0,0,0|4,0,0]=4 90 B15R1.86 COc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000185835 [0,0,0,0,0,0|4,0,0]=4 91 B15R1.86 COc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000185835 [0,0,0,0,0,0|3,0,0]=3 92 B15R1.86 COc1ccccc1C(=O)OCC(C)C 34a_100000005792_200000210301 [0,0,0,0,0,0|1,0,0]=1 93 B15R1.86 COc1ccccc1C(=O)OCC(C)C 7a_100000005792_200000210301 [0,0,0,0,0,0|1,0,0]=1 94 B15R1.86 COc1ccccc1C(C)NCC(C)C 2230a_100000185323_100000210760 [0,0,0,0,0,0|3,0,1]=4 95 B15R1.86 COc1ccccc1C(C)NCC(C)C 269862a_100000210953_100000173324 [0,0,0,0,0,0|3,0,1]=4 96 B15R1.86 COc1ccccc1C(C)NCC(C)C 270004a_100000185323_100000210432 [0,0,0,0,0,0|3,0,1]=4 97 B15R1.86 COc1ccccc1C(C)OCC(C)C 7a_100000742714_100000210760 [0,0,0,0,0,0|2,0,1]=3 98 B15R1.86 COc1ccccc1C(C)OCC(C)O 7a_100000742714_100011218427 [0,0,0,0,0,0|3,0,1]=4 99 B15R1.86 COc1ccccc1C(C)OC[C@@H](C)O 7a_100000742714_100009817552 [0,0,0,0,0,0|3,0,1]=4 100 B15R1.86 COc1ccccc1N(C)CCC(C)C 2230a_100000219746_100000210312 [0,0,0,0,0,0|4,0,0]=4 101 B15R1.86 COc1ccccc1N(C)CCC(C)C 269982a_100000219746_100000210312 [0,0,0,0,0,0|4,0,0]=4 102 B15R1.86 COc1ccccc1N(C)CCC(C)C 34a_100000219746_100000210312 [0,0,0,0,0,0|4,0,0]=4 103 B15R1.86 CSc1ccccc1C(=O)CC=C(C)C 1458a_100000183967_100000761012 [0,0,0,0,0,0|2,0,2]=4 104 B15R1.86 CSc1ccccc1C(=O)CCC(C)C 1458a_100000183967_100000210312 [0,0,0,0,0,0|2,0,0]=2 105 B15R1.86 CSc1ccccc1C(=O)CCC(C)O 1458a_100000183967_100012276601 [0,0,0,0,0,0|3,0,0]=3 106 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000183967 [0,0,0,0,0,0|2,0,0]=2 107 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000183967 [0,0,0,0,0,0|2,0,0]=2 108 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000183967 [0,0,0,0,0,0|2,0,0]=2 109 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000183967 [0,0,0,0,0,0|2,0,0]=2 110 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 62a_200000155729_200000210301 [0,0,0,0,0,0|2,0,0]=2 111 B15R1.86 CSc1ccccc1C(=O)NCC(C)C 62a_200000210301_200000155729 [0,0,0,0,0,0|2,0,0]=2 112 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000183967 [0,0,0,0,0,0|3,0,0]=3 113 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000183967 [0,0,0,0,0,0|3,0,0]=3 114 B15R1.86 CSc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000183967 [0,0,0,0,0,0|3,0,0]=3 115 B15R1.86 CSc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000183967 [0,0,0,0,0,0|4,0,0]=4 116 B15R1.86 CSc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000183967 [0,0,0,0,0,0|4,0,0]=4 117 B15R1.86 CSc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000183967 [0,0,0,0,0,0|4,0,0]=4 118 B15R1.86 CSc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000183967 [0,0,0,0,0,0|4,0,0]=4 119 B15R1.86 CSc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000183967 [0,0,0,0,0,0|3,0,0]=3 120 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_200000210301_201991511838 [0,0,0,0,0,0|2,0,1]=3 121 B15R1.86 CSc1ccccc1C(=O)OCC(=O)C 62a_201991511838_200000210301 [0,0,0,0,0,0|2,0,1]=3 122 B14R1.96 C#Cc1ccccc1COCC(C)C 34a_100000054652_100000210624 [1,0,0,0,0,0|1,0,2]=4 123 B14R1.96 C#Cc1ccccc1COCC(C)C 7a_100000054652_100000210760 [1,0,0,0,0,0|1,0,2]=4 124 B14R1.96 C=Cc1ccccc1COCC(C)C 34a_200010883148_100000210624 [1,0,0,0,0,0|1,0,2]=4 125 B14R1.96 C=Cc1ccccc1COCC(C)C 7a_200010883148_100000210760 [1,0,0,0,0,0|1,0,2]=4 126 B14R1.96 CC(C)CC=Cc1ccccc1C#N 271570a_100016259101_100000188569 [1,0,0,0,0,0|3,0,0]=4 127 B14R1.96 CC(C)CC=Cc1ccccc1C=O 271570a_100016259101_100000211189 [1,0,0,0,0,0|3,0,0]=4 128 B14R1.96 CC(C)CC=Cc1ccccc1CN 271570a_100016259101_100000689332 [1,0,0,0,0,0|3,0,0]=4 129 B14R1.96 CC(C)CC=Cc1ccccc1CO 271570a_100016259101_100000187465 [1,0,0,0,0,0|3,0,0]=4 130 B14R1.96 CC(C)CC=Cc1ccccc1NN 271570a_100016259101_100000241748 [1,0,0,0,0,0|2,0,0]=3 131 B14R1.96 CC(C)CC=Cc1cccnc1NN 271570a_100016259101_100011464834 [1,0,0,0,0,0|3,0,0]=4 132 B14R1.96 CC(C)CC=Cc1cnccc1NN 271570a_100016259101_100013404636 [1,0,0,0,0,0|3,0,0]=4 133 B14R1.96 CC(C)CCSc1ccccc1NN 62a_100000210312_100000241748 [1,0,0,0,0,0|3,0,0]=4 134 B14R1.96 CC(C)CCSc1ccccc1NN 62a_100000241748_100000210312 [1,0,0,0,0,0|3,0,0]=4 135 B14R1.96 CC(C)COCc1ccccc1C#N 34a_100000210257_100000181865 [1,0,0,0,0,0|2,0,1]=4 136 B14R1.96 CC(C)COCc1ccccc1C#N 34a_200011269968_100000210624 [1,0,0,0,0,0|2,0,1]=4 137 B14R1.96 CC(C)COCc1ccccc1C#N 7a_200011269968_100000210760 [1,0,0,0,0,0|2,0,1]=4 138 B14R1.96 CC(C)COCc1ccccc1C=O 34a_100000210257_200009853537 [1,0,0,0,0,0|2,0,1]=4 139 B14R1.96 CC(C)COCc1ccccc1CBr 34a_100009816955_100000210624 [1,0,0,0,0,0|2,0,1]=4 140 B14R1.96 CC(C)COCc1ccccc1CBr 7a_100009816955_100000210760 [1,0,0,0,0,0|2,0,1]=4 141 B14R1.96 CC(C)COCc1ccccc1CN 34a_100000743596_100000210624 [1,0,0,0,0,0|2,0,1]=4 142 B14R1.96 CC(C)COCc1ccccc1CO 34a_100000210257_100009816955 [1,0,0,0,0,0|2,0,1]=4 143 B14R1.96 CCc1ccccc1C=CCC(C)C 271570a_100016259101_100011215823 [1,0,0,0,0,0|2,0,0]=3 144 B14R1.96 CCc1ccccc1C=NNC(C)C 4a_100000741168_100011219594 [1,0,0,0,0,0|3,0,0]=4 145 B14R1.96 CCc1ccccc1CNCC(C)C 207a_100000210953_100011219594 [1,0,0,0,0,0|2,0,1]=4 146 B14R1.96 CCc1ccccc1CNCC(C)C 270004a_100000210953_100011219594 [1,0,0,0,0,0|2,0,1]=4 147 B14R1.96 CCc1ccccc1COCC(C)C 34a_100011663872_100000210624 [1,0,0,0,0,0|1,0,1]=3 148 B14R1.96 CCc1ccccc1COCC(C)C 7a_100011663872_100000210760 [1,0,0,0,0,0|1,0,1]=3 149 B14R1.96 CCc1ccccc1COCC(C)O 34a_100011663872_100011218427 [1,0,0,0,0,0|2,0,1]=4 150 B14R1.96 CCc1ccccc1COCC(C)O 7a_100011663872_100011218427 [1,0,0,0,0,0|2,0,1]=4 151 B14R1.96 CCc1ccccc1COC[C@@H](C)O 34a_100011663872_100009817552 [1,0,0,0,0,0|2,0,1]=4 152 B14R1.96 CCc1ccccc1COC[C@@H](C)O 7a_100011663872_100009817552 [1,0,0,0,0,0|2,0,1]=4 153 B14R1.96 CCc1ccccc1NCCC(C)C 2230a_100000212081_100000210312 [1,0,0,0,0,0|3,0,0]=4 154 B14R1.96 CCc1ccccc1NCCC(C)C 34a_100000212081_100000210312 [1,0,0,0,0,0|3,0,0]=4 155 B14R1.96 CCc1ccccc1NCCC(C)C 7a_100000212081_100000210626 [1,0,0,0,0,0|3,0,0]=4 156 B14R1.96 CCc1ccccc1OCCC(C)C 34a_100000210936_100000210312 [1,0,0,0,0,0|3,0,0]=4 157 B14R1.96 CCc1ccccc1OCCC(C)C 7a_100000210936_100000210626 [1,0,0,0,0,0|3,0,0]=4 158 B14R1.96 CCc1ccccc1SCCC(C)C 62a_100000210312_100011215823 [1,0,0,0,0,0|3,0,0]=4 159 B14R1.96 CCc1ccccc1SCCC(C)C 62a_100011215823_100000210312 [1,0,0,0,0,0|3,0,0]=4 160 B14R1.96 CCc1ccncc1C=CCC(C)C 271570a_100016259101_100009819861 [1,0,0,0,0,0|3,0,0]=4 161 B14R1.96 CCc1cnccc1C=CCC(C)C 271570a_100016259101_100025704421 [1,0,0,0,0,0|3,0,0]=4 162 B14R1.96 CCc1ncccc1C=CCC(C)C 271570a_100016259101_100009877225 [1,0,0,0,0,0|3,0,0]=4 163 B14R1.96 CNc1ccccc1C=CCC(C)C 271570a_100016259101_100020606079 [1,0,0,0,0,0|1,0,0]=2 164 B14R1.96 CNc1ccccc1OCCC(C)C 34a_100000033821_100000210312 [1,0,0,0,0,0|2,0,0]=3 165 B14R1.96 CNc1ccccc1OCCC(C)O 34a_100000033821_100012276601 [1,0,0,0,0,0|3,0,0]=4 166 B14R1.96 CNc1ccccc1OCOC(C)C 34a_100000033821_100000709892 [1,0,0,0,0,0|3,0,0]=4 167 B14R1.96 CNc1ccccc1SCCC(C)C 62a_100000210312_100020606079 [1,0,0,0,0,0|2,0,0]=3 168 B14R1.96 CNc1ccccc1SCCC(C)C 62a_100020606079_100000210312 [1,0,0,0,0,0|2,0,0]=3 169 B14R1.96 CNc1ccccc1SCCC(C)O 62a_100012276601_100020606079 [1,0,0,0,0,0|3,0,0]=4 170 B14R1.96 CNc1ccccc1SCCC(C)O 62a_100020606079_100012276601 [1,0,0,0,0,0|3,0,0]=4 171 B14R1.96 CNc1ccccc1SCCN(C)C 62a_100020606079_100000755713 [1,0,0,0,0,0|3,0,0]=4 172 B14R1.96 CNc1ccccc1SCOC(C)C 62a_100000709892_100020606079 [1,0,0,0,0,0|3,0,0]=4 173 B14R1.96 CNc1ccccc1SCOC(C)C 62a_100020606079_100000709892 [1,0,0,0,0,0|3,0,0]=4 174 B14R1.96 CNc1cccnc1C=CCC(C)C 271570a_100016259101_200011806188 [1,0,0,0,0,0|2,0,0]=3 175 B14R1.96 CNc1cccnc1SCCC(C)C 62a_100000210312_200011806188 [1,0,0,0,0,0|3,0,0]=4 176 B14R1.96 CNc1ccncc1C=CCC(C)C 271570a_100016259101_100010069531 [1,0,0,0,0,0|2,0,0]=3 177 B14R1.96 CNc1ccncc1SCCC(C)C 62a_100000210312_100010069531 [1,0,0,0,0,0|3,0,0]=4 178 B14R1.96 CNc1ccncc1SCCC(C)C 62a_100010069531_100000210312 [1,0,0,0,0,0|3,0,0]=4 179 B14R1.96 CNc1ncccc1C=CCC(C)C 271570a_100016259101_100000700899 [1,0,0,0,0,0|2,0,0]=3 180 B14R1.96 CNc1ncccc1SCCC(C)C 62a_100000210312_100000700899 [1,0,0,0,0,0|3,0,0]=4 181 B14R1.96 CNc1ncccc1SCCC(C)C 62a_100000700899_100000210312 [1,0,0,0,0,0|3,0,0]=4 182 B14R1.96 CNc1nccnc1C=CCC(C)C 271570a_100016259101_100011529439 [1,0,0,0,0,0|3,0,0]=4 183 B14R1.96 CNc1ncncc1C=CCC(C)C 271570a_100016259101_200012180720 [1,0,0,0,0,0|3,0,0]=4 184 B14R1.96 COc1ccccc1C=CCC(C)C 271570a_100016259101_100000174000 [1,0,0,0,0,0|2,0,0]=3 185 B14R1.96 COc1ccccc1C=CCN(C)C 270004a_100102631434_100000210733 [1,0,0,0,0,0|3,0,0]=4 186 B14R1.96 COc1ccccc1C=NNC(C)C 4a_100000741168_100000169842 [1,0,0,0,0,0|3,0,0]=4 187 B14R1.96 COc1ccccc1CNCC(C)C 207a_100000210953_100000169842 [1,0,0,0,0,0|2,0,1]=4 188 B14R1.96 COc1ccccc1CNCC(C)C 2230a_100000210953_100000210004 [1,0,0,0,0,0|2,0,1]=4 189 B14R1.96 COc1ccccc1CNCC(C)C 270004a_100000188900_100000210432 [1,0,0,0,0,0|2,0,1]=4 190 B14R1.96 COc1ccccc1CNCC(C)C 270004a_100000210953_100000169842 [1,0,0,0,0,0|2,0,1]=4 191 B14R1.96 COc1ccccc1CNCC(C)C 34a_100000188900_100000210624 [1,0,0,0,0,0|2,0,1]=4 192 B14R1.96 COc1ccccc1CNCC(C)C 34a_100000210953_100000210004 [1,0,0,0,0,0|2,0,1]=4 193 B14R1.96 COc1ccccc1COCC(C)Br 34a_100012180447_100000210004 [1,0,0,0,0,0|2,0,1]=4 194 B14R1.96 COc1ccccc1COCC(C)C 34a_100000210257_100000210004 [1,0,0,0,0,0|1,0,1]=3 195 B14R1.96 COc1ccccc1COCC(C)C 34a_100000211301_100000210624 [1,0,0,0,0,0|1,0,1]=3 196 B14R1.96 COc1ccccc1COCC(C)F 34a_100015925927_100000210004 [1,0,0,0,0,0|2,0,1]=4 197 B14R1.96 COc1ccccc1COCC(C)O 34a_100000211301_100011218427 [1,0,0,0,0,0|2,0,1]=4 198 B14R1.96 COc1ccccc1COC[C@@H](C)Cl 34a_100016084084_100000210004 [1,0,0,0,0,0|2,0,1]=4 199 B14R1.96 COc1ccccc1COC[C@@H](C)N 34a_100000737577_100000210004 [1,0,0,0,0,0|2,0,1]=4 200 B14R1.96 COc1ccccc1COC[C@@H](C)O 34a_100000211301_100009817552 [1,0,0,0,0,0|2,0,1]=4 201 B14R1.96 COc1ccccc1CSCC(C)C 62a_100000210004_100000210760 [1,0,0,0,0,0|1,1,1]=4 202 B14R1.96 COc1ccccc1CSCC(C)C 62a_100000210624_100000210004 [1,0,0,0,0,0|1,1,1]=4 203 B14R1.96 COc1ccccc1NCCC(C)C 34a_100000210025_100000210312 [1,0,0,0,0,0|3,0,0]=4 204 B14R1.96 COc1ccccc1OCCC(C)C 34a_100000210385_100000210312 [1,0,0,0,0,0|3,0,0]=4 205 B14R1.96 COc1ccccc1SCCC(C)C 62a_100000210312_100000210334 [1,0,0,0,0,0|3,0,0]=4 206 B14R1.96 COc1ccccc1SCCC(C)C 62a_100000210334_100000210312 [1,0,0,0,0,0|3,0,0]=4 207 B14R1.96 COc1cccnc1C=CCC(C)C 271570a_100016259101_100000690851 [1,0,0,0,0,0|3,0,0]=4 208 B14R1.96 COc1cccnc1COCC(C)C 34a_100011998681_100000210624 [1,0,0,0,0,0|2,0,1]=4 209 B14R1.96 COc1ccncc1C=CCC(C)C 271570a_100016259101_100011997281 [1,0,0,0,0,0|3,0,0]=4 210 B14R1.96 COc1cnccc1C=CCC(C)C 271570a_100016259101_100016988167 [1,0,0,0,0,0|3,0,0]=4 211 B14R1.96 COc1ncccc1C=CCC(C)C 271570a_100016259101_100000047025 [1,0,0,0,0,0|3,0,0]=4 212 B14R1.96 COc1ncccc1COCC(C)C 34a_100000210257_100020631285 [1,0,0,0,0,0|2,0,1]=4 213 B14R1.96 COc1ncccc1COCC(C)C 34a_100000717863_100000210624 [1,0,0,0,0,0|2,0,1]=4 214 B14R1.96 CSc1ccccc1C=CCC(C)C 271570a_100016259101_100011217816 [1,0,0,0,0,0|2,0,0]=3 215 B14R1.96 CSc1ccccc1C=NNC(C)C 4a_100000741168_100011217347 [1,0,0,0,0,0|3,0,0]=4 216 B14R1.96 CSc1ccccc1CNCC(C)C 207a_100000210953_100011217347 [1,0,0,0,0,0|2,0,1]=4 217 B14R1.96 CSc1ccccc1CNCC(C)C 2230a_100000210953_100000699184 [1,0,0,0,0,0|2,0,1]=4 218 B14R1.96 CSc1ccccc1CNCC(C)C 270004a_100000210953_100011217347 [1,0,0,0,0,0|2,0,1]=4 219 B14R1.96 CSc1ccccc1CNCC(C)C 270004a_102495365025_100000210432 [1,0,0,0,0,0|2,0,1]=4 220 B14R1.96 CSc1ccccc1CNCC(C)C 34a_100000210953_100000699184 [1,0,0,0,0,0|2,0,1]=4 221 B14R1.96 CSc1ccccc1CNCC(C)C 34a_102495365025_100000210624 [1,0,0,0,0,0|2,0,1]=4 222 B14R1.96 CSc1ccccc1COCC(C)Br 34a_100012180447_100000699184 [1,0,0,0,0,0|2,0,1]=4 223 B14R1.96 CSc1ccccc1COCC(C)C 34a_100000210257_100000699184 [1,0,0,0,0,0|1,0,1]=3 224 B14R1.96 CSc1ccccc1COCC(C)C 34a_100000699167_100000210624 [1,0,0,0,0,0|1,0,1]=3 225 B14R1.96 CSc1ccccc1COCC(C)F 34a_100015925927_100000699184 [1,0,0,0,0,0|2,0,1]=4 226 B14R1.96 CSc1ccccc1COCC(C)O 34a_100000699167_100011218427 [1,0,0,0,0,0|2,0,1]=4 227 B14R1.96 CSc1ccccc1COC[C@@H](C)Cl 34a_100016084084_100000699184 [1,0,0,0,0,0|2,0,1]=4 228 B14R1.96 CSc1ccccc1COC[C@@H](C)N 34a_100000737577_100000699184 [1,0,0,0,0,0|2,0,1]=4 229 B14R1.96 CSc1ccccc1COC[C@@H](C)O 34a_100000699167_100009817552 [1,0,0,0,0,0|2,0,1]=4 230 B14R1.96 CSc1ccccc1CSCC(C)C 62a_100000210624_100000699184 [1,0,0,0,0,0|1,1,1]=4 231 B14R1.96 CSc1ccccc1CSCC(C)C 62a_100000699184_100000210760 [1,0,0,0,0,0|1,1,1]=4 232 B14R1.96 CSc1ccccc1NCCC(C)C 34a_100000211160_100000210312 [1,0,0,0,0,0|3,0,0]=4 233 B14R1.96 CSc1ccccc1OCCC(C)C 34a_100011216402_100000210312 [1,0,0,0,0,0|3,0,0]=4 234 B14R1.96 CSc1ccccc1SCCC(C)C 62a_100000210312_100011217816 [1,0,0,0,0,0|3,0,0]=4 235 B14R1.96 CSc1ccccc1SCCC(C)C 62a_100011217816_100000210312 [1,0,0,0,0,0|3,0,0]=4 236 B14R1.96 CSc1ncccc1C=CCC(C)C 271570a_100016259101_100011465278 [1,0,0,0,0,0|3,0,0]=4 237 B14R1.160 C=C(C)CCC(=O)c1ccccc1C 1458a_100000212026_100000730704 [1,0,0,0,0,0|1,0,2]=4 238 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 11a_100000765925_100000212026 [1,0,0,0,0,0|1,0,2]=4 239 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 1626a_100000765925_100000212026 [1,0,0,0,0,0|1,0,2]=4 240 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 240690a_100000765925_100000212026 [1,0,0,0,0,0|1,0,2]=4 241 B14R1.160 C=C(C)CNC(=O)c1ccccc1C 527a_100000765925_100000212026 [1,0,0,0,0,0|1,0,2]=4 242 B14R1.160 CC(=CCC(=O)c1ccccc1C)C 1458a_100000212026_100000761012 [1,0,0,0,0,0|1,0,2]=4 243 B14R1.160 CC(=NNC(C)C)c1ccccc1C 4a_100000741168_100000211656 [1,0,0,0,0,0|3,0,0]=4 244 B14R1.160 CC(=O)CNC(=O)c1ccccc1C 1458a_100000184812_200000210301 [1,0,0,0,0,0|2,0,1]=4 245 B14R1.160 CC(=O)COC(=O)c1ccccc1O 271570a_203496583355_201991511838 [1,0,0,0,0,0|2,0,1]=4 246 B14R1.160 CC(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000210312 [1,0,0,0,0,0|2,0,0]=3 247 B14R1.160 CC(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210312 [1,0,0,0,0,0|2,0,0]=3 248 B14R1.160 CC(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000210312 [1,0,0,0,0,0|2,0,0]=3 249 B14R1.160 CC(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000210312 [1,0,0,0,0,0|2,0,0]=3 250 B14R1.160 CC(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000210312 [1,0,0,0,0,0|2,0,0]=3 251 B14R1.160 CC(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210312 [1,0,0,0,0,0|2,0,0]=3 252 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 11a_100000210953_100000188424 [1,0,0,0,0,0|2,0,0]=3 253 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 1626a_100000210953_100000188424 [1,0,0,0,0,0|2,0,0]=3 254 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 240690a_100000210953_100000188424 [1,0,0,0,0,0|2,0,0]=3 255 B14R1.160 CC(C)CNC(=O)c1ccccc1Br 527a_100000210953_100000188424 [1,0,0,0,0,0|2,0,0]=3 256 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 11a_100000210953_100000185844 [1,0,0,0,0,0|2,0,0]=3 257 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 1626a_100000210953_100000185844 [1,0,0,0,0,0|2,0,0]=3 258 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 240690a_100000210953_100000185844 [1,0,0,0,0,0|2,0,0]=3 259 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl 527a_100000210953_100000185844 [1,0,0,0,0,0|2,0,0]=3 260 B14R1.160 CC(C)CNC(=O)c1ccccc1F 11a_100000210953_100000188656 [1,0,0,0,0,0|2,0,0]=3 261 B14R1.160 CC(C)CNC(=O)c1ccccc1F 1626a_100000210953_100000188656 [1,0,0,0,0,0|2,0,0]=3 262 B14R1.160 CC(C)CNC(=O)c1ccccc1F 240690a_100000210953_100000188656 [1,0,0,0,0,0|2,0,0]=3 263 B14R1.160 CC(C)CNC(=O)c1ccccc1F 527a_100000210953_100000188656 [1,0,0,0,0,0|2,0,0]=3 264 B14R1.160 CC(C)CNC(=O)c1ccccc1I 11a_100000210953_100000187884 [1,0,0,0,0,0|2,0,0]=3 265 B14R1.160 CC(C)CNC(=O)c1ccccc1I 1626a_100000210953_100000187884 [1,0,0,0,0,0|2,0,0]=3 266 B14R1.160 CC(C)CNC(=O)c1ccccc1I 240690a_100000210953_100000187884 [1,0,0,0,0,0|2,0,0]=3 267 B14R1.160 CC(C)CNC(=O)c1ccccc1I 527a_100000210953_100000187884 [1,0,0,0,0,0|2,0,0]=3 268 B14R1.160 CC(C)CNC(=O)c1ccccc1O 240690a_100000210953_100015234032 [1,0,0,0,0,0|2,0,0]=3 269 B14R1.160 CC(C)CNC(=O)c1ccccc1O 271570a_203496583355_200000155729 [1,0,0,0,0,0|2,0,0]=3 270 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 1626a_100000210953_100009911694 [1,0,0,0,0,0|2,0,0]=3 271 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 240690a_100000210953_100009911694 [1,0,0,0,0,0|2,0,0]=3 272 B14R1.160 CC(C)CNC(=O)c1ccccc1[O-] 527a_100000210953_100009911694 [1,0,0,0,0,0|2,0,0]=3 273 B14R1.160 CC(C)COC(C)c1ccccc1Br 34a_100000702211_100000210624 [1,0,0,0,0,0|2,0,1]=4 274 B14R1.160 CC(C)COC(C)c1ccccc1Br 7a_100000702211_100000210760 [1,0,0,0,0,0|2,0,1]=4 275 B14R1.160 CC(C)COC(C)c1ccccc1Cl 34a_100000740796_100000210624 [1,0,0,0,0,0|2,0,1]=4 276 B14R1.160 CC(C)COC(C)c1ccccc1Cl 7a_100000740796_100000210760 [1,0,0,0,0,0|2,0,1]=4 277 B14R1.160 CC(C)COC(C)c1ccccc1F 34a_100000210257_200000741388 [1,0,0,0,0,0|2,0,1]=4 278 B14R1.160 CC(C)COC(C)c1ccccc1F 34a_100000697922_100000210624 [1,0,0,0,0,0|2,0,1]=4 279 B14R1.160 CC(C)COC(C)c1ccccc1F 7a_100000697922_100000210760 [1,0,0,0,0,0|2,0,1]=4 280 B14R1.160 CC(C)COC(C)c1ccccc1N 7a_100011405641_100000210760 [1,0,0,0,0,0|1,0,1]=3 281 B14R1.160 CC(C)NCC(=O)c1ccccc1Br 34a_100138425928_100000199116 [1,0,0,0,0,0|3,0,0]=4 282 B14R1.160 CC(C)NCC(=O)c1ccccc1Cl 34a_100138425928_100000211432 [1,0,0,0,0,0|3,0,0]=4 283 B14R1.160 CC(C)NCC(=O)c1ccccc1F 34a_100138425928_100000204681 [1,0,0,0,0,0|3,0,0]=4 284 B14R1.160 CC(C)NNC(=O)c1ccccc1Br 22a_100000741168_100000188424 [1,0,0,0,0,0|3,0,0]=4 285 B14R1.160 CC(C)NNC(=O)c1ccccc1Cl 22a_100000741168_100000185844 [1,0,0,0,0,0|3,0,0]=4 286 B14R1.160 CC(C)NNC(=O)c1ccccc1F 22a_100000741168_100000188656 [1,0,0,0,0,0|3,0,0]=4 287 B14R1.160 CC(C)NNC(=O)c1ccccc1I 22a_100000741168_100000187884 [1,0,0,0,0,0|3,0,0]=4 288 B14R1.160 CC(C)NNC(=O)c1ccccc1O 22a_100000741168_100015234032 [1,0,0,0,0,0|3,0,0]=4 289 B14R1.160 CC(C)NNC(=O)c1ccccc1[O-] 22a_100000741168_100009911694 [1,0,0,0,0,0|3,0,0]=4 290 B14R1.160 CC(C)OCC(=O)c1ccccc1Br 34a_100000212225_100000199116 [1,0,0,0,0,0|3,0,0]=4 291 B14R1.160 CC(C)OCC(=O)c1ccccc1Cl 34a_100000212225_100000211432 [1,0,0,0,0,0|3,0,0]=4 292 B14R1.160 CC(C)OCC(=O)c1ccccc1F 34a_100000212225_100000204681 [1,0,0,0,0,0|3,0,0]=4 293 B14R1.160 CC(C)SCC(=O)c1ccccc1Br 62a_100000199116_100000210206 [1,0,0,0,0,0|3,0,0]=4 294 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000210206_100000211432 [1,0,0,0,0,0|3,0,0]=4 295 B14R1.160 CC(C)SCC(=O)c1ccccc1Cl 62a_100000211432_100000210206 [1,0,0,0,0,0|3,0,0]=4 296 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000204681_100000210206 [1,0,0,0,0,0|3,0,0]=4 297 B14R1.160 CC(C)SCC(=O)c1ccccc1F 62a_100000210206_100000204681 [1,0,0,0,0,0|3,0,0]=4 298 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000188908_100000210206 [1,0,0,0,0,0|3,0,0]=4 299 B14R1.160 CC(C)SCC(=O)c1ccccc1O 62a_100000210206_100000188908 [1,0,0,0,0,0|3,0,0]=4 300 B14R1.160 CC(O)CCC(=O)c1ccccc1Br 1458a_100000188424_100012276601 [1,0,0,0,0,0|3,0,0]=4 301 B14R1.160 CC(O)CCC(=O)c1ccccc1Cl 1458a_100000185844_100012276601 [1,0,0,0,0,0|3,0,0]=4 302 B14R1.160 CC(O)CCC(=O)c1ccccc1F 1458a_100000188656_100012276601 [1,0,0,0,0,0|3,0,0]=4 303 B14R1.160 CC(O)CCC(=O)c1ccccc1I 1458a_100000187884_100012276601 [1,0,0,0,0,0|3,0,0]=4 304 B14R1.160 CC(O)CCC(=O)c1ccccc1O 1458a_100015234032_100012276601 [1,0,0,0,0,0|3,0,0]=4 305 B14R1.160 CC(O)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100012276601 [1,0,0,0,0,0|3,0,0]=4 306 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 11a_100000210904_100000188424 [1,0,0,0,0,0|3,0,0]=4 307 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 240690a_100000210904_100000188424 [1,0,0,0,0,0|3,0,0]=4 308 B14R1.160 CC(O)CNC(=O)c1ccccc1Br 527a_100000210904_100000188424 [1,0,0,0,0,0|3,0,0]=4 309 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 11a_100000210904_100000185844 [1,0,0,0,0,0|3,0,0]=4 310 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 240690a_100000210904_100000185844 [1,0,0,0,0,0|3,0,0]=4 311 B14R1.160 CC(O)CNC(=O)c1ccccc1Cl 527a_100000210904_100000185844 [1,0,0,0,0,0|3,0,0]=4 312 B14R1.160 CC(O)CNC(=O)c1ccccc1F 11a_100000210904_100000188656 [1,0,0,0,0,0|3,0,0]=4 313 B14R1.160 CC(O)CNC(=O)c1ccccc1F 240690a_100000210904_100000188656 [1,0,0,0,0,0|3,0,0]=4 314 B14R1.160 CC(O)CNC(=O)c1ccccc1F 527a_100000210904_100000188656 [1,0,0,0,0,0|3,0,0]=4 315 B14R1.160 CC(O)CNC(=O)c1ccccc1I 11a_100000210904_100000187884 [1,0,0,0,0,0|3,0,0]=4 316 B14R1.160 CC(O)CNC(=O)c1ccccc1I 240690a_100000210904_100000187884 [1,0,0,0,0,0|3,0,0]=4 317 B14R1.160 CC(O)CNC(=O)c1ccccc1I 527a_100000210904_100000187884 [1,0,0,0,0,0|3,0,0]=4 318 B14R1.160 CC(O)CNC(=O)c1ccccc1O 240690a_100000210904_100015234032 [1,0,0,0,0,0|3,0,0]=4 319 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 240690a_100000210904_100009911694 [1,0,0,0,0,0|3,0,0]=4 320 B14R1.160 CC(O)CNC(=O)c1ccccc1[O-] 527a_100000210904_100009911694 [1,0,0,0,0,0|3,0,0]=4 321 B14R1.160 CC(O)COC(C)c1ccccc1N 7a_100011405641_100011218427 [1,0,0,0,0,0|2,0,1]=4 322 B14R1.160 CC(OC[C@@H](C)O)c1ccccc1N 7a_100011405641_100009817552 [1,0,0,0,0,0|2,0,1]=4 323 B14R1.160 CN(C)CCC(=O)c1ccccc1F 2230a_100102631434_100000086012 [1,0,0,0,0,0|3,0,0]=4 324 B14R1.160 CN(C)CCC(=O)c1ccccc1F 269982a_100102631434_100000086012 [1,0,0,0,0,0|3,0,0]=4 325 B14R1.160 CN(C)CCC(=O)c1ccccc1O 269982a_100102631434_100009873196 [1,0,0,0,0,0|3,0,0]=4 326 B14R1.160 Cc1ccccc1C(=O)CCC(C)C 1458a_100000212026_100000210312 [1,0,0,0,0,0|1,0,0]=2 327 B14R1.160 Cc1ccccc1C(=O)CCC(C)O 1458a_100000212026_100012276601 [1,0,0,0,0,0|2,0,0]=3 328 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 2230a_100138425928_100000741374 [1,0,0,0,0,0|2,0,0]=3 329 B14R1.160 Cc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000741374 [1,0,0,0,0,0|2,0,0]=3 330 B14R1.160 Cc1ccccc1C(=O)COC(C)C 34a_100000212225_100000741374 [1,0,0,0,0,0|2,0,0]=3 331 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000210206_100000741374 [1,0,0,0,0,0|2,0,0]=3 332 B14R1.160 Cc1ccccc1C(=O)CSC(C)C 62a_100000741374_100000210206 [1,0,0,0,0,0|2,0,0]=3 333 B14R1.160 Cc1ccccc1C(=O)NCC(=O)[13CH3] 1458a_100000184812_200025704644 [1,0,0,0,0,0|2,0,1]=4 334 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000212026 [1,0,0,0,0,0|1,0,0]=2 335 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000212026 [1,0,0,0,0,0|1,0,0]=2 336 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000212026 [1,0,0,0,0,0|1,0,0]=2 337 B14R1.160 Cc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000212026 [1,0,0,0,0,0|1,0,0]=2 338 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000212026 [1,0,0,0,0,0|2,0,0]=3 339 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000212026 [1,0,0,0,0,0|2,0,0]=3 340 B14R1.160 Cc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000212026 [1,0,0,0,0,0|2,0,0]=3 341 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 11a_100000765723_100000212026 [1,0,0,0,0,0|3,0,0]=4 342 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 1626a_100000765723_100000212026 [1,0,0,0,0,0|3,0,0]=4 343 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 240690a_100000765723_100000212026 [1,0,0,0,0,0|3,0,0]=4 344 B14R1.160 Cc1ccccc1C(=O)NCC(F)F 527a_100000765723_100000212026 [1,0,0,0,0,0|3,0,0]=4 345 B14R1.160 Cc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000212026 [1,0,0,0,0,0|2,0,0]=3 346 B14R1.160 Cc1ccccc1C(C)NCC(C)C 2230a_100000181355_100000210760 [1,0,0,0,0,0|2,0,1]=4 347 B14R1.160 Cc1ccccc1C(C)NCC(C)C 269862a_100000210953_100000211656 [1,0,0,0,0,0|2,0,1]=4 348 B14R1.160 Cc1ccccc1C(C)NCC(C)C 270004a_100000181355_100000210432 [1,0,0,0,0,0|2,0,1]=4 349 B14R1.160 Cc1ccccc1C(C)NCC(C)C 34a_100000181355_100000210624 [1,0,0,0,0,0|2,0,1]=4 350 B14R1.160 Cc1ccccc1C(C)OCC(C)C 34a_100000742021_100000210624 [1,0,0,0,0,0|1,0,1]=3 351 B14R1.160 Cc1ccccc1C(C)OCC(C)C 7a_100000742021_100000210760 [1,0,0,0,0,0|1,0,1]=3 352 B14R1.160 Cc1ccccc1C(C)OCC(C)O 34a_100000742021_100011218427 [1,0,0,0,0,0|2,0,1]=4 353 B14R1.160 Cc1ccccc1C(C)OCC(C)O 7a_100000742021_100011218427 [1,0,0,0,0,0|2,0,1]=4 354 B14R1.160 Cc1ccccc1C(C)OC[C@@H](C)O 34a_100000742021_100009817552 [1,0,0,0,0,0|2,0,1]=4 355 B14R1.160 Cc1ccccc1C(C)OC[C@@H](C)O 7a_100000742021_100009817552 [1,0,0,0,0,0|2,0,1]=4 356 B14R1.160 Cc1ccccc1N(C)CCC(C)C 2230a_100000219699_100000210312 [1,0,0,0,0,0|3,0,0]=4 357 B14R1.160 Cc1ccccc1N(C)CCC(C)C 269982a_100000219699_100000210312 [1,0,0,0,0,0|3,0,0]=4 358 B14R1.160 Cc1ccccc1N(C)CCC(C)C 34a_100000219699_100000210312 [1,0,0,0,0,0|3,0,0]=4 359 B14R1.939 C#CCNC(=O)c1ccccc1NC 34a_100000204693_200000210301 [1,0,0,0,0,0|1,0,2]=4 360 B14R1.939 C#CCNC(=O)c1ccccc1N[13CH3] 34a_100000204693_200025704644 [1,0,0,0,0,0|1,0,2]=4 361 B14R1.939 C#Cc1ccccc1C(=O)CCCC 1458a_100011243808_100000210211 [1,0,0,0,0,0|2,0,1]=4 362 B14R1.939 C#Cc1ccccc1C(=O)NCCC 527a_100020643023_100011243808 [1,0,0,0,0,0|2,0,1]=4 363 B14R1.939 C=CCNC(=O)c1ccccc1NC 34a_100000182330_200000210301 [1,0,0,0,0,0|1,0,2]=4 364 B14R1.939 C=CCNC(=O)c1ccccc1N[13CH3] 34a_100000182330_200025704644 [1,0,0,0,0,0|1,0,2]=4 365 B14R1.939 C=Cc1ccccc1C(=O)CCCC 1458a_100011830265_100000210211 [1,0,0,0,0,0|2,0,1]=4 366 B14R1.939 C=Cc1ccccc1C(=O)NCCC 1626a_100020643023_100011830265 [1,0,0,0,0,0|2,0,1]=4 367 B14R1.939 C=Cc1ccccc1C(=O)NCCC 271570a_100011290941_200000152266 [1,0,0,0,0,0|2,0,1]=4 368 B14R1.939 CCCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210211 [1,0,0,0,0,0|3,0,0]=4 369 B14R1.939 CCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210211 [1,0,0,0,0,0|2,0,0]=3 370 B14R1.939 CCCCC(=O)c1ccccc1CO 1458a_100011301526_100000210211 [1,0,0,0,0,0|3,0,0]=4 371 B14R1.939 CCCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210211 [1,0,0,0,0,0|3,0,0]=4 372 B14R1.939 CCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210211 [1,0,0,0,0,0|2,0,0]=3 373 B14R1.939 CCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210211 [1,0,0,0,0,0|2,0,0]=3 374 B14R1.939 CCCNC(=O)c1ccccc1C#N 11a_100020643023_100000742908 [1,0,0,0,0,0|3,0,0]=4 375 B14R1.939 CCCNC(=O)c1ccccc1C#N 1626a_100020643023_100000742908 [1,0,0,0,0,0|3,0,0]=4 376 B14R1.939 CCCNC(=O)c1ccccc1C#N 527a_100020643023_100000742908 [1,0,0,0,0,0|3,0,0]=4 377 B14R1.939 CCCNC(=O)c1ccccc1CC 11a_100020643023_100000689120 [1,0,0,0,0,0|2,0,0]=3 378 B14R1.939 CCCNC(=O)c1ccccc1CC 1626a_100020643023_100000689120 [1,0,0,0,0,0|2,0,0]=3 379 B14R1.939 CCCNC(=O)c1ccccc1CC 240690a_100020643023_100000689120 [1,0,0,0,0,0|2,0,0]=3 380 B14R1.939 CCCNC(=O)c1ccccc1CC 527a_100020643023_100000689120 [1,0,0,0,0,0|2,0,0]=3 381 B14R1.939 CCCNC(=O)c1ccccc1I=O 1626a_100020643023_100000032414 [1,0,0,0,0,0|3,0,0]=4 382 B14R1.939 CCCNC(=O)c1ccccc1I=O 240690a_100020643023_100000032414 [1,0,0,0,0,0|3,0,0]=4 383 B14R1.939 CCCNC(=O)c1ccccc1I=O 527a_100020643023_100000032414 [1,0,0,0,0,0|3,0,0]=4 384 B14R1.939 CCCNC(=O)c1ccccc1NC 27a_100102657272_200000152266 [1,0,0,0,0,0|1,0,0]=2 385 B14R1.939 CCCNC(=O)c1ccccc1NC 34a_100000181257_200000210301 [1,0,0,0,0,0|1,0,0]=2 386 B14R1.939 CCCNC(=O)c1ccccc1N[13CH3] 34a_100000181257_200025704644 [1,0,0,0,0,0|1,0,0]=2 387 B14R1.939 CCCNC(=O)c1ccccc1OC 11a_100020643023_100000185835 [1,0,0,0,0,0|2,0,0]=3 388 B14R1.939 CCCNC(=O)c1ccccc1OC 1626a_100020643023_100000185835 [1,0,0,0,0,0|2,0,0]=3 389 B14R1.939 CCCNC(=O)c1ccccc1OC 240690a_100020643023_100000185835 [1,0,0,0,0,0|2,0,0]=3 390 B14R1.939 CCCNC(=O)c1ccccc1OC 527a_100020643023_100000185835 [1,0,0,0,0,0|2,0,0]=3 391 B14R1.939 CCCNC(=O)c1ccccc1SC 11a_100020643023_100000183967 [1,0,0,0,0,0|2,0,0]=3 392 B14R1.939 CCCNC(=O)c1ccccc1SC 1626a_100020643023_100000183967 [1,0,0,0,0,0|2,0,0]=3 393 B14R1.939 CCCNC(=O)c1ccccc1SC 240690a_100020643023_100000183967 [1,0,0,0,0,0|2,0,0]=3 394 B14R1.939 CCCNC(=O)c1ccccc1SC 527a_100020643023_100000183967 [1,0,0,0,0,0|2,0,0]=3 395 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000152266_200000210301 [1,0,0,0,0,0|2,0,0]=3 396 B14R1.939 CCCNC(=O)c1ccccc1SC 62a_200000210301_200000152266 [1,0,0,0,0,0|2,0,0]=3 397 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200000152266_200025704644 [1,0,0,0,0,0|2,0,0]=3 398 B14R1.939 CCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152266 [1,0,0,0,0,0|2,0,0]=3 399 B14R1.939 CCCNC(=O)c1cccnc1NC 27a_100102657272_100000161721 [1,0,0,0,0,0|2,0,0]=3 400 B14R1.939 CCCNC(=O)c1cccnc1SC 62a_100000161721_200000210301 [1,0,0,0,0,0|3,0,0]=4 401 B14R1.939 CCCNC(=O)c1cccnc1SC 62a_200000210301_100000161721 [1,0,0,0,0,0|3,0,0]=4 402 B14R1.939 CCCNC(=O)c1cccnc1S[13CH3] 62a_100000161721_200025704644 [1,0,0,0,0,0|3,0,0]=4 403 B14R1.939 CCCNC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000161721 [1,0,0,0,0,0|3,0,0]=4 404 B14R1.939 CCCOC(=O)c1ccccc1OC 7a_100000169924_200000210301 [1,0,0,0,0,0|1,0,0]=2 405 B14R1.939 CCCOC(=O)c1ccccc1O[13CH3] 7a_100000169924_200025704644 [1,0,0,0,0,0|1,0,0]=2 406 B14R1.939 CCCOC(C)c1ccccc1OC 7a_100000742714_100000210303 [1,0,0,0,0,0|2,0,1]=4 407 B14R1.939 CCNN=C(C)c1ccccc1NC 4a_100000756455_100000020593 [1,0,0,0,0,0|3,0,0]=4 408 B14R1.939 CCNNC(=O)c1ccccc1CC 22a_100000756455_100000689120 [1,0,0,0,0,0|3,0,0]=4 409 B14R1.939 CCNNC(=O)c1ccccc1OC 22a_100000756455_100000185835 [1,0,0,0,0,0|3,0,0]=4 410 B14R1.939 CCNNC(=O)c1ccccc1SC 22a_100000756455_100000183967 [1,0,0,0,0,0|3,0,0]=4 411 B14R1.939 CCOCC(=O)c1ccccc1OC 34a_100121572206_100000195505 [1,0,0,0,0,0|3,0,0]=4 412 B14R1.939 CCSCC(=O)c1ccccc1OC 62a_100000195505_100000210202 [1,0,0,0,0,0|3,0,0]=4 413 B14R1.939 CCc1ccccc1C(=O)CCCF 1458a_100000689120_100011934791 [1,0,0,0,0,0|3,0,0]=4 414 B14R1.939 CCc1ccccc1C(=O)CCCO 1458a_100000689120_100011215043 [1,0,0,0,0,0|3,0,0]=4 415 B14R1.939 CCc1ccccc1C(=O)CCOC 1458a_100000689120_100000233755 [1,0,0,0,0,0|3,0,0]=4 416 B14R1.939 CCc1ccccc1C(=O)CCSC 1458a_100000689120_100000751147 [1,0,0,0,0,0|3,0,0]=4 417 B14R1.939 CCc1ccccc1C(=O)NCCF 11a_100000724931_100000689120 [1,0,0,0,0,0|3,0,0]=4 418 B14R1.939 CCc1ccccc1C(=O)NCCF 1626a_100000724931_100000689120 [1,0,0,0,0,0|3,0,0]=4 419 B14R1.939 CCc1ccccc1C(=O)NCCF 240690a_100000724931_100000689120 [1,0,0,0,0,0|3,0,0]=4 420 B14R1.939 CCc1ccccc1C(=O)NCCF 527a_100000724931_100000689120 [1,0,0,0,0,0|3,0,0]=4 421 B14R1.939 CCc1ccccc1C(=O)NCCO 240690a_100000210304_100000689120 [1,0,0,0,0,0|3,0,0]=4 422 B14R1.939 CCc1ccccc1C(=O)NCCO 527a_100000210304_100000689120 [1,0,0,0,0,0|3,0,0]=4 423 B14R1.939 CNc1ccccc1C(=O)NCCO 27a_100102657272_200000158863 [1,0,0,0,0,0|2,0,0]=3 424 B14R1.939 COCCC(=O)c1ccccc1OC 1458a_100000185835_100000233755 [1,0,0,0,0,0|3,0,0]=4 425 B14R1.939 COCCC(=O)c1ccccc1SC 1458a_100000183967_100000233755 [1,0,0,0,0,0|3,0,0]=4 426 B14R1.939 COc1ccccc1C(=O)CCCF 1458a_100000185835_100011934791 [1,0,0,0,0,0|3,0,0]=4 427 B14R1.939 COc1ccccc1C(=O)CCCO 1458a_100000185835_100011215043 [1,0,0,0,0,0|3,0,0]=4 428 B14R1.939 COc1ccccc1C(=O)CCSC 1458a_100000185835_100000751147 [1,0,0,0,0,0|3,0,0]=4 429 B14R1.939 COc1ccccc1C(=O)NCCF 11a_100000724931_100000185835 [1,0,0,0,0,0|3,0,0]=4 430 B14R1.939 COc1ccccc1C(=O)NCCF 1626a_100000724931_100000185835 [1,0,0,0,0,0|3,0,0]=4 431 B14R1.939 COc1ccccc1C(=O)NCCF 240690a_100000724931_100000185835 [1,0,0,0,0,0|3,0,0]=4 432 B14R1.939 COc1ccccc1C(=O)NCCF 527a_100000724931_100000185835 [1,0,0,0,0,0|3,0,0]=4 433 B14R1.939 COc1ccccc1C(=O)NCCO 240690a_100000210304_100000185835 [1,0,0,0,0,0|3,0,0]=4 434 B14R1.939 COc1ccccc1C(=O)NCCO 527a_100000210304_100000185835 [1,0,0,0,0,0|3,0,0]=4 435 B14R1.939 COc1ccccc1C(=O)OCCO 7a_100000229999_200000210301 [1,0,0,0,0,0|2,0,0]=3 436 B14R1.939 CSCCC(=O)c1ccccc1SC 1458a_100000183967_100000751147 [1,0,0,0,0,0|3,0,0]=4 437 B14R1.939 CSc1ccccc1C(=O)CCCF 1458a_100000183967_100011934791 [1,0,0,0,0,0|3,0,0]=4 438 B14R1.939 CSc1ccccc1C(=O)CCCO 1458a_100000183967_100011215043 [1,0,0,0,0,0|3,0,0]=4 439 B14R1.939 CSc1ccccc1C(=O)NCCF 11a_100000724931_100000183967 [1,0,0,0,0,0|3,0,0]=4 440 B14R1.939 CSc1ccccc1C(=O)NCCF 1626a_100000724931_100000183967 [1,0,0,0,0,0|3,0,0]=4 441 B14R1.939 CSc1ccccc1C(=O)NCCF 240690a_100000724931_100000183967 [1,0,0,0,0,0|3,0,0]=4 442 B14R1.939 CSc1ccccc1C(=O)NCCF 527a_100000724931_100000183967 [1,0,0,0,0,0|3,0,0]=4 443 B14R1.939 CSc1ccccc1C(=O)NCCO 240690a_100000210304_100000183967 [1,0,0,0,0,0|3,0,0]=4 444 B14R1.939 CSc1ccccc1C(=O)NCCO 527a_100000210304_100000183967 [1,0,0,0,0,0|3,0,0]=4 445 B14R1.939 CSc1ccccc1C(=O)NCCO 62a_200000158863_200000210301 [1,0,0,0,0,0|3,0,0]=4 446 B14R1.939 CSc1ccccc1C(=O)NCCO 62a_200000210301_200000158863 [1,0,0,0,0,0|3,0,0]=4 447 B14R1.939 [13CH3]Oc1ccccc1C(=O)OCCO 7a_100000229999_200025704644 [1,0,0,0,0,0|2,0,0]=3 448 B14R1.939 [13CH3]Sc1ccccc1C(=O)NCCO 62a_200000158863_200025704644 [1,0,0,0,0,0|3,0,0]=4 449 B14R1.939 [13CH3]Sc1ccccc1C(=O)NCCO 62a_200025704644_200000158863 [1,0,0,0,0,0|3,0,0]=4 450 B16R1.697 C=C=Cc1ccccc1C(=O)NCC(C)C 271570a_100015277604_200000155729 [0,1,0,0,0,0|2,0,1]=4 451 B16R1.697 CC(=O)COC(=O)c1ccccc1SCF 62a_100015361967_201991511838 [0,1,0,0,0,0|2,0,1]=4 452 B16R1.697 CC(=O)COC(=O)c1ccccc1SCF 62a_201991511838_100015361967 [0,1,0,0,0,0|2,0,1]=4 453 B16R1.697 CC(C)CCC(=O)c1ccccc1CC#N 1458a_100000010604_100000210312 [0,1,0,0,0,0|2,0,1]=4 454 B16R1.697 CC(C)CCC(=O)c1ccccc1N=[N+]=[N-] 1458a_100009827904_100000210312 [0,1,0,0,0,0|2,0,1]=4 455 B16R1.697 CC(C)CNC(=O)c1ccccc1CC#N 11a_100000210953_100000010604 [0,1,0,0,0,0|2,0,1]=4 456 B16R1.697 CC(C)CNC(=O)c1ccccc1CC#N 1626a_100000210953_100000010604 [0,1,0,0,0,0|2,0,1]=4 457 B16R1.697 CC(C)CNC(=O)c1ccccc1N=[N+]=[N-] 240690a_100000210953_100009827904 [0,1,0,0,0,0|2,0,1]=4 458 B16R1.697 CC(C)CNC(=O)c1ccccc1NCF 34a_100000180285_100015361967 [0,1,0,0,0,0|1,0,0]=2 459 B16R1.697 CC(C)CNC(=O)c1ccccc1SCF 62a_100015361967_200000155729 [0,1,0,0,0,0|2,0,0]=3 460 B16R1.697 CC(C)CNC(=O)c1ccccc1SCF 62a_200000155729_100015361967 [0,1,0,0,0,0|2,0,0]=3 461 B16R1.697 CC(C)COC(=O)c1ccccc1OCF 34a_100000005792_100015361967 [0,1,0,0,0,0|1,0,0]=2 462 B16R1.697 CC(C)COC(=O)c1ccccc1OCF 7a_100000005792_100015361967 [0,1,0,0,0,0|1,0,0]=2 463 B16R1.697 CC=Cc1ccccc1C(=O)NCC(C)C 271570a_100016259895_200000155729 [0,1,0,0,0,0|2,0,0]=3 464 B16R1.697 CC=Cc1ccccc1C(=O)OCC(=O)C 271570a_100016259895_201991511838 [0,1,0,0,0,0|2,0,1]=4 465 B16R1.697 CCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100000210202 [0,1,0,0,0,0|1,0,0]=2 466 B16R1.697 CCNc1ccccc1C(=O)NCC(C)C 27a_100015525214_200000155729 [0,1,0,0,0,0|1,0,0]=2 467 B16R1.697 CCNc1ccccc1C(=O)NCC(C)C 34a_100000180285_100000210202 [0,1,0,0,0,0|1,0,0]=2 468 B16R1.697 CCOc1ccccc1C(=O)CCC(C)C 1458a_100000211144_100000210312 [0,1,0,0,0,0|2,0,0]=3 469 B16R1.697 CCOc1ccccc1C(=O)CCC(C)O 1458a_100000211144_100012276601 [0,1,0,0,0,0|3,0,0]=4 470 B16R1.697 CCOc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000211144 [0,1,0,0,0,0|2,0,0]=3 471 B16R1.697 CCOc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000211144 [0,1,0,0,0,0|2,0,0]=3 472 B16R1.697 CCOc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000211144 [0,1,0,0,0,0|2,0,0]=3 473 B16R1.697 CCOc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000211144 [0,1,0,0,0,0|2,0,0]=3 474 B16R1.697 CCOc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000211144 [0,1,0,0,0,0|3,0,0]=4 475 B16R1.697 CCOc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000211144 [0,1,0,0,0,0|3,0,0]=4 476 B16R1.697 CCOc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000211144 [0,1,0,0,0,0|3,0,0]=4 477 B16R1.697 CCOc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000211144 [0,1,0,0,0,0|3,0,0]=4 478 B16R1.697 CCOc1ccccc1C(=O)OCC(C)C 34a_100000005792_100000210202 [0,1,0,0,0,0|1,0,0]=2 479 B16R1.697 CCOc1ccccc1C(=O)OCC(C)C 7a_100000005792_100000210202 [0,1,0,0,0,0|1,0,0]=2 480 B16R1.697 CCOc1ccccc1C(C)OCC(C)C 7a_100000246524_100000210760 [0,1,0,0,0,0|2,0,1]=4 481 B16R1.697 CCSc1ccccc1C(=O)CCC(C)C 1458a_100000195471_100000210312 [0,1,0,0,0,0|2,0,0]=3 482 B16R1.697 CCSc1ccccc1C(=O)CCC(C)O 1458a_100000195471_100012276601 [0,1,0,0,0,0|3,0,0]=4 483 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000195471 [0,1,0,0,0,0|2,0,0]=3 484 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000195471 [0,1,0,0,0,0|2,0,0]=3 485 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000195471 [0,1,0,0,0,0|2,0,0]=3 486 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000195471 [0,1,0,0,0,0|2,0,0]=3 487 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 62a_100000210202_200000155729 [0,1,0,0,0,0|2,0,0]=3 488 B16R1.697 CCSc1ccccc1C(=O)NCC(C)C 62a_200000155729_100000210202 [0,1,0,0,0,0|2,0,0]=3 489 B16R1.697 CCSc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000195471 [0,1,0,0,0,0|3,0,0]=4 490 B16R1.697 CCSc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000195471 [0,1,0,0,0,0|3,0,0]=4 491 B16R1.697 CCSc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000195471 [0,1,0,0,0,0|3,0,0]=4 492 B16R1.697 CCSc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000195471 [0,1,0,0,0,0|3,0,0]=4 493 B16R1.697 CCSc1ccccc1C(=O)OCC(=O)C 62a_100000210202_201991511838 [0,1,0,0,0,0|2,0,1]=4 494 B16R1.697 CCSc1ccccc1C(=O)OCC(=O)C 62a_201991511838_100000210202 [0,1,0,0,0,0|2,0,1]=4 495 B16R1.697 COCc1ccccc1C(=O)CCC(C)C 1458a_100000737999_100000210312 [0,1,0,0,0,0|2,0,0]=3 496 B16R1.697 COCc1ccccc1C(=O)CCC(C)O 1458a_100000737999_100012276601 [0,1,0,0,0,0|3,0,0]=4 497 B16R1.697 COCc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000737999 [0,1,0,0,0,0|2,0,0]=3 498 B16R1.697 COCc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000737999 [0,1,0,0,0,0|2,0,0]=3 499 B16R1.697 COCc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000737999 [0,1,0,0,0,0|2,0,0]=3 500 B16R1.697 COCc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000737999 [0,1,0,0,0,0|2,0,0]=3 501 B16R1.697 COCc1ccccc1C(=O)NCC(C)O 11a_100000210904_100000737999 [0,1,0,0,0,0|3,0,0]=4 502 B16R1.697 COCc1ccccc1C(=O)NCC(C)O 240690a_100000210904_100000737999 [0,1,0,0,0,0|3,0,0]=4 503 B16R1.697 COCc1ccccc1C(=O)NCC(C)O 527a_100000210904_100000737999 [0,1,0,0,0,0|3,0,0]=4 504 B16R1.697 COCc1ccccc1C(=O)NNC(C)C 22a_100000741168_100000737999 [0,1,0,0,0,0|3,0,0]=4 505 B16R1.4361 C=Cc1ccc(cc1C(=O)NCC(C)C)F 271570a_100011290941_200000205877 [0,1,0,0,0,0|2,0,1]=4 506 B16R1.4361 CC(C)CCC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210312 [0,1,0,0,0,0|3,0,0]=4 507 B16R1.4361 CC(C)CNC(=O)c1cc(ccc1C#N)F 11a_100000210953_100011217471 [0,1,0,0,0,0|3,0,0]=4 508 B16R1.4361 CC(C)CNC(=O)c1cc(ccc1C#N)F 1626a_100000210953_100011217471 [0,1,0,0,0,0|3,0,0]=4 509 B16R1.4361 CC(C)CNC(=O)c1cc(ccc1S[13CH3])F 62a_200000205877_200025704644 [0,1,0,0,0,0|2,0,0]=3 510 B16R1.4361 CC(C)CNC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_200000205877 [0,1,0,0,0,0|2,0,0]=3 511 B16R1.4361 CCc1ccc(cc1C(=O)CCC(C)C)Br 1458a_100012343961_100000210312 [0,1,0,0,0,0|2,0,0]=3 512 B16R1.4361 CCc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100012343961_100012276601 [0,1,0,0,0,0|3,0,0]=4 513 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)C)Br 11a_100000210953_100012343961 [0,1,0,0,0,0|2,0,0]=3 514 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)C)Br 1626a_100000210953_100012343961 [0,1,0,0,0,0|2,0,0]=3 515 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)C)Br 240690a_100000210953_100012343961 [0,1,0,0,0,0|2,0,0]=3 516 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)C)Br 527a_100000210953_100012343961 [0,1,0,0,0,0|2,0,0]=3 517 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)O)Br 11a_100000210904_100012343961 [0,1,0,0,0,0|3,0,0]=4 518 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)O)Br 240690a_100000210904_100012343961 [0,1,0,0,0,0|3,0,0]=4 519 B16R1.4361 CCc1ccc(cc1C(=O)NCC(C)O)Br 527a_100000210904_100012343961 [0,1,0,0,0,0|3,0,0]=4 520 B16R1.4361 CCc1ccc(cc1C(=O)NNC(C)C)Br 22a_100000741168_100012343961 [0,1,0,0,0,0|3,0,0]=4 521 B16R1.4361 CNc1ccc(cc1C(=O)NCC(C)C)F 27a_100102657272_200000205877 [0,1,0,0,0,0|1,0,0]=2 522 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)Br 1458a_100000188853_100000210312 [0,1,0,0,0,0|2,0,0]=3 523 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)C 1458a_100000204667_100000210312 [0,1,0,0,0,0|2,0,0]=3 524 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)Cl 1458a_100000211409_100000210312 [0,1,0,0,0,0|2,0,0]=3 525 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)F 1458a_100000735445_100000210312 [0,1,0,0,0,0|2,0,0]=3 526 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)I 1458a_100000230898_100000210312 [0,1,0,0,0,0|2,0,0]=3 527 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)C)O 1458a_200000100057_100000210312 [0,1,0,0,0,0|2,0,0]=3 528 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100000188853_100012276601 [0,1,0,0,0,0|3,0,0]=4 529 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)C 1458a_100000204667_100012276601 [0,1,0,0,0,0|3,0,0]=4 530 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)Cl 1458a_100000211409_100012276601 [0,1,0,0,0,0|3,0,0]=4 531 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)F 1458a_100000735445_100012276601 [0,1,0,0,0,0|3,0,0]=4 532 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)I 1458a_100000230898_100012276601 [0,1,0,0,0,0|3,0,0]=4 533 B16R1.4361 COc1ccc(cc1C(=O)CCC(C)O)O 1458a_200000100057_100012276601 [0,1,0,0,0,0|3,0,0]=4 534 B16R1.4361 COc1ccc(cc1C(=O)CNC(C)C)Br 34a_100138425928_200000749383 [0,1,0,0,0,0|3,0,0]=4 535 B16R1.4361 COc1ccc(cc1C(=O)CNC(C)C)F 34a_100138425928_100000737820 [0,1,0,0,0,0|3,0,0]=4 536 B16R1.4361 COc1ccc(cc1C(=O)COC(C)C)Br 34a_100000212225_200000749383 [0,1,0,0,0,0|3,0,0]=4 537 B16R1.4361 COc1ccc(cc1C(=O)COC(C)C)F 34a_100000212225_100000737820 [0,1,0,0,0,0|3,0,0]=4 538 B16R1.4361 COc1ccc(cc1C(=O)CSC(C)C)Br 62a_200000749383_100000210206 [0,1,0,0,0,0|3,0,0]=4 539 B16R1.4361 COc1ccc(cc1C(=O)CSC(C)C)Cl 62a_100012340060_100000210206 [0,1,0,0,0,0|3,0,0]=4 540 B16R1.4361 COc1ccc(cc1C(=O)CSC(C)C)F 62a_100000737820_100000210206 [0,1,0,0,0,0|3,0,0]=4 541 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Br 11a_100000210953_100000188853 [0,1,0,0,0,0|2,0,0]=3 542 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Br 1626a_100000210953_100000188853 [0,1,0,0,0,0|2,0,0]=3 543 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Br 240690a_100000210953_100000188853 [0,1,0,0,0,0|2,0,0]=3 544 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Br 527a_100000210953_100000188853 [0,1,0,0,0,0|2,0,0]=3 545 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)C 11a_100000210953_100000204667 [0,1,0,0,0,0|2,0,0]=3 546 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)C 1626a_100000210953_100000204667 [0,1,0,0,0,0|2,0,0]=3 547 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)C 240690a_100000210953_100000204667 [0,1,0,0,0,0|2,0,0]=3 548 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)C 527a_100000210953_100000204667 [0,1,0,0,0,0|2,0,0]=3 549 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Cl 11a_100000210953_100000211409 [0,1,0,0,0,0|2,0,0]=3 550 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000211409 [0,1,0,0,0,0|2,0,0]=3 551 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000211409 [0,1,0,0,0,0|2,0,0]=3 552 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)Cl 527a_100000210953_100000211409 [0,1,0,0,0,0|2,0,0]=3 553 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)F 11a_100000210953_100000735445 [0,1,0,0,0,0|2,0,0]=3 554 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)F 1626a_100000210953_100000735445 [0,1,0,0,0,0|2,0,0]=3 555 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)F 240690a_100000210953_100000735445 [0,1,0,0,0,0|2,0,0]=3 556 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)F 527a_100000210953_100000735445 [0,1,0,0,0,0|2,0,0]=3 557 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)I 11a_100000210953_100000230898 [0,1,0,0,0,0|2,0,0]=3 558 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)I 1626a_100000210953_100000230898 [0,1,0,0,0,0|2,0,0]=3 559 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)I 240690a_100000210953_100000230898 [0,1,0,0,0,0|2,0,0]=3 560 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)I 527a_100000210953_100000230898 [0,1,0,0,0,0|2,0,0]=3 561 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)O 240690a_100000210953_200000100057 [0,1,0,0,0,0|2,0,0]=3 562 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)C)O 527a_100000210953_200000100057 [0,1,0,0,0,0|2,0,0]=3 563 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Br 11a_100000210904_100000188853 [0,1,0,0,0,0|3,0,0]=4 564 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Br 240690a_100000210904_100000188853 [0,1,0,0,0,0|3,0,0]=4 565 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Br 527a_100000210904_100000188853 [0,1,0,0,0,0|3,0,0]=4 566 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)C 11a_100000210904_100000204667 [0,1,0,0,0,0|3,0,0]=4 567 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)C 240690a_100000210904_100000204667 [0,1,0,0,0,0|3,0,0]=4 568 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)C 527a_100000210904_100000204667 [0,1,0,0,0,0|3,0,0]=4 569 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Cl 11a_100000210904_100000211409 [0,1,0,0,0,0|3,0,0]=4 570 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000211409 [0,1,0,0,0,0|3,0,0]=4 571 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)Cl 527a_100000210904_100000211409 [0,1,0,0,0,0|3,0,0]=4 572 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)F 11a_100000210904_100000735445 [0,1,0,0,0,0|3,0,0]=4 573 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)F 240690a_100000210904_100000735445 [0,1,0,0,0,0|3,0,0]=4 574 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)F 527a_100000210904_100000735445 [0,1,0,0,0,0|3,0,0]=4 575 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)I 11a_100000210904_100000230898 [0,1,0,0,0,0|3,0,0]=4 576 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)I 240690a_100000210904_100000230898 [0,1,0,0,0,0|3,0,0]=4 577 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)I 527a_100000210904_100000230898 [0,1,0,0,0,0|3,0,0]=4 578 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)O 240690a_100000210904_200000100057 [0,1,0,0,0,0|3,0,0]=4 579 B16R1.4361 COc1ccc(cc1C(=O)NCC(C)O)O 527a_100000210904_200000100057 [0,1,0,0,0,0|3,0,0]=4 580 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)Br 22a_100000741168_100000188853 [0,1,0,0,0,0|3,0,0]=4 581 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)C 22a_100000741168_100000204667 [0,1,0,0,0,0|3,0,0]=4 582 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)Cl 22a_100000741168_100000211409 [0,1,0,0,0,0|3,0,0]=4 583 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)F 22a_100000741168_100000735445 [0,1,0,0,0,0|3,0,0]=4 584 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)I 22a_100000741168_100000230898 [0,1,0,0,0,0|3,0,0]=4 585 B16R1.4361 COc1ccc(cc1C(=O)NNC(C)C)O 22a_100000741168_200000100057 [0,1,0,0,0,0|3,0,0]=4 586 B16R1.4361 COc1ccc(cc1C(C)OCC(C)C)Cl 34a_100011598618_100000210624 [0,1,0,0,0,0|2,0,1]=4 587 B16R1.4361 COc1ccc(cc1C(C)OCC(C)C)Cl 7a_100011598618_100000210760 [0,1,0,0,0,0|2,0,1]=4 588 B16R1.4361 COc1ccc(cc1C(C)OCC(C)C)F 34a_100011305292_100000210624 [0,1,0,0,0,0|2,0,1]=4 589 B16R1.4361 COc1ccc(cc1C(C)OCC(C)C)F 7a_100011305292_100000210760 [0,1,0,0,0,0|2,0,1]=4 590 B16R1.4361 CSc1ccc(cc1C(=O)NCC(C)C)F 62a_200000205877_200000210301 [0,1,0,0,0,0|2,0,0]=3 591 B16R1.4361 CSc1ccc(cc1C(=O)NCC(C)C)F 62a_200000210301_200000205877 [0,1,0,0,0,0|2,0,0]=3 592 B16R1.4547 C=C(C)CCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000730704 [0,1,0,0,0,0|1,0,2]=4 593 B16R1.4547 C=C(C)CNC(=O)c1ccccc1N(C)C 11a_100000765925_100011218752 [0,1,0,0,0,0|1,0,2]=4 594 B16R1.4547 C=C(C)CNC(=O)c1ccccc1N(C)C 1626a_100000765925_100011218752 [0,1,0,0,0,0|1,0,2]=4 595 B16R1.4547 C=C(C)CNC(=O)c1ccccc1N(C)C 240690a_100000765925_100011218752 [0,1,0,0,0,0|1,0,2]=4 596 B16R1.4547 C=C(C)CNC(=O)c1ccccc1N(C)C 527a_100000765925_100011218752 [0,1,0,0,0,0|1,0,2]=4 597 B16R1.4547 C=C(C)c1ccccc1C(=O)NCC(C)C 271570a_100000694244_200000155729 [0,1,0,0,0,0|2,0,0]=3 598 B16R1.4547 C=C(C)c1ccccc1C(=O)OCC(=O)C 271570a_100000694244_201991511838 [0,1,0,0,0,0|2,0,1]=4 599 B16R1.4547 CC(=CCC(=O)c1ccccc1N(C)C)C 1458a_100011218752_100000761012 [0,1,0,0,0,0|1,0,2]=4 600 B16R1.4547 CC(=NNC(C)C)c1ccccc1N(C)C 4a_100000741168_200000696099 [0,1,0,0,0,0|3,0,0]=4 601 B16R1.4547 CC(C)CCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210312 [0,1,0,0,0,0|2,0,0]=3 602 B16R1.4547 CC(C)CCC(=O)c1ccccc1C(F)F 1458a_100009872251_100000210312 [0,1,0,0,0,0|3,0,0]=4 603 B16R1.4547 CC(C)CCC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210312 [0,1,0,0,0,0|3,0,0]=4 604 B16R1.4547 CC(C)CCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210312 [0,1,0,0,0,0|1,0,0]=2 605 B16R1.4547 CC(C)CCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210312 [0,1,0,0,0,0|2,0,0]=3 606 B16R1.4547 CC(C)CCC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210312 [0,1,0,0,0,0|2,0,1]=4 607 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(C)C 11a_100000210953_100011941426 [0,1,0,0,0,0|2,0,0]=3 608 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(C)C 1626a_100000210953_100011941426 [0,1,0,0,0,0|2,0,0]=3 609 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(C)C 240690a_100000210953_100011941426 [0,1,0,0,0,0|2,0,0]=3 610 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(C)C 527a_100000210953_100011941426 [0,1,0,0,0,0|2,0,0]=3 611 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(F)F 11a_100000210953_100009872251 [0,1,0,0,0,0|3,0,0]=4 612 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(F)F 1626a_100000210953_100009872251 [0,1,0,0,0,0|3,0,0]=4 613 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(F)F 240690a_100000210953_100009872251 [0,1,0,0,0,0|3,0,0]=4 614 B16R1.4547 CC(C)CNC(=O)c1ccccc1C(F)F 527a_100000210953_100009872251 [0,1,0,0,0,0|3,0,0]=4 615 B16R1.4547 CC(C)CNC(=O)c1ccccc1I(=O)=O 1626a_100000210953_100000061294 [0,1,0,0,0,0|3,0,0]=4 616 B16R1.4547 CC(C)CNC(=O)c1ccccc1I(=O)=O 240690a_100000210953_100000061294 [0,1,0,0,0,0|3,0,0]=4 617 B16R1.4547 CC(C)CNC(=O)c1ccccc1N(C)C 11a_100000210953_100011218752 [0,1,0,0,0,0|1,0,0]=2 618 B16R1.4547 CC(C)CNC(=O)c1ccccc1N(C)C 1626a_100000210953_100011218752 [0,1,0,0,0,0|1,0,0]=2 619 B16R1.4547 CC(C)CNC(=O)c1ccccc1N(C)C 240690a_100000210953_100011218752 [0,1,0,0,0,0|1,0,0]=2 620 B16R1.4547 CC(C)CNC(=O)c1ccccc1N(C)C 27a_100102631434_200000155729 [0,1,0,0,0,0|1,0,0]=2 621 B16R1.4547 CC(C)CNC(=O)c1ccccc1N(C)C 527a_100000210953_100011218752 [0,1,0,0,0,0|1,0,0]=2 622 B16R1.4547 CC(C)CNC(=O)c1ccccc1S(=O)C 1626a_100000210953_100000204632 [0,1,0,0,0,0|2,0,0]=3 623 B16R1.4547 CC(C)CNC(=O)c1ccccc1S(=O)C 240690a_100000210953_100000204632 [0,1,0,0,0,0|2,0,0]=3 624 B16R1.4547 CC(C)CNC(=O)c1ccccc1[N+](=O)[O-] 11a_100000210953_100000188706 [0,1,0,0,0,0|2,0,1]=4 625 B16R1.4547 CC(C)CNC(=O)c1ccccc1[N+](=O)[O-] 1626a_100000210953_100000188706 [0,1,0,0,0,0|2,0,1]=4 626 B16R1.4547 CC(C)CNC(=O)c1ccccc1[N+](=O)[O-] 240690a_100000210953_100000188706 [0,1,0,0,0,0|2,0,1]=4 627 B16R1.4547 CC(C)CNC(=O)c1ccccc1[N+](=O)[O-] 527a_100000210953_100000188706 [0,1,0,0,0,0|2,0,1]=4 628 B16R1.4547 CC(C)COC(=O)c1ccccc1N(C)C 269982a_100000170472_200000210301 [0,1,0,0,0,0|0,0,0]=1 629 B16R1.4547 CC(C)COC(=O)c1ccccc1N(C)C 38a_100000170472_200000210301 [0,1,0,0,0,0|0,0,0]=1 630 B16R1.4547 CC(C)COC(=O)c1ccccc1N(C)[13CH3] 269982a_100000170472_200025704644 [0,1,0,0,0,0|0,0,0]=1 631 B16R1.4547 CC(C)COC(=O)c1ccccc1N(C)[13CH3] 38a_100000170472_200025704644 [0,1,0,0,0,0|0,0,0]=1 632 B16R1.4547 CC(C)NNC(=O)c1ccccc1C(C)C 22a_100000741168_100011941426 [0,1,0,0,0,0|3,0,0]=4 633 B16R1.4547 CC(C)NNC(=O)c1ccccc1N(C)C 22a_100000741168_100011218752 [0,1,0,0,0,0|2,0,0]=3 634 B16R1.4547 CC(C)NNC(=O)c1ccccc1S(=O)C 22a_100000741168_100000204632 [0,1,0,0,0,0|3,0,0]=4 635 B16R1.4547 CC(O)CCC(=O)c1ccccc1C(C)C 1458a_100011941426_100012276601 [0,1,0,0,0,0|3,0,0]=4 636 B16R1.4547 CC(O)CCC(=O)c1ccccc1N(C)C 1458a_100011218752_100012276601 [0,1,0,0,0,0|2,0,0]=3 637 B16R1.4547 CC(O)CCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100012276601 [0,1,0,0,0,0|3,0,0]=4 638 B16R1.4547 CC(O)CNC(=O)c1ccccc1C(C)C 11a_100000210904_100011941426 [0,1,0,0,0,0|3,0,0]=4 639 B16R1.4547 CC(O)CNC(=O)c1ccccc1C(C)C 240690a_100000210904_100011941426 [0,1,0,0,0,0|3,0,0]=4 640 B16R1.4547 CC(O)CNC(=O)c1ccccc1C(C)C 527a_100000210904_100011941426 [0,1,0,0,0,0|3,0,0]=4 641 B16R1.4547 CC(O)CNC(=O)c1ccccc1N(C)C 11a_100000210904_100011218752 [0,1,0,0,0,0|2,0,0]=3 642 B16R1.4547 CC(O)CNC(=O)c1ccccc1N(C)C 240690a_100000210904_100011218752 [0,1,0,0,0,0|2,0,0]=3 643 B16R1.4547 CC(O)CNC(=O)c1ccccc1N(C)C 527a_100000210904_100011218752 [0,1,0,0,0,0|2,0,0]=3 644 B16R1.4547 CC(O)CNC(=O)c1ccccc1S(=O)C 240690a_100000210904_100000204632 [0,1,0,0,0,0|3,0,0]=4 645 B16R1.4547 CN(C)c1ccccc1C(=O)NCC(F)F 11a_100000765723_100011218752 [0,1,0,0,0,0|3,0,0]=4 646 B16R1.4547 CN(C)c1ccccc1C(=O)NCC(F)F 1626a_100000765723_100011218752 [0,1,0,0,0,0|3,0,0]=4 647 B16R1.4547 CN(C)c1ccccc1C(=O)NCC(F)F 240690a_100000765723_100011218752 [0,1,0,0,0,0|3,0,0]=4 648 B16R1.4547 CN(C)c1ccccc1C(=O)NCC(F)F 527a_100000765723_100011218752 [0,1,0,0,0,0|3,0,0]=4 649 B16R1.4719 CC(C)CCC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210312 [0,1,0,0,0,0|3,0,0]=4 650 B16R1.4719 CC(C)CCC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210312 [0,1,0,0,0,0|3,0,0]=4 651 B16R1.4719 CC(C)CCC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210312 [0,1,0,0,0,0|3,0,0]=4 652 B16R1.4719 CC(C)CCC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210312 [0,1,0,0,0,0|3,0,0]=4 653 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1C#N)Br 11a_100000210953_100012349539 [0,1,0,0,0,0|3,0,0]=4 654 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1C#N)Br 240690a_100000210953_100012349539 [0,1,0,0,0,0|3,0,0]=4 655 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1C#N)F 11a_100000210953_100012002388 [0,1,0,0,0,0|3,0,0]=4 656 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1C#N)F 1626a_100000210953_100012002388 [0,1,0,0,0,0|3,0,0]=4 657 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1CO)F 1626a_100000210953_100013035055 [0,1,0,0,0,0|3,0,0]=4 658 B16R1.4719 CC(C)CNC(=O)c1ccc(cc1CO)F 240690a_100000210953_100013035055 [0,1,0,0,0,0|3,0,0]=4 659 B16R1.4719 CCc1cc(ccc1C(=O)CCC(C)C)Br 1458a_200012349896_100000210312 [0,1,0,0,0,0|2,0,0]=3 660 B16R1.4719 CCc1cc(ccc1C(=O)CCC(C)O)Br 1458a_200012349896_100012276601 [0,1,0,0,0,0|3,0,0]=4 661 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)C)Br 11a_100000210953_200012349896 [0,1,0,0,0,0|2,0,0]=3 662 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)C)Br 1626a_100000210953_200012349896 [0,1,0,0,0,0|2,0,0]=3 663 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)C)Br 240690a_100000210953_200012349896 [0,1,0,0,0,0|2,0,0]=3 664 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)C)Br 527a_100000210953_200012349896 [0,1,0,0,0,0|2,0,0]=3 665 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)O)Br 11a_100000210904_200012349896 [0,1,0,0,0,0|3,0,0]=4 666 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)O)Br 240690a_100000210904_200012349896 [0,1,0,0,0,0|3,0,0]=4 667 B16R1.4719 CCc1cc(ccc1C(=O)NCC(C)O)Br 527a_100000210904_200012349896 [0,1,0,0,0,0|3,0,0]=4 668 B16R1.4719 CCc1cc(ccc1C(=O)NNC(C)C)Br 22a_100000741168_200012349896 [0,1,0,0,0,0|3,0,0]=4 669 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)C)Br 1458a_100000748230_100000210312 [0,1,0,0,0,0|2,0,0]=3 670 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)C)C 1458a_100000217210_100000210312 [0,1,0,0,0,0|2,0,0]=3 671 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)C)Cl 1458a_100000217211_100000210312 [0,1,0,0,0,0|2,0,0]=3 672 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)C)F 1458a_100000239970_100000210312 [0,1,0,0,0,0|2,0,0]=3 673 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)C)I 1458a_100012353712_100000210312 [0,1,0,0,0,0|2,0,0]=3 674 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000748230_100012276601 [0,1,0,0,0,0|3,0,0]=4 675 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)C 1458a_100000217210_100012276601 [0,1,0,0,0,0|3,0,0]=4 676 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000217211_100012276601 [0,1,0,0,0,0|3,0,0]=4 677 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000239970_100012276601 [0,1,0,0,0,0|3,0,0]=4 678 B16R1.4719 COc1cc(ccc1C(=O)CCC(C)O)I 1458a_100012353712_100012276601 [0,1,0,0,0,0|3,0,0]=4 679 B16R1.4719 COc1cc(ccc1C(=O)CSC(C)C)Cl 62a_100012344415_100000210206 [0,1,0,0,0,0|3,0,0]=4 680 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Br 11a_100000210953_100000748230 [0,1,0,0,0,0|2,0,0]=3 681 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000748230 [0,1,0,0,0,0|2,0,0]=3 682 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000748230 [0,1,0,0,0,0|2,0,0]=3 683 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Br 527a_100000210953_100000748230 [0,1,0,0,0,0|2,0,0]=3 684 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)C 11a_100000210953_100000217210 [0,1,0,0,0,0|2,0,0]=3 685 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)C 1626a_100000210953_100000217210 [0,1,0,0,0,0|2,0,0]=3 686 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)C 240690a_100000210953_100000217210 [0,1,0,0,0,0|2,0,0]=3 687 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)C 527a_100000210953_100000217210 [0,1,0,0,0,0|2,0,0]=3 688 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000217211 [0,1,0,0,0,0|2,0,0]=3 689 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000217211 [0,1,0,0,0,0|2,0,0]=3 690 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000217211 [0,1,0,0,0,0|2,0,0]=3 691 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000217211 [0,1,0,0,0,0|2,0,0]=3 692 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)F 11a_100000210953_100000239970 [0,1,0,0,0,0|2,0,0]=3 693 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)F 1626a_100000210953_100000239970 [0,1,0,0,0,0|2,0,0]=3 694 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)F 240690a_100000210953_100000239970 [0,1,0,0,0,0|2,0,0]=3 695 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)F 527a_100000210953_100000239970 [0,1,0,0,0,0|2,0,0]=3 696 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)I 11a_100000210953_100012353712 [0,1,0,0,0,0|2,0,0]=3 697 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)I 1626a_100000210953_100012353712 [0,1,0,0,0,0|2,0,0]=3 698 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)I 240690a_100000210953_100012353712 [0,1,0,0,0,0|2,0,0]=3 699 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)C)I 527a_100000210953_100012353712 [0,1,0,0,0,0|2,0,0]=3 700 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Br 11a_100000210904_100000748230 [0,1,0,0,0,0|3,0,0]=4 701 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000748230 [0,1,0,0,0,0|3,0,0]=4 702 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Br 527a_100000210904_100000748230 [0,1,0,0,0,0|3,0,0]=4 703 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)C 11a_100000210904_100000217210 [0,1,0,0,0,0|3,0,0]=4 704 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)C 240690a_100000210904_100000217210 [0,1,0,0,0,0|3,0,0]=4 705 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)C 527a_100000210904_100000217210 [0,1,0,0,0,0|3,0,0]=4 706 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000217211 [0,1,0,0,0,0|3,0,0]=4 707 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000217211 [0,1,0,0,0,0|3,0,0]=4 708 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000217211 [0,1,0,0,0,0|3,0,0]=4 709 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)F 11a_100000210904_100000239970 [0,1,0,0,0,0|3,0,0]=4 710 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)F 240690a_100000210904_100000239970 [0,1,0,0,0,0|3,0,0]=4 711 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)F 527a_100000210904_100000239970 [0,1,0,0,0,0|3,0,0]=4 712 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)I 11a_100000210904_100012353712 [0,1,0,0,0,0|3,0,0]=4 713 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)I 240690a_100000210904_100012353712 [0,1,0,0,0,0|3,0,0]=4 714 B16R1.4719 COc1cc(ccc1C(=O)NCC(C)O)I 527a_100000210904_100012353712 [0,1,0,0,0,0|3,0,0]=4 715 B16R1.4719 COc1cc(ccc1C(=O)NNC(C)C)Br 22a_100000741168_100000748230 [0,1,0,0,0,0|3,0,0]=4 716 B16R1.4719 COc1cc(ccc1C(=O)NNC(C)C)C 22a_100000741168_100000217210 [0,1,0,0,0,0|3,0,0]=4 717 B16R1.4719 COc1cc(ccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000217211 [0,1,0,0,0,0|3,0,0]=4 718 B16R1.4719 COc1cc(ccc1C(=O)NNC(C)C)F 22a_100000741168_100000239970 [0,1,0,0,0,0|3,0,0]=4 719 B16R1.4719 COc1cc(ccc1C(=O)NNC(C)C)I 22a_100000741168_100012353712 [0,1,0,0,0,0|3,0,0]=4 720 B16R1.4719 Cc1ccc(c(c1)C#N)C(=O)CCC(C)C 1458a_200012184421_100000210312 [0,1,0,0,0,0|3,0,0]=4 721 B16R1.4719 Cc1ccc(c(c1)C#N)C(=O)NCC(C)C 1626a_100000210953_200012184421 [0,1,0,0,0,0|3,0,0]=4 722 B16R1.4719 Cc1ccc(c(c1)C#N)C(=O)NCC(C)C 240690a_100000210953_200012184421 [0,1,0,0,0,0|3,0,0]=4 723 B16R1.4719 Cc1ccc(c(c1)C#N)C(=O)NCC(C)C 527a_100000210953_200012184421 [0,1,0,0,0,0|3,0,0]=4 724 B16R1.5565 C#Cc1ccccc1C(=O)C(C)CC(C)C 1458a_100011243808_100000731052 [0,1,0,0,0,0|2,0,1]=4 725 B16R1.5565 C#Cc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100011243808 [0,1,0,0,0,0|2,0,1]=4 726 B16R1.5565 C=Cc1ccccc1C(=O)C(C)CC(C)C 1458a_100011830265_100000731052 [0,1,0,0,0,0|2,0,1]=4 727 B16R1.5565 C=Cc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100011830265 [0,1,0,0,0,0|2,0,1]=4 728 B16R1.5565 CC(C)CC(C)C(=O)c1ccccc1C#N 1458a_100000742908_100000731052 [0,1,0,0,0,0|3,0,0]=4 729 B16R1.5565 CC(C)CC(C)C(=O)c1ccccc1CO 1458a_100011301526_100000731052 [0,1,0,0,0,0|3,0,0]=4 730 B16R1.5565 CC(C)CC(C)C(=O)c1ccccc1I=O 1458a_100000032414_100000731052 [0,1,0,0,0,0|3,0,0]=4 731 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1C#N 11a_100000747067_100000742908 [0,1,0,0,0,0|3,0,0]=4 732 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1C#N 1626a_100000747067_100000742908 [0,1,0,0,0,0|3,0,0]=4 733 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1C#N 527a_100000747067_100000742908 [0,1,0,0,0,0|3,0,0]=4 734 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1I=O 1626a_100000747067_100000032414 [0,1,0,0,0,0|3,0,0]=4 735 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1I=O 240690a_100000747067_100000032414 [0,1,0,0,0,0|3,0,0]=4 736 B16R1.5565 CC(C)CN(C)C(=O)c1ccccc1I=O 527a_100000747067_100000032414 [0,1,0,0,0,0|3,0,0]=4 737 B16R1.5565 CCc1ccccc1C(=O)C(C)CC(C)C 1458a_100000689120_100000731052 [0,1,0,0,0,0|2,0,0]=3 738 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000689120 [0,1,0,0,0,0|2,0,0]=3 739 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000689120 [0,1,0,0,0,0|2,0,0]=3 740 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000689120 [0,1,0,0,0,0|2,0,0]=3 741 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000689120 [0,1,0,0,0,0|2,0,0]=3 742 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)O 240690a_100000227577_100000689120 [0,1,0,0,0,0|3,0,0]=4 743 B16R1.5565 CCc1ccccc1C(=O)N(C)CC(C)O 527a_100000227577_100000689120 [0,1,0,0,0,0|3,0,0]=4 744 B16R1.5565 COc1ccccc1C(=O)C(C)CC(C)C 1458a_100000185835_100000731052 [0,1,0,0,0,0|2,0,0]=3 745 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000185835 [0,1,0,0,0,0|2,0,0]=3 746 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000185835 [0,1,0,0,0,0|2,0,0]=3 747 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000185835 [0,1,0,0,0,0|2,0,0]=3 748 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000185835 [0,1,0,0,0,0|2,0,0]=3 749 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)O 240690a_100000227577_100000185835 [0,1,0,0,0,0|3,0,0]=4 750 B16R1.5565 COc1ccccc1C(=O)N(C)CC(C)O 527a_100000227577_100000185835 [0,1,0,0,0,0|3,0,0]=4 751 B16R1.5565 CSc1ccccc1C(=O)C(C)CC(C)C 1458a_100000183967_100000731052 [0,1,0,0,0,0|2,0,0]=3 752 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000183967 [0,1,0,0,0,0|2,0,0]=3 753 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000183967 [0,1,0,0,0,0|2,0,0]=3 754 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000183967 [0,1,0,0,0,0|2,0,0]=3 755 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000183967 [0,1,0,0,0,0|2,0,0]=3 756 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)O 240690a_100000227577_100000183967 [0,1,0,0,0,0|3,0,0]=4 757 B16R1.5565 CSc1ccccc1C(=O)N(C)CC(C)O 527a_100000227577_100000183967 [0,1,0,0,0,0|3,0,0]=4 758 B16R1.5566 C#Cc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100011243808 [0,1,0,0,0,0|2,0,1]=4 759 B16R1.5566 C=Cc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100011830265 [0,1,0,0,0,0|2,0,1]=4 760 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1C#N 11a_100000211541_100000742908 [0,1,0,0,0,0|3,0,0]=4 761 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1C#N 1626a_100000211541_100000742908 [0,1,0,0,0,0|3,0,0]=4 762 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1C#N 527a_100000211541_100000742908 [0,1,0,0,0,0|3,0,0]=4 763 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1I=O 1626a_100000211541_100000032414 [0,1,0,0,0,0|3,0,0]=4 764 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1I=O 240690a_100000211541_100000032414 [0,1,0,0,0,0|3,0,0]=4 765 B16R1.5566 CC(C)C(C)NC(=O)c1ccccc1I=O 527a_100000211541_100000032414 [0,1,0,0,0,0|3,0,0]=4 766 B16R1.5566 CCc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000689120_100000753385 [0,1,0,0,0,0|2,0,1]=4 767 B16R1.5566 CCc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000689120 [0,1,0,0,0,0|2,0,0]=3 768 B16R1.5566 CCc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000689120 [0,1,0,0,0,0|2,0,0]=3 769 B16R1.5566 CCc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000689120 [0,1,0,0,0,0|2,0,0]=3 770 B16R1.5566 CCc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000689120 [0,1,0,0,0,0|2,0,0]=3 771 B16R1.5566 COc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000185835_100000753385 [0,1,0,0,0,0|2,0,1]=4 772 B16R1.5566 COc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000210198_100000195505 [0,1,0,0,0,0|2,0,1]=4 773 B16R1.5566 COc1ccccc1C(=O)CN(C)C(C)C 269982a_200000211004_100000195505 [0,1,0,0,0,0|3,0,0]=4 774 B16R1.5566 COc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000185835 [0,1,0,0,0,0|2,0,0]=3 775 B16R1.5566 COc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000185835 [0,1,0,0,0,0|2,0,0]=3 776 B16R1.5566 COc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000185835 [0,1,0,0,0,0|2,0,0]=3 777 B16R1.5566 COc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000185835 [0,1,0,0,0,0|2,0,0]=3 778 B16R1.5566 CSc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000183967_100000753385 [0,1,0,0,0,0|2,0,1]=4 779 B16R1.5566 CSc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000183967 [0,1,0,0,0,0|2,0,0]=3 780 B16R1.5566 CSc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000183967 [0,1,0,0,0,0|2,0,0]=3 781 B16R1.5566 CSc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000183967 [0,1,0,0,0,0|2,0,0]=3 782 B16R1.5566 CSc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000183967 [0,1,0,0,0,0|2,0,0]=3 783 B16R1.5567 C#Cc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100011243808 [0,1,0,0,0,0|2,0,1]=4 784 B16R1.5567 C#Cc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100011243808 [0,1,0,0,0,0|2,0,1]=4 785 B16R1.5567 C#Cc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100011243808 [0,1,0,0,0,0|2,0,1]=4 786 B16R1.5567 C=Cc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100011830265 [0,1,0,0,0,0|2,0,1]=4 787 B16R1.5567 C=Cc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100011830265 [0,1,0,0,0,0|2,0,1]=4 788 B16R1.5567 CC(CO)CNC(=O)c1ccccc1C#N 527a_100000744482_100000742908 [0,1,0,0,0,0|3,0,0]=4 789 B16R1.5567 CC(CO)CNC(=O)c1ccccc1I=O 240690a_100000744482_100000032414 [0,1,0,0,0,0|3,0,0]=4 790 B16R1.5567 CC(CO)CNC(=O)c1ccccc1I=O 527a_100000744482_100000032414 [0,1,0,0,0,0|3,0,0]=4 791 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 11a_100020588543_100000742908 [0,1,0,0,0,0|3,0,0]=4 792 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 1626a_100020588543_100000742908 [0,1,0,0,0,0|3,0,0]=4 793 B16R1.5567 CCC(C)CNC(=O)c1ccccc1C#N 527a_100020588543_100000742908 [0,1,0,0,0,0|3,0,0]=4 794 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 1626a_100020588543_100000032414 [0,1,0,0,0,0|3,0,0]=4 795 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 240690a_100020588543_100000032414 [0,1,0,0,0,0|3,0,0]=4 796 B16R1.5567 CCC(C)CNC(=O)c1ccccc1I=O 527a_100020588543_100000032414 [0,1,0,0,0,0|3,0,0]=4 797 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 11a_100020588543_100000185835 [0,1,0,0,0,0|2,0,0]=3 798 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 1626a_100020588543_100000185835 [0,1,0,0,0,0|2,0,0]=3 799 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 240690a_100020588543_100000185835 [0,1,0,0,0,0|2,0,0]=3 800 B16R1.5567 CCC(C)CNC(=O)c1ccccc1OC 527a_100020588543_100000185835 [0,1,0,0,0,0|2,0,0]=3 801 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 11a_100020588543_100000183967 [0,1,0,0,0,0|2,0,0]=3 802 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 1626a_100020588543_100000183967 [0,1,0,0,0,0|2,0,0]=3 803 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 240690a_100020588543_100000183967 [0,1,0,0,0,0|2,0,0]=3 804 B16R1.5567 CCC(C)CNC(=O)c1ccccc1SC 527a_100020588543_100000183967 [0,1,0,0,0,0|2,0,0]=3 805 B16R1.5567 CCC(C)COC(C)c1ccccc1OC 7a_100000742714_100000748023 [0,1,0,0,0,0|2,0,1]=4 806 B16R1.5567 CCC(C)NN=C(C)c1ccccc1NC 4a_100000718999_100000020593 [0,1,0,0,0,0|3,0,0]=4 807 B16R1.5567 CCC(C)NNC(=O)c1ccccc1OC 22a_100000718999_100000185835 [0,1,0,0,0,0|3,0,0]=4 808 B16R1.5567 CCC(C)NNC(=O)c1ccccc1SC 22a_100000718999_100000183967 [0,1,0,0,0,0|3,0,0]=4 809 B16R1.5567 CCC(C)OCC(=O)c1ccccc1OC 7a_100000210228_100000195505 [0,1,0,0,0,0|3,0,0]=4 810 B16R1.5567 CCC(C)SCC(=O)c1ccccc1OC 62a_100000195505_100000758301 [0,1,0,0,0,0|3,0,0]=4 811 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 11a_100011218483_100000185835 [0,1,0,0,0,0|3,0,0]=4 812 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 240690a_100011218483_100000185835 [0,1,0,0,0,0|3,0,0]=4 813 B16R1.5567 CCC(O)CNC(=O)c1ccccc1OC 527a_100011218483_100000185835 [0,1,0,0,0,0|3,0,0]=4 814 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 11a_100011218483_100000183967 [0,1,0,0,0,0|3,0,0]=4 815 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 240690a_100011218483_100000183967 [0,1,0,0,0,0|3,0,0]=4 816 B16R1.5567 CCC(O)CNC(=O)c1ccccc1SC 527a_100011218483_100000183967 [0,1,0,0,0,0|3,0,0]=4 817 B16R1.5567 CC[C@H](C)COC(C)c1ccccc1OC 7a_100000742714_100009816398 [0,1,0,0,0,0|2,0,1]=4 818 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 11a_100020588543_100000689120 [0,1,0,0,0,0|2,0,0]=3 819 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100000689120 [0,1,0,0,0,0|2,0,0]=3 820 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 240690a_100020588543_100000689120 [0,1,0,0,0,0|2,0,0]=3 821 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100000689120 [0,1,0,0,0,0|2,0,0]=3 822 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000689120 [0,1,0,0,0,0|2,0,0]=3 823 B16R1.5567 CCc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000689120 [0,1,0,0,0,0|2,0,0]=3 824 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 11a_100011218483_100000689120 [0,1,0,0,0,0|3,0,0]=4 825 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 240690a_100011218483_100000689120 [0,1,0,0,0,0|3,0,0]=4 826 B16R1.5567 CCc1ccccc1C(=O)NCC(O)CC 527a_100011218483_100000689120 [0,1,0,0,0,0|3,0,0]=4 827 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000689120 [0,1,0,0,0,0|2,0,0]=3 828 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000689120 [0,1,0,0,0,0|2,0,0]=3 829 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000689120 [0,1,0,0,0,0|2,0,0]=3 830 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000689120 [0,1,0,0,0,0|2,0,0]=3 831 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000689120 [0,1,0,0,0,0|3,0,0]=4 832 B16R1.5567 CCc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000689120 [0,1,0,0,0,0|3,0,0]=4 833 B16R1.5567 CCc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000689120 [0,1,0,0,0,0|3,0,0]=4 834 B16R1.5567 CCc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000689120 [0,1,0,0,0,0|3,0,0]=4 835 B16R1.5567 CCc1ccccc1C(=O)NNC(C)CC 22a_100000718999_100000689120 [0,1,0,0,0,0|3,0,0]=4 836 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1C#N 11a_100020591295_100000742908 [0,1,0,0,0,0|3,0,0]=4 837 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1C#N 1626a_100020591295_100000742908 [0,1,0,0,0,0|3,0,0]=4 838 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1C#N 527a_100020591295_100000742908 [0,1,0,0,0,0|3,0,0]=4 839 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1I=O 1626a_100020591295_100000032414 [0,1,0,0,0,0|3,0,0]=4 840 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1I=O 240690a_100020591295_100000032414 [0,1,0,0,0,0|3,0,0]=4 841 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1I=O 527a_100020591295_100000032414 [0,1,0,0,0,0|3,0,0]=4 842 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1SC 11a_100020591295_100000183967 [0,1,0,0,0,0|2,0,0]=3 843 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1SC 1626a_100020591295_100000183967 [0,1,0,0,0,0|2,0,0]=3 844 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1SC 240690a_100020591295_100000183967 [0,1,0,0,0,0|2,0,0]=3 845 B16R1.5567 CO[C@H](C)CNC(=O)c1ccccc1SC 527a_100020591295_100000183967 [0,1,0,0,0,0|2,0,0]=3 846 B16R1.5567 COc1ccccc1C(=O)COC(C)CF 34a_100016041109_100000195505 [0,1,0,0,0,0|3,0,0]=4 847 B16R1.5567 COc1ccccc1C(=O)COC(C)CF 7a_100016041109_100000195505 [0,1,0,0,0,0|3,0,0]=4 848 B16R1.5567 COc1ccccc1C(=O)COC(C)CN 34a_100000210904_100000195505 [0,1,0,0,0,0|3,0,0]=4 849 B16R1.5567 COc1ccccc1C(=O)CSC(C)OC 62a_100000195505_100009879195 [0,1,0,0,0,0|3,0,0]=4 850 B16R1.5567 COc1ccccc1C(=O)CS[C@H](C)CO 62a_100000195505_100016084084 [0,1,0,0,0,0|3,0,0]=4 851 B16R1.5567 COc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000185835 [0,1,0,0,0,0|2,0,0]=3 852 B16R1.5567 COc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000185835 [0,1,0,0,0,0|2,0,0]=3 853 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000185835 [0,1,0,0,0,0|2,0,0]=3 854 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000185835 [0,1,0,0,0,0|2,0,0]=3 855 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000185835 [0,1,0,0,0,0|2,0,0]=3 856 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000185835 [0,1,0,0,0,0|2,0,0]=3 857 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000185835 [0,1,0,0,0,0|3,0,0]=4 858 B16R1.5567 COc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000185835 [0,1,0,0,0,0|3,0,0]=4 859 B16R1.5567 COc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000185835 [0,1,0,0,0,0|3,0,0]=4 860 B16R1.5567 COc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000185835 [0,1,0,0,0,0|3,0,0]=4 861 B16R1.5567 COc1ccccc1C(C)OC[C@@H](C)CO 7a_100000742714_100000059175 [0,1,0,0,0,0|2,0,1]=4 862 B16R1.5567 CSc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000183967 [0,1,0,0,0,0|2,0,0]=3 863 B16R1.5567 CSc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000183967 [0,1,0,0,0,0|2,0,0]=3 864 B16R1.5567 CSc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000183967 [0,1,0,0,0,0|3,0,0]=4 865 B16R1.5567 CSc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000183967 [0,1,0,0,0,0|3,0,0]=4 866 B16R1.5567 CSc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000183967 [0,1,0,0,0,0|3,0,0]=4 867 B16R1.5567 CSc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000183967 [0,1,0,0,0,0|3,0,0]=4 868 B16R1.5950 CC(C)CCC(=O)c1cccc(c1C#N)F 1458a_100000702252_100000210312 [0,1,0,0,0,0|3,0,0]=4 869 B16R1.5950 CC(C)CNC(=O)c1cccc(c1C#N)F 240690a_100000210953_100000702252 [0,1,0,0,0,0|3,0,0]=4 870 B16R1.5950 CC(C)CNC(=O)c1cccc(c1C#N)F 527a_100000210953_100000702252 [0,1,0,0,0,0|3,0,0]=4 871 B16R1.5950 CCc1c(cccc1C(=O)CCC(C)C)Br 1458a_100010125490_100000210312 [0,1,0,0,0,0|2,0,0]=3 872 B16R1.5950 CCc1c(cccc1C(=O)CCC(C)O)Br 1458a_100010125490_100012276601 [0,1,0,0,0,0|3,0,0]=4 873 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)C)Br 11a_100000210953_100010125490 [0,1,0,0,0,0|2,0,0]=3 874 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)C)Br 1626a_100000210953_100010125490 [0,1,0,0,0,0|2,0,0]=3 875 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)C)Br 240690a_100000210953_100010125490 [0,1,0,0,0,0|2,0,0]=3 876 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)C)Br 527a_100000210953_100010125490 [0,1,0,0,0,0|2,0,0]=3 877 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)O)Br 11a_100000210904_100010125490 [0,1,0,0,0,0|3,0,0]=4 878 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)O)Br 240690a_100000210904_100010125490 [0,1,0,0,0,0|3,0,0]=4 879 B16R1.5950 CCc1c(cccc1C(=O)NCC(C)O)Br 527a_100000210904_100010125490 [0,1,0,0,0,0|3,0,0]=4 880 B16R1.5950 CCc1c(cccc1C(=O)NNC(C)C)Br 22a_100000741168_100010125490 [0,1,0,0,0,0|3,0,0]=4 881 B16R1.5950 COc1c(cccc1C(=O)CCC(C)C)Br 1458a_100000689802_100000210312 [0,1,0,0,0,0|2,0,0]=3 882 B16R1.5950 COc1c(cccc1C(=O)CCC(C)C)C 1458a_100000187929_100000210312 [0,1,0,0,0,0|2,0,0]=3 883 B16R1.5950 COc1c(cccc1C(=O)CCC(C)C)Cl 1458a_100011934004_100000210312 [0,1,0,0,0,0|2,0,0]=3 884 B16R1.5950 COc1c(cccc1C(=O)CCC(C)C)F 1458a_100011218433_100000210312 [0,1,0,0,0,0|2,0,0]=3 885 B16R1.5950 COc1c(cccc1C(=O)CCC(C)C)O 1458a_100000080799_100000210312 [0,1,0,0,0,0|2,0,0]=3 886 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)Br 1458a_100000689802_100012276601 [0,1,0,0,0,0|3,0,0]=4 887 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)C 1458a_100000187929_100012276601 [0,1,0,0,0,0|3,0,0]=4 888 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)Cl 1458a_100011934004_100012276601 [0,1,0,0,0,0|3,0,0]=4 889 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)F 1458a_100011218433_100012276601 [0,1,0,0,0,0|3,0,0]=4 890 B16R1.5950 COc1c(cccc1C(=O)CCC(C)O)O 1458a_100000080799_100012276601 [0,1,0,0,0,0|3,0,0]=4 891 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Br 11a_100000210953_100000689802 [0,1,0,0,0,0|2,0,0]=3 892 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000689802 [0,1,0,0,0,0|2,0,0]=3 893 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000689802 [0,1,0,0,0,0|2,0,0]=3 894 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Br 527a_100000210953_100000689802 [0,1,0,0,0,0|2,0,0]=3 895 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)C 11a_100000210953_100000187929 [0,1,0,0,0,0|2,0,0]=3 896 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)C 1626a_100000210953_100000187929 [0,1,0,0,0,0|2,0,0]=3 897 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)C 240690a_100000210953_100000187929 [0,1,0,0,0,0|2,0,0]=3 898 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)C 527a_100000210953_100000187929 [0,1,0,0,0,0|2,0,0]=3 899 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Cl 11a_100000210953_100011934004 [0,1,0,0,0,0|2,0,0]=3 900 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100011934004 [0,1,0,0,0,0|2,0,0]=3 901 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100011934004 [0,1,0,0,0,0|2,0,0]=3 902 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)Cl 527a_100000210953_100011934004 [0,1,0,0,0,0|2,0,0]=3 903 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)F 11a_100000210953_100011218433 [0,1,0,0,0,0|2,0,0]=3 904 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)F 1626a_100000210953_100011218433 [0,1,0,0,0,0|2,0,0]=3 905 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)F 240690a_100000210953_100011218433 [0,1,0,0,0,0|2,0,0]=3 906 B16R1.5950 COc1c(cccc1C(=O)NCC(C)C)F 527a_100000210953_100011218433 [0,1,0,0,0,0|2,0,0]=3 907 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Br 11a_100000210904_100000689802 [0,1,0,0,0,0|3,0,0]=4 908 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000689802 [0,1,0,0,0,0|3,0,0]=4 909 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Br 527a_100000210904_100000689802 [0,1,0,0,0,0|3,0,0]=4 910 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)C 11a_100000210904_100000187929 [0,1,0,0,0,0|3,0,0]=4 911 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)C 240690a_100000210904_100000187929 [0,1,0,0,0,0|3,0,0]=4 912 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)C 527a_100000210904_100000187929 [0,1,0,0,0,0|3,0,0]=4 913 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Cl 11a_100000210904_100011934004 [0,1,0,0,0,0|3,0,0]=4 914 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100011934004 [0,1,0,0,0,0|3,0,0]=4 915 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)Cl 527a_100000210904_100011934004 [0,1,0,0,0,0|3,0,0]=4 916 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)F 11a_100000210904_100011218433 [0,1,0,0,0,0|3,0,0]=4 917 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)F 240690a_100000210904_100011218433 [0,1,0,0,0,0|3,0,0]=4 918 B16R1.5950 COc1c(cccc1C(=O)NCC(C)O)F 527a_100000210904_100011218433 [0,1,0,0,0,0|3,0,0]=4 919 B16R1.5950 COc1c(cccc1C(=O)NNC(C)C)Br 22a_100000741168_100000689802 [0,1,0,0,0,0|3,0,0]=4 920 B16R1.5950 COc1c(cccc1C(=O)NNC(C)C)C 22a_100000741168_100000187929 [0,1,0,0,0,0|3,0,0]=4 921 B16R1.5950 COc1c(cccc1C(=O)NNC(C)C)Cl 22a_100000741168_100011934004 [0,1,0,0,0,0|3,0,0]=4 922 B16R1.5950 COc1c(cccc1C(=O)NNC(C)C)F 22a_100000741168_100011218433 [0,1,0,0,0,0|3,0,0]=4 923 B16R1.5950 COc1c(cccc1C(=O)NNC(C)C)O 22a_100000741168_100000080799 [0,1,0,0,0,0|3,0,0]=4 924 B16R1.18701 C#Cc1ccccc1C(=O)CCC(C)(C)C 1458a_100011243808_100000755188 [0,1,0,0,0,0|2,0,1]=4 925 B16R1.18701 C#Cc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100011243808 [0,1,0,0,0,0|2,0,1]=4 926 B16R1.18701 C#Cc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100011243808 [0,1,0,0,0,0|2,0,1]=4 927 B16R1.18701 C#Cc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100011243808 [0,1,0,0,0,0|2,0,1]=4 928 B16R1.18701 C=Cc1ccccc1C(=O)CCC(C)(C)C 1458a_100011830265_100000755188 [0,1,0,0,0,0|2,0,1]=4 929 B16R1.18701 C=Cc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100011830265 [0,1,0,0,0,0|2,0,1]=4 930 B16R1.18701 C=Cc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100011830265 [0,1,0,0,0,0|2,0,1]=4 931 B16R1.18701 C=Cc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100011830265 [0,1,0,0,0,0|2,0,1]=4 932 B16R1.18701 CC(C)(C)CCC(=O)c1ccccc1C#N 1458a_100000742908_100000755188 [0,1,0,0,0,0|3,0,0]=4 933 B16R1.18701 CC(C)(C)CCC(=O)c1ccccc1CO 1458a_100011301526_100000755188 [0,1,0,0,0,0|3,0,0]=4 934 B16R1.18701 CC(C)(C)CCC(=O)c1ccccc1I=O 1458a_100000032414_100000755188 [0,1,0,0,0,0|3,0,0]=4 935 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1C#N 11a_100000743828_100000742908 [0,1,0,0,0,0|3,0,0]=4 936 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1C#N 1626a_100000743828_100000742908 [0,1,0,0,0,0|3,0,0]=4 937 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1C#N 527a_100000743828_100000742908 [0,1,0,0,0,0|3,0,0]=4 938 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1I=O 1626a_100000743828_100000032414 [0,1,0,0,0,0|3,0,0]=4 939 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1I=O 240690a_100000743828_100000032414 [0,1,0,0,0,0|3,0,0]=4 940 B16R1.18701 CC(C)(C)CNC(=O)c1ccccc1I=O 527a_100000743828_100000032414 [0,1,0,0,0,0|3,0,0]=4 941 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1C#N 11a_100020643315_100000742908 [0,1,0,0,0,0|3,0,0]=4 942 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1C#N 1626a_100020643315_100000742908 [0,1,0,0,0,0|3,0,0]=4 943 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1C#N 527a_100020643315_100000742908 [0,1,0,0,0,0|3,0,0]=4 944 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1I=O 1626a_100020643315_100000032414 [0,1,0,0,0,0|3,0,0]=4 945 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1I=O 240690a_100020643315_100000032414 [0,1,0,0,0,0|3,0,0]=4 946 B16R1.18701 CC(C)(F)CNC(=O)c1ccccc1I=O 527a_100020643315_100000032414 [0,1,0,0,0,0|3,0,0]=4 947 B16R1.18701 CC(C)(O)CNC(=O)c1ccccc1C#N 1626a_100000751335_100000742908 [0,1,0,0,0,0|3,0,0]=4 948 B16R1.18701 CC(C)(O)CNC(=O)c1ccccc1C#N 527a_100000751335_100000742908 [0,1,0,0,0,0|3,0,0]=4 949 B16R1.18701 CC(C)(O)CNC(=O)c1ccccc1I=O 1626a_100000751335_100000032414 [0,1,0,0,0,0|3,0,0]=4 950 B16R1.18701 CC(C)(O)CNC(=O)c1ccccc1I=O 240690a_100000751335_100000032414 [0,1,0,0,0,0|3,0,0]=4 951 B16R1.18701 CC(C)(O)CNC(=O)c1ccccc1I=O 527a_100000751335_100000032414 [0,1,0,0,0,0|3,0,0]=4 952 B16R1.18701 CCc1ccccc1C(=O)CCC(C)(C)C 1458a_100000689120_100000755188 [0,1,0,0,0,0|2,0,0]=3 953 B16R1.18701 CCc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000689120_100000085578 [0,1,0,0,0,0|3,0,0]=4 954 B16R1.18701 CCc1ccccc1C(=O)CC[Si](C)(C)C 1458a_100000689120_200000733723 [0,1,0,0,0,0|2,1,0]=4 955 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000689120 [0,1,0,0,0,0|2,0,0]=3 956 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000689120 [0,1,0,0,0,0|2,0,0]=3 957 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000689120 [0,1,0,0,0,0|2,0,0]=3 958 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000689120 [0,1,0,0,0,0|2,0,0]=3 959 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000689120 [0,1,0,0,0,0|2,0,0]=3 960 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000689120 [0,1,0,0,0,0|2,0,0]=3 961 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000689120 [0,1,0,0,0,0|2,0,0]=3 962 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000689120 [0,1,0,0,0,0|2,0,0]=3 963 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000689120 [0,1,0,0,0,0|2,0,0]=3 964 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000689120 [0,1,0,0,0,0|2,0,0]=3 965 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000689120 [0,1,0,0,0,0|2,0,0]=3 966 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100000689120 [0,1,0,0,0,0|3,0,0]=4 967 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100000689120 [0,1,0,0,0,0|3,0,0]=4 968 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100000689120 [0,1,0,0,0,0|3,0,0]=4 969 B16R1.18701 CCc1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100000689120 [0,1,0,0,0,0|3,0,0]=4 970 B16R1.18701 CCc1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100000689120 [0,1,0,0,0,0|2,1,0]=4 971 B16R1.18701 CCc1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100000689120 [0,1,0,0,0,0|2,1,0]=4 972 B16R1.18701 CCc1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100000689120 [0,1,0,0,0,0|2,1,0]=4 973 B16R1.18701 CCc1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100000689120 [0,1,0,0,0,0|2,1,0]=4 974 B16R1.18701 CCc1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100000689120 [0,1,0,0,0,0|3,0,0]=4 975 B16R1.18701 CNc1ccccc1C(=NNC(C)(C)C)C 4a_100000725372_100000020593 [0,1,0,0,0,0|3,0,0]=4 976 B16R1.18701 COc1ccccc1C(=O)CCC(C)(C)C 1458a_100000185835_100000755188 [0,1,0,0,0,0|2,0,0]=3 977 B16R1.18701 COc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000185835_100000085578 [0,1,0,0,0,0|3,0,0]=4 978 B16R1.18701 COc1ccccc1C(=O)CC[Si](C)(C)C 1458a_100000185835_200000733723 [0,1,0,0,0,0|2,1,0]=4 979 B16R1.18701 COc1ccccc1C(=O)COC(C)(C)C 34a_100015890283_100000195505 [0,1,0,0,0,0|3,0,0]=4 980 B16R1.18701 COc1ccccc1C(=O)COC(C)(C)C 7a_100015890283_100000195505 [0,1,0,0,0,0|3,0,0]=4 981 B16R1.18701 COc1ccccc1C(=O)CSC(C)(C)C 62a_100000195505_100000211941 [0,1,0,0,0,0|3,0,0]=4 982 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000185835 [0,1,0,0,0,0|2,0,0]=3 983 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000185835 [0,1,0,0,0,0|2,0,0]=3 984 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000185835 [0,1,0,0,0,0|2,0,0]=3 985 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000185835 [0,1,0,0,0,0|2,0,0]=3 986 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000185835 [0,1,0,0,0,0|2,0,0]=3 987 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000185835 [0,1,0,0,0,0|2,0,0]=3 988 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000185835 [0,1,0,0,0,0|2,0,0]=3 989 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000185835 [0,1,0,0,0,0|2,0,0]=3 990 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000185835 [0,1,0,0,0,0|2,0,0]=3 991 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000185835 [0,1,0,0,0,0|2,0,0]=3 992 B16R1.18701 COc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000185835 [0,1,0,0,0,0|2,0,0]=3 993 B16R1.18701 COc1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100000185835 [0,1,0,0,0,0|3,0,0]=4 994 B16R1.18701 COc1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100000185835 [0,1,0,0,0,0|3,0,0]=4 995 B16R1.18701 COc1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100000185835 [0,1,0,0,0,0|3,0,0]=4 996 B16R1.18701 COc1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100000185835 [0,1,0,0,0,0|3,0,0]=4 997 B16R1.18701 COc1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100000185835 [0,1,0,0,0,0|2,1,0]=4 998 B16R1.18701 COc1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100000185835 [0,1,0,0,0,0|2,1,0]=4 999 B16R1.18701 COc1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100000185835 [0,1,0,0,0,0|2,1,0]=4 1000 B16R1.18701 COc1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100000185835 [0,1,0,0,0,0|2,1,0]=4 1001 B16R1.18701 COc1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100000185835 [0,1,0,0,0,0|3,0,0]=4 1002 B16R1.18701 COc1ccccc1C(C)OCC(C)(C)O 7a_100000742714_100000764493 [0,1,0,0,0,0|2,0,1]=4 1003 B16R1.18701 CSc1ccccc1C(=O)CCC(C)(C)C 1458a_100000183967_100000755188 [0,1,0,0,0,0|2,0,0]=3 1004 B16R1.18701 CSc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000183967_100000085578 [0,1,0,0,0,0|3,0,0]=4 1005 B16R1.18701 CSc1ccccc1C(=O)CC[Si](C)(C)C 1458a_100000183967_200000733723 [0,1,0,0,0,0|2,1,0]=4 1006 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000183967 [0,1,0,0,0,0|2,0,0]=3 1007 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000183967 [0,1,0,0,0,0|2,0,0]=3 1008 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000183967 [0,1,0,0,0,0|2,0,0]=3 1009 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000183967 [0,1,0,0,0,0|2,0,0]=3 1010 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000183967 [0,1,0,0,0,0|2,0,0]=3 1011 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000183967 [0,1,0,0,0,0|2,0,0]=3 1012 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000183967 [0,1,0,0,0,0|2,0,0]=3 1013 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000183967 [0,1,0,0,0,0|2,0,0]=3 1014 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000183967 [0,1,0,0,0,0|2,0,0]=3 1015 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000183967 [0,1,0,0,0,0|2,0,0]=3 1016 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000183967 [0,1,0,0,0,0|2,0,0]=3 1017 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100000183967 [0,1,0,0,0,0|3,0,0]=4 1018 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100000183967 [0,1,0,0,0,0|3,0,0]=4 1019 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100000183967 [0,1,0,0,0,0|3,0,0]=4 1020 B16R1.18701 CSc1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100000183967 [0,1,0,0,0,0|3,0,0]=4 1021 B16R1.18701 CSc1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100000183967 [0,1,0,0,0,0|2,1,0]=4 1022 B16R1.18701 CSc1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100000183967 [0,1,0,0,0,0|2,1,0]=4 1023 B16R1.18701 CSc1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100000183967 [0,1,0,0,0,0|2,1,0]=4 1024 B16R1.18701 CSc1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100000183967 [0,1,0,0,0,0|2,1,0]=4 1025 B16R1.18701 CSc1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100000183967 [0,1,0,0,0,0|3,0,0]=4 1026 B16R1.18705 CCc1ccccc1S(=O)(=O)NCC(C)C 270084a_100000210953_100000708428 [0,1,0,0,0,0|3,0,0]=4 1027 B16R1.18705 CCc1ccccc1S(=O)(=O)NCC(C)C 274078a_100000210953_100000708428 [0,1,0,0,0,0|3,0,0]=4 1028 B16R1.18705 COc1ccccc1S(=O)(=O)NCC(C)C 270084a_100000210953_100000183792 [0,1,0,0,0,0|3,0,0]=4 1029 B16R1.18705 COc1ccccc1S(=O)(=O)NCC(C)C 274078a_100000210953_100000183792 [0,1,0,0,0,0|3,0,0]=4 1030 B16R1.19821 CC(C)CCC(=O)c1c(cccc1C#N)Br 1458a_200010145881_100000210312 [0,1,0,0,0,0|3,0,0]=4 1031 B16R1.19821 CC(C)CNC(=O)c1c(cccc1C#N)Br 240690a_100000210953_200010145881 [0,1,0,0,0,0|3,0,0]=4 1032 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)Br 1458a_100011593405_100000210312 [0,1,0,0,0,0|2,0,0]=3 1033 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)C 1458a_100000066212_100000210312 [0,1,0,0,0,0|2,0,0]=3 1034 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)Cl 1458a_100000743539_100000210312 [0,1,0,0,0,0|2,0,0]=3 1035 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)F 1458a_100000759380_100000210312 [0,1,0,0,0,0|2,0,0]=3 1036 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)I 1458a_100010179659_100000210312 [0,1,0,0,0,0|2,0,0]=3 1037 B16R1.19821 COc1cccc(c1C(=O)CCC(C)C)O 1458a_100000043310_100000210312 [0,1,0,0,0,0|2,0,0]=3 1038 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)Br 1458a_100011593405_100012276601 [0,1,0,0,0,0|3,0,0]=4 1039 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)C 1458a_100000066212_100012276601 [0,1,0,0,0,0|3,0,0]=4 1040 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)Cl 1458a_100000743539_100012276601 [0,1,0,0,0,0|3,0,0]=4 1041 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)F 1458a_100000759380_100012276601 [0,1,0,0,0,0|3,0,0]=4 1042 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)I 1458a_100010179659_100012276601 [0,1,0,0,0,0|3,0,0]=4 1043 B16R1.19821 COc1cccc(c1C(=O)CCC(C)O)O 1458a_100000043310_100012276601 [0,1,0,0,0,0|3,0,0]=4 1044 B16R1.19821 COc1cccc(c1C(=O)CNC(C)C)Cl 2230a_100138425928_100010768284 [0,1,0,0,0,0|3,0,0]=4 1045 B16R1.19821 COc1cccc(c1C(=O)CNC(C)C)Cl 34a_100138425928_100010768284 [0,1,0,0,0,0|3,0,0]=4 1046 B16R1.19821 COc1cccc(c1C(=O)COC(C)C)Cl 34a_100000212225_100010768284 [0,1,0,0,0,0|3,0,0]=4 1047 B16R1.19821 COc1cccc(c1C(=O)CSC(C)C)Cl 62a_100010768284_100000210206 [0,1,0,0,0,0|3,0,0]=4 1048 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Br 11a_100000210953_100011593405 [0,1,0,0,0,0|2,0,0]=3 1049 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Br 1626a_100000210953_100011593405 [0,1,0,0,0,0|2,0,0]=3 1050 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Br 240690a_100000210953_100011593405 [0,1,0,0,0,0|2,0,0]=3 1051 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Br 527a_100000210953_100011593405 [0,1,0,0,0,0|2,0,0]=3 1052 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)C 11a_100000210953_100000066212 [0,1,0,0,0,0|2,0,0]=3 1053 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)C 1626a_100000210953_100000066212 [0,1,0,0,0,0|2,0,0]=3 1054 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)C 240690a_100000210953_100000066212 [0,1,0,0,0,0|2,0,0]=3 1055 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Cl 11a_100000210953_100000743539 [0,1,0,0,0,0|2,0,0]=3 1056 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Cl 1626a_100000210953_100000743539 [0,1,0,0,0,0|2,0,0]=3 1057 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Cl 240690a_100000210953_100000743539 [0,1,0,0,0,0|2,0,0]=3 1058 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)Cl 527a_100000210953_100000743539 [0,1,0,0,0,0|2,0,0]=3 1059 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)F 11a_100000210953_100000759380 [0,1,0,0,0,0|2,0,0]=3 1060 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)F 1626a_100000210953_100000759380 [0,1,0,0,0,0|2,0,0]=3 1061 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)F 240690a_100000210953_100000759380 [0,1,0,0,0,0|2,0,0]=3 1062 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)F 527a_100000210953_100000759380 [0,1,0,0,0,0|2,0,0]=3 1063 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)I 11a_100000210953_100010179659 [0,1,0,0,0,0|2,0,0]=3 1064 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)I 1626a_100000210953_100010179659 [0,1,0,0,0,0|2,0,0]=3 1065 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)I 240690a_100000210953_100010179659 [0,1,0,0,0,0|2,0,0]=3 1066 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)I 527a_100000210953_100010179659 [0,1,0,0,0,0|2,0,0]=3 1067 B16R1.19821 COc1cccc(c1C(=O)NCC(C)C)O 240690a_100000210953_100000043310 [0,1,0,0,0,0|2,0,0]=3 1068 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Br 11a_100000210904_100011593405 [0,1,0,0,0,0|3,0,0]=4 1069 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Br 240690a_100000210904_100011593405 [0,1,0,0,0,0|3,0,0]=4 1070 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Br 527a_100000210904_100011593405 [0,1,0,0,0,0|3,0,0]=4 1071 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)C 11a_100000210904_100000066212 [0,1,0,0,0,0|3,0,0]=4 1072 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)C 240690a_100000210904_100000066212 [0,1,0,0,0,0|3,0,0]=4 1073 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Cl 11a_100000210904_100000743539 [0,1,0,0,0,0|3,0,0]=4 1074 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Cl 240690a_100000210904_100000743539 [0,1,0,0,0,0|3,0,0]=4 1075 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)Cl 527a_100000210904_100000743539 [0,1,0,0,0,0|3,0,0]=4 1076 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)F 11a_100000210904_100000759380 [0,1,0,0,0,0|3,0,0]=4 1077 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)F 240690a_100000210904_100000759380 [0,1,0,0,0,0|3,0,0]=4 1078 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)F 527a_100000210904_100000759380 [0,1,0,0,0,0|3,0,0]=4 1079 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)I 11a_100000210904_100010179659 [0,1,0,0,0,0|3,0,0]=4 1080 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)I 240690a_100000210904_100010179659 [0,1,0,0,0,0|3,0,0]=4 1081 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)I 527a_100000210904_100010179659 [0,1,0,0,0,0|3,0,0]=4 1082 B16R1.19821 COc1cccc(c1C(=O)NCC(C)O)O 240690a_100000210904_100000043310 [0,1,0,0,0,0|3,0,0]=4 1083 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)Br 22a_100000741168_100011593405 [0,1,0,0,0,0|3,0,0]=4 1084 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)C 22a_100000741168_100000066212 [0,1,0,0,0,0|3,0,0]=4 1085 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)Cl 22a_100000741168_100000743539 [0,1,0,0,0,0|3,0,0]=4 1086 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)F 22a_100000741168_100000759380 [0,1,0,0,0,0|3,0,0]=4 1087 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)I 22a_100000741168_100010179659 [0,1,0,0,0,0|3,0,0]=4 1088 B16R1.19821 COc1cccc(c1C(=O)NNC(C)C)O 22a_100000741168_100000043310 [0,1,0,0,0,0|3,0,0]=4 1089 B16R2.26 CC1CC=C(CC1)c2ccccc2NN 271570a_100010240233_100000241748 [0,0,0,1,0,0|3,0,0]=4 1090 B16R2.26 CC1CCN(CC1)c2ccccc2N[13CH3] 34a_200000187776_200025704644 [0,0,0,1,0,0|3,0,0]=4 1091 B16R2.26 CCc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100011215823 [0,0,0,1,0,0|3,0,0]=4 1092 B16R2.26 CNc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100020606079 [0,0,0,1,0,0|2,0,0]=3 1093 B16R2.26 CNc1ccccc1C2=CCC(CC2)O 271570a_100010254553_100020606079 [0,0,0,1,0,0|3,0,0]=4 1094 B16R2.26 CNc1ccccc1N2CCC(CC2)C 34a_200000187776_200000210301 [0,0,0,1,0,0|3,0,0]=4 1095 B16R2.26 CNc1cccnc1C2=CCC(CC2)C 271570a_100010240233_200011806188 [0,0,0,1,0,0|3,0,0]=4 1096 B16R2.26 CNc1ccncc1C2=CCC(CC2)C 271570a_100010240233_100010069531 [0,0,0,1,0,0|3,0,0]=4 1097 B16R2.26 CNc1ncccc1C2=CCC(CC2)C 271570a_100010240233_100000700899 [0,0,0,1,0,0|3,0,0]=4 1098 B16R2.26 COc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100000174000 [0,0,0,1,0,0|3,0,0]=4 1099 B16R2.26 CSc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100011217816 [0,0,0,1,0,0|3,0,0]=4 1100 B16R2.7811 C#Cc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100011243808 [0,0,0,1,0,0|2,0,1]=4 1101 B16R2.7811 CC1CN(C1)C(=O)c2ccccc2C#N 11a_100000702820_100000742908 [0,0,0,1,0,0|3,0,0]=4 1102 B16R2.7811 CC1CN(C1)C(=O)c2ccccc2C#N 527a_100000702820_100000742908 [0,0,0,1,0,0|3,0,0]=4 1103 B16R2.7811 CC1CN(C1)C(=O)c2ccccc2I=O 240690a_100000702820_100000032414 [0,0,0,1,0,0|3,0,0]=4 1104 B16R2.7811 CC1CN(C1)C(=O)c2ccccc2I=O 527a_100000702820_100000032414 [0,0,0,1,0,0|3,0,0]=4 1105 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000689120 [0,0,0,1,0,0|2,0,0]=3 1106 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000689120 [0,0,0,1,0,0|2,0,0]=3 1107 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000689120 [0,0,0,1,0,0|2,0,0]=3 1108 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100000689120 [0,0,0,1,0,0|3,0,0]=4 1109 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100000689120 [0,0,0,1,0,0|3,0,0]=4 1110 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100000689120 [0,0,0,1,0,0|3,0,0]=4 1111 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100000689120 [0,0,0,1,0,0|3,0,0]=4 1112 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100000689120 [0,0,0,1,0,0|3,0,0]=4 1113 B16R2.7811 CCc1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100000689120 [0,0,0,1,0,0|3,0,0]=4 1114 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000185835 [0,0,0,1,0,0|2,0,0]=3 1115 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000185835 [0,0,0,1,0,0|2,0,0]=3 1116 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000185835 [0,0,0,1,0,0|2,0,0]=3 1117 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100000185835 [0,0,0,1,0,0|3,0,0]=4 1118 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100000185835 [0,0,0,1,0,0|3,0,0]=4 1119 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100000185835 [0,0,0,1,0,0|3,0,0]=4 1120 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100000185835 [0,0,0,1,0,0|3,0,0]=4 1121 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100000185835 [0,0,0,1,0,0|3,0,0]=4 1122 B16R2.7811 COc1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100000185835 [0,0,0,1,0,0|3,0,0]=4 1123 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000183967 [0,0,0,1,0,0|2,0,0]=3 1124 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000183967 [0,0,0,1,0,0|2,0,0]=3 1125 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000183967 [0,0,0,1,0,0|2,0,0]=3 1126 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100000183967 [0,0,0,1,0,0|3,0,0]=4 1127 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100000183967 [0,0,0,1,0,0|3,0,0]=4 1128 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100000183967 [0,0,0,1,0,0|3,0,0]=4 1129 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100000183967 [0,0,0,1,0,0|3,0,0]=4 1130 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100000183967 [0,0,0,1,0,0|3,0,0]=4 1131 B16R2.7811 CSc1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100000183967 [0,0,0,1,0,0|3,0,0]=4 1132 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000689120 [0,0,0,1,0,0|3,0,0]=4 1133 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000689120 [0,0,0,1,0,0|3,0,0]=4 1134 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000689120 [0,0,0,1,0,0|3,0,0]=4 1135 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000689120 [0,0,0,1,0,0|3,0,0]=4 1136 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000689120 [0,0,0,1,0,0|3,0,0]=4 1137 B16R2.7876 CCc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000689120 [0,0,0,1,0,0|3,0,0]=4 1138 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000185835 [0,0,0,1,0,0|3,0,0]=4 1139 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000185835 [0,0,0,1,0,0|3,0,0]=4 1140 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000185835 [0,0,0,1,0,0|3,0,0]=4 1141 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000185835 [0,0,0,1,0,0|3,0,0]=4 1142 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000185835 [0,0,0,1,0,0|3,0,0]=4 1143 B16R2.7876 COc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000185835 [0,0,0,1,0,0|3,0,0]=4 1144 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000183967 [0,0,0,1,0,0|3,0,0]=4 1145 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000183967 [0,0,0,1,0,0|3,0,0]=4 1146 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000183967 [0,0,0,1,0,0|3,0,0]=4 1147 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000183967 [0,0,0,1,0,0|3,0,0]=4 1148 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000183967 [0,0,0,1,0,0|3,0,0]=4 1149 B16R2.7876 CSc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000183967 [0,0,0,1,0,0|3,0,0]=4 1150 B16R2.7896 C=Cc1ccccc1C2=NC(CO2)(C)C 271570a_100011290941_100000695370 [0,0,0,1,0,0|2,0,1]=4 1151 B16R2.7896 CC1(COC(=N1)c2ccccc2S[13CH3])C 62a_100000695370_200025704644 [0,0,0,1,0,0|2,0,0]=3 1152 B16R2.7896 CSc1ccccc1C2=NC(CO2)(C)C 62a_100000695370_200000210301 [0,0,0,1,0,0|2,0,0]=3 1153 B16R2.36540 C#Cc1ccccc1C(=O)CCC2CC2 1458a_100011243808_100000694398 [0,0,0,1,0,0|2,0,1]=4 1154 B16R2.36540 C#Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100011243808 [0,0,0,1,0,0|2,0,1]=4 1155 B16R2.36540 C=Cc1ccccc1C(=O)CCC2CC2 1458a_100011830265_100000694398 [0,0,0,1,0,0|2,0,1]=4 1156 B16R2.36540 C=Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100011830265 [0,0,0,1,0,0|2,0,1]=4 1157 B16R2.36540 CCc1ccccc1C(=O)CCC2CC2 1458a_100000689120_100000694398 [0,0,0,1,0,0|2,0,0]=3 1158 B16R2.36540 CCc1ccccc1C(=O)CCC2CO2 1458a_100000689120_100000732470 [0,0,0,1,0,0|3,0,0]=4 1159 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000689120 [0,0,0,1,0,0|2,0,0]=3 1160 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000689120 [0,0,0,1,0,0|2,0,0]=3 1161 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000689120 [0,0,0,1,0,0|2,0,0]=3 1162 B16R2.36540 CCc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000689120 [0,0,0,1,0,0|2,0,0]=3 1163 B16R2.36540 CCc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000689120 [0,0,0,1,0,0|3,0,0]=4 1164 B16R2.36540 CNc1ccccc1C(=NNC2CC2)C 4a_100000701032_100000020593 [0,0,0,1,0,0|3,0,0]=4 1165 B16R2.36540 COc1ccccc1C(=O)CCC2CC2 1458a_100000185835_100000694398 [0,0,0,1,0,0|2,0,0]=3 1166 B16R2.36540 COc1ccccc1C(=O)CCC2CO2 1458a_100000185835_100000732470 [0,0,0,1,0,0|3,0,0]=4 1167 B16R2.36540 COc1ccccc1C(=O)CNC2CC2 34a_100000212008_100000195505 [0,0,0,1,0,0|3,0,0]=4 1168 B16R2.36540 COc1ccccc1C(=O)CSC2CC2 62a_100000195505_100000211595 [0,0,0,1,0,0|3,0,0]=4 1169 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000185835 [0,0,0,1,0,0|2,0,0]=3 1170 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000185835 [0,0,0,1,0,0|2,0,0]=3 1171 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000185835 [0,0,0,1,0,0|2,0,0]=3 1172 B16R2.36540 COc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000185835 [0,0,0,1,0,0|2,0,0]=3 1173 B16R2.36540 COc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000185835 [0,0,0,1,0,0|3,0,0]=4 1174 B16R2.36540 COc1ccccc1C(C)OCC2CC2 7a_100000742714_100000742324 [0,0,0,1,0,0|2,0,1]=4 1175 B16R2.36540 CSc1ccccc1C(=O)CCC2CC2 1458a_100000183967_100000694398 [0,0,0,1,0,0|2,0,0]=3 1176 B16R2.36540 CSc1ccccc1C(=O)CCC2CO2 1458a_100000183967_100000732470 [0,0,0,1,0,0|3,0,0]=4 1177 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000183967 [0,0,0,1,0,0|2,0,0]=3 1178 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000183967 [0,0,0,1,0,0|2,0,0]=3 1179 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000183967 [0,0,0,1,0,0|2,0,0]=3 1180 B16R2.36540 CSc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000183967 [0,0,0,1,0,0|2,0,0]=3 1181 B16R2.36540 CSc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000183967 [0,0,0,1,0,0|3,0,0]=4 1182 B16R2.36540 N#Cc1ccccc1C(=O)CCC2CC2 1458a_100000742908_100000694398 [0,0,0,1,0,0|3,0,0]=4 1183 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000742908 [0,0,0,1,0,0|3,0,0]=4 1184 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000742908 [0,0,0,1,0,0|3,0,0]=4 1185 B16R2.36540 N#Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000742908 [0,0,0,1,0,0|3,0,0]=4 1186 B16R2.36540 O=C(CCC1CC1)c2ccccc2CO 1458a_100011301526_100000694398 [0,0,0,1,0,0|3,0,0]=4 1187 B16R2.36540 O=Ic1ccccc1C(=O)CCC2CC2 1458a_100000032414_100000694398 [0,0,0,1,0,0|3,0,0]=4 1188 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000032414 [0,0,0,1,0,0|3,0,0]=4 1189 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000032414 [0,0,0,1,0,0|3,0,0]=4 1190 B16R2.36540 O=Ic1ccccc1C(=O)NCC2CC2 527a_100000735609_100000032414 [0,0,0,1,0,0|3,0,0]=4 1191 B16R2.83538 CC(C)NC1CCc2ccccc2C1=O 2230a_100138425928_100000229917 [0,0,0,1,0,0|3,0,0]=4 1192 B16R2.83538 CC(C)NC1CCc2ccccc2C1=O 34a_100138425928_100000229917 [0,0,0,1,0,0|3,0,0]=4 1193 B16R2.83538 CC(C)OC1CCc2ccccc2C1=O 34a_100000212225_100000229917 [0,0,0,1,0,0|3,0,0]=4 1194 B16R2.83538 CC(C)SC1CCc2ccccc2C1=O 62a_100000210206_100000229917 [0,0,0,1,0,0|3,0,0]=4 1195 B16R2.83538 CC(C)SC1CCc2ccccc2C1=O 62a_100000229917_100000210206 [0,0,0,1,0,0|3,0,0]=4 1196 B16R2.83538 CC(C)Sc1c[nH]c2ccccc2c1=O 62a_100000210206_100012348052 [0,0,0,1,0,0|2,0,1]=4 1197 B16R2.104522 CC(C)C=Cc1nn(c2c1cccc2)C 271570a_100016257149_100009817141 [0,0,0,1,0,0|2,0,1]=4 1198 B16R2.104522 CC(C)CNc1nn(c2c1cccn2)C 27a_100000210953_100010248644 [0,0,0,1,0,0|3,0,0]=4 1199 B16R2.104522 CC(C)CSc1cn(c2c1cccn2)C 62a_100000210624_100010205794 [0,0,0,1,0,0|2,1,0]=4 1200 B16R2.104522 CC(C)CSc1nn(c2c1cccc2)C 62a_100000210624_100009817141 [0,0,0,1,0,0|1,1,0]=3 1201 B16R2.104522 CC(C)CSc1nn(c2c1cccc2)C 62a_100009817141_100000210760 [0,0,0,1,0,0|1,1,0]=3 1202 B16R2.104522 CC(C)CSc1nn(c2c1cccn2)C 62a_100000210624_100010248644 [0,0,0,1,0,0|2,1,0]=4 1203 B16R2.104522 CC(C)CSc1nn(c2c1cccn2)C 62a_100010248644_100000210760 [0,0,0,1,0,0|2,1,0]=4 1204 B16R2.104522 CC(C)CSc1nn(c2c1nccc2)C 62a_100000210624_100000761950 [0,0,0,1,0,0|2,1,0]=4 1205 B16R2.104522 CC(C)NCc1cn(c2c1cccc2)C 34a_100011997738_100000210206 [0,0,0,1,0,0|3,0,0]=4 1206 B16R2.104522 CC(C)NCc1nn(c2c1cccc2)C 207a_100138425928_100011361492 [0,0,0,1,0,0|3,0,0]=4 1207 B16R2.104522 CC(C)NCc1nn(c2c1cccc2)C 34a_200011934655_100000210206 [0,0,0,1,0,0|3,0,0]=4 1208 B16R2.104522 CC(C)OCc1nn(c2c1cccc2)C 34a_100011934675_100000210206 [0,0,0,1,0,0|3,0,0]=4 1209 B16R2.104522 CC(O)CSc1nn(c2c1cccc2)C 62a_100009817141_100011218427 [0,0,0,1,0,0|2,1,0]=4 1210 B16R2.104522 CC(O)CSc1nn(c2c1cccc2)C 62a_100011218427_100009817141 [0,0,0,1,0,0|2,1,0]=4 1211 B16R2.104522 C[C@@H](O)CSc1nn(c2c1cccc2)C 62a_100009817141_100009817552 [0,0,0,1,0,0|2,1,0]=4 1212 B16R2.104522 C[C@@H](O)CSc1nn(c2c1cccc2)C 62a_100009817552_100009817141 [0,0,0,1,0,0|2,1,0]=4 1213 B16R2.143581 CC(C)COC1(CCc2c1cccc2)C 34a_100000685031_100000210624 [0,0,0,1,0,0|2,0,1]=4 1214 B16R2.143581 CC(C)COC1(CCc2c1cccc2)C 7a_100000685031_100000210760 [0,0,0,1,0,0|2,0,1]=4 1215 B16R2.179941 CC(C)COC1CCCc2c1cccc2 34a_100000183665_100000210624 [0,0,0,1,0,0|2,0,1]=4 1216 B16R2.179941 CC(C)COC1CCCc2c1cccc2 7a_100000183665_100000210760 [0,0,0,1,0,0|2,0,1]=4 1217 B16R2.179941 CC(C)COC1CCOc2c1cccc2 7a_100000708930_100000210760 [0,0,0,1,0,0|2,0,1]=4 1218 B16R2.179941 CC(C)COc1cccc2c1cccc2 34a_100000210388_100000210624 [0,0,0,1,0,0|2,0,1]=4 1219 B16R2.179941 CC(C)COc1cccc2c1cccc2 7a_100000210388_100000210760 [0,0,0,1,0,0|2,0,1]=4 1220 B16R2.179941 CC(C)COc1cncc2c1cccc2 34a_100000066178_100000210624 [0,0,0,1,0,0|3,0,0]=4 1221 B16R2.179941 CC(C)COc1cncc2c1cccc2 7a_100000066178_100000210760 [0,0,0,1,0,0|3,0,0]=4 1222 B16R2.179941 CC(C)COc1nccc2c1cccc2 34a_102531767632_100000210624 [0,0,0,1,0,0|2,0,1]=4 1223 B16R2.179941 CC(C)NN=C1CCNc2c1cccc2 4a_100000741168_100000691674 [0,0,0,1,0,0|3,0,0]=4 1224 B14R1.840 C#Cc1ccccc1C(=O)CC(C)C 1458a_100011243808_100000210624 [0,0,0,0,1,0|1,0,1]=3 1225 B14R1.840 C#Cc1ccccc1C(=O)CC(C)O 1458a_100011243808_100011218427 [0,0,0,0,1,0|2,0,1]=4 1226 B14R1.840 C#Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100011243808 [0,0,0,0,1,0|2,0,1]=4 1227 B14R1.840 C=C(C)CC(=O)c1ccccc1CC 1458a_100000689120_100000748629 [0,0,0,0,1,0|1,0,2]=4 1228 B14R1.840 C=C(C)CC(=O)c1ccccc1OC 1458a_100000185835_100000748629 [0,0,0,0,1,0|1,0,2]=4 1229 B14R1.840 C=C(C)CC(=O)c1ccccc1SC 1458a_100000183967_100000748629 [0,0,0,0,1,0|1,0,2]=4 1230 B14R1.840 C=Cc1ccccc1C(=O)CC(C)C 1458a_100011830265_100000210624 [0,0,0,0,1,0|1,0,1]=3 1231 B14R1.840 C=Cc1ccccc1C(=O)CC(C)O 1458a_100011830265_100011218427 [0,0,0,0,1,0|2,0,1]=4 1232 B14R1.840 C=Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100011830265 [0,0,0,0,1,0|2,0,1]=4 1233 B14R1.840 C=Cc1ccccc1C(=O)NC(C)C 271570a_100011290941_200000152627 [0,0,0,0,1,0|2,0,1]=4 1234 B14R1.840 C=Cc1ccccc1C(=O)OC(C)C 271570a_100011290941_100000169877 [0,0,0,0,1,0|1,0,1]=3 1235 B14R1.840 CC(=O)CC(=O)c1ccccc1S[13CH3] 62a_200011243946_200025704644 [0,0,0,0,1,0|2,0,1]=4 1236 B14R1.840 CC(C)CC(=O)c1ccccc1C#N 1458a_100000742908_100000210624 [0,0,0,0,1,0|2,0,0]=3 1237 B14R1.840 CC(C)CC(=O)c1ccccc1CO 1458a_100011301526_100000210624 [0,0,0,0,1,0|2,0,0]=3 1238 B14R1.840 CC(C)CC(=O)c1ccccc1I=O 1458a_100000032414_100000210624 [0,0,0,0,1,0|2,0,0]=3 1239 B14R1.840 CC(C)CC(C)c1ccccc1N[13CH3] 2230a_100009954483_200025704644 [0,0,0,0,1,0|1,0,1]=3 1240 B14R1.840 CC(C)CC(C)c1ccccc1N[13CH3] 34a_100009954483_200025704644 [0,0,0,0,1,0|1,0,1]=3 1241 B14R1.840 CC(C)CC(C)c1ccccc1N[13CH3] 7a_100009954483_200025704644 [0,0,0,0,1,0|1,0,1]=3 1242 B14R1.840 CC(C)C[C@H](N)c1ccccc1NN 271570a_100015190218_100000241748 [0,0,0,0,1,0|2,0,1]=4 1243 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 11a_100138425928_100000742908 [0,0,0,0,1,0|3,0,0]=4 1244 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 1626a_100138425928_100000742908 [0,0,0,0,1,0|3,0,0]=4 1245 B14R1.840 CC(C)NC(=O)c1ccccc1C#N 527a_100138425928_100000742908 [0,0,0,0,1,0|3,0,0]=4 1246 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 1626a_100138425928_100000032414 [0,0,0,0,1,0|3,0,0]=4 1247 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 240690a_100138425928_100000032414 [0,0,0,0,1,0|3,0,0]=4 1248 B14R1.840 CC(C)NC(=O)c1ccccc1I=O 527a_100138425928_100000032414 [0,0,0,0,1,0|3,0,0]=4 1249 B14R1.840 CC(C)NC(=O)c1ccccc1S[13CH3] 62a_200000152627_200025704644 [0,0,0,0,1,0|2,0,0]=3 1250 B14R1.840 CC(C)NC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152627 [0,0,0,0,1,0|2,0,0]=3 1251 B14R1.840 CC(C)OC(=O)c1ccccc1O[13CH3] 34a_100000169923_200025704644 [0,0,0,0,1,0|1,0,0]=2 1252 B14R1.840 CC(C)OC(=O)c1ccccc1O[13CH3] 7a_100000169923_200025704644 [0,0,0,0,1,0|1,0,0]=2 1253 B14R1.840 CC(C)OC(=O)c1ccccc1S[13CH3] 62a_100000169877_200025704644 [0,0,0,0,1,0|1,0,0]=2 1254 B14R1.840 CC(C)OC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000169877 [0,0,0,0,1,0|1,0,0]=2 1255 B14R1.840 CC(O)CC(=O)c1ccccc1C#N 1458a_100000742908_100011218427 [0,0,0,0,1,0|3,0,0]=4 1256 B14R1.840 CC(O)CC(=O)c1ccccc1CO 1458a_100011301526_100011218427 [0,0,0,0,1,0|3,0,0]=4 1257 B14R1.840 CC(O)CC(=O)c1ccccc1I=O 1458a_100000032414_100011218427 [0,0,0,0,1,0|3,0,0]=4 1258 B14R1.840 CCc1ccccc1C(=O)CC(C)C 1458a_100000689120_100000210624 [0,0,0,0,1,0|1,0,0]=2 1259 B14R1.840 CCc1ccccc1C(=O)CC(C)O 1458a_100000689120_100011218427 [0,0,0,0,1,0|2,0,0]=3 1260 B14R1.840 CCc1ccccc1C(=O)CC(F)F 1458a_100000689120_100011934356 [0,0,0,0,1,0|3,0,0]=4 1261 B14R1.840 CCc1ccccc1C(=O)NC(C)C 11a_100138425928_100000689120 [0,0,0,0,1,0|2,0,0]=3 1262 B14R1.840 CCc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000689120 [0,0,0,0,1,0|2,0,0]=3 1263 B14R1.840 CCc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000689120 [0,0,0,0,1,0|2,0,0]=3 1264 B14R1.840 CCc1ccccc1C(=O)NC(C)C 527a_100138425928_100000689120 [0,0,0,0,1,0|2,0,0]=3 1265 B14R1.840 CCc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100011215823 [0,0,0,0,1,0|2,0,1]=4 1266 B14R1.840 CNc1ccccc1C(=O)NC(C)C 27a_100102657272_200000152627 [0,0,0,0,1,0|1,0,0]=2 1267 B14R1.840 CNc1ccccc1C(C)CC(C)C 2230a_100009954483_200000210301 [0,0,0,0,1,0|1,0,1]=3 1268 B14R1.840 CNc1ccccc1C(C)CC(C)C 34a_100009954483_200000210301 [0,0,0,0,1,0|1,0,1]=3 1269 B14R1.840 CNc1ccccc1C(C)CC(C)C 7a_100009954483_200000210301 [0,0,0,0,1,0|1,0,1]=3 1270 B14R1.840 CNc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100020606079 [0,0,0,0,1,0|1,0,1]=3 1271 B14R1.840 CNc1cccnc1[C@@H](N)CC(C)C 271570a_100015190218_200011806188 [0,0,0,0,1,0|2,0,1]=4 1272 B14R1.840 CNc1ccncc1[C@@H](N)CC(C)C 271570a_100015190218_100010069531 [0,0,0,0,1,0|2,0,1]=4 1273 B14R1.840 CNc1ncccc1[C@@H](N)CC(C)C 271570a_100015190218_100000700899 [0,0,0,0,1,0|2,0,1]=4 1274 B14R1.840 COc1ccccc1C(=O)CC(=O)C 1458a_100000070787_100000195505 [0,0,0,0,1,0|2,0,1]=4 1275 B14R1.840 COc1ccccc1C(=O)CC(C)C 1458a_100000185835_100000210624 [0,0,0,0,1,0|1,0,0]=2 1276 B14R1.840 COc1ccccc1C(=O)CC(C)O 1458a_100000185835_100011218427 [0,0,0,0,1,0|2,0,0]=3 1277 B14R1.840 COc1ccccc1C(=O)CC(F)F 1458a_100000185835_100011934356 [0,0,0,0,1,0|3,0,0]=4 1278 B14R1.840 COc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000195505 [0,0,0,0,1,0|2,0,0]=3 1279 B14R1.840 COc1ccccc1C(=O)NC(C)C 11a_100138425928_100000185835 [0,0,0,0,1,0|2,0,0]=3 1280 B14R1.840 COc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000185835 [0,0,0,0,1,0|2,0,0]=3 1281 B14R1.840 COc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000185835 [0,0,0,0,1,0|2,0,0]=3 1282 B14R1.840 COc1ccccc1C(=O)NC(C)C 527a_100138425928_100000185835 [0,0,0,0,1,0|2,0,0]=3 1283 B14R1.840 COc1ccccc1C(=O)OC(C)C 34a_100000169923_200000210301 [0,0,0,0,1,0|1,0,0]=2 1284 B14R1.840 COc1ccccc1C(=O)OC(C)C 7a_100000169923_200000210301 [0,0,0,0,1,0|1,0,0]=2 1285 B14R1.840 COc1ccccc1C(C)OC(C)C 7a_100000742714_100000210206 [0,0,0,0,1,0|2,0,1]=4 1286 B14R1.840 COc1ccccc1N(C)CC(C)C 2230a_100000219746_100000210760 [0,0,0,0,1,0|3,0,0]=4 1287 B14R1.840 COc1ccccc1N(C)CC(C)C 269982a_100000219746_100000210624 [0,0,0,0,1,0|3,0,0]=4 1288 B14R1.840 COc1ccccc1N(C)CC(C)C 34a_100000219746_100000210624 [0,0,0,0,1,0|3,0,0]=4 1289 B14R1.840 COc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000174000 [0,0,0,0,1,0|2,0,1]=4 1290 B14R1.840 CSc1ccccc1C(=O)CC(=O)C 62a_200011243946_200000210301 [0,0,0,0,1,0|2,0,1]=4 1291 B14R1.840 CSc1ccccc1C(=O)CC(C)C 1458a_100000183967_100000210624 [0,0,0,0,1,0|1,0,0]=2 1292 B14R1.840 CSc1ccccc1C(=O)CC(C)O 1458a_100000183967_100011218427 [0,0,0,0,1,0|2,0,0]=3 1293 B14R1.840 CSc1ccccc1C(=O)CC(F)F 1458a_100000183967_100011934356 [0,0,0,0,1,0|3,0,0]=4 1294 B14R1.840 CSc1ccccc1C(=O)NC(C)C 11a_100138425928_100000183967 [0,0,0,0,1,0|2,0,0]=3 1295 B14R1.840 CSc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000183967 [0,0,0,0,1,0|2,0,0]=3 1296 B14R1.840 CSc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000183967 [0,0,0,0,1,0|2,0,0]=3 1297 B14R1.840 CSc1ccccc1C(=O)NC(C)C 527a_100138425928_100000183967 [0,0,0,0,1,0|2,0,0]=3 1298 B14R1.840 CSc1ccccc1C(=O)NC(C)C 62a_200000152627_200000210301 [0,0,0,0,1,0|2,0,0]=3 1299 B14R1.840 CSc1ccccc1C(=O)NC(C)C 62a_200000210301_200000152627 [0,0,0,0,1,0|2,0,0]=3 1300 B14R1.840 CSc1ccccc1C(=O)OC(C)C 62a_100000169877_200000210301 [0,0,0,0,1,0|1,0,0]=2 1301 B14R1.840 CSc1ccccc1C(=O)OC(C)C 62a_200000210301_100000169877 [0,0,0,0,1,0|1,0,0]=2 1302 B14R1.840 CSc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100011217816 [0,0,0,0,1,0|2,0,1]=4 1303 B16R1.1369 C#Cc1ccccc1NC(=O)CCC(C)C 11a_100011470550_100000181311 [0,0,0,0,0,1|2,0,1]=4 1304 B16R1.1369 C#Cc1ccccc1NC(=O)CCC(C)C 1626a_100011470550_100000181311 [0,0,0,0,0,1|2,0,1]=4 1305 B16R1.1369 C#Cc1ccccc1NC(=O)CCC(C)C 22a_100011470550_100000181311 [0,0,0,0,0,1|2,0,1]=4 1306 B16R1.1369 C#Cc1ccccc1NC(=O)NCC(C)C 2430a_100011470550_100000210953 [0,0,0,0,0,1|2,0,1]=4 1307 B16R1.1369 C=Cc1ccccc1NC(=O)CCC(C)C 11a_100012022501_100000181311 [0,0,0,0,0,1|2,0,1]=4 1308 B16R1.1369 C=Cc1ccccc1NC(=O)CCC(C)C 1626a_100012022501_100000181311 [0,0,0,0,0,1|2,0,1]=4 1309 B16R1.1369 C=Cc1ccccc1NC(=O)CCC(C)C 22a_100012022501_100000181311 [0,0,0,0,0,1|2,0,1]=4 1310 B16R1.1369 C=Cc1ccccc1NC(=O)NCC(C)C 2430a_100012022501_100000210953 [0,0,0,0,0,1|2,0,1]=4 1311 B16R1.1369 CC(C)CCC(=O)Cc1ccccc1C#N 1458a_100000181311_100000181865 [0,0,0,0,0,1|3,0,0]=4 1312 B16R1.1369 CC(C)CCC(=O)Cc1ccccc1C#N 1458a_100000238613_100000210312 [0,0,0,0,0,1|3,0,0]=4 1313 B16R1.1369 CC(C)CCC(=O)Cc1ccccc1C=O 1458a_100000181311_200009853537 [0,0,0,0,0,1|3,0,0]=4 1314 B16R1.1369 CC(C)CCC(=O)Cc1ccccc1CO 1458a_100000181311_100009816955 [0,0,0,0,0,1|3,0,0]=4 1315 B16R1.1369 CC(C)CCC(=O)Nc1ccccc1C#N 11a_100000211148_100000181311 [0,0,0,0,0,1|3,0,0]=4 1316 B16R1.1369 CC(C)CCC(=O)Nc1ccccc1C#N 1626a_100000211148_100000181311 [0,0,0,0,0,1|3,0,0]=4 1317 B16R1.1369 CC(C)CCC(=O)Nc1ccccc1CO 22a_100000212039_100000181311 [0,0,0,0,0,1|3,0,0]=4 1318 B16R1.1369 CC(C)CNC(=O)Cc1ccccc1C#N 11a_100000210953_100000238613 [0,0,0,0,0,1|3,0,0]=4 1319 B16R1.1369 CC(C)CNC(=O)Cc1ccccc1C#N 527a_100000210953_100000238613 [0,0,0,0,0,1|3,0,0]=4 1320 B16R1.1369 CC(C)CNC(=O)Nc1ccccc1C#N 2430a_100000211148_100000210953 [0,0,0,0,0,1|3,0,0]=4 1321 B16R1.1369 CCc1ccccc1NC(=O)C=CC(C)C 11a_100000212081_100016268746 [0,0,0,0,0,1|2,0,1]=4 1322 B16R1.1369 CCc1ccccc1NC(=O)C=CC(C)C 1626a_100000212081_100016268746 [0,0,0,0,0,1|2,0,1]=4 1323 B16R1.1369 CCc1ccccc1NC(=O)C=CC(C)C 22a_100000212081_100016268746 [0,0,0,0,0,1|2,0,1]=4 1324 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)C 11a_100000212081_100000181311 [0,0,0,0,0,1|2,0,0]=3 1325 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)C 1626a_100000212081_100000181311 [0,0,0,0,0,1|2,0,0]=3 1326 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)C 22a_100000212081_100000181311 [0,0,0,0,0,1|2,0,0]=3 1327 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)C 527a_100000212081_100000181311 [0,0,0,0,0,1|2,0,0]=3 1328 B16R1.1369 CCc1ccccc1NC(=O)CCC(C)O 1626a_100000212081_100000718519 [0,0,0,0,0,1|3,0,0]=4 1329 B16R1.1369 CCc1ccccc1NC(=O)CCN(C)C 11a_100000212081_100000689311 [0,0,0,0,0,1|3,0,0]=4 1330 B16R1.1369 CCc1ccccc1NC(=O)CCN(C)C 2230a_100102631434_200011194883 [0,0,0,0,0,1|3,0,0]=4 1331 B16R1.1369 CCc1ccccc1NC(=O)CCN(C)C 22a_100000212081_100000689311 [0,0,0,0,0,1|3,0,0]=4 1332 B16R1.1369 CCc1ccccc1NC(=O)CCN(C)C 269982a_100102631434_200011194883 [0,0,0,0,0,1|3,0,0]=4 1333 B16R1.1369 CCc1ccccc1NC(=O)CCN(C)C 527a_100000212081_100000689311 [0,0,0,0,0,1|3,0,0]=4 1334 B16R1.1369 CCc1ccccc1NC(=O)CC[S+](C)C 11a_100000212081_100009452791 [0,0,0,0,0,1|3,0,0]=4 1335 B16R1.1369 CCc1ccccc1NC(=O)CC[S+](C)C 1626a_100000212081_100009452791 [0,0,0,0,0,1|3,0,0]=4 1336 B16R1.1369 CCc1ccccc1NC(=O)CC[S+](C)C 22a_100000212081_100009452791 [0,0,0,0,0,1|3,0,0]=4 1337 B16R1.1369 CCc1ccccc1NC(=O)CNC(C)C 2230a_100138425928_100000180193 [0,0,0,0,0,1|3,0,0]=4 1338 B16R1.1369 CCc1ccccc1NC(=O)CNC(C)C 34a_100138425928_100000180193 [0,0,0,0,0,1|3,0,0]=4 1339 B16R1.1369 CCc1ccccc1NC(=O)COC(C)C 11a_100000212081_100000745533 [0,0,0,0,0,1|3,0,0]=4 1340 B16R1.1369 CCc1ccccc1NC(=O)COC(C)C 1626a_100000212081_100000745533 [0,0,0,0,0,1|3,0,0]=4 1341 B16R1.1369 CCc1ccccc1NC(=O)COC(C)C 22a_100000212081_100000745533 [0,0,0,0,0,1|3,0,0]=4 1342 B16R1.1369 CCc1ccccc1NC(=O)COC(C)C 34a_100000212225_100000180193 [0,0,0,0,0,1|3,0,0]=4 1343 B16R1.1369 CCc1ccccc1NC(=O)COC(C)C 527a_100000212081_100000745533 [0,0,0,0,0,1|3,0,0]=4 1344 B16R1.1369 CCc1ccccc1NC(=O)CSC(C)C 11a_100000212081_100000241585 [0,0,0,0,0,1|3,0,0]=4 1345 B16R1.1369 CCc1ccccc1NC(=O)CSC(C)C 1626a_100000212081_100000241585 [0,0,0,0,0,1|3,0,0]=4 1346 B16R1.1369 CCc1ccccc1NC(=O)CSC(C)C 22a_100000212081_100000241585 [0,0,0,0,0,1|3,0,0]=4 1347 B16R1.1369 CCc1ccccc1NC(=O)CSC(C)C 527a_100000212081_100000241585 [0,0,0,0,0,1|3,0,0]=4 1348 B16R1.1369 CCc1ccccc1NC(=O)CSC(C)C 62a_100000210206_100000180193 [0,0,0,0,0,1|3,0,0]=4 1349 B16R1.1369 CCc1ccccc1NC(=O)NCC(C)C 2430a_100000212081_100000210953 [0,0,0,0,0,1|2,0,0]=3 1350 B16R1.1369 CCc1ccccc1NC(=O)NCC(C)O 2430a_100000212081_100000210904 [0,0,0,0,0,1|3,0,0]=4 1351 B16R1.1369 CNc1ccccc1OC(C)CCC(C)C 34a_100000033821_100011261404 [0,0,0,0,0,1|2,0,1]=4 1352 B16R1.1369 CNc1ccccc1SC(C)CCC(C)C 62a_100011261404_100020606079 [0,0,0,0,0,1|2,0,1]=4 1353 B16R1.1369 CNc1ccccc1SC(C)CCC(C)C 62a_100020606079_100011261404 [0,0,0,0,0,1|2,0,1]=4 1354 B16R1.1369 COc1ccccc1CC(=O)C=CC(C)C 1458a_100016268746_100000210004 [0,0,0,0,0,1|2,0,1]=4 1355 B16R1.1369 COc1ccccc1CC(=O)CCC(C)C 1458a_100000181311_100000210004 [0,0,0,0,0,1|2,0,0]=3 1356 B16R1.1369 COc1ccccc1CC(=O)CCC(C)C 1458a_100000211604_100000210312 [0,0,0,0,0,1|2,0,0]=3 1357 B16R1.1369 COc1ccccc1CC(=O)CCC(C)O 1458a_100000211604_100012276601 [0,0,0,0,0,1|3,0,0]=4 1358 B16R1.1369 COc1ccccc1CC(=O)CC[S+](C)C 1458a_100009452791_100000210004 [0,0,0,0,0,1|3,0,0]=4 1359 B16R1.1369 COc1ccccc1CC(=O)COC(C)C 1458a_100000745533_100000210004 [0,0,0,0,0,1|3,0,0]=4 1360 B16R1.1369 COc1ccccc1CC(=O)CSC(C)C 1458a_100000241585_100000210004 [0,0,0,0,0,1|3,0,0]=4 1361 B16R1.1369 COc1ccccc1CC(=O)NCC(C)C 11a_100000210953_100000211604 [0,0,0,0,0,1|2,0,0]=3 1362 B16R1.1369 COc1ccccc1CC(=O)NCC(C)C 1626a_100000210953_100000211604 [0,0,0,0,0,1|2,0,0]=3 1363 B16R1.1369 COc1ccccc1CC(=O)NCC(C)C 240690a_100000210953_100000211604 [0,0,0,0,0,1|2,0,0]=3 1364 B16R1.1369 COc1ccccc1CC(=O)NCC(C)C 527a_100000210953_100000211604 [0,0,0,0,0,1|2,0,0]=3 1365 B16R1.1369 COc1ccccc1CC(=O)NCC(C)O 11a_100000210904_100000211604 [0,0,0,0,0,1|3,0,0]=4 1366 B16R1.1369 COc1ccccc1CC(=O)NCC(C)O 240690a_100000210904_100000211604 [0,0,0,0,0,1|3,0,0]=4 1367 B16R1.1369 COc1ccccc1CC(=O)NCC(C)O 527a_100000210904_100000211604 [0,0,0,0,0,1|3,0,0]=4 1368 B16R1.1369 COc1ccccc1CC(=O)NNC(C)C 22a_100000741168_100000211604 [0,0,0,0,0,1|3,0,0]=4 1369 B16R1.1369 COc1ccccc1CC(C)OCC(C)C 7a_100000691916_100000210760 [0,0,0,0,0,1|2,0,1]=4 1370 B16R1.1369 COc1ccccc1NC(=O)C=CC(C)C 11a_100000210025_100016268746 [0,0,0,0,0,1|2,0,1]=4 1371 B16R1.1369 COc1ccccc1NC(=O)C=CC(C)C 1626a_100000210025_100016268746 [0,0,0,0,0,1|2,0,1]=4 1372 B16R1.1369 COc1ccccc1NC(=O)C=CC(C)C 22a_100000210025_100016268746 [0,0,0,0,0,1|2,0,1]=4 1373 B16R1.1369 COc1ccccc1NC(=O)CCC(C)C 11a_100000210025_100000181311 [0,0,0,0,0,1|2,0,0]=3 1374 B16R1.1369 COc1ccccc1NC(=O)CCC(C)C 1626a_100000210025_100000181311 [0,0,0,0,0,1|2,0,0]=3 1375 B16R1.1369 COc1ccccc1NC(=O)CCC(C)C 22a_100000210025_100000181311 [0,0,0,0,0,1|2,0,0]=3 1376 B16R1.1369 COc1ccccc1NC(=O)CCC(C)C 527a_100000210025_100000181311 [0,0,0,0,0,1|2,0,0]=3 1377 B16R1.1369 COc1ccccc1NC(=O)CCC(C)O 1626a_100000210025_100000718519 [0,0,0,0,0,1|3,0,0]=4 1378 B16R1.1369 COc1ccccc1NC(=O)CCN(C)C 11a_100000210025_100000689311 [0,0,0,0,0,1|3,0,0]=4 1379 B16R1.1369 COc1ccccc1NC(=O)CCN(C)C 2230a_100102631434_100000242059 [0,0,0,0,0,1|3,0,0]=4 1380 B16R1.1369 COc1ccccc1NC(=O)CCN(C)C 22a_100000210025_100000689311 [0,0,0,0,0,1|3,0,0]=4 1381 B16R1.1369 COc1ccccc1NC(=O)CCN(C)C 269982a_100102631434_100000242059 [0,0,0,0,0,1|3,0,0]=4 1382 B16R1.1369 COc1ccccc1NC(=O)CCN(C)C 527a_100000210025_100000689311 [0,0,0,0,0,1|3,0,0]=4 1383 B16R1.1369 COc1ccccc1NC(=O)CC[S+](C)C 11a_100000210025_100009452791 [0,0,0,0,0,1|3,0,0]=4 1384 B16R1.1369 COc1ccccc1NC(=O)CC[S+](C)C 1626a_100000210025_100009452791 [0,0,0,0,0,1|3,0,0]=4 1385 B16R1.1369 COc1ccccc1NC(=O)CC[S+](C)C 22a_100000210025_100009452791 [0,0,0,0,0,1|3,0,0]=4 1386 B16R1.1369 COc1ccccc1NC(=O)CNC(C)C 2230a_100138425928_100000182883 [0,0,0,0,0,1|3,0,0]=4 1387 B16R1.1369 COc1ccccc1NC(=O)CNC(C)C 34a_100138425928_100000182883 [0,0,0,0,0,1|3,0,0]=4 1388 B16R1.1369 COc1ccccc1NC(=O)COC(C)C 11a_100000210025_100000745533 [0,0,0,0,0,1|3,0,0]=4 1389 B16R1.1369 COc1ccccc1NC(=O)COC(C)C 1626a_100000210025_100000745533 [0,0,0,0,0,1|3,0,0]=4 1390 B16R1.1369 COc1ccccc1NC(=O)COC(C)C 22a_100000210025_100000745533 [0,0,0,0,0,1|3,0,0]=4 1391 B16R1.1369 COc1ccccc1NC(=O)COC(C)C 34a_100000212225_100000182883 [0,0,0,0,0,1|3,0,0]=4 1392 B16R1.1369 COc1ccccc1NC(=O)COC(C)C 527a_100000210025_100000745533 [0,0,0,0,0,1|3,0,0]=4 1393 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 11a_100000210025_100000241585 [0,0,0,0,0,1|3,0,0]=4 1394 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 1626a_100000210025_100000241585 [0,0,0,0,0,1|3,0,0]=4 1395 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 22a_100000210025_100000241585 [0,0,0,0,0,1|3,0,0]=4 1396 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 527a_100000210025_100000241585 [0,0,0,0,0,1|3,0,0]=4 1397 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 62a_100000210206_100000182883 [0,0,0,0,0,1|3,0,0]=4 1398 B16R1.1369 COc1ccccc1NC(=O)CSC(C)C 62a_200000243729_100000210206 [0,0,0,0,0,1|3,0,0]=4 1399 B16R1.1369 COc1ccccc1NC(=O)NCC(C)C 2430a_100000210025_100000210953 [0,0,0,0,0,1|2,0,0]=3 1400 B16R1.1369 COc1ccccc1NC(=O)NCC(C)O 2430a_100000210025_100000210904 [0,0,0,0,0,1|3,0,0]=4 1401 B16R1.1369 COc1cnccc1CC(=O)CCC(C)C 1458a_100000181311_100020635607 [0,0,0,0,0,1|3,0,0]=4 1402 B16R1.1369 COc1ncccc1CC(=O)CCC(C)C 1458a_100000181311_100020631285 [0,0,0,0,0,1|3,0,0]=4 1403 B16R1.1369 CSc1ccccc1CC(=O)C=CC(C)C 1458a_100016268746_100000699184 [0,0,0,0,0,1|2,0,1]=4 1404 B16R1.1369 CSc1ccccc1CC(=O)CCC(C)C 1458a_100000181311_100000699184 [0,0,0,0,0,1|2,0,0]=3 1405 B16R1.1369 CSc1ccccc1CC(=O)CC[S+](C)C 1458a_100009452791_100000699184 [0,0,0,0,0,1|3,0,0]=4 1406 B16R1.1369 CSc1ccccc1CC(=O)COC(C)C 1458a_100000745533_100000699184 [0,0,0,0,0,1|3,0,0]=4 1407 B16R1.1369 CSc1ccccc1CC(=O)CSC(C)C 1458a_100000241585_100000699184 [0,0,0,0,0,1|3,0,0]=4 1408 B16R1.1369 CSc1ccccc1NC(=O)C=CC(C)C 11a_100000211160_100016268746 [0,0,0,0,0,1|2,0,1]=4 1409 B16R1.1369 CSc1ccccc1NC(=O)C=CC(C)C 22a_100000211160_100016268746 [0,0,0,0,0,1|2,0,1]=4 1410 B16R1.1369 CSc1ccccc1NC(=O)CCC(C)C 11a_100000211160_100000181311 [0,0,0,0,0,1|2,0,0]=3 1411 B16R1.1369 CSc1ccccc1NC(=O)CCC(C)C 22a_100000211160_100000181311 [0,0,0,0,0,1|2,0,0]=3 1412 B16R1.1369 CSc1ccccc1NC(=O)CCN(C)C 11a_100000211160_100000689311 [0,0,0,0,0,1|3,0,0]=4 1413 B16R1.1369 CSc1ccccc1NC(=O)CCN(C)C 2230a_100102631434_100000181524 [0,0,0,0,0,1|3,0,0]=4 1414 B16R1.1369 CSc1ccccc1NC(=O)CCN(C)C 22a_100000211160_100000689311 [0,0,0,0,0,1|3,0,0]=4 1415 B16R1.1369 CSc1ccccc1NC(=O)CCN(C)C 269982a_100102631434_100000181524 [0,0,0,0,0,1|3,0,0]=4 1416 B16R1.1369 CSc1ccccc1NC(=O)CC[S+](C)C 11a_100000211160_100009452791 [0,0,0,0,0,1|3,0,0]=4 1417 B16R1.1369 CSc1ccccc1NC(=O)CC[S+](C)C 22a_100000211160_100009452791 [0,0,0,0,0,1|3,0,0]=4 1418 B16R1.1369 CSc1ccccc1NC(=O)CNC(C)C 2230a_100138425928_200000182989 [0,0,0,0,0,1|3,0,0]=4 1419 B16R1.1369 CSc1ccccc1NC(=O)CNC(C)C 34a_100138425928_200000182989 [0,0,0,0,0,1|3,0,0]=4 1420 B16R1.1369 CSc1ccccc1NC(=O)COC(C)C 11a_100000211160_100000745533 [0,0,0,0,0,1|3,0,0]=4 1421 B16R1.1369 CSc1ccccc1NC(=O)COC(C)C 22a_100000211160_100000745533 [0,0,0,0,0,1|3,0,0]=4 1422 B16R1.1369 CSc1ccccc1NC(=O)COC(C)C 34a_100000212225_200000182989 [0,0,0,0,0,1|3,0,0]=4 1423 B16R1.1369 CSc1ccccc1NC(=O)CSC(C)C 11a_100000211160_100000241585 [0,0,0,0,0,1|3,0,0]=4 1424 B16R1.1369 CSc1ccccc1NC(=O)CSC(C)C 22a_100000211160_100000241585 [0,0,0,0,0,1|3,0,0]=4 1425 B16R1.1369 CSc1ccccc1NC(=O)CSC(C)C 62a_100000210206_200000182989 [0,0,0,0,0,1|3,0,0]=4 1426 B16R1.1369 CSc1ccccc1NC(=O)NCC(C)C 2430a_100000211160_100000210953 [0,0,0,0,0,1|2,0,0]=3 1427 B16R1.1369 CSc1ccccc1NC(=O)NCC(C)C 512a_100000211160_100000210953 [0,0,0,0,0,1|2,0,0]=3 1428 B16R1.1369 CSc1ccccc1NC(=O)NCC(C)O 2430a_100000211160_100000210904 [0,0,0,0,0,1|3,0,0]=4 1429 B16R1.1369 CSc1ccccc1NC(=O)NCC(C)O 512a_100000211160_100000210904 [0,0,0,0,0,1|3,0,0]=4 1430 B16R1.1369 CSc1ccccc1NC(=O)NNC(C)C 512a_100000211160_100000741168 [0,0,0,0,0,1|3,0,0]=4 1431 B16R1.18704 C#Cc1ccccc1C(=O)CCCC(C)C 1458a_100011243808_100011214892 [0,0,0,0,0,1|2,0,1]=4 1432 B16R1.18704 C#Cc1ccccc1C(=O)CCOC(C)C 1458a_100011243808_100000211751 [0,0,0,0,0,1|2,0,1]=4 1433 B16R1.18704 C#Cc1ccccc1C(=O)CCSC(C)C 1458a_100011243808_100000730970 [0,0,0,0,0,1|2,0,1]=4 1434 B16R1.18704 C#Cc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100011243808 [0,0,0,0,0,1|2,0,1]=4 1435 B16R1.18704 C#Cc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100011243808 [0,0,0,0,0,1|2,0,1]=4 1436 B16R1.18704 C=C(C)COCC(=O)c1ccccc1OC 34a_100000210245_100000195505 [0,0,0,0,0,1|1,0,2]=4 1437 B16R1.18704 C=Cc1ccccc1C(=O)CCCC(C)C 1458a_100011830265_100011214892 [0,0,0,0,0,1|2,0,1]=4 1438 B16R1.18704 C=Cc1ccccc1C(=O)CCOC(C)C 1458a_100011830265_100000211751 [0,0,0,0,0,1|2,0,1]=4 1439 B16R1.18704 C=Cc1ccccc1C(=O)CCSC(C)C 1458a_100011830265_100000730970 [0,0,0,0,0,1|2,0,1]=4 1440 B16R1.18704 C=Cc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100011830265 [0,0,0,0,0,1|2,0,1]=4 1441 B16R1.18704 C=Cc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100011830265 [0,0,0,0,0,1|2,0,1]=4 1442 B16R1.18704 CC(C)CCCC(=O)c1ccccc1C#N 1458a_100000742908_100011214892 [0,0,0,0,0,1|3,0,0]=4 1443 B16R1.18704 CC(C)CCCC(=O)c1ccccc1CO 1458a_100011301526_100011214892 [0,0,0,0,0,1|3,0,0]=4 1444 B16R1.18704 CC(C)CCCC(=O)c1ccccc1I=O 1458a_100000032414_100011214892 [0,0,0,0,0,1|3,0,0]=4 1445 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 11a_100000210545_100000742908 [0,0,0,0,0,1|3,0,0]=4 1446 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 1626a_100000210545_100000742908 [0,0,0,0,0,1|3,0,0]=4 1447 B16R1.18704 CC(C)CCNC(=O)c1ccccc1C#N 527a_100000210545_100000742908 [0,0,0,0,0,1|3,0,0]=4 1448 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 1626a_100000210545_100000032414 [0,0,0,0,0,1|3,0,0]=4 1449 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 240690a_100000210545_100000032414 [0,0,0,0,0,1|3,0,0]=4 1450 B16R1.18704 CC(C)CCNC(=O)c1ccccc1I=O 527a_100000210545_100000032414 [0,0,0,0,0,1|3,0,0]=4 1451 B16R1.18704 CC(C)CCOC(=O)c1ccccc1O[13CH3] 7a_100000030269_200025704644 [0,0,0,0,0,1|1,0,0]=2 1452 B16R1.18704 CC(C)CNNC(=O)c1ccccc1C#N 22a_100000696102_100000742908 [0,0,0,0,0,1|3,0,0]=4 1453 B16R1.18704 CC(C)CNNC(=O)c1ccccc1I=O 22a_100000696102_100000032414 [0,0,0,0,0,1|3,0,0]=4 1454 B16R1.18704 CC(C)OCCC(=O)c1ccccc1C#N 1458a_100000742908_100000211751 [0,0,0,0,0,1|3,0,0]=4 1455 B16R1.18704 CC(C)OCCC(=O)c1ccccc1CO 1458a_100011301526_100000211751 [0,0,0,0,0,1|3,0,0]=4 1456 B16R1.18704 CC(C)OCCC(=O)c1ccccc1I=O 1458a_100000032414_100000211751 [0,0,0,0,0,1|3,0,0]=4 1457 B16R1.18704 CC(C)SCCC(=O)c1ccccc1C#N 1458a_100000742908_100000730970 [0,0,0,0,0,1|3,0,0]=4 1458 B16R1.18704 CC(C)SCCC(=O)c1ccccc1CO 1458a_100011301526_100000730970 [0,0,0,0,0,1|3,0,0]=4 1459 B16R1.18704 CC(C)SCCC(=O)c1ccccc1I=O 1458a_100000032414_100000730970 [0,0,0,0,0,1|3,0,0]=4 1460 B16R1.18704 CCc1ccccc1C(=O)CCC=C(C)C 1458a_100000689120_100011217483 [0,0,0,0,0,1|2,0,1]=4 1461 B16R1.18704 CCc1ccccc1C(=O)CCCC(C)C 1458a_100000689120_100011214892 [0,0,0,0,0,1|2,0,0]=3 1462 B16R1.18704 CCc1ccccc1C(=O)CCCC(C)O 1458a_100000689120_200000718107 [0,0,0,0,0,1|3,0,0]=4 1463 B16R1.18704 CCc1ccccc1C(=O)CCCN(C)C 1458a_100000689120_100000695564 [0,0,0,0,0,1|3,0,0]=4 1464 B16R1.18704 CCc1ccccc1C(=O)CCOC(C)C 1458a_100000689120_100000211751 [0,0,0,0,0,1|2,0,0]=3 1465 B16R1.18704 CCc1ccccc1C(=O)CCSC(C)C 1458a_100000689120_100000730970 [0,0,0,0,0,1|2,0,0]=3 1466 B16R1.18704 CCc1ccccc1C(=O)NCC=C(C)C 11a_100000718196_100000689120 [0,0,0,0,0,1|2,0,1]=4 1467 B16R1.18704 CCc1ccccc1C(=O)NCC=C(C)C 1626a_100000718196_100000689120 [0,0,0,0,0,1|2,0,1]=4 1468 B16R1.18704 CCc1ccccc1C(=O)NCC=C(C)C 527a_100000718196_100000689120 [0,0,0,0,0,1|2,0,1]=4 1469 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000689120 [0,0,0,0,0,1|2,0,0]=3 1470 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000689120 [0,0,0,0,0,1|2,0,0]=3 1471 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000689120 [0,0,0,0,0,1|2,0,0]=3 1472 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000689120 [0,0,0,0,0,1|2,0,0]=3 1473 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000689120 [0,0,0,0,0,1|3,0,0]=4 1474 B16R1.18704 CCc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000689120 [0,0,0,0,0,1|3,0,0]=4 1475 B16R1.18704 CCc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000689120 [0,0,0,0,0,1|3,0,0]=4 1476 B16R1.18704 CCc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000689120 [0,0,0,0,0,1|3,0,0]=4 1477 B16R1.18704 CCc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000689120 [0,0,0,0,0,1|2,0,0]=3 1478 B16R1.18704 CCc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000689120 [0,0,0,0,0,1|3,0,0]=4 1479 B16R1.18704 CNc1ccccc1C(=NNCC(C)O)C 4a_200000730056_100000020593 [0,0,0,0,0,1|3,0,0]=4 1480 B16R1.18704 COc1ccccc1C(=O)CCC=C(C)C 1458a_100000185835_100011217483 [0,0,0,0,0,1|2,0,1]=4 1481 B16R1.18704 COc1ccccc1C(=O)CCCC(C)C 1458a_100000185835_100011214892 [0,0,0,0,0,1|2,0,0]=3 1482 B16R1.18704 COc1ccccc1C(=O)CCCC(C)O 1458a_100000185835_200000718107 [0,0,0,0,0,1|3,0,0]=4 1483 B16R1.18704 COc1ccccc1C(=O)CCCN(C)C 1458a_100000185835_100000695564 [0,0,0,0,0,1|3,0,0]=4 1484 B16R1.18704 COc1ccccc1C(=O)CCOC(C)C 1458a_100000185835_100000211751 [0,0,0,0,0,1|2,0,0]=3 1485 B16R1.18704 COc1ccccc1C(=O)CCSC(C)C 1458a_100000185835_100000730970 [0,0,0,0,0,1|2,0,0]=3 1486 B16R1.18704 COc1ccccc1C(=O)CNCC(C)C 34a_100000210953_100000195505 [0,0,0,0,0,1|2,0,0]=3 1487 B16R1.18704 COc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000195505 [0,0,0,0,0,1|3,0,0]=4 1488 B16R1.18704 COc1ccccc1C(=O)COCC(=O)C 34a_100000211253_100000195505 [0,0,0,0,0,1|2,0,1]=4 1489 B16R1.18704 COc1ccccc1C(=O)COCC(C)Br 34a_100012180447_100000195505 [0,0,0,0,0,1|2,0,0]=3 1490 B16R1.18704 COc1ccccc1C(=O)COCC(C)C 34a_100000210257_100000195505 [0,0,0,0,0,1|1,0,0]=2 1491 B16R1.18704 COc1ccccc1C(=O)COCC(C)F 34a_100015925927_100000195505 [0,0,0,0,0,1|2,0,0]=3 1492 B16R1.18704 COc1ccccc1C(=O)COCC(F)F 34a_100000743014_100000195505 [0,0,0,0,0,1|3,0,0]=4 1493 B16R1.18704 COc1ccccc1C(=O)COC[C@@H](C)Cl 34a_100016084084_100000195505 [0,0,0,0,0,1|2,0,0]=3 1494 B16R1.18704 COc1ccccc1C(=O)COC[C@@H](C)N 34a_100000737577_100000195505 [0,0,0,0,0,1|2,0,0]=3 1495 B16R1.18704 COc1ccccc1C(=O)CSCC(C)C 62a_100000195505_100000210760 [0,0,0,0,0,1|1,1,0]=3 1496 B16R1.18704 COc1ccccc1C(=O)CSCC(C)O 62a_100000195505_100011218427 [0,0,0,0,0,1|2,1,0]=4 1497 B16R1.18704 COc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000195505_100009817552 [0,0,0,0,0,1|2,1,0]=4 1498 B16R1.18704 COc1ccccc1C(=O)NCC=C(C)C 11a_100000718196_100000185835 [0,0,0,0,0,1|2,0,1]=4 1499 B16R1.18704 COc1ccccc1C(=O)NCC=C(C)C 1626a_100000718196_100000185835 [0,0,0,0,0,1|2,0,1]=4 1500 B16R1.18704 COc1ccccc1C(=O)NCC=C(C)C 527a_100000718196_100000185835 [0,0,0,0,0,1|2,0,1]=4 1501 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000185835 [0,0,0,0,0,1|2,0,0]=3 1502 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000185835 [0,0,0,0,0,1|2,0,0]=3 1503 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000185835 [0,0,0,0,0,1|2,0,0]=3 1504 B16R1.18704 COc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000185835 [0,0,0,0,0,1|2,0,0]=3 1505 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000185835 [0,0,0,0,0,1|3,0,0]=4 1506 B16R1.18704 COc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000185835 [0,0,0,0,0,1|3,0,0]=4 1507 B16R1.18704 COc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000185835 [0,0,0,0,0,1|3,0,0]=4 1508 B16R1.18704 COc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000185835 [0,0,0,0,0,1|3,0,0]=4 1509 B16R1.18704 COc1ccccc1C(=O)NN=CC(C)C 4a_100000189102_100000210432 [0,0,0,0,0,1|2,0,1]=4 1510 B16R1.18704 COc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000185835 [0,0,0,0,0,1|2,0,0]=3 1511 B16R1.18704 COc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000185835 [0,0,0,0,0,1|3,0,0]=4 1512 B16R1.18704 COc1ccccc1C(=O)OCCC(C)C 7a_100000030269_200000210301 [0,0,0,0,0,1|1,0,0]=2 1513 B16R1.18704 COc1ccccc1C(C)OCCC(C)C 7a_100000742714_100000210626 [0,0,0,0,0,1|2,0,1]=4 1514 B16R1.18704 COc1ccccc1C(N)COCC(C)C 34a_100000756845_100000210624 [0,0,0,0,0,1|2,0,1]=4 1515 B16R1.18704 CSc1ccccc1C(=O)CCC=C(C)C 1458a_100000183967_100011217483 [0,0,0,0,0,1|2,0,1]=4 1516 B16R1.18704 CSc1ccccc1C(=O)CCCC(C)C 1458a_100000183967_100011214892 [0,0,0,0,0,1|2,0,0]=3 1517 B16R1.18704 CSc1ccccc1C(=O)CCCC(C)O 1458a_100000183967_200000718107 [0,0,0,0,0,1|3,0,0]=4 1518 B16R1.18704 CSc1ccccc1C(=O)CCCN(C)C 1458a_100000183967_100000695564 [0,0,0,0,0,1|3,0,0]=4 1519 B16R1.18704 CSc1ccccc1C(=O)CCOC(C)C 1458a_100000183967_100000211751 [0,0,0,0,0,1|2,0,0]=3 1520 B16R1.18704 CSc1ccccc1C(=O)CCSC(C)C 1458a_100000183967_100000730970 [0,0,0,0,0,1|2,0,0]=3 1521 B16R1.18704 CSc1ccccc1C(=O)NCC=C(C)C 11a_100000718196_100000183967 [0,0,0,0,0,1|2,0,1]=4 1522 B16R1.18704 CSc1ccccc1C(=O)NCC=C(C)C 1626a_100000718196_100000183967 [0,0,0,0,0,1|2,0,1]=4 1523 B16R1.18704 CSc1ccccc1C(=O)NCC=C(C)C 527a_100000718196_100000183967 [0,0,0,0,0,1|2,0,1]=4 1524 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000183967 [0,0,0,0,0,1|2,0,0]=3 1525 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000183967 [0,0,0,0,0,1|2,0,0]=3 1526 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000183967 [0,0,0,0,0,1|2,0,0]=3 1527 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000183967 [0,0,0,0,0,1|2,0,0]=3 1528 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000183967 [0,0,0,0,0,1|3,0,0]=4 1529 B16R1.18704 CSc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000183967 [0,0,0,0,0,1|3,0,0]=4 1530 B16R1.18704 CSc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000183967 [0,0,0,0,0,1|3,0,0]=4 1531 B16R1.18704 CSc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000183967 [0,0,0,0,0,1|3,0,0]=4 1532 B16R1.18704 CSc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000183967 [0,0,0,0,0,1|2,0,0]=3 1533 B16R1.18704 CSc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000183967 [0,0,0,0,0,1|3,0,0]=4 1534 B13R1.84 CCCC=Cc1ccccc1CC 271570a_100016258520_100011215823 [2,0,0,0,0,0|2,0,0]=4 1535 B13R1.84 CCCC=Cc1ccccc1NC 271570a_100016258520_100020606079 [2,0,0,0,0,0|1,0,0]=3 1536 B13R1.84 CCCC=Cc1ccccc1NN 271570a_100016258520_100000241748 [2,0,0,0,0,0|2,0,0]=4 1537 B13R1.84 CCCC=Cc1ccccc1OC 271570a_100016258520_100000174000 [2,0,0,0,0,0|2,0,0]=4 1538 B13R1.84 CCCC=Cc1ccccc1SC 271570a_100016258520_100011217816 [2,0,0,0,0,0|2,0,0]=4 1539 B13R1.84 CCCC=Cc1cccnc1NC 271570a_100016258520_100000700899 [2,0,0,0,0,0|2,0,0]=4 1540 B13R1.84 CCCC=Cc1cnccc1NC 271570a_100016258520_100010069531 [2,0,0,0,0,0|2,0,0]=4 1541 B13R1.84 CCCC=Cc1ncccc1NC 271570a_100016258520_200011806188 [2,0,0,0,0,0|2,0,0]=4 1542 B13R1.84 CCCCOc1ccccc1NC 2230a_100000743494_200000210301 [2,0,0,0,0,0|2,0,0]=4 1543 B13R1.84 CCCCOc1ccccc1NC 34a_100000033821_100000210210 [2,0,0,0,0,0|2,0,0]=4 1544 B13R1.84 CCCCOc1ccccc1NC 34a_100000743494_200000210301 [2,0,0,0,0,0|2,0,0]=4 1545 B13R1.84 CCCCOc1ccccc1N[13CH3] 2230a_100000743494_200025704644 [2,0,0,0,0,0|2,0,0]=4 1546 B13R1.84 CCCCOc1ccccc1N[13CH3] 34a_100000743494_200025704644 [2,0,0,0,0,0|2,0,0]=4 1547 B13R1.84 CCCCSc1ccccc1NC 62a_100000210211_100020606079 [2,0,0,0,0,0|2,0,0]=4 1548 B13R1.84 CCCCSc1ccccc1NC 62a_100020606079_100000210210 [2,0,0,0,0,0|2,0,0]=4 1549 B13R1.84 CCCOCc1ccccc1CC 34a_100011663872_100000210303 [2,0,0,0,0,0|1,0,1]=4 1550 B13R1.84 CCCOCc1ccccc1CC 7a_100011663872_100000210303 [2,0,0,0,0,0|1,0,1]=4 1551 B13R1.84 CCCOCc1ccccc1OC 34a_100000210258_100000210004 [2,0,0,0,0,0|1,0,1]=4 1552 B13R1.84 CCCOCc1ccccc1OC 34a_100000211301_100000210303 [2,0,0,0,0,0|1,0,1]=4 1553 B13R1.84 CCCOCc1ccccc1SC 34a_100000210258_100000699184 [2,0,0,0,0,0|1,0,1]=4 1554 B13R1.84 CCCOCc1ccccc1SC 34a_100000699167_100000210303 [2,0,0,0,0,0|1,0,1]=4 1555 B13R1.84 CCOC=Cc1ccccc1NC 271570a_100016256518_100020606079 [2,0,0,0,0,0|2,0,0]=4 1556 B13R1.84 CNc1ccccc1C=CCOC 271570a_100016286323_100020606079 [2,0,0,0,0,0|2,0,0]=4 1557 B13R1.158 CC(C)CC=Cc1cccc[n+]1C 271570a_100016259101_100000212160 [2,0,0,0,0,0|2,0,0]=4 1558 B13R1.158 CC(C)CC=Cc1ccccc1Br 271570a_100016259101_100000695589 [2,0,0,0,0,0|2,0,0]=4 1559 B13R1.158 CC(C)CC=Cc1ccccc1Cl 271570a_100016259101_100000764095 [2,0,0,0,0,0|2,0,0]=4 1560 B13R1.158 CC(C)CC=Cc1ccccc1F 271570a_100016259101_100011215700 [2,0,0,0,0,0|2,0,0]=4 1561 B13R1.158 CC(C)CC=Cc1ccccc1N 271570a_100016259101_100000210017 [2,0,0,0,0,0|1,0,0]=3 1562 B13R1.158 CC(C)CC=Cc1ccccc1O 271570a_100016259101_100000739446 [2,0,0,0,0,0|2,0,0]=4 1563 B13R1.158 CC(C)CC=Cc1cccnc1N 271570a_100016259101_100000045569 [2,0,0,0,0,0|2,0,0]=4 1564 B13R1.158 CC(C)CC=Cc1ccncc1N 271570a_100016259101_100009815883 [2,0,0,0,0,0|2,0,0]=4 1565 B13R1.158 CC(C)CC=Cc1cnccc1N 271570a_100016259101_100000047001 [2,0,0,0,0,0|2,0,0]=4 1566 B13R1.158 CC(C)CC=Cc1ncccc1N 271570a_100016259101_100000688686 [2,0,0,0,0,0|2,0,0]=4 1567 B13R1.158 CC(C)CCOc1ccccc1N 34a_100000185747_100000210312 [2,0,0,0,0,0|2,0,0]=4 1568 B13R1.158 CC(C)CCOc1ccccc1N 7a_100000185747_100000210626 [2,0,0,0,0,0|2,0,0]=4 1569 B13R1.158 CC(C)CCSc1ccccc1N 62a_100000210017_100000210312 [2,0,0,0,0,0|2,0,0]=4 1570 B13R1.158 CC(C)CCSc1ccccc1N 62a_100000210312_100000210017 [2,0,0,0,0,0|2,0,0]=4 1571 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000210257_100000184730 [2,0,0,0,0,0|1,0,1]=4 1572 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000756307_100000210624 [2,0,0,0,0,0|1,0,1]=4 1573 B13R1.158 CC(C)COCc1ccccc1Br 7a_100000756307_100000210760 [2,0,0,0,0,0|1,0,1]=4 1574 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210257_100000187162 [2,0,0,0,0,0|1,0,1]=4 1575 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210847_100000210624 [2,0,0,0,0,0|1,0,1]=4 1576 B13R1.158 CC(C)COCc1ccccc1Cl 7a_100000210847_100000210760 [2,0,0,0,0,0|1,0,1]=4 1577 B13R1.158 CC(C)COCc1ccccc1F 34a_100000210257_100000211605 [2,0,0,0,0,0|1,0,1]=4 1578 B13R1.158 CC(C)COCc1ccccc1F 34a_100000211962_100000210624 [2,0,0,0,0,0|1,0,1]=4 1579 B13R1.158 CC(C)COCc1ccccc1F 7a_100000211962_100000210760 [2,0,0,0,0,0|1,0,1]=4 1580 B13R1.158 CC(C)COCc1ccccc1I 34a_100000187465_100000210624 [2,0,0,0,0,0|1,0,1]=4 1581 B13R1.158 CC(C)COCc1ccccc1I 34a_100000210257_100011215278 [2,0,0,0,0,0|1,0,1]=4 1582 B13R1.158 CC(C)COCc1ccccc1I 7a_100000187465_100000210760 [2,0,0,0,0,0|1,0,1]=4 1583 B13R1.158 CC(C)COCc1ccccc1N 34a_100000212039_100000210624 [2,0,0,0,0,0|0,0,1]=3 1584 B13R1.158 CC(C)COCc1ncccc1N 34a_114873767017_100000210624 [2,0,0,0,0,0|1,0,1]=4 1585 B13R1.158 CC(O)COCc1ccccc1N 34a_100000212039_100011218427 [2,0,0,0,0,0|1,0,1]=4 1586 B13R1.158 C[C@@H](O)COCc1ccccc1N 34a_100000212039_100009817552 [2,0,0,0,0,0|1,0,1]=4 1587 B13R1.158 Cc1ccccc1C=CCC(C)C 271570a_100016259101_100000210755 [2,0,0,0,0,0|1,0,0]=3 1588 B13R1.158 Cc1ccccc1C=NNC(C)C 4a_100000741168_100000211143 [2,0,0,0,0,0|2,0,0]=4 1589 B13R1.158 Cc1ccccc1CNCC(C)C 207a_100000210953_100000211143 [2,0,0,0,0,0|1,0,1]=4 1590 B13R1.158 Cc1ccccc1CNCC(C)C 2230a_100000210953_100000211839 [2,0,0,0,0,0|1,0,1]=4 1591 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000174972_100000210432 [2,0,0,0,0,0|1,0,1]=4 1592 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000210953_100000211143 [2,0,0,0,0,0|1,0,1]=4 1593 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000174972_100000210624 [2,0,0,0,0,0|1,0,1]=4 1594 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000210953_100000211839 [2,0,0,0,0,0|1,0,1]=4 1595 B13R1.158 Cc1ccccc1COCC(C)Br 34a_100012180447_100000211839 [2,0,0,0,0,0|1,0,1]=4 1596 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000210257_100000211839 [2,0,0,0,0,0|0,0,1]=3 1597 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000698903_100000210624 [2,0,0,0,0,0|0,0,1]=3 1598 B13R1.158 Cc1ccccc1COCC(C)C 7a_100000698903_100000210760 [2,0,0,0,0,0|0,0,1]=3 1599 B13R1.158 Cc1ccccc1COCC(C)F 34a_100015925927_100000211839 [2,0,0,0,0,0|1,0,1]=4 1600 B13R1.158 Cc1ccccc1COCC(C)O 34a_100000698903_100011218427 [2,0,0,0,0,0|1,0,1]=4 1601 B13R1.158 Cc1ccccc1COCC(C)O 7a_100000698903_100011218427 [2,0,0,0,0,0|1,0,1]=4 1602 B13R1.158 Cc1ccccc1COC[C@@H](C)Cl 34a_100016084084_100000211839 [2,0,0,0,0,0|1,0,1]=4 1603 B13R1.158 Cc1ccccc1COC[C@@H](C)N 34a_100000737577_100000211839 [2,0,0,0,0,0|1,0,1]=4 1604 B13R1.158 Cc1ccccc1COC[C@@H](C)O 34a_100000698903_100009817552 [2,0,0,0,0,0|1,0,1]=4 1605 B13R1.158 Cc1ccccc1COC[C@@H](C)O 7a_100000698903_100009817552 [2,0,0,0,0,0|1,0,1]=4 1606 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000210624_100000211839 [2,0,0,0,0,0|0,1,1]=4 1607 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000211839_100000210760 [2,0,0,0,0,0|0,1,1]=4 1608 B13R1.158 Cc1ccccc1NCCC(C)C 34a_100015192222_100000210312 [2,0,0,0,0,0|2,0,0]=4 1609 B13R1.158 Cc1ccccc1OCCC(C)C 34a_100000210338_100000210312 [2,0,0,0,0,0|2,0,0]=4 1610 B13R1.158 Cc1ccccc1OCCC(C)C 7a_100000210338_100000210626 [2,0,0,0,0,0|2,0,0]=4 1611 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210312_100000210755 [2,0,0,0,0,0|2,0,0]=4 1612 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210755_100000210312 [2,0,0,0,0,0|2,0,0]=4 1613 B13R1.158 Cc1cccnc1C=CCC(C)C 271570a_100016259101_100000751373 [2,0,0,0,0,0|2,0,0]=4 1614 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000210257_100000696600 [2,0,0,0,0,0|1,0,1]=4 1615 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000698912_100000210624 [2,0,0,0,0,0|1,0,1]=4 1616 B13R1.158 Cc1ccncc1C=CCC(C)C 271570a_100016259101_100000761580 [2,0,0,0,0,0|2,0,0]=4 1617 B13R1.158 Cc1ccncc1COCC(C)C 34a_100000210257_100000690890 [2,0,0,0,0,0|1,0,1]=4 1618 B13R1.158 Cc1ccncc1COCC(C)C 34a_100011996381_100000210624 [2,0,0,0,0,0|1,0,1]=4 1619 B13R1.158 Cc1cnccc1C=CCC(C)C 271570a_100016259101_100015191297 [2,0,0,0,0,0|2,0,0]=4 1620 B13R1.158 Cc1cnccc1COCC(C)C 34a_100000210257_100020672809 [2,0,0,0,0,0|1,0,1]=4 1621 B13R1.158 Cc1cnccc1COCC(C)C 34a_100011997032_100000210624 [2,0,0,0,0,0|1,0,1]=4 1622 B13R1.158 Cc1ncccc1C=CCC(C)C 271570a_100016259101_100000751574 [2,0,0,0,0,0|2,0,0]=4 1623 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000210257_100000732876 [2,0,0,0,0,0|1,0,1]=4 1624 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000729262_100000210624 [2,0,0,0,0,0|1,0,1]=4 1625 B13R1.158 Cc1ncccc1COCC(C)C 7a_100000729262_100000210760 [2,0,0,0,0,0|1,0,1]=4 1626 B13R1.45 CC(=O)COC(=O)c1ccccc1 1458a_100000070787_100000073877 [2,0,0,0,0,0|1,0,1]=4 1627 B13R1.45 CC(C)CCC(=O)c1ccccc1 1458a_100000185807_100000210312 [2,0,0,0,0,0|1,0,0]=3 1628 B13R1.45 CC(C)CNC(=O)c1ccccc1 11a_100000210953_100000185807 [2,0,0,0,0,0|1,0,0]=3 1629 B13R1.45 CC(C)CNC(=O)c1ccccc1 1626a_100000210953_100000185807 [2,0,0,0,0,0|1,0,0]=3 1630 B13R1.45 CC(C)CNC(=O)c1ccccc1 240690a_100000210953_100000185807 [2,0,0,0,0,0|1,0,0]=3 1631 B13R1.45 CC(C)CNC(=O)c1ccccc1 527a_100000210953_100000185807 [2,0,0,0,0,0|1,0,0]=3 1632 B13R1.45 CC(C)COC(C)c1ccccc1 34a_100000210257_100000211855 [2,0,0,0,0,0|1,0,1]=4 1633 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 34a_100000761318_100000210624 [2,0,0,0,0,0|1,0,1]=4 1634 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 7a_100000761318_100000210760 [2,0,0,0,0,0|1,0,1]=4 1635 B13R1.45 CC(C)NNC(=O)c1ccccc1 22a_100000741168_100000185807 [2,0,0,0,0,0|2,0,0]=4 1636 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000210206_100000211460 [2,0,0,0,0,0|2,0,0]=4 1637 B13R1.45 CC(C)SCC(=O)c1ccccc1 62a_100000211460_100000210206 [2,0,0,0,0,0|2,0,0]=4 1638 B13R1.45 CC(O)CCC(=O)c1ccccc1 1458a_100000185807_100012276601 [2,0,0,0,0,0|2,0,0]=4 1639 B13R1.45 CC(O)CNC(=O)c1ccccc1 11a_100000210904_100000185807 [2,0,0,0,0,0|2,0,0]=4 1640 B13R1.45 CC(O)CNC(=O)c1ccccc1 240690a_100000210904_100000185807 [2,0,0,0,0,0|2,0,0]=4 1641 B13R1.45 CC(O)CNC(=O)c1ccccc1 527a_100000210904_100000185807 [2,0,0,0,0,0|2,0,0]=4 1642 B13R1.45 CN(C)CCC(=O)c1ccccc1 2230a_100102631434_100000750707 [2,0,0,0,0,0|2,0,0]=4 1643 B13R1.45 CN(C)CCC(=O)c1ccccc1 269982a_100102631434_100000750707 [2,0,0,0,0,0|2,0,0]=4 1644 B13R1.45 CN(C)COC(=O)c1ccccc1 269982a_100102631434_100000073877 [2,0,0,0,0,0|1,0,0]=3 1645 B13R1.674 CCCCC(=O)c1ccccc1Br 1458a_100000188424_100000210211 [2,0,0,0,0,0|2,0,0]=4 1646 B13R1.674 CCCCC(=O)c1ccccc1C 1458a_100000212026_100000210211 [2,0,0,0,0,0|1,0,0]=3 1647 B13R1.674 CCCCC(=O)c1ccccc1Cl 1458a_100000185844_100000210211 [2,0,0,0,0,0|2,0,0]=4 1648 B13R1.674 CCCCC(=O)c1ccccc1F 1458a_100000188656_100000210211 [2,0,0,0,0,0|2,0,0]=4 1649 B13R1.674 CCCCC(=O)c1ccccc1I 1458a_100000187884_100000210211 [2,0,0,0,0,0|2,0,0]=4 1650 B13R1.674 CCCCC(=O)c1ccccc1O 1458a_100015234032_100000210211 [2,0,0,0,0,0|2,0,0]=4 1651 B13R1.674 CCCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210211 [2,0,0,0,0,0|2,0,0]=4 1652 B13R1.674 CCCNC(=O)c1ccccc1Br 11a_100020643023_100000188424 [2,0,0,0,0,0|2,0,0]=4 1653 B13R1.674 CCCNC(=O)c1ccccc1Br 1626a_100020643023_100000188424 [2,0,0,0,0,0|2,0,0]=4 1654 B13R1.674 CCCNC(=O)c1ccccc1Br 240690a_100020643023_100000188424 [2,0,0,0,0,0|2,0,0]=4 1655 B13R1.674 CCCNC(=O)c1ccccc1Br 527a_100020643023_100000188424 [2,0,0,0,0,0|2,0,0]=4 1656 B13R1.674 CCCNC(=O)c1ccccc1C 11a_100020643023_100000212026 [2,0,0,0,0,0|1,0,0]=3 1657 B13R1.674 CCCNC(=O)c1ccccc1C 1626a_100020643023_100000212026 [2,0,0,0,0,0|1,0,0]=3 1658 B13R1.674 CCCNC(=O)c1ccccc1C 240690a_100020643023_100000212026 [2,0,0,0,0,0|1,0,0]=3 1659 B13R1.674 CCCNC(=O)c1ccccc1C 527a_100020643023_100000212026 [2,0,0,0,0,0|1,0,0]=3 1660 B13R1.674 CCCNC(=O)c1ccccc1Cl 11a_100020643023_100000185844 [2,0,0,0,0,0|2,0,0]=4 1661 B13R1.674 CCCNC(=O)c1ccccc1Cl 1626a_100020643023_100000185844 [2,0,0,0,0,0|2,0,0]=4 1662 B13R1.674 CCCNC(=O)c1ccccc1Cl 240690a_100020643023_100000185844 [2,0,0,0,0,0|2,0,0]=4 1663 B13R1.674 CCCNC(=O)c1ccccc1Cl 527a_100020643023_100000185844 [2,0,0,0,0,0|2,0,0]=4 1664 B13R1.674 CCCNC(=O)c1ccccc1F 11a_100020643023_100000188656 [2,0,0,0,0,0|2,0,0]=4 1665 B13R1.674 CCCNC(=O)c1ccccc1F 1626a_100020643023_100000188656 [2,0,0,0,0,0|2,0,0]=4 1666 B13R1.674 CCCNC(=O)c1ccccc1F 240690a_100020643023_100000188656 [2,0,0,0,0,0|2,0,0]=4 1667 B13R1.674 CCCNC(=O)c1ccccc1F 527a_100020643023_100000188656 [2,0,0,0,0,0|2,0,0]=4 1668 B13R1.674 CCCNC(=O)c1ccccc1I 11a_100020643023_100000187884 [2,0,0,0,0,0|2,0,0]=4 1669 B13R1.674 CCCNC(=O)c1ccccc1I 1626a_100020643023_100000187884 [2,0,0,0,0,0|2,0,0]=4 1670 B13R1.674 CCCNC(=O)c1ccccc1I 240690a_100020643023_100000187884 [2,0,0,0,0,0|2,0,0]=4 1671 B13R1.674 CCCNC(=O)c1ccccc1I 527a_100020643023_100000187884 [2,0,0,0,0,0|2,0,0]=4 1672 B13R1.674 CCCNC(=O)c1ccccc1O 240690a_100020643023_100015234032 [2,0,0,0,0,0|2,0,0]=4 1673 B13R1.674 CCCNC(=O)c1ccccc1O 271570a_203496583355_200000152266 [2,0,0,0,0,0|2,0,0]=4 1674 B13R1.674 CCCNC(=O)c1ccccc1[O-] 1626a_100020643023_100009911694 [2,0,0,0,0,0|2,0,0]=4 1675 B13R1.674 CCCNC(=O)c1ccccc1[O-] 240690a_100020643023_100009911694 [2,0,0,0,0,0|2,0,0]=4 1676 B13R1.674 CCCNC(=O)c1ccccc1[O-] 527a_100020643023_100009911694 [2,0,0,0,0,0|2,0,0]=4 1677 B13R1.674 CCCOC(C)c1ccccc1C 34a_100000742021_100000210303 [2,0,0,0,0,0|1,0,1]=4 1678 B13R1.674 CCCOC(C)c1ccccc1C 7a_100000742021_100000210303 [2,0,0,0,0,0|1,0,1]=4 1679 B13R1.674 CCCOC(C)c1ccccc1N 7a_100011405641_100000210303 [2,0,0,0,0,0|1,0,1]=4 1680 B13R1.674 CCNCC(=O)c1ccccc1C 2230a_100015525214_100000741374 [2,0,0,0,0,0|2,0,0]=4 1681 B13R1.674 CCNNC(=O)c1ccccc1C 22a_100000756455_100000212026 [2,0,0,0,0,0|2,0,0]=4 1682 B13R1.674 CCOCC(=O)c1ccccc1C 34a_100121572206_100000741374 [2,0,0,0,0,0|2,0,0]=4 1683 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000210202_100000741374 [2,0,0,0,0,0|2,0,0]=4 1684 B13R1.674 CCSCC(=O)c1ccccc1C 62a_100000741374_100000210202 [2,0,0,0,0,0|2,0,0]=4 1685 B13R1.674 COCCC(=O)c1ccccc1C 1458a_100000212026_100000233755 [2,0,0,0,0,0|2,0,0]=4 1686 B13R1.674 CSCCC(=O)c1ccccc1C 1458a_100000212026_100000751147 [2,0,0,0,0,0|2,0,0]=4 1687 B13R1.674 Cc1ccccc1C(=O)CCCF 1458a_100000212026_100011934791 [2,0,0,0,0,0|2,0,0]=4 1688 B13R1.674 Cc1ccccc1C(=O)CCCO 1458a_100000212026_100011215043 [2,0,0,0,0,0|2,0,0]=4 1689 B13R1.674 Cc1ccccc1C(=O)NCCF 11a_100000724931_100000212026 [2,0,0,0,0,0|2,0,0]=4 1690 B13R1.674 Cc1ccccc1C(=O)NCCF 1626a_100000724931_100000212026 [2,0,0,0,0,0|2,0,0]=4 1691 B13R1.674 Cc1ccccc1C(=O)NCCF 240690a_100000724931_100000212026 [2,0,0,0,0,0|2,0,0]=4 1692 B13R1.674 Cc1ccccc1C(=O)NCCF 527a_100000724931_100000212026 [2,0,0,0,0,0|2,0,0]=4 1693 B13R1.674 Cc1ccccc1C(=O)NCCO 240690a_100000210304_100000212026 [2,0,0,0,0,0|2,0,0]=4 1694 B13R1.674 Cc1ccccc1C(=O)NCCO 527a_100000210304_100000212026 [2,0,0,0,0,0|2,0,0]=4 1695 B13R1.464 C#Cc1ccccc1C(=O)CCC 1458a_100011243808_100000210303 [2,0,0,0,0,0|1,0,1]=4 1696 B13R1.464 C=Cc1ccccc1C(=O)CCC 1458a_100011830265_100000210303 [2,0,0,0,0,0|1,0,1]=4 1697 B13R1.464 C=Cc1ccccc1C(=O)OCC 271570a_100011290941_100000169879 [2,0,0,0,0,0|1,0,1]=4 1698 B13R1.464 CCCC(=O)c1ccccc1C#N 1458a_100000742908_100000210303 [2,0,0,0,0,0|2,0,0]=4 1699 B13R1.464 CCCC(=O)c1ccccc1CC 1458a_100000689120_100000210303 [2,0,0,0,0,0|1,0,0]=3 1700 B13R1.464 CCCC(=O)c1ccccc1CO 1458a_100011301526_100000210303 [2,0,0,0,0,0|2,0,0]=4 1701 B13R1.464 CCCC(=O)c1ccccc1I=O 1458a_100000032414_100000210303 [2,0,0,0,0,0|2,0,0]=4 1702 B13R1.464 CCCC(=O)c1ccccc1OC 1458a_100000185835_100000210303 [2,0,0,0,0,0|1,0,0]=3 1703 B13R1.464 CCCC(=O)c1ccccc1OC 34a_200000073644_200000210301 [2,0,0,0,0,0|1,0,0]=3 1704 B13R1.464 CCCC(=O)c1ccccc1OC 7a_200000073644_200000210301 [2,0,0,0,0,0|1,0,0]=3 1705 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 34a_200000073644_200025704644 [2,0,0,0,0,0|1,0,0]=3 1706 B13R1.464 CCCC(=O)c1ccccc1O[13CH3] 7a_200000073644_200025704644 [2,0,0,0,0,0|1,0,0]=3 1707 B13R1.464 CCCC(=O)c1ccccc1SC 1458a_100000183967_100000210303 [2,0,0,0,0,0|1,0,0]=3 1708 B13R1.464 CCNC(=O)c1ccccc1CC 11a_100015525214_100000689120 [2,0,0,0,0,0|2,0,0]=4 1709 B13R1.464 CCNC(=O)c1ccccc1CC 240690a_100015525214_100000689120 [2,0,0,0,0,0|2,0,0]=4 1710 B13R1.464 CCNC(=O)c1ccccc1CC 527a_100015525214_100000689120 [2,0,0,0,0,0|2,0,0]=4 1711 B13R1.464 CCNC(=O)c1ccccc1NC 27a_100102657272_200000155173 [2,0,0,0,0,0|1,0,0]=3 1712 B13R1.464 CCNC(=O)c1ccccc1NC 34a_100000205978_200000210301 [2,0,0,0,0,0|1,0,0]=3 1713 B13R1.464 CCNC(=O)c1ccccc1N[13CH3] 34a_100000205978_200025704644 [2,0,0,0,0,0|1,0,0]=3 1714 B13R1.464 CCNC(=O)c1ccccc1OC 11a_100015525214_100000185835 [2,0,0,0,0,0|2,0,0]=4 1715 B13R1.464 CCNC(=O)c1ccccc1OC 240690a_100015525214_100000185835 [2,0,0,0,0,0|2,0,0]=4 1716 B13R1.464 CCNC(=O)c1ccccc1OC 34a_100000192205_200000210301 [2,0,0,0,0,0|2,0,0]=4 1717 B13R1.464 CCNC(=O)c1ccccc1OC 527a_100015525214_100000185835 [2,0,0,0,0,0|2,0,0]=4 1718 B13R1.464 CCNC(=O)c1ccccc1OC 7a_100000192205_200000210301 [2,0,0,0,0,0|2,0,0]=4 1719 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 34a_100000192205_200025704644 [2,0,0,0,0,0|2,0,0]=4 1720 B13R1.464 CCNC(=O)c1ccccc1O[13CH3] 7a_100000192205_200025704644 [2,0,0,0,0,0|2,0,0]=4 1721 B13R1.464 CCNC(=O)c1ccccc1SC 11a_100015525214_100000183967 [2,0,0,0,0,0|2,0,0]=4 1722 B13R1.464 CCNC(=O)c1ccccc1SC 240690a_100015525214_100000183967 [2,0,0,0,0,0|2,0,0]=4 1723 B13R1.464 CCNC(=O)c1ccccc1SC 527a_100015525214_100000183967 [2,0,0,0,0,0|2,0,0]=4 1724 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000155173_200000210301 [2,0,0,0,0,0|2,0,0]=4 1725 B13R1.464 CCNC(=O)c1ccccc1SC 62a_200000210301_200000155173 [2,0,0,0,0,0|2,0,0]=4 1726 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200000155173_200025704644 [2,0,0,0,0,0|2,0,0]=4 1727 B13R1.464 CCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000155173 [2,0,0,0,0,0|2,0,0]=4 1728 B13R1.464 CCNC(=O)c1cccnc1NC 27a_100102657272_100000160120 [2,0,0,0,0,0|2,0,0]=4 1729 B13R1.464 CCOC(=O)c1ccccc1OC 7a_100000169922_200000210301 [2,0,0,0,0,0|1,0,0]=3 1730 B13R1.464 CCOC(=O)c1ccccc1O[13CH3] 7a_100000169922_200025704644 [2,0,0,0,0,0|1,0,0]=3 1731 B13R1.464 CCOC(=O)c1ccccc1SC 62a_100000169876_200000210301 [2,0,0,0,0,0|1,0,0]=3 1732 B13R1.464 CCOC(=O)c1ccccc1SC 62a_200000210301_100000169879 [2,0,0,0,0,0|1,0,0]=3 1733 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_100000169876_200025704644 [2,0,0,0,0,0|1,0,0]=3 1734 B13R1.464 CCOC(=O)c1ccccc1S[13CH3] 62a_200025704644_100000169879 [2,0,0,0,0,0|1,0,0]=3 1735 B13R1.464 CCOC(=O)c1cccnc1NC 27a_100102657272_100000170124 [2,0,0,0,0,0|1,0,0]=3 1736 B13R1.464 CCOC(=O)c1cccnc1SC 62a_100011291640_200000210301 [2,0,0,0,0,0|2,0,0]=4 1737 B13R1.464 CCOC(=O)c1cccnc1SC 62a_200000210301_100000170124 [2,0,0,0,0,0|2,0,0]=4 1738 B13R1.464 CCOC(=O)c1cccnc1S[13CH3] 62a_100011291640_200025704644 [2,0,0,0,0,0|2,0,0]=4 1739 B13R1.464 CCOC(=O)c1cccnc1S[13CH3] 62a_200025704644_100000170124 [2,0,0,0,0,0|2,0,0]=4 1740 B13R1.464 CCOC(=O)c1ccncc1SC 62a_100010238393_200000210301 [2,0,0,0,0,0|2,0,0]=4 1741 B13R1.464 CCOC(=O)c1ccncc1SC 62a_200000210301_100010238393 [2,0,0,0,0,0|2,0,0]=4 1742 B13R1.464 CCOC(=O)c1ccncc1S[13CH3] 62a_100010238393_200025704644 [2,0,0,0,0,0|2,0,0]=4 1743 B13R1.464 CCOC(=O)c1ccncc1S[13CH3] 62a_200025704644_100010238393 [2,0,0,0,0,0|2,0,0]=4 1744 B13R1.464 CCOC(=O)c1cnccc1NC 27a_100102657272_100016987518 [2,0,0,0,0,0|1,0,0]=3 1745 B13R1.464 CCOC(=O)c1cnccc1SC 62a_200000210301_100016987518 [2,0,0,0,0,0|2,0,0]=4 1746 B13R1.464 CCOC(=O)c1cnccc1S[13CH3] 62a_200025704644_100016987518 [2,0,0,0,0,0|2,0,0]=4 1747 B13R1.464 CCOC(=O)c1cncnc1NC 27a_100102657272_100011998183 [2,0,0,0,0,0|2,0,0]=4 1748 B13R1.464 CCOC(=O)c1ncccc1OC 7a_200011376064_200000210301 [2,0,0,0,0,0|2,0,0]=4 1749 B13R1.464 CCOC(=O)c1ncccc1O[13CH3] 7a_200011376064_200025704644 [2,0,0,0,0,0|2,0,0]=4 1750 B13R1.464 CCOC(=O)c1ncccc1SC 62a_100012351660_200000210301 [2,0,0,0,0,0|2,0,0]=4 1751 B13R1.464 CCOC(=O)c1ncccc1SC 62a_200000210301_100012351660 [2,0,0,0,0,0|2,0,0]=4 1752 B13R1.464 CCOC(=O)c1ncccc1S[13CH3] 62a_100012351660_200025704644 [2,0,0,0,0,0|2,0,0]=4 1753 B13R1.464 CCOC(=O)c1ncccc1S[13CH3] 62a_200025704644_100012351660 [2,0,0,0,0,0|2,0,0]=4 1754 B13R1.464 CCOC(=O)c1nccnc1NC 27a_100102657272_100000085455 [2,0,0,0,0,0|2,0,0]=4 1755 B13R1.464 CCOC(=O)c1ncncc1NC 27a_100102657272_100012344254 [2,0,0,0,0,0|2,0,0]=4 1756 B13R1.464 CCc1ccccc1C(=O)CCF 1458a_100000689120_100011217306 [2,0,0,0,0,0|2,0,0]=4 1757 B13R1.464 CCc1ccccc1C(=O)CCO 1458a_100000689120_100000211926 [2,0,0,0,0,0|2,0,0]=4 1758 B13R1.464 CNCC(=O)c1ccccc1OC 34a_100102657272_100000195505 [2,0,0,0,0,0|2,0,0]=4 1759 B13R1.464 CNCC(=O)c1ccccc1OC 7a_106832991635_100000195505 [2,0,0,0,0,0|2,0,0]=4 1760 B13R1.464 CNc1ccccc1C(=O)NOC 34a_100011599994_200000210301 [2,0,0,0,0,0|2,0,0]=4 1761 B13R1.464 COCC(=O)c1ccccc1OC 34a_100138415774_100000195505 [2,0,0,0,0,0|2,0,0]=4 1762 B13R1.464 CONC(=O)c1ccccc1N[13CH3] 34a_100011599994_200025704644 [2,0,0,0,0,0|2,0,0]=4 1763 B13R1.464 COc1ccccc1C(=O)CCCl 7a_100009873196_200000210301 [2,0,0,0,0,0|2,0,0]=4 1764 B13R1.464 COc1ccccc1C(=O)CCF 1458a_100000185835_100011217306 [2,0,0,0,0,0|2,0,0]=4 1765 B13R1.464 COc1ccccc1C(=O)CCO 1458a_100000185835_100000211926 [2,0,0,0,0,0|2,0,0]=4 1766 B13R1.464 COc1ccccc1C(=O)CSC 62a_100000195505_200000210301 [2,0,0,0,0,0|2,0,0]=4 1767 B13R1.464 COc1ccccc1C(=O)CS[13CH3] 62a_100000195505_200025704644 [2,0,0,0,0,0|2,0,0]=4 1768 B13R1.464 CSc1ccccc1C(=O)CCF 1458a_100000183967_100011217306 [2,0,0,0,0,0|2,0,0]=4 1769 B13R1.464 CSc1ccccc1C(=O)CCO 1458a_100000183967_100000211926 [2,0,0,0,0,0|2,0,0]=4 1770 B13R1.464 [13CH3]Oc1ccccc1C(=O)CCCl 7a_100009873196_200025704644 [2,0,0,0,0,0|2,0,0]=4 1771 B15R1.85 CCC(C)COCc1ccccc1OC 34a_100000211301_100000748023 [1,1,0,0,0,0|1,0,1]=4 1772 B15R1.85 CCC(C)COCc1ccccc1SC 34a_100000699167_100000748023 [1,1,0,0,0,0|1,0,1]=4 1773 B15R1.85 CC[C@H](C)COCc1ccccc1OC 34a_100000211301_100009816398 [1,1,0,0,0,0|1,0,1]=4 1774 B15R1.85 CC[C@H](C)COCc1ccccc1OC 7a_100009816381_100000210004 [1,1,0,0,0,0|1,0,1]=4 1775 B15R1.85 CC[C@H](C)COCc1ccccc1SC 34a_100000699167_100009816398 [1,1,0,0,0,0|1,0,1]=4 1776 B15R1.85 CC[C@H](C)COCc1ccccc1SC 7a_100009816381_100000699184 [1,1,0,0,0,0|1,0,1]=4 1777 B15R1.85 CCc1ccccc1COCC(C)CC 34a_100011663872_100000748023 [1,1,0,0,0,0|1,0,1]=4 1778 B15R1.85 CCc1ccccc1COCC(C)CC 7a_100011663872_100000748023 [1,1,0,0,0,0|1,0,1]=4 1779 B15R1.85 CCc1ccccc1COC[C@@H](C)CC 34a_100011663872_100009816398 [1,1,0,0,0,0|1,0,1]=4 1780 B15R1.85 CCc1ccccc1COC[C@@H](C)CC 7a_100011663872_100009816398 [1,1,0,0,0,0|1,0,1]=4 1781 B15R1.85 CCc1ccccc1COC[C@@H](C)CO 34a_100011663872_100000059175 [1,1,0,0,0,0|1,0,1]=4 1782 B15R1.85 CCc1ccccc1COC[C@@H](C)CO 7a_100011663872_100000059175 [1,1,0,0,0,0|1,0,1]=4 1783 B15R1.85 COC(C)COCc1ccccc1SC 34a_100000690652_100000699184 [1,1,0,0,0,0|1,0,1]=4 1784 B15R1.85 COc1ccccc1COCC(C)CN 34a_100000744482_100000210004 [1,1,0,0,0,0|1,0,1]=4 1785 B15R1.85 COc1ccccc1COCC(C)OC 34a_100000690652_100000210004 [1,1,0,0,0,0|1,0,1]=4 1786 B15R1.85 COc1ccccc1COC[C@@H](C)CO 34a_100000211301_100000059175 [1,1,0,0,0,0|1,0,1]=4 1787 B15R1.85 CSc1ccccc1COCC(C)CN 34a_100000744482_100000699184 [1,1,0,0,0,0|1,0,1]=4 1788 B15R1.85 CSc1ccccc1COC[C@@H](C)CO 34a_100000699167_100000059175 [1,1,0,0,0,0|1,0,1]=4 1789 B15R1.87 COc1ccccc1COC(C)C(C)C 7a_100000748068_100000210004 [1,1,0,0,0,0|1,0,1]=4 1790 B15R1.87 CSc1ccccc1COC(C)C(C)C 7a_100000748068_100000699184 [1,1,0,0,0,0|1,0,1]=4 1791 B15R1.589 CC(C)CC=Cc1ccccc1CCN 271570a_100016259101_100000747383 [1,1,0,0,0,0|2,0,0]=4 1792 B15R1.589 CC(C)CC=Cc1ccccc1CCO 271570a_100016259101_100000731337 [1,1,0,0,0,0|2,0,0]=4 1793 B15R1.589 CC(C)CC=Cc1ccccc1CNN 271570a_100016259101_200016993956 [1,1,0,0,0,0|2,0,0]=4 1794 B15R1.589 CC(C)CCOc1ccccc1CN[13CH3] 34a_100000748829_200025704644 [1,1,0,0,0,0|2,0,0]=4 1795 B15R1.589 CCNc1ccccc1C=CCC(C)C 271570a_100016259101_114873767003 [1,1,0,0,0,0|1,0,0]=3 1796 B15R1.589 CCNc1ccccc1OCCC(C)C 34a_103624766699_100000210312 [1,1,0,0,0,0|2,0,0]=4 1797 B15R1.589 CCNc1ccccc1OCCC(C)C 7a_103624766699_100000210626 [1,1,0,0,0,0|2,0,0]=4 1798 B15R1.589 CCNc1ccccc1SCCC(C)C 62a_100000210312_114873767003 [1,1,0,0,0,0|2,0,0]=4 1799 B15R1.589 CCNc1ccccc1SCCC(C)C 62a_114873767003_100000210312 [1,1,0,0,0,0|2,0,0]=4 1800 B15R1.589 CCOc1ccccc1C=CCC(C)C 271570a_100016259101_100000230754 [1,1,0,0,0,0|2,0,0]=4 1801 B15R1.589 CCOc1ccccc1COCC(C)C 34a_100000708577_100000210624 [1,1,0,0,0,0|1,0,1]=4 1802 B15R1.589 CCOc1ccccc1COCC(C)C 7a_100000708577_100000210760 [1,1,0,0,0,0|1,0,1]=4 1803 B15R1.589 CCSc1ccccc1C=CCC(C)C 271570a_100016259101_100000230856 [1,1,0,0,0,0|2,0,0]=4 1804 B15R1.589 CNCc1ccccc1C=CCC(C)C 271570a_100016259101_100000184654 [1,1,0,0,0,0|1,0,0]=3 1805 B15R1.589 CNCc1ccccc1OCCC(C)C 207a_100102657272_200000188554 [1,1,0,0,0,0|2,0,0]=4 1806 B15R1.589 CNCc1ccccc1OCCC(C)C 270004a_106832991635_200000188554 [1,1,0,0,0,0|2,0,0]=4 1807 B15R1.589 CNCc1ccccc1OCCC(C)C 34a_100000748829_200000210301 [1,1,0,0,0,0|2,0,0]=4 1808 B15R1.589 CNCc1ccccc1OCCC(C)C 34a_100015189988_100000210312 [1,1,0,0,0,0|2,0,0]=4 1809 B15R1.589 CNCc1ccccc1SCCC(C)C 62a_100000184654_100000210312 [1,1,0,0,0,0|2,0,0]=4 1810 B15R1.589 CNCc1ccccc1SCCC(C)C 62a_100000210312_100000184654 [1,1,0,0,0,0|2,0,0]=4 1811 B15R1.589 CNCc1cccnc1C=CCC(C)C 271570a_100016259101_103496529121 [1,1,0,0,0,0|2,0,0]=4 1812 B15R1.589 COCc1ccccc1C=CCC(C)C 271570a_100016259101_100011493684 [1,1,0,0,0,0|2,0,0]=4 1813 B15R1.589 CSCc1ccccc1C=CCC(C)C 271570a_100016259101_100000148299 [1,1,0,0,0,0|2,0,0]=4 1814 B15R1.1145 CC(C)CC(=O)Nc1ccccc1N[13CH3] 34a_200011193550_200025704644 [1,1,0,0,0,0|2,0,0]=4 1815 B15R1.1145 CC(C)CC(=O)Nc1ccccc1N[13CH3] 7a_200011193550_200025704644 [1,1,0,0,0,0|2,0,0]=4 1816 B15R1.1145 CNc1ccccc1NC(=O)CC(C)C 34a_200011193550_200000210301 [1,1,0,0,0,0|2,0,0]=4 1817 B15R1.1145 CNc1ccccc1NC(=O)CC(C)C 7a_200011193550_200000210301 [1,1,0,0,0,0|2,0,0]=4 1818 B15R1.1145 CNc1ccccc1OC(C)CC(C)C 34a_100000033821_100000731052 [1,1,0,0,0,0|2,0,0]=4 1819 B15R1.1145 CNc1ccccc1SC(C)CC(C)C 62a_100000731052_100020606079 [1,1,0,0,0,0|2,0,0]=4 1820 B15R1.1145 CNc1ccccc1SC(C)CC(C)C 62a_100020606079_100000731052 [1,1,0,0,0,0|2,0,0]=4 1821 B15R1.1575 CCc1cccc(c1C=CCC(C)C)C 271570a_100016259101_100000036235 [1,1,0,0,0,0|2,0,0]=4 1822 B15R1.1575 COc1cccc(c1C=CCC(C)C)Br 271570a_100016259101_100010131421 [1,1,0,0,0,0|2,0,0]=4 1823 B15R1.1575 COc1cccc(c1C=CCC(C)C)F 271570a_100016259101_100000041735 [1,1,0,0,0,0|2,0,0]=4 1824 B15R1.1575 COc1cccc(c1C=CCC(C)C)N 271570a_100016259101_100000703447 [1,1,0,0,0,0|2,0,0]=4 1825 B15R1.1575 COc1cccc(c1C=CCC(C)C)O 271570a_100016259101_100010202623 [1,1,0,0,0,0|2,0,0]=4 1826 B15R1.1575 COc1cccc(c1COCC(C)C)Cl 34a_100000210257_100012349678 [1,1,0,0,0,0|1,0,1]=4 1827 B15R1.1575 COc1cccc(c1COCC(C)C)F 34a_100000210257_100011216731 [1,1,0,0,0,0|1,0,1]=4 1828 B15R1.1575 COc1cccc(c1COCC(C)C)F 34a_100011216733_100000210624 [1,1,0,0,0,0|1,0,1]=4 1829 B15R1.1575 COc1cccc(c1COCC(C)C)F 7a_100011216733_100000210760 [1,1,0,0,0,0|1,0,1]=4 1830 B15R1.3531 CCc1ccccc1COCC(C)(C)C 34a_100011663872_100011219605 [1,1,0,0,0,0|1,0,1]=4 1831 B15R1.3531 CCc1ccccc1COCC(C)(C)F 34a_100011663872_100011997219 [1,1,0,0,0,0|1,0,1]=4 1832 B15R1.3531 CCc1ccccc1COCC(C)(C)O 34a_100011663872_100000764493 [1,1,0,0,0,0|1,0,1]=4 1833 B15R1.3531 CCc1ccccc1COCC(C)(C)O 7a_100011663872_100000764493 [1,1,0,0,0,0|1,0,1]=4 1834 B15R1.3531 CNc1ccccc1OCCC(C)(C)C 34a_100000033821_100000755188 [1,1,0,0,0,0|2,0,0]=4 1835 B15R1.3531 CNc1ccccc1OCCC(C)(C)O 34a_100000033821_100000702414 [1,1,0,0,0,0|2,0,0]=4 1836 B15R1.3531 CNc1ccccc1SCCC(C)(C)C 62a_100000755188_100020606079 [1,1,0,0,0,0|2,0,0]=4 1837 B15R1.3531 CNc1ccccc1SCCC(C)(C)C 62a_100020606079_100000755188 [1,1,0,0,0,0|2,0,0]=4 1838 B15R1.3531 CNc1ccccc1SCCC(C)(C)O 62a_100000702414_100020606079 [1,1,0,0,0,0|2,0,0]=4 1839 B15R1.3531 CNc1ccccc1SCCC(C)(C)O 62a_100020606079_100000702414 [1,1,0,0,0,0|2,0,0]=4 1840 B15R1.3531 COc1ccccc1COCC(C)(C)C 34a_100000211301_100011219605 [1,1,0,0,0,0|1,0,1]=4 1841 B15R1.3531 COc1ccccc1COCC(C)(C)F 34a_100000211301_100011997219 [1,1,0,0,0,0|1,0,1]=4 1842 B15R1.3531 COc1ccccc1COCC(C)(C)F 34a_100000716592_100000210004 [1,1,0,0,0,0|1,0,1]=4 1843 B15R1.3531 COc1ccccc1COCC(C)(C)O 34a_100000211301_100000764493 [1,1,0,0,0,0|1,0,1]=4 1844 B15R1.3531 CSc1ccccc1COCC(C)(C)C 34a_100000699167_100011219605 [1,1,0,0,0,0|1,0,1]=4 1845 B15R1.3531 CSc1ccccc1COCC(C)(C)F 34a_100000699167_100011997219 [1,1,0,0,0,0|1,0,1]=4 1846 B15R1.3531 CSc1ccccc1COCC(C)(C)F 34a_100000716592_100000699184 [1,1,0,0,0,0|1,0,1]=4 1847 B15R1.3531 CSc1ccccc1COCC(C)(C)O 34a_100000699167_100000764493 [1,1,0,0,0,0|1,0,1]=4 1848 B15R1.4802 CC(C)CC=Cc1cccc(c1NN)F 271570a_100016259101_100016994982 [1,1,0,0,0,0|2,0,0]=4 1849 B15R1.4802 CNc1c(cccc1C=CCC(C)C)N 271570a_100016259101_100010510394 [1,1,0,0,0,0|1,0,0]=3 1850 B15R1.4802 CNc1c(cccc1SCCC(C)C)N 62a_100010510394_100000210312 [1,1,0,0,0,0|2,0,0]=4 1851 B15R1.4802 COc1c(cccc1C=CCC(C)C)Br 271570a_100016259101_100010146560 [1,1,0,0,0,0|2,0,0]=4 1852 B15R1.4802 COc1c(cccc1C=CCC(C)C)C 271570a_100016259101_100010141385 [1,1,0,0,0,0|2,0,0]=4 1853 B15R1.4802 COc1c(cccc1C=CCC(C)C)Cl 271570a_100016259101_100010147678 [1,1,0,0,0,0|2,0,0]=4 1854 B15R1.4802 COc1c(cccc1C=CCC(C)C)F 271570a_100016259101_100009816759 [1,1,0,0,0,0|2,0,0]=4 1855 B15R1.4802 COc1c(cccc1C=CCC(C)C)N 271570a_100016259101_100011935253 [1,1,0,0,0,0|2,0,0]=4 1856 B15R1.4802 COc1c(cccc1C=CCC(C)C)O 271570a_100016259101_100010234590 [1,1,0,0,0,0|2,0,0]=4 1857 B15R1.4802 COc1c(cccc1COCC(C)C)Br 34a_100000210257_100011470457 [1,1,0,0,0,0|1,0,1]=4 1858 B15R1.4802 COc1c(cccc1COCC(C)C)Br 34a_100000704359_100000210624 [1,1,0,0,0,0|1,0,1]=4 1859 B15R1.4802 COc1c(cccc1COCC(C)C)Br 7a_100000704359_100000210760 [1,1,0,0,0,0|1,0,1]=4 1860 B15R1.4802 COc1c(cccc1COCC(C)C)C 34a_100000210257_100012349798 [1,1,0,0,0,0|1,0,1]=4 1861 B15R1.4802 COc1c(cccc1COCC(C)C)C 34a_100012184769_100000210624 [1,1,0,0,0,0|1,0,1]=4 1862 B15R1.4802 COc1c(cccc1COCC(C)C)C 7a_100012184769_100000210760 [1,1,0,0,0,0|1,0,1]=4 1863 B15R1.4802 COc1c(cccc1COCC(C)C)F 34a_100011830279_100000210624 [1,1,0,0,0,0|1,0,1]=4 1864 B15R1.4802 COc1c(cccc1COCC(C)C)F 7a_100011830279_100000210760 [1,1,0,0,0,0|1,0,1]=4 1865 B15R1.4802 CSc1c(cccc1C=CCC(C)C)F 271570a_100016259101_200010709249 [1,1,0,0,0,0|2,0,0]=4 1866 B15R1.8882 CC(=O)c1ccccc1C=CCC(C)C 271570a_100016259101_100000751169 [1,1,0,0,0,0|2,0,0]=4 1867 B15R1.8882 CC(C)CC=Cc1ccccc1C(C)C 271570a_100016259101_100011218076 [1,1,0,0,0,0|2,0,0]=4 1868 B15R1.8882 CC(C)CC=Cc1ccccc1C(C)N 271570a_100016259101_100000181357 [1,1,0,0,0,0|2,0,0]=4 1869 B15R1.8882 CC(C)CC=Cc1ccccc1C(C)O 271570a_100016259101_100000702211 [1,1,0,0,0,0|2,0,0]=4 1870 B15R1.8882 CC(C)CC=Cc1ccccc1N(C)C 271570a_100016259101_100011290883 [1,1,0,0,0,0|1,0,0]=3 1871 B15R1.8882 CC(C)CC=Cc1ccccc1S(=O)C 271570a_100016259101_100000734199 [1,1,0,0,0,0|2,0,0]=4 1872 B15R1.8882 CC(C)CC=Cc1cccnc1N(C)C 271570a_100016259101_100011465059 [1,1,0,0,0,0|2,0,0]=4 1873 B15R1.8882 CC(C)CC=Cc1cnccc1N(C)C 271570a_100016259101_100012355995 [1,1,0,0,0,0|2,0,0]=4 1874 B15R1.8882 CC(C)CCSc1ccccc1N(C)C 62a_100000210312_100011290883 [1,1,0,0,0,0|2,0,0]=4 1875 B15R1.8882 CC(C)CCSc1ccccc1N(C)C 62a_100011290883_100000210312 [1,1,0,0,0,0|2,0,0]=4 1876 B15R1.8882 CC(C)CNCc1ccccc1N(C)C 207a_100000210953_100000750901 [1,1,0,0,0,0|1,0,1]=4 1877 B15R1.8882 CC(C)CNCc1ccccc1N(C)C 270004a_100000210953_100000750901 [1,1,0,0,0,0|1,0,1]=4 1878 B15R1.8882 CC(C)CNCc1ccccc1N(C)C 270004a_100000748089_100000210432 [1,1,0,0,0,0|1,0,1]=4 1879 B15R1.8882 CC(C)NN=Cc1ccccc1N(C)C 4a_100000741168_100000750901 [1,1,0,0,0,0|2,0,0]=4 1880 B15R1.12845 CCc1ccc(cc1COCC(C)C)Br 34a_100010766240_100000210624 [1,1,0,0,0,0|1,0,1]=4 1881 B15R1.12845 CCc1ccc(cc1COCC(C)C)Br 7a_100010766240_100000210760 [1,1,0,0,0,0|1,0,1]=4 1882 B15R1.12845 CNc1ccc(cc1C=CCC(C)C)C 271570a_100016259101_100000221369 [1,1,0,0,0,0|1,0,0]=3 1883 B15R1.12845 CNc1ccc(cc1C=CCC(C)C)F 271570a_100016259101_100011246292 [1,1,0,0,0,0|1,0,0]=3 1884 B15R1.12845 CNc1ccc(cc1SCCC(C)C)C 62a_100000210312_100000221369 [1,1,0,0,0,0|2,0,0]=4 1885 B15R1.12845 CNc1ccc(cc1SCCC(C)C)C 62a_100000221369_100000210312 [1,1,0,0,0,0|2,0,0]=4 1886 B15R1.12845 CNc1ccc(cc1SCCC(C)C)F 62a_100000210312_100011246292 [1,1,0,0,0,0|2,0,0]=4 1887 B15R1.12845 CNc1ccc(cc1SCCC(C)C)F 62a_100011246292_100000210312 [1,1,0,0,0,0|2,0,0]=4 1888 B15R1.12845 COc1ccc(cc1C=CCC(C)C)Br 271570a_100016259101_100012351588 [1,1,0,0,0,0|2,0,0]=4 1889 B15R1.12845 COc1ccc(cc1C=CCC(C)C)C 271570a_100016259101_100000186399 [1,1,0,0,0,0|2,0,0]=4 1890 B15R1.12845 COc1ccc(cc1C=CCC(C)C)Cl 271570a_100016259101_100011215930 [1,1,0,0,0,0|2,0,0]=4 1891 B15R1.12845 COc1ccc(cc1C=CCC(C)C)F 271570a_100016259101_100000171694 [1,1,0,0,0,0|2,0,0]=4 1892 B15R1.12845 COc1ccc(cc1C=CCC(C)C)N 271570a_100016259101_100000187427 [1,1,0,0,0,0|2,0,0]=4 1893 B15R1.12845 COc1ccc(cc1C=CCC(C)C)O 271570a_100016259101_100010084122 [1,1,0,0,0,0|2,0,0]=4 1894 B15R1.12845 COc1ccc(cc1COCC(C)C)Br 34a_100000204679_100000210624 [1,1,0,0,0,0|1,0,1]=4 1895 B15R1.12845 COc1ccc(cc1COCC(C)C)Br 34a_100000210257_100000204665 [1,1,0,0,0,0|1,0,1]=4 1896 B15R1.12845 COc1ccc(cc1COCC(C)C)Br 7a_100000204679_100000210760 [1,1,0,0,0,0|1,0,1]=4 1897 B15R1.12845 COc1ccc(cc1COCC(C)C)C 34a_100000210257_100000199068 [1,1,0,0,0,0|1,0,1]=4 1898 B15R1.12845 COc1ccc(cc1COCC(C)C)C 34a_200000246444_100000210624 [1,1,0,0,0,0|1,0,1]=4 1899 B15R1.12845 COc1ccc(cc1COCC(C)C)C 7a_200000246444_100000210760 [1,1,0,0,0,0|1,0,1]=4 1900 B15R1.12845 COc1ccc(cc1COCC(C)C)Cl 34a_100000210257_100000209806 [1,1,0,0,0,0|1,0,1]=4 1901 B15R1.12845 COc1ccc(cc1COCC(C)C)F 34a_100000210257_100011830354 [1,1,0,0,0,0|1,0,1]=4 1902 B15R1.12845 COc1ccc(cc1COCC(C)C)F 34a_100011266440_100000210624 [1,1,0,0,0,0|1,0,1]=4 1903 B15R1.12845 COc1ccc(cc1COCC(C)C)F 7a_100011266440_100000210760 [1,1,0,0,0,0|1,0,1]=4 1904 B15R1.12845 COc1ccc(cc1COCC(C)C)I 34a_200137411115_100000210624 [1,1,0,0,0,0|1,0,1]=4 1905 B15R1.12845 COc1ccc(cc1COCC(C)C)I 7a_200137411115_100000210760 [1,1,0,0,0,0|1,0,1]=4 1906 B15R1.12845 CSc1ccc(cc1C=CCC(C)C)C 271570a_100016259101_200010201864 [1,1,0,0,0,0|2,0,0]=4 1907 B15R1.12845 CSc1ccc(cc1C=CCC(C)C)F 271570a_100016259101_100009817003 [1,1,0,0,0,0|2,0,0]=4 1908 B15R1.12845 Cc1ccc(c(c1)C=CCC(C)C)NN 271570a_100016259101_100016996181 [1,1,0,0,0,0|2,0,0]=4 1909 B15R1.13063 CC(C)CC=Cc1ccc(cc1NN)F 271570a_100016259101_100012362518 [1,1,0,0,0,0|2,0,0]=4 1910 B15R1.13063 CCc1cc(ccc1C=CCC(C)C)Br 271570a_100016259101_100011216195 [1,1,0,0,0,0|2,0,0]=4 1911 B15R1.13063 CCc1cc(ccc1C=CCC(C)C)N 271570a_100016259101_100010109747 [1,1,0,0,0,0|2,0,0]=4 1912 B15R1.13063 CNc1cc(ccc1C=CCC(C)C)F 271570a_100016259101_100020633008 [1,1,0,0,0,0|1,0,0]=3 1913 B15R1.13063 CNc1cc(ccc1SCCC(C)C)F 62a_100000210312_100020633008 [1,1,0,0,0,0|2,0,0]=4 1914 B15R1.13063 CNc1cc(ccc1SCCC(C)C)F 62a_100020633008_100000210312 [1,1,0,0,0,0|2,0,0]=4 1915 B15R1.13063 COc1cc(ccc1C=CCC(C)C)Br 271570a_100016259101_100010245111 [1,1,0,0,0,0|2,0,0]=4 1916 B15R1.13063 COc1cc(ccc1C=CCC(C)C)C 271570a_100016259101_100010200004 [1,1,0,0,0,0|2,0,0]=4 1917 B15R1.13063 COc1cc(ccc1C=CCC(C)C)Cl 271570a_100016259101_100000050115 [1,1,0,0,0,0|2,0,0]=4 1918 B15R1.13063 COc1cc(ccc1C=CCC(C)C)F 271570a_100016259101_100000757151 [1,1,0,0,0,0|2,0,0]=4 1919 B15R1.13063 COc1cc(ccc1C=CCC(C)C)N 271570a_100016259101_100000765947 [1,1,0,0,0,0|2,0,0]=4 1920 B15R1.13063 COc1cc(ccc1C=CCC(C)C)O 271570a_100016259101_100011827694 [1,1,0,0,0,0|2,0,0]=4 1921 B15R1.13063 COc1cc(ccc1COCC(C)C)Br 34a_100000210257_100012359436 [1,1,0,0,0,0|1,0,1]=4 1922 B15R1.13063 COc1cc(ccc1COCC(C)C)Br 34a_100011277633_100000210624 [1,1,0,0,0,0|1,0,1]=4 1923 B15R1.13063 COc1cc(ccc1COCC(C)C)Br 7a_100011277633_100000210760 [1,1,0,0,0,0|1,0,1]=4 1924 B15R1.13063 COc1cc(ccc1COCC(C)C)C 34a_200012017176_100000210624 [1,1,0,0,0,0|1,0,1]=4 1925 B15R1.13063 COc1cc(ccc1COCC(C)C)C 7a_200012017176_100000210760 [1,1,0,0,0,0|1,0,1]=4 1926 B15R1.13063 COc1cc(ccc1COCC(C)C)Cl 34a_200011215853_100000210624 [1,1,0,0,0,0|1,0,1]=4 1927 B15R1.13063 COc1cc(ccc1COCC(C)C)Cl 7a_200011215853_100000210760 [1,1,0,0,0,0|1,0,1]=4 1928 B15R1.13063 COc1cc(ccc1COCC(C)C)F 34a_100000117171_100000210624 [1,1,0,0,0,0|1,0,1]=4 1929 B15R1.13063 COc1cc(ccc1COCC(C)C)F 34a_100000210257_200010171551 [1,1,0,0,0,0|1,0,1]=4 1930 B15R1.13063 COc1cc(ccc1COCC(C)C)F 7a_100000117171_100000210760 [1,1,0,0,0,0|1,0,1]=4 1931 B15R1.13063 COc1cc(ccc1COCC(C)C)I 34a_100010233823_100000210624 [1,1,0,0,0,0|1,0,1]=4 1932 B15R1.13063 COc1cc(ccc1COCC(C)C)I 7a_100010233823_100000210760 [1,1,0,0,0,0|1,0,1]=4 1933 B15R1.13063 COc1cc(ccc1COCC(C)C)N 34a_100012183141_100000210624 [1,1,0,0,0,0|1,0,1]=4 1934 B15R1.13063 CSc1cc(ccc1C=CCC(C)C)C 271570a_100016259101_200010709736 [1,1,0,0,0,0|2,0,0]=4 1935 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210312 [1,1,0,0,0,0|2,0,0]=4 1936 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210312 [1,1,0,0,0,0|2,0,0]=4 1937 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210312 [1,1,0,0,0,0|2,0,0]=4 1938 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210312 [1,1,0,0,0,0|2,0,0]=4 1939 B15R1.124 CC(C)CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210312 [1,1,0,0,0,0|2,0,0]=4 1940 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210312 [1,1,0,0,0,0|2,0,0]=4 1941 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210312 [1,1,0,0,0,0|2,0,0]=4 1942 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210312 [1,1,0,0,0,0|2,0,0]=4 1943 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210312 [1,1,0,0,0,0|2,0,0]=4 1944 B15R1.124 CC(C)CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210312 [1,1,0,0,0,0|2,0,0]=4 1945 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210312 [1,1,0,0,0,0|2,0,0]=4 1946 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210312 [1,1,0,0,0,0|2,0,0]=4 1947 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210312 [1,1,0,0,0,0|2,0,0]=4 1948 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210312 [1,1,0,0,0,0|2,0,0]=4 1949 B15R1.124 CC(C)CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210312 [1,1,0,0,0,0|2,0,0]=4 1950 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210312 [1,1,0,0,0,0|2,0,0]=4 1951 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210312 [1,1,0,0,0,0|2,0,0]=4 1952 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210312 [1,1,0,0,0,0|2,0,0]=4 1953 B15R1.124 CC(C)CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210312 [1,1,0,0,0,0|2,0,0]=4 1954 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210312 [1,1,0,0,0,0|2,0,0]=4 1955 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210312 [1,1,0,0,0,0|2,0,0]=4 1956 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210312 [1,1,0,0,0,0|2,0,0]=4 1957 B15R1.124 CC(C)CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210312 [1,1,0,0,0,0|2,0,0]=4 1958 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 11a_100000210953_100012360534 [1,1,0,0,0,0|2,0,0]=4 1959 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 1626a_100000210953_100012360534 [1,1,0,0,0,0|2,0,0]=4 1960 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 240690a_100000210953_100012360534 [1,1,0,0,0,0|2,0,0]=4 1961 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Br 527a_100000210953_100012360534 [1,1,0,0,0,0|2,0,0]=4 1962 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 11a_100000210953_100012339722 [1,1,0,0,0,0|2,0,0]=4 1963 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 1626a_100000210953_100012339722 [1,1,0,0,0,0|2,0,0]=4 1964 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 240690a_100000210953_100012339722 [1,1,0,0,0,0|2,0,0]=4 1965 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)Cl 527a_100000210953_100012339722 [1,1,0,0,0,0|2,0,0]=4 1966 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 11a_100000210953_100011217547 [1,1,0,0,0,0|2,0,0]=4 1967 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 1626a_100000210953_100011217547 [1,1,0,0,0,0|2,0,0]=4 1968 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 240690a_100000210953_100011217547 [1,1,0,0,0,0|2,0,0]=4 1969 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)F 527a_100000210953_100011217547 [1,1,0,0,0,0|2,0,0]=4 1970 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 11a_100000210953_100010232522 [1,1,0,0,0,0|2,0,0]=4 1971 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 1626a_100000210953_100010232522 [1,1,0,0,0,0|2,0,0]=4 1972 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 240690a_100000210953_100010232522 [1,1,0,0,0,0|2,0,0]=4 1973 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)I 527a_100000210953_100010232522 [1,1,0,0,0,0|2,0,0]=4 1974 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)O 240690a_100000210953_100010230362 [1,1,0,0,0,0|2,0,0]=4 1975 B15R1.124 CC(C)CNC(=O)c1cccc(c1Br)O 527a_100000210953_100010230362 [1,1,0,0,0,0|2,0,0]=4 1976 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 11a_100000210953_100000760540 [1,1,0,0,0,0|2,0,0]=4 1977 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 1626a_100000210953_100000760540 [1,1,0,0,0,0|2,0,0]=4 1978 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 240690a_100000210953_100000760540 [1,1,0,0,0,0|2,0,0]=4 1979 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Br 527a_100000210953_100000760540 [1,1,0,0,0,0|2,0,0]=4 1980 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 11a_100000210953_100000183631 [1,1,0,0,0,0|2,0,0]=4 1981 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 1626a_100000210953_100000183631 [1,1,0,0,0,0|2,0,0]=4 1982 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 240690a_100000210953_100000183631 [1,1,0,0,0,0|2,0,0]=4 1983 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)Cl 527a_100000210953_100000183631 [1,1,0,0,0,0|2,0,0]=4 1984 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 11a_100000210953_100000759904 [1,1,0,0,0,0|2,0,0]=4 1985 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 1626a_100000210953_100000759904 [1,1,0,0,0,0|2,0,0]=4 1986 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 240690a_100000210953_100000759904 [1,1,0,0,0,0|2,0,0]=4 1987 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)F 527a_100000210953_100000759904 [1,1,0,0,0,0|2,0,0]=4 1988 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 11a_100000210953_100010176783 [1,1,0,0,0,0|2,0,0]=4 1989 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 1626a_100000210953_100010176783 [1,1,0,0,0,0|2,0,0]=4 1990 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 240690a_100000210953_100010176783 [1,1,0,0,0,0|2,0,0]=4 1991 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)I 527a_100000210953_100010176783 [1,1,0,0,0,0|2,0,0]=4 1992 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)O 240690a_100000210953_100000092362 [1,1,0,0,0,0|2,0,0]=4 1993 B15R1.124 CC(C)CNC(=O)c1cccc(c1Cl)O 527a_100000210953_100000092362 [1,1,0,0,0,0|2,0,0]=4 1994 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 11a_100000210953_100000756403 [1,1,0,0,0,0|2,0,0]=4 1995 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 1626a_100000210953_100000756403 [1,1,0,0,0,0|2,0,0]=4 1996 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 240690a_100000210953_100000756403 [1,1,0,0,0,0|2,0,0]=4 1997 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Br 527a_100000210953_100000756403 [1,1,0,0,0,0|2,0,0]=4 1998 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 11a_100000210953_100000688816 [1,1,0,0,0,0|2,0,0]=4 1999 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 1626a_100000210953_100000688816 [1,1,0,0,0,0|2,0,0]=4 2000 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 240690a_100000210953_100000688816 [1,1,0,0,0,0|2,0,0]=4 2001 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)Cl 527a_100000210953_100000688816 [1,1,0,0,0,0|2,0,0]=4 2002 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 11a_100000210953_100000748134 [1,1,0,0,0,0|2,0,0]=4 2003 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 1626a_100000210953_100000748134 [1,1,0,0,0,0|2,0,0]=4 2004 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 240690a_100000210953_100000748134 [1,1,0,0,0,0|2,0,0]=4 2005 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)F 527a_100000210953_100000748134 [1,1,0,0,0,0|2,0,0]=4 2006 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 11a_100000210953_100010185205 [1,1,0,0,0,0|2,0,0]=4 2007 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 1626a_100000210953_100010185205 [1,1,0,0,0,0|2,0,0]=4 2008 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 240690a_100000210953_100010185205 [1,1,0,0,0,0|2,0,0]=4 2009 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)I 527a_100000210953_100010185205 [1,1,0,0,0,0|2,0,0]=4 2010 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)O 240690a_100000210953_100000037433 [1,1,0,0,0,0|2,0,0]=4 2011 B15R1.124 CC(C)CNC(=O)c1cccc(c1F)O 527a_100000210953_100000037433 [1,1,0,0,0,0|2,0,0]=4 2012 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 11a_100000210953_100000688019 [1,1,0,0,0,0|2,0,0]=4 2013 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 1626a_100000210953_100000688019 [1,1,0,0,0,0|2,0,0]=4 2014 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 240690a_100000210953_100000688019 [1,1,0,0,0,0|2,0,0]=4 2015 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Br 527a_100000210953_100000688019 [1,1,0,0,0,0|2,0,0]=4 2016 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 11a_100000210953_100010176784 [1,1,0,0,0,0|2,0,0]=4 2017 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 1626a_100000210953_100010176784 [1,1,0,0,0,0|2,0,0]=4 2018 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 240690a_100000210953_100010176784 [1,1,0,0,0,0|2,0,0]=4 2019 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)Cl 527a_100000210953_100010176784 [1,1,0,0,0,0|2,0,0]=4 2020 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 11a_100000210953_100000690930 [1,1,0,0,0,0|2,0,0]=4 2021 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 1626a_100000210953_100000690930 [1,1,0,0,0,0|2,0,0]=4 2022 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 240690a_100000210953_100000690930 [1,1,0,0,0,0|2,0,0]=4 2023 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)F 527a_100000210953_100000690930 [1,1,0,0,0,0|2,0,0]=4 2024 B15R1.124 CC(C)CNC(=O)c1cccc(c1I)O 527a_100000210953_100010084636 [1,1,0,0,0,0|2,0,0]=4 2025 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Br 240690a_100000210953_100000752940 [1,1,0,0,0,0|2,0,0]=4 2026 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Br 527a_100000210953_100000752940 [1,1,0,0,0,0|2,0,0]=4 2027 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Cl 240690a_100000210953_100000742801 [1,1,0,0,0,0|2,0,0]=4 2028 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)Cl 527a_100000210953_100000742801 [1,1,0,0,0,0|2,0,0]=4 2029 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)F 240690a_100000210953_100011217230 [1,1,0,0,0,0|2,0,0]=4 2030 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)F 527a_100000210953_100011217230 [1,1,0,0,0,0|2,0,0]=4 2031 B15R1.124 CC(C)CNC(=O)c1cccc(c1O)O 527a_100000210953_100000690420 [1,1,0,0,0,0|2,0,0]=4 2032 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)Br 1458a_100000760464_100000210312 [1,1,0,0,0,0|1,0,0]=3 2033 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)Cl 1458a_100000690184_100000210312 [1,1,0,0,0,0|1,0,0]=3 2034 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)F 1458a_100011218272_100000210312 [1,1,0,0,0,0|1,0,0]=3 2035 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)I 1458a_100000751865_100000210312 [1,1,0,0,0,0|1,0,0]=3 2036 B15R1.124 Cc1c(cccc1C(=O)CCC(C)C)O 1458a_100000766327_100000210312 [1,1,0,0,0,0|1,0,0]=3 2037 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Br 1458a_100000760464_100012276601 [1,1,0,0,0,0|2,0,0]=4 2038 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)Cl 1458a_100000690184_100012276601 [1,1,0,0,0,0|2,0,0]=4 2039 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)F 1458a_100011218272_100012276601 [1,1,0,0,0,0|2,0,0]=4 2040 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)I 1458a_100000751865_100012276601 [1,1,0,0,0,0|2,0,0]=4 2041 B15R1.124 Cc1c(cccc1C(=O)CCC(C)O)O 1458a_100000766327_100012276601 [1,1,0,0,0,0|2,0,0]=4 2042 B15R1.124 Cc1c(cccc1C(=O)CNC(C)C)I 34a_100138425928_100160470822 [1,1,0,0,0,0|2,0,0]=4 2043 B15R1.124 Cc1c(cccc1C(=O)COC(C)C)I 34a_100000212225_100160470822 [1,1,0,0,0,0|2,0,0]=4 2044 B15R1.124 Cc1c(cccc1C(=O)CSC(C)C)I 62a_100000210206_100160470822 [1,1,0,0,0,0|2,0,0]=4 2045 B15R1.124 Cc1c(cccc1C(=O)CSC(C)C)I 62a_100160470822_100000210206 [1,1,0,0,0,0|2,0,0]=4 2046 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 11a_100000210953_100000760464 [1,1,0,0,0,0|1,0,0]=3 2047 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000760464 [1,1,0,0,0,0|1,0,0]=3 2048 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000760464 [1,1,0,0,0,0|1,0,0]=3 2049 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Br 527a_100000210953_100000760464 [1,1,0,0,0,0|1,0,0]=3 2050 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000690184 [1,1,0,0,0,0|1,0,0]=3 2051 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000690184 [1,1,0,0,0,0|1,0,0]=3 2052 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000690184 [1,1,0,0,0,0|1,0,0]=3 2053 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000690184 [1,1,0,0,0,0|1,0,0]=3 2054 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 11a_100000210953_100011218272 [1,1,0,0,0,0|1,0,0]=3 2055 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 1626a_100000210953_100011218272 [1,1,0,0,0,0|1,0,0]=3 2056 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 240690a_100000210953_100011218272 [1,1,0,0,0,0|1,0,0]=3 2057 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)F 527a_100000210953_100011218272 [1,1,0,0,0,0|1,0,0]=3 2058 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 11a_100000210953_100000751865 [1,1,0,0,0,0|1,0,0]=3 2059 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 1626a_100000210953_100000751865 [1,1,0,0,0,0|1,0,0]=3 2060 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 240690a_100000210953_100000751865 [1,1,0,0,0,0|1,0,0]=3 2061 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)I 527a_100000210953_100000751865 [1,1,0,0,0,0|1,0,0]=3 2062 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)O 240690a_100000210953_100000766327 [1,1,0,0,0,0|1,0,0]=3 2063 B15R1.124 Cc1c(cccc1C(=O)NCC(C)C)O 527a_100000210953_100000766327 [1,1,0,0,0,0|1,0,0]=3 2064 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 11a_100000210904_100000760464 [1,1,0,0,0,0|2,0,0]=4 2065 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000760464 [1,1,0,0,0,0|2,0,0]=4 2066 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Br 527a_100000210904_100000760464 [1,1,0,0,0,0|2,0,0]=4 2067 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000690184 [1,1,0,0,0,0|2,0,0]=4 2068 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000690184 [1,1,0,0,0,0|2,0,0]=4 2069 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000690184 [1,1,0,0,0,0|2,0,0]=4 2070 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 11a_100000210904_100011218272 [1,1,0,0,0,0|2,0,0]=4 2071 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 240690a_100000210904_100011218272 [1,1,0,0,0,0|2,0,0]=4 2072 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)F 527a_100000210904_100011218272 [1,1,0,0,0,0|2,0,0]=4 2073 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 11a_100000210904_100000751865 [1,1,0,0,0,0|2,0,0]=4 2074 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 240690a_100000210904_100000751865 [1,1,0,0,0,0|2,0,0]=4 2075 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)I 527a_100000210904_100000751865 [1,1,0,0,0,0|2,0,0]=4 2076 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)O 240690a_100000210904_100000766327 [1,1,0,0,0,0|2,0,0]=4 2077 B15R1.124 Cc1c(cccc1C(=O)NCC(C)O)O 527a_100000210904_100000766327 [1,1,0,0,0,0|2,0,0]=4 2078 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)Br 22a_100000741168_100000760464 [1,1,0,0,0,0|2,0,0]=4 2079 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000690184 [1,1,0,0,0,0|2,0,0]=4 2080 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)F 22a_100000741168_100011218272 [1,1,0,0,0,0|2,0,0]=4 2081 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)I 22a_100000741168_100000751865 [1,1,0,0,0,0|2,0,0]=4 2082 B15R1.124 Cc1c(cccc1C(=O)NNC(C)C)O 22a_100000741168_100000766327 [1,1,0,0,0,0|2,0,0]=4 2083 B15R1.124 Cc1cccc(c1Br)C(=O)CCC(C)C 1458a_100000692419_100000210312 [1,1,0,0,0,0|2,0,0]=4 2084 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 11a_100000210953_100000692419 [1,1,0,0,0,0|2,0,0]=4 2085 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 1626a_100000210953_100000692419 [1,1,0,0,0,0|2,0,0]=4 2086 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 240690a_100000210953_100000692419 [1,1,0,0,0,0|2,0,0]=4 2087 B15R1.124 Cc1cccc(c1Br)C(=O)NCC(C)C 527a_100000210953_100000692419 [1,1,0,0,0,0|2,0,0]=4 2088 B15R1.124 Cc1cccc(c1C)C(=O)CCC(C)C 1458a_100000183679_100000210312 [1,1,0,0,0,0|1,0,0]=3 2089 B15R1.124 Cc1cccc(c1C)C(=O)CCC(C)O 1458a_100000183679_100012276601 [1,1,0,0,0,0|2,0,0]=4 2090 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 11a_100000210953_100000183679 [1,1,0,0,0,0|1,0,0]=3 2091 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 1626a_100000210953_100000183679 [1,1,0,0,0,0|1,0,0]=3 2092 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 240690a_100000210953_100000183679 [1,1,0,0,0,0|1,0,0]=3 2093 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)C 527a_100000210953_100000183679 [1,1,0,0,0,0|1,0,0]=3 2094 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 11a_100000210904_100000183679 [1,1,0,0,0,0|2,0,0]=4 2095 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 240690a_100000210904_100000183679 [1,1,0,0,0,0|2,0,0]=4 2096 B15R1.124 Cc1cccc(c1C)C(=O)NCC(C)O 527a_100000210904_100000183679 [1,1,0,0,0,0|2,0,0]=4 2097 B15R1.124 Cc1cccc(c1C)C(=O)NNC(C)C 22a_100000741168_100000183679 [1,1,0,0,0,0|2,0,0]=4 2098 B15R1.124 Cc1cccc(c1C)C(C)OCC(C)C 34a_100000210257_100012183177 [1,1,0,0,0,0|1,0,1]=4 2099 B15R1.124 Cc1cccc(c1Cl)C(=O)CCC(C)C 1458a_100000693142_100000210312 [1,1,0,0,0,0|2,0,0]=4 2100 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 11a_100000210953_100000693142 [1,1,0,0,0,0|2,0,0]=4 2101 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 1626a_100000210953_100000693142 [1,1,0,0,0,0|2,0,0]=4 2102 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 240690a_100000210953_100000693142 [1,1,0,0,0,0|2,0,0]=4 2103 B15R1.124 Cc1cccc(c1Cl)C(=O)NCC(C)C 527a_100000210953_100000693142 [1,1,0,0,0,0|2,0,0]=4 2104 B15R1.124 Cc1cccc(c1F)C(=O)CCC(C)C 1458a_100000766181_100000210312 [1,1,0,0,0,0|2,0,0]=4 2105 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 11a_100000210953_100000766181 [1,1,0,0,0,0|2,0,0]=4 2106 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 1626a_100000210953_100000766181 [1,1,0,0,0,0|2,0,0]=4 2107 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 240690a_100000210953_100000766181 [1,1,0,0,0,0|2,0,0]=4 2108 B15R1.124 Cc1cccc(c1F)C(=O)NCC(C)C 527a_100000210953_100000766181 [1,1,0,0,0,0|2,0,0]=4 2109 B15R1.124 Cc1cccc(c1I)C(=O)CCC(C)C 1458a_100000739377_100000210312 [1,1,0,0,0,0|2,0,0]=4 2110 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 11a_100000210953_100000739377 [1,1,0,0,0,0|2,0,0]=4 2111 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 1626a_100000210953_100000739377 [1,1,0,0,0,0|2,0,0]=4 2112 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 240690a_100000210953_100000739377 [1,1,0,0,0,0|2,0,0]=4 2113 B15R1.124 Cc1cccc(c1I)C(=O)NCC(C)C 527a_100000210953_100000739377 [1,1,0,0,0,0|2,0,0]=4 2114 B15R1.124 Cc1cccc(c1O)C(=O)CCC(C)C 1458a_100000183896_100000210312 [1,1,0,0,0,0|2,0,0]=4 2115 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)C 240690a_100000210953_100000183896 [1,1,0,0,0,0|2,0,0]=4 2116 B15R1.124 Cc1cccc(c1O)C(=O)NCC(C)C 527a_100000210953_100000183896 [1,1,0,0,0,0|2,0,0]=4 2117 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1Br 1458a_100000188424_100000731052 [1,1,0,0,0,0|2,0,0]=4 2118 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000731052 [1,1,0,0,0,0|2,0,0]=4 2119 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1F 1458a_100000188656_100000731052 [1,1,0,0,0,0|2,0,0]=4 2120 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1I 1458a_100000187884_100000731052 [1,1,0,0,0,0|2,0,0]=4 2121 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1O 1458a_100015234032_100000731052 [1,1,0,0,0,0|2,0,0]=4 2122 B15R1.5792 CC(C)CC(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000731052 [1,1,0,0,0,0|2,0,0]=4 2123 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 11a_100000747067_100000188424 [1,1,0,0,0,0|2,0,0]=4 2124 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 1626a_100000747067_100000188424 [1,1,0,0,0,0|2,0,0]=4 2125 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 240690a_100000747067_100000188424 [1,1,0,0,0,0|2,0,0]=4 2126 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Br 527a_100000747067_100000188424 [1,1,0,0,0,0|2,0,0]=4 2127 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 11a_100000747067_100000185844 [1,1,0,0,0,0|2,0,0]=4 2128 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 1626a_100000747067_100000185844 [1,1,0,0,0,0|2,0,0]=4 2129 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 240690a_100000747067_100000185844 [1,1,0,0,0,0|2,0,0]=4 2130 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1Cl 527a_100000747067_100000185844 [1,1,0,0,0,0|2,0,0]=4 2131 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 11a_100000747067_100000188656 [1,1,0,0,0,0|2,0,0]=4 2132 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 1626a_100000747067_100000188656 [1,1,0,0,0,0|2,0,0]=4 2133 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 240690a_100000747067_100000188656 [1,1,0,0,0,0|2,0,0]=4 2134 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1F 527a_100000747067_100000188656 [1,1,0,0,0,0|2,0,0]=4 2135 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 11a_100000747067_100000187884 [1,1,0,0,0,0|2,0,0]=4 2136 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 1626a_100000747067_100000187884 [1,1,0,0,0,0|2,0,0]=4 2137 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 240690a_100000747067_100000187884 [1,1,0,0,0,0|2,0,0]=4 2138 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1I 527a_100000747067_100000187884 [1,1,0,0,0,0|2,0,0]=4 2139 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1O 240690a_100000747067_100015234032 [1,1,0,0,0,0|2,0,0]=4 2140 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 1626a_100000747067_100009911694 [1,1,0,0,0,0|2,0,0]=4 2141 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 240690a_100000747067_100009911694 [1,1,0,0,0,0|2,0,0]=4 2142 B15R1.5792 CC(C)CN(C)C(=O)c1ccccc1[O-] 527a_100000747067_100009911694 [1,1,0,0,0,0|2,0,0]=4 2143 B15R1.5792 Cc1ccccc1C(=O)C(C)CC(C)C 1458a_100000212026_100000731052 [1,1,0,0,0,0|1,0,0]=3 2144 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000212026 [1,1,0,0,0,0|1,0,0]=3 2145 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000212026 [1,1,0,0,0,0|1,0,0]=3 2146 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000212026 [1,1,0,0,0,0|1,0,0]=3 2147 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000212026 [1,1,0,0,0,0|1,0,0]=3 2148 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)O 240690a_100000227577_100000212026 [1,1,0,0,0,0|2,0,0]=4 2149 B15R1.5792 Cc1ccccc1C(=O)N(C)CC(C)O 527a_100000227577_100000212026 [1,1,0,0,0,0|2,0,0]=4 2150 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 11a_100000211541_100000188424 [1,1,0,0,0,0|2,0,0]=4 2151 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 1626a_100000211541_100000188424 [1,1,0,0,0,0|2,0,0]=4 2152 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 240690a_100000211541_100000188424 [1,1,0,0,0,0|2,0,0]=4 2153 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Br 527a_100000211541_100000188424 [1,1,0,0,0,0|2,0,0]=4 2154 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 11a_100000211541_100000185844 [1,1,0,0,0,0|2,0,0]=4 2155 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 1626a_100000211541_100000185844 [1,1,0,0,0,0|2,0,0]=4 2156 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 240690a_100000211541_100000185844 [1,1,0,0,0,0|2,0,0]=4 2157 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1Cl 527a_100000211541_100000185844 [1,1,0,0,0,0|2,0,0]=4 2158 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 11a_100000211541_100000188656 [1,1,0,0,0,0|2,0,0]=4 2159 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 1626a_100000211541_100000188656 [1,1,0,0,0,0|2,0,0]=4 2160 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 240690a_100000211541_100000188656 [1,1,0,0,0,0|2,0,0]=4 2161 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1F 527a_100000211541_100000188656 [1,1,0,0,0,0|2,0,0]=4 2162 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 11a_100000211541_100000187884 [1,1,0,0,0,0|2,0,0]=4 2163 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 1626a_100000211541_100000187884 [1,1,0,0,0,0|2,0,0]=4 2164 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 240690a_100000211541_100000187884 [1,1,0,0,0,0|2,0,0]=4 2165 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1I 527a_100000211541_100000187884 [1,1,0,0,0,0|2,0,0]=4 2166 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1O 240690a_100000211541_100015234032 [1,1,0,0,0,0|2,0,0]=4 2167 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 1626a_100000211541_100009911694 [1,1,0,0,0,0|2,0,0]=4 2168 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 240690a_100000211541_100009911694 [1,1,0,0,0,0|2,0,0]=4 2169 B15R1.5793 CC(C)C(C)NC(=O)c1ccccc1[O-] 527a_100000211541_100009911694 [1,1,0,0,0,0|2,0,0]=4 2170 B15R1.5793 Cc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000210198_100000741374 [1,1,0,0,0,0|1,0,1]=4 2171 B15R1.5793 Cc1ccccc1C(=O)CC(=O)C(C)C 1458a_100000212026_100000753385 [1,1,0,0,0,0|1,0,1]=4 2172 B15R1.5793 Cc1ccccc1C(=O)CN(C)C(C)C 269982a_200000211004_100000741374 [1,1,0,0,0,0|2,0,0]=4 2173 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000212026 [1,1,0,0,0,0|1,0,0]=3 2174 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000212026 [1,1,0,0,0,0|1,0,0]=3 2175 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000212026 [1,1,0,0,0,0|1,0,0]=3 2176 B15R1.5793 Cc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000212026 [1,1,0,0,0,0|1,0,0]=3 2177 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 240690a_100000744482_100000188424 [1,1,0,0,0,0|2,0,0]=4 2178 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Br 527a_100000744482_100000188424 [1,1,0,0,0,0|2,0,0]=4 2179 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 240690a_100000744482_100000185844 [1,1,0,0,0,0|2,0,0]=4 2180 B15R1.5815 CC(CO)CNC(=O)c1ccccc1Cl 527a_100000744482_100000185844 [1,1,0,0,0,0|2,0,0]=4 2181 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 240690a_100000744482_100000188656 [1,1,0,0,0,0|2,0,0]=4 2182 B15R1.5815 CC(CO)CNC(=O)c1ccccc1F 527a_100000744482_100000188656 [1,1,0,0,0,0|2,0,0]=4 2183 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 240690a_100000744482_100000187884 [1,1,0,0,0,0|2,0,0]=4 2184 B15R1.5815 CC(CO)CNC(=O)c1ccccc1I 527a_100000744482_100000187884 [1,1,0,0,0,0|2,0,0]=4 2185 B15R1.5815 CC(CO)CNC(=O)c1ccccc1O 240690a_100000744482_100015234032 [1,1,0,0,0,0|2,0,0]=4 2186 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 240690a_100000744482_100009911694 [1,1,0,0,0,0|2,0,0]=4 2187 B15R1.5815 CC(CO)CNC(=O)c1ccccc1[O-] 527a_100000744482_100009911694 [1,1,0,0,0,0|2,0,0]=4 2188 B15R1.5815 CC(OC[C@@H](C)CO)c1ccccc1N 7a_100011405641_100000059175 [1,1,0,0,0,0|1,0,1]=4 2189 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 11a_100020588543_100000188424 [1,1,0,0,0,0|2,0,0]=4 2190 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 1626a_100020588543_100000188424 [1,1,0,0,0,0|2,0,0]=4 2191 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 240690a_100020588543_100000188424 [1,1,0,0,0,0|2,0,0]=4 2192 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Br 527a_100020588543_100000188424 [1,1,0,0,0,0|2,0,0]=4 2193 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 11a_100020588543_100000212026 [1,1,0,0,0,0|1,0,0]=3 2194 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 1626a_100020588543_100000212026 [1,1,0,0,0,0|1,0,0]=3 2195 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 240690a_100020588543_100000212026 [1,1,0,0,0,0|1,0,0]=3 2196 B15R1.5815 CCC(C)CNC(=O)c1ccccc1C 527a_100020588543_100000212026 [1,1,0,0,0,0|1,0,0]=3 2197 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 11a_100020588543_100000185844 [1,1,0,0,0,0|2,0,0]=4 2198 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 1626a_100020588543_100000185844 [1,1,0,0,0,0|2,0,0]=4 2199 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 240690a_100020588543_100000185844 [1,1,0,0,0,0|2,0,0]=4 2200 B15R1.5815 CCC(C)CNC(=O)c1ccccc1Cl 527a_100020588543_100000185844 [1,1,0,0,0,0|2,0,0]=4 2201 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 11a_100020588543_100000188656 [1,1,0,0,0,0|2,0,0]=4 2202 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 1626a_100020588543_100000188656 [1,1,0,0,0,0|2,0,0]=4 2203 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 240690a_100020588543_100000188656 [1,1,0,0,0,0|2,0,0]=4 2204 B15R1.5815 CCC(C)CNC(=O)c1ccccc1F 527a_100020588543_100000188656 [1,1,0,0,0,0|2,0,0]=4 2205 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 11a_100020588543_100000187884 [1,1,0,0,0,0|2,0,0]=4 2206 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 1626a_100020588543_100000187884 [1,1,0,0,0,0|2,0,0]=4 2207 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 240690a_100020588543_100000187884 [1,1,0,0,0,0|2,0,0]=4 2208 B15R1.5815 CCC(C)CNC(=O)c1ccccc1I 527a_100020588543_100000187884 [1,1,0,0,0,0|2,0,0]=4 2209 B15R1.5815 CCC(C)CNC(=O)c1ccccc1O 240690a_100020588543_100015234032 [1,1,0,0,0,0|2,0,0]=4 2210 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 1626a_100020588543_100009911694 [1,1,0,0,0,0|2,0,0]=4 2211 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 240690a_100020588543_100009911694 [1,1,0,0,0,0|2,0,0]=4 2212 B15R1.5815 CCC(C)CNC(=O)c1ccccc1[O-] 527a_100020588543_100009911694 [1,1,0,0,0,0|2,0,0]=4 2213 B15R1.5815 CCC(C)COC(C)c1ccccc1C 34a_100000742021_100000748023 [1,1,0,0,0,0|1,0,1]=4 2214 B15R1.5815 CCC(C)COC(C)c1ccccc1C 7a_100000742021_100000748023 [1,1,0,0,0,0|1,0,1]=4 2215 B15R1.5815 CCC(C)COC(C)c1ccccc1N 7a_100011405641_100000748023 [1,1,0,0,0,0|1,0,1]=4 2216 B15R1.5815 CCC(C)NCC(=O)c1ccccc1C 2230a_100000209981_100000741374 [1,1,0,0,0,0|2,0,0]=4 2217 B15R1.5815 CCC(C)NNC(=O)c1ccccc1C 22a_100000718999_100000212026 [1,1,0,0,0,0|2,0,0]=4 2218 B15R1.5815 CCC(C)OCC(=O)c1ccccc1C 7a_100000210228_100000741374 [1,1,0,0,0,0|2,0,0]=4 2219 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000741374_100000758301 [1,1,0,0,0,0|2,0,0]=4 2220 B15R1.5815 CCC(C)SCC(=O)c1ccccc1C 62a_100000758301_100000741374 [1,1,0,0,0,0|2,0,0]=4 2221 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 11a_100011218483_100000212026 [1,1,0,0,0,0|2,0,0]=4 2222 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 240690a_100011218483_100000212026 [1,1,0,0,0,0|2,0,0]=4 2223 B15R1.5815 CCC(O)CNC(=O)c1ccccc1C 527a_100011218483_100000212026 [1,1,0,0,0,0|2,0,0]=4 2224 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 34a_100000742021_100009816398 [1,1,0,0,0,0|1,0,1]=4 2225 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1C 7a_100000742021_100009816398 [1,1,0,0,0,0|1,0,1]=4 2226 B15R1.5815 CC[C@H](C)COC(C)c1ccccc1N 7a_100011405641_100009816398 [1,1,0,0,0,0|1,0,1]=4 2227 B15R1.5815 CNC(C)COC(=O)c1ccccc1Br 270004a_106832991635_201991511838 [1,1,0,0,0,0|1,0,0]=3 2228 B15R1.5815 COC(C)SCC(=O)c1ccccc1C 62a_100000741374_100009879195 [1,1,0,0,0,0|2,0,0]=4 2229 B15R1.5815 COC(C)SCC(=O)c1ccccc1C 62a_100009879195_100000741374 [1,1,0,0,0,0|2,0,0]=4 2230 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 11a_100020591295_100000188424 [1,1,0,0,0,0|2,0,0]=4 2231 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 1626a_100020591295_100000188424 [1,1,0,0,0,0|2,0,0]=4 2232 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 240690a_100020591295_100000188424 [1,1,0,0,0,0|2,0,0]=4 2233 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Br 527a_100020591295_100000188424 [1,1,0,0,0,0|2,0,0]=4 2234 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 11a_100020591295_100000212026 [1,1,0,0,0,0|1,0,0]=3 2235 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 1626a_100020591295_100000212026 [1,1,0,0,0,0|1,0,0]=3 2236 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 240690a_100020591295_100000212026 [1,1,0,0,0,0|1,0,0]=3 2237 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1C 527a_100020591295_100000212026 [1,1,0,0,0,0|1,0,0]=3 2238 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 11a_100020591295_100000185844 [1,1,0,0,0,0|2,0,0]=4 2239 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 1626a_100020591295_100000185844 [1,1,0,0,0,0|2,0,0]=4 2240 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 240690a_100020591295_100000185844 [1,1,0,0,0,0|2,0,0]=4 2241 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1Cl 527a_100020591295_100000185844 [1,1,0,0,0,0|2,0,0]=4 2242 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 11a_100020591295_100000188656 [1,1,0,0,0,0|2,0,0]=4 2243 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 1626a_100020591295_100000188656 [1,1,0,0,0,0|2,0,0]=4 2244 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 240690a_100020591295_100000188656 [1,1,0,0,0,0|2,0,0]=4 2245 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1F 527a_100020591295_100000188656 [1,1,0,0,0,0|2,0,0]=4 2246 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 11a_100020591295_100000187884 [1,1,0,0,0,0|2,0,0]=4 2247 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 1626a_100020591295_100000187884 [1,1,0,0,0,0|2,0,0]=4 2248 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 240690a_100020591295_100000187884 [1,1,0,0,0,0|2,0,0]=4 2249 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1I 527a_100020591295_100000187884 [1,1,0,0,0,0|2,0,0]=4 2250 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1O 240690a_100020591295_100015234032 [1,1,0,0,0,0|2,0,0]=4 2251 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 1626a_100020591295_100009911694 [1,1,0,0,0,0|2,0,0]=4 2252 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 240690a_100020591295_100009911694 [1,1,0,0,0,0|2,0,0]=4 2253 B15R1.5815 CO[C@H](C)CNC(=O)c1ccccc1[O-] 527a_100020591295_100009911694 [1,1,0,0,0,0|2,0,0]=4 2254 B15R1.5815 Cc1ccccc1C(=O)CN[C@H](C)CO 2230a_100000737577_100000741374 [1,1,0,0,0,0|2,0,0]=4 2255 B15R1.5815 Cc1ccccc1C(=O)COC(C)CF 34a_100016041109_100000741374 [1,1,0,0,0,0|2,0,0]=4 2256 B15R1.5815 Cc1ccccc1C(=O)COC(C)CF 7a_100016041109_100000741374 [1,1,0,0,0,0|2,0,0]=4 2257 B15R1.5815 Cc1ccccc1C(=O)COC(C)CN 34a_100000210904_100000741374 [1,1,0,0,0,0|2,0,0]=4 2258 B15R1.5815 Cc1ccccc1C(=O)CSC(C)CO 62a_100012180447_100000741374 [1,1,0,0,0,0|2,0,0]=4 2259 B15R1.5815 Cc1ccccc1C(=O)CS[C@H](C)CO 62a_100000741374_100016084084 [1,1,0,0,0,0|2,0,0]=4 2260 B15R1.5815 Cc1ccccc1C(=O)CS[C@H](C)CO 62a_100016084084_100000741374 [1,1,0,0,0,0|2,0,0]=4 2261 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000212026 [1,1,0,0,0,0|1,0,0]=3 2262 B15R1.5815 Cc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000212026 [1,1,0,0,0,0|1,0,0]=3 2263 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100000212026 [1,1,0,0,0,0|2,0,0]=4 2264 B15R1.5815 Cc1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100000212026 [1,1,0,0,0,0|2,0,0]=4 2265 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100000212026 [1,1,0,0,0,0|2,0,0]=4 2266 B15R1.5815 Cc1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100000212026 [1,1,0,0,0,0|2,0,0]=4 2267 B15R1.5815 Cc1ccccc1C(C)OC[C@@H](C)CO 34a_100000742021_100000059175 [1,1,0,0,0,0|1,0,1]=4 2268 B15R1.5815 Cc1ccccc1C(C)OC[C@@H](C)CO 7a_100000742021_100000059175 [1,1,0,0,0,0|1,0,1]=4 2269 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210312 [1,1,0,0,0,0|2,0,0]=4 2270 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210312 [1,1,0,0,0,0|2,0,0]=4 2271 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210312 [1,1,0,0,0,0|2,0,0]=4 2272 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210312 [1,1,0,0,0,0|2,0,0]=4 2273 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210312 [1,1,0,0,0,0|2,0,0]=4 2274 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210312 [1,1,0,0,0,0|2,0,0]=4 2275 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210312 [1,1,0,0,0,0|2,0,0]=4 2276 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210312 [1,1,0,0,0,0|2,0,0]=4 2277 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210312 [1,1,0,0,0,0|2,0,0]=4 2278 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210312 [1,1,0,0,0,0|2,0,0]=4 2279 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210312 [1,1,0,0,0,0|2,0,0]=4 2280 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210312 [1,1,0,0,0,0|2,0,0]=4 2281 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210312 [1,1,0,0,0,0|2,0,0]=4 2282 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210312 [1,1,0,0,0,0|2,0,0]=4 2283 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210312 [1,1,0,0,0,0|2,0,0]=4 2284 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210312 [1,1,0,0,0,0|2,0,0]=4 2285 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210312 [1,1,0,0,0,0|2,0,0]=4 2286 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210312 [1,1,0,0,0,0|2,0,0]=4 2287 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210312 [1,1,0,0,0,0|2,0,0]=4 2288 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210312 [1,1,0,0,0,0|2,0,0]=4 2289 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210312 [1,1,0,0,0,0|2,0,0]=4 2290 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210312 [1,1,0,0,0,0|2,0,0]=4 2291 B15R1.5822 CC(C)CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210312 [1,1,0,0,0,0|2,0,0]=4 2292 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 11a_100000210953_100000762965 [1,1,0,0,0,0|2,0,0]=4 2293 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 1626a_100000210953_100000762965 [1,1,0,0,0,0|2,0,0]=4 2294 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 240690a_100000210953_100000762965 [1,1,0,0,0,0|2,0,0]=4 2295 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Br 527a_100000210953_100000762965 [1,1,0,0,0,0|2,0,0]=4 2296 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 11a_100000210953_100000766353 [1,1,0,0,0,0|2,0,0]=4 2297 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 1626a_100000210953_100000766353 [1,1,0,0,0,0|2,0,0]=4 2298 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 240690a_100000210953_100000766353 [1,1,0,0,0,0|2,0,0]=4 2299 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)Cl 527a_100000210953_100000766353 [1,1,0,0,0,0|2,0,0]=4 2300 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 11a_100000210953_100000212304 [1,1,0,0,0,0|2,0,0]=4 2301 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 1626a_100000210953_100000212304 [1,1,0,0,0,0|2,0,0]=4 2302 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 240690a_100000210953_100000212304 [1,1,0,0,0,0|2,0,0]=4 2303 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)F 527a_100000210953_100000212304 [1,1,0,0,0,0|2,0,0]=4 2304 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 11a_100000210953_100012360512 [1,1,0,0,0,0|2,0,0]=4 2305 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 1626a_100000210953_100012360512 [1,1,0,0,0,0|2,0,0]=4 2306 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 240690a_100000210953_100012360512 [1,1,0,0,0,0|2,0,0]=4 2307 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)I 527a_100000210953_100012360512 [1,1,0,0,0,0|2,0,0]=4 2308 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 240690a_100000210953_100012344906 [1,1,0,0,0,0|2,0,0]=4 2309 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Br)O 527a_100000210953_100012344906 [1,1,0,0,0,0|2,0,0]=4 2310 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 11a_100000210953_100000741628 [1,1,0,0,0,0|2,0,0]=4 2311 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 1626a_100000210953_100000741628 [1,1,0,0,0,0|2,0,0]=4 2312 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 240690a_100000210953_100000741628 [1,1,0,0,0,0|2,0,0]=4 2313 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Br 527a_100000210953_100000741628 [1,1,0,0,0,0|2,0,0]=4 2314 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 11a_100000210953_100000185840 [1,1,0,0,0,0|2,0,0]=4 2315 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 1626a_100000210953_100000185840 [1,1,0,0,0,0|2,0,0]=4 2316 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 240690a_100000210953_100000185840 [1,1,0,0,0,0|2,0,0]=4 2317 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)Cl 527a_100000210953_100000185840 [1,1,0,0,0,0|2,0,0]=4 2318 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 11a_100000210953_100000211397 [1,1,0,0,0,0|2,0,0]=4 2319 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 1626a_100000210953_100000211397 [1,1,0,0,0,0|2,0,0]=4 2320 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 240690a_100000210953_100000211397 [1,1,0,0,0,0|2,0,0]=4 2321 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)F 527a_100000210953_100000211397 [1,1,0,0,0,0|2,0,0]=4 2322 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 11a_100000210953_100000751301 [1,1,0,0,0,0|2,0,0]=4 2323 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 1626a_100000210953_100000751301 [1,1,0,0,0,0|2,0,0]=4 2324 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 240690a_100000210953_100000751301 [1,1,0,0,0,0|2,0,0]=4 2325 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)I 527a_100000210953_100000751301 [1,1,0,0,0,0|2,0,0]=4 2326 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 240690a_100000210953_100000702456 [1,1,0,0,0,0|2,0,0]=4 2327 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1Cl)O 527a_100000210953_100000702456 [1,1,0,0,0,0|2,0,0]=4 2328 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 11a_100000210953_100000214689 [1,1,0,0,0,0|2,0,0]=4 2329 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 1626a_100000210953_100000214689 [1,1,0,0,0,0|2,0,0]=4 2330 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 240690a_100000210953_100000214689 [1,1,0,0,0,0|2,0,0]=4 2331 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Br 527a_100000210953_100000214689 [1,1,0,0,0,0|2,0,0]=4 2332 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 11a_100000210953_100000212326 [1,1,0,0,0,0|2,0,0]=4 2333 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 1626a_100000210953_100000212326 [1,1,0,0,0,0|2,0,0]=4 2334 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 240690a_100000210953_100000212326 [1,1,0,0,0,0|2,0,0]=4 2335 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)Cl 527a_100000210953_100000212326 [1,1,0,0,0,0|2,0,0]=4 2336 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 11a_100000210953_100000211022 [1,1,0,0,0,0|2,0,0]=4 2337 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 1626a_100000210953_100000211022 [1,1,0,0,0,0|2,0,0]=4 2338 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 240690a_100000210953_100000211022 [1,1,0,0,0,0|2,0,0]=4 2339 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)F 527a_100000210953_100000211022 [1,1,0,0,0,0|2,0,0]=4 2340 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 11a_100000210953_100000037189 [1,1,0,0,0,0|2,0,0]=4 2341 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 1626a_100000210953_100000037189 [1,1,0,0,0,0|2,0,0]=4 2342 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 240690a_100000210953_100000037189 [1,1,0,0,0,0|2,0,0]=4 2343 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)I 527a_100000210953_100000037189 [1,1,0,0,0,0|2,0,0]=4 2344 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 240690a_100000210953_100000689029 [1,1,0,0,0,0|2,0,0]=4 2345 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1F)O 527a_100000210953_100000689029 [1,1,0,0,0,0|2,0,0]=4 2346 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 11a_100000210953_100000751167 [1,1,0,0,0,0|2,0,0]=4 2347 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 1626a_100000210953_100000751167 [1,1,0,0,0,0|2,0,0]=4 2348 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 240690a_100000210953_100000751167 [1,1,0,0,0,0|2,0,0]=4 2349 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Br 527a_100000210953_100000751167 [1,1,0,0,0,0|2,0,0]=4 2350 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 11a_100000210953_100000739380 [1,1,0,0,0,0|2,0,0]=4 2351 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 1626a_100000210953_100000739380 [1,1,0,0,0,0|2,0,0]=4 2352 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 240690a_100000210953_100000739380 [1,1,0,0,0,0|2,0,0]=4 2353 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)Cl 527a_100000210953_100000739380 [1,1,0,0,0,0|2,0,0]=4 2354 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 11a_100000210953_100000739341 [1,1,0,0,0,0|2,0,0]=4 2355 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 1626a_100000210953_100000739341 [1,1,0,0,0,0|2,0,0]=4 2356 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 240690a_100000210953_100000739341 [1,1,0,0,0,0|2,0,0]=4 2357 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1I)F 527a_100000210953_100000739341 [1,1,0,0,0,0|2,0,0]=4 2358 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 240690a_100000210953_100000744433 [1,1,0,0,0,0|2,0,0]=4 2359 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Br 527a_100000210953_100000744433 [1,1,0,0,0,0|2,0,0]=4 2360 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 11a_100000210953_100000188622 [1,1,0,0,0,0|2,0,0]=4 2361 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 240690a_100000210953_100000188622 [1,1,0,0,0,0|2,0,0]=4 2362 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)Cl 527a_100000210953_100000188622 [1,1,0,0,0,0|2,0,0]=4 2363 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 240690a_100000210953_100000746061 [1,1,0,0,0,0|2,0,0]=4 2364 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)F 527a_100000210953_100000746061 [1,1,0,0,0,0|2,0,0]=4 2365 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 240690a_100000210953_100000091984 [1,1,0,0,0,0|2,0,0]=4 2366 B15R1.5822 CC(C)CNC(=O)c1ccc(cc1O)I 527a_100000210953_100000091984 [1,1,0,0,0,0|2,0,0]=4 2367 B15R1.5822 CN(C)COC(=O)c1ccc(cc1Cl)Cl 2230a_100102631434_100010978946 [1,1,0,0,0,0|2,0,0]=4 2368 B15R1.5822 CN(C)COC(=O)c1ccc(cc1Cl)Cl 269982a_100102631434_100010978946 [1,1,0,0,0,0|2,0,0]=4 2369 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)Br 1458a_100000741311_100000210312 [1,1,0,0,0,0|1,0,0]=3 2370 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)Cl 1458a_100000688705_100000210312 [1,1,0,0,0,0|1,0,0]=3 2371 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)F 1458a_100000686989_100000210312 [1,1,0,0,0,0|1,0,0]=3 2372 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)I 1458a_100010189873_100000210312 [1,1,0,0,0,0|1,0,0]=3 2373 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)C)O 1458a_100000692822_100000210312 [1,1,0,0,0,0|1,0,0]=3 2374 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Br 1458a_100000741311_100012276601 [1,1,0,0,0,0|2,0,0]=4 2375 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)Cl 1458a_100000688705_100012276601 [1,1,0,0,0,0|2,0,0]=4 2376 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)F 1458a_100000686989_100012276601 [1,1,0,0,0,0|2,0,0]=4 2377 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)I 1458a_100010189873_100012276601 [1,1,0,0,0,0|2,0,0]=4 2378 B15R1.5822 Cc1cc(ccc1C(=O)CCC(C)O)O 1458a_100000692822_100012276601 [1,1,0,0,0,0|2,0,0]=4 2379 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 11a_100000210953_100000741311 [1,1,0,0,0,0|1,0,0]=3 2380 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 1626a_100000210953_100000741311 [1,1,0,0,0,0|1,0,0]=3 2381 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 240690a_100000210953_100000741311 [1,1,0,0,0,0|1,0,0]=3 2382 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Br 527a_100000210953_100000741311 [1,1,0,0,0,0|1,0,0]=3 2383 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 11a_100000210953_100000688705 [1,1,0,0,0,0|1,0,0]=3 2384 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000688705 [1,1,0,0,0,0|1,0,0]=3 2385 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000688705 [1,1,0,0,0,0|1,0,0]=3 2386 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)Cl 527a_100000210953_100000688705 [1,1,0,0,0,0|1,0,0]=3 2387 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 11a_100000210953_100000686989 [1,1,0,0,0,0|1,0,0]=3 2388 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 1626a_100000210953_100000686989 [1,1,0,0,0,0|1,0,0]=3 2389 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 240690a_100000210953_100000686989 [1,1,0,0,0,0|1,0,0]=3 2390 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)F 527a_100000210953_100000686989 [1,1,0,0,0,0|1,0,0]=3 2391 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 11a_100000210953_100010189873 [1,1,0,0,0,0|1,0,0]=3 2392 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 1626a_100000210953_100010189873 [1,1,0,0,0,0|1,0,0]=3 2393 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 240690a_100000210953_100010189873 [1,1,0,0,0,0|1,0,0]=3 2394 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)I 527a_100000210953_100010189873 [1,1,0,0,0,0|1,0,0]=3 2395 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 240690a_100000210953_100000692822 [1,1,0,0,0,0|1,0,0]=3 2396 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)C)O 527a_100000210953_100000692822 [1,1,0,0,0,0|1,0,0]=3 2397 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 11a_100000210904_100000741311 [1,1,0,0,0,0|2,0,0]=4 2398 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 240690a_100000210904_100000741311 [1,1,0,0,0,0|2,0,0]=4 2399 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Br 527a_100000210904_100000741311 [1,1,0,0,0,0|2,0,0]=4 2400 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 11a_100000210904_100000688705 [1,1,0,0,0,0|2,0,0]=4 2401 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000688705 [1,1,0,0,0,0|2,0,0]=4 2402 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)Cl 527a_100000210904_100000688705 [1,1,0,0,0,0|2,0,0]=4 2403 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 11a_100000210904_100000686989 [1,1,0,0,0,0|2,0,0]=4 2404 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 240690a_100000210904_100000686989 [1,1,0,0,0,0|2,0,0]=4 2405 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)F 527a_100000210904_100000686989 [1,1,0,0,0,0|2,0,0]=4 2406 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 11a_100000210904_100010189873 [1,1,0,0,0,0|2,0,0]=4 2407 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 240690a_100000210904_100010189873 [1,1,0,0,0,0|2,0,0]=4 2408 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)I 527a_100000210904_100010189873 [1,1,0,0,0,0|2,0,0]=4 2409 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 240690a_100000210904_100000692822 [1,1,0,0,0,0|2,0,0]=4 2410 B15R1.5822 Cc1cc(ccc1C(=O)NCC(C)O)O 527a_100000210904_100000692822 [1,1,0,0,0,0|2,0,0]=4 2411 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)Br 22a_100000741168_100000741311 [1,1,0,0,0,0|2,0,0]=4 2412 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)Cl 22a_100000741168_100000688705 [1,1,0,0,0,0|2,0,0]=4 2413 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)F 22a_100000741168_100000686989 [1,1,0,0,0,0|2,0,0]=4 2414 B15R1.5822 Cc1cc(ccc1C(=O)NNC(C)C)I 22a_100000741168_100010189873 [1,1,0,0,0,0|2,0,0]=4 2415 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)CCC(C)C 1458a_100000685072_100000210312 [1,1,0,0,0,0|2,0,0]=4 2416 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 11a_100000210953_100000685072 [1,1,0,0,0,0|2,0,0]=4 2417 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 1626a_100000210953_100000685072 [1,1,0,0,0,0|2,0,0]=4 2418 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 240690a_100000210953_100000685072 [1,1,0,0,0,0|2,0,0]=4 2419 B15R1.5822 Cc1ccc(c(c1)Br)C(=O)NCC(C)C 527a_100000210953_100000685072 [1,1,0,0,0,0|2,0,0]=4 2420 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)C 1458a_100000211164_100000210312 [1,1,0,0,0,0|1,0,0]=3 2421 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CCC(C)O 1458a_100000211164_100012276601 [1,1,0,0,0,0|2,0,0]=4 2422 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CNC(C)C 2230a_100138425928_100000229959 [1,1,0,0,0,0|2,0,0]=4 2423 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CNC(C)C 34a_100138425928_100000229959 [1,1,0,0,0,0|2,0,0]=4 2424 B15R1.5822 Cc1ccc(c(c1)C)C(=O)COC(C)C 34a_100000212225_100000229959 [1,1,0,0,0,0|2,0,0]=4 2425 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CSC(C)C 62a_100000210206_100000229959 [1,1,0,0,0,0|2,0,0]=4 2426 B15R1.5822 Cc1ccc(c(c1)C)C(=O)CSC(C)C 62a_100000229959_100000210206 [1,1,0,0,0,0|2,0,0]=4 2427 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 11a_100000210953_100000211164 [1,1,0,0,0,0|1,0,0]=3 2428 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 1626a_100000210953_100000211164 [1,1,0,0,0,0|1,0,0]=3 2429 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 240690a_100000210953_100000211164 [1,1,0,0,0,0|1,0,0]=3 2430 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)C 527a_100000210953_100000211164 [1,1,0,0,0,0|1,0,0]=3 2431 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 11a_100000210904_100000211164 [1,1,0,0,0,0|2,0,0]=4 2432 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 240690a_100000210904_100000211164 [1,1,0,0,0,0|2,0,0]=4 2433 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NCC(C)O 527a_100000210904_100000211164 [1,1,0,0,0,0|2,0,0]=4 2434 B15R1.5822 Cc1ccc(c(c1)C)C(=O)NNC(C)C 22a_100000741168_100000211164 [1,1,0,0,0,0|2,0,0]=4 2435 B15R1.5822 Cc1ccc(c(c1)C)C(C)OCC(C)C 34a_100000246504_100000210624 [1,1,0,0,0,0|1,0,1]=4 2436 B15R1.5822 Cc1ccc(c(c1)C)C(C)OCC(C)C 7a_100000246504_100000210760 [1,1,0,0,0,0|1,0,1]=4 2437 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)CCC(C)C 1458a_100000766932_100000210312 [1,1,0,0,0,0|2,0,0]=4 2438 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 11a_100000210953_100000766932 [1,1,0,0,0,0|2,0,0]=4 2439 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 1626a_100000210953_100000766932 [1,1,0,0,0,0|2,0,0]=4 2440 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 240690a_100000210953_100000766932 [1,1,0,0,0,0|2,0,0]=4 2441 B15R1.5822 Cc1ccc(c(c1)Cl)C(=O)NCC(C)C 527a_100000210953_100000766932 [1,1,0,0,0,0|2,0,0]=4 2442 B15R1.5822 Cc1ccc(c(c1)F)C(=O)CCC(C)C 1458a_100000766033_100000210312 [1,1,0,0,0,0|2,0,0]=4 2443 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 11a_100000210953_100000766033 [1,1,0,0,0,0|2,0,0]=4 2444 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 1626a_100000210953_100000766033 [1,1,0,0,0,0|2,0,0]=4 2445 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 240690a_100000210953_100000766033 [1,1,0,0,0,0|2,0,0]=4 2446 B15R1.5822 Cc1ccc(c(c1)F)C(=O)NCC(C)C 527a_100000210953_100000766033 [1,1,0,0,0,0|2,0,0]=4 2447 B15R1.5822 Cc1ccc(c(c1)I)C(=O)CCC(C)C 1458a_100009999607_100000210312 [1,1,0,0,0,0|2,0,0]=4 2448 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 11a_100000210953_100009999607 [1,1,0,0,0,0|2,0,0]=4 2449 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 1626a_100000210953_100009999607 [1,1,0,0,0,0|2,0,0]=4 2450 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 240690a_100000210953_100009999607 [1,1,0,0,0,0|2,0,0]=4 2451 B15R1.5822 Cc1ccc(c(c1)I)C(=O)NCC(C)C 527a_100000210953_100009999607 [1,1,0,0,0,0|2,0,0]=4 2452 B15R1.5822 Cc1ccc(c(c1)O)C(=O)CCC(C)C 1458a_100000212137_100000210312 [1,1,0,0,0,0|2,0,0]=4 2453 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 1626a_100000210953_100000212137 [1,1,0,0,0,0|2,0,0]=4 2454 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 240690a_100000210953_100000212137 [1,1,0,0,0,0|2,0,0]=4 2455 B15R1.5822 Cc1ccc(c(c1)O)C(=O)NCC(C)C 527a_100000210953_100000212137 [1,1,0,0,0,0|2,0,0]=4 2456 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1Br 1458a_100000188424_100000755188 [1,1,0,0,0,0|2,0,0]=4 2457 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1Cl 1458a_100000185844_100000755188 [1,1,0,0,0,0|2,0,0]=4 2458 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1F 1458a_100000188656_100000755188 [1,1,0,0,0,0|2,0,0]=4 2459 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1I 1458a_100000187884_100000755188 [1,1,0,0,0,0|2,0,0]=4 2460 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1O 1458a_100015234032_100000755188 [1,1,0,0,0,0|2,0,0]=4 2461 B15R1.8018 CC(C)(C)CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000755188 [1,1,0,0,0,0|2,0,0]=4 2462 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 11a_100000743828_100000188424 [1,1,0,0,0,0|2,0,0]=4 2463 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 1626a_100000743828_100000188424 [1,1,0,0,0,0|2,0,0]=4 2464 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 240690a_100000743828_100000188424 [1,1,0,0,0,0|2,0,0]=4 2465 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Br 527a_100000743828_100000188424 [1,1,0,0,0,0|2,0,0]=4 2466 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 11a_100000743828_100000185844 [1,1,0,0,0,0|2,0,0]=4 2467 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 1626a_100000743828_100000185844 [1,1,0,0,0,0|2,0,0]=4 2468 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 240690a_100000743828_100000185844 [1,1,0,0,0,0|2,0,0]=4 2469 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1Cl 527a_100000743828_100000185844 [1,1,0,0,0,0|2,0,0]=4 2470 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 11a_100000743828_100000188656 [1,1,0,0,0,0|2,0,0]=4 2471 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 1626a_100000743828_100000188656 [1,1,0,0,0,0|2,0,0]=4 2472 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 240690a_100000743828_100000188656 [1,1,0,0,0,0|2,0,0]=4 2473 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1F 527a_100000743828_100000188656 [1,1,0,0,0,0|2,0,0]=4 2474 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 11a_100000743828_100000187884 [1,1,0,0,0,0|2,0,0]=4 2475 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 1626a_100000743828_100000187884 [1,1,0,0,0,0|2,0,0]=4 2476 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 240690a_100000743828_100000187884 [1,1,0,0,0,0|2,0,0]=4 2477 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1I 527a_100000743828_100000187884 [1,1,0,0,0,0|2,0,0]=4 2478 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1O 240690a_100000743828_100015234032 [1,1,0,0,0,0|2,0,0]=4 2479 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 1626a_100000743828_100009911694 [1,1,0,0,0,0|2,0,0]=4 2480 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 240690a_100000743828_100009911694 [1,1,0,0,0,0|2,0,0]=4 2481 B15R1.8018 CC(C)(C)CNC(=O)c1ccccc1[O-] 527a_100000743828_100009911694 [1,1,0,0,0,0|2,0,0]=4 2482 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 11a_100020643315_100000188424 [1,1,0,0,0,0|2,0,0]=4 2483 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 1626a_100020643315_100000188424 [1,1,0,0,0,0|2,0,0]=4 2484 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 240690a_100020643315_100000188424 [1,1,0,0,0,0|2,0,0]=4 2485 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Br 527a_100020643315_100000188424 [1,1,0,0,0,0|2,0,0]=4 2486 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 11a_100020643315_100000185844 [1,1,0,0,0,0|2,0,0]=4 2487 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 1626a_100020643315_100000185844 [1,1,0,0,0,0|2,0,0]=4 2488 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 240690a_100020643315_100000185844 [1,1,0,0,0,0|2,0,0]=4 2489 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1Cl 527a_100020643315_100000185844 [1,1,0,0,0,0|2,0,0]=4 2490 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 11a_100020643315_100000188656 [1,1,0,0,0,0|2,0,0]=4 2491 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 1626a_100020643315_100000188656 [1,1,0,0,0,0|2,0,0]=4 2492 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 240690a_100020643315_100000188656 [1,1,0,0,0,0|2,0,0]=4 2493 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1F 527a_100020643315_100000188656 [1,1,0,0,0,0|2,0,0]=4 2494 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 11a_100020643315_100000187884 [1,1,0,0,0,0|2,0,0]=4 2495 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 1626a_100020643315_100000187884 [1,1,0,0,0,0|2,0,0]=4 2496 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 240690a_100020643315_100000187884 [1,1,0,0,0,0|2,0,0]=4 2497 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1I 527a_100020643315_100000187884 [1,1,0,0,0,0|2,0,0]=4 2498 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1O 240690a_100020643315_100015234032 [1,1,0,0,0,0|2,0,0]=4 2499 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 1626a_100020643315_100009911694 [1,1,0,0,0,0|2,0,0]=4 2500 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 240690a_100020643315_100009911694 [1,1,0,0,0,0|2,0,0]=4 2501 B15R1.8018 CC(C)(F)CNC(=O)c1ccccc1[O-] 527a_100020643315_100009911694 [1,1,0,0,0,0|2,0,0]=4 2502 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 1626a_100000751335_100000188424 [1,1,0,0,0,0|2,0,0]=4 2503 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 240690a_100000751335_100000188424 [1,1,0,0,0,0|2,0,0]=4 2504 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Br 527a_100000751335_100000188424 [1,1,0,0,0,0|2,0,0]=4 2505 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 1626a_100000751335_100000185844 [1,1,0,0,0,0|2,0,0]=4 2506 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 240690a_100000751335_100000185844 [1,1,0,0,0,0|2,0,0]=4 2507 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1Cl 527a_100000751335_100000185844 [1,1,0,0,0,0|2,0,0]=4 2508 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 1626a_100000751335_100000188656 [1,1,0,0,0,0|2,0,0]=4 2509 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 240690a_100000751335_100000188656 [1,1,0,0,0,0|2,0,0]=4 2510 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1F 527a_100000751335_100000188656 [1,1,0,0,0,0|2,0,0]=4 2511 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 1626a_100000751335_100000187884 [1,1,0,0,0,0|2,0,0]=4 2512 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 240690a_100000751335_100000187884 [1,1,0,0,0,0|2,0,0]=4 2513 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1I 527a_100000751335_100000187884 [1,1,0,0,0,0|2,0,0]=4 2514 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1O 240690a_100000751335_100015234032 [1,1,0,0,0,0|2,0,0]=4 2515 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 1626a_100000751335_100009911694 [1,1,0,0,0,0|2,0,0]=4 2516 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 240690a_100000751335_100009911694 [1,1,0,0,0,0|2,0,0]=4 2517 B15R1.8018 CC(C)(O)CNC(=O)c1ccccc1[O-] 527a_100000751335_100009911694 [1,1,0,0,0,0|2,0,0]=4 2518 B15R1.8018 CC(OCC(C)(C)O)c1ccccc1N 7a_100011405641_100000764493 [1,1,0,0,0,0|1,0,1]=4 2519 B15R1.8018 Cc1ccccc1C(=O)CCC(C)(C)C 1458a_100000212026_100000755188 [1,1,0,0,0,0|1,0,0]=3 2520 B15R1.8018 Cc1ccccc1C(=O)CC[N+](C)(C)C 1458a_100000212026_100000085578 [1,1,0,0,0,0|2,0,0]=4 2521 B15R1.8018 Cc1ccccc1C(=O)CC[Si](C)(C)C 1458a_100000212026_200000733723 [1,1,0,0,0,0|1,1,0]=4 2522 B15R1.8018 Cc1ccccc1C(=O)CNC(C)(C)C 2230a_100000715429_100000741374 [1,1,0,0,0,0|2,0,0]=4 2523 B15R1.8018 Cc1ccccc1C(=O)COC(C)(C)C 34a_100015890283_100000741374 [1,1,0,0,0,0|2,0,0]=4 2524 B15R1.8018 Cc1ccccc1C(=O)COC(C)(C)C 7a_100015890283_100000741374 [1,1,0,0,0,0|2,0,0]=4 2525 B15R1.8018 Cc1ccccc1C(=O)CSC(C)(C)C 62a_100000211941_100000741374 [1,1,0,0,0,0|2,0,0]=4 2526 B15R1.8018 Cc1ccccc1C(=O)CSC(C)(C)C 62a_100000741374_100000211941 [1,1,0,0,0,0|2,0,0]=4 2527 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000212026 [1,1,0,0,0,0|1,0,0]=3 2528 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000212026 [1,1,0,0,0,0|1,0,0]=3 2529 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000212026 [1,1,0,0,0,0|1,0,0]=3 2530 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000212026 [1,1,0,0,0,0|1,0,0]=3 2531 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000212026 [1,1,0,0,0,0|1,0,0]=3 2532 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000212026 [1,1,0,0,0,0|1,0,0]=3 2533 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000212026 [1,1,0,0,0,0|1,0,0]=3 2534 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000212026 [1,1,0,0,0,0|1,0,0]=3 2535 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000212026 [1,1,0,0,0,0|1,0,0]=3 2536 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000212026 [1,1,0,0,0,0|1,0,0]=3 2537 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000212026 [1,1,0,0,0,0|1,0,0]=3 2538 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100000212026 [1,1,0,0,0,0|2,0,0]=4 2539 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100000212026 [1,1,0,0,0,0|2,0,0]=4 2540 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100000212026 [1,1,0,0,0,0|2,0,0]=4 2541 B15R1.8018 Cc1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100000212026 [1,1,0,0,0,0|2,0,0]=4 2542 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100000212026 [1,1,0,0,0,0|1,1,0]=4 2543 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100000212026 [1,1,0,0,0,0|1,1,0]=4 2544 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100000212026 [1,1,0,0,0,0|1,1,0]=4 2545 B15R1.8018 Cc1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100000212026 [1,1,0,0,0,0|1,1,0]=4 2546 B15R1.8018 Cc1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100000212026 [1,1,0,0,0,0|2,0,0]=4 2547 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)C 34a_100000742021_100011219605 [1,1,0,0,0,0|1,0,1]=4 2548 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)F 34a_100000742021_100011997219 [1,1,0,0,0,0|1,0,1]=4 2549 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 34a_100000742021_100000764493 [1,1,0,0,0,0|1,0,1]=4 2550 B15R1.8018 Cc1ccccc1C(C)OCC(C)(C)O 7a_100000742021_100000764493 [1,1,0,0,0,0|1,0,1]=4 2551 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1N 40a_100000210953_100000703237 [1,1,0,0,0,0|2,0,0]=4 2552 B15R1.8020 CC(C)COC(C)(C)c1ccccc1N 7a_100000081495_100000210760 [1,1,0,0,0,0|1,0,1]=4 2553 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 270084a_100000210953_100000750907 [1,1,0,0,0,0|2,0,0]=4 2554 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 274078a_100000210953_100000750907 [1,1,0,0,0,0|2,0,0]=4 2555 B15R1.8020 Cc1ccccc1S(=O)(=O)NCC(C)C 40a_100000210953_100010269479 [1,1,0,0,0,0|2,0,0]=4 2556 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)Br 1458a_100000690891_100000210312 [1,1,0,0,0,0|2,0,0]=4 2557 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)Cl 1458a_100011253703_100000210312 [1,1,0,0,0,0|2,0,0]=4 2558 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)F 1458a_100000752694_100000210312 [1,1,0,0,0,0|2,0,0]=4 2559 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Br)O 1458a_100011935254_100000210312 [1,1,0,0,0,0|2,0,0]=4 2560 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_100000210312 [1,1,0,0,0,0|2,0,0]=4 2561 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)F 1458a_100000210369_100000210312 [1,1,0,0,0,0|2,0,0]=4 2562 B15R1.8312 CC(C)CCC(=O)c1c(cccc1Cl)O 1458a_100000745519_100000210312 [1,1,0,0,0,0|2,0,0]=4 2563 B15R1.8312 CC(C)CCC(=O)c1c(cccc1F)F 1458a_100000210804_100000210312 [1,1,0,0,0,0|2,0,0]=4 2564 B15R1.8312 CC(C)CCC(=O)c1c(cccc1F)O 1458a_100000763259_100000210312 [1,1,0,0,0,0|2,0,0]=4 2565 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)Br 1458a_100010232521_100000210312 [1,1,0,0,0,0|2,0,0]=4 2566 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)Cl 1458a_100000702859_100000210312 [1,1,0,0,0,0|2,0,0]=4 2567 B15R1.8312 CC(C)CCC(=O)c1c(cccc1I)F 1458a_100000023732_100000210312 [1,1,0,0,0,0|2,0,0]=4 2568 B15R1.8312 CC(C)CCC(=O)c1c(cccc1O)O 1458a_100000755285_100000210312 [1,1,0,0,0,0|2,0,0]=4 2569 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 11a_100000210953_100000690891 [1,1,0,0,0,0|2,0,0]=4 2570 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 1626a_100000210953_100000690891 [1,1,0,0,0,0|2,0,0]=4 2571 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 240690a_100000210953_100000690891 [1,1,0,0,0,0|2,0,0]=4 2572 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Br 527a_100000210953_100000690891 [1,1,0,0,0,0|2,0,0]=4 2573 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 11a_100000210953_100011253703 [1,1,0,0,0,0|2,0,0]=4 2574 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 1626a_100000210953_100011253703 [1,1,0,0,0,0|2,0,0]=4 2575 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 240690a_100000210953_100011253703 [1,1,0,0,0,0|2,0,0]=4 2576 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)Cl 527a_100000210953_100011253703 [1,1,0,0,0,0|2,0,0]=4 2577 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 11a_100000210953_100000752694 [1,1,0,0,0,0|2,0,0]=4 2578 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 1626a_100000210953_100000752694 [1,1,0,0,0,0|2,0,0]=4 2579 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 240690a_100000210953_100000752694 [1,1,0,0,0,0|2,0,0]=4 2580 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)F 527a_100000210953_100000752694 [1,1,0,0,0,0|2,0,0]=4 2581 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)O 240690a_100000210953_100011935254 [1,1,0,0,0,0|2,0,0]=4 2582 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Br)O 527a_100000210953_100011935254 [1,1,0,0,0,0|2,0,0]=4 2583 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 11a_100000210953_100000210656 [1,1,0,0,0,0|2,0,0]=4 2584 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 1626a_100000210953_100000210656 [1,1,0,0,0,0|2,0,0]=4 2585 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)Cl 240690a_100000210953_100000210656 [1,1,0,0,0,0|2,0,0]=4 2586 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 11a_100000210953_100000210369 [1,1,0,0,0,0|2,0,0]=4 2587 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 1626a_100000210953_100000210369 [1,1,0,0,0,0|2,0,0]=4 2588 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 240690a_100000210953_100000210369 [1,1,0,0,0,0|2,0,0]=4 2589 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)F 527a_100000210953_100000210369 [1,1,0,0,0,0|2,0,0]=4 2590 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)O 240690a_100000210953_100000745519 [1,1,0,0,0,0|2,0,0]=4 2591 B15R1.8312 CC(C)CNC(=O)c1c(cccc1Cl)O 527a_100000210953_100000745519 [1,1,0,0,0,0|2,0,0]=4 2592 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 11a_100000210953_100000210804 [1,1,0,0,0,0|2,0,0]=4 2593 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 1626a_100000210953_100000210804 [1,1,0,0,0,0|2,0,0]=4 2594 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 240690a_100000210953_100000210804 [1,1,0,0,0,0|2,0,0]=4 2595 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)F 527a_100000210953_100000210804 [1,1,0,0,0,0|2,0,0]=4 2596 B15R1.8312 CC(C)CNC(=O)c1c(cccc1F)O 527a_100000210953_100000763259 [1,1,0,0,0,0|2,0,0]=4 2597 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 11a_100000210953_100010232521 [1,1,0,0,0,0|2,0,0]=4 2598 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 1626a_100000210953_100010232521 [1,1,0,0,0,0|2,0,0]=4 2599 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 240690a_100000210953_100010232521 [1,1,0,0,0,0|2,0,0]=4 2600 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Br 527a_100000210953_100010232521 [1,1,0,0,0,0|2,0,0]=4 2601 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 11a_100000210953_100000702859 [1,1,0,0,0,0|2,0,0]=4 2602 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 1626a_100000210953_100000702859 [1,1,0,0,0,0|2,0,0]=4 2603 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 240690a_100000210953_100000702859 [1,1,0,0,0,0|2,0,0]=4 2604 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)Cl 527a_100000210953_100000702859 [1,1,0,0,0,0|2,0,0]=4 2605 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 11a_100000210953_100000023732 [1,1,0,0,0,0|2,0,0]=4 2606 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 1626a_100000210953_100000023732 [1,1,0,0,0,0|2,0,0]=4 2607 B15R1.8312 CC(C)CNC(=O)c1c(cccc1I)F 240690a_100000210953_100000023732 [1,1,0,0,0,0|2,0,0]=4 2608 B15R1.8312 CC(C)CNC(=O)c1c(cccc1O)O 527a_100000210953_100000755285 [1,1,0,0,0,0|2,0,0]=4 2609 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)Br 1458a_100000701904_100000210312 [1,1,0,0,0,0|1,0,0]=3 2610 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)C 1458a_100000758298_100000210312 [1,1,0,0,0,0|1,0,0]=3 2611 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)Cl 1458a_100000692601_100000210312 [1,1,0,0,0,0|1,0,0]=3 2612 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)F 1458a_100000762013_100000210312 [1,1,0,0,0,0|1,0,0]=3 2613 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)I 1458a_100000688020_100000210312 [1,1,0,0,0,0|1,0,0]=3 2614 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)O 1458a_100011934116_100000210312 [1,1,0,0,0,0|1,0,0]=3 2615 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Br 1458a_100000701904_100012276601 [1,1,0,0,0,0|2,0,0]=4 2616 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)C 1458a_100000758298_100012276601 [1,1,0,0,0,0|2,0,0]=4 2617 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)Cl 1458a_100000692601_100012276601 [1,1,0,0,0,0|2,0,0]=4 2618 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)F 1458a_100000762013_100012276601 [1,1,0,0,0,0|2,0,0]=4 2619 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)I 1458a_100000688020_100012276601 [1,1,0,0,0,0|2,0,0]=4 2620 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)O 1458a_100011934116_100012276601 [1,1,0,0,0,0|2,0,0]=4 2621 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 11a_100000210953_100000701904 [1,1,0,0,0,0|1,0,0]=3 2622 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 1626a_100000210953_100000701904 [1,1,0,0,0,0|1,0,0]=3 2623 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 240690a_100000210953_100000701904 [1,1,0,0,0,0|1,0,0]=3 2624 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Br 527a_100000210953_100000701904 [1,1,0,0,0,0|1,0,0]=3 2625 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 11a_100000210953_100000758298 [1,1,0,0,0,0|1,0,0]=3 2626 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 1626a_100000210953_100000758298 [1,1,0,0,0,0|1,0,0]=3 2627 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 240690a_100000210953_100000758298 [1,1,0,0,0,0|1,0,0]=3 2628 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 11a_100000210953_100000692601 [1,1,0,0,0,0|1,0,0]=3 2629 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 1626a_100000210953_100000692601 [1,1,0,0,0,0|1,0,0]=3 2630 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)Cl 240690a_100000210953_100000692601 [1,1,0,0,0,0|1,0,0]=3 2631 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 11a_100000210953_100000762013 [1,1,0,0,0,0|1,0,0]=3 2632 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 1626a_100000210953_100000762013 [1,1,0,0,0,0|1,0,0]=3 2633 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 240690a_100000210953_100000762013 [1,1,0,0,0,0|1,0,0]=3 2634 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)F 527a_100000210953_100000762013 [1,1,0,0,0,0|1,0,0]=3 2635 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 11a_100000210953_100000688020 [1,1,0,0,0,0|1,0,0]=3 2636 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 1626a_100000210953_100000688020 [1,1,0,0,0,0|1,0,0]=3 2637 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)I 240690a_100000210953_100000688020 [1,1,0,0,0,0|1,0,0]=3 2638 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 11a_100000210904_100000701904 [1,1,0,0,0,0|2,0,0]=4 2639 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 240690a_100000210904_100000701904 [1,1,0,0,0,0|2,0,0]=4 2640 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Br 527a_100000210904_100000701904 [1,1,0,0,0,0|2,0,0]=4 2641 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 11a_100000210904_100000758298 [1,1,0,0,0,0|2,0,0]=4 2642 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 240690a_100000210904_100000758298 [1,1,0,0,0,0|2,0,0]=4 2643 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Cl 11a_100000210904_100000692601 [1,1,0,0,0,0|2,0,0]=4 2644 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)Cl 240690a_100000210904_100000692601 [1,1,0,0,0,0|2,0,0]=4 2645 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 11a_100000210904_100000762013 [1,1,0,0,0,0|2,0,0]=4 2646 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 240690a_100000210904_100000762013 [1,1,0,0,0,0|2,0,0]=4 2647 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)F 527a_100000210904_100000762013 [1,1,0,0,0,0|2,0,0]=4 2648 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)I 11a_100000210904_100000688020 [1,1,0,0,0,0|2,0,0]=4 2649 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)I 240690a_100000210904_100000688020 [1,1,0,0,0,0|2,0,0]=4 2650 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)Br 22a_100000741168_100000701904 [1,1,0,0,0,0|2,0,0]=4 2651 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)C 22a_100000741168_100000758298 [1,1,0,0,0,0|2,0,0]=4 2652 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)Cl 22a_100000741168_100000692601 [1,1,0,0,0,0|2,0,0]=4 2653 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)F 22a_100000741168_100000762013 [1,1,0,0,0,0|2,0,0]=4 2654 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)I 22a_100000741168_100000688020 [1,1,0,0,0,0|2,0,0]=4 2655 B15R1.8312 Cc1cccc(c1C(=O)NNC(C)C)O 22a_100000741168_100011934116 [1,1,0,0,0,0|2,0,0]=4 2656 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 34a_200000695261_100000210624 [1,1,0,0,0,0|1,0,1]=4 2657 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 7a_200000695261_100000210760 [1,1,0,0,0,0|1,0,1]=4 2658 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)Br 1458a_100000690610_100000210312 [1,1,0,0,0,0|2,0,0]=4 2659 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_100000210312 [1,1,0,0,0,0|2,0,0]=4 2660 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)F 1458a_100000212315_100000210312 [1,1,0,0,0,0|2,0,0]=4 2661 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)I 1458a_100000698340_100000210312 [1,1,0,0,0,0|2,0,0]=4 2662 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Br)O 1458a_100012352043_100000210312 [1,1,0,0,0,0|2,0,0]=4 2663 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_100000210312 [1,1,0,0,0,0|2,0,0]=4 2664 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_100000210312 [1,1,0,0,0,0|2,0,0]=4 2665 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)F 1458a_100011219680_100000210312 [1,1,0,0,0,0|2,0,0]=4 2666 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)I 1458a_100000688013_100000210312 [1,1,0,0,0,0|2,0,0]=4 2667 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1Cl)O 1458a_100000719527_100000210312 [1,1,0,0,0,0|2,0,0]=4 2668 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)Br 1458a_100000212322_100000210312 [1,1,0,0,0,0|2,0,0]=4 2669 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)Cl 1458a_100000214954_100000210312 [1,1,0,0,0,0|2,0,0]=4 2670 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)F 1458a_100000198512_100000210312 [1,1,0,0,0,0|2,0,0]=4 2671 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)I 1458a_100000688014_100000210312 [1,1,0,0,0,0|2,0,0]=4 2672 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1F)O 1458a_100000037260_100000210312 [1,1,0,0,0,0|2,0,0]=4 2673 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)Br 1458a_100000183945_100000210312 [1,1,0,0,0,0|2,0,0]=4 2674 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)Cl 1458a_100000739379_100000210312 [1,1,0,0,0,0|2,0,0]=4 2675 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)F 1458a_100000748905_100000210312 [1,1,0,0,0,0|2,0,0]=4 2676 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)I 1458a_100000750460_100000210312 [1,1,0,0,0,0|2,0,0]=4 2677 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1I)O 1458a_200009995701_100000210312 [1,1,0,0,0,0|2,0,0]=4 2678 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Br 1458a_100000212140_100000210312 [1,1,0,0,0,0|2,0,0]=4 2679 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)Cl 1458a_100000212143_100000210312 [1,1,0,0,0,0|2,0,0]=4 2680 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)F 1458a_100000742286_100000210312 [1,1,0,0,0,0|2,0,0]=4 2681 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)I 1458a_100000212111_100000210312 [1,1,0,0,0,0|2,0,0]=4 2682 B15R1.8420 CC(C)CCC(=O)c1cc(ccc1O)O 1458a_100000758025_100000210312 [1,1,0,0,0,0|2,0,0]=4 2683 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 11a_100000210953_100000690610 [1,1,0,0,0,0|2,0,0]=4 2684 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 1626a_100000210953_100000690610 [1,1,0,0,0,0|2,0,0]=4 2685 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 240690a_100000210953_100000690610 [1,1,0,0,0,0|2,0,0]=4 2686 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Br 527a_100000210953_100000690610 [1,1,0,0,0,0|2,0,0]=4 2687 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 11a_100000210953_100000736951 [1,1,0,0,0,0|2,0,0]=4 2688 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 1626a_100000210953_100000736951 [1,1,0,0,0,0|2,0,0]=4 2689 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 240690a_100000210953_100000736951 [1,1,0,0,0,0|2,0,0]=4 2690 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)Cl 527a_100000210953_100000736951 [1,1,0,0,0,0|2,0,0]=4 2691 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 11a_100000210953_100000212315 [1,1,0,0,0,0|2,0,0]=4 2692 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 1626a_100000210953_100000212315 [1,1,0,0,0,0|2,0,0]=4 2693 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 240690a_100000210953_100000212315 [1,1,0,0,0,0|2,0,0]=4 2694 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)F 527a_100000210953_100000212315 [1,1,0,0,0,0|2,0,0]=4 2695 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 11a_100000210953_100000698340 [1,1,0,0,0,0|2,0,0]=4 2696 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 1626a_100000210953_100000698340 [1,1,0,0,0,0|2,0,0]=4 2697 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 240690a_100000210953_100000698340 [1,1,0,0,0,0|2,0,0]=4 2698 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)I 527a_100000210953_100000698340 [1,1,0,0,0,0|2,0,0]=4 2699 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)O 240690a_100000210953_100012352043 [1,1,0,0,0,0|2,0,0]=4 2700 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Br)O 527a_100000210953_100012352043 [1,1,0,0,0,0|2,0,0]=4 2701 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 11a_100000210953_100000211212 [1,1,0,0,0,0|2,0,0]=4 2702 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 1626a_100000210953_100000211212 [1,1,0,0,0,0|2,0,0]=4 2703 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 240690a_100000210953_100000211212 [1,1,0,0,0,0|2,0,0]=4 2704 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Br 527a_100000210953_100000211212 [1,1,0,0,0,0|2,0,0]=4 2705 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 11a_100000210953_100000210642 [1,1,0,0,0,0|2,0,0]=4 2706 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 1626a_100000210953_100000210642 [1,1,0,0,0,0|2,0,0]=4 2707 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 240690a_100000210953_100000210642 [1,1,0,0,0,0|2,0,0]=4 2708 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)Cl 527a_100000210953_100000210642 [1,1,0,0,0,0|2,0,0]=4 2709 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 11a_100000210953_100011219680 [1,1,0,0,0,0|2,0,0]=4 2710 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 1626a_100000210953_100011219680 [1,1,0,0,0,0|2,0,0]=4 2711 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 240690a_100000210953_100011219680 [1,1,0,0,0,0|2,0,0]=4 2712 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)F 527a_100000210953_100011219680 [1,1,0,0,0,0|2,0,0]=4 2713 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 11a_100000210953_100000688013 [1,1,0,0,0,0|2,0,0]=4 2714 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 1626a_100000210953_100000688013 [1,1,0,0,0,0|2,0,0]=4 2715 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 240690a_100000210953_100000688013 [1,1,0,0,0,0|2,0,0]=4 2716 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)I 527a_100000210953_100000688013 [1,1,0,0,0,0|2,0,0]=4 2717 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)O 240690a_100000210953_100000719527 [1,1,0,0,0,0|2,0,0]=4 2718 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1Cl)O 527a_100000210953_100000719527 [1,1,0,0,0,0|2,0,0]=4 2719 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 11a_100000210953_100000212322 [1,1,0,0,0,0|2,0,0]=4 2720 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 1626a_100000210953_100000212322 [1,1,0,0,0,0|2,0,0]=4 2721 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 240690a_100000210953_100000212322 [1,1,0,0,0,0|2,0,0]=4 2722 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Br 527a_100000210953_100000212322 [1,1,0,0,0,0|2,0,0]=4 2723 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 11a_100000210953_100000214954 [1,1,0,0,0,0|2,0,0]=4 2724 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 1626a_100000210953_100000214954 [1,1,0,0,0,0|2,0,0]=4 2725 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 240690a_100000210953_100000214954 [1,1,0,0,0,0|2,0,0]=4 2726 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)Cl 527a_100000210953_100000214954 [1,1,0,0,0,0|2,0,0]=4 2727 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 11a_100000210953_100000198512 [1,1,0,0,0,0|2,0,0]=4 2728 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 1626a_100000210953_100000198512 [1,1,0,0,0,0|2,0,0]=4 2729 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 240690a_100000210953_100000198512 [1,1,0,0,0,0|2,0,0]=4 2730 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)F 527a_100000210953_100000198512 [1,1,0,0,0,0|2,0,0]=4 2731 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 11a_100000210953_100000688014 [1,1,0,0,0,0|2,0,0]=4 2732 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 1626a_100000210953_100000688014 [1,1,0,0,0,0|2,0,0]=4 2733 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 240690a_100000210953_100000688014 [1,1,0,0,0,0|2,0,0]=4 2734 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)I 527a_100000210953_100000688014 [1,1,0,0,0,0|2,0,0]=4 2735 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)O 240690a_100000210953_100000037260 [1,1,0,0,0,0|2,0,0]=4 2736 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1F)O 527a_100000210953_100000037260 [1,1,0,0,0,0|2,0,0]=4 2737 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 11a_100000210953_100000183945 [1,1,0,0,0,0|2,0,0]=4 2738 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 1626a_100000210953_100000183945 [1,1,0,0,0,0|2,0,0]=4 2739 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Br 240690a_100000210953_100000183945 [1,1,0,0,0,0|2,0,0]=4 2740 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 11a_100000210953_100000739379 [1,1,0,0,0,0|2,0,0]=4 2741 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 1626a_100000210953_100000739379 [1,1,0,0,0,0|2,0,0]=4 2742 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 240690a_100000210953_100000739379 [1,1,0,0,0,0|2,0,0]=4 2743 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)Cl 527a_100000210953_100000739379 [1,1,0,0,0,0|2,0,0]=4 2744 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 11a_100000210953_100000748905 [1,1,0,0,0,0|2,0,0]=4 2745 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 1626a_100000210953_100000748905 [1,1,0,0,0,0|2,0,0]=4 2746 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 240690a_100000210953_100000748905 [1,1,0,0,0,0|2,0,0]=4 2747 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)F 527a_100000210953_100000748905 [1,1,0,0,0,0|2,0,0]=4 2748 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 11a_100000210953_100000750460 [1,1,0,0,0,0|2,0,0]=4 2749 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 1626a_100000210953_100000750460 [1,1,0,0,0,0|2,0,0]=4 2750 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 240690a_100000210953_100000750460 [1,1,0,0,0,0|2,0,0]=4 2751 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)I 527a_100000210953_100000750460 [1,1,0,0,0,0|2,0,0]=4 2752 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 1626a_100000210953_200009995701 [1,1,0,0,0,0|2,0,0]=4 2753 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 240690a_100000210953_200009995701 [1,1,0,0,0,0|2,0,0]=4 2754 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1I)O 527a_100000210953_200009995701 [1,1,0,0,0,0|2,0,0]=4 2755 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 1626a_100000210953_100000212140 [1,1,0,0,0,0|2,0,0]=4 2756 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 240690a_100000210953_100000212140 [1,1,0,0,0,0|2,0,0]=4 2757 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Br 527a_100000210953_100000212140 [1,1,0,0,0,0|2,0,0]=4 2758 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 11a_100000210953_100000212143 [1,1,0,0,0,0|2,0,0]=4 2759 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 1626a_100000210953_100000212143 [1,1,0,0,0,0|2,0,0]=4 2760 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 240690a_100000210953_100000212143 [1,1,0,0,0,0|2,0,0]=4 2761 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)Cl 527a_100000210953_100000212143 [1,1,0,0,0,0|2,0,0]=4 2762 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 240690a_100000210953_100000742286 [1,1,0,0,0,0|2,0,0]=4 2763 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 271570a_203496583355_200000205877 [1,1,0,0,0,0|2,0,0]=4 2764 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)F 527a_100000210953_100000742286 [1,1,0,0,0,0|2,0,0]=4 2765 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)I 240690a_100000210953_100000212111 [1,1,0,0,0,0|2,0,0]=4 2766 B15R1.8420 CC(C)CNC(=O)c1cc(ccc1O)I 527a_100000210953_100000212111 [1,1,0,0,0,0|2,0,0]=4 2767 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)Br 1458a_100000689033_100000210312 [1,1,0,0,0,0|2,0,0]=4 2768 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)C 1458a_100000195421_100000210312 [1,1,0,0,0,0|1,0,0]=3 2769 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)Cl 1458a_100011290873_100000210312 [1,1,0,0,0,0|2,0,0]=4 2770 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)F 1458a_100000749327_100000210312 [1,1,0,0,0,0|2,0,0]=4 2771 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)I 1458a_100000057929_100000210312 [1,1,0,0,0,0|2,0,0]=4 2772 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)C)O 1458a_100000229998_100000210312 [1,1,0,0,0,0|2,0,0]=4 2773 B15R1.8420 Cc1ccc(c(c1)C(=O)CCC(C)O)C 1458a_100000195421_100012276601 [1,1,0,0,0,0|2,0,0]=4 2774 B15R1.8420 Cc1ccc(c(c1)C(=O)CNC(C)C)C 2230a_100138425928_100000183774 [1,1,0,0,0,0|2,0,0]=4 2775 B15R1.8420 Cc1ccc(c(c1)C(=O)CNC(C)C)C 34a_100138425928_100000183774 [1,1,0,0,0,0|2,0,0]=4 2776 B15R1.8420 Cc1ccc(c(c1)C(=O)COC(C)C)C 34a_100000212225_100000183774 [1,1,0,0,0,0|2,0,0]=4 2777 B15R1.8420 Cc1ccc(c(c1)C(=O)CSC(C)C)C 62a_100000183774_100000210206 [1,1,0,0,0,0|2,0,0]=4 2778 B15R1.8420 Cc1ccc(c(c1)C(=O)CSC(C)C)C 62a_100000210206_100000183774 [1,1,0,0,0,0|2,0,0]=4 2779 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 11a_100000210953_100000689033 [1,1,0,0,0,0|2,0,0]=4 2780 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 1626a_100000210953_100000689033 [1,1,0,0,0,0|2,0,0]=4 2781 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 240690a_100000210953_100000689033 [1,1,0,0,0,0|2,0,0]=4 2782 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Br 527a_100000210953_100000689033 [1,1,0,0,0,0|2,0,0]=4 2783 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 11a_100000210953_100000195421 [1,1,0,0,0,0|1,0,0]=3 2784 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 1626a_100000210953_100000195421 [1,1,0,0,0,0|1,0,0]=3 2785 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 240690a_100000210953_100000195421 [1,1,0,0,0,0|1,0,0]=3 2786 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)C 527a_100000210953_100000195421 [1,1,0,0,0,0|1,0,0]=3 2787 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 11a_100000210953_100011290873 [1,1,0,0,0,0|2,0,0]=4 2788 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 1626a_100000210953_100011290873 [1,1,0,0,0,0|2,0,0]=4 2789 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 240690a_100000210953_100011290873 [1,1,0,0,0,0|2,0,0]=4 2790 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)Cl 527a_100000210953_100011290873 [1,1,0,0,0,0|2,0,0]=4 2791 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 11a_100000210953_100000749327 [1,1,0,0,0,0|2,0,0]=4 2792 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 1626a_100000210953_100000749327 [1,1,0,0,0,0|2,0,0]=4 2793 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 240690a_100000210953_100000749327 [1,1,0,0,0,0|2,0,0]=4 2794 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)F 527a_100000210953_100000749327 [1,1,0,0,0,0|2,0,0]=4 2795 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 11a_100000210953_100000057929 [1,1,0,0,0,0|2,0,0]=4 2796 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 1626a_100000210953_100000057929 [1,1,0,0,0,0|2,0,0]=4 2797 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 240690a_100000210953_100000057929 [1,1,0,0,0,0|2,0,0]=4 2798 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)I 527a_100000210953_100000057929 [1,1,0,0,0,0|2,0,0]=4 2799 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)O 240690a_100000210953_100000229998 [1,1,0,0,0,0|2,0,0]=4 2800 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)C)O 527a_100000210953_100000229998 [1,1,0,0,0,0|2,0,0]=4 2801 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 11a_100000210904_100000195421 [1,1,0,0,0,0|2,0,0]=4 2802 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 240690a_100000210904_100000195421 [1,1,0,0,0,0|2,0,0]=4 2803 B15R1.8420 Cc1ccc(c(c1)C(=O)NCC(C)O)C 527a_100000210904_100000195421 [1,1,0,0,0,0|2,0,0]=4 2804 B15R1.8420 Cc1ccc(c(c1)C(=O)NNC(C)C)C 22a_100000741168_100000195421 [1,1,0,0,0,0|2,0,0]=4 2805 B15R1.8420 Cc1ccc(c(c1)C(C)OCC(C)C)C 34a_200000246511_100000210624 [1,1,0,0,0,0|1,0,1]=4 2806 B15R1.8420 Cc1ccc(c(c1)C(C)OCC(C)C)C 7a_200000246511_100000210760 [1,1,0,0,0,0|1,0,1]=4 2807 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)Br 1458a_100000759961_100000210312 [1,1,0,0,0,0|1,0,0]=3 2808 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)Cl 1458a_100000692595_100000210312 [1,1,0,0,0,0|1,0,0]=3 2809 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)F 1458a_100000240043_100000210312 [1,1,0,0,0,0|1,0,0]=3 2810 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)I 1458a_100000688012_100000210312 [1,1,0,0,0,0|1,0,0]=3 2811 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)C)O 1458a_100000687834_100000210312 [1,1,0,0,0,0|1,0,0]=3 2812 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Br 1458a_100000759961_100012276601 [1,1,0,0,0,0|2,0,0]=4 2813 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)Cl 1458a_100000692595_100012276601 [1,1,0,0,0,0|2,0,0]=4 2814 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)F 1458a_100000240043_100012276601 [1,1,0,0,0,0|2,0,0]=4 2815 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)I 1458a_100000688012_100012276601 [1,1,0,0,0,0|2,0,0]=4 2816 B15R1.8420 Cc1ccc(cc1C(=O)CCC(C)O)O 1458a_100000687834_100012276601 [1,1,0,0,0,0|2,0,0]=4 2817 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 11a_100000210953_100000759961 [1,1,0,0,0,0|1,0,0]=3 2818 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 1626a_100000210953_100000759961 [1,1,0,0,0,0|1,0,0]=3 2819 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 240690a_100000210953_100000759961 [1,1,0,0,0,0|1,0,0]=3 2820 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Br 527a_100000210953_100000759961 [1,1,0,0,0,0|1,0,0]=3 2821 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 11a_100000210953_100000692595 [1,1,0,0,0,0|1,0,0]=3 2822 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 1626a_100000210953_100000692595 [1,1,0,0,0,0|1,0,0]=3 2823 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 240690a_100000210953_100000692595 [1,1,0,0,0,0|1,0,0]=3 2824 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)Cl 527a_100000210953_100000692595 [1,1,0,0,0,0|1,0,0]=3 2825 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 11a_100000210953_100000240043 [1,1,0,0,0,0|1,0,0]=3 2826 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 1626a_100000210953_100000240043 [1,1,0,0,0,0|1,0,0]=3 2827 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 240690a_100000210953_100000240043 [1,1,0,0,0,0|1,0,0]=3 2828 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)F 527a_100000210953_100000240043 [1,1,0,0,0,0|1,0,0]=3 2829 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 11a_100000210953_100000688012 [1,1,0,0,0,0|1,0,0]=3 2830 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 1626a_100000210953_100000688012 [1,1,0,0,0,0|1,0,0]=3 2831 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 240690a_100000210953_100000688012 [1,1,0,0,0,0|1,0,0]=3 2832 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)I 527a_100000210953_100000688012 [1,1,0,0,0,0|1,0,0]=3 2833 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)C)O 240690a_100000210953_100000687834 [1,1,0,0,0,0|1,0,0]=3 2834 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 11a_100000210904_100000759961 [1,1,0,0,0,0|2,0,0]=4 2835 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 240690a_100000210904_100000759961 [1,1,0,0,0,0|2,0,0]=4 2836 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Br 527a_100000210904_100000759961 [1,1,0,0,0,0|2,0,0]=4 2837 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 11a_100000210904_100000692595 [1,1,0,0,0,0|2,0,0]=4 2838 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 240690a_100000210904_100000692595 [1,1,0,0,0,0|2,0,0]=4 2839 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)Cl 527a_100000210904_100000692595 [1,1,0,0,0,0|2,0,0]=4 2840 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 11a_100000210904_100000240043 [1,1,0,0,0,0|2,0,0]=4 2841 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 240690a_100000210904_100000240043 [1,1,0,0,0,0|2,0,0]=4 2842 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)F 527a_100000210904_100000240043 [1,1,0,0,0,0|2,0,0]=4 2843 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 11a_100000210904_100000688012 [1,1,0,0,0,0|2,0,0]=4 2844 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 240690a_100000210904_100000688012 [1,1,0,0,0,0|2,0,0]=4 2845 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)I 527a_100000210904_100000688012 [1,1,0,0,0,0|2,0,0]=4 2846 B15R1.8420 Cc1ccc(cc1C(=O)NCC(C)O)O 240690a_100000210904_100000687834 [1,1,0,0,0,0|2,0,0]=4 2847 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)Br 22a_100000741168_100000759961 [1,1,0,0,0,0|2,0,0]=4 2848 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)Cl 22a_100000741168_100000692595 [1,1,0,0,0,0|2,0,0]=4 2849 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)F 22a_100000741168_100000240043 [1,1,0,0,0,0|2,0,0]=4 2850 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)I 22a_100000741168_100000688012 [1,1,0,0,0,0|2,0,0]=4 2851 B15R1.8420 Cc1ccc(cc1C(=O)NNC(C)C)O 22a_100000741168_100000687834 [1,1,0,0,0,0|2,0,0]=4 2852 B15R1.8420 Cc1ccc(cc1C(C)OCC(C)C)Cl 34a_100012002745_100000210624 [1,1,0,0,0,0|1,0,1]=4 2853 B15R1.8420 Cc1ccc(cc1C(C)OCC(C)C)Cl 7a_100012002745_100000210760 [1,1,0,0,0,0|1,0,1]=4 2854 B15R1.1209 CCCCC(=O)c1cc(ccc1CC)Br 1458a_100012343961_100000210211 [1,1,0,0,0,0|2,0,0]=4 2855 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)Br 1458a_100000188853_100000210211 [1,1,0,0,0,0|2,0,0]=4 2856 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)C 1458a_100000204667_100000210211 [1,1,0,0,0,0|2,0,0]=4 2857 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)Cl 1458a_100000211409_100000210211 [1,1,0,0,0,0|2,0,0]=4 2858 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)F 1458a_100000735445_100000210211 [1,1,0,0,0,0|2,0,0]=4 2859 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)I 1458a_100000230898_100000210211 [1,1,0,0,0,0|2,0,0]=4 2860 B15R1.1209 CCCCC(=O)c1cc(ccc1OC)O 1458a_200000100057_100000210211 [1,1,0,0,0,0|2,0,0]=4 2861 B15R1.1209 CCCNC(=O)c1cc(ccc1CC)Br 11a_100020643023_100012343961 [1,1,0,0,0,0|2,0,0]=4 2862 B15R1.1209 CCCNC(=O)c1cc(ccc1CC)Br 1626a_100020643023_100012343961 [1,1,0,0,0,0|2,0,0]=4 2863 B15R1.1209 CCCNC(=O)c1cc(ccc1CC)Br 240690a_100020643023_100012343961 [1,1,0,0,0,0|2,0,0]=4 2864 B15R1.1209 CCCNC(=O)c1cc(ccc1CC)Br 527a_100020643023_100012343961 [1,1,0,0,0,0|2,0,0]=4 2865 B15R1.1209 CCCNC(=O)c1cc(ccc1NC)F 34a_100011257930_200000210301 [1,1,0,0,0,0|1,0,0]=3 2866 B15R1.1209 CCCNC(=O)c1cc(ccc1NC)F 7a_100011257930_200000210301 [1,1,0,0,0,0|1,0,0]=3 2867 B15R1.1209 CCCNC(=O)c1cc(ccc1N[13CH3])F 34a_100011257930_200025704644 [1,1,0,0,0,0|1,0,0]=3 2868 B15R1.1209 CCCNC(=O)c1cc(ccc1N[13CH3])F 7a_100011257930_200025704644 [1,1,0,0,0,0|1,0,0]=3 2869 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Br 11a_100020643023_100000188853 [1,1,0,0,0,0|2,0,0]=4 2870 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Br 1626a_100020643023_100000188853 [1,1,0,0,0,0|2,0,0]=4 2871 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Br 240690a_100020643023_100000188853 [1,1,0,0,0,0|2,0,0]=4 2872 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Br 527a_100020643023_100000188853 [1,1,0,0,0,0|2,0,0]=4 2873 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)C 11a_100020643023_100000204667 [1,1,0,0,0,0|2,0,0]=4 2874 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)C 1626a_100020643023_100000204667 [1,1,0,0,0,0|2,0,0]=4 2875 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)C 240690a_100020643023_100000204667 [1,1,0,0,0,0|2,0,0]=4 2876 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)C 527a_100020643023_100000204667 [1,1,0,0,0,0|2,0,0]=4 2877 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Cl 11a_100020643023_100000211409 [1,1,0,0,0,0|2,0,0]=4 2878 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Cl 1626a_100020643023_100000211409 [1,1,0,0,0,0|2,0,0]=4 2879 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Cl 240690a_100020643023_100000211409 [1,1,0,0,0,0|2,0,0]=4 2880 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)Cl 527a_100020643023_100000211409 [1,1,0,0,0,0|2,0,0]=4 2881 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)F 11a_100020643023_100000735445 [1,1,0,0,0,0|2,0,0]=4 2882 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)F 1626a_100020643023_100000735445 [1,1,0,0,0,0|2,0,0]=4 2883 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)F 240690a_100020643023_100000735445 [1,1,0,0,0,0|2,0,0]=4 2884 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)F 527a_100020643023_100000735445 [1,1,0,0,0,0|2,0,0]=4 2885 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)I 11a_100020643023_100000230898 [1,1,0,0,0,0|2,0,0]=4 2886 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)I 1626a_100020643023_100000230898 [1,1,0,0,0,0|2,0,0]=4 2887 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)I 240690a_100020643023_100000230898 [1,1,0,0,0,0|2,0,0]=4 2888 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)I 527a_100020643023_100000230898 [1,1,0,0,0,0|2,0,0]=4 2889 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)O 240690a_100020643023_200000100057 [1,1,0,0,0,0|2,0,0]=4 2890 B15R1.1209 CCCNC(=O)c1cc(ccc1OC)O 527a_100020643023_200000100057 [1,1,0,0,0,0|2,0,0]=4 2891 B15R1.1209 CNc1ccc(cc1C(=O)NCCO)F 27a_100102657272_200000206141 [1,1,0,0,0,0|2,0,0]=4 2892 B15R1.1239 C=C(C)c1ccccc1C(=O)NCCC 271570a_100000694244_200000152266 [1,1,0,0,0,0|2,0,0]=4 2893 B15R1.1239 CCCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210211 [1,1,0,0,0,0|2,0,0]=4 2894 B15R1.1239 CCCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210211 [1,1,0,0,0,0|1,0,0]=3 2895 B15R1.1239 CCCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210211 [1,1,0,0,0,0|2,0,0]=4 2896 B15R1.1239 CCCNC(=O)c1ccccc1C(C)C 11a_100020643023_100011941426 [1,1,0,0,0,0|2,0,0]=4 2897 B15R1.1239 CCCNC(=O)c1ccccc1C(C)C 1626a_100020643023_100011941426 [1,1,0,0,0,0|2,0,0]=4 2898 B15R1.1239 CCCNC(=O)c1ccccc1C(C)C 240690a_100020643023_100011941426 [1,1,0,0,0,0|2,0,0]=4 2899 B15R1.1239 CCCNC(=O)c1ccccc1C(C)C 527a_100020643023_100011941426 [1,1,0,0,0,0|2,0,0]=4 2900 B15R1.1239 CCCNC(=O)c1ccccc1N(C)C 11a_100020643023_100011218752 [1,1,0,0,0,0|1,0,0]=3 2901 B15R1.1239 CCCNC(=O)c1ccccc1N(C)C 1626a_100020643023_100011218752 [1,1,0,0,0,0|1,0,0]=3 2902 B15R1.1239 CCCNC(=O)c1ccccc1N(C)C 240690a_100020643023_100011218752 [1,1,0,0,0,0|1,0,0]=3 2903 B15R1.1239 CCCNC(=O)c1ccccc1N(C)C 27a_100102631434_200000152266 [1,1,0,0,0,0|1,0,0]=3 2904 B15R1.1239 CCCNC(=O)c1ccccc1N(C)C 527a_100020643023_100011218752 [1,1,0,0,0,0|1,0,0]=3 2905 B15R1.1239 CCCNC(=O)c1ccccc1S(=O)C 1626a_100020643023_100000204632 [1,1,0,0,0,0|2,0,0]=4 2906 B15R1.1239 CCCNC(=O)c1ccccc1S(=O)C 240690a_100020643023_100000204632 [1,1,0,0,0,0|2,0,0]=4 2907 B15R1.1239 CCCNC(=O)c1cccnc1N(C)C 27a_100102631434_100000161721 [1,1,0,0,0,0|2,0,0]=4 2908 B15R1.1239 CCNNC(=O)c1ccccc1N(C)C 22a_100000756455_100011218752 [1,1,0,0,0,0|2,0,0]=4 2909 B15R1.1239 CN(C)c1ccccc1C(=O)CCCF 1458a_100011218752_100011934791 [1,1,0,0,0,0|2,0,0]=4 2910 B15R1.1239 CN(C)c1ccccc1C(=O)CCCO 1458a_100011218752_100011215043 [1,1,0,0,0,0|2,0,0]=4 2911 B15R1.1239 CN(C)c1ccccc1C(=O)NCCF 11a_100000724931_100011218752 [1,1,0,0,0,0|2,0,0]=4 2912 B15R1.1239 CN(C)c1ccccc1C(=O)NCCF 1626a_100000724931_100011218752 [1,1,0,0,0,0|2,0,0]=4 2913 B15R1.1239 CN(C)c1ccccc1C(=O)NCCF 240690a_100000724931_100011218752 [1,1,0,0,0,0|2,0,0]=4 2914 B15R1.1239 CN(C)c1ccccc1C(=O)NCCF 527a_100000724931_100011218752 [1,1,0,0,0,0|2,0,0]=4 2915 B15R1.1239 CN(C)c1ccccc1C(=O)NCCO 240690a_100000210304_100011218752 [1,1,0,0,0,0|2,0,0]=4 2916 B15R1.1239 CN(C)c1ccccc1C(=O)NCCO 27a_100102631434_200000158863 [1,1,0,0,0,0|2,0,0]=4 2917 B15R1.1239 CN(C)c1ccccc1C(=O)NCCO 527a_100000210304_100011218752 [1,1,0,0,0,0|2,0,0]=4 2918 B15R1.1239 COCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000233755 [1,1,0,0,0,0|2,0,0]=4 2919 B15R1.1239 CSCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000751147 [1,1,0,0,0,0|2,0,0]=4 2920 B15R1.1240 CC=Cc1ccccc1C(=O)NCCC 271570a_100016259895_200000152266 [1,1,0,0,0,0|2,0,0]=4 2921 B15R1.1240 CCCCC(=O)c1ccccc1COC 1458a_100000737999_100000210211 [1,1,0,0,0,0|2,0,0]=4 2922 B15R1.1240 CCCCC(=O)c1ccccc1OCC 1458a_100000211144_100000210211 [1,1,0,0,0,0|2,0,0]=4 2923 B15R1.1240 CCCCC(=O)c1ccccc1SCC 1458a_100000195471_100000210211 [1,1,0,0,0,0|2,0,0]=4 2924 B15R1.1240 CCCNC(=O)c1ccccc1COC 11a_100020643023_100000737999 [1,1,0,0,0,0|2,0,0]=4 2925 B15R1.1240 CCCNC(=O)c1ccccc1COC 1626a_100020643023_100000737999 [1,1,0,0,0,0|2,0,0]=4 2926 B15R1.1240 CCCNC(=O)c1ccccc1COC 240690a_100020643023_100000737999 [1,1,0,0,0,0|2,0,0]=4 2927 B15R1.1240 CCCNC(=O)c1ccccc1COC 527a_100020643023_100000737999 [1,1,0,0,0,0|2,0,0]=4 2928 B15R1.1240 CCCNC(=O)c1ccccc1NCC 27a_100015525214_200000152266 [1,1,0,0,0,0|1,0,0]=3 2929 B15R1.1240 CCCNC(=O)c1ccccc1NCC 34a_100000181257_100000210202 [1,1,0,0,0,0|1,0,0]=3 2930 B15R1.1240 CCCNC(=O)c1ccccc1NCF 34a_100000181257_100015361967 [1,1,0,0,0,0|1,0,0]=3 2931 B15R1.1240 CCCNC(=O)c1ccccc1OCC 11a_100020643023_100000211144 [1,1,0,0,0,0|2,0,0]=4 2932 B15R1.1240 CCCNC(=O)c1ccccc1OCC 1626a_100020643023_100000211144 [1,1,0,0,0,0|2,0,0]=4 2933 B15R1.1240 CCCNC(=O)c1ccccc1OCC 240690a_100020643023_100000211144 [1,1,0,0,0,0|2,0,0]=4 2934 B15R1.1240 CCCNC(=O)c1ccccc1OCC 527a_100020643023_100000211144 [1,1,0,0,0,0|2,0,0]=4 2935 B15R1.1240 CCCNC(=O)c1ccccc1SCC 11a_100020643023_100000195471 [1,1,0,0,0,0|2,0,0]=4 2936 B15R1.1240 CCCNC(=O)c1ccccc1SCC 1626a_100020643023_100000195471 [1,1,0,0,0,0|2,0,0]=4 2937 B15R1.1240 CCCNC(=O)c1ccccc1SCC 240690a_100020643023_100000195471 [1,1,0,0,0,0|2,0,0]=4 2938 B15R1.1240 CCCNC(=O)c1ccccc1SCC 527a_100020643023_100000195471 [1,1,0,0,0,0|2,0,0]=4 2939 B15R1.1240 CCCNC(=O)c1ccccc1SCC 62a_100000210202_200000152266 [1,1,0,0,0,0|2,0,0]=4 2940 B15R1.1240 CCCNC(=O)c1ccccc1SCC 62a_200000152266_100000210202 [1,1,0,0,0,0|2,0,0]=4 2941 B15R1.1240 CCCNC(=O)c1ccccc1SCF 62a_100015361967_200000152266 [1,1,0,0,0,0|2,0,0]=4 2942 B15R1.1240 CCCNC(=O)c1ccccc1SCF 62a_200000152266_100015361967 [1,1,0,0,0,0|2,0,0]=4 2943 B15R1.1240 CCCNC(=O)c1cccnc1NCC 27a_100015525214_100000161721 [1,1,0,0,0,0|2,0,0]=4 2944 B15R1.1240 CCCOC(=O)c1ccccc1OCC 7a_100000169924_100000210202 [1,1,0,0,0,0|1,0,0]=3 2945 B15R1.1240 CCCOC(=O)c1ccccc1OCF 7a_100000169924_100015361967 [1,1,0,0,0,0|1,0,0]=3 2946 B15R1.1240 CCNc1ccccc1C(=O)NCCO 27a_100015525214_200000158863 [1,1,0,0,0,0|2,0,0]=4 2947 B15R1.1240 CCOc1ccccc1C(=O)OCCO 7a_100000229999_100000210202 [1,1,0,0,0,0|2,0,0]=4 2948 B15R1.1240 O=C(OCCO)c1ccccc1OCF 7a_100000229999_100015361967 [1,1,0,0,0,0|2,0,0]=4 2949 B15R1.1402 CCCCCC(=O)c1ccccc1CC 1458a_100000689120_100000210326 [1,1,0,0,0,0|2,0,0]=4 2950 B15R1.1402 CCCCCC(=O)c1ccccc1OC 1458a_100000185835_100000210326 [1,1,0,0,0,0|2,0,0]=4 2951 B15R1.1402 CCCCCC(=O)c1ccccc1SC 1458a_100000183967_100000210326 [1,1,0,0,0,0|2,0,0]=4 2952 B15R1.1402 CCCCNC(=O)c1ccccc1CC 11a_100000102301_100000689120 [1,1,0,0,0,0|2,0,0]=4 2953 B15R1.1402 CCCCNC(=O)c1ccccc1CC 1626a_100000102301_100000689120 [1,1,0,0,0,0|2,0,0]=4 2954 B15R1.1402 CCCCNC(=O)c1ccccc1CC 240690a_100000102301_100000689120 [1,1,0,0,0,0|2,0,0]=4 2955 B15R1.1402 CCCCNC(=O)c1ccccc1CC 527a_100000102301_100000689120 [1,1,0,0,0,0|2,0,0]=4 2956 B15R1.1402 CCCCNC(=O)c1ccccc1NC 2230a_100000243867_200000210301 [1,1,0,0,0,0|1,0,0]=3 2957 B15R1.1402 CCCCNC(=O)c1ccccc1NC 27a_100102657272_200000154865 [1,1,0,0,0,0|1,0,0]=3 2958 B15R1.1402 CCCCNC(=O)c1ccccc1NC 34a_100000243867_200000210301 [1,1,0,0,0,0|1,0,0]=3 2959 B15R1.1402 CCCCNC(=O)c1ccccc1N[13CH3] 2230a_100000243867_200025704644 [1,1,0,0,0,0|1,0,0]=3 2960 B15R1.1402 CCCCNC(=O)c1ccccc1N[13CH3] 34a_100000243867_200025704644 [1,1,0,0,0,0|1,0,0]=3 2961 B15R1.1402 CCCCNC(=O)c1ccccc1OC 11a_100000102301_100000185835 [1,1,0,0,0,0|2,0,0]=4 2962 B15R1.1402 CCCCNC(=O)c1ccccc1OC 1626a_100000102301_100000185835 [1,1,0,0,0,0|2,0,0]=4 2963 B15R1.1402 CCCCNC(=O)c1ccccc1OC 240690a_100000102301_100000185835 [1,1,0,0,0,0|2,0,0]=4 2964 B15R1.1402 CCCCNC(=O)c1ccccc1OC 527a_100000102301_100000185835 [1,1,0,0,0,0|2,0,0]=4 2965 B15R1.1402 CCCCNC(=O)c1ccccc1SC 11a_100000102301_100000183967 [1,1,0,0,0,0|2,0,0]=4 2966 B15R1.1402 CCCCNC(=O)c1ccccc1SC 1626a_100000102301_100000183967 [1,1,0,0,0,0|2,0,0]=4 2967 B15R1.1402 CCCCNC(=O)c1ccccc1SC 240690a_100000102301_100000183967 [1,1,0,0,0,0|2,0,0]=4 2968 B15R1.1402 CCCCNC(=O)c1ccccc1SC 527a_100000102301_100000183967 [1,1,0,0,0,0|2,0,0]=4 2969 B15R1.1402 CCCCNC(=O)c1ccccc1SC 62a_200000154865_200000210301 [1,1,0,0,0,0|2,0,0]=4 2970 B15R1.1402 CCCCNC(=O)c1ccccc1SC 62a_200000210301_200000154865 [1,1,0,0,0,0|2,0,0]=4 2971 B15R1.1402 CCCCNC(=O)c1ccccc1S[13CH3] 62a_200000154865_200025704644 [1,1,0,0,0,0|2,0,0]=4 2972 B15R1.1402 CCCCNC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000154865 [1,1,0,0,0,0|2,0,0]=4 2973 B15R1.1402 CCCCOC(=O)c1ccccc1OC 7a_100011204317_200000210301 [1,1,0,0,0,0|1,0,0]=3 2974 B15R1.1402 CCCCOC(=O)c1ccccc1O[13CH3] 7a_100011204317_200025704644 [1,1,0,0,0,0|1,0,0]=3 2975 B15R1.1402 CCCNN=C(C)c1ccccc1NC 4a_100000740057_100000020593 [1,1,0,0,0,0|2,0,0]=4 2976 B15R1.1402 CCCNNC(=O)c1ccccc1CC 22a_100000740057_100000689120 [1,1,0,0,0,0|2,0,0]=4 2977 B15R1.1402 CCCNNC(=O)c1ccccc1OC 22a_100000740057_100000185835 [1,1,0,0,0,0|2,0,0]=4 2978 B15R1.1402 CCCNNC(=O)c1ccccc1SC 22a_100000740057_100000183967 [1,1,0,0,0,0|2,0,0]=4 2979 B15R1.1402 CCCOCC(=O)c1ccccc1OC 34a_100000210258_100000195505 [1,1,0,0,0,0|1,0,0]=3 2980 B15R1.1402 CCCSCC(=O)c1ccccc1OC 62a_100000195505_100000210303 [1,1,0,0,0,0|1,1,0]=4 2981 B15R1.1402 CCOCCC(=O)c1ccccc1CC 1458a_100000689120_100011215890 [1,1,0,0,0,0|2,0,0]=4 2982 B15R1.1402 CCOCCC(=O)c1ccccc1OC 1458a_100000185835_100011215890 [1,1,0,0,0,0|2,0,0]=4 2983 B15R1.1402 CCOCCC(=O)c1ccccc1SC 1458a_100000183967_100011215890 [1,1,0,0,0,0|2,0,0]=4 2984 B15R1.1402 CCSCCC(=O)c1ccccc1CC 1458a_100000689120_100000757381 [1,1,0,0,0,0|2,0,0]=4 2985 B15R1.1402 CCSCCC(=O)c1ccccc1OC 1458a_100000185835_100000757381 [1,1,0,0,0,0|2,0,0]=4 2986 B15R1.1402 CCSCCC(=O)c1ccccc1SC 1458a_100000183967_100000757381 [1,1,0,0,0,0|2,0,0]=4 2987 B15R1.1402 CCc1ccccc1C(=O)CCCCF 1458a_100000689120_100000729493 [1,1,0,0,0,0|2,0,0]=4 2988 B15R1.1402 CCc1ccccc1C(=O)CCCCO 1458a_100000689120_100000210776 [1,1,0,0,0,0|2,0,0]=4 2989 B15R1.1402 CCc1ccccc1C(=O)CCCOC 1458a_100000689120_100000740836 [1,1,0,0,0,0|2,0,0]=4 2990 B15R1.1402 CCc1ccccc1C(=O)NCCCF 11a_100015189416_100000689120 [1,1,0,0,0,0|2,0,0]=4 2991 B15R1.1402 CCc1ccccc1C(=O)NCCCF 1626a_100015189416_100000689120 [1,1,0,0,0,0|2,0,0]=4 2992 B15R1.1402 CCc1ccccc1C(=O)NCCCF 240690a_100015189416_100000689120 [1,1,0,0,0,0|2,0,0]=4 2993 B15R1.1402 CCc1ccccc1C(=O)NCCCF 527a_100015189416_100000689120 [1,1,0,0,0,0|2,0,0]=4 2994 B15R1.1402 CCc1ccccc1C(=O)NCCCO 240690a_100000182051_100000689120 [1,1,0,0,0,0|2,0,0]=4 2995 B15R1.1402 CCc1ccccc1C(=O)NCCCO 527a_100000182051_100000689120 [1,1,0,0,0,0|2,0,0]=4 2996 B15R1.1402 CCc1ccccc1C(=O)NCCOC 1626a_100000209980_100000689120 [1,1,0,0,0,0|2,0,0]=4 2997 B15R1.1402 CCc1ccccc1C(=O)NCCOC 240690a_100000209980_100000689120 [1,1,0,0,0,0|2,0,0]=4 2998 B15R1.1402 CCc1ccccc1C(=O)NCCOC 527a_100000209980_100000689120 [1,1,0,0,0,0|2,0,0]=4 2999 B15R1.1402 CCc1ccccc1C(=O)NCCSC 11a_100020590264_100000689120 [1,1,0,0,0,0|2,0,0]=4 3000 B15R1.1402 CCc1ccccc1C(=O)NCCSC 1626a_100020590264_100000689120 [1,1,0,0,0,0|2,0,0]=4 3001 B15R1.1402 CCc1ccccc1C(=O)NCCSC 240690a_100020590264_100000689120 [1,1,0,0,0,0|2,0,0]=4 3002 B15R1.1402 CCc1ccccc1C(=O)NCCSC 527a_100020590264_100000689120 [1,1,0,0,0,0|2,0,0]=4 3003 B15R1.1402 CNc1ccccc1C(=O)NCCCO 34a_200011191992_200000210301 [1,1,0,0,0,0|1,0,0]=3 3004 B15R1.1402 COCCCC(=O)c1ccccc1OC 1458a_100000185835_100000740836 [1,1,0,0,0,0|2,0,0]=4 3005 B15R1.1402 COCCCC(=O)c1ccccc1SC 1458a_100000183967_100000740836 [1,1,0,0,0,0|2,0,0]=4 3006 B15R1.1402 COCCNC(=O)c1ccccc1OC 1626a_100000209980_100000185835 [1,1,0,0,0,0|2,0,0]=4 3007 B15R1.1402 COCCNC(=O)c1ccccc1OC 240690a_100000209980_100000185835 [1,1,0,0,0,0|2,0,0]=4 3008 B15R1.1402 COCCNC(=O)c1ccccc1OC 527a_100000209980_100000185835 [1,1,0,0,0,0|2,0,0]=4 3009 B15R1.1402 COCCNC(=O)c1ccccc1SC 1626a_100000209980_100000183967 [1,1,0,0,0,0|2,0,0]=4 3010 B15R1.1402 COCCNC(=O)c1ccccc1SC 240690a_100000209980_100000183967 [1,1,0,0,0,0|2,0,0]=4 3011 B15R1.1402 COCCNC(=O)c1ccccc1SC 527a_100000209980_100000183967 [1,1,0,0,0,0|2,0,0]=4 3012 B15R1.1402 COc1ccccc1C(=O)CCCCF 1458a_100000185835_100000729493 [1,1,0,0,0,0|2,0,0]=4 3013 B15R1.1402 COc1ccccc1C(=O)CCCCO 1458a_100000185835_100000210776 [1,1,0,0,0,0|2,0,0]=4 3014 B15R1.1402 COc1ccccc1C(=O)COCCBr 34a_100000211926_100000195505 [1,1,0,0,0,0|2,0,0]=4 3015 B15R1.1402 COc1ccccc1C(=O)COCCN 34a_100000210304_100000195505 [1,1,0,0,0,0|2,0,0]=4 3016 B15R1.1402 COc1ccccc1C(=O)NCCCF 11a_100015189416_100000185835 [1,1,0,0,0,0|2,0,0]=4 3017 B15R1.1402 COc1ccccc1C(=O)NCCCF 1626a_100015189416_100000185835 [1,1,0,0,0,0|2,0,0]=4 3018 B15R1.1402 COc1ccccc1C(=O)NCCCF 240690a_100015189416_100000185835 [1,1,0,0,0,0|2,0,0]=4 3019 B15R1.1402 COc1ccccc1C(=O)NCCCF 527a_100015189416_100000185835 [1,1,0,0,0,0|2,0,0]=4 3020 B15R1.1402 COc1ccccc1C(=O)NCCCO 240690a_100000182051_100000185835 [1,1,0,0,0,0|2,0,0]=4 3021 B15R1.1402 COc1ccccc1C(=O)NCCCO 527a_100000182051_100000185835 [1,1,0,0,0,0|2,0,0]=4 3022 B15R1.1402 COc1ccccc1C(=O)NCCSC 11a_100020590264_100000185835 [1,1,0,0,0,0|2,0,0]=4 3023 B15R1.1402 COc1ccccc1C(=O)NCCSC 1626a_100020590264_100000185835 [1,1,0,0,0,0|2,0,0]=4 3024 B15R1.1402 COc1ccccc1C(=O)NCCSC 240690a_100020590264_100000185835 [1,1,0,0,0,0|2,0,0]=4 3025 B15R1.1402 COc1ccccc1C(=O)NCCSC 527a_100020590264_100000185835 [1,1,0,0,0,0|2,0,0]=4 3026 B15R1.1402 CSCCNC(=O)c1ccccc1SC 11a_100020590264_100000183967 [1,1,0,0,0,0|2,0,0]=4 3027 B15R1.1402 CSCCNC(=O)c1ccccc1SC 1626a_100020590264_100000183967 [1,1,0,0,0,0|2,0,0]=4 3028 B15R1.1402 CSCCNC(=O)c1ccccc1SC 240690a_100020590264_100000183967 [1,1,0,0,0,0|2,0,0]=4 3029 B15R1.1402 CSCCNC(=O)c1ccccc1SC 527a_100020590264_100000183967 [1,1,0,0,0,0|2,0,0]=4 3030 B15R1.1402 CSc1ccccc1C(=O)CCCCF 1458a_100000183967_100000729493 [1,1,0,0,0,0|2,0,0]=4 3031 B15R1.1402 CSc1ccccc1C(=O)CCCCO 1458a_100000183967_100000210776 [1,1,0,0,0,0|2,0,0]=4 3032 B15R1.1402 CSc1ccccc1C(=O)NCCCF 11a_100015189416_100000183967 [1,1,0,0,0,0|2,0,0]=4 3033 B15R1.1402 CSc1ccccc1C(=O)NCCCF 1626a_100015189416_100000183967 [1,1,0,0,0,0|2,0,0]=4 3034 B15R1.1402 CSc1ccccc1C(=O)NCCCF 240690a_100015189416_100000183967 [1,1,0,0,0,0|2,0,0]=4 3035 B15R1.1402 CSc1ccccc1C(=O)NCCCF 527a_100015189416_100000183967 [1,1,0,0,0,0|2,0,0]=4 3036 B15R1.1402 CSc1ccccc1C(=O)NCCCO 240690a_100000182051_100000183967 [1,1,0,0,0,0|2,0,0]=4 3037 B15R1.1402 CSc1ccccc1C(=O)NCCCO 527a_100000182051_100000183967 [1,1,0,0,0,0|2,0,0]=4 3038 B15R1.1402 [13CH3]Nc1ccccc1C(=O)NCCCO 34a_200011191992_200025704644 [1,1,0,0,0,0|1,0,0]=3 3039 B15R1.2313 CCCCC(=O)c1ccc(cc1CC)Br 1458a_200012349896_100000210211 [1,1,0,0,0,0|2,0,0]=4 3040 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)Br 1458a_100000748230_100000210211 [1,1,0,0,0,0|2,0,0]=4 3041 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)C 1458a_100000217210_100000210211 [1,1,0,0,0,0|2,0,0]=4 3042 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)Cl 1458a_100000217211_100000210211 [1,1,0,0,0,0|2,0,0]=4 3043 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)F 1458a_100000239970_100000210211 [1,1,0,0,0,0|2,0,0]=4 3044 B15R1.2313 CCCCC(=O)c1ccc(cc1OC)I 1458a_100012353712_100000210211 [1,1,0,0,0,0|2,0,0]=4 3045 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 11a_100020643023_200012349896 [1,1,0,0,0,0|2,0,0]=4 3046 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 1626a_100020643023_200012349896 [1,1,0,0,0,0|2,0,0]=4 3047 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 240690a_100020643023_200012349896 [1,1,0,0,0,0|2,0,0]=4 3048 B15R1.2313 CCCNC(=O)c1ccc(cc1CC)Br 527a_100020643023_200012349896 [1,1,0,0,0,0|2,0,0]=4 3049 B15R1.2313 CCCNC(=O)c1ccc(cc1NC)Cl 34a_100000741975_200000210301 [1,1,0,0,0,0|1,0,0]=3 3050 B15R1.2313 CCCNC(=O)c1ccc(cc1NC)Cl 7a_100000741975_200000210301 [1,1,0,0,0,0|1,0,0]=3 3051 B15R1.2313 CCCNC(=O)c1ccc(cc1N[13CH3])Cl 34a_100000741975_200025704644 [1,1,0,0,0,0|1,0,0]=3 3052 B15R1.2313 CCCNC(=O)c1ccc(cc1N[13CH3])Cl 7a_100000741975_200025704644 [1,1,0,0,0,0|1,0,0]=3 3053 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 11a_100020643023_100000748230 [1,1,0,0,0,0|2,0,0]=4 3054 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 1626a_100020643023_100000748230 [1,1,0,0,0,0|2,0,0]=4 3055 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 240690a_100020643023_100000748230 [1,1,0,0,0,0|2,0,0]=4 3056 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Br 527a_100020643023_100000748230 [1,1,0,0,0,0|2,0,0]=4 3057 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 11a_100020643023_100000217210 [1,1,0,0,0,0|2,0,0]=4 3058 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 1626a_100020643023_100000217210 [1,1,0,0,0,0|2,0,0]=4 3059 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 240690a_100020643023_100000217210 [1,1,0,0,0,0|2,0,0]=4 3060 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)C 527a_100020643023_100000217210 [1,1,0,0,0,0|2,0,0]=4 3061 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 11a_100020643023_100000217211 [1,1,0,0,0,0|2,0,0]=4 3062 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 1626a_100020643023_100000217211 [1,1,0,0,0,0|2,0,0]=4 3063 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 240690a_100020643023_100000217211 [1,1,0,0,0,0|2,0,0]=4 3064 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)Cl 527a_100020643023_100000217211 [1,1,0,0,0,0|2,0,0]=4 3065 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 11a_100020643023_100000239970 [1,1,0,0,0,0|2,0,0]=4 3066 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 1626a_100020643023_100000239970 [1,1,0,0,0,0|2,0,0]=4 3067 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 240690a_100020643023_100000239970 [1,1,0,0,0,0|2,0,0]=4 3068 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)F 527a_100020643023_100000239970 [1,1,0,0,0,0|2,0,0]=4 3069 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 11a_100020643023_100012353712 [1,1,0,0,0,0|2,0,0]=4 3070 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 1626a_100020643023_100012353712 [1,1,0,0,0,0|2,0,0]=4 3071 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 240690a_100020643023_100012353712 [1,1,0,0,0,0|2,0,0]=4 3072 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)I 527a_100020643023_100012353712 [1,1,0,0,0,0|2,0,0]=4 3073 B15R1.2313 CCCNC(=O)c1ccc(cc1OC)O 271570a_203496583355_200011640145 [1,1,0,0,0,0|2,0,0]=4 3074 B15R1.2336 CCCCC(=O)c1cccc(c1CC)Br 1458a_100010125490_100000210211 [1,1,0,0,0,0|2,0,0]=4 3075 B15R1.2336 CCCCC(=O)c1cccc(c1OC)Br 1458a_100000689802_100000210211 [1,1,0,0,0,0|2,0,0]=4 3076 B15R1.2336 CCCCC(=O)c1cccc(c1OC)C 1458a_100000187929_100000210211 [1,1,0,0,0,0|2,0,0]=4 3077 B15R1.2336 CCCCC(=O)c1cccc(c1OC)Cl 1458a_100011934004_100000210211 [1,1,0,0,0,0|2,0,0]=4 3078 B15R1.2336 CCCCC(=O)c1cccc(c1OC)F 1458a_100011218433_100000210211 [1,1,0,0,0,0|2,0,0]=4 3079 B15R1.2336 CCCCC(=O)c1cccc(c1OC)O 1458a_100000080799_100000210211 [1,1,0,0,0,0|2,0,0]=4 3080 B15R1.2336 CCCNC(=O)c1cccc(c1CC)Br 11a_100020643023_100010125490 [1,1,0,0,0,0|2,0,0]=4 3081 B15R1.2336 CCCNC(=O)c1cccc(c1CC)Br 1626a_100020643023_100010125490 [1,1,0,0,0,0|2,0,0]=4 3082 B15R1.2336 CCCNC(=O)c1cccc(c1CC)Br 240690a_100020643023_100010125490 [1,1,0,0,0,0|2,0,0]=4 3083 B15R1.2336 CCCNC(=O)c1cccc(c1CC)Br 527a_100020643023_100010125490 [1,1,0,0,0,0|2,0,0]=4 3084 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Br 11a_100020643023_100000689802 [1,1,0,0,0,0|2,0,0]=4 3085 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Br 1626a_100020643023_100000689802 [1,1,0,0,0,0|2,0,0]=4 3086 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Br 240690a_100020643023_100000689802 [1,1,0,0,0,0|2,0,0]=4 3087 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Br 527a_100020643023_100000689802 [1,1,0,0,0,0|2,0,0]=4 3088 B15R1.2336 CCCNC(=O)c1cccc(c1OC)C 11a_100020643023_100000187929 [1,1,0,0,0,0|2,0,0]=4 3089 B15R1.2336 CCCNC(=O)c1cccc(c1OC)C 1626a_100020643023_100000187929 [1,1,0,0,0,0|2,0,0]=4 3090 B15R1.2336 CCCNC(=O)c1cccc(c1OC)C 240690a_100020643023_100000187929 [1,1,0,0,0,0|2,0,0]=4 3091 B15R1.2336 CCCNC(=O)c1cccc(c1OC)C 527a_100020643023_100000187929 [1,1,0,0,0,0|2,0,0]=4 3092 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Cl 11a_100020643023_100011934004 [1,1,0,0,0,0|2,0,0]=4 3093 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Cl 1626a_100020643023_100011934004 [1,1,0,0,0,0|2,0,0]=4 3094 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Cl 240690a_100020643023_100011934004 [1,1,0,0,0,0|2,0,0]=4 3095 B15R1.2336 CCCNC(=O)c1cccc(c1OC)Cl 527a_100020643023_100011934004 [1,1,0,0,0,0|2,0,0]=4 3096 B15R1.2336 CCCNC(=O)c1cccc(c1OC)F 11a_100020643023_100011218433 [1,1,0,0,0,0|2,0,0]=4 3097 B15R1.2336 CCCNC(=O)c1cccc(c1OC)F 1626a_100020643023_100011218433 [1,1,0,0,0,0|2,0,0]=4 3098 B15R1.2336 CCCNC(=O)c1cccc(c1OC)F 240690a_100020643023_100011218433 [1,1,0,0,0,0|2,0,0]=4 3099 B15R1.2336 CCCNC(=O)c1cccc(c1OC)F 527a_100020643023_100011218433 [1,1,0,0,0,0|2,0,0]=4 3100 B15R1.2359 CCCCC(=O)c1c(cccc1OC)Br 1458a_100011593405_100000210211 [1,1,0,0,0,0|2,0,0]=4 3101 B15R1.2359 CCCCC(=O)c1c(cccc1OC)C 1458a_100000066212_100000210211 [1,1,0,0,0,0|2,0,0]=4 3102 B15R1.2359 CCCCC(=O)c1c(cccc1OC)Cl 1458a_100000743539_100000210211 [1,1,0,0,0,0|2,0,0]=4 3103 B15R1.2359 CCCCC(=O)c1c(cccc1OC)F 1458a_100000759380_100000210211 [1,1,0,0,0,0|2,0,0]=4 3104 B15R1.2359 CCCCC(=O)c1c(cccc1OC)I 1458a_100010179659_100000210211 [1,1,0,0,0,0|2,0,0]=4 3105 B15R1.2359 CCCCC(=O)c1c(cccc1OC)O 1458a_100000043310_100000210211 [1,1,0,0,0,0|2,0,0]=4 3106 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Br 11a_100020643023_100011593405 [1,1,0,0,0,0|2,0,0]=4 3107 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Br 1626a_100020643023_100011593405 [1,1,0,0,0,0|2,0,0]=4 3108 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Br 240690a_100020643023_100011593405 [1,1,0,0,0,0|2,0,0]=4 3109 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Br 527a_100020643023_100011593405 [1,1,0,0,0,0|2,0,0]=4 3110 B15R1.2359 CCCNC(=O)c1c(cccc1OC)C 11a_100020643023_100000066212 [1,1,0,0,0,0|2,0,0]=4 3111 B15R1.2359 CCCNC(=O)c1c(cccc1OC)C 1626a_100020643023_100000066212 [1,1,0,0,0,0|2,0,0]=4 3112 B15R1.2359 CCCNC(=O)c1c(cccc1OC)C 240690a_100020643023_100000066212 [1,1,0,0,0,0|2,0,0]=4 3113 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Cl 11a_100020643023_100000743539 [1,1,0,0,0,0|2,0,0]=4 3114 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Cl 1626a_100020643023_100000743539 [1,1,0,0,0,0|2,0,0]=4 3115 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Cl 240690a_100020643023_100000743539 [1,1,0,0,0,0|2,0,0]=4 3116 B15R1.2359 CCCNC(=O)c1c(cccc1OC)Cl 527a_100020643023_100000743539 [1,1,0,0,0,0|2,0,0]=4 3117 B15R1.2359 CCCNC(=O)c1c(cccc1OC)F 11a_100020643023_100000759380 [1,1,0,0,0,0|2,0,0]=4 3118 B15R1.2359 CCCNC(=O)c1c(cccc1OC)F 1626a_100020643023_100000759380 [1,1,0,0,0,0|2,0,0]=4 3119 B15R1.2359 CCCNC(=O)c1c(cccc1OC)F 240690a_100020643023_100000759380 [1,1,0,0,0,0|2,0,0]=4 3120 B15R1.2359 CCCNC(=O)c1c(cccc1OC)F 527a_100020643023_100000759380 [1,1,0,0,0,0|2,0,0]=4 3121 B15R1.2359 CCCNC(=O)c1c(cccc1OC)I 11a_100020643023_100010179659 [1,1,0,0,0,0|2,0,0]=4 3122 B15R1.2359 CCCNC(=O)c1c(cccc1OC)I 1626a_100020643023_100010179659 [1,1,0,0,0,0|2,0,0]=4 3123 B15R1.2359 CCCNC(=O)c1c(cccc1OC)I 240690a_100020643023_100010179659 [1,1,0,0,0,0|2,0,0]=4 3124 B15R1.2359 CCCNC(=O)c1c(cccc1OC)I 527a_100020643023_100010179659 [1,1,0,0,0,0|2,0,0]=4 3125 B15R1.2359 CCCNC(=O)c1c(cccc1OC)O 240690a_100020643023_100000043310 [1,1,0,0,0,0|2,0,0]=4 3126 B15R1.3954 CCCC(C)C(=O)c1ccccc1CC 1458a_100000689120_100000766640 [1,1,0,0,0,0|2,0,0]=4 3127 B15R1.3954 CCCC(C)C(=O)c1ccccc1OC 1458a_100000185835_100000766640 [1,1,0,0,0,0|2,0,0]=4 3128 B15R1.3954 CCCC(C)C(=O)c1ccccc1SC 1458a_100000183967_100000766640 [1,1,0,0,0,0|2,0,0]=4 3129 B15R1.3954 CCCN(C)C(=O)c1ccccc1CC 11a_100000747261_100000689120 [1,1,0,0,0,0|2,0,0]=4 3130 B15R1.3954 CCCN(C)C(=O)c1ccccc1CC 1626a_100000747261_100000689120 [1,1,0,0,0,0|2,0,0]=4 3131 B15R1.3954 CCCN(C)C(=O)c1ccccc1CC 240690a_100000747261_100000689120 [1,1,0,0,0,0|2,0,0]=4 3132 B15R1.3954 CCCN(C)C(=O)c1ccccc1CC 527a_100000747261_100000689120 [1,1,0,0,0,0|2,0,0]=4 3133 B15R1.3954 CCCN(C)C(=O)c1ccccc1OC 11a_100000747261_100000185835 [1,1,0,0,0,0|2,0,0]=4 3134 B15R1.3954 CCCN(C)C(=O)c1ccccc1OC 1626a_100000747261_100000185835 [1,1,0,0,0,0|2,0,0]=4 3135 B15R1.3954 CCCN(C)C(=O)c1ccccc1OC 240690a_100000747261_100000185835 [1,1,0,0,0,0|2,0,0]=4 3136 B15R1.3954 CCCN(C)C(=O)c1ccccc1OC 527a_100000747261_100000185835 [1,1,0,0,0,0|2,0,0]=4 3137 B15R1.3954 CCCN(C)C(=O)c1ccccc1SC 11a_100000747261_100000183967 [1,1,0,0,0,0|2,0,0]=4 3138 B15R1.3954 CCCN(C)C(=O)c1ccccc1SC 1626a_100000747261_100000183967 [1,1,0,0,0,0|2,0,0]=4 3139 B15R1.3954 CCCN(C)C(=O)c1ccccc1SC 240690a_100000747261_100000183967 [1,1,0,0,0,0|2,0,0]=4 3140 B15R1.3954 CCCN(C)C(=O)c1ccccc1SC 527a_100000747261_100000183967 [1,1,0,0,0,0|2,0,0]=4 3141 B15R1.5417 CCCNS(=O)(=O)c1ccccc1NC 27a_100102657272_200000165487 [1,1,0,0,0,0|2,0,0]=4 3142 B15R1.12623 CCC(C)CC(=O)c1ccccc1OC 1458a_100000185835_100000748023 [1,1,0,0,0,0|2,0,0]=4 3143 B15R1.12623 CCC(C)CC(=O)c1ccccc1SC 1458a_100000183967_100000748023 [1,1,0,0,0,0|2,0,0]=4 3144 B15R1.12623 CCC(C)NC(=O)c1ccccc1NC 27a_100102657272_200000152809 [1,1,0,0,0,0|1,0,0]=3 3145 B15R1.12623 CCC(C)NC(=O)c1ccccc1OC 11a_100000209981_100000185835 [1,1,0,0,0,0|2,0,0]=4 3146 B15R1.12623 CCC(C)NC(=O)c1ccccc1OC 1626a_100000209981_100000185835 [1,1,0,0,0,0|2,0,0]=4 3147 B15R1.12623 CCC(C)NC(=O)c1ccccc1OC 240690a_100000209981_100000185835 [1,1,0,0,0,0|2,0,0]=4 3148 B15R1.12623 CCC(C)NC(=O)c1ccccc1OC 527a_100000209981_100000185835 [1,1,0,0,0,0|2,0,0]=4 3149 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 11a_100000209981_100000183967 [1,1,0,0,0,0|2,0,0]=4 3150 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 1626a_100000209981_100000183967 [1,1,0,0,0,0|2,0,0]=4 3151 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 240690a_100000209981_100000183967 [1,1,0,0,0,0|2,0,0]=4 3152 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 527a_100000209981_100000183967 [1,1,0,0,0,0|2,0,0]=4 3153 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 62a_200000152809_200000210301 [1,1,0,0,0,0|2,0,0]=4 3154 B15R1.12623 CCC(C)NC(=O)c1ccccc1SC 62a_200000210301_200000152809 [1,1,0,0,0,0|2,0,0]=4 3155 B15R1.12623 CCC(C)NC(=O)c1ccccc1S[13CH3] 62a_200000152809_200025704644 [1,1,0,0,0,0|2,0,0]=4 3156 B15R1.12623 CCC(C)NC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000152809 [1,1,0,0,0,0|2,0,0]=4 3157 B15R1.12623 CCC(O)CC(=O)c1ccccc1OC 1458a_100000185835_100011218378 [1,1,0,0,0,0|2,0,0]=4 3158 B15R1.12623 CCC(O)CC(=O)c1ccccc1SC 1458a_100000183967_100011218378 [1,1,0,0,0,0|2,0,0]=4 3159 B15R1.12623 CC[C@H](C)CC(=O)c1ccccc1OC 1458a_100000185835_100009816398 [1,1,0,0,0,0|2,0,0]=4 3160 B15R1.12623 CC[C@H](C)CC(=O)c1ccccc1SC 1458a_100000183967_100009816398 [1,1,0,0,0,0|2,0,0]=4 3161 B15R1.12623 CCc1ccccc1C(=O)CC(C)CC 1458a_100000689120_100000748023 [1,1,0,0,0,0|2,0,0]=4 3162 B15R1.12623 CCc1ccccc1C(=O)CC(O)CC 1458a_100000689120_100011218378 [1,1,0,0,0,0|2,0,0]=4 3163 B15R1.12623 CCc1ccccc1C(=O)C[C@@H](C)CC 1458a_100000689120_100009816398 [1,1,0,0,0,0|2,0,0]=4 3164 B15R1.12623 CCc1ccccc1C(=O)NC(C)CC 11a_100000209981_100000689120 [1,1,0,0,0,0|2,0,0]=4 3165 B15R1.12623 CCc1ccccc1C(=O)NC(C)CC 1626a_100000209981_100000689120 [1,1,0,0,0,0|2,0,0]=4 3166 B15R1.12623 CCc1ccccc1C(=O)NC(C)CC 240690a_100000209981_100000689120 [1,1,0,0,0,0|2,0,0]=4 3167 B15R1.12623 CCc1ccccc1C(=O)NC(C)CC 527a_100000209981_100000689120 [1,1,0,0,0,0|2,0,0]=4 3168 B15R1.271 C=C=Cc1ccccc1C(=O)OC(C)C 271570a_100015277604_100000169877 [0,1,0,0,1,0|1,0,1]=4 3169 B15R1.271 CC(C)CC(=O)c1ccccc1CC#N 1458a_100000010604_100000210624 [0,1,0,0,1,0|1,0,1]=4 3170 B15R1.271 CC(C)CC(=O)c1ccccc1N=[N+]=[N-] 1458a_100009827904_100000210624 [0,1,0,0,1,0|1,0,1]=4 3171 B15R1.271 CC(C)CC(C)c1ccccc1NCF 34a_100009954483_100015361967 [0,1,0,0,1,0|1,0,1]=4 3172 B15R1.271 CC(C)CC(C)c1ccccc1NCF 7a_100009954483_100015361967 [0,1,0,0,1,0|1,0,1]=4 3173 B15R1.271 CC(C)NC(=O)c1ccccc1SCF 62a_100015361967_200000152627 [0,1,0,0,1,0|2,0,0]=4 3174 B15R1.271 CC(C)NC(=O)c1ccccc1SCF 62a_200000152627_100015361967 [0,1,0,0,1,0|2,0,0]=4 3175 B15R1.271 CC(C)OC(=O)c1ccccc1OCF 34a_100000169923_100015361967 [0,1,0,0,1,0|1,0,0]=3 3176 B15R1.271 CC(C)OC(=O)c1ccccc1OCF 7a_100000169923_100015361967 [0,1,0,0,1,0|1,0,0]=3 3177 B15R1.271 CC(C)OC(=O)c1ccccc1SCF 62a_100000169877_100015361967 [0,1,0,0,1,0|1,0,0]=3 3178 B15R1.271 CC(C)OC(=O)c1ccccc1SCF 62a_100015361967_100000169877 [0,1,0,0,1,0|1,0,0]=3 3179 B15R1.271 CC=Cc1ccccc1C(=O)NC(C)C 271570a_100016259895_200000152627 [0,1,0,0,1,0|2,0,0]=4 3180 B15R1.271 CC=Cc1ccccc1C(=O)OC(C)C 271570a_100016259895_100000169877 [0,1,0,0,1,0|1,0,0]=3 3181 B15R1.271 CCNc1ccccc1C(=O)NC(C)C 27a_100015525214_200000152627 [0,1,0,0,1,0|1,0,0]=3 3182 B15R1.271 CCNc1ccccc1C(C)CC(C)C 2230a_100009954483_100000210202 [0,1,0,0,1,0|1,0,1]=4 3183 B15R1.271 CCNc1ccccc1C(C)CC(C)C 34a_100009954483_100000210202 [0,1,0,0,1,0|1,0,1]=4 3184 B15R1.271 CCNc1ccccc1C(C)CC(C)C 7a_100009954483_100000210202 [0,1,0,0,1,0|1,0,1]=4 3185 B15R1.271 CCNc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_114873767003 [0,1,0,0,1,0|1,0,1]=4 3186 B15R1.271 CCOc1ccccc1C(=O)CC(C)C 1458a_100000211144_100000210624 [0,1,0,0,1,0|1,0,0]=3 3187 B15R1.271 CCOc1ccccc1C(=O)CC(C)O 1458a_100000211144_100011218427 [0,1,0,0,1,0|2,0,0]=4 3188 B15R1.271 CCOc1ccccc1C(=O)NC(C)C 11a_100138425928_100000211144 [0,1,0,0,1,0|2,0,0]=4 3189 B15R1.271 CCOc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000211144 [0,1,0,0,1,0|2,0,0]=4 3190 B15R1.271 CCOc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000211144 [0,1,0,0,1,0|2,0,0]=4 3191 B15R1.271 CCOc1ccccc1C(=O)NC(C)C 527a_100138425928_100000211144 [0,1,0,0,1,0|2,0,0]=4 3192 B15R1.271 CCOc1ccccc1C(=O)OC(C)C 34a_100000169923_100000210202 [0,1,0,0,1,0|1,0,0]=3 3193 B15R1.271 CCOc1ccccc1C(=O)OC(C)C 7a_100000169923_100000210202 [0,1,0,0,1,0|1,0,0]=3 3194 B15R1.271 CCSc1ccccc1C(=O)CC(C)C 1458a_100000195471_100000210624 [0,1,0,0,1,0|1,0,0]=3 3195 B15R1.271 CCSc1ccccc1C(=O)CC(C)O 1458a_100000195471_100011218427 [0,1,0,0,1,0|2,0,0]=4 3196 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 11a_100138425928_100000195471 [0,1,0,0,1,0|2,0,0]=4 3197 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000195471 [0,1,0,0,1,0|2,0,0]=4 3198 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000195471 [0,1,0,0,1,0|2,0,0]=4 3199 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 527a_100138425928_100000195471 [0,1,0,0,1,0|2,0,0]=4 3200 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 62a_100000210202_200000152627 [0,1,0,0,1,0|2,0,0]=4 3201 B15R1.271 CCSc1ccccc1C(=O)NC(C)C 62a_200000152627_100000210202 [0,1,0,0,1,0|2,0,0]=4 3202 B15R1.271 CCSc1ccccc1C(=O)OC(C)C 62a_100000169877_100000210202 [0,1,0,0,1,0|1,0,0]=3 3203 B15R1.271 CCSc1ccccc1C(=O)OC(C)C 62a_100000210202_100000169877 [0,1,0,0,1,0|1,0,0]=3 3204 B15R1.271 CNCc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000184654 [0,1,0,0,1,0|1,0,1]=4 3205 B15R1.271 COCc1ccccc1C(=O)CC(C)C 1458a_100000737999_100000210624 [0,1,0,0,1,0|1,0,0]=3 3206 B15R1.271 COCc1ccccc1C(=O)CC(C)O 1458a_100000737999_100011218427 [0,1,0,0,1,0|2,0,0]=4 3207 B15R1.271 COCc1ccccc1C(=O)NC(C)C 11a_100138425928_100000737999 [0,1,0,0,1,0|2,0,0]=4 3208 B15R1.271 COCc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000737999 [0,1,0,0,1,0|2,0,0]=4 3209 B15R1.271 COCc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000737999 [0,1,0,0,1,0|2,0,0]=4 3210 B15R1.271 COCc1ccccc1C(=O)NC(C)C 527a_100138425928_100000737999 [0,1,0,0,1,0|2,0,0]=4 3211 B15R1.1117 CC(C)N(C)C(=O)c1ccccc1N[13CH3] 34a_100011193792_200025704644 [0,1,0,0,1,0|1,0,0]=3 3212 B15R1.1117 CCc1ccccc1C(=O)N(C)C(C)C 11a_200000211004_100000689120 [0,1,0,0,1,0|2,0,0]=4 3213 B15R1.1117 CCc1ccccc1C(=O)N(C)C(C)C 1626a_200000211004_100000689120 [0,1,0,0,1,0|2,0,0]=4 3214 B15R1.1117 CCc1ccccc1C(=O)N(C)C(C)C 240690a_200000211004_100000689120 [0,1,0,0,1,0|2,0,0]=4 3215 B15R1.1117 CCc1ccccc1C(=O)N(C)C(C)C 527a_200000211004_100000689120 [0,1,0,0,1,0|2,0,0]=4 3216 B15R1.1117 CNc1ccccc1C(=O)N(C)C(C)C 34a_100011193792_200000210301 [0,1,0,0,1,0|1,0,0]=3 3217 B15R1.1117 COc1ccccc1C(=O)N(C)C(C)C 11a_200000211004_100000185835 [0,1,0,0,1,0|2,0,0]=4 3218 B15R1.1117 COc1ccccc1C(=O)N(C)C(C)C 1626a_200000211004_100000185835 [0,1,0,0,1,0|2,0,0]=4 3219 B15R1.1117 COc1ccccc1C(=O)N(C)C(C)C 240690a_200000211004_100000185835 [0,1,0,0,1,0|2,0,0]=4 3220 B15R1.1117 COc1ccccc1C(=O)N(C)C(C)C 527a_200000211004_100000185835 [0,1,0,0,1,0|2,0,0]=4 3221 B15R1.1117 CSc1ccccc1C(=O)N(C)C(C)C 11a_200000211004_100000183967 [0,1,0,0,1,0|2,0,0]=4 3222 B15R1.1117 CSc1ccccc1C(=O)N(C)C(C)C 1626a_200000211004_100000183967 [0,1,0,0,1,0|2,0,0]=4 3223 B15R1.1117 CSc1ccccc1C(=O)N(C)C(C)C 240690a_200000211004_100000183967 [0,1,0,0,1,0|2,0,0]=4 3224 B15R1.1117 CSc1ccccc1C(=O)N(C)C(C)C 527a_200000211004_100000183967 [0,1,0,0,1,0|2,0,0]=4 3225 B15R1.1573 CC(C)CC(=O)c1c(cccc1C#N)Br 1458a_200010145881_100000210624 [0,1,0,0,1,0|2,0,0]=4 3226 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)Br 1458a_100011593405_100000210624 [0,1,0,0,1,0|1,0,0]=3 3227 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)C 1458a_100000066212_100000210624 [0,1,0,0,1,0|1,0,0]=3 3228 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)Cl 1458a_100000743539_100000210624 [0,1,0,0,1,0|1,0,0]=3 3229 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)F 1458a_100000759380_100000210624 [0,1,0,0,1,0|1,0,0]=3 3230 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)I 1458a_100010179659_100000210624 [0,1,0,0,1,0|1,0,0]=3 3231 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)O 1458a_100000043310_100000210624 [0,1,0,0,1,0|1,0,0]=3 3232 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)Br 1458a_100011593405_100011218427 [0,1,0,0,1,0|2,0,0]=4 3233 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)C 1458a_100000066212_100011218427 [0,1,0,0,1,0|2,0,0]=4 3234 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)Cl 1458a_100000743539_100011218427 [0,1,0,0,1,0|2,0,0]=4 3235 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)F 1458a_100000759380_100011218427 [0,1,0,0,1,0|2,0,0]=4 3236 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)I 1458a_100010179659_100011218427 [0,1,0,0,1,0|2,0,0]=4 3237 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)O 1458a_100000043310_100011218427 [0,1,0,0,1,0|2,0,0]=4 3238 B15R1.1573 COc1cccc(c1C(=O)CN(C)C)Cl 2230a_100102631434_100010768284 [0,1,0,0,1,0|2,0,0]=4 3239 B15R1.1573 COc1cccc(c1C(=O)CN(C)C)Cl 269982a_100102631434_100010768284 [0,1,0,0,1,0|2,0,0]=4 3240 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Br 11a_100138425928_100011593405 [0,1,0,0,1,0|2,0,0]=4 3241 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Br 1626a_100138425928_100011593405 [0,1,0,0,1,0|2,0,0]=4 3242 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Br 240690a_100138425928_100011593405 [0,1,0,0,1,0|2,0,0]=4 3243 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Br 527a_100138425928_100011593405 [0,1,0,0,1,0|2,0,0]=4 3244 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)C 11a_100138425928_100000066212 [0,1,0,0,1,0|2,0,0]=4 3245 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)C 1626a_100138425928_100000066212 [0,1,0,0,1,0|2,0,0]=4 3246 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)C 240690a_100138425928_100000066212 [0,1,0,0,1,0|2,0,0]=4 3247 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Cl 11a_100138425928_100000743539 [0,1,0,0,1,0|2,0,0]=4 3248 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Cl 1626a_100138425928_100000743539 [0,1,0,0,1,0|2,0,0]=4 3249 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Cl 240690a_100138425928_100000743539 [0,1,0,0,1,0|2,0,0]=4 3250 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)Cl 527a_100138425928_100000743539 [0,1,0,0,1,0|2,0,0]=4 3251 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)F 11a_100138425928_100000759380 [0,1,0,0,1,0|2,0,0]=4 3252 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)F 1626a_100138425928_100000759380 [0,1,0,0,1,0|2,0,0]=4 3253 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)F 240690a_100138425928_100000759380 [0,1,0,0,1,0|2,0,0]=4 3254 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)F 527a_100138425928_100000759380 [0,1,0,0,1,0|2,0,0]=4 3255 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)I 11a_100138425928_100010179659 [0,1,0,0,1,0|2,0,0]=4 3256 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)I 1626a_100138425928_100010179659 [0,1,0,0,1,0|2,0,0]=4 3257 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)I 240690a_100138425928_100010179659 [0,1,0,0,1,0|2,0,0]=4 3258 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)I 527a_100138425928_100010179659 [0,1,0,0,1,0|2,0,0]=4 3259 B15R1.1573 COc1cccc(c1C(=O)NC(C)C)O 240690a_100138425928_100000043310 [0,1,0,0,1,0|2,0,0]=4 3260 B15R1.3762 CC(C)CC(=O)c1cc(ccc1C#N)F 1458a_100011217471_100000210624 [0,1,0,0,1,0|2,0,0]=4 3261 B15R1.3762 CC(C)NC(=O)c1cc(ccc1S[13CH3])F 62a_200000205832_200025704644 [0,1,0,0,1,0|2,0,0]=4 3262 B15R1.3762 CC(C)NC(=O)c1cc(ccc1S[13CH3])F 62a_200025704644_200000205832 [0,1,0,0,1,0|2,0,0]=4 3263 B15R1.3762 CCc1ccc(cc1C(=O)CC(C)C)Br 1458a_100012343961_100000210624 [0,1,0,0,1,0|1,0,0]=3 3264 B15R1.3762 CCc1ccc(cc1C(=O)CC(C)O)Br 1458a_100012343961_100011218427 [0,1,0,0,1,0|2,0,0]=4 3265 B15R1.3762 CCc1ccc(cc1C(=O)NC(C)C)Br 11a_100138425928_100012343961 [0,1,0,0,1,0|2,0,0]=4 3266 B15R1.3762 CCc1ccc(cc1C(=O)NC(C)C)Br 1626a_100138425928_100012343961 [0,1,0,0,1,0|2,0,0]=4 3267 B15R1.3762 CCc1ccc(cc1C(=O)NC(C)C)Br 240690a_100138425928_100012343961 [0,1,0,0,1,0|2,0,0]=4 3268 B15R1.3762 CCc1ccc(cc1C(=O)NC(C)C)Br 527a_100138425928_100012343961 [0,1,0,0,1,0|2,0,0]=4 3269 B15R1.3762 CNc1ccc(cc1C(=O)NC(C)C)F 27a_100102657272_200000205832 [0,1,0,0,1,0|1,0,0]=3 3270 B15R1.3762 CNc1ccc(cc1[C@@H](N)CC(C)C)C 271570a_100015190218_100000221369 [0,1,0,0,1,0|1,0,1]=4 3271 B15R1.3762 CNc1ccc(cc1[C@@H](N)CC(C)C)F 271570a_100015190218_100011246292 [0,1,0,0,1,0|1,0,1]=4 3272 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)Br 1458a_100000188853_100000210624 [0,1,0,0,1,0|1,0,0]=3 3273 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)C 1458a_100000204667_100000210624 [0,1,0,0,1,0|1,0,0]=3 3274 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)Cl 1458a_100000211409_100000210624 [0,1,0,0,1,0|1,0,0]=3 3275 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)F 1458a_100000735445_100000210624 [0,1,0,0,1,0|1,0,0]=3 3276 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)I 1458a_100000230898_100000210624 [0,1,0,0,1,0|1,0,0]=3 3277 B15R1.3762 COc1ccc(cc1C(=O)CC(C)C)O 1458a_200000100057_100000210624 [0,1,0,0,1,0|1,0,0]=3 3278 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)Br 1458a_100000188853_100011218427 [0,1,0,0,1,0|2,0,0]=4 3279 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)C 1458a_100000204667_100011218427 [0,1,0,0,1,0|2,0,0]=4 3280 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)Cl 1458a_100000211409_100011218427 [0,1,0,0,1,0|2,0,0]=4 3281 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)F 1458a_100000735445_100011218427 [0,1,0,0,1,0|2,0,0]=4 3282 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)I 1458a_100000230898_100011218427 [0,1,0,0,1,0|2,0,0]=4 3283 B15R1.3762 COc1ccc(cc1C(=O)CC(C)O)O 1458a_200000100057_100011218427 [0,1,0,0,1,0|2,0,0]=4 3284 B15R1.3762 COc1ccc(cc1C(=O)CN(C)C)Br 269982a_100102631434_200000749383 [0,1,0,0,1,0|2,0,0]=4 3285 B15R1.3762 COc1ccc(cc1C(=O)CN(C)C)Cl 269982a_100102631434_100012340060 [0,1,0,0,1,0|2,0,0]=4 3286 B15R1.3762 COc1ccc(cc1C(=O)CN(C)C)F 269982a_100102631434_100000737820 [0,1,0,0,1,0|2,0,0]=4 3287 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Br 11a_100138425928_100000188853 [0,1,0,0,1,0|2,0,0]=4 3288 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Br 1626a_100138425928_100000188853 [0,1,0,0,1,0|2,0,0]=4 3289 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Br 240690a_100138425928_100000188853 [0,1,0,0,1,0|2,0,0]=4 3290 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Br 527a_100138425928_100000188853 [0,1,0,0,1,0|2,0,0]=4 3291 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)C 11a_100138425928_100000204667 [0,1,0,0,1,0|2,0,0]=4 3292 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)C 1626a_100138425928_100000204667 [0,1,0,0,1,0|2,0,0]=4 3293 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)C 240690a_100138425928_100000204667 [0,1,0,0,1,0|2,0,0]=4 3294 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)C 527a_100138425928_100000204667 [0,1,0,0,1,0|2,0,0]=4 3295 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Cl 11a_100138425928_100000211409 [0,1,0,0,1,0|2,0,0]=4 3296 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Cl 1626a_100138425928_100000211409 [0,1,0,0,1,0|2,0,0]=4 3297 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Cl 240690a_100138425928_100000211409 [0,1,0,0,1,0|2,0,0]=4 3298 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)Cl 527a_100138425928_100000211409 [0,1,0,0,1,0|2,0,0]=4 3299 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)F 11a_100138425928_100000735445 [0,1,0,0,1,0|2,0,0]=4 3300 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)F 1626a_100138425928_100000735445 [0,1,0,0,1,0|2,0,0]=4 3301 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)F 240690a_100138425928_100000735445 [0,1,0,0,1,0|2,0,0]=4 3302 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)F 527a_100138425928_100000735445 [0,1,0,0,1,0|2,0,0]=4 3303 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)I 11a_100138425928_100000230898 [0,1,0,0,1,0|2,0,0]=4 3304 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)I 1626a_100138425928_100000230898 [0,1,0,0,1,0|2,0,0]=4 3305 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)I 240690a_100138425928_100000230898 [0,1,0,0,1,0|2,0,0]=4 3306 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)I 527a_100138425928_100000230898 [0,1,0,0,1,0|2,0,0]=4 3307 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)O 240690a_100138425928_200000100057 [0,1,0,0,1,0|2,0,0]=4 3308 B15R1.3762 COc1ccc(cc1C(=O)NC(C)C)O 527a_100138425928_200000100057 [0,1,0,0,1,0|2,0,0]=4 3309 B15R1.3762 CSc1ccc(cc1C(=O)NC(C)C)F 62a_200000205832_200000210301 [0,1,0,0,1,0|2,0,0]=4 3310 B15R1.3762 CSc1ccc(cc1C(=O)NC(C)C)F 62a_200000210301_200000205832 [0,1,0,0,1,0|2,0,0]=4 3311 B15R1.4047 CC(C)CC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_100000210624 [0,1,0,0,1,0|2,0,0]=4 3312 B15R1.4047 CC(C)CC(=O)c1ccc(cc1C#N)F 1458a_100012002388_100000210624 [0,1,0,0,1,0|2,0,0]=4 3313 B15R1.4047 CC(C)CC(=O)c1ccc(cc1CO)Br 1458a_100010253900_100000210624 [0,1,0,0,1,0|2,0,0]=4 3314 B15R1.4047 CC(C)CC(=O)c1ccc(cc1CO)F 1458a_100013035055_100000210624 [0,1,0,0,1,0|2,0,0]=4 3315 B15R1.4047 CC(C)NC(=O)c1ccc(cc1N[13CH3])Cl 7a_100000741636_200025704644 [0,1,0,0,1,0|1,0,0]=3 3316 B15R1.4047 CCc1cc(ccc1C(=O)CC(C)C)Br 1458a_200012349896_100000210624 [0,1,0,0,1,0|1,0,0]=3 3317 B15R1.4047 CCc1cc(ccc1C(=O)CC(C)O)Br 1458a_200012349896_100011218427 [0,1,0,0,1,0|2,0,0]=4 3318 B15R1.4047 CCc1cc(ccc1C(=O)NC(C)C)Br 11a_100138425928_200012349896 [0,1,0,0,1,0|2,0,0]=4 3319 B15R1.4047 CCc1cc(ccc1C(=O)NC(C)C)Br 1626a_100138425928_200012349896 [0,1,0,0,1,0|2,0,0]=4 3320 B15R1.4047 CCc1cc(ccc1C(=O)NC(C)C)Br 240690a_100138425928_200012349896 [0,1,0,0,1,0|2,0,0]=4 3321 B15R1.4047 CCc1cc(ccc1C(=O)NC(C)C)Br 527a_100138425928_200012349896 [0,1,0,0,1,0|2,0,0]=4 3322 B15R1.4047 CNc1cc(ccc1C(=O)NC(C)C)Cl 7a_100000741636_200000210301 [0,1,0,0,1,0|1,0,0]=3 3323 B15R1.4047 CNc1cc(ccc1[C@@H](N)CC(C)C)F 271570a_100015190218_100020633008 [0,1,0,0,1,0|1,0,1]=4 3324 B15R1.4047 COc1cc(ccc1C(=O)CC(C)C)Br 1458a_100000748230_100000210624 [0,1,0,0,1,0|1,0,0]=3 3325 B15R1.4047 COc1cc(ccc1C(=O)CC(C)C)C 1458a_100000217210_100000210624 [0,1,0,0,1,0|1,0,0]=3 3326 B15R1.4047 COc1cc(ccc1C(=O)CC(C)C)Cl 1458a_100000217211_100000210624 [0,1,0,0,1,0|1,0,0]=3 3327 B15R1.4047 COc1cc(ccc1C(=O)CC(C)C)F 1458a_100000239970_100000210624 [0,1,0,0,1,0|1,0,0]=3 3328 B15R1.4047 COc1cc(ccc1C(=O)CC(C)C)I 1458a_100012353712_100000210624 [0,1,0,0,1,0|1,0,0]=3 3329 B15R1.4047 COc1cc(ccc1C(=O)CC(C)O)Br 1458a_100000748230_100011218427 [0,1,0,0,1,0|2,0,0]=4 3330 B15R1.4047 COc1cc(ccc1C(=O)CC(C)O)C 1458a_100000217210_100011218427 [0,1,0,0,1,0|2,0,0]=4 3331 B15R1.4047 COc1cc(ccc1C(=O)CC(C)O)Cl 1458a_100000217211_100011218427 [0,1,0,0,1,0|2,0,0]=4 3332 B15R1.4047 COc1cc(ccc1C(=O)CC(C)O)F 1458a_100000239970_100011218427 [0,1,0,0,1,0|2,0,0]=4 3333 B15R1.4047 COc1cc(ccc1C(=O)CC(C)O)I 1458a_100012353712_100011218427 [0,1,0,0,1,0|2,0,0]=4 3334 B15R1.4047 COc1cc(ccc1C(=O)CN(C)C)Cl 269982a_100102631434_100012344415 [0,1,0,0,1,0|2,0,0]=4 3335 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Br 11a_100138425928_100000748230 [0,1,0,0,1,0|2,0,0]=4 3336 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Br 1626a_100138425928_100000748230 [0,1,0,0,1,0|2,0,0]=4 3337 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Br 240690a_100138425928_100000748230 [0,1,0,0,1,0|2,0,0]=4 3338 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Br 527a_100138425928_100000748230 [0,1,0,0,1,0|2,0,0]=4 3339 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)C 11a_100138425928_100000217210 [0,1,0,0,1,0|2,0,0]=4 3340 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)C 1626a_100138425928_100000217210 [0,1,0,0,1,0|2,0,0]=4 3341 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)C 240690a_100138425928_100000217210 [0,1,0,0,1,0|2,0,0]=4 3342 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)C 527a_100138425928_100000217210 [0,1,0,0,1,0|2,0,0]=4 3343 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Cl 11a_100138425928_100000217211 [0,1,0,0,1,0|2,0,0]=4 3344 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Cl 1626a_100138425928_100000217211 [0,1,0,0,1,0|2,0,0]=4 3345 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Cl 240690a_100138425928_100000217211 [0,1,0,0,1,0|2,0,0]=4 3346 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)Cl 527a_100138425928_100000217211 [0,1,0,0,1,0|2,0,0]=4 3347 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)F 11a_100138425928_100000239970 [0,1,0,0,1,0|2,0,0]=4 3348 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)F 1626a_100138425928_100000239970 [0,1,0,0,1,0|2,0,0]=4 3349 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)F 240690a_100138425928_100000239970 [0,1,0,0,1,0|2,0,0]=4 3350 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)F 527a_100138425928_100000239970 [0,1,0,0,1,0|2,0,0]=4 3351 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)I 11a_100138425928_100012353712 [0,1,0,0,1,0|2,0,0]=4 3352 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)I 1626a_100138425928_100012353712 [0,1,0,0,1,0|2,0,0]=4 3353 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)I 240690a_100138425928_100012353712 [0,1,0,0,1,0|2,0,0]=4 3354 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)I 527a_100138425928_100012353712 [0,1,0,0,1,0|2,0,0]=4 3355 B15R1.4047 COc1cc(ccc1C(=O)NC(C)C)O 271570a_203496583355_200011640141 [0,1,0,0,1,0|2,0,0]=4 3356 B15R1.4047 Cc1ccc(c(c1)C#N)C(=O)CC(C)C 1458a_200012184421_100000210624 [0,1,0,0,1,0|2,0,0]=4 3357 B15R1.4541 C=Cc1ccccc1C(=O)OC(C)(C)C 271570a_100011290941_100011942462 [0,1,0,0,1,0|1,0,1]=4 3358 B15R1.4541 CC(C)(C)NC(=O)c1ccccc1N[13CH3] 34a_100000180283_200025704644 [0,1,0,0,1,0|1,0,0]=3 3359 B15R1.4541 CC(C)(C)NC(=O)c1ccccc1N[13CH3] 7a_100000180283_200025704644 [0,1,0,0,1,0|1,0,0]=3 3360 B15R1.4541 CC(C)(C)NC(=O)c1ccccc1S[13CH3] 62a_200000154197_200025704644 [0,1,0,0,1,0|2,0,0]=4 3361 B15R1.4541 CC(C)(C)NC(=O)c1ccccc1S[13CH3] 62a_200025704644_200000154197 [0,1,0,0,1,0|2,0,0]=4 3362 B15R1.4541 CC(C)(C)OC(=O)c1ccccc1S[13CH3] 62a_100011942462_200025704644 [0,1,0,0,1,0|1,0,0]=3 3363 B15R1.4541 CC(C)(C)OC(=O)c1ccccc1S[13CH3] 62a_200025704644_100011942462 [0,1,0,0,1,0|1,0,0]=3 3364 B15R1.4541 CC(C)(C)OC(=O)c1cccnc1S[13CH3] 62a_100011933524_200025704644 [0,1,0,0,1,0|2,0,0]=4 3365 B15R1.4541 CC(C)(C)OC(=O)c1cccnc1S[13CH3] 62a_200025704644_100011933524 [0,1,0,0,1,0|2,0,0]=4 3366 B15R1.4541 CC(C)(C)OC(=O)c1ccncc1S[13CH3] 62a_100012344410_200025704644 [0,1,0,0,1,0|2,0,0]=4 3367 B15R1.4541 CC(C)(C)OC(=O)c1ccncc1S[13CH3] 62a_200025704644_100012344410 [0,1,0,0,1,0|2,0,0]=4 3368 B15R1.4541 CC(C)(C)OC(=O)c1ncccc1S[13CH3] 62a_100012355708_200025704644 [0,1,0,0,1,0|2,0,0]=4 3369 B15R1.4541 CC(C)(C)OC(=O)c1ncccc1S[13CH3] 62a_200025704644_100012355708 [0,1,0,0,1,0|2,0,0]=4 3370 B15R1.4541 CCc1ccccc1C(=O)C[Si](C)(C)C 1458a_100000689120_100000233785 [0,1,0,0,1,0|1,1,0]=4 3371 B15R1.4541 CCc1ccccc1C(=O)NC(C)(C)C 11a_100000715429_100000689120 [0,1,0,0,1,0|2,0,0]=4 3372 B15R1.4541 CCc1ccccc1C(=O)NC(C)(C)C 1626a_100000715429_100000689120 [0,1,0,0,1,0|2,0,0]=4 3373 B15R1.4541 CCc1ccccc1C(=O)NC(C)(C)C 240690a_100000715429_100000689120 [0,1,0,0,1,0|2,0,0]=4 3374 B15R1.4541 CCc1ccccc1C(=O)NC(C)(C)C 527a_100000715429_100000689120 [0,1,0,0,1,0|2,0,0]=4 3375 B15R1.4541 CNc1ccccc1C(=O)NC(C)(C)C 27a_100102657272_200000154197 [0,1,0,0,1,0|1,0,0]=3 3376 B15R1.4541 CNc1ccccc1C(=O)NC(C)(C)C 34a_100000180283_200000210301 [0,1,0,0,1,0|1,0,0]=3 3377 B15R1.4541 CNc1ccccc1C(=O)NC(C)(C)C 7a_100000180283_200000210301 [0,1,0,0,1,0|1,0,0]=3 3378 B15R1.4541 CNc1ncccc1C(=O)OC(C)(C)C 27a_100102657272_100011933524 [0,1,0,0,1,0|1,0,0]=3 3379 B15R1.4541 COc1ccccc1C(=O)C[Si](C)(C)C 1458a_100000185835_100000233785 [0,1,0,0,1,0|1,1,0]=4 3380 B15R1.4541 COc1ccccc1C(=O)NC(C)(C)C 11a_100000715429_100000185835 [0,1,0,0,1,0|2,0,0]=4 3381 B15R1.4541 COc1ccccc1C(=O)NC(C)(C)C 1626a_100000715429_100000185835 [0,1,0,0,1,0|2,0,0]=4 3382 B15R1.4541 COc1ccccc1C(=O)NC(C)(C)C 240690a_100000715429_100000185835 [0,1,0,0,1,0|2,0,0]=4 3383 B15R1.4541 COc1ccccc1C(=O)NC(C)(C)C 527a_100000715429_100000185835 [0,1,0,0,1,0|2,0,0]=4 3384 B15R1.4541 CSc1ccccc1C(=O)C[Si](C)(C)C 1458a_100000183967_100000233785 [0,1,0,0,1,0|1,1,0]=4 3385 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 11a_100000715429_100000183967 [0,1,0,0,1,0|2,0,0]=4 3386 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 1626a_100000715429_100000183967 [0,1,0,0,1,0|2,0,0]=4 3387 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 240690a_100000715429_100000183967 [0,1,0,0,1,0|2,0,0]=4 3388 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 527a_100000715429_100000183967 [0,1,0,0,1,0|2,0,0]=4 3389 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 62a_200000154197_200000210301 [0,1,0,0,1,0|2,0,0]=4 3390 B15R1.4541 CSc1ccccc1C(=O)NC(C)(C)C 62a_200000210301_200000154197 [0,1,0,0,1,0|2,0,0]=4 3391 B15R1.4541 CSc1ccccc1C(=O)OC(C)(C)C 62a_100011942462_200000210301 [0,1,0,0,1,0|1,0,0]=3 3392 B15R1.4541 CSc1ccccc1C(=O)OC(C)(C)C 62a_200000210301_100011942462 [0,1,0,0,1,0|1,0,0]=3 3393 B15R1.4541 CSc1cccnc1C(=O)OC(C)(C)C 62a_100012355708_200000210301 [0,1,0,0,1,0|2,0,0]=4 3394 B15R1.4541 CSc1cccnc1C(=O)OC(C)(C)C 62a_200000210301_100012355708 [0,1,0,0,1,0|2,0,0]=4 3395 B15R1.4541 CSc1cnccc1C(=O)OC(C)(C)C 62a_100012344410_200000210301 [0,1,0,0,1,0|2,0,0]=4 3396 B15R1.4541 CSc1cnccc1C(=O)OC(C)(C)C 62a_200000210301_100012344410 [0,1,0,0,1,0|2,0,0]=4 3397 B15R1.4541 CSc1ncccc1C(=O)OC(C)(C)C 62a_100011933524_200000210301 [0,1,0,0,1,0|2,0,0]=4 3398 B15R1.4541 CSc1ncccc1C(=O)OC(C)(C)C 62a_200000210301_100011933524 [0,1,0,0,1,0|2,0,0]=4 3399 B15R1.4809 CC(C)CC(=O)c1cccc(c1C#N)F 1458a_100000702252_100000210624 [0,1,0,0,1,0|2,0,0]=4 3400 B15R1.4809 CCc1c(cccc1C(=O)CC(C)C)Br 1458a_100010125490_100000210624 [0,1,0,0,1,0|1,0,0]=3 3401 B15R1.4809 CCc1c(cccc1C(=O)CC(C)O)Br 1458a_100010125490_100011218427 [0,1,0,0,1,0|2,0,0]=4 3402 B15R1.4809 CCc1c(cccc1C(=O)NC(C)C)Br 11a_100138425928_100010125490 [0,1,0,0,1,0|2,0,0]=4 3403 B15R1.4809 CCc1c(cccc1C(=O)NC(C)C)Br 1626a_100138425928_100010125490 [0,1,0,0,1,0|2,0,0]=4 3404 B15R1.4809 CCc1c(cccc1C(=O)NC(C)C)Br 240690a_100138425928_100010125490 [0,1,0,0,1,0|2,0,0]=4 3405 B15R1.4809 CCc1c(cccc1C(=O)NC(C)C)Br 527a_100138425928_100010125490 [0,1,0,0,1,0|2,0,0]=4 3406 B15R1.4809 CNc1c(cccc1[C@@H](N)CC(C)C)N 271570a_100015190218_100010510394 [0,1,0,0,1,0|1,0,1]=4 3407 B15R1.4809 COc1c(cccc1C(=O)CC(C)C)Br 1458a_100000689802_100000210624 [0,1,0,0,1,0|1,0,0]=3 3408 B15R1.4809 COc1c(cccc1C(=O)CC(C)C)C 1458a_100000187929_100000210624 [0,1,0,0,1,0|1,0,0]=3 3409 B15R1.4809 COc1c(cccc1C(=O)CC(C)C)Cl 1458a_100011934004_100000210624 [0,1,0,0,1,0|1,0,0]=3 3410 B15R1.4809 COc1c(cccc1C(=O)CC(C)C)F 1458a_100011218433_100000210624 [0,1,0,0,1,0|1,0,0]=3 3411 B15R1.4809 COc1c(cccc1C(=O)CC(C)C)O 1458a_100000080799_100000210624 [0,1,0,0,1,0|1,0,0]=3 3412 B15R1.4809 COc1c(cccc1C(=O)CC(C)O)Br 1458a_100000689802_100011218427 [0,1,0,0,1,0|2,0,0]=4 3413 B15R1.4809 COc1c(cccc1C(=O)CC(C)O)C 1458a_100000187929_100011218427 [0,1,0,0,1,0|2,0,0]=4 3414 B15R1.4809 COc1c(cccc1C(=O)CC(C)O)Cl 1458a_100011934004_100011218427 [0,1,0,0,1,0|2,0,0]=4 3415 B15R1.4809 COc1c(cccc1C(=O)CC(C)O)F 1458a_100011218433_100011218427 [0,1,0,0,1,0|2,0,0]=4 3416 B15R1.4809 COc1c(cccc1C(=O)CC(C)O)O 1458a_100000080799_100011218427 [0,1,0,0,1,0|2,0,0]=4 3417 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Br 11a_100138425928_100000689802 [0,1,0,0,1,0|2,0,0]=4 3418 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Br 1626a_100138425928_100000689802 [0,1,0,0,1,0|2,0,0]=4 3419 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Br 240690a_100138425928_100000689802 [0,1,0,0,1,0|2,0,0]=4 3420 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Br 527a_100138425928_100000689802 [0,1,0,0,1,0|2,0,0]=4 3421 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)C 11a_100138425928_100000187929 [0,1,0,0,1,0|2,0,0]=4 3422 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)C 1626a_100138425928_100000187929 [0,1,0,0,1,0|2,0,0]=4 3423 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)C 240690a_100138425928_100000187929 [0,1,0,0,1,0|2,0,0]=4 3424 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)C 527a_100138425928_100000187929 [0,1,0,0,1,0|2,0,0]=4 3425 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Cl 11a_100138425928_100011934004 [0,1,0,0,1,0|2,0,0]=4 3426 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Cl 1626a_100138425928_100011934004 [0,1,0,0,1,0|2,0,0]=4 3427 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Cl 240690a_100138425928_100011934004 [0,1,0,0,1,0|2,0,0]=4 3428 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)Cl 527a_100138425928_100011934004 [0,1,0,0,1,0|2,0,0]=4 3429 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)F 11a_100138425928_100011218433 [0,1,0,0,1,0|2,0,0]=4 3430 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)F 1626a_100138425928_100011218433 [0,1,0,0,1,0|2,0,0]=4 3431 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)F 240690a_100138425928_100011218433 [0,1,0,0,1,0|2,0,0]=4 3432 B15R1.4809 COc1c(cccc1C(=O)NC(C)C)F 527a_100138425928_100011218433 [0,1,0,0,1,0|2,0,0]=4 3433 B15R1.5509 C=C(C)CC(=O)c1ccccc1N(C)C 1458a_100011218752_100000748629 [0,1,0,0,1,0|0,0,2]=4 3434 B15R1.5509 C=C(C)c1ccccc1C(=O)NC(C)C 271570a_100000694244_200000152627 [0,1,0,0,1,0|2,0,0]=4 3435 B15R1.5509 C=C(C)c1ccccc1C(=O)OC(C)C 271570a_100000694244_100000169877 [0,1,0,0,1,0|1,0,0]=3 3436 B15R1.5509 CC(C)CC(=O)c1ccccc1C(C)C 1458a_100011941426_100000210624 [0,1,0,0,1,0|1,0,0]=3 3437 B15R1.5509 CC(C)CC(=O)c1ccccc1C(F)F 1458a_100009872251_100000210624 [0,1,0,0,1,0|2,0,0]=4 3438 B15R1.5509 CC(C)CC(=O)c1ccccc1I(=O)=O 1458a_100000061294_100000210624 [0,1,0,0,1,0|2,0,0]=4 3439 B15R1.5509 CC(C)CC(=O)c1ccccc1N(C)C 1458a_100011218752_100000210624 [0,1,0,0,1,0|0,0,0]=2 3440 B15R1.5509 CC(C)CC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000210624 [0,1,0,0,1,0|1,0,0]=3 3441 B15R1.5509 CC(C)CC(=O)c1ccccc1[N+](=O)[O-] 1458a_100000188706_100000210624 [0,1,0,0,1,0|1,0,1]=4 3442 B15R1.5509 CC(C)C[C@H](N)c1ccccc1N(C)C 271570a_100015190218_100011290883 [0,1,0,0,1,0|1,0,1]=4 3443 B15R1.5509 CC(C)NC(=O)c1ccccc1C(C)C 11a_100138425928_100011941426 [0,1,0,0,1,0|2,0,0]=4 3444 B15R1.5509 CC(C)NC(=O)c1ccccc1C(C)C 1626a_100138425928_100011941426 [0,1,0,0,1,0|2,0,0]=4 3445 B15R1.5509 CC(C)NC(=O)c1ccccc1C(C)C 240690a_100138425928_100011941426 [0,1,0,0,1,0|2,0,0]=4 3446 B15R1.5509 CC(C)NC(=O)c1ccccc1C(C)C 527a_100138425928_100011941426 [0,1,0,0,1,0|2,0,0]=4 3447 B15R1.5509 CC(C)NC(=O)c1ccccc1N(C)C 11a_100138425928_100011218752 [0,1,0,0,1,0|1,0,0]=3 3448 B15R1.5509 CC(C)NC(=O)c1ccccc1N(C)C 1626a_100138425928_100011218752 [0,1,0,0,1,0|1,0,0]=3 3449 B15R1.5509 CC(C)NC(=O)c1ccccc1N(C)C 240690a_100138425928_100011218752 [0,1,0,0,1,0|1,0,0]=3 3450 B15R1.5509 CC(C)NC(=O)c1ccccc1N(C)C 27a_100102631434_200000152627 [0,1,0,0,1,0|1,0,0]=3 3451 B15R1.5509 CC(C)NC(=O)c1ccccc1N(C)C 527a_100138425928_100011218752 [0,1,0,0,1,0|1,0,0]=3 3452 B15R1.5509 CC(C)NC(=O)c1ccccc1S(=O)C 1626a_100138425928_100000204632 [0,1,0,0,1,0|2,0,0]=4 3453 B15R1.5509 CC(C)NC(=O)c1ccccc1S(=O)C 240690a_100138425928_100000204632 [0,1,0,0,1,0|2,0,0]=4 3454 B15R1.5509 CC(C)OC(=O)c1ccccc1N(C)C 269982a_100000170470_200000210301 [0,1,0,0,1,0|0,0,0]=2 3455 B15R1.5509 CC(C)OC(=O)c1ccccc1N(C)C 38a_100000170470_200000210301 [0,1,0,0,1,0|0,0,0]=2 3456 B15R1.5509 CC(C)OC(=O)c1ccccc1N(C)[13CH3] 269982a_100000170470_200025704644 [0,1,0,0,1,0|0,0,0]=2 3457 B15R1.5509 CC(C)OC(=O)c1ccccc1N(C)[13CH3] 38a_100000170470_200025704644 [0,1,0,0,1,0|0,0,0]=2 3458 B15R1.5509 CC(O)CC(=O)c1ccccc1C(C)C 1458a_100011941426_100011218427 [0,1,0,0,1,0|2,0,0]=4 3459 B15R1.5509 CC(O)CC(=O)c1ccccc1N(C)C 1458a_100011218752_100011218427 [0,1,0,0,1,0|1,0,0]=3 3460 B15R1.5509 CC(O)CC(=O)c1ccccc1S(=O)C 1458a_100000204632_100011218427 [0,1,0,0,1,0|2,0,0]=4 3461 B15R1.5509 CN(C)c1ccccc1C(=O)CC(F)F 1458a_100011218752_100011934356 [0,1,0,0,1,0|2,0,0]=4 3462 B15R1.12622 CC(C)CC(C)(O)c1ccccc1N[13CH3] 7a_200009983031_200025704644 [0,1,0,0,1,0|0,0,2]=4 3463 B15R1.12622 CC(C)OS(=O)(=O)c1ccccc1S[13CH3] 62a_100010876974_200025704644 [0,1,0,0,1,0|2,0,0]=4 3464 B15R1.12622 CNc1ccccc1C(C)(O)CC(C)C 7a_200009983031_200000210301 [0,1,0,0,1,0|0,0,2]=4 3465 B15R1.12622 CNc1ccccc1S(=O)(=O)NC(C)C 27a_100102657272_200000164685 [0,1,0,0,1,0|2,0,0]=4 3466 B15R1.12622 CSc1ccccc1S(=O)(=O)OC(C)C 62a_100010876974_200000210301 [0,1,0,0,1,0|2,0,0]=4 3467 B17R1.348 CC(C)CCC(=O)Nc1ccccc1CCO 22a_100011215289_100000181311 [0,1,0,0,0,1|2,0,0]=4 3468 B17R1.348 CC(C)CCC(=O)Nc1ccccc1CCO 527a_100011215289_100000181311 [0,1,0,0,0,1|2,0,0]=4 3469 B17R1.348 CCCc1ccccc1NC(=O)CCC(C)C 11a_100000737634_100000181311 [0,1,0,0,0,1|2,0,0]=4 3470 B17R1.348 CCCc1ccccc1NC(=O)CCC(C)C 1626a_100000737634_100000181311 [0,1,0,0,0,1|2,0,0]=4 3471 B17R1.348 CCCc1ccccc1NC(=O)CCC(C)C 22a_100000737634_100000181311 [0,1,0,0,0,1|2,0,0]=4 3472 B17R1.348 CCCc1ccccc1NC(=O)CCC(C)C 527a_100000737634_100000181311 [0,1,0,0,0,1|2,0,0]=4 3473 B17R1.348 CCCc1ccccc1NC(=O)NCC(C)C 2430a_100000737634_100000210953 [0,1,0,0,0,1|2,0,0]=4 3474 B17R1.348 CCCc1ccccc1NC(=O)NCC(C)C 512a_100000737634_100000210953 [0,1,0,0,0,1|2,0,0]=4 3475 B17R1.348 CCOc1ccccc1CC(=O)CCC(C)C 1458a_100011247627_100000210312 [0,1,0,0,0,1|2,0,0]=4 3476 B17R1.348 CCOc1ccccc1CC(=O)NCC(C)C 11a_100000210953_100011247627 [0,1,0,0,0,1|2,0,0]=4 3477 B17R1.348 CCOc1ccccc1CC(=O)NCC(C)C 1626a_100000210953_100011247627 [0,1,0,0,0,1|2,0,0]=4 3478 B17R1.348 CCOc1ccccc1CC(=O)NCC(C)C 240690a_100000210953_100011247627 [0,1,0,0,0,1|2,0,0]=4 3479 B17R1.348 CCOc1ccccc1CC(=O)NCC(C)C 527a_100000210953_100011247627 [0,1,0,0,0,1|2,0,0]=4 3480 B17R1.348 CCOc1ccccc1NC(=O)CCC(C)C 11a_100000211218_100000181311 [0,1,0,0,0,1|2,0,0]=4 3481 B17R1.348 CCOc1ccccc1NC(=O)CCC(C)C 1626a_100000211218_100000181311 [0,1,0,0,0,1|2,0,0]=4 3482 B17R1.348 CCOc1ccccc1NC(=O)CCC(C)C 22a_100000211218_100000181311 [0,1,0,0,0,1|2,0,0]=4 3483 B17R1.348 CCOc1ccccc1NC(=O)NCC(C)C 2430a_100000211218_100000210953 [0,1,0,0,0,1|2,0,0]=4 3484 B17R1.348 CCSc1ccccc1NC(=O)CCC(C)C 11a_100011223125_100000181311 [0,1,0,0,0,1|2,0,0]=4 3485 B17R1.348 CCSc1ccccc1NC(=O)CCC(C)C 1626a_100011223125_100000181311 [0,1,0,0,0,1|2,0,0]=4 3486 B17R1.348 CCSc1ccccc1NC(=O)CCC(C)C 22a_100011223125_100000181311 [0,1,0,0,0,1|2,0,0]=4 3487 B17R1.348 CCSc1ccccc1NC(=O)NCC(C)C 2430a_100011223125_100000210953 [0,1,0,0,0,1|2,0,0]=4 3488 B17R1.348 CCSc1ccccc1NC(=O)NCC(C)C 512a_100011223125_100000210953 [0,1,0,0,0,1|2,0,0]=4 3489 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Br 11a_100012354963_100000181311 [0,1,0,0,0,1|2,0,0]=4 3490 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Br 1626a_100012354963_100000181311 [0,1,0,0,0,1|2,0,0]=4 3491 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Br 22a_100012354963_100000181311 [0,1,0,0,0,1|2,0,0]=4 3492 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Br 527a_100012354963_100000181311 [0,1,0,0,0,1|2,0,0]=4 3493 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Cl 11a_200012281948_100000181311 [0,1,0,0,0,1|2,0,0]=4 3494 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Cl 1626a_200012281948_100000181311 [0,1,0,0,0,1|2,0,0]=4 3495 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Cl 22a_200012281948_100000181311 [0,1,0,0,0,1|2,0,0]=4 3496 B17R1.4715 CCc1ccc(cc1NC(=O)CCC(C)C)Cl 527a_200012281948_100000181311 [0,1,0,0,0,1|2,0,0]=4 3497 B17R1.4715 CCc1ccc(cc1NC(=O)NCC(C)C)Br 2430a_100012354963_100000210953 [0,1,0,0,0,1|2,0,0]=4 3498 B17R1.4715 CCc1ccc(cc1NC(=O)NCC(C)C)Br 512a_100012354963_100000210953 [0,1,0,0,0,1|2,0,0]=4 3499 B17R1.4715 CCc1ccc(cc1NC(=O)NCC(C)C)Cl 2430a_200012281948_100000210953 [0,1,0,0,0,1|2,0,0]=4 3500 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)Br 1458a_100000181311_100000204665 [0,1,0,0,0,1|2,0,0]=4 3501 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)Br 1458a_100000763194_100000210312 [0,1,0,0,0,1|2,0,0]=4 3502 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)C 1458a_100000181311_100000199068 [0,1,0,0,0,1|2,0,0]=4 3503 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)C 1458a_100000204598_100000210312 [0,1,0,0,0,1|2,0,0]=4 3504 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)Cl 1458a_100000181311_100000209806 [0,1,0,0,0,1|2,0,0]=4 3505 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)Cl 1458a_100000209874_100000210312 [0,1,0,0,0,1|2,0,0]=4 3506 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)F 1458a_100000181311_100011830354 [0,1,0,0,0,1|2,0,0]=4 3507 B17R1.4715 COc1ccc(cc1CC(=O)CCC(C)C)F 1458a_100000707523_100000210312 [0,1,0,0,0,1|2,0,0]=4 3508 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Br 11a_100000210953_100000763194 [0,1,0,0,0,1|2,0,0]=4 3509 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Br 1626a_100000210953_100000763194 [0,1,0,0,0,1|2,0,0]=4 3510 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Br 240690a_100000210953_100000763194 [0,1,0,0,0,1|2,0,0]=4 3511 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Br 527a_100000210953_100000763194 [0,1,0,0,0,1|2,0,0]=4 3512 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)C 11a_100000210953_100000204598 [0,1,0,0,0,1|2,0,0]=4 3513 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)C 1626a_100000210953_100000204598 [0,1,0,0,0,1|2,0,0]=4 3514 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)C 240690a_100000210953_100000204598 [0,1,0,0,0,1|2,0,0]=4 3515 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)C 527a_100000210953_100000204598 [0,1,0,0,0,1|2,0,0]=4 3516 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Cl 11a_100000210953_100000209874 [0,1,0,0,0,1|2,0,0]=4 3517 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Cl 1626a_100000210953_100000209874 [0,1,0,0,0,1|2,0,0]=4 3518 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Cl 240690a_100000210953_100000209874 [0,1,0,0,0,1|2,0,0]=4 3519 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)Cl 527a_100000210953_100000209874 [0,1,0,0,0,1|2,0,0]=4 3520 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)F 11a_100000210953_100000707523 [0,1,0,0,0,1|2,0,0]=4 3521 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)F 1626a_100000210953_100000707523 [0,1,0,0,0,1|2,0,0]=4 3522 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)F 240690a_100000210953_100000707523 [0,1,0,0,0,1|2,0,0]=4 3523 B17R1.4715 COc1ccc(cc1CC(=O)NCC(C)C)F 527a_100000210953_100000707523 [0,1,0,0,0,1|2,0,0]=4 3524 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Br 11a_100000743470_100000181311 [0,1,0,0,0,1|2,0,0]=4 3525 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Br 1626a_100000743470_100000181311 [0,1,0,0,0,1|2,0,0]=4 3526 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Br 22a_100000743470_100000181311 [0,1,0,0,0,1|2,0,0]=4 3527 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Br 527a_100000743470_100000181311 [0,1,0,0,0,1|2,0,0]=4 3528 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)C 11a_100000210980_100000181311 [0,1,0,0,0,1|2,0,0]=4 3529 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)C 1626a_100000210980_100000181311 [0,1,0,0,0,1|2,0,0]=4 3530 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)C 22a_100000210980_100000181311 [0,1,0,0,0,1|2,0,0]=4 3531 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)C 527a_100000210980_100000181311 [0,1,0,0,0,1|2,0,0]=4 3532 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Cl 11a_100000182114_100000181311 [0,1,0,0,0,1|2,0,0]=4 3533 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Cl 1626a_100000182114_100000181311 [0,1,0,0,0,1|2,0,0]=4 3534 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)Cl 22a_100000182114_100000181311 [0,1,0,0,0,1|2,0,0]=4 3535 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)F 11a_100000757179_100000181311 [0,1,0,0,0,1|2,0,0]=4 3536 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)F 1626a_100000757179_100000181311 [0,1,0,0,0,1|2,0,0]=4 3537 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)F 22a_100000757179_100000181311 [0,1,0,0,0,1|2,0,0]=4 3538 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)F 527a_100000757179_100000181311 [0,1,0,0,0,1|2,0,0]=4 3539 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)I 11a_100011249504_100000181311 [0,1,0,0,0,1|2,0,0]=4 3540 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)I 1626a_100011249504_100000181311 [0,1,0,0,0,1|2,0,0]=4 3541 B17R1.4715 COc1ccc(cc1NC(=O)CCC(C)C)I 22a_100011249504_100000181311 [0,1,0,0,0,1|2,0,0]=4 3542 B17R1.4715 COc1ccc(cc1NC(=O)NCC(C)C)Br 2430a_100000743470_100000210953 [0,1,0,0,0,1|2,0,0]=4 3543 B17R1.4715 COc1ccc(cc1NC(=O)NCC(C)C)C 2430a_100000210980_100000210953 [0,1,0,0,0,1|2,0,0]=4 3544 B17R1.4715 COc1ccc(cc1NC(=O)NCC(C)C)Cl 2430a_100000182114_100000210953 [0,1,0,0,0,1|2,0,0]=4 3545 B17R1.4715 COc1ccc(cc1NC(=O)NCC(C)C)F 2430a_100000757179_100000210953 [0,1,0,0,0,1|2,0,0]=4 3546 B17R1.4715 COc1ccc(cc1NC(=O)NCC(C)C)I 2430a_100011249504_100000210953 [0,1,0,0,0,1|2,0,0]=4 3547 B17R1.4715 CSc1ccc(cc1NC(=O)CCC(C)C)Cl 11a_100000745667_100000181311 [0,1,0,0,0,1|2,0,0]=4 3548 B17R1.4715 CSc1ccc(cc1NC(=O)CCC(C)C)Cl 1626a_100000745667_100000181311 [0,1,0,0,0,1|2,0,0]=4 3549 B17R1.4715 CSc1ccc(cc1NC(=O)CCC(C)C)Cl 22a_100000745667_100000181311 [0,1,0,0,0,1|2,0,0]=4 3550 B17R1.4715 CSc1ccc(cc1NC(=O)NCC(C)C)Cl 2430a_100000745667_100000210953 [0,1,0,0,0,1|2,0,0]=4 3551 B17R1.4715 CSc1ccc(cc1NC(=O)NCC(C)C)Cl 512a_100000745667_100000210953 [0,1,0,0,0,1|2,0,0]=4 3552 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Br 11a_100000686106_100000181311 [0,1,0,0,0,1|2,0,0]=4 3553 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Br 1626a_100000686106_100000181311 [0,1,0,0,0,1|2,0,0]=4 3554 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Br 22a_100000686106_100000181311 [0,1,0,0,0,1|2,0,0]=4 3555 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Br 527a_100000686106_100000181311 [0,1,0,0,0,1|2,0,0]=4 3556 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Cl 11a_100012017146_100000181311 [0,1,0,0,0,1|2,0,0]=4 3557 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Cl 1626a_100012017146_100000181311 [0,1,0,0,0,1|2,0,0]=4 3558 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)Cl 22a_100012017146_100000181311 [0,1,0,0,0,1|2,0,0]=4 3559 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)I 11a_100000014069_100000181311 [0,1,0,0,0,1|2,0,0]=4 3560 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)I 1626a_100000014069_100000181311 [0,1,0,0,0,1|2,0,0]=4 3561 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)I 22a_100000014069_100000181311 [0,1,0,0,0,1|2,0,0]=4 3562 B17R1.5361 CCc1cc(ccc1NC(=O)CCC(C)C)I 527a_100000014069_100000181311 [0,1,0,0,0,1|2,0,0]=4 3563 B17R1.5361 CCc1cc(ccc1NC(=O)NCC(C)C)Br 2430a_100000686106_100000210953 [0,1,0,0,0,1|2,0,0]=4 3564 B17R1.5361 CCc1cc(ccc1NC(=O)NCC(C)C)Br 512a_100000686106_100000210953 [0,1,0,0,0,1|2,0,0]=4 3565 B17R1.5361 CCc1cc(ccc1NC(=O)NCC(C)C)Cl 2430a_100012017146_100000210953 [0,1,0,0,0,1|2,0,0]=4 3566 B17R1.5361 CCc1cc(ccc1NC(=O)NCC(C)C)I 2430a_100000014069_100000210953 [0,1,0,0,0,1|2,0,0]=4 3567 B17R1.5361 CCc1cc(ccc1NC(=O)NCC(C)C)I 512a_100000014069_100000210953 [0,1,0,0,0,1|2,0,0]=4 3568 B17R1.5361 COc1cc(ccc1CC(=O)CCC(C)C)Br 1458a_100000181311_100012359436 [0,1,0,0,0,1|2,0,0]=4 3569 B17R1.5361 COc1cc(ccc1CC(=O)CCC(C)C)Br 1458a_100010245118_100000210312 [0,1,0,0,0,1|2,0,0]=4 3570 B17R1.5361 COc1cc(ccc1CC(=O)CCC(C)C)Cl 1458a_100010217541_100000210312 [0,1,0,0,0,1|2,0,0]=4 3571 B17R1.5361 COc1cc(ccc1CC(=O)CCC(C)C)F 1458a_100000062011_100000210312 [0,1,0,0,0,1|2,0,0]=4 3572 B17R1.5361 COc1cc(ccc1CC(=O)CCC(C)C)F 1458a_100000181311_200010171551 [0,1,0,0,0,1|2,0,0]=4 3573 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Br 11a_100000210953_100010245118 [0,1,0,0,0,1|2,0,0]=4 3574 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Br 1626a_100000210953_100010245118 [0,1,0,0,0,1|2,0,0]=4 3575 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Br 240690a_100000210953_100010245118 [0,1,0,0,0,1|2,0,0]=4 3576 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Br 527a_100000210953_100010245118 [0,1,0,0,0,1|2,0,0]=4 3577 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Cl 11a_100000210953_100010217541 [0,1,0,0,0,1|2,0,0]=4 3578 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Cl 1626a_100000210953_100010217541 [0,1,0,0,0,1|2,0,0]=4 3579 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Cl 240690a_100000210953_100010217541 [0,1,0,0,0,1|2,0,0]=4 3580 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)Cl 527a_100000210953_100010217541 [0,1,0,0,0,1|2,0,0]=4 3581 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)F 11a_100000210953_100000062011 [0,1,0,0,0,1|2,0,0]=4 3582 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)F 1626a_100000210953_100000062011 [0,1,0,0,0,1|2,0,0]=4 3583 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)F 240690a_100000210953_100000062011 [0,1,0,0,0,1|2,0,0]=4 3584 B17R1.5361 COc1cc(ccc1CC(=O)NCC(C)C)F 527a_100000210953_100000062011 [0,1,0,0,0,1|2,0,0]=4 3585 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Br 11a_100011279103_100000181311 [0,1,0,0,0,1|2,0,0]=4 3586 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Br 1626a_100011279103_100000181311 [0,1,0,0,0,1|2,0,0]=4 3587 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Br 22a_100011279103_100000181311 [0,1,0,0,0,1|2,0,0]=4 3588 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)C 11a_100000746441_100000181311 [0,1,0,0,0,1|2,0,0]=4 3589 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)C 1626a_100000746441_100000181311 [0,1,0,0,0,1|2,0,0]=4 3590 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)C 22a_100000746441_100000181311 [0,1,0,0,0,1|2,0,0]=4 3591 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)C 527a_100000746441_100000181311 [0,1,0,0,0,1|2,0,0]=4 3592 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Cl 11a_100000707585_100000181311 [0,1,0,0,0,1|2,0,0]=4 3593 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Cl 1626a_100000707585_100000181311 [0,1,0,0,0,1|2,0,0]=4 3594 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)Cl 22a_100000707585_100000181311 [0,1,0,0,0,1|2,0,0]=4 3595 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)F 11a_100000737216_100000181311 [0,1,0,0,0,1|2,0,0]=4 3596 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)F 1626a_100000737216_100000181311 [0,1,0,0,0,1|2,0,0]=4 3597 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)F 22a_100000737216_100000181311 [0,1,0,0,0,1|2,0,0]=4 3598 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)F 527a_100000737216_100000181311 [0,1,0,0,0,1|2,0,0]=4 3599 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)I 11a_100015196925_100000181311 [0,1,0,0,0,1|2,0,0]=4 3600 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)I 1626a_100015196925_100000181311 [0,1,0,0,0,1|2,0,0]=4 3601 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)I 22a_100015196925_100000181311 [0,1,0,0,0,1|2,0,0]=4 3602 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)O 22a_100015326901_100000181311 [0,1,0,0,0,1|2,0,0]=4 3603 B17R1.5361 COc1cc(ccc1NC(=O)CCC(C)C)O 527a_100015326901_100000181311 [0,1,0,0,0,1|2,0,0]=4 3604 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)Br 2430a_100011279103_100000210953 [0,1,0,0,0,1|2,0,0]=4 3605 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)C 2430a_100000746441_100000210953 [0,1,0,0,0,1|2,0,0]=4 3606 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)Cl 2430a_100000707585_100000210953 [0,1,0,0,0,1|2,0,0]=4 3607 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)F 2430a_100000737216_100000210953 [0,1,0,0,0,1|2,0,0]=4 3608 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)I 2430a_100015196925_100000210953 [0,1,0,0,0,1|2,0,0]=4 3609 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)I 512a_100015196925_100000210953 [0,1,0,0,0,1|2,0,0]=4 3610 B17R1.5361 COc1cc(ccc1NC(=O)NCC(C)C)O 2430a_100015326901_100000210953 [0,1,0,0,0,1|2,0,0]=4 3611 B17R1.6549 CCc1ccccc1NC(=O)C(=O)CC(C)C 1458a_200011297324_100000210624 [0,1,0,0,0,1|2,0,0]=4 3612 B17R1.6549 CCc1ccccc1NC(=O)N(C)CC(C)C 2430a_100000212081_100000747067 [0,1,0,0,0,1|2,0,0]=4 3613 B17R1.6549 CCc1ccccc1NC(=O)[C@@H](O)CC(C)C 1626a_100000212081_100012027011 [0,1,0,0,0,1|2,0,0]=4 3614 B17R1.6549 CCc1ccccc1NC(=O)[C@@H](O)CC(C)C 22a_100000212081_100012027011 [0,1,0,0,0,1|2,0,0]=4 3615 B17R1.6549 COc1ccccc1CC(=O)C(C)CC(C)C 1458a_100000211604_100000731052 [0,1,0,0,0,1|2,0,0]=4 3616 B17R1.6549 COc1ccccc1CC(=O)N(C)CC(C)C 11a_100000747067_100000211604 [0,1,0,0,0,1|2,0,0]=4 3617 B17R1.6549 COc1ccccc1CC(=O)N(C)CC(C)C 1626a_100000747067_100000211604 [0,1,0,0,0,1|2,0,0]=4 3618 B17R1.6549 COc1ccccc1CC(=O)N(C)CC(C)C 240690a_100000747067_100000211604 [0,1,0,0,0,1|2,0,0]=4 3619 B17R1.6549 COc1ccccc1CC(=O)N(C)CC(C)C 527a_100000747067_100000211604 [0,1,0,0,0,1|2,0,0]=4 3620 B17R1.6549 COc1ccccc1CC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210004 [0,1,0,0,0,1|2,0,0]=4 3621 B17R1.6549 COc1ccccc1NC(=O)C(=O)CC(C)C 1458a_200011297187_100000210624 [0,1,0,0,0,1|2,0,0]=4 3622 B17R1.6549 COc1ccccc1NC(=O)N(C)CC(C)C 2430a_100000210025_100000747067 [0,1,0,0,0,1|2,0,0]=4 3623 B17R1.6549 COc1ccccc1NC(=O)[C@@H](O)CC(C)C 1626a_100000210025_100012027011 [0,1,0,0,0,1|2,0,0]=4 3624 B17R1.6549 COc1ccccc1NC(=O)[C@@H](O)CC(C)C 22a_100000210025_100012027011 [0,1,0,0,0,1|2,0,0]=4 3625 B17R1.6549 CSc1ccccc1CC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000699184 [0,1,0,0,0,1|2,0,0]=4 3626 B17R1.6549 CSc1ccccc1NC(=O)N(C)CC(C)C 2430a_100000211160_100000747067 [0,1,0,0,0,1|2,0,0]=4 3627 B17R1.6549 CSc1ccccc1NC(=O)[C@@H](O)CC(C)C 22a_100000211160_100012027011 [0,1,0,0,0,1|2,0,0]=4 3628 B17R1.6550 CCc1ccccc1NC(=O)NC(C)C(C)C 2430a_100000212081_100000211541 [0,1,0,0,0,1|2,0,0]=4 3629 B17R1.6550 COc1ccccc1CC(=O)NC(C)C(C)C 11a_100000211541_100000211604 [0,1,0,0,0,1|2,0,0]=4 3630 B17R1.6550 COc1ccccc1CC(=O)NC(C)C(C)C 1626a_100000211541_100000211604 [0,1,0,0,0,1|2,0,0]=4 3631 B17R1.6550 COc1ccccc1CC(=O)NC(C)C(C)C 240690a_100000211541_100000211604 [0,1,0,0,0,1|2,0,0]=4 3632 B17R1.6550 COc1ccccc1CC(=O)NC(C)C(C)C 527a_100000211541_100000211604 [0,1,0,0,0,1|2,0,0]=4 3633 B17R1.6550 COc1ccccc1NC(=O)NC(C)C(C)C 2430a_100000210025_100000211541 [0,1,0,0,0,1|2,0,0]=4 3634 B17R1.6550 CSc1ccccc1NC(=O)NC(C)C(C)C 2430a_100000211160_100000211541 [0,1,0,0,0,1|2,0,0]=4 3635 B17R1.6550 CSc1ccccc1NC(=O)NC(C)C(C)C 512a_100000211160_100000211541 [0,1,0,0,0,1|2,0,0]=4 3636 B17R1.6552 CCC(C)CCC(=O)Cc1ccccc1OC 1458a_100000701222_100000210004 [0,1,0,0,0,1|2,0,0]=4 3637 B17R1.6552 CCC(C)CCC(=O)Cc1ccccc1SC 1458a_100000701222_100000699184 [0,1,0,0,0,1|2,0,0]=4 3638 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1OC 11a_100000210025_100000701222 [0,1,0,0,0,1|2,0,0]=4 3639 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1OC 1626a_100000210025_100000701222 [0,1,0,0,0,1|2,0,0]=4 3640 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1OC 22a_100000210025_100000701222 [0,1,0,0,0,1|2,0,0]=4 3641 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1OC 527a_100000210025_100000701222 [0,1,0,0,0,1|2,0,0]=4 3642 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1SC 11a_100000211160_100000701222 [0,1,0,0,0,1|2,0,0]=4 3643 B17R1.6552 CCC(C)CCC(=O)Nc1ccccc1SC 22a_100000211160_100000701222 [0,1,0,0,0,1|2,0,0]=4 3644 B17R1.6552 CCC(C)CNC(=O)Cc1ccccc1OC 11a_100020588543_100000211604 [0,1,0,0,0,1|2,0,0]=4 3645 B17R1.6552 CCC(C)CNC(=O)Cc1ccccc1OC 1626a_100020588543_100000211604 [0,1,0,0,0,1|2,0,0]=4 3646 B17R1.6552 CCC(C)CNC(=O)Cc1ccccc1OC 240690a_100020588543_100000211604 [0,1,0,0,0,1|2,0,0]=4 3647 B17R1.6552 CCC(C)CNC(=O)Cc1ccccc1OC 527a_100020588543_100000211604 [0,1,0,0,0,1|2,0,0]=4 3648 B17R1.6552 CCC(C)CNC(=O)Nc1ccccc1OC 2430a_100000210025_100020588543 [0,1,0,0,0,1|2,0,0]=4 3649 B17R1.6552 CCC(C)CNC(=O)Nc1ccccc1SC 2430a_100000211160_100020588543 [0,1,0,0,0,1|2,0,0]=4 3650 B17R1.6552 CCC(C)CNC(=O)Nc1ccccc1SC 512a_100000211160_100020588543 [0,1,0,0,0,1|2,0,0]=4 3651 B17R1.6552 CCc1ccccc1NC(=O)CCC(C)CC 11a_100000212081_100000701222 [0,1,0,0,0,1|2,0,0]=4 3652 B17R1.6552 CCc1ccccc1NC(=O)CCC(C)CC 1626a_100000212081_100000701222 [0,1,0,0,0,1|2,0,0]=4 3653 B17R1.6552 CCc1ccccc1NC(=O)CCC(C)CC 22a_100000212081_100000701222 [0,1,0,0,0,1|2,0,0]=4 3654 B17R1.6552 CCc1ccccc1NC(=O)CCC(C)CC 527a_100000212081_100000701222 [0,1,0,0,0,1|2,0,0]=4 3655 B17R1.6552 CCc1ccccc1NC(=O)NCC(C)CC 2430a_100000212081_100020588543 [0,1,0,0,0,1|2,0,0]=4 3656 B17R1.6552 CCc1ccccc1NC(=O)NCC(C)CO 2430a_100000212081_100000744482 [0,1,0,0,0,1|2,0,0]=4 3657 B17R1.6552 CCc1ccccc1NC(=O)NC[C@@H](C)OC 2430a_100000212081_100020591295 [0,1,0,0,0,1|2,0,0]=4 3658 B17R1.6552 CO[C@H](C)CNC(=O)Nc1ccccc1SC 2430a_100000211160_100020591295 [0,1,0,0,0,1|2,0,0]=4 3659 B17R1.6552 CO[C@H](C)CNC(=O)Nc1ccccc1SC 512a_100000211160_100020591295 [0,1,0,0,0,1|2,0,0]=4 3660 B17R1.6552 COc1ccccc1CC(=O)NCC(C)CO 240690a_100000744482_100000211604 [0,1,0,0,0,1|2,0,0]=4 3661 B17R1.6552 COc1ccccc1CC(=O)NCC(C)CO 527a_100000744482_100000211604 [0,1,0,0,0,1|2,0,0]=4 3662 B17R1.6552 COc1ccccc1CC(=O)NC[C@@H](C)OC 11a_100020591295_100000211604 [0,1,0,0,0,1|2,0,0]=4 3663 B17R1.6552 COc1ccccc1CC(=O)NC[C@@H](C)OC 1626a_100020591295_100000211604 [0,1,0,0,0,1|2,0,0]=4 3664 B17R1.6552 COc1ccccc1CC(=O)NC[C@@H](C)OC 240690a_100020591295_100000211604 [0,1,0,0,0,1|2,0,0]=4 3665 B17R1.6552 COc1ccccc1CC(=O)NC[C@@H](C)OC 527a_100020591295_100000211604 [0,1,0,0,0,1|2,0,0]=4 3666 B17R1.6552 COc1ccccc1NC(=O)NCC(C)CO 2430a_100000210025_100000744482 [0,1,0,0,0,1|2,0,0]=4 3667 B17R1.6552 COc1ccccc1NC(=O)NC[C@@H](C)OC 2430a_100000210025_100020591295 [0,1,0,0,0,1|2,0,0]=4 3668 B17R1.6552 CSc1ccccc1NC(=O)NCC(C)CO 2430a_100000211160_100000744482 [0,1,0,0,0,1|2,0,0]=4 3669 B17R1.6552 CSc1ccccc1NC(=O)NCC(C)CO 512a_100000211160_100000744482 [0,1,0,0,0,1|2,0,0]=4 3670 B17R1.6578 CCc1ccccc1NC(=O)CCC(C)(C)C 11a_100000212081_100000757465 [0,1,0,0,0,1|2,0,0]=4 3671 B17R1.6578 CCc1ccccc1NC(=O)CCC(C)(C)C 1626a_100000212081_100000757465 [0,1,0,0,0,1|2,0,0]=4 3672 B17R1.6578 CCc1ccccc1NC(=O)CCC(C)(C)C 22a_100000212081_100000757465 [0,1,0,0,0,1|2,0,0]=4 3673 B17R1.6578 CCc1ccccc1NC(=O)CCC(C)(C)C 527a_100000212081_100000757465 [0,1,0,0,0,1|2,0,0]=4 3674 B17R1.6578 CCc1ccccc1NC(=O)NCC(C)(C)C 2430a_100000212081_100000743828 [0,1,0,0,0,1|2,0,0]=4 3675 B17R1.6578 CCc1ccccc1NC(=O)NCC(C)(C)F 2430a_100000212081_100020643315 [0,1,0,0,0,1|2,0,0]=4 3676 B17R1.6578 CCc1ccccc1NC(=O)NCC(C)(C)O 2430a_100000212081_100000751335 [0,1,0,0,0,1|2,0,0]=4 3677 B17R1.6578 COc1ccccc1CC(=O)CCC(C)(C)C 1458a_100000211604_100000755188 [0,1,0,0,0,1|2,0,0]=4 3678 B17R1.6578 COc1ccccc1CC(=O)CCC(C)(C)C 1458a_100000757465_100000210004 [0,1,0,0,0,1|2,0,0]=4 3679 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)C 11a_100000743828_100000211604 [0,1,0,0,0,1|2,0,0]=4 3680 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)C 1626a_100000743828_100000211604 [0,1,0,0,0,1|2,0,0]=4 3681 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)C 240690a_100000743828_100000211604 [0,1,0,0,0,1|2,0,0]=4 3682 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)C 527a_100000743828_100000211604 [0,1,0,0,0,1|2,0,0]=4 3683 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)F 11a_100020643315_100000211604 [0,1,0,0,0,1|2,0,0]=4 3684 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)F 1626a_100020643315_100000211604 [0,1,0,0,0,1|2,0,0]=4 3685 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)F 240690a_100020643315_100000211604 [0,1,0,0,0,1|2,0,0]=4 3686 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)F 527a_100020643315_100000211604 [0,1,0,0,0,1|2,0,0]=4 3687 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)O 1626a_100000751335_100000211604 [0,1,0,0,0,1|2,0,0]=4 3688 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)O 240690a_100000751335_100000211604 [0,1,0,0,0,1|2,0,0]=4 3689 B17R1.6578 COc1ccccc1CC(=O)NCC(C)(C)O 527a_100000751335_100000211604 [0,1,0,0,0,1|2,0,0]=4 3690 B17R1.6578 COc1ccccc1NC(=O)CCC(C)(C)C 11a_100000210025_100000757465 [0,1,0,0,0,1|2,0,0]=4 3691 B17R1.6578 COc1ccccc1NC(=O)CCC(C)(C)C 1626a_100000210025_100000757465 [0,1,0,0,0,1|2,0,0]=4 3692 B17R1.6578 COc1ccccc1NC(=O)CCC(C)(C)C 22a_100000210025_100000757465 [0,1,0,0,0,1|2,0,0]=4 3693 B17R1.6578 COc1ccccc1NC(=O)CCC(C)(C)C 527a_100000210025_100000757465 [0,1,0,0,0,1|2,0,0]=4 3694 B17R1.6578 COc1ccccc1NC(=O)NCC(C)(C)C 2430a_100000210025_100000743828 [0,1,0,0,0,1|2,0,0]=4 3695 B17R1.6578 COc1ccccc1NC(=O)NCC(C)(C)F 2430a_100000210025_100020643315 [0,1,0,0,0,1|2,0,0]=4 3696 B17R1.6578 COc1ccccc1NC(=O)NCC(C)(C)O 2430a_100000210025_100000751335 [0,1,0,0,0,1|2,0,0]=4 3697 B17R1.6578 CSc1ccccc1CC(=O)CCC(C)(C)C 1458a_100000757465_100000699184 [0,1,0,0,0,1|2,0,0]=4 3698 B17R1.6578 CSc1ccccc1NC(=O)CCC(C)(C)C 11a_100000211160_100000757465 [0,1,0,0,0,1|2,0,0]=4 3699 B17R1.6578 CSc1ccccc1NC(=O)CCC(C)(C)C 22a_100000211160_100000757465 [0,1,0,0,0,1|2,0,0]=4 3700 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)C 2430a_100000211160_100000743828 [0,1,0,0,0,1|2,0,0]=4 3701 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)C 512a_100000211160_100000743828 [0,1,0,0,0,1|2,0,0]=4 3702 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)F 2430a_100000211160_100020643315 [0,1,0,0,0,1|2,0,0]=4 3703 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)F 512a_100000211160_100020643315 [0,1,0,0,0,1|2,0,0]=4 3704 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)O 2430a_100000211160_100000751335 [0,1,0,0,0,1|2,0,0]=4 3705 B17R1.6578 CSc1ccccc1NC(=O)NCC(C)(C)O 512a_100000211160_100000751335 [0,1,0,0,0,1|2,0,0]=4 3706 B17R1.7392 COc1c(cccc1CC(=O)CCC(C)C)Br 1458a_100000181311_100011470457 [0,1,0,0,0,1|2,0,0]=4 3707 B17R1.7392 COc1c(cccc1CC(=O)CCC(C)C)C 1458a_100000181311_100012349798 [0,1,0,0,0,1|2,0,0]=4 3708 B17R1.7392 COc1c(cccc1CC(=O)CCC(C)C)F 1458a_100000061543_100000210312 [0,1,0,0,0,1|2,0,0]=4 3709 B17R1.7392 COc1c(cccc1CC(=O)NCC(C)C)F 11a_100000210953_100000061543 [0,1,0,0,0,1|2,0,0]=4 3710 B17R1.7392 COc1c(cccc1CC(=O)NCC(C)C)F 1626a_100000210953_100000061543 [0,1,0,0,0,1|2,0,0]=4 3711 B17R1.7392 COc1c(cccc1CC(=O)NCC(C)C)F 240690a_100000210953_100000061543 [0,1,0,0,0,1|2,0,0]=4 3712 B17R1.7392 COc1c(cccc1CC(=O)NCC(C)C)F 527a_100000210953_100000061543 [0,1,0,0,0,1|2,0,0]=4 3713 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Br 11a_100011935253_100000181311 [0,1,0,0,0,1|2,0,0]=4 3714 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Br 1626a_100011935253_100000181311 [0,1,0,0,0,1|2,0,0]=4 3715 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Br 22a_100011935253_100000181311 [0,1,0,0,0,1|2,0,0]=4 3716 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Br 527a_100011935253_100000181311 [0,1,0,0,0,1|2,0,0]=4 3717 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)C 11a_100012017360_100000181311 [0,1,0,0,0,1|2,0,0]=4 3718 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)C 1626a_100012017360_100000181311 [0,1,0,0,0,1|2,0,0]=4 3719 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)C 22a_100012017360_100000181311 [0,1,0,0,0,1|2,0,0]=4 3720 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)C 527a_100012017360_100000181311 [0,1,0,0,0,1|2,0,0]=4 3721 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Cl 11a_100000743799_100000181311 [0,1,0,0,0,1|2,0,0]=4 3722 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Cl 1626a_100000743799_100000181311 [0,1,0,0,0,1|2,0,0]=4 3723 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Cl 22a_100000743799_100000181311 [0,1,0,0,0,1|2,0,0]=4 3724 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)Cl 527a_100000743799_100000181311 [0,1,0,0,0,1|2,0,0]=4 3725 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)F 11a_100011215007_100000181311 [0,1,0,0,0,1|2,0,0]=4 3726 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)F 1626a_100011215007_100000181311 [0,1,0,0,0,1|2,0,0]=4 3727 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)F 22a_100011215007_100000181311 [0,1,0,0,0,1|2,0,0]=4 3728 B17R1.7392 COc1c(cccc1NC(=O)CCC(C)C)F 527a_100011215007_100000181311 [0,1,0,0,0,1|2,0,0]=4 3729 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)Br 2430a_100011935253_100000210953 [0,1,0,0,0,1|2,0,0]=4 3730 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)Br 512a_100011935253_100000210953 [0,1,0,0,0,1|2,0,0]=4 3731 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)C 2430a_100012017360_100000210953 [0,1,0,0,0,1|2,0,0]=4 3732 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)C 512a_100012017360_100000210953 [0,1,0,0,0,1|2,0,0]=4 3733 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)Cl 2430a_100000743799_100000210953 [0,1,0,0,0,1|2,0,0]=4 3734 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)Cl 512a_100000743799_100000210953 [0,1,0,0,0,1|2,0,0]=4 3735 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)F 2430a_100011215007_100000210953 [0,1,0,0,0,1|2,0,0]=4 3736 B17R1.7392 COc1c(cccc1NC(=O)NCC(C)C)F 512a_100011215007_100000210953 [0,1,0,0,0,1|2,0,0]=4 3737 B17R1.16418 C=C(C)c1ccccc1NC(=O)CCC(C)C 11a_100000037685_100000181311 [0,1,0,0,0,1|2,0,0]=4 3738 B17R1.16418 C=C(C)c1ccccc1NC(=O)CCC(C)C 1626a_100000037685_100000181311 [0,1,0,0,0,1|2,0,0]=4 3739 B17R1.16418 C=C(C)c1ccccc1NC(=O)CCC(C)C 22a_100000037685_100000181311 [0,1,0,0,0,1|2,0,0]=4 3740 B17R1.16418 C=C(C)c1ccccc1NC(=O)NCC(C)C 2430a_100000037685_100000210953 [0,1,0,0,0,1|2,0,0]=4 3741 B17R1.16418 CC(C)C=CC(=O)Nc1ccccc1N(C)C 11a_100000737595_100016268746 [0,1,0,0,0,1|1,0,1]=4 3742 B17R1.16418 CC(C)C=CC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100016268746 [0,1,0,0,0,1|1,0,1]=4 3743 B17R1.16418 CC(C)C=CC(=O)Nc1ccccc1N(C)C 22a_100000737595_100016268746 [0,1,0,0,0,1|1,0,1]=4 3744 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1C(C)C 11a_100000210643_100000181311 [0,1,0,0,0,1|2,0,0]=4 3745 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1C(C)C 1626a_100000210643_100000181311 [0,1,0,0,0,1|2,0,0]=4 3746 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1C(C)C 22a_100000210643_100000181311 [0,1,0,0,0,1|2,0,0]=4 3747 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1C(C)C 527a_100000210643_100000181311 [0,1,0,0,0,1|2,0,0]=4 3748 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1N(C)C 11a_100000737595_100000181311 [0,1,0,0,0,1|1,0,0]=3 3749 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100000181311 [0,1,0,0,0,1|1,0,0]=3 3750 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000181311 [0,1,0,0,0,1|1,0,0]=3 3751 B17R1.16418 CC(C)CCC(=O)Nc1ccccc1N(C)C 527a_100000737595_100000181311 [0,1,0,0,0,1|1,0,0]=3 3752 B17R1.16418 CC(C)CNC(=O)Nc1ccccc1C(C)C 2430a_100000210643_100000210953 [0,1,0,0,0,1|2,0,0]=4 3753 B17R1.16418 CC(C)CNC(=O)Nc1ccccc1N(C)C 2430a_100000737595_100000210953 [0,1,0,0,0,1|1,0,0]=3 3754 B17R1.16418 CC(C)OCC(=O)Nc1ccccc1N(C)C 11a_100000737595_100000745533 [0,1,0,0,0,1|2,0,0]=4 3755 B17R1.16418 CC(C)OCC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100000745533 [0,1,0,0,0,1|2,0,0]=4 3756 B17R1.16418 CC(C)OCC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000745533 [0,1,0,0,0,1|2,0,0]=4 3757 B17R1.16418 CC(C)OCC(=O)Nc1ccccc1N(C)C 527a_100000737595_100000745533 [0,1,0,0,0,1|2,0,0]=4 3758 B17R1.16418 CC(C)SCC(=O)Nc1ccccc1N(C)C 11a_100000737595_100000241585 [0,1,0,0,0,1|2,0,0]=4 3759 B17R1.16418 CC(C)SCC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100000241585 [0,1,0,0,0,1|2,0,0]=4 3760 B17R1.16418 CC(C)SCC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000241585 [0,1,0,0,0,1|2,0,0]=4 3761 B17R1.16418 CC(C)SCC(=O)Nc1ccccc1N(C)C 527a_100000737595_100000241585 [0,1,0,0,0,1|2,0,0]=4 3762 B17R1.16418 CC(O)CCC(=O)Nc1ccccc1N(C)C 1626a_100000737595_100000718519 [0,1,0,0,0,1|2,0,0]=4 3763 B17R1.16418 CC(O)CNC(=O)Nc1ccccc1N(C)C 2430a_100000737595_100000210904 [0,1,0,0,0,1|2,0,0]=4 3764 B17R1.16418 CN(C)CCC(=O)Nc1ccccc1N(C)C 11a_100000737595_100000689311 [0,1,0,0,0,1|2,0,0]=4 3765 B17R1.16418 CN(C)CCC(=O)Nc1ccccc1N(C)C 22a_100000737595_100000689311 [0,1,0,0,0,1|2,0,0]=4 3766 B17R1.16418 CN(C)CCC(=O)Nc1ccccc1N(C)C 527a_100000737595_100000689311 [0,1,0,0,0,1|2,0,0]=4 3767 B17R1.16418 CN(C)c1ccccc1NC(=O)CC[S+](C)C 11a_100000737595_100009452791 [0,1,0,0,0,1|2,0,0]=4 3768 B17R1.16418 CN(C)c1ccccc1NC(=O)CC[S+](C)C 1626a_100000737595_100009452791 [0,1,0,0,0,1|2,0,0]=4 3769 B17R1.16418 CN(C)c1ccccc1NC(=O)CC[S+](C)C 22a_100000737595_100009452791 [0,1,0,0,0,1|2,0,0]=4 3770 B17R1.27039 COc1ccccc1C(C)C(=O)CCC(C)C 1458a_100011435281_100000210312 [0,1,0,0,0,1|2,0,0]=4 3771 B17R1.27039 COc1ccccc1C(C)C(=O)NCC(C)C 11a_100000210953_100011435281 [0,1,0,0,0,1|2,0,0]=4 3772 B17R1.27039 COc1ccccc1C(C)C(=O)NCC(C)C 1626a_100000210953_100011435281 [0,1,0,0,0,1|2,0,0]=4 3773 B17R1.27039 COc1ccccc1C(C)C(=O)NCC(C)C 240690a_100000210953_100011435281 [0,1,0,0,0,1|2,0,0]=4 3774 B17R1.27039 COc1ccccc1C(C)C(=O)NCC(C)C 527a_100000210953_100011435281 [0,1,0,0,0,1|2,0,0]=4 3775 B17R1.27039 COc1ccccc1N(C)C(=O)CCC(C)C 11a_100000219746_100000181311 [0,1,0,0,0,1|2,0,0]=4 3776 B17R1.27039 COc1ccccc1N(C)C(=O)CCC(C)C 1626a_100000219746_100000181311 [0,1,0,0,0,1|2,0,0]=4 3777 B17R1.27039 COc1ccccc1N(C)C(=O)CCC(C)C 22a_100000219746_100000181311 [0,1,0,0,0,1|2,0,0]=4 3778 B17R1.27039 COc1ccccc1N(C)C(=O)NCC(C)C 512a_100000210953_100000219746 [0,1,0,0,0,1|2,0,0]=4 3779 B17R1.28461 CCc1cccc(c1NC(=O)CCC(C)C)C 11a_100000210048_100000181311 [0,1,0,0,0,1|2,0,0]=4 3780 B17R1.28461 CCc1cccc(c1NC(=O)CCC(C)C)C 1626a_100000210048_100000181311 [0,1,0,0,0,1|2,0,0]=4 3781 B17R1.28461 CCc1cccc(c1NC(=O)CCC(C)C)C 22a_100000210048_100000181311 [0,1,0,0,0,1|2,0,0]=4 3782 B17R1.28461 CCc1cccc(c1NC(=O)NCC(C)C)C 2430a_100000210048_100000210953 [0,1,0,0,0,1|2,0,0]=4 3783 B17R1.28461 COc1cccc(c1CC(=O)CCC(C)C)Cl 1458a_100000181311_100012349678 [0,1,0,0,0,1|2,0,0]=4 3784 B17R1.28461 COc1cccc(c1CC(=O)CCC(C)C)F 1458a_100000181311_100011216731 [0,1,0,0,0,1|2,0,0]=4 3785 B17R1.28461 COc1cccc(c1CC(=O)CCC(C)C)F 1458a_100011216732_100000210312 [0,1,0,0,0,1|2,0,0]=4 3786 B17R1.28461 COc1cccc(c1CC(=O)NCC(C)C)F 11a_100000210953_100011216732 [0,1,0,0,0,1|2,0,0]=4 3787 B17R1.28461 COc1cccc(c1CC(=O)NCC(C)C)F 1626a_100000210953_100011216732 [0,1,0,0,0,1|2,0,0]=4 3788 B17R1.28461 COc1cccc(c1CC(=O)NCC(C)C)F 240690a_100000210953_100011216732 [0,1,0,0,0,1|2,0,0]=4 3789 B17R1.28461 COc1cccc(c1CC(=O)NCC(C)C)F 527a_100000210953_100011216732 [0,1,0,0,0,1|2,0,0]=4 3790 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Br 11a_100000708083_100000181311 [0,1,0,0,0,1|2,0,0]=4 3791 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Br 1626a_100000708083_100000181311 [0,1,0,0,0,1|2,0,0]=4 3792 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Br 22a_100000708083_100000181311 [0,1,0,0,0,1|2,0,0]=4 3793 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)C 11a_100000758225_100000181311 [0,1,0,0,0,1|2,0,0]=4 3794 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)C 1626a_100000758225_100000181311 [0,1,0,0,0,1|2,0,0]=4 3795 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)C 22a_100000758225_100000181311 [0,1,0,0,0,1|2,0,0]=4 3796 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Cl 11a_100011309317_100000181311 [0,1,0,0,0,1|2,0,0]=4 3797 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Cl 1626a_100011309317_100000181311 [0,1,0,0,0,1|2,0,0]=4 3798 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)Cl 22a_100011309317_100000181311 [0,1,0,0,0,1|2,0,0]=4 3799 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)F 11a_100000686744_100000181311 [0,1,0,0,0,1|2,0,0]=4 3800 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)F 1626a_100000686744_100000181311 [0,1,0,0,0,1|2,0,0]=4 3801 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)F 22a_100000686744_100000181311 [0,1,0,0,0,1|2,0,0]=4 3802 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)I 11a_100010253897_100000181311 [0,1,0,0,0,1|2,0,0]=4 3803 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)I 1626a_100010253897_100000181311 [0,1,0,0,0,1|2,0,0]=4 3804 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)O 22a_100012022766_100000181311 [0,1,0,0,0,1|2,0,0]=4 3805 B17R1.28461 COc1cccc(c1NC(=O)CCC(C)C)O 527a_100012022766_100000181311 [0,1,0,0,0,1|2,0,0]=4 3806 B17R1.28461 COc1cccc(c1NC(=O)NCC(C)C)C 2430a_100000758225_100000210953 [0,1,0,0,0,1|2,0,0]=4 3807 B17R1.28461 COc1cccc(c1NC(=O)NCC(C)C)Cl 2430a_100011309317_100000210953 [0,1,0,0,0,1|2,0,0]=4 3808 B17R1.28461 COc1cccc(c1NC(=O)NCC(C)C)F 2430a_100000686744_100000210953 [0,1,0,0,0,1|2,0,0]=4 3809 B17R1.28461 COc1cccc(c1NC(=O)NCC(C)C)I 512a_100010253897_100000210953 [0,1,0,0,0,1|2,0,0]=4 3810 B17R1.28461 COc1cccc(c1NC(=O)NCC(C)C)O 2430a_100012022766_100000210953 [0,1,0,0,0,1|2,0,0]=4 3811 B17R1.5378 CCc1cc(ccc1C(=O)CCCC(C)C)Br 1458a_200012349896_100011214892 [0,1,0,0,0,1|2,0,0]=4 3812 B17R1.5378 CCc1cc(ccc1C(=O)CCOC(C)C)Br 1458a_200012349896_100000211751 [0,1,0,0,0,1|2,0,0]=4 3813 B17R1.5378 CCc1cc(ccc1C(=O)CCSC(C)C)Br 1458a_200012349896_100000730970 [0,1,0,0,0,1|2,0,0]=4 3814 B17R1.5378 CCc1cc(ccc1C(=O)NCCC(C)C)Br 11a_100000210545_200012349896 [0,1,0,0,0,1|2,0,0]=4 3815 B17R1.5378 CCc1cc(ccc1C(=O)NCCC(C)C)Br 1626a_100000210545_200012349896 [0,1,0,0,0,1|2,0,0]=4 3816 B17R1.5378 CCc1cc(ccc1C(=O)NCCC(C)C)Br 240690a_100000210545_200012349896 [0,1,0,0,0,1|2,0,0]=4 3817 B17R1.5378 CCc1cc(ccc1C(=O)NCCC(C)C)Br 527a_100000210545_200012349896 [0,1,0,0,0,1|2,0,0]=4 3818 B17R1.5378 CCc1cc(ccc1C(=O)NNCC(C)C)Br 22a_100000696102_200012349896 [0,1,0,0,0,1|2,0,0]=4 3819 B17R1.5378 COc1cc(ccc1C(=O)CCCC(C)C)Br 1458a_100000748230_100011214892 [0,1,0,0,0,1|2,0,0]=4 3820 B17R1.5378 COc1cc(ccc1C(=O)CCCC(C)C)C 1458a_100000217210_100011214892 [0,1,0,0,0,1|2,0,0]=4 3821 B17R1.5378 COc1cc(ccc1C(=O)CCCC(C)C)Cl 1458a_100000217211_100011214892 [0,1,0,0,0,1|2,0,0]=4 3822 B17R1.5378 COc1cc(ccc1C(=O)CCCC(C)C)F 1458a_100000239970_100011214892 [0,1,0,0,0,1|2,0,0]=4 3823 B17R1.5378 COc1cc(ccc1C(=O)CCCC(C)C)I 1458a_100012353712_100011214892 [0,1,0,0,0,1|2,0,0]=4 3824 B17R1.5378 COc1cc(ccc1C(=O)CCOC(C)C)Br 1458a_100000748230_100000211751 [0,1,0,0,0,1|2,0,0]=4 3825 B17R1.5378 COc1cc(ccc1C(=O)CCOC(C)C)C 1458a_100000217210_100000211751 [0,1,0,0,0,1|2,0,0]=4 3826 B17R1.5378 COc1cc(ccc1C(=O)CCOC(C)C)Cl 1458a_100000217211_100000211751 [0,1,0,0,0,1|2,0,0]=4 3827 B17R1.5378 COc1cc(ccc1C(=O)CCOC(C)C)F 1458a_100000239970_100000211751 [0,1,0,0,0,1|2,0,0]=4 3828 B17R1.5378 COc1cc(ccc1C(=O)CCOC(C)C)I 1458a_100012353712_100000211751 [0,1,0,0,0,1|2,0,0]=4 3829 B17R1.5378 COc1cc(ccc1C(=O)CCSC(C)C)Br 1458a_100000748230_100000730970 [0,1,0,0,0,1|2,0,0]=4 3830 B17R1.5378 COc1cc(ccc1C(=O)CCSC(C)C)C 1458a_100000217210_100000730970 [0,1,0,0,0,1|2,0,0]=4 3831 B17R1.5378 COc1cc(ccc1C(=O)CCSC(C)C)Cl 1458a_100000217211_100000730970 [0,1,0,0,0,1|2,0,0]=4 3832 B17R1.5378 COc1cc(ccc1C(=O)CCSC(C)C)F 1458a_100000239970_100000730970 [0,1,0,0,0,1|2,0,0]=4 3833 B17R1.5378 COc1cc(ccc1C(=O)CCSC(C)C)I 1458a_100012353712_100000730970 [0,1,0,0,0,1|2,0,0]=4 3834 B17R1.5378 COc1cc(ccc1C(=O)CSCC(C)C)Cl 62a_100012344415_100000210760 [0,1,0,0,0,1|1,1,0]=4 3835 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Br 11a_100000210545_100000748230 [0,1,0,0,0,1|2,0,0]=4 3836 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000748230 [0,1,0,0,0,1|2,0,0]=4 3837 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000748230 [0,1,0,0,0,1|2,0,0]=4 3838 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Br 527a_100000210545_100000748230 [0,1,0,0,0,1|2,0,0]=4 3839 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)C 11a_100000210545_100000217210 [0,1,0,0,0,1|2,0,0]=4 3840 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)C 1626a_100000210545_100000217210 [0,1,0,0,0,1|2,0,0]=4 3841 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)C 240690a_100000210545_100000217210 [0,1,0,0,0,1|2,0,0]=4 3842 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)C 527a_100000210545_100000217210 [0,1,0,0,0,1|2,0,0]=4 3843 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Cl 11a_100000210545_100000217211 [0,1,0,0,0,1|2,0,0]=4 3844 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000217211 [0,1,0,0,0,1|2,0,0]=4 3845 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000217211 [0,1,0,0,0,1|2,0,0]=4 3846 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)Cl 527a_100000210545_100000217211 [0,1,0,0,0,1|2,0,0]=4 3847 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)F 11a_100000210545_100000239970 [0,1,0,0,0,1|2,0,0]=4 3848 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)F 1626a_100000210545_100000239970 [0,1,0,0,0,1|2,0,0]=4 3849 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)F 240690a_100000210545_100000239970 [0,1,0,0,0,1|2,0,0]=4 3850 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)F 527a_100000210545_100000239970 [0,1,0,0,0,1|2,0,0]=4 3851 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)I 11a_100000210545_100012353712 [0,1,0,0,0,1|2,0,0]=4 3852 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)I 1626a_100000210545_100012353712 [0,1,0,0,0,1|2,0,0]=4 3853 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)I 240690a_100000210545_100012353712 [0,1,0,0,0,1|2,0,0]=4 3854 B17R1.5378 COc1cc(ccc1C(=O)NCCC(C)C)I 527a_100000210545_100012353712 [0,1,0,0,0,1|2,0,0]=4 3855 B17R1.5378 COc1cc(ccc1C(=O)NNCC(C)C)Br 22a_100000696102_100000748230 [0,1,0,0,0,1|2,0,0]=4 3856 B17R1.5378 COc1cc(ccc1C(=O)NNCC(C)C)C 22a_100000696102_100000217210 [0,1,0,0,0,1|2,0,0]=4 3857 B17R1.5378 COc1cc(ccc1C(=O)NNCC(C)C)Cl 22a_100000696102_100000217211 [0,1,0,0,0,1|2,0,0]=4 3858 B17R1.5378 COc1cc(ccc1C(=O)NNCC(C)C)F 22a_100000696102_100000239970 [0,1,0,0,0,1|2,0,0]=4 3859 B17R1.5378 COc1cc(ccc1C(=O)NNCC(C)C)I 22a_100000696102_100012353712 [0,1,0,0,0,1|2,0,0]=4 3860 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)C 11a_100000738805_100000689120 [0,1,0,0,0,1|2,0,0]=4 3861 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)C 1626a_100000738805_100000689120 [0,1,0,0,0,1|2,0,0]=4 3862 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)C 240690a_100000738805_100000689120 [0,1,0,0,0,1|2,0,0]=4 3863 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)C 527a_100000738805_100000689120 [0,1,0,0,0,1|2,0,0]=4 3864 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)F 11a_100016253952_100000689120 [0,1,0,0,0,1|2,0,0]=4 3865 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)F 1626a_100016253952_100000689120 [0,1,0,0,0,1|2,0,0]=4 3866 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)F 240690a_100016253952_100000689120 [0,1,0,0,0,1|2,0,0]=4 3867 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)F 527a_100016253952_100000689120 [0,1,0,0,0,1|2,0,0]=4 3868 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)O 1626a_100000707701_100000689120 [0,1,0,0,0,1|2,0,0]=4 3869 B17R1.6518 CCc1ccccc1C(=O)NCCC(C)(C)O 527a_100000707701_100000689120 [0,1,0,0,0,1|2,0,0]=4 3870 B17R1.6518 COc1ccccc1C(=O)COCC(C)(C)F 34a_100000716592_100000195505 [0,1,0,0,0,1|1,0,0]=3 3871 B17R1.6518 COc1ccccc1C(=O)COCC(C)(F)F 34a_100000068830_100000195505 [0,1,0,0,0,1|2,0,0]=4 3872 B17R1.6518 COc1ccccc1C(=O)CSCC(C)(C)C 62a_100000195505_100011219605 [0,1,0,0,0,1|1,1,0]=4 3873 B17R1.6518 COc1ccccc1C(=O)CSCC(C)(C)F 62a_100000195505_100011997219 [0,1,0,0,0,1|1,1,0]=4 3874 B17R1.6518 COc1ccccc1C(=O)CSCC(C)(C)O 62a_100000195505_100000764493 [0,1,0,0,0,1|1,1,0]=4 3875 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)C 11a_100000738805_100000185835 [0,1,0,0,0,1|2,0,0]=4 3876 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)C 1626a_100000738805_100000185835 [0,1,0,0,0,1|2,0,0]=4 3877 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)C 240690a_100000738805_100000185835 [0,1,0,0,0,1|2,0,0]=4 3878 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)C 527a_100000738805_100000185835 [0,1,0,0,0,1|2,0,0]=4 3879 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)F 11a_100016253952_100000185835 [0,1,0,0,0,1|2,0,0]=4 3880 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)F 1626a_100016253952_100000185835 [0,1,0,0,0,1|2,0,0]=4 3881 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)F 240690a_100016253952_100000185835 [0,1,0,0,0,1|2,0,0]=4 3882 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)F 527a_100016253952_100000185835 [0,1,0,0,0,1|2,0,0]=4 3883 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)O 1626a_100000707701_100000185835 [0,1,0,0,0,1|2,0,0]=4 3884 B17R1.6518 COc1ccccc1C(=O)NCCC(C)(C)O 527a_100000707701_100000185835 [0,1,0,0,0,1|2,0,0]=4 3885 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)C 11a_100000738805_100000183967 [0,1,0,0,0,1|2,0,0]=4 3886 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)C 1626a_100000738805_100000183967 [0,1,0,0,0,1|2,0,0]=4 3887 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)C 240690a_100000738805_100000183967 [0,1,0,0,0,1|2,0,0]=4 3888 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)C 527a_100000738805_100000183967 [0,1,0,0,0,1|2,0,0]=4 3889 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)F 11a_100016253952_100000183967 [0,1,0,0,0,1|2,0,0]=4 3890 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)F 1626a_100016253952_100000183967 [0,1,0,0,0,1|2,0,0]=4 3891 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)F 240690a_100016253952_100000183967 [0,1,0,0,0,1|2,0,0]=4 3892 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)F 527a_100016253952_100000183967 [0,1,0,0,0,1|2,0,0]=4 3893 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)O 1626a_100000707701_100000183967 [0,1,0,0,0,1|2,0,0]=4 3894 B17R1.6518 CSc1ccccc1C(=O)NCCC(C)(C)O 527a_100000707701_100000183967 [0,1,0,0,0,1|2,0,0]=4 3895 B17R1.6602 CCc1ccccc1C(=O)NC(C)CC(C)C 11a_100000692259_100000689120 [0,1,0,0,0,1|2,0,0]=4 3896 B17R1.6602 CCc1ccccc1C(=O)NC(C)CC(C)C 1626a_100000692259_100000689120 [0,1,0,0,0,1|2,0,0]=4 3897 B17R1.6602 CCc1ccccc1C(=O)NC(C)CC(C)C 240690a_100000692259_100000689120 [0,1,0,0,0,1|2,0,0]=4 3898 B17R1.6602 CCc1ccccc1C(=O)NC(C)CC(C)C 527a_100000692259_100000689120 [0,1,0,0,0,1|2,0,0]=4 3899 B17R1.6602 COc1ccccc1C(=O)CC(=O)CC(C)C 1458a_100000210554_100000195505 [0,1,0,0,0,1|2,0,0]=4 3900 B17R1.6602 COc1ccccc1C(=O)CN(C)CC(C)C 269982a_100000747067_100000195505 [0,1,0,0,0,1|2,0,0]=4 3901 B17R1.6602 COc1ccccc1C(=O)NC(C)CC(C)C 11a_100000692259_100000185835 [0,1,0,0,0,1|2,0,0]=4 3902 B17R1.6602 COc1ccccc1C(=O)NC(C)CC(C)C 1626a_100000692259_100000185835 [0,1,0,0,0,1|2,0,0]=4 3903 B17R1.6602 COc1ccccc1C(=O)NC(C)CC(C)C 240690a_100000692259_100000185835 [0,1,0,0,0,1|2,0,0]=4 3904 B17R1.6602 COc1ccccc1C(=O)NC(C)CC(C)C 527a_100000692259_100000185835 [0,1,0,0,0,1|2,0,0]=4 3905 B17R1.6602 CSc1ccccc1C(=O)NC(C)CC(C)C 11a_100000692259_100000183967 [0,1,0,0,0,1|2,0,0]=4 3906 B17R1.6602 CSc1ccccc1C(=O)NC(C)CC(C)C 1626a_100000692259_100000183967 [0,1,0,0,0,1|2,0,0]=4 3907 B17R1.6602 CSc1ccccc1C(=O)NC(C)CC(C)C 240690a_100000692259_100000183967 [0,1,0,0,0,1|2,0,0]=4 3908 B17R1.6602 CSc1ccccc1C(=O)NC(C)CC(C)C 527a_100000692259_100000183967 [0,1,0,0,0,1|2,0,0]=4 3909 B17R1.7049 CCc1c(cccc1C(=O)CCCC(C)C)Br 1458a_100010125490_100011214892 [0,1,0,0,0,1|2,0,0]=4 3910 B17R1.7049 CCc1c(cccc1C(=O)CCOC(C)C)Br 1458a_100010125490_100000211751 [0,1,0,0,0,1|2,0,0]=4 3911 B17R1.7049 CCc1c(cccc1C(=O)CCSC(C)C)Br 1458a_100010125490_100000730970 [0,1,0,0,0,1|2,0,0]=4 3912 B17R1.7049 CCc1c(cccc1C(=O)NCCC(C)C)Br 11a_100000210545_100010125490 [0,1,0,0,0,1|2,0,0]=4 3913 B17R1.7049 CCc1c(cccc1C(=O)NCCC(C)C)Br 1626a_100000210545_100010125490 [0,1,0,0,0,1|2,0,0]=4 3914 B17R1.7049 CCc1c(cccc1C(=O)NCCC(C)C)Br 240690a_100000210545_100010125490 [0,1,0,0,0,1|2,0,0]=4 3915 B17R1.7049 CCc1c(cccc1C(=O)NCCC(C)C)Br 527a_100000210545_100010125490 [0,1,0,0,0,1|2,0,0]=4 3916 B17R1.7049 CCc1c(cccc1C(=O)NNCC(C)C)Br 22a_100000696102_100010125490 [0,1,0,0,0,1|2,0,0]=4 3917 B17R1.7049 COc1c(cccc1C(=O)CCCC(C)C)Br 1458a_100000689802_100011214892 [0,1,0,0,0,1|2,0,0]=4 3918 B17R1.7049 COc1c(cccc1C(=O)CCCC(C)C)C 1458a_100000187929_100011214892 [0,1,0,0,0,1|2,0,0]=4 3919 B17R1.7049 COc1c(cccc1C(=O)CCCC(C)C)Cl 1458a_100011934004_100011214892 [0,1,0,0,0,1|2,0,0]=4 3920 B17R1.7049 COc1c(cccc1C(=O)CCCC(C)C)F 1458a_100011218433_100011214892 [0,1,0,0,0,1|2,0,0]=4 3921 B17R1.7049 COc1c(cccc1C(=O)CCCC(C)C)O 1458a_100000080799_100011214892 [0,1,0,0,0,1|2,0,0]=4 3922 B17R1.7049 COc1c(cccc1C(=O)CCOC(C)C)Br 1458a_100000689802_100000211751 [0,1,0,0,0,1|2,0,0]=4 3923 B17R1.7049 COc1c(cccc1C(=O)CCOC(C)C)C 1458a_100000187929_100000211751 [0,1,0,0,0,1|2,0,0]=4 3924 B17R1.7049 COc1c(cccc1C(=O)CCOC(C)C)Cl 1458a_100011934004_100000211751 [0,1,0,0,0,1|2,0,0]=4 3925 B17R1.7049 COc1c(cccc1C(=O)CCOC(C)C)F 1458a_100011218433_100000211751 [0,1,0,0,0,1|2,0,0]=4 3926 B17R1.7049 COc1c(cccc1C(=O)CCOC(C)C)O 1458a_100000080799_100000211751 [0,1,0,0,0,1|2,0,0]=4 3927 B17R1.7049 COc1c(cccc1C(=O)CCSC(C)C)Br 1458a_100000689802_100000730970 [0,1,0,0,0,1|2,0,0]=4 3928 B17R1.7049 COc1c(cccc1C(=O)CCSC(C)C)C 1458a_100000187929_100000730970 [0,1,0,0,0,1|2,0,0]=4 3929 B17R1.7049 COc1c(cccc1C(=O)CCSC(C)C)Cl 1458a_100011934004_100000730970 [0,1,0,0,0,1|2,0,0]=4 3930 B17R1.7049 COc1c(cccc1C(=O)CCSC(C)C)F 1458a_100011218433_100000730970 [0,1,0,0,0,1|2,0,0]=4 3931 B17R1.7049 COc1c(cccc1C(=O)CCSC(C)C)O 1458a_100000080799_100000730970 [0,1,0,0,0,1|2,0,0]=4 3932 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Br 11a_100000210545_100000689802 [0,1,0,0,0,1|2,0,0]=4 3933 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000689802 [0,1,0,0,0,1|2,0,0]=4 3934 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000689802 [0,1,0,0,0,1|2,0,0]=4 3935 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Br 527a_100000210545_100000689802 [0,1,0,0,0,1|2,0,0]=4 3936 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)C 11a_100000210545_100000187929 [0,1,0,0,0,1|2,0,0]=4 3937 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)C 1626a_100000210545_100000187929 [0,1,0,0,0,1|2,0,0]=4 3938 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)C 240690a_100000210545_100000187929 [0,1,0,0,0,1|2,0,0]=4 3939 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)C 527a_100000210545_100000187929 [0,1,0,0,0,1|2,0,0]=4 3940 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Cl 11a_100000210545_100011934004 [0,1,0,0,0,1|2,0,0]=4 3941 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100011934004 [0,1,0,0,0,1|2,0,0]=4 3942 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100011934004 [0,1,0,0,0,1|2,0,0]=4 3943 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)Cl 527a_100000210545_100011934004 [0,1,0,0,0,1|2,0,0]=4 3944 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)F 11a_100000210545_100011218433 [0,1,0,0,0,1|2,0,0]=4 3945 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)F 1626a_100000210545_100011218433 [0,1,0,0,0,1|2,0,0]=4 3946 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)F 240690a_100000210545_100011218433 [0,1,0,0,0,1|2,0,0]=4 3947 B17R1.7049 COc1c(cccc1C(=O)NCCC(C)C)F 527a_100000210545_100011218433 [0,1,0,0,0,1|2,0,0]=4 3948 B17R1.7049 COc1c(cccc1C(=O)NNCC(C)C)Br 22a_100000696102_100000689802 [0,1,0,0,0,1|2,0,0]=4 3949 B17R1.7049 COc1c(cccc1C(=O)NNCC(C)C)C 22a_100000696102_100000187929 [0,1,0,0,0,1|2,0,0]=4 3950 B17R1.7049 COc1c(cccc1C(=O)NNCC(C)C)Cl 22a_100000696102_100011934004 [0,1,0,0,0,1|2,0,0]=4 3951 B17R1.7049 COc1c(cccc1C(=O)NNCC(C)C)F 22a_100000696102_100011218433 [0,1,0,0,0,1|2,0,0]=4 3952 B17R1.7049 COc1c(cccc1C(=O)NNCC(C)C)O 22a_100000696102_100000080799 [0,1,0,0,0,1|2,0,0]=4 3953 B17R1.16385 CC(=CCCC(=O)c1ccccc1N(C)C)C 1458a_100011218752_100011217483 [0,1,0,0,0,1|1,0,1]=4 3954 B17R1.16385 CC(=CCNC(=O)c1ccccc1N(C)C)C 11a_100000718196_100011218752 [0,1,0,0,0,1|1,0,1]=4 3955 B17R1.16385 CC(=CCNC(=O)c1ccccc1N(C)C)C 1626a_100000718196_100011218752 [0,1,0,0,0,1|1,0,1]=4 3956 B17R1.16385 CC(=CCNC(=O)c1ccccc1N(C)C)C 527a_100000718196_100011218752 [0,1,0,0,0,1|1,0,1]=4 3957 B17R1.16385 CC(C)CCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100011214892 [0,1,0,0,0,1|2,0,0]=4 3958 B17R1.16385 CC(C)CCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100011214892 [0,1,0,0,0,1|1,0,0]=3 3959 B17R1.16385 CC(C)CCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100011214892 [0,1,0,0,0,1|2,0,0]=4 3960 B17R1.16385 CC(C)CCNC(=O)c1ccccc1C(C)C 11a_100000210545_100011941426 [0,1,0,0,0,1|2,0,0]=4 3961 B17R1.16385 CC(C)CCNC(=O)c1ccccc1C(C)C 1626a_100000210545_100011941426 [0,1,0,0,0,1|2,0,0]=4 3962 B17R1.16385 CC(C)CCNC(=O)c1ccccc1C(C)C 240690a_100000210545_100011941426 [0,1,0,0,0,1|2,0,0]=4 3963 B17R1.16385 CC(C)CCNC(=O)c1ccccc1C(C)C 527a_100000210545_100011941426 [0,1,0,0,0,1|2,0,0]=4 3964 B17R1.16385 CC(C)CCNC(=O)c1ccccc1N(C)C 11a_100000210545_100011218752 [0,1,0,0,0,1|1,0,0]=3 3965 B17R1.16385 CC(C)CCNC(=O)c1ccccc1N(C)C 1626a_100000210545_100011218752 [0,1,0,0,0,1|1,0,0]=3 3966 B17R1.16385 CC(C)CCNC(=O)c1ccccc1N(C)C 240690a_100000210545_100011218752 [0,1,0,0,0,1|1,0,0]=3 3967 B17R1.16385 CC(C)CCNC(=O)c1ccccc1N(C)C 527a_100000210545_100011218752 [0,1,0,0,0,1|1,0,0]=3 3968 B17R1.16385 CC(C)CCNC(=O)c1ccccc1S(=O)C 1626a_100000210545_100000204632 [0,1,0,0,0,1|2,0,0]=4 3969 B17R1.16385 CC(C)CCNC(=O)c1ccccc1S(=O)C 240690a_100000210545_100000204632 [0,1,0,0,0,1|2,0,0]=4 3970 B17R1.16385 CC(C)CNNC(=O)c1ccccc1C(C)C 22a_100000696102_100011941426 [0,1,0,0,0,1|2,0,0]=4 3971 B17R1.16385 CC(C)CNNC(=O)c1ccccc1N(C)C 22a_100000696102_100011218752 [0,1,0,0,0,1|1,0,0]=3 3972 B17R1.16385 CC(C)CNNC(=O)c1ccccc1S(=O)C 22a_100000696102_100000204632 [0,1,0,0,0,1|2,0,0]=4 3973 B17R1.16385 CC(C)OCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000211751 [0,1,0,0,0,1|2,0,0]=4 3974 B17R1.16385 CC(C)OCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000211751 [0,1,0,0,0,1|1,0,0]=3 3975 B17R1.16385 CC(C)OCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000211751 [0,1,0,0,0,1|2,0,0]=4 3976 B17R1.16385 CC(C)SCCC(=O)c1ccccc1C(C)C 1458a_100011941426_100000730970 [0,1,0,0,0,1|2,0,0]=4 3977 B17R1.16385 CC(C)SCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000730970 [0,1,0,0,0,1|1,0,0]=3 3978 B17R1.16385 CC(C)SCCC(=O)c1ccccc1S(=O)C 1458a_100000204632_100000730970 [0,1,0,0,0,1|2,0,0]=4 3979 B17R1.16385 CC(O)CCCC(=O)c1ccccc1N(C)C 1458a_100011218752_200000718107 [0,1,0,0,0,1|2,0,0]=4 3980 B17R1.16385 CC(O)CCNC(=O)c1ccccc1N(C)C 240690a_200000755665_100011218752 [0,1,0,0,0,1|2,0,0]=4 3981 B17R1.16385 CC(O)CCNC(=O)c1ccccc1N(C)C 527a_200000755665_100011218752 [0,1,0,0,0,1|2,0,0]=4 3982 B17R1.16385 CC(O)CNNC(=O)c1ccccc1N(C)C 22a_200000730056_100011218752 [0,1,0,0,0,1|2,0,0]=4 3983 B17R1.16385 CN(C)CCCC(=O)c1ccccc1N(C)C 1458a_100011218752_100000695564 [0,1,0,0,0,1|2,0,0]=4 3984 B17R1.16385 CN(C)CCNC(=O)c1ccccc1N(C)C 240690a_100000210585_100011218752 [0,1,0,0,0,1|2,0,0]=4 3985 B17R1.16385 CN(C)CCNC(=O)c1ccccc1N(C)C 527a_100000210585_100011218752 [0,1,0,0,0,1|2,0,0]=4 3986 B17R1.18073 CC(C)CCOC(=O)c1ccccc1OCF 7a_100000030269_100015361967 [0,1,0,0,0,1|1,0,0]=3 3987 B17R1.18073 CCOc1ccccc1C(=O)CCCC(C)C 1458a_100000211144_100011214892 [0,1,0,0,0,1|2,0,0]=4 3988 B17R1.18073 CCOc1ccccc1C(=O)CCOC(C)C 1458a_100000211144_100000211751 [0,1,0,0,0,1|2,0,0]=4 3989 B17R1.18073 CCOc1ccccc1C(=O)CCSC(C)C 1458a_100000211144_100000730970 [0,1,0,0,0,1|2,0,0]=4 3990 B17R1.18073 CCOc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000211144 [0,1,0,0,0,1|2,0,0]=4 3991 B17R1.18073 CCOc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000211144 [0,1,0,0,0,1|2,0,0]=4 3992 B17R1.18073 CCOc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000211144 [0,1,0,0,0,1|2,0,0]=4 3993 B17R1.18073 CCOc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000211144 [0,1,0,0,0,1|2,0,0]=4 3994 B17R1.18073 CCOc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000211144 [0,1,0,0,0,1|2,0,0]=4 3995 B17R1.18073 CCOc1ccccc1C(=O)OCCC(C)C 7a_100000030269_100000210202 [0,1,0,0,0,1|1,0,0]=3 3996 B17R1.18073 CCSc1ccccc1C(=O)CCCC(C)C 1458a_100000195471_100011214892 [0,1,0,0,0,1|2,0,0]=4 3997 B17R1.18073 CCSc1ccccc1C(=O)CCOC(C)C 1458a_100000195471_100000211751 [0,1,0,0,0,1|2,0,0]=4 3998 B17R1.18073 CCSc1ccccc1C(=O)CCSC(C)C 1458a_100000195471_100000730970 [0,1,0,0,0,1|2,0,0]=4 3999 B17R1.18073 CCSc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000195471 [0,1,0,0,0,1|2,0,0]=4 4000 B17R1.18073 CCSc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000195471 [0,1,0,0,0,1|2,0,0]=4 4001 B17R1.18073 CCSc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000195471 [0,1,0,0,0,1|2,0,0]=4 4002 B17R1.18073 CCSc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000195471 [0,1,0,0,0,1|2,0,0]=4 4003 B17R1.18073 CCSc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000195471 [0,1,0,0,0,1|2,0,0]=4 4004 B17R1.18073 COCc1ccccc1C(=O)CCCC(C)C 1458a_100000737999_100011214892 [0,1,0,0,0,1|2,0,0]=4 4005 B17R1.18073 COCc1ccccc1C(=O)CCOC(C)C 1458a_100000737999_100000211751 [0,1,0,0,0,1|2,0,0]=4 4006 B17R1.18073 COCc1ccccc1C(=O)CCSC(C)C 1458a_100000737999_100000730970 [0,1,0,0,0,1|2,0,0]=4 4007 B17R1.18073 COCc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000737999 [0,1,0,0,0,1|2,0,0]=4 4008 B17R1.18073 COCc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000737999 [0,1,0,0,0,1|2,0,0]=4 4009 B17R1.18073 COCc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000737999 [0,1,0,0,0,1|2,0,0]=4 4010 B17R1.18073 COCc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000737999 [0,1,0,0,0,1|2,0,0]=4 4011 B17R1.18073 COCc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000737999 [0,1,0,0,0,1|2,0,0]=4 4012 B17R1.27038 C=CC(C)COCC(=O)c1ccccc1OC 34a_100011215527_100000195505 [0,1,0,0,0,1|1,0,1]=4 4013 B17R1.27038 C=CC(C)COCC(=O)c1ccccc1OC 7a_100011215527_100000195505 [0,1,0,0,0,1|1,0,1]=4 4014 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1OC 11a_100020591266_100000185835 [0,1,0,0,0,1|2,0,0]=4 4015 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1OC 1626a_100020591266_100000185835 [0,1,0,0,0,1|2,0,0]=4 4016 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1OC 240690a_100020591266_100000185835 [0,1,0,0,0,1|2,0,0]=4 4017 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1OC 527a_100020591266_100000185835 [0,1,0,0,0,1|2,0,0]=4 4018 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1SC 11a_100020591266_100000183967 [0,1,0,0,0,1|2,0,0]=4 4019 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1SC 1626a_100020591266_100000183967 [0,1,0,0,0,1|2,0,0]=4 4020 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1SC 240690a_100020591266_100000183967 [0,1,0,0,0,1|2,0,0]=4 4021 B17R1.27038 CCC(C)CCNC(=O)c1ccccc1SC 527a_100020591266_100000183967 [0,1,0,0,0,1|2,0,0]=4 4022 B17R1.27038 CCC(C)CSCC(=O)c1ccccc1OC 62a_100000195505_100000748023 [0,1,0,0,0,1|1,1,0]=4 4023 B17R1.27038 CC[C@H](C)COCC(=O)c1ccccc1OC 7a_100009816381_100000195505 [0,1,0,0,0,1|1,0,0]=3 4024 B17R1.27038 CC[C@H](C)CSCC(=O)c1ccccc1OC 62a_100000195505_100009816398 [0,1,0,0,0,1|1,1,0]=4 4025 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CC 11a_100020591266_100000689120 [0,1,0,0,0,1|2,0,0]=4 4026 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CC 1626a_100020591266_100000689120 [0,1,0,0,0,1|2,0,0]=4 4027 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CC 240690a_100020591266_100000689120 [0,1,0,0,0,1|2,0,0]=4 4028 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CC 527a_100020591266_100000689120 [0,1,0,0,0,1|2,0,0]=4 4029 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CO 240690a_106354213184_100000689120 [0,1,0,0,0,1|2,0,0]=4 4030 B17R1.27038 CCc1ccccc1C(=O)NCCC(C)CO 527a_106354213184_100000689120 [0,1,0,0,0,1|2,0,0]=4 4031 B17R1.27038 COc1ccccc1C(=O)CNCC(C)CO 34a_100000744482_100000195505 [0,1,0,0,0,1|2,0,0]=4 4032 B17R1.27038 COc1ccccc1C(=O)COCC(C)CN 34a_100000744482_100000195505 [0,1,0,0,0,1|1,0,0]=3 4033 B17R1.27038 COc1ccccc1C(=O)COCC(C)OC 34a_100000690652_100000195505 [0,1,0,0,0,1|1,0,0]=3 4034 B17R1.27038 COc1ccccc1C(=O)COCC(Cl)CCl 34a_100000033668_100000195505 [0,1,0,0,0,1|2,0,0]=4 4035 B17R1.27038 COc1ccccc1C(=O)COC[C@H](F)CN 34a_100015665980_100000195505 [0,1,0,0,0,1|2,0,0]=4 4036 B17R1.27038 COc1ccccc1C(=O)CSC[C@@H](C)CO 62a_100000195505_100000059175 [0,1,0,0,0,1|1,1,0]=4 4037 B17R1.27038 COc1ccccc1C(=O)NCCC(C)CO 240690a_106354213184_100000185835 [0,1,0,0,0,1|2,0,0]=4 4038 B17R1.27038 COc1ccccc1C(=O)NCCC(C)CO 527a_106354213184_100000185835 [0,1,0,0,0,1|2,0,0]=4 4039 B17R1.27038 CSc1ccccc1C(=O)NCCC(C)CO 240690a_106354213184_100000183967 [0,1,0,0,0,1|2,0,0]=4 4040 B17R1.27038 CSc1ccccc1C(=O)NCCC(C)CO 527a_106354213184_100000183967 [0,1,0,0,0,1|2,0,0]=4 4041 B17R1.27040 CCc1ccccc1C(=O)COC(=O)C(C)C 1458a_100000689120_100000139345 [0,1,0,0,0,1|1,0,1]=4 4042 B17R1.27040 CCc1ccccc1C(=O)NCC(O)C(C)C 11a_100000759067_100000689120 [0,1,0,0,0,1|2,0,0]=4 4043 B17R1.27040 CCc1ccccc1C(=O)NCC(O)C(C)C 240690a_100000759067_100000689120 [0,1,0,0,0,1|2,0,0]=4 4044 B17R1.27040 CCc1ccccc1C(=O)NCC(O)C(C)C 527a_100000759067_100000689120 [0,1,0,0,0,1|2,0,0]=4 4045 B17R1.27040 COc1ccccc1C(=O)COC(=O)C(C)C 1458a_100000185835_100000139345 [0,1,0,0,0,1|1,0,1]=4 4046 B17R1.27040 COc1ccccc1C(=O)COC(C)C(C)C 7a_100000748068_100000195505 [0,1,0,0,0,1|1,0,0]=3 4047 B17R1.27040 COc1ccccc1C(=O)NCC(=O)C(C)C 1458a_100000183908_100000210206 [0,1,0,0,0,1|2,0,0]=4 4048 B17R1.27040 COc1ccccc1C(=O)NCC(O)C(C)C 11a_100000759067_100000185835 [0,1,0,0,0,1|2,0,0]=4 4049 B17R1.27040 COc1ccccc1C(=O)NCC(O)C(C)C 240690a_100000759067_100000185835 [0,1,0,0,0,1|2,0,0]=4 4050 B17R1.27040 COc1ccccc1C(=O)NCC(O)C(C)C 527a_100000759067_100000185835 [0,1,0,0,0,1|2,0,0]=4 4051 B17R1.27040 CSc1ccccc1C(=O)COC(=O)C(C)C 1458a_100000183967_100000139345 [0,1,0,0,0,1|1,0,1]=4 4052 B17R1.27040 CSc1ccccc1C(=O)NCC(O)C(C)C 11a_100000759067_100000183967 [0,1,0,0,0,1|2,0,0]=4 4053 B17R1.27040 CSc1ccccc1C(=O)NCC(O)C(C)C 240690a_100000759067_100000183967 [0,1,0,0,0,1|2,0,0]=4 4054 B17R1.27040 CSc1ccccc1C(=O)NCC(O)C(C)C 527a_100000759067_100000183967 [0,1,0,0,0,1|2,0,0]=4 4055 B17R1.48014 CCc1ccc(cc1C(=O)CCCC(C)C)Br 1458a_100012343961_100011214892 [0,1,0,0,0,1|2,0,0]=4 4056 B17R1.48014 CCc1ccc(cc1C(=O)CCOC(C)C)Br 1458a_100012343961_100000211751 [0,1,0,0,0,1|2,0,0]=4 4057 B17R1.48014 CCc1ccc(cc1C(=O)CCSC(C)C)Br 1458a_100012343961_100000730970 [0,1,0,0,0,1|2,0,0]=4 4058 B17R1.48014 CCc1ccc(cc1C(=O)NCCC(C)C)Br 11a_100000210545_100012343961 [0,1,0,0,0,1|2,0,0]=4 4059 B17R1.48014 CCc1ccc(cc1C(=O)NCCC(C)C)Br 1626a_100000210545_100012343961 [0,1,0,0,0,1|2,0,0]=4 4060 B17R1.48014 CCc1ccc(cc1C(=O)NCCC(C)C)Br 240690a_100000210545_100012343961 [0,1,0,0,0,1|2,0,0]=4 4061 B17R1.48014 CCc1ccc(cc1C(=O)NCCC(C)C)Br 527a_100000210545_100012343961 [0,1,0,0,0,1|2,0,0]=4 4062 B17R1.48014 CCc1ccc(cc1C(=O)NNCC(C)C)Br 22a_100000696102_100012343961 [0,1,0,0,0,1|2,0,0]=4 4063 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)Br 1458a_100000188853_100011214892 [0,1,0,0,0,1|2,0,0]=4 4064 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)C 1458a_100000204667_100011214892 [0,1,0,0,0,1|2,0,0]=4 4065 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)Cl 1458a_100000211409_100011214892 [0,1,0,0,0,1|2,0,0]=4 4066 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)F 1458a_100000735445_100011214892 [0,1,0,0,0,1|2,0,0]=4 4067 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)I 1458a_100000230898_100011214892 [0,1,0,0,0,1|2,0,0]=4 4068 B17R1.48014 COc1ccc(cc1C(=O)CCCC(C)C)O 1458a_200000100057_100011214892 [0,1,0,0,0,1|2,0,0]=4 4069 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)Br 1458a_100000188853_100000211751 [0,1,0,0,0,1|2,0,0]=4 4070 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)C 1458a_100000204667_100000211751 [0,1,0,0,0,1|2,0,0]=4 4071 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)Cl 1458a_100000211409_100000211751 [0,1,0,0,0,1|2,0,0]=4 4072 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)F 1458a_100000735445_100000211751 [0,1,0,0,0,1|2,0,0]=4 4073 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)I 1458a_100000230898_100000211751 [0,1,0,0,0,1|2,0,0]=4 4074 B17R1.48014 COc1ccc(cc1C(=O)CCOC(C)C)O 1458a_200000100057_100000211751 [0,1,0,0,0,1|2,0,0]=4 4075 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)Br 1458a_100000188853_100000730970 [0,1,0,0,0,1|2,0,0]=4 4076 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)C 1458a_100000204667_100000730970 [0,1,0,0,0,1|2,0,0]=4 4077 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)Cl 1458a_100000211409_100000730970 [0,1,0,0,0,1|2,0,0]=4 4078 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)F 1458a_100000735445_100000730970 [0,1,0,0,0,1|2,0,0]=4 4079 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)I 1458a_100000230898_100000730970 [0,1,0,0,0,1|2,0,0]=4 4080 B17R1.48014 COc1ccc(cc1C(=O)CCSC(C)C)O 1458a_200000100057_100000730970 [0,1,0,0,0,1|2,0,0]=4 4081 B17R1.48014 COc1ccc(cc1C(=O)CNCC(C)C)Br 34a_100000210953_200000749383 [0,1,0,0,0,1|2,0,0]=4 4082 B17R1.48014 COc1ccc(cc1C(=O)CNCC(C)C)F 34a_100000210953_100000737820 [0,1,0,0,0,1|2,0,0]=4 4083 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)Br)Br 34a_100012180447_200000749383 [0,1,0,0,0,1|2,0,0]=4 4084 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)Br)F 34a_100012180447_100000737820 [0,1,0,0,0,1|2,0,0]=4 4085 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)C)Br 34a_100000210257_200000749383 [0,1,0,0,0,1|1,0,0]=3 4086 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)C)F 34a_100000210257_100000737820 [0,1,0,0,0,1|1,0,0]=3 4087 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)F)Br 34a_100015925927_200000749383 [0,1,0,0,0,1|2,0,0]=4 4088 B17R1.48014 COc1ccc(cc1C(=O)COCC(C)F)F 34a_100015925927_100000737820 [0,1,0,0,0,1|2,0,0]=4 4089 B17R1.48014 COc1ccc(cc1C(=O)COC[C@@H](C)Cl)Br 34a_100016084084_200000749383 [0,1,0,0,0,1|2,0,0]=4 4090 B17R1.48014 COc1ccc(cc1C(=O)COC[C@@H](C)Cl)F 34a_100016084084_100000737820 [0,1,0,0,0,1|2,0,0]=4 4091 B17R1.48014 COc1ccc(cc1C(=O)COC[C@@H](C)N)Br 34a_100000737577_200000749383 [0,1,0,0,0,1|2,0,0]=4 4092 B17R1.48014 COc1ccc(cc1C(=O)COC[C@@H](C)N)F 34a_100000737577_100000737820 [0,1,0,0,0,1|2,0,0]=4 4093 B17R1.48014 COc1ccc(cc1C(=O)CSCC(C)C)Br 62a_200000749383_100000210760 [0,1,0,0,0,1|1,1,0]=4 4094 B17R1.48014 COc1ccc(cc1C(=O)CSCC(C)C)Cl 62a_100012340060_100000210760 [0,1,0,0,0,1|1,1,0]=4 4095 B17R1.48014 COc1ccc(cc1C(=O)CSCC(C)C)F 62a_100000737820_100000210760 [0,1,0,0,0,1|1,1,0]=4 4096 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Br 11a_100000210545_100000188853 [0,1,0,0,0,1|2,0,0]=4 4097 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Br 1626a_100000210545_100000188853 [0,1,0,0,0,1|2,0,0]=4 4098 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Br 240690a_100000210545_100000188853 [0,1,0,0,0,1|2,0,0]=4 4099 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Br 527a_100000210545_100000188853 [0,1,0,0,0,1|2,0,0]=4 4100 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)C 11a_100000210545_100000204667 [0,1,0,0,0,1|2,0,0]=4 4101 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)C 1626a_100000210545_100000204667 [0,1,0,0,0,1|2,0,0]=4 4102 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)C 240690a_100000210545_100000204667 [0,1,0,0,0,1|2,0,0]=4 4103 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)C 527a_100000210545_100000204667 [0,1,0,0,0,1|2,0,0]=4 4104 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Cl 11a_100000210545_100000211409 [0,1,0,0,0,1|2,0,0]=4 4105 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000211409 [0,1,0,0,0,1|2,0,0]=4 4106 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000211409 [0,1,0,0,0,1|2,0,0]=4 4107 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)Cl 527a_100000210545_100000211409 [0,1,0,0,0,1|2,0,0]=4 4108 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)F 11a_100000210545_100000735445 [0,1,0,0,0,1|2,0,0]=4 4109 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)F 1626a_100000210545_100000735445 [0,1,0,0,0,1|2,0,0]=4 4110 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)F 240690a_100000210545_100000735445 [0,1,0,0,0,1|2,0,0]=4 4111 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)F 527a_100000210545_100000735445 [0,1,0,0,0,1|2,0,0]=4 4112 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)I 11a_100000210545_100000230898 [0,1,0,0,0,1|2,0,0]=4 4113 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)I 1626a_100000210545_100000230898 [0,1,0,0,0,1|2,0,0]=4 4114 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)I 240690a_100000210545_100000230898 [0,1,0,0,0,1|2,0,0]=4 4115 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)I 527a_100000210545_100000230898 [0,1,0,0,0,1|2,0,0]=4 4116 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)O 240690a_100000210545_200000100057 [0,1,0,0,0,1|2,0,0]=4 4117 B17R1.48014 COc1ccc(cc1C(=O)NCCC(C)C)O 527a_100000210545_200000100057 [0,1,0,0,0,1|2,0,0]=4 4118 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)Br 22a_100000696102_100000188853 [0,1,0,0,0,1|2,0,0]=4 4119 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)C 22a_100000696102_100000204667 [0,1,0,0,0,1|2,0,0]=4 4120 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)Cl 22a_100000696102_100000211409 [0,1,0,0,0,1|2,0,0]=4 4121 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)F 22a_100000696102_100000735445 [0,1,0,0,0,1|2,0,0]=4 4122 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)I 22a_100000696102_100000230898 [0,1,0,0,0,1|2,0,0]=4 4123 B17R1.48014 COc1ccc(cc1C(=O)NNCC(C)C)O 22a_100000696102_200000100057 [0,1,0,0,0,1|2,0,0]=4 4124 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)Br 1458a_100011593405_100011214892 [0,1,0,0,0,1|2,0,0]=4 4125 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)C 1458a_100000066212_100011214892 [0,1,0,0,0,1|2,0,0]=4 4126 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)Cl 1458a_100000743539_100011214892 [0,1,0,0,0,1|2,0,0]=4 4127 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)F 1458a_100000759380_100011214892 [0,1,0,0,0,1|2,0,0]=4 4128 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)I 1458a_100010179659_100011214892 [0,1,0,0,0,1|2,0,0]=4 4129 B17R1.155154 COc1cccc(c1C(=O)CCCC(C)C)O 1458a_100000043310_100011214892 [0,1,0,0,0,1|2,0,0]=4 4130 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)Br 1458a_100011593405_100000211751 [0,1,0,0,0,1|2,0,0]=4 4131 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)C 1458a_100000066212_100000211751 [0,1,0,0,0,1|2,0,0]=4 4132 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)Cl 1458a_100000743539_100000211751 [0,1,0,0,0,1|2,0,0]=4 4133 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)F 1458a_100000759380_100000211751 [0,1,0,0,0,1|2,0,0]=4 4134 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)I 1458a_100010179659_100000211751 [0,1,0,0,0,1|2,0,0]=4 4135 B17R1.155154 COc1cccc(c1C(=O)CCOC(C)C)O 1458a_100000043310_100000211751 [0,1,0,0,0,1|2,0,0]=4 4136 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)Br 1458a_100011593405_100000730970 [0,1,0,0,0,1|2,0,0]=4 4137 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)C 1458a_100000066212_100000730970 [0,1,0,0,0,1|2,0,0]=4 4138 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)Cl 1458a_100000743539_100000730970 [0,1,0,0,0,1|2,0,0]=4 4139 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)F 1458a_100000759380_100000730970 [0,1,0,0,0,1|2,0,0]=4 4140 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)I 1458a_100010179659_100000730970 [0,1,0,0,0,1|2,0,0]=4 4141 B17R1.155154 COc1cccc(c1C(=O)CCSC(C)C)O 1458a_100000043310_100000730970 [0,1,0,0,0,1|2,0,0]=4 4142 B17R1.155154 COc1cccc(c1C(=O)CNCC(C)C)Cl 2230a_100000210953_100010768284 [0,1,0,0,0,1|2,0,0]=4 4143 B17R1.155154 COc1cccc(c1C(=O)CNCC(C)C)Cl 34a_100000210953_100010768284 [0,1,0,0,0,1|2,0,0]=4 4144 B17R1.155154 COc1cccc(c1C(=O)COCC(C)Br)Cl 34a_100012180447_100010768284 [0,1,0,0,0,1|2,0,0]=4 4145 B17R1.155154 COc1cccc(c1C(=O)COCC(C)C)Cl 34a_100000210257_100010768284 [0,1,0,0,0,1|1,0,0]=3 4146 B17R1.155154 COc1cccc(c1C(=O)COCC(C)F)Cl 34a_100015925927_100010768284 [0,1,0,0,0,1|2,0,0]=4 4147 B17R1.155154 COc1cccc(c1C(=O)COC[C@@H](C)Cl)Cl 34a_100016084084_100010768284 [0,1,0,0,0,1|2,0,0]=4 4148 B17R1.155154 COc1cccc(c1C(=O)COC[C@@H](C)N)Cl 34a_100000737577_100010768284 [0,1,0,0,0,1|2,0,0]=4 4149 B17R1.155154 COc1cccc(c1C(=O)CSCC(C)C)Cl 62a_100010768284_100000210760 [0,1,0,0,0,1|1,1,0]=4 4150 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Br 11a_100000210545_100011593405 [0,1,0,0,0,1|2,0,0]=4 4151 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Br 1626a_100000210545_100011593405 [0,1,0,0,0,1|2,0,0]=4 4152 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Br 240690a_100000210545_100011593405 [0,1,0,0,0,1|2,0,0]=4 4153 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Br 527a_100000210545_100011593405 [0,1,0,0,0,1|2,0,0]=4 4154 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)C 11a_100000210545_100000066212 [0,1,0,0,0,1|2,0,0]=4 4155 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)C 1626a_100000210545_100000066212 [0,1,0,0,0,1|2,0,0]=4 4156 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)C 240690a_100000210545_100000066212 [0,1,0,0,0,1|2,0,0]=4 4157 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Cl 11a_100000210545_100000743539 [0,1,0,0,0,1|2,0,0]=4 4158 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Cl 1626a_100000210545_100000743539 [0,1,0,0,0,1|2,0,0]=4 4159 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Cl 240690a_100000210545_100000743539 [0,1,0,0,0,1|2,0,0]=4 4160 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)Cl 527a_100000210545_100000743539 [0,1,0,0,0,1|2,0,0]=4 4161 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)F 11a_100000210545_100000759380 [0,1,0,0,0,1|2,0,0]=4 4162 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)F 1626a_100000210545_100000759380 [0,1,0,0,0,1|2,0,0]=4 4163 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)F 240690a_100000210545_100000759380 [0,1,0,0,0,1|2,0,0]=4 4164 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)F 527a_100000210545_100000759380 [0,1,0,0,0,1|2,0,0]=4 4165 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)I 11a_100000210545_100010179659 [0,1,0,0,0,1|2,0,0]=4 4166 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)I 1626a_100000210545_100010179659 [0,1,0,0,0,1|2,0,0]=4 4167 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)I 240690a_100000210545_100010179659 [0,1,0,0,0,1|2,0,0]=4 4168 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)I 527a_100000210545_100010179659 [0,1,0,0,0,1|2,0,0]=4 4169 B17R1.155154 COc1cccc(c1C(=O)NCCC(C)C)O 240690a_100000210545_100000043310 [0,1,0,0,0,1|2,0,0]=4 4170 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)Br 22a_100000696102_100011593405 [0,1,0,0,0,1|2,0,0]=4 4171 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)C 22a_100000696102_100000066212 [0,1,0,0,0,1|2,0,0]=4 4172 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)Cl 22a_100000696102_100000743539 [0,1,0,0,0,1|2,0,0]=4 4173 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)F 22a_100000696102_100000759380 [0,1,0,0,0,1|2,0,0]=4 4174 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)I 22a_100000696102_100010179659 [0,1,0,0,0,1|2,0,0]=4 4175 B17R1.155154 COc1cccc(c1C(=O)NNCC(C)C)O 22a_100000696102_100000043310 [0,1,0,0,0,1|2,0,0]=4 4176 B17R1.1228 CC(C)COC(=O)c1ccccc1N(C)CF 269982a_100000170472_100015361967 [0,2,0,0,0,0|0,0,0]=2 4177 B17R1.1228 CC(C)COC(=O)c1ccccc1N(C)CF 38a_100000170472_100015361967 [0,2,0,0,0,0|0,0,0]=2 4178 B17R1.1228 CCN(C)c1ccccc1C(=O)OCC(C)C 269982a_100000170472_100000204670 [0,2,0,0,0,0|0,0,0]=2 4179 B17R1.1228 CCN(C)c1ccccc1C(=O)OCC(C)C 38a_100000170472_100000204670 [0,2,0,0,0,0|0,0,0]=2 4180 B17R1.1228 COC(=O)c1ccccc1C(=O)CCC(C)C 1458a_100011215673_100000210312 [0,2,0,0,0,0|2,0,0]=4 4181 B17R1.1228 COC(=O)c1ccccc1C(=O)NCC(C)C 1626a_100000210953_100011215673 [0,2,0,0,0,0|2,0,0]=4 4182 B17R1.1228 COC(=O)c1ccccc1C(=O)NCC(C)C 240690a_100000210953_100011215673 [0,2,0,0,0,0|2,0,0]=4 4183 B17R1.1296 C#CCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100000038162 [0,2,0,0,0,0|1,0,0]=3 4184 B17R1.1296 C#CCNc1ccccc1C(=O)NCC(C)C 27a_100000212058_200000155729 [0,2,0,0,0,0|1,0,0]=3 4185 B17R1.1296 C#CCNc1ccccc1C(=O)NCC(C)C 34a_100000180285_100000184674 [0,2,0,0,0,0|1,0,0]=3 4186 B17R1.1296 C#CCOc1ccccc1C(=O)CCC(C)C 1458a_100000217172_100000210312 [0,2,0,0,0,0|2,0,0]=4 4187 B17R1.1296 C#CCOc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000217172 [0,2,0,0,0,0|2,0,0]=4 4188 B17R1.1296 C#CCOc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000217172 [0,2,0,0,0,0|2,0,0]=4 4189 B17R1.1296 C#CCOc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000217172 [0,2,0,0,0,0|2,0,0]=4 4190 B17R1.1296 C#CCOc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000217172 [0,2,0,0,0,0|2,0,0]=4 4191 B17R1.1296 C#CCOc1ccccc1C(=O)OCC(C)C 34a_100000005792_100000184674 [0,2,0,0,0,0|1,0,0]=3 4192 B17R1.1296 C#CCOc1ccccc1C(=O)OCC(C)C 7a_100000005792_100000038162 [0,2,0,0,0,0|1,0,0]=3 4193 B17R1.1296 C#CCSc1ccccc1C(=O)NCC(C)C 62a_100000038162_200000155729 [0,2,0,0,0,0|2,0,0]=4 4194 B17R1.1296 C=CCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100000210623 [0,2,0,0,0,0|1,0,0]=3 4195 B17R1.1296 C=CCNc1ccccc1C(=O)NCC(C)C 27a_100020586998_200000155729 [0,2,0,0,0,0|1,0,0]=3 4196 B17R1.1296 C=CCNc1ccccc1C(=O)NCC(C)C 34a_100000180285_100015514636 [0,2,0,0,0,0|1,0,0]=3 4197 B17R1.1296 C=CCOc1ccccc1C(=O)CCC(C)C 1458a_100000189412_100000210312 [0,2,0,0,0,0|2,0,0]=4 4198 B17R1.1296 C=CCOc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000189412 [0,2,0,0,0,0|2,0,0]=4 4199 B17R1.1296 C=CCOc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000189412 [0,2,0,0,0,0|2,0,0]=4 4200 B17R1.1296 C=CCOc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000189412 [0,2,0,0,0,0|2,0,0]=4 4201 B17R1.1296 C=CCOc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000189412 [0,2,0,0,0,0|2,0,0]=4 4202 B17R1.1296 C=CCOc1ccccc1C(=O)OCC(C)C 34a_100000005792_100015514636 [0,2,0,0,0,0|1,0,0]=3 4203 B17R1.1296 C=CCOc1ccccc1C(=O)OCC(C)C 7a_100000005792_100015514636 [0,2,0,0,0,0|1,0,0]=3 4204 B17R1.1296 C=CCSc1ccccc1C(=O)NCC(C)C 62a_100000210623_200000155729 [0,2,0,0,0,0|2,0,0]=4 4205 B17R1.1296 C=CCSc1ccccc1C(=O)NCC(C)C 62a_200000155729_100000210623 [0,2,0,0,0,0|2,0,0]=4 4206 B17R1.1296 CC(C)CCC(=O)c1ccccc1OCCO 1458a_200000217288_100000210312 [0,2,0,0,0,0|2,0,0]=4 4207 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCC#N 2230a_100000180285_100011215382 [0,2,0,0,0,0|1,0,0]=3 4208 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCC=O 2230a_100000180285_200015260668 [0,2,0,0,0,0|1,0,0]=3 4209 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCC=O 34a_100000180285_200009817547 [0,2,0,0,0,0|1,0,0]=3 4210 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCCF 2230a_100000180285_100011217306 [0,2,0,0,0,0|1,0,0]=3 4211 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCCF 34a_100000180285_100011217306 [0,2,0,0,0,0|1,0,0]=3 4212 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCCO 2230a_100000180285_100000211926 [0,2,0,0,0,0|1,0,0]=3 4213 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCCO 27a_100000210304_200000155729 [0,2,0,0,0,0|1,0,0]=3 4214 B17R1.1296 CC(C)CNC(=O)c1ccccc1NCCO 34a_100000180285_100000211926 [0,2,0,0,0,0|1,0,0]=3 4215 B17R1.1296 CC(C)CNC(=O)c1ccccc1OCCO 240690a_100000210953_200000217288 [0,2,0,0,0,0|2,0,0]=4 4216 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCC#N 62a_100011215382_200000155729 [0,2,0,0,0,0|2,0,0]=4 4217 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCC#N 62a_200000155729_100011215382 [0,2,0,0,0,0|2,0,0]=4 4218 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCC=O 62a_200000155729_200015260668 [0,2,0,0,0,0|2,0,0]=4 4219 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCC=O 62a_200015260668_200000155729 [0,2,0,0,0,0|2,0,0]=4 4220 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCCF 62a_100011217306_200000155729 [0,2,0,0,0,0|2,0,0]=4 4221 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCCF 62a_200000155729_100011217306 [0,2,0,0,0,0|2,0,0]=4 4222 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCCO 62a_100000211926_200000155729 [0,2,0,0,0,0|2,0,0]=4 4223 B17R1.1296 CC(C)CNC(=O)c1ccccc1SCCO 62a_200000155729_100000211926 [0,2,0,0,0,0|2,0,0]=4 4224 B17R1.1296 CC(C)COC(=O)c1ccccc1OCC#N 7a_100000005792_100011215382 [0,2,0,0,0,0|1,0,0]=3 4225 B17R1.1296 CC(C)COC(=O)c1ccccc1OCC=O 34a_100000005792_200009817547 [0,2,0,0,0,0|1,0,0]=3 4226 B17R1.1296 CC(C)COC(=O)c1ccccc1OCC=O 7a_100000005792_200015260668 [0,2,0,0,0,0|1,0,0]=3 4227 B17R1.1296 CC(C)COC(=O)c1ccccc1OCCF 34a_100000005792_100011217306 [0,2,0,0,0,0|1,0,0]=3 4228 B17R1.1296 CC(C)COC(=O)c1ccccc1OCCF 7a_100000005792_100011217306 [0,2,0,0,0,0|1,0,0]=3 4229 B17R1.1296 CC(C)COC(=O)c1ccccc1OCCO 34a_100000005792_100000211926 [0,2,0,0,0,0|1,0,0]=3 4230 B17R1.1296 CC(C)COC(=O)c1ccccc1OCCO 7a_100000005792_100000211926 [0,2,0,0,0,0|1,0,0]=3 4231 B17R1.1296 CCCCc1ccccc1C(=O)NCC(C)C 271570a_100020621405_200000155729 [0,2,0,0,0,0|2,0,0]=4 4232 B17R1.1296 CCCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100000210303 [0,2,0,0,0,0|1,0,0]=3 4233 B17R1.1296 CCCNc1ccccc1C(=O)NCC(C)C 34a_100000180285_100000210303 [0,2,0,0,0,0|1,0,0]=3 4234 B17R1.1296 CCCOc1ccccc1C(=O)CCC(C)C 1458a_100000215688_100000210312 [0,2,0,0,0,0|2,0,0]=4 4235 B17R1.1296 CCCOc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000215688 [0,2,0,0,0,0|2,0,0]=4 4236 B17R1.1296 CCCOc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000215688 [0,2,0,0,0,0|2,0,0]=4 4237 B17R1.1296 CCCOc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000215688 [0,2,0,0,0,0|2,0,0]=4 4238 B17R1.1296 CCCOc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000215688 [0,2,0,0,0,0|2,0,0]=4 4239 B17R1.1296 CCCOc1ccccc1C(=O)OCC(C)C 34a_100000005792_100000210303 [0,2,0,0,0,0|1,0,0]=3 4240 B17R1.1296 CCCOc1ccccc1C(=O)OCC(C)C 7a_100000005792_100000210303 [0,2,0,0,0,0|1,0,0]=3 4241 B17R1.1296 CCCSc1ccccc1C(=O)CCC(C)C 1458a_100000217225_100000210312 [0,2,0,0,0,0|2,0,0]=4 4242 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000217225 [0,2,0,0,0,0|2,0,0]=4 4243 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000217225 [0,2,0,0,0,0|2,0,0]=4 4244 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000217225 [0,2,0,0,0,0|2,0,0]=4 4245 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000217225 [0,2,0,0,0,0|2,0,0]=4 4246 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 62a_100000210303_200000155729 [0,2,0,0,0,0|2,0,0]=4 4247 B17R1.1296 CCCSc1ccccc1C(=O)NCC(C)C 62a_200000155729_100000210303 [0,2,0,0,0,0|2,0,0]=4 4248 B17R1.1296 CC[Hg]Sc1ccccc1C(=O)CCC(C)C 1458a_100000046266_100000210312 [0,2,0,0,0,0|2,0,0]=4 4249 B17R1.1296 CC[Hg]Sc1ccccc1C(=O)NCC(C)C 11a_100000210953_100000046266 [0,2,0,0,0,0|2,0,0]=4 4250 B17R1.1296 CC[Hg]Sc1ccccc1C(=O)NCC(C)C 1626a_100000210953_100000046266 [0,2,0,0,0,0|2,0,0]=4 4251 B17R1.1296 CC[Hg]Sc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000046266 [0,2,0,0,0,0|2,0,0]=4 4252 B17R1.1296 CC[Hg]Sc1ccccc1C(=O)NCC(C)C 527a_100000210953_100000046266 [0,2,0,0,0,0|2,0,0]=4 4253 B17R1.1296 COCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100000766300 [0,2,0,0,0,0|1,0,0]=3 4254 B17R1.1296 COCSc1ccccc1C(=O)NCC(C)C 62a_100000766300_200000155729 [0,2,0,0,0,0|2,0,0]=4 4255 B17R1.1296 COCSc1ccccc1C(=O)NCC(C)C 62a_200000155729_100000766300 [0,2,0,0,0,0|2,0,0]=4 4256 B17R1.1296 CSCNc1ccccc1C(=O)NCC(C)C 2230a_100000180285_100011218213 [0,2,0,0,0,0|1,0,0]=3 4257 B17R1.1296 CSCNc1ccccc1C(=O)NCC(C)C 34a_100000180285_100011218213 [0,2,0,0,0,0|1,0,0]=3 4258 B17R1.1296 CSCOc1ccccc1C(=O)OCC(C)C 34a_100000005792_100011218213 [0,2,0,0,0,0|1,0,0]=3 4259 B17R1.1296 CSCSc1ccccc1C(=O)NCC(C)C 62a_100011218213_200000155729 [0,2,0,0,0,0|2,0,0]=4 4260 B17R1.1296 CSCSc1ccccc1C(=O)NCC(C)C 62a_200000155729_100011218213 [0,2,0,0,0,0|2,0,0]=4 4261 B17R1.5006 CC(=Cc1ccccc1C(=O)NCC(C)C)C 271570a_100102525489_200000155729 [0,2,0,0,0,0|2,0,0]=4 4262 B17R1.5006 CC(=O)Nc1ccccc1C(=O)NCC(C)C 11a_100000180285_100015343762 [0,2,0,0,0,0|1,0,0]=3 4263 B17R1.5006 CC(=O)Nc1ccccc1C(=O)NCC(C)C 1626a_100000180285_100015343762 [0,2,0,0,0,0|1,0,0]=3 4264 B17R1.5006 CC(=O)Nc1ccccc1C(=O)NCC(C)C 22a_100000180285_100000070787 [0,2,0,0,0,0|1,0,0]=3 4265 B17R1.5006 CC(=O)Oc1ccccc1C(=O)NCC(C)C 240690a_100000210953_100000210466 [0,2,0,0,0,0|2,0,0]=4 4266 B17R1.5006 CC(C)CCC(=O)c1ccccc1CN(C)C 1458a_100000743624_100000210312 [0,2,0,0,0,0|1,0,0]=3 4267 B17R1.5006 CC(C)CCC(=O)c1ccccc1OC(C)C 1458a_100000244644_100000210312 [0,2,0,0,0,0|2,0,0]=4 4268 B17R1.5006 CC(C)CCC(=O)c1ccccc1OC(F)F 1458a_100000184405_100000210312 [0,2,0,0,0,0|2,0,0]=4 4269 B17R1.5006 CC(C)CCC(=O)c1ccccc1SC(C)C 1458a_100000229993_100000210312 [0,2,0,0,0,0|2,0,0]=4 4270 B17R1.5006 CC(C)CCC(=O)c1ccccc1SC(F)F 1458a_100000185210_100000210312 [0,2,0,0,0,0|2,0,0]=4 4271 B17R1.5006 CC(C)CNC(=O)c1ccccc1CN(C)C 1626a_100000210953_100000743624 [0,2,0,0,0,0|1,0,0]=3 4272 B17R1.5006 CC(C)CNC(=O)c1ccccc1CN(C)C 240690a_100000210953_100000743624 [0,2,0,0,0,0|1,0,0]=3 4273 B17R1.5006 CC(C)CNC(=O)c1ccccc1NC(C)C 2230a_100000180285_100000210206 [0,2,0,0,0,0|1,0,0]=3 4274 B17R1.5006 CC(C)CNC(=O)c1ccccc1NC(C)C 27a_100138425928_200000155729 [0,2,0,0,0,0|1,0,0]=3 4275 B17R1.5006 CC(C)CNC(=O)c1ccccc1NC(C)C 34a_100000180285_100000210206 [0,2,0,0,0,0|1,0,0]=3 4276 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(C)C 11a_100000210953_100000244644 [0,2,0,0,0,0|2,0,0]=4 4277 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(C)C 1626a_100000210953_100000244644 [0,2,0,0,0,0|2,0,0]=4 4278 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(C)C 240690a_100000210953_100000244644 [0,2,0,0,0,0|2,0,0]=4 4279 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(C)C 527a_100000210953_100000244644 [0,2,0,0,0,0|2,0,0]=4 4280 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(F)F 11a_100000210953_100000184405 [0,2,0,0,0,0|2,0,0]=4 4281 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(F)F 1626a_100000210953_100000184405 [0,2,0,0,0,0|2,0,0]=4 4282 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(F)F 240690a_100000210953_100000184405 [0,2,0,0,0,0|2,0,0]=4 4283 B17R1.5006 CC(C)CNC(=O)c1ccccc1OC(F)F 527a_100000210953_100000184405 [0,2,0,0,0,0|2,0,0]=4 4284 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 11a_100000210953_100000229993 [0,2,0,0,0,0|2,0,0]=4 4285 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 1626a_100000210953_100000229993 [0,2,0,0,0,0|2,0,0]=4 4286 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 240690a_100000210953_100000229993 [0,2,0,0,0,0|2,0,0]=4 4287 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 527a_100000210953_100000229993 [0,2,0,0,0,0|2,0,0]=4 4288 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 62a_100000210206_200000155729 [0,2,0,0,0,0|2,0,0]=4 4289 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(C)C 62a_200000155729_100000210206 [0,2,0,0,0,0|2,0,0]=4 4290 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(F)F 11a_100000210953_100000185210 [0,2,0,0,0,0|2,0,0]=4 4291 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(F)F 1626a_100000210953_100000185210 [0,2,0,0,0,0|2,0,0]=4 4292 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(F)F 240690a_100000210953_100000185210 [0,2,0,0,0,0|2,0,0]=4 4293 B17R1.5006 CC(C)CNC(=O)c1ccccc1SC(F)F 527a_100000210953_100000185210 [0,2,0,0,0,0|2,0,0]=4 4294 B17R1.5006 CC(C)COC(=O)c1ccccc1OC(C)C 34a_100000005792_100000210206 [0,2,0,0,0,0|1,0,0]=3 4295 B17R1.5006 CC(C)COC(=O)c1ccccc1OC(C)C 7a_100000005792_100000210206 [0,2,0,0,0,0|1,0,0]=3 4296 B17R1.5006 CC(C)NNC(=O)c1ccccc1CN(C)C 22a_100000741168_100000743624 [0,2,0,0,0,0|2,0,0]=4 4297 B17R1.5006 CC(O)CCC(=O)c1ccccc1CN(C)C 1458a_100000743624_100012276601 [0,2,0,0,0,0|2,0,0]=4 4298 B17R1.5006 CC(O)CNC(=O)c1ccccc1CN(C)C 240690a_100000210904_100000743624 [0,2,0,0,0,0|2,0,0]=4 4299 B17R1.8716 CC(C)CNC(=O)c1cc(ccc1SCF)F 62a_100015361967_200000205877 [0,2,0,0,0,0|2,0,0]=4 4300 B17R1.8716 CC(C)CNC(=O)c1cc(ccc1SCF)F 62a_200000205877_100015361967 [0,2,0,0,0,0|2,0,0]=4 4301 B17R1.8716 CC=Cc1ccc(cc1C(=O)NCC(C)C)F 271570a_100016259895_200000205877 [0,2,0,0,0,0|2,0,0]=4 4302 B17R1.8716 CCNc1ccc(cc1C(=O)NCC(C)C)F 27a_100015525214_200000205877 [0,2,0,0,0,0|1,0,0]=3 4303 B17R1.8716 CCOc1ccc(cc1C(=O)CCC(C)C)Br 1458a_200000215690_100000210312 [0,2,0,0,0,0|2,0,0]=4 4304 B17R1.8716 CCOc1ccc(cc1C(=O)CCC(C)C)Cl 1458a_200000215692_100000210312 [0,2,0,0,0,0|2,0,0]=4 4305 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Br 11a_100000210953_200000215690 [0,2,0,0,0,0|2,0,0]=4 4306 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Br 1626a_100000210953_200000215690 [0,2,0,0,0,0|2,0,0]=4 4307 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Br 240690a_100000210953_200000215690 [0,2,0,0,0,0|2,0,0]=4 4308 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Br 527a_100000210953_200000215690 [0,2,0,0,0,0|2,0,0]=4 4309 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Cl 11a_100000210953_200000215692 [0,2,0,0,0,0|2,0,0]=4 4310 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Cl 1626a_100000210953_200000215692 [0,2,0,0,0,0|2,0,0]=4 4311 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Cl 240690a_100000210953_200000215692 [0,2,0,0,0,0|2,0,0]=4 4312 B17R1.8716 CCOc1ccc(cc1C(=O)NCC(C)C)Cl 527a_100000210953_200000215692 [0,2,0,0,0,0|2,0,0]=4 4313 B17R1.8716 CCSc1ccc(cc1C(=O)NCC(C)C)F 62a_100000210202_200000205877 [0,2,0,0,0,0|2,0,0]=4 4314 B17R1.8716 CCSc1ccc(cc1C(=O)NCC(C)C)F 62a_200000205877_100000210202 [0,2,0,0,0,0|2,0,0]=4 4315 B17R1.18071 CCOc1ccccc1C(=O)C(C)CC(C)C 1458a_100000211144_100000731052 [0,2,0,0,0,0|2,0,0]=4 4316 B17R1.18071 CCOc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000211144 [0,2,0,0,0,0|2,0,0]=4 4317 B17R1.18071 CCOc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000211144 [0,2,0,0,0,0|2,0,0]=4 4318 B17R1.18071 CCOc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000211144 [0,2,0,0,0,0|2,0,0]=4 4319 B17R1.18071 CCOc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000211144 [0,2,0,0,0,0|2,0,0]=4 4320 B17R1.18071 CCSc1ccccc1C(=O)C(C)CC(C)C 1458a_100000195471_100000731052 [0,2,0,0,0,0|2,0,0]=4 4321 B17R1.18071 CCSc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000195471 [0,2,0,0,0,0|2,0,0]=4 4322 B17R1.18071 CCSc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000195471 [0,2,0,0,0,0|2,0,0]=4 4323 B17R1.18071 CCSc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000195471 [0,2,0,0,0,0|2,0,0]=4 4324 B17R1.18071 CCSc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000195471 [0,2,0,0,0,0|2,0,0]=4 4325 B17R1.18071 COCc1ccccc1C(=O)C(C)CC(C)C 1458a_100000737999_100000731052 [0,2,0,0,0,0|2,0,0]=4 4326 B17R1.18071 COCc1ccccc1C(=O)N(C)CC(C)C 11a_100000747067_100000737999 [0,2,0,0,0,0|2,0,0]=4 4327 B17R1.18071 COCc1ccccc1C(=O)N(C)CC(C)C 1626a_100000747067_100000737999 [0,2,0,0,0,0|2,0,0]=4 4328 B17R1.18071 COCc1ccccc1C(=O)N(C)CC(C)C 240690a_100000747067_100000737999 [0,2,0,0,0,0|2,0,0]=4 4329 B17R1.18071 COCc1ccccc1C(=O)N(C)CC(C)C 527a_100000747067_100000737999 [0,2,0,0,0,0|2,0,0]=4 4330 B17R1.18072 CCOc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000211144 [0,2,0,0,0,0|2,0,0]=4 4331 B17R1.18072 CCOc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000211144 [0,2,0,0,0,0|2,0,0]=4 4332 B17R1.18072 CCOc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000211144 [0,2,0,0,0,0|2,0,0]=4 4333 B17R1.18072 CCOc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000211144 [0,2,0,0,0,0|2,0,0]=4 4334 B17R1.18072 CCSc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000195471 [0,2,0,0,0,0|2,0,0]=4 4335 B17R1.18072 CCSc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000195471 [0,2,0,0,0,0|2,0,0]=4 4336 B17R1.18072 CCSc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000195471 [0,2,0,0,0,0|2,0,0]=4 4337 B17R1.18072 CCSc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000195471 [0,2,0,0,0,0|2,0,0]=4 4338 B17R1.18072 COCc1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100000737999 [0,2,0,0,0,0|2,0,0]=4 4339 B17R1.18072 COCc1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100000737999 [0,2,0,0,0,0|2,0,0]=4 4340 B17R1.18072 COCc1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100000737999 [0,2,0,0,0,0|2,0,0]=4 4341 B17R1.18072 COCc1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100000737999 [0,2,0,0,0,0|2,0,0]=4 4342 B17R1.18074 CCC(C)CNC(=O)c1ccccc1COC 11a_100020588543_100000737999 [0,2,0,0,0,0|2,0,0]=4 4343 B17R1.18074 CCC(C)CNC(=O)c1ccccc1COC 1626a_100020588543_100000737999 [0,2,0,0,0,0|2,0,0]=4 4344 B17R1.18074 CCC(C)CNC(=O)c1ccccc1COC 240690a_100020588543_100000737999 [0,2,0,0,0,0|2,0,0]=4 4345 B17R1.18074 CCC(C)CNC(=O)c1ccccc1COC 527a_100020588543_100000737999 [0,2,0,0,0,0|2,0,0]=4 4346 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CC 11a_100020588543_100000211144 [0,2,0,0,0,0|2,0,0]=4 4347 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100000211144 [0,2,0,0,0,0|2,0,0]=4 4348 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CC 240690a_100020588543_100000211144 [0,2,0,0,0,0|2,0,0]=4 4349 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100000211144 [0,2,0,0,0,0|2,0,0]=4 4350 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000211144 [0,2,0,0,0,0|2,0,0]=4 4351 B17R1.18074 CCOc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000211144 [0,2,0,0,0,0|2,0,0]=4 4352 B17R1.18074 CCOc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000211144 [0,2,0,0,0,0|2,0,0]=4 4353 B17R1.18074 CCOc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000211144 [0,2,0,0,0,0|2,0,0]=4 4354 B17R1.18074 CCOc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000211144 [0,2,0,0,0,0|2,0,0]=4 4355 B17R1.18074 CCOc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000211144 [0,2,0,0,0,0|2,0,0]=4 4356 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CC 11a_100020588543_100000195471 [0,2,0,0,0,0|2,0,0]=4 4357 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CC 1626a_100020588543_100000195471 [0,2,0,0,0,0|2,0,0]=4 4358 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CC 240690a_100020588543_100000195471 [0,2,0,0,0,0|2,0,0]=4 4359 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CC 527a_100020588543_100000195471 [0,2,0,0,0,0|2,0,0]=4 4360 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000195471 [0,2,0,0,0,0|2,0,0]=4 4361 B17R1.18074 CCSc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000195471 [0,2,0,0,0,0|2,0,0]=4 4362 B17R1.18074 CCSc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000195471 [0,2,0,0,0,0|2,0,0]=4 4363 B17R1.18074 CCSc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000195471 [0,2,0,0,0,0|2,0,0]=4 4364 B17R1.18074 CCSc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000195471 [0,2,0,0,0,0|2,0,0]=4 4365 B17R1.18074 CCSc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000195471 [0,2,0,0,0,0|2,0,0]=4 4366 B17R1.18074 COCc1ccccc1C(=O)NCC(C)CO 240690a_100000744482_100000737999 [0,2,0,0,0,0|2,0,0]=4 4367 B17R1.18074 COCc1ccccc1C(=O)NCC(C)CO 527a_100000744482_100000737999 [0,2,0,0,0,0|2,0,0]=4 4368 B17R1.18074 COCc1ccccc1C(=O)NC[C@@H](C)OC 11a_100020591295_100000737999 [0,2,0,0,0,0|2,0,0]=4 4369 B17R1.18074 COCc1ccccc1C(=O)NC[C@@H](C)OC 1626a_100020591295_100000737999 [0,2,0,0,0,0|2,0,0]=4 4370 B17R1.18074 COCc1ccccc1C(=O)NC[C@@H](C)OC 240690a_100020591295_100000737999 [0,2,0,0,0,0|2,0,0]=4 4371 B17R1.18074 COCc1ccccc1C(=O)NC[C@@H](C)OC 527a_100020591295_100000737999 [0,2,0,0,0,0|2,0,0]=4 4372 B17R1.18144 CCOc1ccccc1C(=O)CCC(C)(C)C 1458a_100000211144_100000755188 [0,2,0,0,0,0|2,0,0]=4 4373 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000211144 [0,2,0,0,0,0|2,0,0]=4 4374 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000211144 [0,2,0,0,0,0|2,0,0]=4 4375 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000211144 [0,2,0,0,0,0|2,0,0]=4 4376 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000211144 [0,2,0,0,0,0|2,0,0]=4 4377 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000211144 [0,2,0,0,0,0|2,0,0]=4 4378 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000211144 [0,2,0,0,0,0|2,0,0]=4 4379 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000211144 [0,2,0,0,0,0|2,0,0]=4 4380 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000211144 [0,2,0,0,0,0|2,0,0]=4 4381 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000211144 [0,2,0,0,0,0|2,0,0]=4 4382 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000211144 [0,2,0,0,0,0|2,0,0]=4 4383 B17R1.18144 CCOc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000211144 [0,2,0,0,0,0|2,0,0]=4 4384 B17R1.18144 CCSc1ccccc1C(=O)CCC(C)(C)C 1458a_100000195471_100000755188 [0,2,0,0,0,0|2,0,0]=4 4385 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000195471 [0,2,0,0,0,0|2,0,0]=4 4386 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000195471 [0,2,0,0,0,0|2,0,0]=4 4387 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000195471 [0,2,0,0,0,0|2,0,0]=4 4388 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000195471 [0,2,0,0,0,0|2,0,0]=4 4389 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000195471 [0,2,0,0,0,0|2,0,0]=4 4390 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000195471 [0,2,0,0,0,0|2,0,0]=4 4391 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000195471 [0,2,0,0,0,0|2,0,0]=4 4392 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000195471 [0,2,0,0,0,0|2,0,0]=4 4393 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000195471 [0,2,0,0,0,0|2,0,0]=4 4394 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000195471 [0,2,0,0,0,0|2,0,0]=4 4395 B17R1.18144 CCSc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000195471 [0,2,0,0,0,0|2,0,0]=4 4396 B17R1.18144 COCc1ccccc1C(=O)CCC(C)(C)C 1458a_100000737999_100000755188 [0,2,0,0,0,0|2,0,0]=4 4397 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100000737999 [0,2,0,0,0,0|2,0,0]=4 4398 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000737999 [0,2,0,0,0,0|2,0,0]=4 4399 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000737999 [0,2,0,0,0,0|2,0,0]=4 4400 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100000737999 [0,2,0,0,0,0|2,0,0]=4 4401 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100000737999 [0,2,0,0,0,0|2,0,0]=4 4402 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000737999 [0,2,0,0,0,0|2,0,0]=4 4403 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000737999 [0,2,0,0,0,0|2,0,0]=4 4404 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100000737999 [0,2,0,0,0,0|2,0,0]=4 4405 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000737999 [0,2,0,0,0,0|2,0,0]=4 4406 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000737999 [0,2,0,0,0,0|2,0,0]=4 4407 B17R1.18144 COCc1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100000737999 [0,2,0,0,0,0|2,0,0]=4 4408 B17R1.38877 CCOc1cccc(c1C(=O)CCC(C)C)C 1458a_200009913675_100000210312 [0,2,0,0,0,0|2,0,0]=4 4409 B17R1.38877 CCOc1cccc(c1C(=O)NCC(C)C)C 11a_100000210953_200009913675 [0,2,0,0,0,0|2,0,0]=4 4410 B17R1.38877 CCOc1cccc(c1C(=O)NCC(C)C)C 1626a_100000210953_200009913675 [0,2,0,0,0,0|2,0,0]=4 4411 B17R1.38877 CCOc1cccc(c1C(=O)NCC(C)C)C 240690a_100000210953_200009913675 [0,2,0,0,0,0|2,0,0]=4 4412 B17R1.38877 CCOc1cccc(c1C(=O)NCC(C)C)C 527a_100000210953_200009913675 [0,2,0,0,0,0|2,0,0]=4 4413 B17R1.4685 CCc1ccc(cc1C(=O)C(C)CC(C)C)Br 1458a_100012343961_100000731052 [0,2,0,0,0,0|2,0,0]=4 4414 B17R1.4685 CCc1ccc(cc1C(=O)N(C)CC(C)C)Br 11a_100000747067_100012343961 [0,2,0,0,0,0|2,0,0]=4 4415 B17R1.4685 CCc1ccc(cc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100012343961 [0,2,0,0,0,0|2,0,0]=4 4416 B17R1.4685 CCc1ccc(cc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100012343961 [0,2,0,0,0,0|2,0,0]=4 4417 B17R1.4685 CCc1ccc(cc1C(=O)N(C)CC(C)C)Br 527a_100000747067_100012343961 [0,2,0,0,0,0|2,0,0]=4 4418 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)Br 1458a_100000188853_100000731052 [0,2,0,0,0,0|2,0,0]=4 4419 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)C 1458a_100000204667_100000731052 [0,2,0,0,0,0|2,0,0]=4 4420 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)Cl 1458a_100000211409_100000731052 [0,2,0,0,0,0|2,0,0]=4 4421 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)F 1458a_100000735445_100000731052 [0,2,0,0,0,0|2,0,0]=4 4422 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)I 1458a_100000230898_100000731052 [0,2,0,0,0,0|2,0,0]=4 4423 B17R1.4685 COc1ccc(cc1C(=O)C(C)CC(C)C)O 1458a_200000100057_100000731052 [0,2,0,0,0,0|2,0,0]=4 4424 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Br 11a_100000747067_100000188853 [0,2,0,0,0,0|2,0,0]=4 4425 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100000188853 [0,2,0,0,0,0|2,0,0]=4 4426 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100000188853 [0,2,0,0,0,0|2,0,0]=4 4427 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Br 527a_100000747067_100000188853 [0,2,0,0,0,0|2,0,0]=4 4428 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)C 11a_100000747067_100000204667 [0,2,0,0,0,0|2,0,0]=4 4429 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)C 1626a_100000747067_100000204667 [0,2,0,0,0,0|2,0,0]=4 4430 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)C 240690a_100000747067_100000204667 [0,2,0,0,0,0|2,0,0]=4 4431 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)C 527a_100000747067_100000204667 [0,2,0,0,0,0|2,0,0]=4 4432 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Cl 11a_100000747067_100000211409 [0,2,0,0,0,0|2,0,0]=4 4433 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Cl 1626a_100000747067_100000211409 [0,2,0,0,0,0|2,0,0]=4 4434 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Cl 240690a_100000747067_100000211409 [0,2,0,0,0,0|2,0,0]=4 4435 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)Cl 527a_100000747067_100000211409 [0,2,0,0,0,0|2,0,0]=4 4436 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)F 11a_100000747067_100000735445 [0,2,0,0,0,0|2,0,0]=4 4437 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)F 1626a_100000747067_100000735445 [0,2,0,0,0,0|2,0,0]=4 4438 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)F 240690a_100000747067_100000735445 [0,2,0,0,0,0|2,0,0]=4 4439 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)F 527a_100000747067_100000735445 [0,2,0,0,0,0|2,0,0]=4 4440 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)I 11a_100000747067_100000230898 [0,2,0,0,0,0|2,0,0]=4 4441 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)I 1626a_100000747067_100000230898 [0,2,0,0,0,0|2,0,0]=4 4442 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)I 240690a_100000747067_100000230898 [0,2,0,0,0,0|2,0,0]=4 4443 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)I 527a_100000747067_100000230898 [0,2,0,0,0,0|2,0,0]=4 4444 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)O 240690a_100000747067_200000100057 [0,2,0,0,0,0|2,0,0]=4 4445 B17R1.4685 COc1ccc(cc1C(=O)N(C)CC(C)C)O 527a_100000747067_200000100057 [0,2,0,0,0,0|2,0,0]=4 4446 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Br 11a_100020588543_100000188853 [0,2,0,0,0,0|2,0,0]=4 4447 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Br 1626a_100020588543_100000188853 [0,2,0,0,0,0|2,0,0]=4 4448 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Br 240690a_100020588543_100000188853 [0,2,0,0,0,0|2,0,0]=4 4449 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Br 527a_100020588543_100000188853 [0,2,0,0,0,0|2,0,0]=4 4450 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)C 11a_100020588543_100000204667 [0,2,0,0,0,0|2,0,0]=4 4451 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)C 1626a_100020588543_100000204667 [0,2,0,0,0,0|2,0,0]=4 4452 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)C 240690a_100020588543_100000204667 [0,2,0,0,0,0|2,0,0]=4 4453 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)C 527a_100020588543_100000204667 [0,2,0,0,0,0|2,0,0]=4 4454 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Cl 11a_100020588543_100000211409 [0,2,0,0,0,0|2,0,0]=4 4455 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Cl 1626a_100020588543_100000211409 [0,2,0,0,0,0|2,0,0]=4 4456 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Cl 240690a_100020588543_100000211409 [0,2,0,0,0,0|2,0,0]=4 4457 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)Cl 527a_100020588543_100000211409 [0,2,0,0,0,0|2,0,0]=4 4458 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)F 11a_100020588543_100000735445 [0,2,0,0,0,0|2,0,0]=4 4459 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)F 1626a_100020588543_100000735445 [0,2,0,0,0,0|2,0,0]=4 4460 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)F 240690a_100020588543_100000735445 [0,2,0,0,0,0|2,0,0]=4 4461 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)F 527a_100020588543_100000735445 [0,2,0,0,0,0|2,0,0]=4 4462 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)I 11a_100020588543_100000230898 [0,2,0,0,0,0|2,0,0]=4 4463 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)I 1626a_100020588543_100000230898 [0,2,0,0,0,0|2,0,0]=4 4464 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)I 240690a_100020588543_100000230898 [0,2,0,0,0,0|2,0,0]=4 4465 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)I 527a_100020588543_100000230898 [0,2,0,0,0,0|2,0,0]=4 4466 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)O 240690a_100020588543_200000100057 [0,2,0,0,0,0|2,0,0]=4 4467 B17R1.4762 CCC(C)CNC(=O)c1cc(ccc1OC)O 527a_100020588543_200000100057 [0,2,0,0,0,0|2,0,0]=4 4468 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CC)Br 11a_100020588543_100012343961 [0,2,0,0,0,0|2,0,0]=4 4469 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CC)Br 1626a_100020588543_100012343961 [0,2,0,0,0,0|2,0,0]=4 4470 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CC)Br 240690a_100020588543_100012343961 [0,2,0,0,0,0|2,0,0]=4 4471 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CC)Br 527a_100020588543_100012343961 [0,2,0,0,0,0|2,0,0]=4 4472 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CO)Br 240690a_100000744482_100012343961 [0,2,0,0,0,0|2,0,0]=4 4473 B17R1.4762 CCc1ccc(cc1C(=O)NCC(C)CO)Br 527a_100000744482_100012343961 [0,2,0,0,0,0|2,0,0]=4 4474 B17R1.4762 CCc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100012343961 [0,2,0,0,0,0|2,0,0]=4 4475 B17R1.4762 CCc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100012343961 [0,2,0,0,0,0|2,0,0]=4 4476 B17R1.4762 CCc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100012343961 [0,2,0,0,0,0|2,0,0]=4 4477 B17R1.4762 CCc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100012343961 [0,2,0,0,0,0|2,0,0]=4 4478 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)Br 240690a_100000744482_100000188853 [0,2,0,0,0,0|2,0,0]=4 4479 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)Br 527a_100000744482_100000188853 [0,2,0,0,0,0|2,0,0]=4 4480 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)C 240690a_100000744482_100000204667 [0,2,0,0,0,0|2,0,0]=4 4481 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)C 527a_100000744482_100000204667 [0,2,0,0,0,0|2,0,0]=4 4482 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)Cl 240690a_100000744482_100000211409 [0,2,0,0,0,0|2,0,0]=4 4483 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)Cl 527a_100000744482_100000211409 [0,2,0,0,0,0|2,0,0]=4 4484 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)F 240690a_100000744482_100000735445 [0,2,0,0,0,0|2,0,0]=4 4485 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)F 527a_100000744482_100000735445 [0,2,0,0,0,0|2,0,0]=4 4486 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)I 240690a_100000744482_100000230898 [0,2,0,0,0,0|2,0,0]=4 4487 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)I 527a_100000744482_100000230898 [0,2,0,0,0,0|2,0,0]=4 4488 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)O 240690a_100000744482_200000100057 [0,2,0,0,0,0|2,0,0]=4 4489 B17R1.4762 COc1ccc(cc1C(=O)NCC(C)CO)O 527a_100000744482_200000100057 [0,2,0,0,0,0|2,0,0]=4 4490 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100000188853 [0,2,0,0,0,0|2,0,0]=4 4491 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100000188853 [0,2,0,0,0,0|2,0,0]=4 4492 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100000188853 [0,2,0,0,0,0|2,0,0]=4 4493 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100000188853 [0,2,0,0,0,0|2,0,0]=4 4494 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)C 11a_100020591295_100000204667 [0,2,0,0,0,0|2,0,0]=4 4495 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)C 1626a_100020591295_100000204667 [0,2,0,0,0,0|2,0,0]=4 4496 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)C 240690a_100020591295_100000204667 [0,2,0,0,0,0|2,0,0]=4 4497 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)C 527a_100020591295_100000204667 [0,2,0,0,0,0|2,0,0]=4 4498 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Cl 11a_100020591295_100000211409 [0,2,0,0,0,0|2,0,0]=4 4499 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Cl 1626a_100020591295_100000211409 [0,2,0,0,0,0|2,0,0]=4 4500 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Cl 240690a_100020591295_100000211409 [0,2,0,0,0,0|2,0,0]=4 4501 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)Cl 527a_100020591295_100000211409 [0,2,0,0,0,0|2,0,0]=4 4502 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)F 11a_100020591295_100000735445 [0,2,0,0,0,0|2,0,0]=4 4503 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)F 1626a_100020591295_100000735445 [0,2,0,0,0,0|2,0,0]=4 4504 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)F 240690a_100020591295_100000735445 [0,2,0,0,0,0|2,0,0]=4 4505 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)F 527a_100020591295_100000735445 [0,2,0,0,0,0|2,0,0]=4 4506 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)I 11a_100020591295_100000230898 [0,2,0,0,0,0|2,0,0]=4 4507 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)I 1626a_100020591295_100000230898 [0,2,0,0,0,0|2,0,0]=4 4508 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)I 240690a_100020591295_100000230898 [0,2,0,0,0,0|2,0,0]=4 4509 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)I 527a_100020591295_100000230898 [0,2,0,0,0,0|2,0,0]=4 4510 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)O 240690a_100020591295_200000100057 [0,2,0,0,0,0|2,0,0]=4 4511 B17R1.4762 COc1ccc(cc1C(=O)NC[C@@H](C)OC)O 527a_100020591295_200000100057 [0,2,0,0,0,0|2,0,0]=4 4512 B17R1.6698 COc1ccc(c(c1)C(=O)CCC(C)C)OC 1458a_100000185243_100000210312 [0,2,0,0,0,0|2,0,0]=4 4513 B17R1.6698 COc1ccc(c(c1)C(=O)NCC(C)C)OC 11a_100000210953_100000185243 [0,2,0,0,0,0|2,0,0]=4 4514 B17R1.6698 COc1ccc(c(c1)C(=O)NCC(C)C)OC 1626a_100000210953_100000185243 [0,2,0,0,0,0|2,0,0]=4 4515 B17R1.6698 COc1ccc(c(c1)C(=O)NCC(C)C)OC 240690a_100000210953_100000185243 [0,2,0,0,0,0|2,0,0]=4 4516 B17R1.6698 COc1ccc(c(c1)C(=O)NCC(C)C)OC 527a_100000210953_100000185243 [0,2,0,0,0,0|2,0,0]=4 4517 B17R1.6698 COc1ccc(cc1C(=O)CCC(C)C)C#N 1458a_100009859923_100000210312 [0,2,0,0,0,0|2,0,0]=4 4518 B17R1.6698 COc1ccc(cc1C(=O)NCC(C)C)C#N 11a_100000210953_100009859923 [0,2,0,0,0,0|2,0,0]=4 4519 B17R1.6698 COc1ccc(cc1C(=O)NCC(C)C)C#N 1626a_100000210953_100009859923 [0,2,0,0,0,0|2,0,0]=4 4520 B17R1.6698 COc1ccc(cc1C(=O)NCC(C)C)C#N 240690a_100000210953_100009859923 [0,2,0,0,0,0|2,0,0]=4 4521 B17R1.6698 COc1ccc(cc1C(=O)NCC(C)C)C#N 527a_100000210953_100009859923 [0,2,0,0,0,0|2,0,0]=4 4522 B17R1.14594 C=C(C)c1ccc(cc1C(=O)NCC(C)C)F 271570a_100000694244_200000205877 [0,2,0,0,0,0|2,0,0]=4 4523 B17R1.14594 CC(C)CNC(=O)c1cc(ccc1N(C)C)F 27a_100102631434_200000205877 [0,2,0,0,0,0|1,0,0]=3 4524 B17R1.14594 Cc1ccc(c(c1)C(=O)CCC(C)C)C(C)C 1458a_200012176289_100000210312 [0,2,0,0,0,0|2,0,0]=4 4525 B17R1.14594 Cc1ccc(c(c1)C(=O)NCC(C)C)C(C)C 11a_100000210953_200012176289 [0,2,0,0,0,0|2,0,0]=4 4526 B17R1.14594 Cc1ccc(c(c1)C(=O)NCC(C)C)C(C)C 1626a_100000210953_200012176289 [0,2,0,0,0,0|2,0,0]=4 4527 B17R1.14594 Cc1ccc(c(c1)C(=O)NCC(C)C)C(C)C 240690a_100000210953_200012176289 [0,2,0,0,0,0|2,0,0]=4 4528 B17R1.14594 Cc1ccc(c(c1)C(=O)NCC(C)C)C(C)C 527a_100000210953_200012176289 [0,2,0,0,0,0|2,0,0]=4 4529 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)Br)C 1458a_100000728833_100000210312 [0,2,0,0,0,0|2,0,0]=4 4530 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)Br)Cl 1458a_100000760434_100000210312 [0,2,0,0,0,0|2,0,0]=4 4531 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)Br)F 1458a_100012355408_100000210312 [0,2,0,0,0,0|2,0,0]=4 4532 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)Cl)Cl 1458a_100000684457_100000210312 [0,2,0,0,0,0|2,0,0]=4 4533 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)Cl)I 1458a_200000738201_100000210312 [0,2,0,0,0,0|2,0,0]=4 4534 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)F)Br 1458a_100010827335_100000210312 [0,2,0,0,0,0|2,0,0]=4 4535 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)F)F 1458a_100000062012_100000210312 [0,2,0,0,0,0|2,0,0]=4 4536 B17R1.28804 COc1cc(c(cc1C(=O)CCC(C)C)I)Cl 1458a_100013369036_100000210312 [0,2,0,0,0,0|2,0,0]=4 4537 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)C 11a_100000210953_100000728833 [0,2,0,0,0,0|2,0,0]=4 4538 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)C 1626a_100000210953_100000728833 [0,2,0,0,0,0|2,0,0]=4 4539 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)C 240690a_100000210953_100000728833 [0,2,0,0,0,0|2,0,0]=4 4540 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)C 527a_100000210953_100000728833 [0,2,0,0,0,0|2,0,0]=4 4541 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)Cl 11a_100000210953_100000760434 [0,2,0,0,0,0|2,0,0]=4 4542 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)Cl 1626a_100000210953_100000760434 [0,2,0,0,0,0|2,0,0]=4 4543 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)Cl 240690a_100000210953_100000760434 [0,2,0,0,0,0|2,0,0]=4 4544 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)Cl 527a_100000210953_100000760434 [0,2,0,0,0,0|2,0,0]=4 4545 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)F 11a_100000210953_100012355408 [0,2,0,0,0,0|2,0,0]=4 4546 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)F 1626a_100000210953_100012355408 [0,2,0,0,0,0|2,0,0]=4 4547 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)F 240690a_100000210953_100012355408 [0,2,0,0,0,0|2,0,0]=4 4548 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Br)F 527a_100000210953_100012355408 [0,2,0,0,0,0|2,0,0]=4 4549 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)Cl 11a_100000210953_100000684457 [0,2,0,0,0,0|2,0,0]=4 4550 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)Cl 1626a_100000210953_100000684457 [0,2,0,0,0,0|2,0,0]=4 4551 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)Cl 240690a_100000210953_100000684457 [0,2,0,0,0,0|2,0,0]=4 4552 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)Cl 527a_100000210953_100000684457 [0,2,0,0,0,0|2,0,0]=4 4553 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)I 11a_100000210953_200000738201 [0,2,0,0,0,0|2,0,0]=4 4554 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)I 1626a_100000210953_200000738201 [0,2,0,0,0,0|2,0,0]=4 4555 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)I 240690a_100000210953_200000738201 [0,2,0,0,0,0|2,0,0]=4 4556 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)Cl)I 527a_100000210953_200000738201 [0,2,0,0,0,0|2,0,0]=4 4557 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)Br 11a_100000210953_100010827335 [0,2,0,0,0,0|2,0,0]=4 4558 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)Br 1626a_100000210953_100010827335 [0,2,0,0,0,0|2,0,0]=4 4559 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)Br 240690a_100000210953_100010827335 [0,2,0,0,0,0|2,0,0]=4 4560 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)Br 527a_100000210953_100010827335 [0,2,0,0,0,0|2,0,0]=4 4561 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)F 11a_100000210953_100000062012 [0,2,0,0,0,0|2,0,0]=4 4562 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)F 1626a_100000210953_100000062012 [0,2,0,0,0,0|2,0,0]=4 4563 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)F 240690a_100000210953_100000062012 [0,2,0,0,0,0|2,0,0]=4 4564 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)F)F 527a_100000210953_100000062012 [0,2,0,0,0,0|2,0,0]=4 4565 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)I)Cl 11a_100000210953_100013369036 [0,2,0,0,0,0|2,0,0]=4 4566 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)I)Cl 1626a_100000210953_100013369036 [0,2,0,0,0,0|2,0,0]=4 4567 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)I)Cl 240690a_100000210953_100013369036 [0,2,0,0,0,0|2,0,0]=4 4568 B17R1.28804 COc1cc(c(cc1C(=O)NCC(C)C)I)Cl 527a_100000210953_100013369036 [0,2,0,0,0,0|2,0,0]=4 4569 B17R1.29044 COc1ccc(c(c1C(=O)CCC(C)C)C)Br 1458a_200010273786_100000210312 [0,2,0,0,0,0|2,0,0]=4 4570 B17R1.29044 COc1ccc(c(c1C(=O)CCC(C)C)F)Br 1458a_100010782282_100000210312 [0,2,0,0,0,0|2,0,0]=4 4571 B17R1.29044 COc1ccc(c(c1C(=O)CCC(C)C)F)F 1458a_100000062122_100000210312 [0,2,0,0,0,0|2,0,0]=4 4572 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)C)Br 11a_100000210953_200010273786 [0,2,0,0,0,0|2,0,0]=4 4573 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)C)Br 240690a_100000210953_200010273786 [0,2,0,0,0,0|2,0,0]=4 4574 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)C)Br 527a_100000210953_200010273786 [0,2,0,0,0,0|2,0,0]=4 4575 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)Br 11a_100000210953_100010782282 [0,2,0,0,0,0|2,0,0]=4 4576 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)Br 240690a_100000210953_100010782282 [0,2,0,0,0,0|2,0,0]=4 4577 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)Br 527a_100000210953_100010782282 [0,2,0,0,0,0|2,0,0]=4 4578 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)F 11a_100000210953_100000062122 [0,2,0,0,0,0|2,0,0]=4 4579 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)F 1626a_100000210953_100000062122 [0,2,0,0,0,0|2,0,0]=4 4580 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)F 240690a_100000210953_100000062122 [0,2,0,0,0,0|2,0,0]=4 4581 B17R1.29044 COc1ccc(c(c1C(=O)NCC(C)C)F)F 527a_100000210953_100000062122 [0,2,0,0,0,0|2,0,0]=4 4582 B17R1.37613 CCc1ccc(cc1C(=O)NC(C)C(C)C)Br 11a_100000211541_100012343961 [0,2,0,0,0,0|2,0,0]=4 4583 B17R1.37613 CCc1ccc(cc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100012343961 [0,2,0,0,0,0|2,0,0]=4 4584 B17R1.37613 CCc1ccc(cc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100012343961 [0,2,0,0,0,0|2,0,0]=4 4585 B17R1.37613 CCc1ccc(cc1C(=O)NC(C)C(C)C)Br 527a_100000211541_100012343961 [0,2,0,0,0,0|2,0,0]=4 4586 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Br 11a_100000211541_100000188853 [0,2,0,0,0,0|2,0,0]=4 4587 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100000188853 [0,2,0,0,0,0|2,0,0]=4 4588 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100000188853 [0,2,0,0,0,0|2,0,0]=4 4589 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Br 527a_100000211541_100000188853 [0,2,0,0,0,0|2,0,0]=4 4590 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)C 11a_100000211541_100000204667 [0,2,0,0,0,0|2,0,0]=4 4591 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)C 1626a_100000211541_100000204667 [0,2,0,0,0,0|2,0,0]=4 4592 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)C 240690a_100000211541_100000204667 [0,2,0,0,0,0|2,0,0]=4 4593 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)C 527a_100000211541_100000204667 [0,2,0,0,0,0|2,0,0]=4 4594 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Cl 11a_100000211541_100000211409 [0,2,0,0,0,0|2,0,0]=4 4595 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Cl 1626a_100000211541_100000211409 [0,2,0,0,0,0|2,0,0]=4 4596 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Cl 240690a_100000211541_100000211409 [0,2,0,0,0,0|2,0,0]=4 4597 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)Cl 527a_100000211541_100000211409 [0,2,0,0,0,0|2,0,0]=4 4598 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)F 11a_100000211541_100000735445 [0,2,0,0,0,0|2,0,0]=4 4599 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)F 1626a_100000211541_100000735445 [0,2,0,0,0,0|2,0,0]=4 4600 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)F 240690a_100000211541_100000735445 [0,2,0,0,0,0|2,0,0]=4 4601 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)F 527a_100000211541_100000735445 [0,2,0,0,0,0|2,0,0]=4 4602 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)I 11a_100000211541_100000230898 [0,2,0,0,0,0|2,0,0]=4 4603 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)I 1626a_100000211541_100000230898 [0,2,0,0,0,0|2,0,0]=4 4604 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)I 240690a_100000211541_100000230898 [0,2,0,0,0,0|2,0,0]=4 4605 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)I 527a_100000211541_100000230898 [0,2,0,0,0,0|2,0,0]=4 4606 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)O 240690a_100000211541_200000100057 [0,2,0,0,0,0|2,0,0]=4 4607 B17R1.37613 COc1ccc(cc1C(=O)NC(C)C(C)C)O 527a_100000211541_200000100057 [0,2,0,0,0,0|2,0,0]=4 4608 B17R1.48015 CCc1ccc(cc1C(=O)CCC(C)(C)C)Br 1458a_100012343961_100000755188 [0,2,0,0,0,0|2,0,0]=4 4609 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)C)Br 11a_100000743828_100012343961 [0,2,0,0,0,0|2,0,0]=4 4610 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100012343961 [0,2,0,0,0,0|2,0,0]=4 4611 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100012343961 [0,2,0,0,0,0|2,0,0]=4 4612 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)C)Br 527a_100000743828_100012343961 [0,2,0,0,0,0|2,0,0]=4 4613 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)F)Br 11a_100020643315_100012343961 [0,2,0,0,0,0|2,0,0]=4 4614 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100012343961 [0,2,0,0,0,0|2,0,0]=4 4615 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100012343961 [0,2,0,0,0,0|2,0,0]=4 4616 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)F)Br 527a_100020643315_100012343961 [0,2,0,0,0,0|2,0,0]=4 4617 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100012343961 [0,2,0,0,0,0|2,0,0]=4 4618 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100012343961 [0,2,0,0,0,0|2,0,0]=4 4619 B17R1.48015 CCc1ccc(cc1C(=O)NCC(C)(C)O)Br 527a_100000751335_100012343961 [0,2,0,0,0,0|2,0,0]=4 4620 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)Br 1458a_100000188853_100000755188 [0,2,0,0,0,0|2,0,0]=4 4621 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)C 1458a_100000204667_100000755188 [0,2,0,0,0,0|2,0,0]=4 4622 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)Cl 1458a_100000211409_100000755188 [0,2,0,0,0,0|2,0,0]=4 4623 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)F 1458a_100000735445_100000755188 [0,2,0,0,0,0|2,0,0]=4 4624 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)I 1458a_100000230898_100000755188 [0,2,0,0,0,0|2,0,0]=4 4625 B17R1.48015 COc1ccc(cc1C(=O)CCC(C)(C)C)O 1458a_200000100057_100000755188 [0,2,0,0,0,0|2,0,0]=4 4626 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Br 11a_100000743828_100000188853 [0,2,0,0,0,0|2,0,0]=4 4627 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100000188853 [0,2,0,0,0,0|2,0,0]=4 4628 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100000188853 [0,2,0,0,0,0|2,0,0]=4 4629 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Br 527a_100000743828_100000188853 [0,2,0,0,0,0|2,0,0]=4 4630 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)C 11a_100000743828_100000204667 [0,2,0,0,0,0|2,0,0]=4 4631 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)C 1626a_100000743828_100000204667 [0,2,0,0,0,0|2,0,0]=4 4632 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)C 240690a_100000743828_100000204667 [0,2,0,0,0,0|2,0,0]=4 4633 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)C 527a_100000743828_100000204667 [0,2,0,0,0,0|2,0,0]=4 4634 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Cl 11a_100000743828_100000211409 [0,2,0,0,0,0|2,0,0]=4 4635 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Cl 1626a_100000743828_100000211409 [0,2,0,0,0,0|2,0,0]=4 4636 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Cl 240690a_100000743828_100000211409 [0,2,0,0,0,0|2,0,0]=4 4637 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)Cl 527a_100000743828_100000211409 [0,2,0,0,0,0|2,0,0]=4 4638 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)F 11a_100000743828_100000735445 [0,2,0,0,0,0|2,0,0]=4 4639 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)F 1626a_100000743828_100000735445 [0,2,0,0,0,0|2,0,0]=4 4640 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)F 240690a_100000743828_100000735445 [0,2,0,0,0,0|2,0,0]=4 4641 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)F 527a_100000743828_100000735445 [0,2,0,0,0,0|2,0,0]=4 4642 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)I 11a_100000743828_100000230898 [0,2,0,0,0,0|2,0,0]=4 4643 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)I 1626a_100000743828_100000230898 [0,2,0,0,0,0|2,0,0]=4 4644 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)I 240690a_100000743828_100000230898 [0,2,0,0,0,0|2,0,0]=4 4645 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)I 527a_100000743828_100000230898 [0,2,0,0,0,0|2,0,0]=4 4646 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)O 240690a_100000743828_200000100057 [0,2,0,0,0,0|2,0,0]=4 4647 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)C)O 527a_100000743828_200000100057 [0,2,0,0,0,0|2,0,0]=4 4648 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Br 11a_100020643315_100000188853 [0,2,0,0,0,0|2,0,0]=4 4649 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100000188853 [0,2,0,0,0,0|2,0,0]=4 4650 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100000188853 [0,2,0,0,0,0|2,0,0]=4 4651 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Br 527a_100020643315_100000188853 [0,2,0,0,0,0|2,0,0]=4 4652 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)C 11a_100020643315_100000204667 [0,2,0,0,0,0|2,0,0]=4 4653 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)C 1626a_100020643315_100000204667 [0,2,0,0,0,0|2,0,0]=4 4654 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)C 240690a_100020643315_100000204667 [0,2,0,0,0,0|2,0,0]=4 4655 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)C 527a_100020643315_100000204667 [0,2,0,0,0,0|2,0,0]=4 4656 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Cl 11a_100020643315_100000211409 [0,2,0,0,0,0|2,0,0]=4 4657 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Cl 1626a_100020643315_100000211409 [0,2,0,0,0,0|2,0,0]=4 4658 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Cl 240690a_100020643315_100000211409 [0,2,0,0,0,0|2,0,0]=4 4659 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)Cl 527a_100020643315_100000211409 [0,2,0,0,0,0|2,0,0]=4 4660 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)F 11a_100020643315_100000735445 [0,2,0,0,0,0|2,0,0]=4 4661 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)F 1626a_100020643315_100000735445 [0,2,0,0,0,0|2,0,0]=4 4662 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)F 240690a_100020643315_100000735445 [0,2,0,0,0,0|2,0,0]=4 4663 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)F 527a_100020643315_100000735445 [0,2,0,0,0,0|2,0,0]=4 4664 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)I 11a_100020643315_100000230898 [0,2,0,0,0,0|2,0,0]=4 4665 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)I 1626a_100020643315_100000230898 [0,2,0,0,0,0|2,0,0]=4 4666 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)I 240690a_100020643315_100000230898 [0,2,0,0,0,0|2,0,0]=4 4667 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)I 527a_100020643315_100000230898 [0,2,0,0,0,0|2,0,0]=4 4668 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)O 240690a_100020643315_200000100057 [0,2,0,0,0,0|2,0,0]=4 4669 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)F)O 527a_100020643315_200000100057 [0,2,0,0,0,0|2,0,0]=4 4670 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100000188853 [0,2,0,0,0,0|2,0,0]=4 4671 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100000188853 [0,2,0,0,0,0|2,0,0]=4 4672 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Br 527a_100000751335_100000188853 [0,2,0,0,0,0|2,0,0]=4 4673 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)C 1626a_100000751335_100000204667 [0,2,0,0,0,0|2,0,0]=4 4674 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)C 240690a_100000751335_100000204667 [0,2,0,0,0,0|2,0,0]=4 4675 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)C 527a_100000751335_100000204667 [0,2,0,0,0,0|2,0,0]=4 4676 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Cl 1626a_100000751335_100000211409 [0,2,0,0,0,0|2,0,0]=4 4677 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Cl 240690a_100000751335_100000211409 [0,2,0,0,0,0|2,0,0]=4 4678 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)Cl 527a_100000751335_100000211409 [0,2,0,0,0,0|2,0,0]=4 4679 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)F 1626a_100000751335_100000735445 [0,2,0,0,0,0|2,0,0]=4 4680 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)F 240690a_100000751335_100000735445 [0,2,0,0,0,0|2,0,0]=4 4681 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)F 527a_100000751335_100000735445 [0,2,0,0,0,0|2,0,0]=4 4682 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)I 1626a_100000751335_100000230898 [0,2,0,0,0,0|2,0,0]=4 4683 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)I 240690a_100000751335_100000230898 [0,2,0,0,0,0|2,0,0]=4 4684 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)I 527a_100000751335_100000230898 [0,2,0,0,0,0|2,0,0]=4 4685 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)O 240690a_100000751335_200000100057 [0,2,0,0,0,0|2,0,0]=4 4686 B17R1.48015 COc1ccc(cc1C(=O)NCC(C)(C)O)O 527a_100000751335_200000100057 [0,2,0,0,0,0|2,0,0]=4 4687 B17R1.59250 COc1c(cc(cc1C(=O)CCC(C)C)Br)Br 1458a_100000188141_100000210312 [0,2,0,0,0,0|2,0,0]=4 4688 B17R1.59250 COc1c(cc(cc1C(=O)CCC(C)C)Cl)Cl 1458a_100000186506_100000210312 [0,2,0,0,0,0|2,0,0]=4 4689 B17R1.59250 COc1c(cc(cc1C(=O)CCC(C)C)F)F 1458a_100000062013_100000210312 [0,2,0,0,0,0|2,0,0]=4 4690 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Br)Br 11a_100000210953_100000188141 [0,2,0,0,0,0|2,0,0]=4 4691 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Br)Br 1626a_100000210953_100000188141 [0,2,0,0,0,0|2,0,0]=4 4692 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Br)Br 240690a_100000210953_100000188141 [0,2,0,0,0,0|2,0,0]=4 4693 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Br)Br 527a_100000210953_100000188141 [0,2,0,0,0,0|2,0,0]=4 4694 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Cl)Cl 11a_100000210953_100000186506 [0,2,0,0,0,0|2,0,0]=4 4695 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Cl)Cl 1626a_100000210953_100000186506 [0,2,0,0,0,0|2,0,0]=4 4696 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Cl)Cl 240690a_100000210953_100000186506 [0,2,0,0,0,0|2,0,0]=4 4697 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)Cl)Cl 527a_100000210953_100000186506 [0,2,0,0,0,0|2,0,0]=4 4698 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)F)F 11a_100000210953_100000062013 [0,2,0,0,0,0|2,0,0]=4 4699 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)F)F 1626a_100000210953_100000062013 [0,2,0,0,0,0|2,0,0]=4 4700 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)F)F 240690a_100000210953_100000062013 [0,2,0,0,0,0|2,0,0]=4 4701 B17R1.59250 COc1c(cc(cc1C(=O)NCC(C)C)F)F 527a_100000210953_100000062013 [0,2,0,0,0,0|2,0,0]=4 4702 B17R1.5007 CC(C)CCC(=O)c1ccccc1C(C)(C)C 1458a_100000690655_100000210312 [0,2,0,0,0,0|2,0,0]=4 4703 B17R1.5007 CC(C)CCC(=O)c1ccccc1S(=O)(=O)C 1458a_100000185186_100000210312 [0,2,0,0,0,0|2,0,0]=4 4704 B17R1.5007 CC(C)CNC(=O)c1ccccc1C(C)(C)C 11a_100000210953_100000690655 [0,2,0,0,0,0|2,0,0]=4 4705 B17R1.5007 CC(C)CNC(=O)c1ccccc1C(C)(C)C 1626a_100000210953_100000690655 [0,2,0,0,0,0|2,0,0]=4 4706 B17R1.5007 CC(C)CNC(=O)c1ccccc1C(C)(C)C 240690a_100000210953_100000690655 [0,2,0,0,0,0|2,0,0]=4 4707 B17R1.5007 CC(C)CNC(=O)c1ccccc1C(C)(C)C 527a_100000210953_100000690655 [0,2,0,0,0,0|2,0,0]=4 4708 B17R1.5007 CC(C)CNC(=O)c1ccccc1S(=O)(=O)C 11a_100000210953_100000185186 [0,2,0,0,0,0|2,0,0]=4 4709 B17R1.5007 CC(C)CNC(=O)c1ccccc1S(=O)(=O)C 1626a_100000210953_100000185186 [0,2,0,0,0,0|2,0,0]=4 4710 B17R1.5007 CC(C)CNC(=O)c1ccccc1S(=O)(=O)C 240690a_100000210953_100000185186 [0,2,0,0,0,0|2,0,0]=4 4711 B17R1.9061 CC(CO)CNC(=O)c1ccccc1C(C)C 240690a_100000744482_100011941426 [0,2,0,0,0,0|2,0,0]=4 4712 B17R1.9061 CC(CO)CNC(=O)c1ccccc1C(C)C 527a_100000744482_100011941426 [0,2,0,0,0,0|2,0,0]=4 4713 B17R1.9061 CC(CO)CNC(=O)c1ccccc1N(C)C 240690a_100000744482_100011218752 [0,2,0,0,0,0|1,0,0]=3 4714 B17R1.9061 CC(CO)CNC(=O)c1ccccc1N(C)C 527a_100000744482_100011218752 [0,2,0,0,0,0|1,0,0]=3 4715 B17R1.9061 CC(CO)CNC(=O)c1ccccc1S(=O)C 240690a_100000744482_100000204632 [0,2,0,0,0,0|2,0,0]=4 4716 B17R1.9061 CCC(C)CNC(=O)c1ccccc1C(C)C 11a_100020588543_100011941426 [0,2,0,0,0,0|2,0,0]=4 4717 B17R1.9061 CCC(C)CNC(=O)c1ccccc1C(C)C 1626a_100020588543_100011941426 [0,2,0,0,0,0|2,0,0]=4 4718 B17R1.9061 CCC(C)CNC(=O)c1ccccc1C(C)C 240690a_100020588543_100011941426 [0,2,0,0,0,0|2,0,0]=4 4719 B17R1.9061 CCC(C)CNC(=O)c1ccccc1C(C)C 527a_100020588543_100011941426 [0,2,0,0,0,0|2,0,0]=4 4720 B17R1.9061 CCC(C)CNC(=O)c1ccccc1N(C)C 11a_100020588543_100011218752 [0,2,0,0,0,0|1,0,0]=3 4721 B17R1.9061 CCC(C)CNC(=O)c1ccccc1N(C)C 1626a_100020588543_100011218752 [0,2,0,0,0,0|1,0,0]=3 4722 B17R1.9061 CCC(C)CNC(=O)c1ccccc1N(C)C 240690a_100020588543_100011218752 [0,2,0,0,0,0|1,0,0]=3 4723 B17R1.9061 CCC(C)CNC(=O)c1ccccc1N(C)C 527a_100020588543_100011218752 [0,2,0,0,0,0|1,0,0]=3 4724 B17R1.9061 CCC(C)CNC(=O)c1ccccc1S(=O)C 1626a_100020588543_100000204632 [0,2,0,0,0,0|2,0,0]=4 4725 B17R1.9061 CCC(C)CNC(=O)c1ccccc1S(=O)C 240690a_100020588543_100000204632 [0,2,0,0,0,0|2,0,0]=4 4726 B17R1.9061 CCC(C)NNC(=O)c1ccccc1N(C)C 22a_100000718999_100011218752 [0,2,0,0,0,0|2,0,0]=4 4727 B17R1.9061 CCC(O)CNC(=O)c1ccccc1N(C)C 11a_100011218483_100011218752 [0,2,0,0,0,0|2,0,0]=4 4728 B17R1.9061 CCC(O)CNC(=O)c1ccccc1N(C)C 240690a_100011218483_100011218752 [0,2,0,0,0,0|2,0,0]=4 4729 B17R1.9061 CCC(O)CNC(=O)c1ccccc1N(C)C 527a_100011218483_100011218752 [0,2,0,0,0,0|2,0,0]=4 4730 B17R1.9061 CN(C)c1ccccc1C(=O)NC[C@@H](F)CO 240690a_100015665980_100011218752 [0,2,0,0,0,0|2,0,0]=4 4731 B17R1.9061 CN(C)c1ccccc1C(=O)NC[C@@H](F)CO 527a_100015665980_100011218752 [0,2,0,0,0,0|2,0,0]=4 4732 B17R1.9061 CN(C)c1ccccc1C(=O)NC[C@H](O)CO 240690a_100020644852_100011218752 [0,2,0,0,0,0|2,0,0]=4 4733 B17R1.9061 CN(C)c1ccccc1C(=O)NC[C@H](O)CO 527a_100020644852_100011218752 [0,2,0,0,0,0|2,0,0]=4 4734 B17R1.9061 CNC(C)COC(=O)c1ccccc1[N+](=O)[O-] 270004a_106832991635_200000000681 [0,2,0,0,0,0|1,0,1]=4 4735 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1C(C)C 11a_100020591295_100011941426 [0,2,0,0,0,0|2,0,0]=4 4736 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1C(C)C 1626a_100020591295_100011941426 [0,2,0,0,0,0|2,0,0]=4 4737 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1C(C)C 240690a_100020591295_100011941426 [0,2,0,0,0,0|2,0,0]=4 4738 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1C(C)C 527a_100020591295_100011941426 [0,2,0,0,0,0|2,0,0]=4 4739 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1N(C)C 11a_100020591295_100011218752 [0,2,0,0,0,0|1,0,0]=3 4740 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1N(C)C 1626a_100020591295_100011218752 [0,2,0,0,0,0|1,0,0]=3 4741 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1N(C)C 240690a_100020591295_100011218752 [0,2,0,0,0,0|1,0,0]=3 4742 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1N(C)C 527a_100020591295_100011218752 [0,2,0,0,0,0|1,0,0]=3 4743 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1S(=O)C 1626a_100020591295_100000204632 [0,2,0,0,0,0|2,0,0]=4 4744 B17R1.9061 CO[C@H](C)CNC(=O)c1ccccc1S(=O)C 240690a_100020591295_100000204632 [0,2,0,0,0,0|2,0,0]=4 4745 B17R1.14644 CC(C)CCC(=O)c1ccc(cc1N(C)C)Br 1458a_200000744963_100000210312 [0,2,0,0,0,0|1,0,0]=3 4746 B17R1.14644 CC(C)CNC(=O)c1ccc(cc1N(C)C)Br 11a_100000210953_200000744963 [0,2,0,0,0,0|1,0,0]=3 4747 B17R1.14644 CC(C)CNC(=O)c1ccc(cc1N(C)C)Br 1626a_100000210953_200000744963 [0,2,0,0,0,0|1,0,0]=3 4748 B17R1.14644 CC(C)CNC(=O)c1ccc(cc1N(C)C)Br 240690a_100000210953_200000744963 [0,2,0,0,0,0|1,0,0]=3 4749 B17R1.14644 CC(C)NNC(=O)c1ccc(cc1N(C)C)Br 22a_100000741168_200000744963 [0,2,0,0,0,0|2,0,0]=4 4750 B17R1.14644 CC(O)CCC(=O)c1ccc(cc1N(C)C)Br 1458a_200000744963_100012276601 [0,2,0,0,0,0|2,0,0]=4 4751 B17R1.14644 CC(O)CNC(=O)c1ccc(cc1N(C)C)Br 11a_100000210904_200000744963 [0,2,0,0,0,0|2,0,0]=4 4752 B17R1.14644 CC(O)CNC(=O)c1ccc(cc1N(C)C)Br 240690a_100000210904_200000744963 [0,2,0,0,0,0|2,0,0]=4 4753 B17R1.16327 CC(C)CC(C)C(=O)c1ccccc1C(C)C 1458a_100011941426_100000731052 [0,2,0,0,0,0|2,0,0]=4 4754 B17R1.16327 CC(C)CC(C)C(=O)c1ccccc1N(C)C 1458a_100011218752_100000731052 [0,2,0,0,0,0|1,0,0]=3 4755 B17R1.16327 CC(C)CC(C)C(=O)c1ccccc1S(=O)C 1458a_100000204632_100000731052 [0,2,0,0,0,0|2,0,0]=4 4756 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1C(C)C 11a_100000747067_100011941426 [0,2,0,0,0,0|2,0,0]=4 4757 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1C(C)C 1626a_100000747067_100011941426 [0,2,0,0,0,0|2,0,0]=4 4758 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1C(C)C 240690a_100000747067_100011941426 [0,2,0,0,0,0|2,0,0]=4 4759 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1C(C)C 527a_100000747067_100011941426 [0,2,0,0,0,0|2,0,0]=4 4760 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1N(C)C 11a_100000747067_100011218752 [0,2,0,0,0,0|1,0,0]=3 4761 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1N(C)C 1626a_100000747067_100011218752 [0,2,0,0,0,0|1,0,0]=3 4762 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1N(C)C 240690a_100000747067_100011218752 [0,2,0,0,0,0|1,0,0]=3 4763 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1N(C)C 527a_100000747067_100011218752 [0,2,0,0,0,0|1,0,0]=3 4764 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1S(=O)C 1626a_100000747067_100000204632 [0,2,0,0,0,0|2,0,0]=4 4765 B17R1.16327 CC(C)CN(C)C(=O)c1ccccc1S(=O)C 240690a_100000747067_100000204632 [0,2,0,0,0,0|2,0,0]=4 4766 B17R1.16327 CC(O)CN(C)C(=O)c1ccccc1N(C)C 240690a_100000227577_100011218752 [0,2,0,0,0,0|2,0,0]=4 4767 B17R1.16327 CC(O)CN(C)C(=O)c1ccccc1N(C)C 527a_100000227577_100011218752 [0,2,0,0,0,0|2,0,0]=4 4768 B17R1.16535 CC(C)C(=O)CC(=O)c1ccccc1N(C)C 1458a_100011218752_100000753385 [0,2,0,0,0,0|1,0,1]=4 4769 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1N(C)C 11a_100000211541_100011218752 [0,2,0,0,0,0|1,0,0]=3 4770 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1N(C)C 1626a_100000211541_100011218752 [0,2,0,0,0,0|1,0,0]=3 4771 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1N(C)C 240690a_100000211541_100011218752 [0,2,0,0,0,0|1,0,0]=3 4772 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1N(C)C 527a_100000211541_100011218752 [0,2,0,0,0,0|1,0,0]=3 4773 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1S(=O)C 1626a_100000211541_100000204632 [0,2,0,0,0,0|2,0,0]=4 4774 B17R1.16535 CC(C)C(C)NC(=O)c1ccccc1S(=O)C 240690a_100000211541_100000204632 [0,2,0,0,0,0|2,0,0]=4 4775 B17R1.16535 CC(C)c1ccccc1C(=O)NC(C)C(C)C 11a_100000211541_100011941426 [0,2,0,0,0,0|2,0,0]=4 4776 B17R1.16535 CC(C)c1ccccc1C(=O)NC(C)C(C)C 1626a_100000211541_100011941426 [0,2,0,0,0,0|2,0,0]=4 4777 B17R1.16535 CC(C)c1ccccc1C(=O)NC(C)C(C)C 240690a_100000211541_100011941426 [0,2,0,0,0,0|2,0,0]=4 4778 B17R1.16535 CC(C)c1ccccc1C(=O)NC(C)C(C)C 527a_100000211541_100011941426 [0,2,0,0,0,0|2,0,0]=4 4779 B17R1.16550 CC(C)c1ccccc1C(=O)CCC(C)(C)C 1458a_100011941426_100000755188 [0,2,0,0,0,0|2,0,0]=4 4780 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100011941426 [0,2,0,0,0,0|2,0,0]=4 4781 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100011941426 [0,2,0,0,0,0|2,0,0]=4 4782 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100011941426 [0,2,0,0,0,0|2,0,0]=4 4783 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100011941426 [0,2,0,0,0,0|2,0,0]=4 4784 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100011941426 [0,2,0,0,0,0|2,0,0]=4 4785 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100011941426 [0,2,0,0,0,0|2,0,0]=4 4786 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100011941426 [0,2,0,0,0,0|2,0,0]=4 4787 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100011941426 [0,2,0,0,0,0|2,0,0]=4 4788 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100011941426 [0,2,0,0,0,0|2,0,0]=4 4789 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100011941426 [0,2,0,0,0,0|2,0,0]=4 4790 B17R1.16550 CC(C)c1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100011941426 [0,2,0,0,0,0|2,0,0]=4 4791 B17R1.16550 CN(C)c1ccccc1C(=O)CCC(C)(C)C 1458a_100011218752_100000755188 [0,2,0,0,0,0|1,0,0]=3 4792 B17R1.16550 CN(C)c1ccccc1C(=O)CC[N+](C)(C)C 1458a_100011218752_100000085578 [0,2,0,0,0,0|2,0,0]=4 4793 B17R1.16550 CN(C)c1ccccc1C(=O)CC[Si](C)(C)C 1458a_100011218752_200000733723 [0,2,0,0,0,0|1,1,0]=4 4794 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)C 11a_100000743828_100011218752 [0,2,0,0,0,0|1,0,0]=3 4795 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100011218752 [0,2,0,0,0,0|1,0,0]=3 4796 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100011218752 [0,2,0,0,0,0|1,0,0]=3 4797 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)C 527a_100000743828_100011218752 [0,2,0,0,0,0|1,0,0]=3 4798 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)F 11a_100020643315_100011218752 [0,2,0,0,0,0|1,0,0]=3 4799 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100011218752 [0,2,0,0,0,0|1,0,0]=3 4800 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100011218752 [0,2,0,0,0,0|1,0,0]=3 4801 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)F 527a_100020643315_100011218752 [0,2,0,0,0,0|1,0,0]=3 4802 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100011218752 [0,2,0,0,0,0|1,0,0]=3 4803 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100011218752 [0,2,0,0,0,0|1,0,0]=3 4804 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(C)O 527a_100000751335_100011218752 [0,2,0,0,0,0|1,0,0]=3 4805 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(F)F 11a_100000731000_100011218752 [0,2,0,0,0,0|2,0,0]=4 4806 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(F)F 1626a_100000731000_100011218752 [0,2,0,0,0,0|2,0,0]=4 4807 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(F)F 240690a_100000731000_100011218752 [0,2,0,0,0,0|2,0,0]=4 4808 B17R1.16550 CN(C)c1ccccc1C(=O)NCC(C)(F)F 527a_100000731000_100011218752 [0,2,0,0,0,0|2,0,0]=4 4809 B17R1.16550 CN(C)c1ccccc1C(=O)NC[Si](C)(C)C 11a_102516607284_100011218752 [0,2,0,0,0,0|1,1,0]=4 4810 B17R1.16550 CN(C)c1ccccc1C(=O)NC[Si](C)(C)C 1626a_102516607284_100011218752 [0,2,0,0,0,0|1,1,0]=4 4811 B17R1.16550 CN(C)c1ccccc1C(=O)NC[Si](C)(C)C 240690a_102516607284_100011218752 [0,2,0,0,0,0|1,1,0]=4 4812 B17R1.16550 CN(C)c1ccccc1C(=O)NC[Si](C)(C)C 527a_102516607284_100011218752 [0,2,0,0,0,0|1,1,0]=4 4813 B17R1.16550 CN(C)c1ccccc1C(=O)NNC(C)(C)C 22a_100000725372_100011218752 [0,2,0,0,0,0|2,0,0]=4 4814 B17R1.16550 CS(=O)c1ccccc1C(=O)CCC(C)(C)C 1458a_100000204632_100000755188 [0,2,0,0,0,0|2,0,0]=4 4815 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)C 1626a_100000743828_100000204632 [0,2,0,0,0,0|2,0,0]=4 4816 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)C 240690a_100000743828_100000204632 [0,2,0,0,0,0|2,0,0]=4 4817 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)F 1626a_100020643315_100000204632 [0,2,0,0,0,0|2,0,0]=4 4818 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)F 240690a_100020643315_100000204632 [0,2,0,0,0,0|2,0,0]=4 4819 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)O 1626a_100000751335_100000204632 [0,2,0,0,0,0|2,0,0]=4 4820 B17R1.16550 CS(=O)c1ccccc1C(=O)NCC(C)(C)O 240690a_100000751335_100000204632 [0,2,0,0,0,0|2,0,0]=4 4821 B17R1.571 COc1cc(cc(c1C(=O)CCC(C)C)C)C 1458a_200012180181_100000210312 [0,2,0,0,0,0|2,0,0]=4 4822 B17R1.571 COc1cc(cc(c1C(=O)CCC(C)C)F)Br 1458a_100010734140_100000210312 [0,2,0,0,0,0|2,0,0]=4 4823 B17R1.571 COc1cc(cc(c1C(=O)CCC(C)C)F)C 1458a_200010768512_100000210312 [0,2,0,0,0,0|2,0,0]=4 4824 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)C)C 11a_100000210953_200012180181 [0,2,0,0,0,0|2,0,0]=4 4825 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)C)C 1626a_100000210953_200012180181 [0,2,0,0,0,0|2,0,0]=4 4826 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)C)C 240690a_100000210953_200012180181 [0,2,0,0,0,0|2,0,0]=4 4827 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)Br 11a_100000210953_100010734140 [0,2,0,0,0,0|2,0,0]=4 4828 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)Br 240690a_100000210953_100010734140 [0,2,0,0,0,0|2,0,0]=4 4829 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)Br 527a_100000210953_100010734140 [0,2,0,0,0,0|2,0,0]=4 4830 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)C 11a_100000210953_200010768512 [0,2,0,0,0,0|2,0,0]=4 4831 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)C 1626a_100000210953_200010768512 [0,2,0,0,0,0|2,0,0]=4 4832 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)C 240690a_100000210953_200010768512 [0,2,0,0,0,0|2,0,0]=4 4833 B17R1.571 COc1cc(cc(c1C(=O)NCC(C)C)F)C 527a_100000210953_200010768512 [0,2,0,0,0,0|2,0,0]=4 4834 B17R1.5321 CCc1cc(ccc1C(=O)NC(C)C(C)C)Br 11a_100000211541_200012349896 [0,2,0,0,0,0|2,0,0]=4 4835 B17R1.5321 CCc1cc(ccc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_200012349896 [0,2,0,0,0,0|2,0,0]=4 4836 B17R1.5321 CCc1cc(ccc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_200012349896 [0,2,0,0,0,0|2,0,0]=4 4837 B17R1.5321 CCc1cc(ccc1C(=O)NC(C)C(C)C)Br 527a_100000211541_200012349896 [0,2,0,0,0,0|2,0,0]=4 4838 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Br 11a_100000211541_100000748230 [0,2,0,0,0,0|2,0,0]=4 4839 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100000748230 [0,2,0,0,0,0|2,0,0]=4 4840 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100000748230 [0,2,0,0,0,0|2,0,0]=4 4841 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Br 527a_100000211541_100000748230 [0,2,0,0,0,0|2,0,0]=4 4842 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)C 11a_100000211541_100000217210 [0,2,0,0,0,0|2,0,0]=4 4843 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)C 1626a_100000211541_100000217210 [0,2,0,0,0,0|2,0,0]=4 4844 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)C 240690a_100000211541_100000217210 [0,2,0,0,0,0|2,0,0]=4 4845 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)C 527a_100000211541_100000217210 [0,2,0,0,0,0|2,0,0]=4 4846 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Cl 11a_100000211541_100000217211 [0,2,0,0,0,0|2,0,0]=4 4847 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Cl 1626a_100000211541_100000217211 [0,2,0,0,0,0|2,0,0]=4 4848 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Cl 240690a_100000211541_100000217211 [0,2,0,0,0,0|2,0,0]=4 4849 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)Cl 527a_100000211541_100000217211 [0,2,0,0,0,0|2,0,0]=4 4850 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)F 11a_100000211541_100000239970 [0,2,0,0,0,0|2,0,0]=4 4851 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)F 1626a_100000211541_100000239970 [0,2,0,0,0,0|2,0,0]=4 4852 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)F 240690a_100000211541_100000239970 [0,2,0,0,0,0|2,0,0]=4 4853 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)F 527a_100000211541_100000239970 [0,2,0,0,0,0|2,0,0]=4 4854 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)I 11a_100000211541_100012353712 [0,2,0,0,0,0|2,0,0]=4 4855 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)I 1626a_100000211541_100012353712 [0,2,0,0,0,0|2,0,0]=4 4856 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)I 240690a_100000211541_100012353712 [0,2,0,0,0,0|2,0,0]=4 4857 B17R1.5321 COc1cc(ccc1C(=O)NC(C)C(C)C)I 527a_100000211541_100012353712 [0,2,0,0,0,0|2,0,0]=4 4858 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Br 11a_100020588543_100000748230 [0,2,0,0,0,0|2,0,0]=4 4859 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Br 1626a_100020588543_100000748230 [0,2,0,0,0,0|2,0,0]=4 4860 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Br 240690a_100020588543_100000748230 [0,2,0,0,0,0|2,0,0]=4 4861 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Br 527a_100020588543_100000748230 [0,2,0,0,0,0|2,0,0]=4 4862 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)C 11a_100020588543_100000217210 [0,2,0,0,0,0|2,0,0]=4 4863 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)C 1626a_100020588543_100000217210 [0,2,0,0,0,0|2,0,0]=4 4864 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)C 240690a_100020588543_100000217210 [0,2,0,0,0,0|2,0,0]=4 4865 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)C 527a_100020588543_100000217210 [0,2,0,0,0,0|2,0,0]=4 4866 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Cl 11a_100020588543_100000217211 [0,2,0,0,0,0|2,0,0]=4 4867 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Cl 1626a_100020588543_100000217211 [0,2,0,0,0,0|2,0,0]=4 4868 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Cl 240690a_100020588543_100000217211 [0,2,0,0,0,0|2,0,0]=4 4869 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)Cl 527a_100020588543_100000217211 [0,2,0,0,0,0|2,0,0]=4 4870 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)F 11a_100020588543_100000239970 [0,2,0,0,0,0|2,0,0]=4 4871 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)F 1626a_100020588543_100000239970 [0,2,0,0,0,0|2,0,0]=4 4872 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)F 240690a_100020588543_100000239970 [0,2,0,0,0,0|2,0,0]=4 4873 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)F 527a_100020588543_100000239970 [0,2,0,0,0,0|2,0,0]=4 4874 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)I 11a_100020588543_100012353712 [0,2,0,0,0,0|2,0,0]=4 4875 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)I 1626a_100020588543_100012353712 [0,2,0,0,0,0|2,0,0]=4 4876 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)I 240690a_100020588543_100012353712 [0,2,0,0,0,0|2,0,0]=4 4877 B17R1.5335 CCC(C)CNC(=O)c1ccc(cc1OC)I 527a_100020588543_100012353712 [0,2,0,0,0,0|2,0,0]=4 4878 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CC)Br 11a_100020588543_200012349896 [0,2,0,0,0,0|2,0,0]=4 4879 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CC)Br 1626a_100020588543_200012349896 [0,2,0,0,0,0|2,0,0]=4 4880 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CC)Br 240690a_100020588543_200012349896 [0,2,0,0,0,0|2,0,0]=4 4881 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CC)Br 527a_100020588543_200012349896 [0,2,0,0,0,0|2,0,0]=4 4882 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CO)Br 240690a_100000744482_200012349896 [0,2,0,0,0,0|2,0,0]=4 4883 B17R1.5335 CCc1cc(ccc1C(=O)NCC(C)CO)Br 527a_100000744482_200012349896 [0,2,0,0,0,0|2,0,0]=4 4884 B17R1.5335 CCc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_200012349896 [0,2,0,0,0,0|2,0,0]=4 4885 B17R1.5335 CCc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_200012349896 [0,2,0,0,0,0|2,0,0]=4 4886 B17R1.5335 CCc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_200012349896 [0,2,0,0,0,0|2,0,0]=4 4887 B17R1.5335 CCc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_200012349896 [0,2,0,0,0,0|2,0,0]=4 4888 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)Br 240690a_100000744482_100000748230 [0,2,0,0,0,0|2,0,0]=4 4889 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)Br 527a_100000744482_100000748230 [0,2,0,0,0,0|2,0,0]=4 4890 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)C 240690a_100000744482_100000217210 [0,2,0,0,0,0|2,0,0]=4 4891 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)C 527a_100000744482_100000217210 [0,2,0,0,0,0|2,0,0]=4 4892 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)Cl 240690a_100000744482_100000217211 [0,2,0,0,0,0|2,0,0]=4 4893 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)Cl 527a_100000744482_100000217211 [0,2,0,0,0,0|2,0,0]=4 4894 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)F 240690a_100000744482_100000239970 [0,2,0,0,0,0|2,0,0]=4 4895 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)F 527a_100000744482_100000239970 [0,2,0,0,0,0|2,0,0]=4 4896 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)I 240690a_100000744482_100012353712 [0,2,0,0,0,0|2,0,0]=4 4897 B17R1.5335 COc1cc(ccc1C(=O)NCC(C)CO)I 527a_100000744482_100012353712 [0,2,0,0,0,0|2,0,0]=4 4898 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100000748230 [0,2,0,0,0,0|2,0,0]=4 4899 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100000748230 [0,2,0,0,0,0|2,0,0]=4 4900 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100000748230 [0,2,0,0,0,0|2,0,0]=4 4901 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100000748230 [0,2,0,0,0,0|2,0,0]=4 4902 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)C 11a_100020591295_100000217210 [0,2,0,0,0,0|2,0,0]=4 4903 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)C 1626a_100020591295_100000217210 [0,2,0,0,0,0|2,0,0]=4 4904 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)C 240690a_100020591295_100000217210 [0,2,0,0,0,0|2,0,0]=4 4905 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)C 527a_100020591295_100000217210 [0,2,0,0,0,0|2,0,0]=4 4906 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Cl 11a_100020591295_100000217211 [0,2,0,0,0,0|2,0,0]=4 4907 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Cl 1626a_100020591295_100000217211 [0,2,0,0,0,0|2,0,0]=4 4908 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Cl 240690a_100020591295_100000217211 [0,2,0,0,0,0|2,0,0]=4 4909 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)Cl 527a_100020591295_100000217211 [0,2,0,0,0,0|2,0,0]=4 4910 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)F 11a_100020591295_100000239970 [0,2,0,0,0,0|2,0,0]=4 4911 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)F 1626a_100020591295_100000239970 [0,2,0,0,0,0|2,0,0]=4 4912 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)F 240690a_100020591295_100000239970 [0,2,0,0,0,0|2,0,0]=4 4913 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)F 527a_100020591295_100000239970 [0,2,0,0,0,0|2,0,0]=4 4914 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)I 11a_100020591295_100012353712 [0,2,0,0,0,0|2,0,0]=4 4915 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)I 1626a_100020591295_100012353712 [0,2,0,0,0,0|2,0,0]=4 4916 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)I 240690a_100020591295_100012353712 [0,2,0,0,0,0|2,0,0]=4 4917 B17R1.5335 COc1cc(ccc1C(=O)NC[C@@H](C)OC)I 527a_100020591295_100012353712 [0,2,0,0,0,0|2,0,0]=4 4918 B17R1.5346 CCc1cc(ccc1C(=O)C(C)CC(C)C)Br 1458a_200012349896_100000731052 [0,2,0,0,0,0|2,0,0]=4 4919 B17R1.5346 CCc1cc(ccc1C(=O)N(C)CC(C)C)Br 11a_100000747067_200012349896 [0,2,0,0,0,0|2,0,0]=4 4920 B17R1.5346 CCc1cc(ccc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_200012349896 [0,2,0,0,0,0|2,0,0]=4 4921 B17R1.5346 CCc1cc(ccc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_200012349896 [0,2,0,0,0,0|2,0,0]=4 4922 B17R1.5346 CCc1cc(ccc1C(=O)N(C)CC(C)C)Br 527a_100000747067_200012349896 [0,2,0,0,0,0|2,0,0]=4 4923 B17R1.5346 COc1cc(ccc1C(=O)C(C)CC(C)C)Br 1458a_100000748230_100000731052 [0,2,0,0,0,0|2,0,0]=4 4924 B17R1.5346 COc1cc(ccc1C(=O)C(C)CC(C)C)C 1458a_100000217210_100000731052 [0,2,0,0,0,0|2,0,0]=4 4925 B17R1.5346 COc1cc(ccc1C(=O)C(C)CC(C)C)Cl 1458a_100000217211_100000731052 [0,2,0,0,0,0|2,0,0]=4 4926 B17R1.5346 COc1cc(ccc1C(=O)C(C)CC(C)C)F 1458a_100000239970_100000731052 [0,2,0,0,0,0|2,0,0]=4 4927 B17R1.5346 COc1cc(ccc1C(=O)C(C)CC(C)C)I 1458a_100012353712_100000731052 [0,2,0,0,0,0|2,0,0]=4 4928 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Br 11a_100000747067_100000748230 [0,2,0,0,0,0|2,0,0]=4 4929 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100000748230 [0,2,0,0,0,0|2,0,0]=4 4930 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100000748230 [0,2,0,0,0,0|2,0,0]=4 4931 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Br 527a_100000747067_100000748230 [0,2,0,0,0,0|2,0,0]=4 4932 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)C 11a_100000747067_100000217210 [0,2,0,0,0,0|2,0,0]=4 4933 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)C 1626a_100000747067_100000217210 [0,2,0,0,0,0|2,0,0]=4 4934 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)C 240690a_100000747067_100000217210 [0,2,0,0,0,0|2,0,0]=4 4935 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)C 527a_100000747067_100000217210 [0,2,0,0,0,0|2,0,0]=4 4936 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Cl 11a_100000747067_100000217211 [0,2,0,0,0,0|2,0,0]=4 4937 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Cl 1626a_100000747067_100000217211 [0,2,0,0,0,0|2,0,0]=4 4938 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Cl 240690a_100000747067_100000217211 [0,2,0,0,0,0|2,0,0]=4 4939 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)Cl 527a_100000747067_100000217211 [0,2,0,0,0,0|2,0,0]=4 4940 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)F 11a_100000747067_100000239970 [0,2,0,0,0,0|2,0,0]=4 4941 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)F 1626a_100000747067_100000239970 [0,2,0,0,0,0|2,0,0]=4 4942 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)F 240690a_100000747067_100000239970 [0,2,0,0,0,0|2,0,0]=4 4943 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)F 527a_100000747067_100000239970 [0,2,0,0,0,0|2,0,0]=4 4944 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)I 11a_100000747067_100012353712 [0,2,0,0,0,0|2,0,0]=4 4945 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)I 1626a_100000747067_100012353712 [0,2,0,0,0,0|2,0,0]=4 4946 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)I 240690a_100000747067_100012353712 [0,2,0,0,0,0|2,0,0]=4 4947 B17R1.5346 COc1cc(ccc1C(=O)N(C)CC(C)C)I 527a_100000747067_100012353712 [0,2,0,0,0,0|2,0,0]=4 4948 B17R1.5379 CCc1cc(ccc1C(=O)CCC(C)(C)C)Br 1458a_200012349896_100000755188 [0,2,0,0,0,0|2,0,0]=4 4949 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)C)Br 11a_100000743828_200012349896 [0,2,0,0,0,0|2,0,0]=4 4950 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_200012349896 [0,2,0,0,0,0|2,0,0]=4 4951 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_200012349896 [0,2,0,0,0,0|2,0,0]=4 4952 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)C)Br 527a_100000743828_200012349896 [0,2,0,0,0,0|2,0,0]=4 4953 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)F)Br 11a_100020643315_200012349896 [0,2,0,0,0,0|2,0,0]=4 4954 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_200012349896 [0,2,0,0,0,0|2,0,0]=4 4955 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_200012349896 [0,2,0,0,0,0|2,0,0]=4 4956 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)F)Br 527a_100020643315_200012349896 [0,2,0,0,0,0|2,0,0]=4 4957 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_200012349896 [0,2,0,0,0,0|2,0,0]=4 4958 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_200012349896 [0,2,0,0,0,0|2,0,0]=4 4959 B17R1.5379 CCc1cc(ccc1C(=O)NCC(C)(C)O)Br 527a_100000751335_200012349896 [0,2,0,0,0,0|2,0,0]=4 4960 B17R1.5379 COc1cc(ccc1C(=O)CCC(C)(C)C)Br 1458a_100000748230_100000755188 [0,2,0,0,0,0|2,0,0]=4 4961 B17R1.5379 COc1cc(ccc1C(=O)CCC(C)(C)C)C 1458a_100000217210_100000755188 [0,2,0,0,0,0|2,0,0]=4 4962 B17R1.5379 COc1cc(ccc1C(=O)CCC(C)(C)C)Cl 1458a_100000217211_100000755188 [0,2,0,0,0,0|2,0,0]=4 4963 B17R1.5379 COc1cc(ccc1C(=O)CCC(C)(C)C)F 1458a_100000239970_100000755188 [0,2,0,0,0,0|2,0,0]=4 4964 B17R1.5379 COc1cc(ccc1C(=O)CCC(C)(C)C)I 1458a_100012353712_100000755188 [0,2,0,0,0,0|2,0,0]=4 4965 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Br 11a_100000743828_100000748230 [0,2,0,0,0,0|2,0,0]=4 4966 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100000748230 [0,2,0,0,0,0|2,0,0]=4 4967 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100000748230 [0,2,0,0,0,0|2,0,0]=4 4968 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Br 527a_100000743828_100000748230 [0,2,0,0,0,0|2,0,0]=4 4969 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)C 11a_100000743828_100000217210 [0,2,0,0,0,0|2,0,0]=4 4970 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)C 1626a_100000743828_100000217210 [0,2,0,0,0,0|2,0,0]=4 4971 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)C 240690a_100000743828_100000217210 [0,2,0,0,0,0|2,0,0]=4 4972 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)C 527a_100000743828_100000217210 [0,2,0,0,0,0|2,0,0]=4 4973 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Cl 11a_100000743828_100000217211 [0,2,0,0,0,0|2,0,0]=4 4974 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Cl 1626a_100000743828_100000217211 [0,2,0,0,0,0|2,0,0]=4 4975 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Cl 240690a_100000743828_100000217211 [0,2,0,0,0,0|2,0,0]=4 4976 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)Cl 527a_100000743828_100000217211 [0,2,0,0,0,0|2,0,0]=4 4977 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)F 11a_100000743828_100000239970 [0,2,0,0,0,0|2,0,0]=4 4978 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)F 1626a_100000743828_100000239970 [0,2,0,0,0,0|2,0,0]=4 4979 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)F 240690a_100000743828_100000239970 [0,2,0,0,0,0|2,0,0]=4 4980 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)F 527a_100000743828_100000239970 [0,2,0,0,0,0|2,0,0]=4 4981 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)I 11a_100000743828_100012353712 [0,2,0,0,0,0|2,0,0]=4 4982 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)I 1626a_100000743828_100012353712 [0,2,0,0,0,0|2,0,0]=4 4983 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)I 240690a_100000743828_100012353712 [0,2,0,0,0,0|2,0,0]=4 4984 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)C)I 527a_100000743828_100012353712 [0,2,0,0,0,0|2,0,0]=4 4985 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Br 11a_100020643315_100000748230 [0,2,0,0,0,0|2,0,0]=4 4986 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100000748230 [0,2,0,0,0,0|2,0,0]=4 4987 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100000748230 [0,2,0,0,0,0|2,0,0]=4 4988 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Br 527a_100020643315_100000748230 [0,2,0,0,0,0|2,0,0]=4 4989 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)C 11a_100020643315_100000217210 [0,2,0,0,0,0|2,0,0]=4 4990 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)C 1626a_100020643315_100000217210 [0,2,0,0,0,0|2,0,0]=4 4991 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)C 240690a_100020643315_100000217210 [0,2,0,0,0,0|2,0,0]=4 4992 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)C 527a_100020643315_100000217210 [0,2,0,0,0,0|2,0,0]=4 4993 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Cl 11a_100020643315_100000217211 [0,2,0,0,0,0|2,0,0]=4 4994 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Cl 1626a_100020643315_100000217211 [0,2,0,0,0,0|2,0,0]=4 4995 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Cl 240690a_100020643315_100000217211 [0,2,0,0,0,0|2,0,0]=4 4996 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)Cl 527a_100020643315_100000217211 [0,2,0,0,0,0|2,0,0]=4 4997 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)F 11a_100020643315_100000239970 [0,2,0,0,0,0|2,0,0]=4 4998 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)F 1626a_100020643315_100000239970 [0,2,0,0,0,0|2,0,0]=4 4999 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)F 240690a_100020643315_100000239970 [0,2,0,0,0,0|2,0,0]=4 5000 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)F 527a_100020643315_100000239970 [0,2,0,0,0,0|2,0,0]=4 5001 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)I 11a_100020643315_100012353712 [0,2,0,0,0,0|2,0,0]=4 5002 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)I 1626a_100020643315_100012353712 [0,2,0,0,0,0|2,0,0]=4 5003 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)I 240690a_100020643315_100012353712 [0,2,0,0,0,0|2,0,0]=4 5004 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)F)I 527a_100020643315_100012353712 [0,2,0,0,0,0|2,0,0]=4 5005 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100000748230 [0,2,0,0,0,0|2,0,0]=4 5006 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100000748230 [0,2,0,0,0,0|2,0,0]=4 5007 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Br 527a_100000751335_100000748230 [0,2,0,0,0,0|2,0,0]=4 5008 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)C 1626a_100000751335_100000217210 [0,2,0,0,0,0|2,0,0]=4 5009 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)C 240690a_100000751335_100000217210 [0,2,0,0,0,0|2,0,0]=4 5010 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)C 527a_100000751335_100000217210 [0,2,0,0,0,0|2,0,0]=4 5011 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Cl 1626a_100000751335_100000217211 [0,2,0,0,0,0|2,0,0]=4 5012 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Cl 240690a_100000751335_100000217211 [0,2,0,0,0,0|2,0,0]=4 5013 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)Cl 527a_100000751335_100000217211 [0,2,0,0,0,0|2,0,0]=4 5014 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)F 1626a_100000751335_100000239970 [0,2,0,0,0,0|2,0,0]=4 5015 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)F 240690a_100000751335_100000239970 [0,2,0,0,0,0|2,0,0]=4 5016 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)F 527a_100000751335_100000239970 [0,2,0,0,0,0|2,0,0]=4 5017 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)I 1626a_100000751335_100012353712 [0,2,0,0,0,0|2,0,0]=4 5018 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)I 240690a_100000751335_100012353712 [0,2,0,0,0,0|2,0,0]=4 5019 B17R1.5379 COc1cc(ccc1C(=O)NCC(C)(C)O)I 527a_100000751335_100012353712 [0,2,0,0,0,0|2,0,0]=4 5020 B17R1.28977 COc1cc(ccc1C(=O)CCC(C)C)C#N 1458a_100012002740_100000210312 [0,2,0,0,0,0|2,0,0]=4 5021 B17R1.28977 COc1cc(ccc1C(=O)CCC(C)C)SC 1458a_100000211074_100000210312 [0,2,0,0,0,0|2,0,0]=4 5022 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)C#N 11a_100000210953_100012002740 [0,2,0,0,0,0|2,0,0]=4 5023 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)C#N 1626a_100000210953_100012002740 [0,2,0,0,0,0|2,0,0]=4 5024 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)C#N 240690a_100000210953_100012002740 [0,2,0,0,0,0|2,0,0]=4 5025 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)C#N 527a_100000210953_100012002740 [0,2,0,0,0,0|2,0,0]=4 5026 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)SC 11a_100000210953_100000211074 [0,2,0,0,0,0|2,0,0]=4 5027 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)SC 1626a_100000210953_100000211074 [0,2,0,0,0,0|2,0,0]=4 5028 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)SC 240690a_100000210953_100000211074 [0,2,0,0,0,0|2,0,0]=4 5029 B17R1.28977 COc1cc(ccc1C(=O)NCC(C)C)SC 527a_100000210953_100000211074 [0,2,0,0,0,0|2,0,0]=4 5030 B17R1.28977 COc1ccc(c(c1)OC)C(=O)CCC(C)C 1458a_100000210807_100000210312 [0,2,0,0,0,0|2,0,0]=4 5031 B17R1.28977 COc1ccc(c(c1)OC)C(=O)NCC(C)C 11a_100000210953_100000210807 [0,2,0,0,0,0|2,0,0]=4 5032 B17R1.28977 COc1ccc(c(c1)OC)C(=O)NCC(C)C 1626a_100000210953_100000210807 [0,2,0,0,0,0|2,0,0]=4 5033 B17R1.28977 COc1ccc(c(c1)OC)C(=O)NCC(C)C 240690a_100000210953_100000210807 [0,2,0,0,0,0|2,0,0]=4 5034 B17R1.28977 COc1ccc(c(c1)OC)C(=O)NCC(C)C 527a_100000210953_100000210807 [0,2,0,0,0,0|2,0,0]=4 5035 B17R1.58585 COc1c(ccc(c1Cl)Cl)C(=O)CCC(C)C 1458a_100010981877_100000210312 [0,2,0,0,0,0|2,0,0]=4 5036 B17R1.58585 COc1c(ccc(c1Cl)Cl)C(=O)NCC(C)C 11a_100000210953_100010981877 [0,2,0,0,0,0|2,0,0]=4 5037 B17R1.58585 COc1c(ccc(c1Cl)Cl)C(=O)NCC(C)C 1626a_100000210953_100010981877 [0,2,0,0,0,0|2,0,0]=4 5038 B17R1.58585 COc1c(ccc(c1Cl)Cl)C(=O)NCC(C)C 240690a_100000210953_100010981877 [0,2,0,0,0,0|2,0,0]=4 5039 B17R1.58585 COc1c(ccc(c1Cl)Cl)C(=O)NCC(C)C 527a_100000210953_100010981877 [0,2,0,0,0,0|2,0,0]=4 5040 B17R1.58585 COc1c(ccc(c1F)F)C(=O)CCC(C)C 1458a_100000061878_100000210312 [0,2,0,0,0,0|2,0,0]=4 5041 B17R1.58585 COc1c(ccc(c1F)F)C(=O)NCC(C)C 11a_100000210953_100000061878 [0,2,0,0,0,0|2,0,0]=4 5042 B17R1.58585 COc1c(ccc(c1F)F)C(=O)NCC(C)C 1626a_100000210953_100000061878 [0,2,0,0,0,0|2,0,0]=4 5043 B17R1.58585 COc1c(ccc(c1F)F)C(=O)NCC(C)C 240690a_100000210953_100000061878 [0,2,0,0,0,0|2,0,0]=4 5044 B17R1.58585 COc1c(ccc(c1F)F)C(=O)NCC(C)C 527a_100000210953_100000061878 [0,2,0,0,0,0|2,0,0]=4 5045 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1OC 11a_100000738554_100000185835 [0,2,0,0,0,0|2,0,0]=4 5046 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1OC 1626a_100000738554_100000185835 [0,2,0,0,0,0|2,0,0]=4 5047 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1OC 240690a_100000738554_100000185835 [0,2,0,0,0,0|2,0,0]=4 5048 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1OC 527a_100000738554_100000185835 [0,2,0,0,0,0|2,0,0]=4 5049 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1SC 11a_100000738554_100000183967 [0,2,0,0,0,0|2,0,0]=4 5050 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1SC 1626a_100000738554_100000183967 [0,2,0,0,0,0|2,0,0]=4 5051 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1SC 240690a_100000738554_100000183967 [0,2,0,0,0,0|2,0,0]=4 5052 B17R1.6519 CCN(CC(C)C)C(=O)c1ccccc1SC 527a_100000738554_100000183967 [0,2,0,0,0,0|2,0,0]=4 5053 B17R1.6519 CCc1ccccc1C(=O)N(CC)CC(C)C 11a_100000738554_100000689120 [0,2,0,0,0,0|2,0,0]=4 5054 B17R1.6519 CCc1ccccc1C(=O)N(CC)CC(C)C 1626a_100000738554_100000689120 [0,2,0,0,0,0|2,0,0]=4 5055 B17R1.6519 CCc1ccccc1C(=O)N(CC)CC(C)C 240690a_100000738554_100000689120 [0,2,0,0,0,0|2,0,0]=4 5056 B17R1.6519 CCc1ccccc1C(=O)N(CC)CC(C)C 527a_100000738554_100000689120 [0,2,0,0,0,0|2,0,0]=4 5057 B17R1.6521 CCc1ccccc1C(=O)N(C)C(C)C(C)C 11a_100000228512_100000689120 [0,2,0,0,0,0|2,0,0]=4 5058 B17R1.6521 CCc1ccccc1C(=O)N(C)C(C)C(C)C 1626a_100000228512_100000689120 [0,2,0,0,0,0|2,0,0]=4 5059 B17R1.6521 CCc1ccccc1C(=O)N(C)C(C)C(C)C 240690a_100000228512_100000689120 [0,2,0,0,0,0|2,0,0]=4 5060 B17R1.6521 CCc1ccccc1C(=O)N(C)C(C)C(C)C 527a_100000228512_100000689120 [0,2,0,0,0,0|2,0,0]=4 5061 B17R1.6521 COc1ccccc1C(=O)N(C)C(C)C(C)C 11a_100000228512_100000185835 [0,2,0,0,0,0|2,0,0]=4 5062 B17R1.6521 COc1ccccc1C(=O)N(C)C(C)C(C)C 1626a_100000228512_100000185835 [0,2,0,0,0,0|2,0,0]=4 5063 B17R1.6521 COc1ccccc1C(=O)N(C)C(C)C(C)C 240690a_100000228512_100000185835 [0,2,0,0,0,0|2,0,0]=4 5064 B17R1.6521 COc1ccccc1C(=O)N(C)C(C)C(C)C 527a_100000228512_100000185835 [0,2,0,0,0,0|2,0,0]=4 5065 B17R1.6521 CSc1ccccc1C(=O)N(C)C(C)C(C)C 11a_100000228512_100000183967 [0,2,0,0,0,0|2,0,0]=4 5066 B17R1.6521 CSc1ccccc1C(=O)N(C)C(C)C(C)C 1626a_100000228512_100000183967 [0,2,0,0,0,0|2,0,0]=4 5067 B17R1.6521 CSc1ccccc1C(=O)N(C)C(C)C(C)C 240690a_100000228512_100000183967 [0,2,0,0,0,0|2,0,0]=4 5068 B17R1.6521 CSc1ccccc1C(=O)N(C)C(C)C(C)C 527a_100000228512_100000183967 [0,2,0,0,0,0|2,0,0]=4 5069 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)C 11a_100000742839_100000689120 [0,2,0,0,0,0|2,0,0]=4 5070 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)C 1626a_100000742839_100000689120 [0,2,0,0,0,0|2,0,0]=4 5071 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)C 240690a_100000742839_100000689120 [0,2,0,0,0,0|2,0,0]=4 5072 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)C 527a_100000742839_100000689120 [0,2,0,0,0,0|2,0,0]=4 5073 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)O 1626a_100000755907_100000689120 [0,2,0,0,0,0|2,0,0]=4 5074 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)O 240690a_100000755907_100000689120 [0,2,0,0,0,0|2,0,0]=4 5075 B17R1.6571 CCc1ccccc1C(=O)N(C)CC(C)(C)O 527a_100000755907_100000689120 [0,2,0,0,0,0|2,0,0]=4 5076 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)C 11a_100000742839_100000185835 [0,2,0,0,0,0|2,0,0]=4 5077 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)C 1626a_100000742839_100000185835 [0,2,0,0,0,0|2,0,0]=4 5078 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)C 240690a_100000742839_100000185835 [0,2,0,0,0,0|2,0,0]=4 5079 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)C 527a_100000742839_100000185835 [0,2,0,0,0,0|2,0,0]=4 5080 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)O 1626a_100000755907_100000185835 [0,2,0,0,0,0|2,0,0]=4 5081 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)O 240690a_100000755907_100000185835 [0,2,0,0,0,0|2,0,0]=4 5082 B17R1.6571 COc1ccccc1C(=O)N(C)CC(C)(C)O 527a_100000755907_100000185835 [0,2,0,0,0,0|2,0,0]=4 5083 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)C 11a_100000742839_100000183967 [0,2,0,0,0,0|2,0,0]=4 5084 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)C 1626a_100000742839_100000183967 [0,2,0,0,0,0|2,0,0]=4 5085 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)C 240690a_100000742839_100000183967 [0,2,0,0,0,0|2,0,0]=4 5086 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)C 527a_100000742839_100000183967 [0,2,0,0,0,0|2,0,0]=4 5087 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)O 1626a_100000755907_100000183967 [0,2,0,0,0,0|2,0,0]=4 5088 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)O 240690a_100000755907_100000183967 [0,2,0,0,0,0|2,0,0]=4 5089 B17R1.6571 CSc1ccccc1C(=O)N(C)CC(C)(C)O 527a_100000755907_100000183967 [0,2,0,0,0,0|2,0,0]=4 5090 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1OC 11a_100000753921_100000185835 [0,2,0,0,0,0|2,0,0]=4 5091 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1OC 1626a_100000753921_100000185835 [0,2,0,0,0,0|2,0,0]=4 5092 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1OC 240690a_100000753921_100000185835 [0,2,0,0,0,0|2,0,0]=4 5093 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1OC 527a_100000753921_100000185835 [0,2,0,0,0,0|2,0,0]=4 5094 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1SC 11a_100000753921_100000183967 [0,2,0,0,0,0|2,0,0]=4 5095 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1SC 1626a_100000753921_100000183967 [0,2,0,0,0,0|2,0,0]=4 5096 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1SC 240690a_100000753921_100000183967 [0,2,0,0,0,0|2,0,0]=4 5097 B17R1.6572 CCC(C)CN(C)C(=O)c1ccccc1SC 527a_100000753921_100000183967 [0,2,0,0,0,0|2,0,0]=4 5098 B17R1.6572 CCc1ccccc1C(=O)N(C)CC(C)CC 11a_100000753921_100000689120 [0,2,0,0,0,0|2,0,0]=4 5099 B17R1.6572 CCc1ccccc1C(=O)N(C)CC(C)CC 1626a_100000753921_100000689120 [0,2,0,0,0,0|2,0,0]=4 5100 B17R1.6572 CCc1ccccc1C(=O)N(C)CC(C)CC 240690a_100000753921_100000689120 [0,2,0,0,0,0|2,0,0]=4 5101 B17R1.6572 CCc1ccccc1C(=O)N(C)CC(C)CC 527a_100000753921_100000689120 [0,2,0,0,0,0|2,0,0]=4 5102 B17R1.7017 CCc1c(cccc1C(=O)C(C)CC(C)C)Br 1458a_100010125490_100000731052 [0,2,0,0,0,0|2,0,0]=4 5103 B17R1.7017 CCc1c(cccc1C(=O)N(C)CC(C)C)Br 11a_100000747067_100010125490 [0,2,0,0,0,0|2,0,0]=4 5104 B17R1.7017 CCc1c(cccc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100010125490 [0,2,0,0,0,0|2,0,0]=4 5105 B17R1.7017 CCc1c(cccc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100010125490 [0,2,0,0,0,0|2,0,0]=4 5106 B17R1.7017 CCc1c(cccc1C(=O)N(C)CC(C)C)Br 527a_100000747067_100010125490 [0,2,0,0,0,0|2,0,0]=4 5107 B17R1.7017 COc1c(cccc1C(=O)C(C)CC(C)C)Br 1458a_100000689802_100000731052 [0,2,0,0,0,0|2,0,0]=4 5108 B17R1.7017 COc1c(cccc1C(=O)C(C)CC(C)C)C 1458a_100000187929_100000731052 [0,2,0,0,0,0|2,0,0]=4 5109 B17R1.7017 COc1c(cccc1C(=O)C(C)CC(C)C)Cl 1458a_100011934004_100000731052 [0,2,0,0,0,0|2,0,0]=4 5110 B17R1.7017 COc1c(cccc1C(=O)C(C)CC(C)C)F 1458a_100011218433_100000731052 [0,2,0,0,0,0|2,0,0]=4 5111 B17R1.7017 COc1c(cccc1C(=O)C(C)CC(C)C)O 1458a_100000080799_100000731052 [0,2,0,0,0,0|2,0,0]=4 5112 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Br 11a_100000747067_100000689802 [0,2,0,0,0,0|2,0,0]=4 5113 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100000689802 [0,2,0,0,0,0|2,0,0]=4 5114 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100000689802 [0,2,0,0,0,0|2,0,0]=4 5115 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Br 527a_100000747067_100000689802 [0,2,0,0,0,0|2,0,0]=4 5116 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)C 11a_100000747067_100000187929 [0,2,0,0,0,0|2,0,0]=4 5117 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)C 1626a_100000747067_100000187929 [0,2,0,0,0,0|2,0,0]=4 5118 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)C 240690a_100000747067_100000187929 [0,2,0,0,0,0|2,0,0]=4 5119 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)C 527a_100000747067_100000187929 [0,2,0,0,0,0|2,0,0]=4 5120 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Cl 11a_100000747067_100011934004 [0,2,0,0,0,0|2,0,0]=4 5121 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Cl 1626a_100000747067_100011934004 [0,2,0,0,0,0|2,0,0]=4 5122 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Cl 240690a_100000747067_100011934004 [0,2,0,0,0,0|2,0,0]=4 5123 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)Cl 527a_100000747067_100011934004 [0,2,0,0,0,0|2,0,0]=4 5124 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)F 11a_100000747067_100011218433 [0,2,0,0,0,0|2,0,0]=4 5125 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)F 1626a_100000747067_100011218433 [0,2,0,0,0,0|2,0,0]=4 5126 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)F 240690a_100000747067_100011218433 [0,2,0,0,0,0|2,0,0]=4 5127 B17R1.7017 COc1c(cccc1C(=O)N(C)CC(C)C)F 527a_100000747067_100011218433 [0,2,0,0,0,0|2,0,0]=4 5128 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)Br 1458a_100011593405_100000731052 [0,2,0,0,0,0|2,0,0]=4 5129 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)C 1458a_100000066212_100000731052 [0,2,0,0,0,0|2,0,0]=4 5130 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)Cl 1458a_100000743539_100000731052 [0,2,0,0,0,0|2,0,0]=4 5131 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)F 1458a_100000759380_100000731052 [0,2,0,0,0,0|2,0,0]=4 5132 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)I 1458a_100010179659_100000731052 [0,2,0,0,0,0|2,0,0]=4 5133 B17R1.28427 COc1cccc(c1C(=O)C(C)CC(C)C)O 1458a_100000043310_100000731052 [0,2,0,0,0,0|2,0,0]=4 5134 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Br 11a_100000747067_100011593405 [0,2,0,0,0,0|2,0,0]=4 5135 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Br 1626a_100000747067_100011593405 [0,2,0,0,0,0|2,0,0]=4 5136 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Br 240690a_100000747067_100011593405 [0,2,0,0,0,0|2,0,0]=4 5137 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Br 527a_100000747067_100011593405 [0,2,0,0,0,0|2,0,0]=4 5138 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)C 11a_100000747067_100000066212 [0,2,0,0,0,0|2,0,0]=4 5139 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)C 1626a_100000747067_100000066212 [0,2,0,0,0,0|2,0,0]=4 5140 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)C 240690a_100000747067_100000066212 [0,2,0,0,0,0|2,0,0]=4 5141 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Cl 11a_100000747067_100000743539 [0,2,0,0,0,0|2,0,0]=4 5142 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Cl 1626a_100000747067_100000743539 [0,2,0,0,0,0|2,0,0]=4 5143 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Cl 240690a_100000747067_100000743539 [0,2,0,0,0,0|2,0,0]=4 5144 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)Cl 527a_100000747067_100000743539 [0,2,0,0,0,0|2,0,0]=4 5145 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)F 11a_100000747067_100000759380 [0,2,0,0,0,0|2,0,0]=4 5146 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)F 1626a_100000747067_100000759380 [0,2,0,0,0,0|2,0,0]=4 5147 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)F 240690a_100000747067_100000759380 [0,2,0,0,0,0|2,0,0]=4 5148 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)F 527a_100000747067_100000759380 [0,2,0,0,0,0|2,0,0]=4 5149 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)I 11a_100000747067_100010179659 [0,2,0,0,0,0|2,0,0]=4 5150 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)I 1626a_100000747067_100010179659 [0,2,0,0,0,0|2,0,0]=4 5151 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)I 240690a_100000747067_100010179659 [0,2,0,0,0,0|2,0,0]=4 5152 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)I 527a_100000747067_100010179659 [0,2,0,0,0,0|2,0,0]=4 5153 B17R1.28427 COc1cccc(c1C(=O)N(C)CC(C)C)O 240690a_100000747067_100000043310 [0,2,0,0,0,0|2,0,0]=4 5154 B17R1.6604 CCC(NC(=O)c1ccccc1OC)C(C)C 11a_100000745074_100000185835 [0,2,0,0,0,0|2,0,0]=4 5155 B17R1.6604 CCC(NC(=O)c1ccccc1OC)C(C)C 1626a_100000745074_100000185835 [0,2,0,0,0,0|2,0,0]=4 5156 B17R1.6604 CCC(NC(=O)c1ccccc1OC)C(C)C 240690a_100000745074_100000185835 [0,2,0,0,0,0|2,0,0]=4 5157 B17R1.6604 CCC(NC(=O)c1ccccc1OC)C(C)C 527a_100000745074_100000185835 [0,2,0,0,0,0|2,0,0]=4 5158 B17R1.6604 CCC(NC(=O)c1ccccc1SC)C(C)C 11a_100000745074_100000183967 [0,2,0,0,0,0|2,0,0]=4 5159 B17R1.6604 CCC(NC(=O)c1ccccc1SC)C(C)C 1626a_100000745074_100000183967 [0,2,0,0,0,0|2,0,0]=4 5160 B17R1.6604 CCC(NC(=O)c1ccccc1SC)C(C)C 240690a_100000745074_100000183967 [0,2,0,0,0,0|2,0,0]=4 5161 B17R1.6604 CCC(NC(=O)c1ccccc1SC)C(C)C 527a_100000745074_100000183967 [0,2,0,0,0,0|2,0,0]=4 5162 B17R1.6604 CCc1ccccc1C(=O)NC(CC)C(C)C 11a_100000745074_100000689120 [0,2,0,0,0,0|2,0,0]=4 5163 B17R1.6604 CCc1ccccc1C(=O)NC(CC)C(C)C 1626a_100000745074_100000689120 [0,2,0,0,0,0|2,0,0]=4 5164 B17R1.6604 CCc1ccccc1C(=O)NC(CC)C(C)C 240690a_100000745074_100000689120 [0,2,0,0,0,0|2,0,0]=4 5165 B17R1.6604 CCc1ccccc1C(=O)NC(CC)C(C)C 527a_100000745074_100000689120 [0,2,0,0,0,0|2,0,0]=4 5166 B17R1.6604 CCc1ccccc1C(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100000689120 [0,2,0,0,0,0|2,0,0]=4 5167 B17R1.6604 CCc1ccccc1C(=O)N[C@@H](CO)C(C)C 527a_100011830312_100000689120 [0,2,0,0,0,0|2,0,0]=4 5168 B17R1.6604 COc1ccccc1C(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100000185835 [0,2,0,0,0,0|2,0,0]=4 5169 B17R1.6604 COc1ccccc1C(=O)N[C@@H](CO)C(C)C 527a_100011830312_100000185835 [0,2,0,0,0,0|2,0,0]=4 5170 B17R1.6604 CSc1ccccc1C(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100000183967 [0,2,0,0,0,0|2,0,0]=4 5171 B17R1.6604 CSc1ccccc1C(=O)N[C@@H](CO)C(C)C 527a_100011830312_100000183967 [0,2,0,0,0,0|2,0,0]=4 5172 B17R1.7045 CCc1c(cccc1C(=O)NC(C)C(C)C)Br 11a_100000211541_100010125490 [0,2,0,0,0,0|2,0,0]=4 5173 B17R1.7045 CCc1c(cccc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100010125490 [0,2,0,0,0,0|2,0,0]=4 5174 B17R1.7045 CCc1c(cccc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100010125490 [0,2,0,0,0,0|2,0,0]=4 5175 B17R1.7045 CCc1c(cccc1C(=O)NC(C)C(C)C)Br 527a_100000211541_100010125490 [0,2,0,0,0,0|2,0,0]=4 5176 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Br 11a_100000211541_100000689802 [0,2,0,0,0,0|2,0,0]=4 5177 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100000689802 [0,2,0,0,0,0|2,0,0]=4 5178 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100000689802 [0,2,0,0,0,0|2,0,0]=4 5179 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Br 527a_100000211541_100000689802 [0,2,0,0,0,0|2,0,0]=4 5180 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)C 11a_100000211541_100000187929 [0,2,0,0,0,0|2,0,0]=4 5181 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)C 1626a_100000211541_100000187929 [0,2,0,0,0,0|2,0,0]=4 5182 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)C 240690a_100000211541_100000187929 [0,2,0,0,0,0|2,0,0]=4 5183 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)C 527a_100000211541_100000187929 [0,2,0,0,0,0|2,0,0]=4 5184 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Cl 11a_100000211541_100011934004 [0,2,0,0,0,0|2,0,0]=4 5185 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Cl 1626a_100000211541_100011934004 [0,2,0,0,0,0|2,0,0]=4 5186 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Cl 240690a_100000211541_100011934004 [0,2,0,0,0,0|2,0,0]=4 5187 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)Cl 527a_100000211541_100011934004 [0,2,0,0,0,0|2,0,0]=4 5188 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)F 11a_100000211541_100011218433 [0,2,0,0,0,0|2,0,0]=4 5189 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)F 1626a_100000211541_100011218433 [0,2,0,0,0,0|2,0,0]=4 5190 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)F 240690a_100000211541_100011218433 [0,2,0,0,0,0|2,0,0]=4 5191 B17R1.7045 COc1c(cccc1C(=O)NC(C)C(C)C)F 527a_100000211541_100011218433 [0,2,0,0,0,0|2,0,0]=4 5192 B17R1.27062 CCc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100000689120 [0,2,0,0,0,0|2,0,0]=4 5193 B17R1.27062 CCc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100000689120 [0,2,0,0,0,0|2,0,0]=4 5194 B17R1.27062 CCc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100000689120 [0,2,0,0,0,0|2,0,0]=4 5195 B17R1.27062 CCc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100000689120 [0,2,0,0,0,0|2,0,0]=4 5196 B17R1.27062 CCc1ccccc1C(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100000689120 [0,2,0,0,0,0|2,0,0]=4 5197 B17R1.27062 CCc1ccccc1C(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100000689120 [0,2,0,0,0,0|2,0,0]=4 5198 B17R1.27062 CCc1ccccc1C(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100000689120 [0,2,0,0,0,0|2,0,0]=4 5199 B17R1.27062 CCc1ccccc1C(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100000689120 [0,2,0,0,0,0|2,0,0]=4 5200 B17R1.27062 COc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100000185835 [0,2,0,0,0,0|2,0,0]=4 5201 B17R1.27062 COc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100000185835 [0,2,0,0,0,0|2,0,0]=4 5202 B17R1.27062 COc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100000185835 [0,2,0,0,0,0|2,0,0]=4 5203 B17R1.27062 COc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100000185835 [0,2,0,0,0,0|2,0,0]=4 5204 B17R1.27062 COc1ccccc1C(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100000185835 [0,2,0,0,0,0|2,0,0]=4 5205 B17R1.27062 COc1ccccc1C(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100000185835 [0,2,0,0,0,0|2,0,0]=4 5206 B17R1.27062 COc1ccccc1C(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100000185835 [0,2,0,0,0,0|2,0,0]=4 5207 B17R1.27062 COc1ccccc1C(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100000185835 [0,2,0,0,0,0|2,0,0]=4 5208 B17R1.27062 CSc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100000183967 [0,2,0,0,0,0|2,0,0]=4 5209 B17R1.27062 CSc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100000183967 [0,2,0,0,0,0|2,0,0]=4 5210 B17R1.27062 CSc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100000183967 [0,2,0,0,0,0|2,0,0]=4 5211 B17R1.27062 CSc1ccccc1C(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100000183967 [0,2,0,0,0,0|2,0,0]=4 5212 B17R1.27062 CSc1ccccc1C(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100000183967 [0,2,0,0,0,0|2,0,0]=4 5213 B17R1.27062 CSc1ccccc1C(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100000183967 [0,2,0,0,0,0|2,0,0]=4 5214 B17R1.27062 CSc1ccccc1C(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100000183967 [0,2,0,0,0,0|2,0,0]=4 5215 B17R1.27062 CSc1ccccc1C(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100000183967 [0,2,0,0,0,0|2,0,0]=4 5216 B17R1.49022 CCc1ccccc1C(=O)NC(C)(C)C(C)C 11a_200160471154_100000689120 [0,2,0,0,0,0|2,0,0]=4 5217 B17R1.49022 CCc1ccccc1C(=O)NC(C)(C)C(C)C 1626a_200160471154_100000689120 [0,2,0,0,0,0|2,0,0]=4 5218 B17R1.49022 CCc1ccccc1C(=O)NC(C)(C)C(C)C 240690a_200160471154_100000689120 [0,2,0,0,0,0|2,0,0]=4 5219 B17R1.49022 CCc1ccccc1C(=O)NC(C)(C)C(C)C 527a_200160471154_100000689120 [0,2,0,0,0,0|2,0,0]=4 5220 B17R1.49022 COc1ccccc1C(=O)NC(C)(C)C(C)C 11a_200160471154_100000185835 [0,2,0,0,0,0|2,0,0]=4 5221 B17R1.49022 COc1ccccc1C(=O)NC(C)(C)C(C)C 1626a_200160471154_100000185835 [0,2,0,0,0,0|2,0,0]=4 5222 B17R1.49022 COc1ccccc1C(=O)NC(C)(C)C(C)C 240690a_200160471154_100000185835 [0,2,0,0,0,0|2,0,0]=4 5223 B17R1.49022 COc1ccccc1C(=O)NC(C)(C)C(C)C 527a_200160471154_100000185835 [0,2,0,0,0,0|2,0,0]=4 5224 B17R1.49022 CSc1ccccc1C(=O)NC(C)(C)C(C)C 11a_200160471154_100000183967 [0,2,0,0,0,0|2,0,0]=4 5225 B17R1.49022 CSc1ccccc1C(=O)NC(C)(C)C(C)C 1626a_200160471154_100000183967 [0,2,0,0,0,0|2,0,0]=4 5226 B17R1.49022 CSc1ccccc1C(=O)NC(C)(C)C(C)C 240690a_200160471154_100000183967 [0,2,0,0,0,0|2,0,0]=4 5227 B17R1.49022 CSc1ccccc1C(=O)NC(C)(C)C(C)C 527a_200160471154_100000183967 [0,2,0,0,0,0|2,0,0]=4 5228 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Br 11a_100000211541_100011593405 [0,2,0,0,0,0|2,0,0]=4 5229 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Br 1626a_100000211541_100011593405 [0,2,0,0,0,0|2,0,0]=4 5230 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Br 240690a_100000211541_100011593405 [0,2,0,0,0,0|2,0,0]=4 5231 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Br 527a_100000211541_100011593405 [0,2,0,0,0,0|2,0,0]=4 5232 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)C 11a_100000211541_100000066212 [0,2,0,0,0,0|2,0,0]=4 5233 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)C 1626a_100000211541_100000066212 [0,2,0,0,0,0|2,0,0]=4 5234 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)C 240690a_100000211541_100000066212 [0,2,0,0,0,0|2,0,0]=4 5235 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Cl 11a_100000211541_100000743539 [0,2,0,0,0,0|2,0,0]=4 5236 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Cl 1626a_100000211541_100000743539 [0,2,0,0,0,0|2,0,0]=4 5237 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Cl 240690a_100000211541_100000743539 [0,2,0,0,0,0|2,0,0]=4 5238 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)Cl 527a_100000211541_100000743539 [0,2,0,0,0,0|2,0,0]=4 5239 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)F 11a_100000211541_100000759380 [0,2,0,0,0,0|2,0,0]=4 5240 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)F 1626a_100000211541_100000759380 [0,2,0,0,0,0|2,0,0]=4 5241 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)F 240690a_100000211541_100000759380 [0,2,0,0,0,0|2,0,0]=4 5242 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)F 527a_100000211541_100000759380 [0,2,0,0,0,0|2,0,0]=4 5243 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)I 11a_100000211541_100010179659 [0,2,0,0,0,0|2,0,0]=4 5244 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)I 1626a_100000211541_100010179659 [0,2,0,0,0,0|2,0,0]=4 5245 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)I 240690a_100000211541_100010179659 [0,2,0,0,0,0|2,0,0]=4 5246 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)I 527a_100000211541_100010179659 [0,2,0,0,0,0|2,0,0]=4 5247 B17R1.162492 COc1cccc(c1C(=O)NC(C)C(C)C)O 240690a_100000211541_100000043310 [0,2,0,0,0,0|2,0,0]=4 5248 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1OC 11a_100102946423_100000185835 [0,2,0,0,0,0|2,0,0]=4 5249 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1OC 1626a_100102946423_100000185835 [0,2,0,0,0,0|2,0,0]=4 5250 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1OC 240690a_100102946423_100000185835 [0,2,0,0,0,0|2,0,0]=4 5251 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1OC 527a_100102946423_100000185835 [0,2,0,0,0,0|2,0,0]=4 5252 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1SC 11a_100102946423_100000183967 [0,2,0,0,0,0|2,0,0]=4 5253 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1SC 1626a_100102946423_100000183967 [0,2,0,0,0,0|2,0,0]=4 5254 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1SC 240690a_100102946423_100000183967 [0,2,0,0,0,0|2,0,0]=4 5255 B17R1.6603 CCC(CC)CNC(=O)c1ccccc1SC 527a_100102946423_100000183967 [0,2,0,0,0,0|2,0,0]=4 5256 B17R1.6603 CCC(CNC(=O)c1ccccc1OC)OC 11a_100000731041_100000185835 [0,2,0,0,0,0|2,0,0]=4 5257 B17R1.6603 CCC(CNC(=O)c1ccccc1OC)OC 1626a_100000731041_100000185835 [0,2,0,0,0,0|2,0,0]=4 5258 B17R1.6603 CCC(CNC(=O)c1ccccc1OC)OC 240690a_100000731041_100000185835 [0,2,0,0,0,0|2,0,0]=4 5259 B17R1.6603 CCC(CNC(=O)c1ccccc1OC)OC 527a_100000731041_100000185835 [0,2,0,0,0,0|2,0,0]=4 5260 B17R1.6603 CCC(CNC(=O)c1ccccc1SC)OC 11a_100000731041_100000183967 [0,2,0,0,0,0|2,0,0]=4 5261 B17R1.6603 CCC(CNC(=O)c1ccccc1SC)OC 1626a_100000731041_100000183967 [0,2,0,0,0,0|2,0,0]=4 5262 B17R1.6603 CCC(CNC(=O)c1ccccc1SC)OC 240690a_100000731041_100000183967 [0,2,0,0,0,0|2,0,0]=4 5263 B17R1.6603 CCC(CNC(=O)c1ccccc1SC)OC 527a_100000731041_100000183967 [0,2,0,0,0,0|2,0,0]=4 5264 B17R1.6603 CCc1ccccc1C(=O)CCC(OC)OC 1458a_100000689120_100000139399 [0,2,0,0,0,0|2,0,0]=4 5265 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)CC 11a_100102946423_100000689120 [0,2,0,0,0,0|2,0,0]=4 5266 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)CC 1626a_100102946423_100000689120 [0,2,0,0,0,0|2,0,0]=4 5267 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)CC 240690a_100102946423_100000689120 [0,2,0,0,0,0|2,0,0]=4 5268 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)CC 527a_100102946423_100000689120 [0,2,0,0,0,0|2,0,0]=4 5269 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)OC 11a_100000731041_100000689120 [0,2,0,0,0,0|2,0,0]=4 5270 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)OC 1626a_100000731041_100000689120 [0,2,0,0,0,0|2,0,0]=4 5271 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)OC 240690a_100000731041_100000689120 [0,2,0,0,0,0|2,0,0]=4 5272 B17R1.6603 CCc1ccccc1C(=O)NCC(CC)OC 527a_100000731041_100000689120 [0,2,0,0,0,0|2,0,0]=4 5273 B17R1.6603 CCc1ccccc1C(=O)NCC(OC)OC 11a_100000210479_100000689120 [0,2,0,0,0,0|2,0,0]=4 5274 B17R1.6603 CCc1ccccc1C(=O)NCC(OC)OC 1626a_100000210479_100000689120 [0,2,0,0,0,0|2,0,0]=4 5275 B17R1.6603 CCc1ccccc1C(=O)NCC(OC)OC 240690a_100000210479_100000689120 [0,2,0,0,0,0|2,0,0]=4 5276 B17R1.6603 CCc1ccccc1C(=O)NCC(OC)OC 527a_100000210479_100000689120 [0,2,0,0,0,0|2,0,0]=4 5277 B17R1.6603 COC(CCC(=O)c1ccccc1SC)OC 1458a_100000183967_100000139399 [0,2,0,0,0,0|2,0,0]=4 5278 B17R1.6603 COC(CNC(=O)c1ccccc1SC)OC 11a_100000210479_100000183967 [0,2,0,0,0,0|2,0,0]=4 5279 B17R1.6603 COC(CNC(=O)c1ccccc1SC)OC 1626a_100000210479_100000183967 [0,2,0,0,0,0|2,0,0]=4 5280 B17R1.6603 COC(CNC(=O)c1ccccc1SC)OC 240690a_100000210479_100000183967 [0,2,0,0,0,0|2,0,0]=4 5281 B17R1.6603 COC(CNC(=O)c1ccccc1SC)OC 527a_100000210479_100000183967 [0,2,0,0,0,0|2,0,0]=4 5282 B17R1.6603 COc1ccccc1C(=O)CCC(OC)OC 1458a_100000185835_100000139399 [0,2,0,0,0,0|2,0,0]=4 5283 B17R1.6603 COc1ccccc1C(=O)NCC(OC)OC 11a_100000210479_100000185835 [0,2,0,0,0,0|2,0,0]=4 5284 B17R1.6603 COc1ccccc1C(=O)NCC(OC)OC 1626a_100000210479_100000185835 [0,2,0,0,0,0|2,0,0]=4 5285 B17R1.6603 COc1ccccc1C(=O)NCC(OC)OC 240690a_100000210479_100000185835 [0,2,0,0,0,0|2,0,0]=4 5286 B17R1.6603 COc1ccccc1C(=O)NCC(OC)OC 527a_100000210479_100000185835 [0,2,0,0,0,0|2,0,0]=4 5287 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Br 11a_100020588543_100000689802 [0,2,0,0,0,0|2,0,0]=4 5288 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Br 1626a_100020588543_100000689802 [0,2,0,0,0,0|2,0,0]=4 5289 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Br 240690a_100020588543_100000689802 [0,2,0,0,0,0|2,0,0]=4 5290 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Br 527a_100020588543_100000689802 [0,2,0,0,0,0|2,0,0]=4 5291 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)C 11a_100020588543_100000187929 [0,2,0,0,0,0|2,0,0]=4 5292 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)C 1626a_100020588543_100000187929 [0,2,0,0,0,0|2,0,0]=4 5293 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)C 240690a_100020588543_100000187929 [0,2,0,0,0,0|2,0,0]=4 5294 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)C 527a_100020588543_100000187929 [0,2,0,0,0,0|2,0,0]=4 5295 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Cl 11a_100020588543_100011934004 [0,2,0,0,0,0|2,0,0]=4 5296 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Cl 1626a_100020588543_100011934004 [0,2,0,0,0,0|2,0,0]=4 5297 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Cl 240690a_100020588543_100011934004 [0,2,0,0,0,0|2,0,0]=4 5298 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)Cl 527a_100020588543_100011934004 [0,2,0,0,0,0|2,0,0]=4 5299 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)F 11a_100020588543_100011218433 [0,2,0,0,0,0|2,0,0]=4 5300 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)F 1626a_100020588543_100011218433 [0,2,0,0,0,0|2,0,0]=4 5301 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)F 240690a_100020588543_100011218433 [0,2,0,0,0,0|2,0,0]=4 5302 B17R1.7028 CCC(C)CNC(=O)c1cccc(c1OC)F 527a_100020588543_100011218433 [0,2,0,0,0,0|2,0,0]=4 5303 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CC)Br 11a_100020588543_100010125490 [0,2,0,0,0,0|2,0,0]=4 5304 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CC)Br 1626a_100020588543_100010125490 [0,2,0,0,0,0|2,0,0]=4 5305 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CC)Br 240690a_100020588543_100010125490 [0,2,0,0,0,0|2,0,0]=4 5306 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CC)Br 527a_100020588543_100010125490 [0,2,0,0,0,0|2,0,0]=4 5307 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CO)Br 240690a_100000744482_100010125490 [0,2,0,0,0,0|2,0,0]=4 5308 B17R1.7028 CCc1c(cccc1C(=O)NCC(C)CO)Br 527a_100000744482_100010125490 [0,2,0,0,0,0|2,0,0]=4 5309 B17R1.7028 CCc1c(cccc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100010125490 [0,2,0,0,0,0|2,0,0]=4 5310 B17R1.7028 CCc1c(cccc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100010125490 [0,2,0,0,0,0|2,0,0]=4 5311 B17R1.7028 CCc1c(cccc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100010125490 [0,2,0,0,0,0|2,0,0]=4 5312 B17R1.7028 CCc1c(cccc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100010125490 [0,2,0,0,0,0|2,0,0]=4 5313 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)Br 240690a_100000744482_100000689802 [0,2,0,0,0,0|2,0,0]=4 5314 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)Br 527a_100000744482_100000689802 [0,2,0,0,0,0|2,0,0]=4 5315 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)C 240690a_100000744482_100000187929 [0,2,0,0,0,0|2,0,0]=4 5316 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)C 527a_100000744482_100000187929 [0,2,0,0,0,0|2,0,0]=4 5317 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)Cl 240690a_100000744482_100011934004 [0,2,0,0,0,0|2,0,0]=4 5318 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)Cl 527a_100000744482_100011934004 [0,2,0,0,0,0|2,0,0]=4 5319 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)F 240690a_100000744482_100011218433 [0,2,0,0,0,0|2,0,0]=4 5320 B17R1.7028 COc1c(cccc1C(=O)NCC(C)CO)F 527a_100000744482_100011218433 [0,2,0,0,0,0|2,0,0]=4 5321 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100000689802 [0,2,0,0,0,0|2,0,0]=4 5322 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100000689802 [0,2,0,0,0,0|2,0,0]=4 5323 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100000689802 [0,2,0,0,0,0|2,0,0]=4 5324 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100000689802 [0,2,0,0,0,0|2,0,0]=4 5325 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)C 11a_100020591295_100000187929 [0,2,0,0,0,0|2,0,0]=4 5326 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)C 1626a_100020591295_100000187929 [0,2,0,0,0,0|2,0,0]=4 5327 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)C 240690a_100020591295_100000187929 [0,2,0,0,0,0|2,0,0]=4 5328 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)C 527a_100020591295_100000187929 [0,2,0,0,0,0|2,0,0]=4 5329 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Cl 11a_100020591295_100011934004 [0,2,0,0,0,0|2,0,0]=4 5330 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Cl 1626a_100020591295_100011934004 [0,2,0,0,0,0|2,0,0]=4 5331 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Cl 240690a_100020591295_100011934004 [0,2,0,0,0,0|2,0,0]=4 5332 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)Cl 527a_100020591295_100011934004 [0,2,0,0,0,0|2,0,0]=4 5333 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)F 11a_100020591295_100011218433 [0,2,0,0,0,0|2,0,0]=4 5334 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)F 1626a_100020591295_100011218433 [0,2,0,0,0,0|2,0,0]=4 5335 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)F 240690a_100020591295_100011218433 [0,2,0,0,0,0|2,0,0]=4 5336 B17R1.7028 COc1c(cccc1C(=O)NC[C@@H](C)OC)F 527a_100020591295_100011218433 [0,2,0,0,0,0|2,0,0]=4 5337 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Br 11a_100020588543_100011593405 [0,2,0,0,0,0|2,0,0]=4 5338 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Br 1626a_100020588543_100011593405 [0,2,0,0,0,0|2,0,0]=4 5339 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Br 240690a_100020588543_100011593405 [0,2,0,0,0,0|2,0,0]=4 5340 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Br 527a_100020588543_100011593405 [0,2,0,0,0,0|2,0,0]=4 5341 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)C 11a_100020588543_100000066212 [0,2,0,0,0,0|2,0,0]=4 5342 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)C 1626a_100020588543_100000066212 [0,2,0,0,0,0|2,0,0]=4 5343 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)C 240690a_100020588543_100000066212 [0,2,0,0,0,0|2,0,0]=4 5344 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Cl 11a_100020588543_100000743539 [0,2,0,0,0,0|2,0,0]=4 5345 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Cl 1626a_100020588543_100000743539 [0,2,0,0,0,0|2,0,0]=4 5346 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Cl 240690a_100020588543_100000743539 [0,2,0,0,0,0|2,0,0]=4 5347 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)Cl 527a_100020588543_100000743539 [0,2,0,0,0,0|2,0,0]=4 5348 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)F 11a_100020588543_100000759380 [0,2,0,0,0,0|2,0,0]=4 5349 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)F 1626a_100020588543_100000759380 [0,2,0,0,0,0|2,0,0]=4 5350 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)F 240690a_100020588543_100000759380 [0,2,0,0,0,0|2,0,0]=4 5351 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)F 527a_100020588543_100000759380 [0,2,0,0,0,0|2,0,0]=4 5352 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)I 11a_100020588543_100010179659 [0,2,0,0,0,0|2,0,0]=4 5353 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)I 1626a_100020588543_100010179659 [0,2,0,0,0,0|2,0,0]=4 5354 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)I 240690a_100020588543_100010179659 [0,2,0,0,0,0|2,0,0]=4 5355 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)I 527a_100020588543_100010179659 [0,2,0,0,0,0|2,0,0]=4 5356 B17R1.28527 CCC(C)CNC(=O)c1c(cccc1OC)O 240690a_100020588543_100000043310 [0,2,0,0,0,0|2,0,0]=4 5357 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)Br 240690a_100000744482_100011593405 [0,2,0,0,0,0|2,0,0]=4 5358 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)Br 527a_100000744482_100011593405 [0,2,0,0,0,0|2,0,0]=4 5359 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)C 240690a_100000744482_100000066212 [0,2,0,0,0,0|2,0,0]=4 5360 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)Cl 240690a_100000744482_100000743539 [0,2,0,0,0,0|2,0,0]=4 5361 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)Cl 527a_100000744482_100000743539 [0,2,0,0,0,0|2,0,0]=4 5362 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)F 240690a_100000744482_100000759380 [0,2,0,0,0,0|2,0,0]=4 5363 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)F 527a_100000744482_100000759380 [0,2,0,0,0,0|2,0,0]=4 5364 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)I 240690a_100000744482_100010179659 [0,2,0,0,0,0|2,0,0]=4 5365 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)I 527a_100000744482_100010179659 [0,2,0,0,0,0|2,0,0]=4 5366 B17R1.28527 COc1cccc(c1C(=O)NCC(C)CO)O 240690a_100000744482_100000043310 [0,2,0,0,0,0|2,0,0]=4 5367 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Br 11a_100020591295_100011593405 [0,2,0,0,0,0|2,0,0]=4 5368 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Br 1626a_100020591295_100011593405 [0,2,0,0,0,0|2,0,0]=4 5369 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Br 240690a_100020591295_100011593405 [0,2,0,0,0,0|2,0,0]=4 5370 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Br 527a_100020591295_100011593405 [0,2,0,0,0,0|2,0,0]=4 5371 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)C 11a_100020591295_100000066212 [0,2,0,0,0,0|2,0,0]=4 5372 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)C 1626a_100020591295_100000066212 [0,2,0,0,0,0|2,0,0]=4 5373 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)C 240690a_100020591295_100000066212 [0,2,0,0,0,0|2,0,0]=4 5374 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Cl 11a_100020591295_100000743539 [0,2,0,0,0,0|2,0,0]=4 5375 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Cl 1626a_100020591295_100000743539 [0,2,0,0,0,0|2,0,0]=4 5376 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Cl 240690a_100020591295_100000743539 [0,2,0,0,0,0|2,0,0]=4 5377 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)Cl 527a_100020591295_100000743539 [0,2,0,0,0,0|2,0,0]=4 5378 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)F 11a_100020591295_100000759380 [0,2,0,0,0,0|2,0,0]=4 5379 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)F 1626a_100020591295_100000759380 [0,2,0,0,0,0|2,0,0]=4 5380 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)F 240690a_100020591295_100000759380 [0,2,0,0,0,0|2,0,0]=4 5381 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)F 527a_100020591295_100000759380 [0,2,0,0,0,0|2,0,0]=4 5382 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)I 11a_100020591295_100010179659 [0,2,0,0,0,0|2,0,0]=4 5383 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)I 1626a_100020591295_100010179659 [0,2,0,0,0,0|2,0,0]=4 5384 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)I 240690a_100020591295_100010179659 [0,2,0,0,0,0|2,0,0]=4 5385 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)I 527a_100020591295_100010179659 [0,2,0,0,0,0|2,0,0]=4 5386 B17R1.28527 COc1cccc(c1C(=O)NC[C@@H](C)OC)O 240690a_100020591295_100000043310 [0,2,0,0,0,0|2,0,0]=4 5387 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)CO 240690a_100020635058_100000689120 [0,2,0,0,0,0|2,0,0]=4 5388 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)CO 527a_100020635058_100000689120 [0,2,0,0,0,0|2,0,0]=4 5389 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)OC 11a_100000763424_100000689120 [0,2,0,0,0,0|2,0,0]=4 5390 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)OC 1626a_100000763424_100000689120 [0,2,0,0,0,0|2,0,0]=4 5391 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)OC 240690a_100000763424_100000689120 [0,2,0,0,0,0|2,0,0]=4 5392 B17R1.154776 CCc1ccccc1C(=O)NCC(C)(C)OC 527a_100000763424_100000689120 [0,2,0,0,0,0|2,0,0]=4 5393 B17R1.154776 COC(C)(C)CNC(=O)c1ccccc1SC 11a_100000763424_100000183967 [0,2,0,0,0,0|2,0,0]=4 5394 B17R1.154776 COC(C)(C)CNC(=O)c1ccccc1SC 1626a_100000763424_100000183967 [0,2,0,0,0,0|2,0,0]=4 5395 B17R1.154776 COC(C)(C)CNC(=O)c1ccccc1SC 240690a_100000763424_100000183967 [0,2,0,0,0,0|2,0,0]=4 5396 B17R1.154776 COC(C)(C)CNC(=O)c1ccccc1SC 527a_100000763424_100000183967 [0,2,0,0,0,0|2,0,0]=4 5397 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)CO 240690a_100020635058_100000185835 [0,2,0,0,0,0|2,0,0]=4 5398 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)CO 527a_100020635058_100000185835 [0,2,0,0,0,0|2,0,0]=4 5399 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)OC 11a_100000763424_100000185835 [0,2,0,0,0,0|2,0,0]=4 5400 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)OC 1626a_100000763424_100000185835 [0,2,0,0,0,0|2,0,0]=4 5401 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)OC 240690a_100000763424_100000185835 [0,2,0,0,0,0|2,0,0]=4 5402 B17R1.154776 COc1ccccc1C(=O)NCC(C)(C)OC 527a_100000763424_100000185835 [0,2,0,0,0,0|2,0,0]=4 5403 B17R1.154776 CSc1ccccc1C(=O)NCC(C)(C)CO 240690a_100020635058_100000183967 [0,2,0,0,0,0|2,0,0]=4 5404 B17R1.154776 CSc1ccccc1C(=O)NCC(C)(C)CO 527a_100020635058_100000183967 [0,2,0,0,0,0|2,0,0]=4 5405 B17R1.7050 CCc1c(cccc1C(=O)CCC(C)(C)C)Br 1458a_100010125490_100000755188 [0,2,0,0,0,0|2,0,0]=4 5406 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)C)Br 11a_100000743828_100010125490 [0,2,0,0,0,0|2,0,0]=4 5407 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100010125490 [0,2,0,0,0,0|2,0,0]=4 5408 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100010125490 [0,2,0,0,0,0|2,0,0]=4 5409 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)C)Br 527a_100000743828_100010125490 [0,2,0,0,0,0|2,0,0]=4 5410 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)F)Br 11a_100020643315_100010125490 [0,2,0,0,0,0|2,0,0]=4 5411 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100010125490 [0,2,0,0,0,0|2,0,0]=4 5412 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100010125490 [0,2,0,0,0,0|2,0,0]=4 5413 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)F)Br 527a_100020643315_100010125490 [0,2,0,0,0,0|2,0,0]=4 5414 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100010125490 [0,2,0,0,0,0|2,0,0]=4 5415 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100010125490 [0,2,0,0,0,0|2,0,0]=4 5416 B17R1.7050 CCc1c(cccc1C(=O)NCC(C)(C)O)Br 527a_100000751335_100010125490 [0,2,0,0,0,0|2,0,0]=4 5417 B17R1.7050 COc1c(cccc1C(=O)CCC(C)(C)C)Br 1458a_100000689802_100000755188 [0,2,0,0,0,0|2,0,0]=4 5418 B17R1.7050 COc1c(cccc1C(=O)CCC(C)(C)C)C 1458a_100000187929_100000755188 [0,2,0,0,0,0|2,0,0]=4 5419 B17R1.7050 COc1c(cccc1C(=O)CCC(C)(C)C)Cl 1458a_100011934004_100000755188 [0,2,0,0,0,0|2,0,0]=4 5420 B17R1.7050 COc1c(cccc1C(=O)CCC(C)(C)C)F 1458a_100011218433_100000755188 [0,2,0,0,0,0|2,0,0]=4 5421 B17R1.7050 COc1c(cccc1C(=O)CCC(C)(C)C)O 1458a_100000080799_100000755188 [0,2,0,0,0,0|2,0,0]=4 5422 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Br 11a_100000743828_100000689802 [0,2,0,0,0,0|2,0,0]=4 5423 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100000689802 [0,2,0,0,0,0|2,0,0]=4 5424 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100000689802 [0,2,0,0,0,0|2,0,0]=4 5425 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Br 527a_100000743828_100000689802 [0,2,0,0,0,0|2,0,0]=4 5426 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)C 11a_100000743828_100000187929 [0,2,0,0,0,0|2,0,0]=4 5427 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)C 1626a_100000743828_100000187929 [0,2,0,0,0,0|2,0,0]=4 5428 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)C 240690a_100000743828_100000187929 [0,2,0,0,0,0|2,0,0]=4 5429 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)C 527a_100000743828_100000187929 [0,2,0,0,0,0|2,0,0]=4 5430 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Cl 11a_100000743828_100011934004 [0,2,0,0,0,0|2,0,0]=4 5431 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Cl 1626a_100000743828_100011934004 [0,2,0,0,0,0|2,0,0]=4 5432 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Cl 240690a_100000743828_100011934004 [0,2,0,0,0,0|2,0,0]=4 5433 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)Cl 527a_100000743828_100011934004 [0,2,0,0,0,0|2,0,0]=4 5434 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)F 11a_100000743828_100011218433 [0,2,0,0,0,0|2,0,0]=4 5435 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)F 1626a_100000743828_100011218433 [0,2,0,0,0,0|2,0,0]=4 5436 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)F 240690a_100000743828_100011218433 [0,2,0,0,0,0|2,0,0]=4 5437 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)C)F 527a_100000743828_100011218433 [0,2,0,0,0,0|2,0,0]=4 5438 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Br 11a_100020643315_100000689802 [0,2,0,0,0,0|2,0,0]=4 5439 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100000689802 [0,2,0,0,0,0|2,0,0]=4 5440 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100000689802 [0,2,0,0,0,0|2,0,0]=4 5441 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Br 527a_100020643315_100000689802 [0,2,0,0,0,0|2,0,0]=4 5442 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)C 11a_100020643315_100000187929 [0,2,0,0,0,0|2,0,0]=4 5443 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)C 1626a_100020643315_100000187929 [0,2,0,0,0,0|2,0,0]=4 5444 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)C 240690a_100020643315_100000187929 [0,2,0,0,0,0|2,0,0]=4 5445 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)C 527a_100020643315_100000187929 [0,2,0,0,0,0|2,0,0]=4 5446 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Cl 11a_100020643315_100011934004 [0,2,0,0,0,0|2,0,0]=4 5447 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Cl 1626a_100020643315_100011934004 [0,2,0,0,0,0|2,0,0]=4 5448 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Cl 240690a_100020643315_100011934004 [0,2,0,0,0,0|2,0,0]=4 5449 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)Cl 527a_100020643315_100011934004 [0,2,0,0,0,0|2,0,0]=4 5450 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)F 11a_100020643315_100011218433 [0,2,0,0,0,0|2,0,0]=4 5451 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)F 1626a_100020643315_100011218433 [0,2,0,0,0,0|2,0,0]=4 5452 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)F 240690a_100020643315_100011218433 [0,2,0,0,0,0|2,0,0]=4 5453 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)F)F 527a_100020643315_100011218433 [0,2,0,0,0,0|2,0,0]=4 5454 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100000689802 [0,2,0,0,0,0|2,0,0]=4 5455 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100000689802 [0,2,0,0,0,0|2,0,0]=4 5456 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Br 527a_100000751335_100000689802 [0,2,0,0,0,0|2,0,0]=4 5457 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)C 1626a_100000751335_100000187929 [0,2,0,0,0,0|2,0,0]=4 5458 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)C 240690a_100000751335_100000187929 [0,2,0,0,0,0|2,0,0]=4 5459 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)C 527a_100000751335_100000187929 [0,2,0,0,0,0|2,0,0]=4 5460 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Cl 1626a_100000751335_100011934004 [0,2,0,0,0,0|2,0,0]=4 5461 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Cl 240690a_100000751335_100011934004 [0,2,0,0,0,0|2,0,0]=4 5462 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)Cl 527a_100000751335_100011934004 [0,2,0,0,0,0|2,0,0]=4 5463 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)F 1626a_100000751335_100011218433 [0,2,0,0,0,0|2,0,0]=4 5464 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)F 240690a_100000751335_100011218433 [0,2,0,0,0,0|2,0,0]=4 5465 B17R1.7050 COc1c(cccc1C(=O)NCC(C)(C)O)F 527a_100000751335_100011218433 [0,2,0,0,0,0|2,0,0]=4 5466 B17R1.7659 COc1c(ccc(c1C(=O)CCC(C)C)Cl)Cl 1458a_100000033403_100000210312 [0,2,0,0,0,0|2,0,0]=4 5467 B17R1.7659 COc1c(ccc(c1C(=O)CCC(C)C)F)F 1458a_100000686818_100000210312 [0,2,0,0,0,0|2,0,0]=4 5468 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)Cl)Cl 11a_100000210953_100000033403 [0,2,0,0,0,0|2,0,0]=4 5469 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)Cl)Cl 1626a_100000210953_100000033403 [0,2,0,0,0,0|2,0,0]=4 5470 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)Cl)Cl 240690a_100000210953_100000033403 [0,2,0,0,0,0|2,0,0]=4 5471 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)Cl)Cl 527a_100000210953_100000033403 [0,2,0,0,0,0|2,0,0]=4 5472 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)F)F 11a_100000210953_100000686818 [0,2,0,0,0,0|2,0,0]=4 5473 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)F)F 1626a_100000210953_100000686818 [0,2,0,0,0,0|2,0,0]=4 5474 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)F)F 240690a_100000210953_100000686818 [0,2,0,0,0,0|2,0,0]=4 5475 B17R1.7659 COc1c(ccc(c1C(=O)NCC(C)C)F)F 527a_100000210953_100000686818 [0,2,0,0,0,0|2,0,0]=4 5476 B17R1.28360 CCc1c(cccc1C(=O)CCC(C)C)OC 1458a_100000101922_100000210312 [0,2,0,0,0,0|2,0,0]=4 5477 B17R1.28360 CCc1c(cccc1C(=O)NCC(C)C)OC 11a_100000210953_100000101922 [0,2,0,0,0,0|2,0,0]=4 5478 B17R1.28360 CCc1c(cccc1C(=O)NCC(C)C)OC 1626a_100000210953_100000101922 [0,2,0,0,0,0|2,0,0]=4 5479 B17R1.28360 CCc1c(cccc1C(=O)NCC(C)C)OC 240690a_100000210953_100000101922 [0,2,0,0,0,0|2,0,0]=4 5480 B17R1.28360 CCc1c(cccc1C(=O)NCC(C)C)OC 527a_100000210953_100000101922 [0,2,0,0,0,0|2,0,0]=4 5481 B17R1.28360 COc1cccc(c1OC)C(=O)CCC(C)C 1458a_100000210806_100000210312 [0,2,0,0,0,0|2,0,0]=4 5482 B17R1.28360 COc1cccc(c1OC)C(=O)NCC(C)C 11a_100000210953_100000210806 [0,2,0,0,0,0|2,0,0]=4 5483 B17R1.28360 COc1cccc(c1OC)C(=O)NCC(C)C 1626a_100000210953_100000210806 [0,2,0,0,0,0|2,0,0]=4 5484 B17R1.28360 COc1cccc(c1OC)C(=O)NCC(C)C 240690a_100000210953_100000210806 [0,2,0,0,0,0|2,0,0]=4 5485 B17R1.28360 COc1cccc(c1OC)C(=O)NCC(C)C 527a_100000210953_100000210806 [0,2,0,0,0,0|2,0,0]=4 5486 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)Br 1458a_100011593405_100000755188 [0,2,0,0,0,0|2,0,0]=4 5487 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)C 1458a_100000066212_100000755188 [0,2,0,0,0,0|2,0,0]=4 5488 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)Cl 1458a_100000743539_100000755188 [0,2,0,0,0,0|2,0,0]=4 5489 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)F 1458a_100000759380_100000755188 [0,2,0,0,0,0|2,0,0]=4 5490 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)I 1458a_100010179659_100000755188 [0,2,0,0,0,0|2,0,0]=4 5491 B17R1.155155 COc1cccc(c1C(=O)CCC(C)(C)C)O 1458a_100000043310_100000755188 [0,2,0,0,0,0|2,0,0]=4 5492 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Br 11a_100000743828_100011593405 [0,2,0,0,0,0|2,0,0]=4 5493 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Br 1626a_100000743828_100011593405 [0,2,0,0,0,0|2,0,0]=4 5494 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Br 240690a_100000743828_100011593405 [0,2,0,0,0,0|2,0,0]=4 5495 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Br 527a_100000743828_100011593405 [0,2,0,0,0,0|2,0,0]=4 5496 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)C 11a_100000743828_100000066212 [0,2,0,0,0,0|2,0,0]=4 5497 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)C 1626a_100000743828_100000066212 [0,2,0,0,0,0|2,0,0]=4 5498 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)C 240690a_100000743828_100000066212 [0,2,0,0,0,0|2,0,0]=4 5499 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Cl 11a_100000743828_100000743539 [0,2,0,0,0,0|2,0,0]=4 5500 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Cl 1626a_100000743828_100000743539 [0,2,0,0,0,0|2,0,0]=4 5501 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Cl 240690a_100000743828_100000743539 [0,2,0,0,0,0|2,0,0]=4 5502 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)Cl 527a_100000743828_100000743539 [0,2,0,0,0,0|2,0,0]=4 5503 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)F 11a_100000743828_100000759380 [0,2,0,0,0,0|2,0,0]=4 5504 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)F 1626a_100000743828_100000759380 [0,2,0,0,0,0|2,0,0]=4 5505 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)F 240690a_100000743828_100000759380 [0,2,0,0,0,0|2,0,0]=4 5506 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)F 527a_100000743828_100000759380 [0,2,0,0,0,0|2,0,0]=4 5507 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)I 11a_100000743828_100010179659 [0,2,0,0,0,0|2,0,0]=4 5508 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)I 1626a_100000743828_100010179659 [0,2,0,0,0,0|2,0,0]=4 5509 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)I 240690a_100000743828_100010179659 [0,2,0,0,0,0|2,0,0]=4 5510 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)I 527a_100000743828_100010179659 [0,2,0,0,0,0|2,0,0]=4 5511 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)C)O 240690a_100000743828_100000043310 [0,2,0,0,0,0|2,0,0]=4 5512 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Br 11a_100020643315_100011593405 [0,2,0,0,0,0|2,0,0]=4 5513 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Br 1626a_100020643315_100011593405 [0,2,0,0,0,0|2,0,0]=4 5514 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Br 240690a_100020643315_100011593405 [0,2,0,0,0,0|2,0,0]=4 5515 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Br 527a_100020643315_100011593405 [0,2,0,0,0,0|2,0,0]=4 5516 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)C 11a_100020643315_100000066212 [0,2,0,0,0,0|2,0,0]=4 5517 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)C 1626a_100020643315_100000066212 [0,2,0,0,0,0|2,0,0]=4 5518 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)C 240690a_100020643315_100000066212 [0,2,0,0,0,0|2,0,0]=4 5519 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Cl 11a_100020643315_100000743539 [0,2,0,0,0,0|2,0,0]=4 5520 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Cl 1626a_100020643315_100000743539 [0,2,0,0,0,0|2,0,0]=4 5521 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Cl 240690a_100020643315_100000743539 [0,2,0,0,0,0|2,0,0]=4 5522 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)Cl 527a_100020643315_100000743539 [0,2,0,0,0,0|2,0,0]=4 5523 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)F 11a_100020643315_100000759380 [0,2,0,0,0,0|2,0,0]=4 5524 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)F 1626a_100020643315_100000759380 [0,2,0,0,0,0|2,0,0]=4 5525 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)F 240690a_100020643315_100000759380 [0,2,0,0,0,0|2,0,0]=4 5526 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)F 527a_100020643315_100000759380 [0,2,0,0,0,0|2,0,0]=4 5527 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)I 11a_100020643315_100010179659 [0,2,0,0,0,0|2,0,0]=4 5528 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)I 1626a_100020643315_100010179659 [0,2,0,0,0,0|2,0,0]=4 5529 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)I 240690a_100020643315_100010179659 [0,2,0,0,0,0|2,0,0]=4 5530 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)I 527a_100020643315_100010179659 [0,2,0,0,0,0|2,0,0]=4 5531 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)F)O 240690a_100020643315_100000043310 [0,2,0,0,0,0|2,0,0]=4 5532 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Br 1626a_100000751335_100011593405 [0,2,0,0,0,0|2,0,0]=4 5533 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Br 240690a_100000751335_100011593405 [0,2,0,0,0,0|2,0,0]=4 5534 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Br 527a_100000751335_100011593405 [0,2,0,0,0,0|2,0,0]=4 5535 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)C 1626a_100000751335_100000066212 [0,2,0,0,0,0|2,0,0]=4 5536 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)C 240690a_100000751335_100000066212 [0,2,0,0,0,0|2,0,0]=4 5537 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Cl 1626a_100000751335_100000743539 [0,2,0,0,0,0|2,0,0]=4 5538 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Cl 240690a_100000751335_100000743539 [0,2,0,0,0,0|2,0,0]=4 5539 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)Cl 527a_100000751335_100000743539 [0,2,0,0,0,0|2,0,0]=4 5540 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)F 1626a_100000751335_100000759380 [0,2,0,0,0,0|2,0,0]=4 5541 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)F 240690a_100000751335_100000759380 [0,2,0,0,0,0|2,0,0]=4 5542 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)F 527a_100000751335_100000759380 [0,2,0,0,0,0|2,0,0]=4 5543 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)I 1626a_100000751335_100010179659 [0,2,0,0,0,0|2,0,0]=4 5544 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)I 240690a_100000751335_100010179659 [0,2,0,0,0,0|2,0,0]=4 5545 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)I 527a_100000751335_100010179659 [0,2,0,0,0,0|2,0,0]=4 5546 B17R1.155155 COc1cccc(c1C(=O)NCC(C)(C)O)O 240690a_100000751335_100000043310 [0,2,0,0,0,0|2,0,0]=4 5547 B17R1.28529 CCc1cccc(c1C(=O)CCC(C)C)CC 1458a_100000092080_100000210312 [0,2,0,0,0,0|2,0,0]=4 5548 B17R1.28529 CCc1cccc(c1C(=O)NCC(C)C)CC 11a_100000210953_100000092080 [0,2,0,0,0,0|2,0,0]=4 5549 B17R1.28529 CCc1cccc(c1C(=O)NCC(C)C)CC 1626a_100000210953_100000092080 [0,2,0,0,0,0|2,0,0]=4 5550 B17R1.28529 CCc1cccc(c1C(=O)NCC(C)C)CC 240690a_100000210953_100000092080 [0,2,0,0,0,0|2,0,0]=4 5551 B17R1.28529 COc1cccc(c1C(=O)CCC(C)C)OC 1458a_100000188675_100000210312 [0,2,0,0,0,0|2,0,0]=4 5552 B17R1.28529 COc1cccc(c1C(=O)NCC(C)C)OC 11a_100000210953_100000188675 [0,2,0,0,0,0|2,0,0]=4 5553 B17R1.28529 COc1cccc(c1C(=O)NCC(C)C)OC 240690a_100000210953_100000188675 [0,2,0,0,0,0|2,0,0]=4 5554 B17R1.28529 COc1cccc(c1C(=O)NCC(C)C)OC 527a_100000210953_100000188675 [0,2,0,0,0,0|2,0,0]=4 5555 B15R1.355 CC(C)CCC(=O)C=Cc1ccnn1C 1458a_100102528386_100000210312 [0,0,1,1,0,0|2,0,0]=4 5556 B15R1.355 CC(C)CNC(=O)C=Cc1ccnn1C 11a_100000210953_100102528386 [0,0,1,1,0,0|2,0,0]=4 5557 B15R1.355 CC(C)CNC(=O)C=Cc1ccnn1C 1626a_100000210953_100102528386 [0,0,1,1,0,0|2,0,0]=4 5558 B15R1.355 CC(C)CNC(=O)C=Cc1ccnn1C 240690a_100000210953_100102528386 [0,0,1,1,0,0|2,0,0]=4 5559 B15R1.985 CNC(=O)c1ccccc1OCC(C)C 34a_100000185920_100000210624 [0,0,1,1,0,0|2,0,0]=4 5560 B15R1.985 CNC(=O)c1ccccc1OCC(C)C 7a_100000185920_100000210760 [0,0,1,1,0,0|2,0,0]=4 5561 B15R2.6 CC(C)COC1CCc2c1cccc2 34a_100000212247_100000210624 [1,0,0,1,0,0|1,0,1]=4 5562 B15R2.6 CC(C)COC1CCc2c1cccc2 7a_100000212247_100000210760 [1,0,0,1,0,0|1,0,1]=4 5563 B15R2.6 CC(C)COc1csc2c1cccc2 34a_100000077758_100000210624 [1,0,0,1,0,0|1,0,1]=4 5564 B15R2.6 CC(C)COc1csc2c1cccc2 7a_100000077758_100000210760 [1,0,0,1,0,0|1,0,1]=4 5565 B15R2.6 CC(C)CSc1n[nH]c2c1cccc2 62a_100000210624_100000050141 [1,0,0,1,0,0|1,1,0]=4 5566 B15R2.629 CC(C)Oc1cc2ccccc2n1C 34a_100000066695_100000210206 [1,0,0,1,0,0|2,0,0]=4 5567 B15R2.629 CN(C)Cc1cc2ccccc2n1C 2230a_100011997959_200000210301 [1,0,0,1,0,0|2,0,0]=4 5568 B15R2.629 CN(C)Cc1cc2ccccc2n1C 269982a_100011997959_200000210301 [1,0,0,1,0,0|2,0,0]=4 5569 B15R2.629 CN(C)Cc1cc2ccccc2n1C 270004a_100102631434_100000033373 [1,0,0,1,0,0|2,0,0]=4 5570 B15R2.629 CN([13CH3])Cc1cc2ccccc2n1C 2230a_100011997959_200025704644 [1,0,0,1,0,0|2,0,0]=4 5571 B15R2.629 CN([13CH3])Cc1cc2ccccc2n1C 269982a_100011997959_200025704644 [1,0,0,1,0,0|2,0,0]=4 5572 B15R2.4931 CCc1ccccc1COCC2CC2 34a_100011663872_100000742324 [1,0,0,1,0,0|1,0,1]=4 5573 B15R2.4931 CCc1ccccc1COCC2CC2 7a_100011663872_100000742324 [1,0,0,1,0,0|1,0,1]=4 5574 B15R2.4931 CNc1ccccc1OCCC2CC2 34a_100000033821_100000694398 [1,0,0,1,0,0|2,0,0]=4 5575 B15R2.4931 CNc1ccccc1SCCC2CC2 62a_100000764125_100020606079 [1,0,0,1,0,0|2,0,0]=4 5576 B15R2.4931 CNc1ccccc1SCCC2CC2 62a_100020606079_100000764125 [1,0,0,1,0,0|2,0,0]=4 5577 B15R2.4931 COc1ccccc1COCC2CC2 34a_100000211283_100000210004 [1,0,0,1,0,0|1,0,1]=4 5578 B15R2.4931 COc1ccccc1COCC2CC2 34a_100000211301_100000742324 [1,0,0,1,0,0|1,0,1]=4 5579 B15R2.4931 CSc1ccccc1COCC2CC2 34a_100000211283_100000699184 [1,0,0,1,0,0|1,0,1]=4 5580 B15R2.4931 CSc1ccccc1COCC2CC2 34a_100000699167_100000742324 [1,0,0,1,0,0|1,0,1]=4 5581 B15R2.308 CC1CC=C(CC1)c2ccccc2N 271570a_100010240233_100000210017 [1,0,0,1,0,0|2,0,0]=4 5582 B15R2.308 Cc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100000210755 [1,0,0,1,0,0|2,0,0]=4 5583 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 11a_100000702820_100000188424 [1,0,0,1,0,0|2,0,0]=4 5584 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 240690a_100000702820_100000188424 [1,0,0,1,0,0|2,0,0]=4 5585 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Br 527a_100000702820_100000188424 [1,0,0,1,0,0|2,0,0]=4 5586 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 11a_100000702820_100000185844 [1,0,0,1,0,0|2,0,0]=4 5587 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 240690a_100000702820_100000185844 [1,0,0,1,0,0|2,0,0]=4 5588 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2Cl 527a_100000702820_100000185844 [1,0,0,1,0,0|2,0,0]=4 5589 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 11a_100000702820_100000188656 [1,0,0,1,0,0|2,0,0]=4 5590 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 240690a_100000702820_100000188656 [1,0,0,1,0,0|2,0,0]=4 5591 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2F 527a_100000702820_100000188656 [1,0,0,1,0,0|2,0,0]=4 5592 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 11a_100000702820_100000187884 [1,0,0,1,0,0|2,0,0]=4 5593 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 240690a_100000702820_100000187884 [1,0,0,1,0,0|2,0,0]=4 5594 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2I 527a_100000702820_100000187884 [1,0,0,1,0,0|2,0,0]=4 5595 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2O 240690a_100000702820_100015234032 [1,0,0,1,0,0|2,0,0]=4 5596 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2[O-] 240690a_100000702820_100009911694 [1,0,0,1,0,0|2,0,0]=4 5597 B15R2.7432 CC1CN(C1)C(=O)c2ccccc2[O-] 527a_100000702820_100009911694 [1,0,0,1,0,0|2,0,0]=4 5598 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000212026 [1,0,0,1,0,0|1,0,0]=3 5599 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000212026 [1,0,0,1,0,0|1,0,0]=3 5600 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000212026 [1,0,0,1,0,0|1,0,0]=3 5601 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100000212026 [1,0,0,1,0,0|2,0,0]=4 5602 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100000212026 [1,0,0,1,0,0|2,0,0]=4 5603 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100000212026 [1,0,0,1,0,0|2,0,0]=4 5604 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100000212026 [1,0,0,1,0,0|2,0,0]=4 5605 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100000212026 [1,0,0,1,0,0|2,0,0]=4 5606 B15R2.7432 Cc1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100000212026 [1,0,0,1,0,0|2,0,0]=4 5607 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100000212026 [1,0,0,1,0,0|2,0,0]=4 5608 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100000212026 [1,0,0,1,0,0|2,0,0]=4 5609 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100000212026 [1,0,0,1,0,0|2,0,0]=4 5610 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100000212026 [1,0,0,1,0,0|2,0,0]=4 5611 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100000212026 [1,0,0,1,0,0|2,0,0]=4 5612 B15R2.7464 Cc1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100000212026 [1,0,0,1,0,0|2,0,0]=4 5613 B15R2.7474 CC1(COC(=N1)c2ccccc2O)C 271570a_203496583355_100000695370 [1,0,0,1,0,0|2,0,0]=4 5614 B15R2.8805 CC(OCC1CC1)c2ccccc2N 7a_100011405641_100000742324 [1,0,0,1,0,0|1,0,1]=4 5615 B15R2.8805 Cc1ccccc1C(=O)CCC2CC2 1458a_100000212026_100000694398 [1,0,0,1,0,0|1,0,0]=3 5616 B15R2.8805 Cc1ccccc1C(=O)CCC2CO2 1458a_100000212026_100000732470 [1,0,0,1,0,0|2,0,0]=4 5617 B15R2.8805 Cc1ccccc1C(=O)CNC2CC2 34a_100000212008_100000741374 [1,0,0,1,0,0|2,0,0]=4 5618 B15R2.8805 Cc1ccccc1C(=O)CSC2CC2 62a_100000741374_100000211595 [1,0,0,1,0,0|2,0,0]=4 5619 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000212026 [1,0,0,1,0,0|1,0,0]=3 5620 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000212026 [1,0,0,1,0,0|1,0,0]=3 5621 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000212026 [1,0,0,1,0,0|1,0,0]=3 5622 B15R2.8805 Cc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000212026 [1,0,0,1,0,0|1,0,0]=3 5623 B15R2.8805 Cc1ccccc1C(=O)NNC2CC2 22a_100000701032_100000212026 [1,0,0,1,0,0|2,0,0]=4 5624 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 34a_100000742021_100000742324 [1,0,0,1,0,0|1,0,1]=4 5625 B15R2.8805 Cc1ccccc1C(C)OCC2CC2 7a_100000742021_100000742324 [1,0,0,1,0,0|1,0,1]=4 5626 B15R2.8805 O=C(CCC1CC1)c2ccccc2Br 1458a_100000188424_100000694398 [1,0,0,1,0,0|2,0,0]=4 5627 B15R2.8805 O=C(CCC1CC1)c2ccccc2Cl 1458a_100000185844_100000694398 [1,0,0,1,0,0|2,0,0]=4 5628 B15R2.8805 O=C(CCC1CC1)c2ccccc2F 1458a_100000188656_100000694398 [1,0,0,1,0,0|2,0,0]=4 5629 B15R2.8805 O=C(CCC1CC1)c2ccccc2I 1458a_100000187884_100000694398 [1,0,0,1,0,0|2,0,0]=4 5630 B15R2.8805 O=C(CCC1CC1)c2ccccc2O 1458a_100015234032_100000694398 [1,0,0,1,0,0|2,0,0]=4 5631 B15R2.8805 O=C(CCC1CC1)c2ccccc2[O-] 1458a_100009911694_100000694398 [1,0,0,1,0,0|2,0,0]=4 5632 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 11a_100000735609_100000188424 [1,0,0,1,0,0|2,0,0]=4 5633 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 1626a_100000735609_100000188424 [1,0,0,1,0,0|2,0,0]=4 5634 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 240690a_100000735609_100000188424 [1,0,0,1,0,0|2,0,0]=4 5635 B15R2.8805 O=C(NCC1CC1)c2ccccc2Br 527a_100000735609_100000188424 [1,0,0,1,0,0|2,0,0]=4 5636 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 11a_100000735609_100000185844 [1,0,0,1,0,0|2,0,0]=4 5637 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 1626a_100000735609_100000185844 [1,0,0,1,0,0|2,0,0]=4 5638 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 240690a_100000735609_100000185844 [1,0,0,1,0,0|2,0,0]=4 5639 B15R2.8805 O=C(NCC1CC1)c2ccccc2Cl 527a_100000735609_100000185844 [1,0,0,1,0,0|2,0,0]=4 5640 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 11a_100000735609_100000188656 [1,0,0,1,0,0|2,0,0]=4 5641 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 1626a_100000735609_100000188656 [1,0,0,1,0,0|2,0,0]=4 5642 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 240690a_100000735609_100000188656 [1,0,0,1,0,0|2,0,0]=4 5643 B15R2.8805 O=C(NCC1CC1)c2ccccc2F 527a_100000735609_100000188656 [1,0,0,1,0,0|2,0,0]=4 5644 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 11a_100000735609_100000187884 [1,0,0,1,0,0|2,0,0]=4 5645 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 1626a_100000735609_100000187884 [1,0,0,1,0,0|2,0,0]=4 5646 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 240690a_100000735609_100000187884 [1,0,0,1,0,0|2,0,0]=4 5647 B15R2.8805 O=C(NCC1CC1)c2ccccc2I 527a_100000735609_100000187884 [1,0,0,1,0,0|2,0,0]=4 5648 B15R2.8805 O=C(NCC1CC1)c2ccccc2O 240690a_100000735609_100015234032 [1,0,0,1,0,0|2,0,0]=4 5649 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 1626a_100000735609_100009911694 [1,0,0,1,0,0|2,0,0]=4 5650 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 240690a_100000735609_100009911694 [1,0,0,1,0,0|2,0,0]=4 5651 B15R2.8805 O=C(NCC1CC1)c2ccccc2[O-] 527a_100000735609_100009911694 [1,0,0,1,0,0|2,0,0]=4 5652 B15R2.21 CCc1ccccc1C2=CCCCO2 271570a_100010177797_100011215823 [1,0,0,1,0,0|2,0,0]=4 5653 B15R2.21 CNc1ccccc1C2=CCCCC2 271570a_100000062251_100020606079 [1,0,0,1,0,0|2,0,0]=4 5654 B15R2.21 CNc1ccccc1C2=CCCCO2 271570a_100010177797_100020606079 [1,0,0,1,0,0|1,0,0]=3 5655 B15R2.21 CNc1cccnc1C2=CCCCO2 271570a_100010177797_200011806188 [1,0,0,1,0,0|2,0,0]=4 5656 B15R2.21 CNc1ccncc1C2=CCCCO2 271570a_100010177797_100010069531 [1,0,0,1,0,0|2,0,0]=4 5657 B15R2.21 CNc1ncccc1C2=CCCCO2 271570a_100010177797_100000700899 [1,0,0,1,0,0|2,0,0]=4 5658 B15R2.21 COc1ccccc1C2=CCCCO2 271570a_100010177797_100000174000 [1,0,0,1,0,0|2,0,0]=4 5659 B15R2.21 CSc1ccccc1C2=CCCCO2 271570a_100010177797_100011217816 [1,0,0,1,0,0|2,0,0]=4 5660 B15R2.21 NNc1ccccc1C2=CCCCO2 271570a_100010177797_100000241748 [1,0,0,1,0,0|2,0,0]=4 5661 B15R2.1428 CCCCc1nn(c2c1cccc2)C 271570a_100020621405_100009817141 [1,0,0,1,0,0|2,0,0]=4 5662 B15R2.1428 CCCSc1nn(c2c1cccc2)C 62a_100000210303_100009817141 [1,0,0,1,0,0|1,1,0]=4 5663 B15R2.1428 CCCSc1nn(c2c1cccc2)C 62a_100009817141_100000210303 [1,0,0,1,0,0|1,1,0]=4 5664 B15R2.4952 CCc1ccccc1C(=O)CC2CC2 1458a_100000689120_100000742324 [1,0,0,1,0,0|2,0,0]=4 5665 B15R2.4952 CCc1ccccc1C(=O)NC2CC2 1626a_100000212008_100000689120 [1,0,0,1,0,0|2,0,0]=4 5666 B15R2.4952 CCc1ccccc1C(=O)NC2CC2 240690a_100000212008_100000689120 [1,0,0,1,0,0|2,0,0]=4 5667 B15R2.4952 CCc1ccccc1C(=O)NC2CC2 527a_100000212008_100000689120 [1,0,0,1,0,0|2,0,0]=4 5668 B15R2.4952 CNc1ccccc1C(=O)NC2CC2 27a_100102657272_200000155669 [1,0,0,1,0,0|1,0,0]=3 5669 B15R2.4952 CNc1ncccc1C(=O)NC2CC2 27a_100102657272_100000160638 [1,0,0,1,0,0|2,0,0]=4 5670 B15R2.4952 COc1ccccc1C(=O)CC2CC2 1458a_100000185835_100000742324 [1,0,0,1,0,0|2,0,0]=4 5671 B15R2.4952 COc1ccccc1C(=O)NC2CC2 1626a_100000212008_100000185835 [1,0,0,1,0,0|2,0,0]=4 5672 B15R2.4952 COc1ccccc1C(=O)NC2CC2 240690a_100000212008_100000185835 [1,0,0,1,0,0|2,0,0]=4 5673 B15R2.4952 COc1ccccc1C(=O)NC2CC2 34a_100000187548_200000210301 [1,0,0,1,0,0|2,0,0]=4 5674 B15R2.4952 COc1ccccc1C(=O)NC2CC2 527a_100000212008_100000185835 [1,0,0,1,0,0|2,0,0]=4 5675 B15R2.4952 COc1ccccc1C(=O)NC2CC2 7a_100000187548_200000210301 [1,0,0,1,0,0|2,0,0]=4 5676 B15R2.4952 CSc1ccccc1C(=O)CC2CC2 1458a_100000183967_100000742324 [1,0,0,1,0,0|2,0,0]=4 5677 B15R2.4952 CSc1ccccc1C(=O)NC2CC2 1626a_100000212008_100000183967 [1,0,0,1,0,0|2,0,0]=4 5678 B15R2.4952 CSc1ccccc1C(=O)NC2CC2 240690a_100000212008_100000183967 [1,0,0,1,0,0|2,0,0]=4 5679 B15R2.4952 CSc1ccccc1C(=O)NC2CC2 527a_100000212008_100000183967 [1,0,0,1,0,0|2,0,0]=4 5680 B15R2.4952 CSc1ccccc1C(=O)NC2CC2 62a_200000155669_200000210301 [1,0,0,1,0,0|2,0,0]=4 5681 B15R2.4952 CSc1ccccc1C(=O)NC2CC2 62a_200000210301_200000155669 [1,0,0,1,0,0|2,0,0]=4 5682 B15R2.4952 [13CH3]Oc1ccccc1C(=O)NC2CC2 34a_100000187548_200025704644 [1,0,0,1,0,0|2,0,0]=4 5683 B15R2.4952 [13CH3]Oc1ccccc1C(=O)NC2CC2 7a_100000187548_200025704644 [1,0,0,1,0,0|2,0,0]=4 5684 B15R2.4952 [13CH3]Sc1ccccc1C(=O)NC2CC2 62a_200000155669_200025704644 [1,0,0,1,0,0|2,0,0]=4 5685 B15R2.4952 [13CH3]Sc1ccccc1C(=O)NC2CC2 62a_200025704644_200000155669 [1,0,0,1,0,0|2,0,0]=4 5686 B15R2.32052 CCc1ccccc1C(=O)C2CCC2 1458a_100000689120_100000749161 [1,0,0,1,0,0|2,0,0]=4 5687 B15R2.32052 CCc1ccccc1C(=O)N2CCC2 11a_100000754969_100000689120 [1,0,0,1,0,0|2,0,0]=4 5688 B15R2.32052 CCc1ccccc1C(=O)N2CCC2 240690a_100000754969_100000689120 [1,0,0,1,0,0|2,0,0]=4 5689 B15R2.32052 CCc1ccccc1C(=O)N2CCC2 527a_100000754969_100000689120 [1,0,0,1,0,0|2,0,0]=4 5690 B15R2.32052 COc1ccccc1C(=O)C2CCC2 1458a_100000185835_100000749161 [1,0,0,1,0,0|2,0,0]=4 5691 B15R2.32052 COc1ccccc1C(=O)N2CCC2 11a_100000754969_100000185835 [1,0,0,1,0,0|2,0,0]=4 5692 B15R2.32052 COc1ccccc1C(=O)N2CCC2 240690a_100000754969_100000185835 [1,0,0,1,0,0|2,0,0]=4 5693 B15R2.32052 COc1ccccc1C(=O)N2CCC2 527a_100000754969_100000185835 [1,0,0,1,0,0|2,0,0]=4 5694 B15R2.32052 CSc1ccccc1C(=O)C2CCC2 1458a_100000183967_100000749161 [1,0,0,1,0,0|2,0,0]=4 5695 B15R2.32052 CSc1ccccc1C(=O)N2CCC2 11a_100000754969_100000183967 [1,0,0,1,0,0|2,0,0]=4 5696 B15R2.32052 CSc1ccccc1C(=O)N2CCC2 240690a_100000754969_100000183967 [1,0,0,1,0,0|2,0,0]=4 5697 B15R2.32052 CSc1ccccc1C(=O)N2CCC2 527a_100000754969_100000183967 [1,0,0,1,0,0|2,0,0]=4 5698 B15R2.20946 CC1(OC(=O)c2c1ccnc2S[13CH3])C 62a_200025704644_100000057204 [0,0,0,1,1,0|2,0,0]=4 5699 B15R2.20946 CC1CC(c2c1c(ccc2)N[13CH3])(C)C 2230a_100102513154_200025704644 [0,0,0,1,1,0|1,0,1]=4 5700 B15R2.20946 CC1CC(c2c1c(ccc2)N[13CH3])(C)C 34a_100102513154_200025704644 [0,0,0,1,1,0|1,0,1]=4 5701 B15R2.20946 CC1CC(c2c1c(ccc2)N[13CH3])(C)C 7a_100102513154_200025704644 [0,0,0,1,1,0|1,0,1]=4 5702 B15R2.20946 CNc1cccc2c1C(CC2(C)C)C 2230a_100102513154_200000210301 [0,0,0,1,1,0|1,0,1]=4 5703 B15R2.20946 CNc1cccc2c1C(CC2(C)C)C 34a_100102513154_200000210301 [0,0,0,1,1,0|1,0,1]=4 5704 B15R2.20946 CNc1cccc2c1C(CC2(C)C)C 7a_100102513154_200000210301 [0,0,0,1,1,0|1,0,1]=4 5705 B15R2.20946 CNc1nccc2c1C(=O)OC2(C)C 27a_100102657272_100000057204 [0,0,0,1,1,0|1,0,0]=3 5706 B15R2.20946 CSc1nccc2c1C(=O)OC2(C)C 62a_200000210301_100000057204 [0,0,0,1,1,0|2,0,0]=4 5707 B15R2.53147 CC(C)Sc1nn(c2c1cccc2)C 62a_100000210206_100009817141 [0,0,0,1,1,0|1,1,0]=4 5708 B15R2.53147 CC(C)Sc1nn(c2c1cccc2)C 62a_100009817141_100000210206 [0,0,0,1,1,0|1,1,0]=4 5709 B15R2.53147 CN(C)Cc1nn(c2c1cccc2)C 270004a_100102631434_100011361492 [0,0,0,1,1,0|2,0,0]=4 5710 B15R2.86986 CNc1cccc2c1c(=O)oc(n2)C 27a_100102657272_200010128068 [0,0,0,1,1,0|1,0,1]=4 5711 B17R2.877 CC(C)CCC(=O)C1CCc2c1cccc2 1458a_100000750891_100000210312 [0,0,0,1,0,1|2,0,0]=4 5712 B17R2.877 CC(C)CNC(=O)C1CCc2c1cccc2 11a_100000210953_100000750891 [0,0,0,1,0,1|2,0,0]=4 5713 B17R2.877 CC(C)CNC(=O)C1CCc2c1cccc2 1626a_100000210953_100000750891 [0,0,0,1,0,1|2,0,0]=4 5714 B17R2.877 CC(C)CNC(=O)C1CCc2c1cccc2 240690a_100000210953_100000750891 [0,0,0,1,0,1|2,0,0]=4 5715 B17R2.877 CC(C)CNC(=O)C1CCc2c1cccc2 527a_100000210953_100000750891 [0,0,0,1,0,1|2,0,0]=4 5716 B17R2.12455 CCc1ccccc1NC(=O)C2CC(C2)C 11a_100000212081_100000686124 [0,0,0,1,0,1|2,0,0]=4 5717 B17R2.12455 CCc1ccccc1NC(=O)C2CC(C2)C 1626a_100000212081_100000686124 [0,0,0,1,0,1|2,0,0]=4 5718 B17R2.12455 CCc1ccccc1NC(=O)C2CC(C2)C 22a_100000212081_100000686124 [0,0,0,1,0,1|2,0,0]=4 5719 B17R2.12455 CCc1ccccc1NC(=O)C2CC(C2)C 527a_100000212081_100000686124 [0,0,0,1,0,1|2,0,0]=4 5720 B17R2.12455 CCc1ccccc1NC(=O)N2CC(C2)C 2430a_100000212081_100000702820 [0,0,0,1,0,1|2,0,0]=4 5721 B17R2.12455 COc1ccccc1CC(=O)C2CC(C2)C 1458a_100000686124_100000210004 [0,0,0,1,0,1|2,0,0]=4 5722 B17R2.12455 COc1ccccc1CC(=O)N2CC(C2)C 11a_100000702820_100000211604 [0,0,0,1,0,1|2,0,0]=4 5723 B17R2.12455 COc1ccccc1CC(=O)N2CC(C2)C 240690a_100000702820_100000211604 [0,0,0,1,0,1|2,0,0]=4 5724 B17R2.12455 COc1ccccc1CC(=O)N2CC(C2)C 527a_100000702820_100000211604 [0,0,0,1,0,1|2,0,0]=4 5725 B17R2.12455 COc1ccccc1NC(=O)C2CC(C2)C 11a_100000210025_100000686124 [0,0,0,1,0,1|2,0,0]=4 5726 B17R2.12455 COc1ccccc1NC(=O)C2CC(C2)C 1626a_100000210025_100000686124 [0,0,0,1,0,1|2,0,0]=4 5727 B17R2.12455 COc1ccccc1NC(=O)C2CC(C2)C 22a_100000210025_100000686124 [0,0,0,1,0,1|2,0,0]=4 5728 B17R2.12455 COc1ccccc1NC(=O)C2CC(C2)C 527a_100000210025_100000686124 [0,0,0,1,0,1|2,0,0]=4 5729 B17R2.12455 COc1ccccc1NC(=O)N2CC(C2)C 2430a_100000210025_100000702820 [0,0,0,1,0,1|2,0,0]=4 5730 B17R2.12455 CSc1ccccc1CC(=O)C2CC(C2)C 1458a_100000686124_100000699184 [0,0,0,1,0,1|2,0,0]=4 5731 B17R2.12455 CSc1ccccc1NC(=O)C2CC(C2)C 11a_100000211160_100000686124 [0,0,0,1,0,1|2,0,0]=4 5732 B17R2.12455 CSc1ccccc1NC(=O)C2CC(C2)C 22a_100000211160_100000686124 [0,0,0,1,0,1|2,0,0]=4 5733 B17R2.12455 CSc1ccccc1NC(=O)N2CC(C2)C 2430a_100000211160_100000702820 [0,0,0,1,0,1|2,0,0]=4 5734 B17R2.68621 CCc1ccccc1NC(=O)CCC2CC2 11a_100000212081_100000756386 [0,0,0,1,0,1|2,0,0]=4 5735 B17R2.68621 CCc1ccccc1NC(=O)CCC2CC2 1626a_100000212081_100000756386 [0,0,0,1,0,1|2,0,0]=4 5736 B17R2.68621 CCc1ccccc1NC(=O)CCC2CC2 22a_100000212081_100000756386 [0,0,0,1,0,1|2,0,0]=4 5737 B17R2.68621 CCc1ccccc1NC(=O)CCC2CC2 527a_100000212081_100000756386 [0,0,0,1,0,1|2,0,0]=4 5738 B17R2.68621 CCc1ccccc1NC(=O)NCC2CC2 2430a_100000212081_100000735609 [0,0,0,1,0,1|2,0,0]=4 5739 B17R2.68621 COc1ccccc1CC(=O)CCC2CC2 1458a_100000211604_100000694398 [0,0,0,1,0,1|2,0,0]=4 5740 B17R2.68621 COc1ccccc1CC(=O)CCC2CC2 1458a_100000756386_100000210004 [0,0,0,1,0,1|2,0,0]=4 5741 B17R2.68621 COc1ccccc1CC(=O)NCC2CC2 11a_100000735609_100000211604 [0,0,0,1,0,1|2,0,0]=4 5742 B17R2.68621 COc1ccccc1CC(=O)NCC2CC2 1626a_100000735609_100000211604 [0,0,0,1,0,1|2,0,0]=4 5743 B17R2.68621 COc1ccccc1CC(=O)NCC2CC2 240690a_100000735609_100000211604 [0,0,0,1,0,1|2,0,0]=4 5744 B17R2.68621 COc1ccccc1CC(=O)NCC2CC2 527a_100000735609_100000211604 [0,0,0,1,0,1|2,0,0]=4 5745 B17R2.68621 COc1ccccc1NC(=O)CCC2CC2 11a_100000210025_100000756386 [0,0,0,1,0,1|2,0,0]=4 5746 B17R2.68621 COc1ccccc1NC(=O)CCC2CC2 1626a_100000210025_100000756386 [0,0,0,1,0,1|2,0,0]=4 5747 B17R2.68621 COc1ccccc1NC(=O)CCC2CC2 22a_100000210025_100000756386 [0,0,0,1,0,1|2,0,0]=4 5748 B17R2.68621 COc1ccccc1NC(=O)CCC2CC2 527a_100000210025_100000756386 [0,0,0,1,0,1|2,0,0]=4 5749 B17R2.68621 COc1ccccc1NC(=O)NCC2CC2 2430a_100000210025_100000735609 [0,0,0,1,0,1|2,0,0]=4 5750 B17R2.68621 CSc1ccccc1CC(=O)CCC2CC2 1458a_100000756386_100000699184 [0,0,0,1,0,1|2,0,0]=4 5751 B17R2.68621 CSc1ccccc1NC(=O)CCC2CC2 11a_100000211160_100000756386 [0,0,0,1,0,1|2,0,0]=4 5752 B17R2.68621 CSc1ccccc1NC(=O)CCC2CC2 22a_100000211160_100000756386 [0,0,0,1,0,1|2,0,0]=4 5753 B17R2.68621 CSc1ccccc1NC(=O)NCC2CC2 2430a_100000211160_100000735609 [0,0,0,1,0,1|2,0,0]=4 5754 B17R2.68621 CSc1ccccc1NC(=O)NCC2CC2 512a_100000211160_100000735609 [0,0,0,1,0,1|2,0,0]=4 5755 B17R2.105851 CCc1ccccc1NC(=O)[C@H]2CC2(C)C 11a_100000212081_100000692687 [0,0,0,1,0,1|2,0,0]=4 5756 B17R2.105851 CCc1ccccc1NC(=O)[C@H]2CC2(C)C 1626a_100000212081_100000692687 [0,0,0,1,0,1|2,0,0]=4 5757 B17R2.105851 CCc1ccccc1NC(=O)[C@H]2CC2(C)C 22a_100000212081_100000692687 [0,0,0,1,0,1|2,0,0]=4 5758 B17R2.105851 CCc1ccccc1NC(=O)[C@H]2CC2(C)C 527a_100000212081_100000692687 [0,0,0,1,0,1|2,0,0]=4 5759 B17R2.105851 COc1ccccc1CC(=O)[C@H]2CC2(C)C 1458a_100000692687_100000210004 [0,0,0,1,0,1|2,0,0]=4 5760 B17R2.105851 COc1ccccc1NC(=O)[C@H]2CC2(C)C 11a_100000210025_100000692687 [0,0,0,1,0,1|2,0,0]=4 5761 B17R2.105851 COc1ccccc1NC(=O)[C@H]2CC2(C)C 1626a_100000210025_100000692687 [0,0,0,1,0,1|2,0,0]=4 5762 B17R2.105851 COc1ccccc1NC(=O)[C@H]2CC2(C)C 22a_100000210025_100000692687 [0,0,0,1,0,1|2,0,0]=4 5763 B17R2.105851 COc1ccccc1NC(=O)[C@H]2CC2(C)C 527a_100000210025_100000692687 [0,0,0,1,0,1|2,0,0]=4 5764 B17R2.105851 CSc1ccccc1CC(=O)[C@H]2CC2(C)C 1458a_100000692687_100000699184 [0,0,0,1,0,1|2,0,0]=4 5765 B17R2.105851 CSc1ccccc1NC(=O)[C@H]2CC2(C)C 11a_100000211160_100000692687 [0,0,0,1,0,1|2,0,0]=4 5766 B17R2.105851 CSc1ccccc1NC(=O)[C@H]2CC2(C)C 22a_100000211160_100000692687 [0,0,0,1,0,1|2,0,0]=4 5767 B17R2.2723 CCc1ccccc1C(=O)N2CC[C@H](C2)C 11a_100016987628_100000689120 [0,0,0,1,0,1|2,0,0]=4 5768 B17R2.2723 CCc1ccccc1C(=O)N2CC[C@H](C2)C 240690a_100016987628_100000689120 [0,0,0,1,0,1|2,0,0]=4 5769 B17R2.2723 CCc1ccccc1C(=O)N2CC[C@H](C2)C 527a_100016987628_100000689120 [0,0,0,1,0,1|2,0,0]=4 5770 B17R2.2723 COc1ccccc1C(=O)N2CC[C@H](C2)C 11a_100016987628_100000185835 [0,0,0,1,0,1|2,0,0]=4 5771 B17R2.2723 COc1ccccc1C(=O)N2CC[C@H](C2)C 240690a_100016987628_100000185835 [0,0,0,1,0,1|2,0,0]=4 5772 B17R2.2723 COc1ccccc1C(=O)N2CC[C@H](C2)C 527a_100016987628_100000185835 [0,0,0,1,0,1|2,0,0]=4 5773 B17R2.2723 CSc1ccccc1C(=O)N2CC[C@H](C2)C 11a_100016987628_100000183967 [0,0,0,1,0,1|2,0,0]=4 5774 B17R2.2723 CSc1ccccc1C(=O)N2CC[C@H](C2)C 240690a_100016987628_100000183967 [0,0,0,1,0,1|2,0,0]=4 5775 B17R2.2723 CSc1ccccc1C(=O)N2CC[C@H](C2)C 527a_100016987628_100000183967 [0,0,0,1,0,1|2,0,0]=4 5776 B17R2.12561 COc1ccccc1C(=O)CN2CC(C2)C 269982a_100000702820_100000195505 [0,0,0,1,0,1|2,0,0]=4 5777 B17R2.12561 COc1ccccc1C(=O)CN2CC(C2)C 34a_100000702820_100000195505 [0,0,0,1,0,1|2,0,0]=4 5778 B17R2.12608 CC(C)[C@@H]1COC(=N1)c2ccccc2S[13CH3] 62a_100015289593_200025704644 [0,0,0,1,0,1|2,0,0]=4 5779 B17R2.12608 CC(C)[C@H]1COC(=N1)c2ccccc2O[13CH3] 34a_100034010439_200025704644 [0,0,0,1,0,1|2,0,0]=4 5780 B17R2.12608 CNc1ccccc1C2=N[C@@H](CO2)C(C)C 27a_100102657272_100015289593 [0,0,0,1,0,1|1,0,0]=3 5781 B17R2.12608 CNc1ccccc1c2noc(n2)C(C)C 270196a_100000744078_100000210198 [0,0,0,1,0,1|1,0,1]=4 5782 B17R2.12608 COc1ccccc1C2=N[C@H](CO2)C(C)C 34a_100034010439_200000210301 [0,0,0,1,0,1|2,0,0]=4 5783 B17R2.12608 CSc1ccccc1C2=N[C@@H](CO2)C(C)C 62a_100015289593_200000210301 [0,0,0,1,0,1|2,0,0]=4 5784 B17R2.62884 CCc1ccccc1C(=O)NCCC2CC2 1626a_100000764129_100000689120 [0,0,0,1,0,1|2,0,0]=4 5785 B17R2.62884 CCc1ccccc1C(=O)NCCC2CC2 240690a_100000764129_100000689120 [0,0,0,1,0,1|2,0,0]=4 5786 B17R2.62884 CCc1ccccc1C(=O)NCCC2CC2 527a_100000764129_100000689120 [0,0,0,1,0,1|2,0,0]=4 5787 B17R2.62884 CCc1ccccc1C(=O)NNCC2CC2 22a_100000736359_100000689120 [0,0,0,1,0,1|2,0,0]=4 5788 B17R2.62884 CNc1ccccc1C(=NNCC2CC2)C 4a_100000736359_100000020593 [0,0,0,1,0,1|2,0,0]=4 5789 B17R2.62884 COc1ccccc1C(=O)CNCC2CC2 34a_100000735609_100000195505 [0,0,0,1,0,1|2,0,0]=4 5790 B17R2.62884 COc1ccccc1C(=O)COCC2CC2 34a_100000211283_100000195505 [0,0,0,1,0,1|1,0,0]=3 5791 B17R2.62884 COc1ccccc1C(=O)COC[C@@H]2CO2 34a_100000757423_100000195505 [0,0,0,1,0,1|2,0,0]=4 5792 B17R2.62884 COc1ccccc1C(=O)CSCC2CC2 62a_100000195505_100000742324 [0,0,0,1,0,1|1,1,0]=4 5793 B17R2.62884 COc1ccccc1C(=O)NCCC2CC2 1626a_100000764129_100000185835 [0,0,0,1,0,1|2,0,0]=4 5794 B17R2.62884 COc1ccccc1C(=O)NCCC2CC2 240690a_100000764129_100000185835 [0,0,0,1,0,1|2,0,0]=4 5795 B17R2.62884 COc1ccccc1C(=O)NCCC2CC2 527a_100000764129_100000185835 [0,0,0,1,0,1|2,0,0]=4 5796 B17R2.62884 COc1ccccc1C(=O)NNCC2CC2 22a_100000736359_100000185835 [0,0,0,1,0,1|2,0,0]=4 5797 B17R2.62884 CSc1ccccc1C(=O)NCCC2CC2 1626a_100000764129_100000183967 [0,0,0,1,0,1|2,0,0]=4 5798 B17R2.62884 CSc1ccccc1C(=O)NCCC2CC2 240690a_100000764129_100000183967 [0,0,0,1,0,1|2,0,0]=4 5799 B17R2.62884 CSc1ccccc1C(=O)NCCC2CC2 527a_100000764129_100000183967 [0,0,0,1,0,1|2,0,0]=4 5800 B17R2.62884 CSc1ccccc1C(=O)NNCC2CC2 22a_100000736359_100000183967 [0,0,0,1,0,1|2,0,0]=4 5801 B17R2.78537 CC(C)CC=Cc1nn(c2c1cccc2)C 271570a_100016259101_100009817141 [0,0,0,1,0,1|2,0,0]=4 5802 B17R2.78537 CC(C)CCSc1nn(c2c1cccc2)C 62a_100000210312_100009817141 [0,0,0,1,0,1|1,1,0]=4 5803 B17R2.78537 CC(C)CCSc1nn(c2c1cccc2)C 62a_100009817141_100000210312 [0,0,0,1,0,1|1,1,0]=4 5804 B17R2.78537 CC(C)CNCc1cn(c2c1cccc2)C 270004a_100011997738_100000210432 [0,0,0,1,0,1|2,0,0]=4 5805 B17R2.78537 CC(C)CNCc1cn(c2c1cccc2)C 34a_100011997738_100000210624 [0,0,0,1,0,1|2,0,0]=4 5806 B17R2.78537 CC(C)CNCc1nn(c2c1cccc2)C 207a_100000210953_100011361492 [0,0,0,1,0,1|2,0,0]=4 5807 B17R2.78537 CC(C)CNCc1nn(c2c1cccc2)C 270004a_100000210953_100011361492 [0,0,0,1,0,1|2,0,0]=4 5808 B17R2.78537 CC(C)CNCc1nn(c2c1cccc2)C 270004a_200011934655_100000210432 [0,0,0,1,0,1|2,0,0]=4 5809 B17R2.78537 CC(C)CNCc1nn(c2c1cccc2)C 34a_200011934655_100000210624 [0,0,0,1,0,1|2,0,0]=4 5810 B17R2.78537 CC(C)COCc1nn(c2c1cccc2)C 34a_100011934675_100000210624 [0,0,0,1,0,1|1,0,0]=3 5811 B17R2.78537 CC(C)OCCc1cn(c2c1cccc2)C 34a_100000101561_100000210206 [0,0,0,1,0,1|2,0,0]=4 5812 B17R2.78537 CC(C)OCSc1nn(c2c1cccc2)C 62a_100000709892_100009817141 [0,0,0,1,0,1|1,1,0]=4 5813 B17R2.78537 CC(C)OCSc1nn(c2c1cccc2)C 62a_100009817141_100000709892 [0,0,0,1,0,1|1,1,0]=4 5814 B17R2.78537 CC(O)COCc1nn(c2c1cccc2)C 34a_100011934675_100011218427 [0,0,0,1,0,1|2,0,0]=4 5815 B17R2.78537 C[C@@H](O)COCc1nn(c2c1cccc2)C 34a_100011934675_100009817552 [0,0,0,1,0,1|2,0,0]=4 5816 B17R2.155580 CC(Br)COC1CCc2ccccc2C1=O 34a_100012180447_100000229917 [0,0,0,1,0,1|2,0,0]=4 5817 B17R2.155580 CC(C)CNC1CCc2ccccc2C1=O 2230a_100000210953_100000229917 [0,0,0,1,0,1|2,0,0]=4 5818 B17R2.155580 CC(C)CNC1CCc2ccccc2C1=O 34a_100000210953_100000229917 [0,0,0,1,0,1|2,0,0]=4 5819 B17R2.155580 CC(C)COC1CCc2ccccc2C1=O 34a_100000210257_100000229917 [0,0,0,1,0,1|1,0,0]=3 5820 B17R2.155580 CC(C)CSC1CCc2ccccc2C1=O 62a_100000210624_100000229917 [0,0,0,1,0,1|1,1,0]=4 5821 B17R2.155580 CC(C)CSC1CCc2ccccc2C1=O 62a_100000229917_100000210760 [0,0,0,1,0,1|1,1,0]=4 5822 B17R2.155580 CC(C)CSc1c[nH]c2ccccc2c1=O 62a_100000210624_100012348052 [0,0,0,1,0,1|0,1,1]=4 5823 B17R2.155580 CC(F)COC1CCc2ccccc2C1=O 34a_100015925927_100000229917 [0,0,0,1,0,1|2,0,0]=4 5824 B17R2.155580 C[C@@H](Cl)COC1CCc2ccccc2C1=O 34a_100016084084_100000229917 [0,0,0,1,0,1|2,0,0]=4 5825 B17R2.155580 C[C@@H](N)COC1CCc2ccccc2C1=O 34a_100000737577_100000229917 [0,0,0,1,0,1|2,0,0]=4 5826 B17R2.157 CCNc1ccccc1C2=CCC(CC2)C 271570a_100010240233_114873767003 [0,1,0,1,0,0|2,0,0]=4 5827 B17R2.157 CNCc1ccccc1C2=CCC(CC2)C 271570a_100010240233_100000184654 [0,1,0,1,0,0|2,0,0]=4 5828 B17R2.5014 Cc1cc(c2ccccc2n1)OCC(C)C 34a_100000698765_100000210624 [0,1,0,1,0,0|1,0,1]=4 5829 B17R2.28756 CCOc1ccccc1C(=O)CCC2CC2 1458a_100000211144_100000694398 [0,1,0,1,0,0|2,0,0]=4 5830 B17R2.28756 CCOc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000211144 [0,1,0,1,0,0|2,0,0]=4 5831 B17R2.28756 CCOc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000211144 [0,1,0,1,0,0|2,0,0]=4 5832 B17R2.28756 CCOc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000211144 [0,1,0,1,0,0|2,0,0]=4 5833 B17R2.28756 CCOc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000211144 [0,1,0,1,0,0|2,0,0]=4 5834 B17R2.28756 CCSc1ccccc1C(=O)CCC2CC2 1458a_100000195471_100000694398 [0,1,0,1,0,0|2,0,0]=4 5835 B17R2.28756 CCSc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000195471 [0,1,0,1,0,0|2,0,0]=4 5836 B17R2.28756 CCSc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000195471 [0,1,0,1,0,0|2,0,0]=4 5837 B17R2.28756 CCSc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000195471 [0,1,0,1,0,0|2,0,0]=4 5838 B17R2.28756 CCSc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000195471 [0,1,0,1,0,0|2,0,0]=4 5839 B17R2.28756 COCc1ccccc1C(=O)CCC2CC2 1458a_100000737999_100000694398 [0,1,0,1,0,0|2,0,0]=4 5840 B17R2.28756 COCc1ccccc1C(=O)NCC2CC2 11a_100000735609_100000737999 [0,1,0,1,0,0|2,0,0]=4 5841 B17R2.28756 COCc1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000737999 [0,1,0,1,0,0|2,0,0]=4 5842 B17R2.28756 COCc1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000737999 [0,1,0,1,0,0|2,0,0]=4 5843 B17R2.28756 COCc1ccccc1C(=O)NCC2CC2 527a_100000735609_100000737999 [0,1,0,1,0,0|2,0,0]=4 5844 B17R2.46988 CCOc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000211144 [0,1,0,1,0,0|2,0,0]=4 5845 B17R2.46988 CCOc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000211144 [0,1,0,1,0,0|2,0,0]=4 5846 B17R2.46988 CCOc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000211144 [0,1,0,1,0,0|2,0,0]=4 5847 B17R2.46988 CCSc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000195471 [0,1,0,1,0,0|2,0,0]=4 5848 B17R2.46988 CCSc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000195471 [0,1,0,1,0,0|2,0,0]=4 5849 B17R2.46988 CCSc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000195471 [0,1,0,1,0,0|2,0,0]=4 5850 B17R2.46988 COCc1ccccc1C(=O)N2CC(C2)C 11a_100000702820_100000737999 [0,1,0,1,0,0|2,0,0]=4 5851 B17R2.46988 COCc1ccccc1C(=O)N2CC(C2)C 240690a_100000702820_100000737999 [0,1,0,1,0,0|2,0,0]=4 5852 B17R2.46988 COCc1ccccc1C(=O)N2CC(C2)C 527a_100000702820_100000737999 [0,1,0,1,0,0|2,0,0]=4 5853 B17R2.47068 CC1(COC(=N1)c2ccccc2SCF)C 62a_100000695370_100015361967 [0,1,0,1,0,0|2,0,0]=4 5854 B17R2.47068 CC=Cc1ccccc1C2=NC(CO2)(C)C 271570a_100016259895_100000695370 [0,1,0,1,0,0|2,0,0]=4 5855 B17R2.47068 CCSc1ccccc1C2=NC(CO2)(C)C 62a_100000695370_100000210202 [0,1,0,1,0,0|2,0,0]=4 5856 B17R2.90916 CC(C)CCC(=O)c1ccccc1C2CC2 1458a_100011688854_100000210312 [0,1,0,1,0,0|2,0,0]=4 5857 B17R2.90916 CC(C)CNC(=O)c1ccccc1C2CC2 11a_100000210953_100011688854 [0,1,0,1,0,0|2,0,0]=4 5858 B17R2.90916 CC(C)CNC(=O)c1ccccc1C2CC2 1626a_100000210953_100011688854 [0,1,0,1,0,0|2,0,0]=4 5859 B17R2.90916 CC(C)CNC(=O)c1ccccc1C2CC2 271570a_100011220607_200000155729 [0,1,0,1,0,0|2,0,0]=4 5860 B17R2.90916 CC(C)CNC(=O)c1ccccc1C2CC2 527a_100000210953_100011688854 [0,1,0,1,0,0|2,0,0]=4 5861 B17R2.90971 CC(C)CCC(=O)c1cccc2c1CCC2 1458a_100000051556_100000210312 [0,1,0,1,0,0|2,0,0]=4 5862 B17R2.90971 CC(C)CCC(=O)c1cccc2c1OCC2 1458a_100011216994_100000210312 [0,1,0,1,0,0|2,0,0]=4 5863 B17R2.90971 CC(C)CCC(=O)c1cccc2c1OCO2 1458a_100000048783_100000210312 [0,1,0,1,0,0|2,0,0]=4 5864 B17R2.90971 CC(C)CCC(=O)c1cccc2c1[nH]cc2 1458a_100000027293_100000210312 [0,1,0,1,0,0|1,0,1]=4 5865 B17R2.90971 CC(C)CCC(=O)c1cccc2c1[nH]nc2 1458a_100000030479_100000210312 [0,1,0,1,0,0|1,0,1]=4 5866 B17R2.90971 CC(C)CNC(=O)c1cccc2c1CCC2 11a_100000210953_100000051556 [0,1,0,1,0,0|2,0,0]=4 5867 B17R2.90971 CC(C)CNC(=O)c1cccc2c1CCC2 1626a_100000210953_100000051556 [0,1,0,1,0,0|2,0,0]=4 5868 B17R2.90971 CC(C)CNC(=O)c1cccc2c1CCC2 240690a_100000210953_100000051556 [0,1,0,1,0,0|2,0,0]=4 5869 B17R2.90971 CC(C)CNC(=O)c1cccc2c1CCC2 527a_100000210953_100000051556 [0,1,0,1,0,0|2,0,0]=4 5870 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCC2 11a_100000210953_100011216994 [0,1,0,1,0,0|2,0,0]=4 5871 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCC2 1626a_100000210953_100011216994 [0,1,0,1,0,0|2,0,0]=4 5872 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCC2 240690a_100000210953_100011216994 [0,1,0,1,0,0|2,0,0]=4 5873 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCC2 527a_100000210953_100011216994 [0,1,0,1,0,0|2,0,0]=4 5874 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCO2 11a_100000210953_100000048783 [0,1,0,1,0,0|2,0,0]=4 5875 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCO2 1626a_100000210953_100000048783 [0,1,0,1,0,0|2,0,0]=4 5876 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCO2 240690a_100000210953_100000048783 [0,1,0,1,0,0|2,0,0]=4 5877 B17R2.90971 CC(C)CNC(=O)c1cccc2c1OCO2 527a_100000210953_100000048783 [0,1,0,1,0,0|2,0,0]=4 5878 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]cc2 11a_100000210953_100000027293 [0,1,0,1,0,0|1,0,1]=4 5879 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]cc2 240690a_100000210953_100000027293 [0,1,0,1,0,0|1,0,1]=4 5880 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]cc2 527a_100000210953_100000027293 [0,1,0,1,0,0|1,0,1]=4 5881 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]nc2 11a_100000210953_100000030479 [0,1,0,1,0,0|1,0,1]=4 5882 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]nc2 1626a_100000210953_100000030479 [0,1,0,1,0,0|1,0,1]=4 5883 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]nc2 240690a_100000210953_100000030479 [0,1,0,1,0,0|1,0,1]=4 5884 B17R2.90971 CC(C)CNC(=O)c1cccc2c1[nH]nc2 527a_100000210953_100000030479 [0,1,0,1,0,0|1,0,1]=4 5885 B17R2.140478 CCn1nc(c2c1cccc2)SCC(C)C 62a_100000210624_200010288290 [0,1,0,1,0,0|1,1,0]=4 5886 B17R2.2405 CNc1ccc(cc1C2=CCC(CC2)C)C 271570a_100010240233_100000221369 [0,1,0,1,0,0|2,0,0]=4 5887 B17R2.2405 CNc1ccc(cc1C2=CCC(CC2)C)F 271570a_100010240233_100011246292 [0,1,0,1,0,0|2,0,0]=4 5888 B17R2.9419 CCc1ccc(cc1C(=O)CCC2CC2)Br 1458a_100012343961_100000694398 [0,1,0,1,0,0|2,0,0]=4 5889 B17R2.9419 CCc1ccc(cc1C(=O)NCC2CC2)Br 11a_100000735609_100012343961 [0,1,0,1,0,0|2,0,0]=4 5890 B17R2.9419 CCc1ccc(cc1C(=O)NCC2CC2)Br 1626a_100000735609_100012343961 [0,1,0,1,0,0|2,0,0]=4 5891 B17R2.9419 CCc1ccc(cc1C(=O)NCC2CC2)Br 240690a_100000735609_100012343961 [0,1,0,1,0,0|2,0,0]=4 5892 B17R2.9419 CCc1ccc(cc1C(=O)NCC2CC2)Br 527a_100000735609_100012343961 [0,1,0,1,0,0|2,0,0]=4 5893 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)Br 1458a_100000188853_100000694398 [0,1,0,1,0,0|2,0,0]=4 5894 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)C 1458a_100000204667_100000694398 [0,1,0,1,0,0|2,0,0]=4 5895 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)Cl 1458a_100000211409_100000694398 [0,1,0,1,0,0|2,0,0]=4 5896 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)F 1458a_100000735445_100000694398 [0,1,0,1,0,0|2,0,0]=4 5897 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)I 1458a_100000230898_100000694398 [0,1,0,1,0,0|2,0,0]=4 5898 B17R2.9419 COc1ccc(cc1C(=O)CCC2CC2)O 1458a_200000100057_100000694398 [0,1,0,1,0,0|2,0,0]=4 5899 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Br 11a_100000735609_100000188853 [0,1,0,1,0,0|2,0,0]=4 5900 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Br 1626a_100000735609_100000188853 [0,1,0,1,0,0|2,0,0]=4 5901 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Br 240690a_100000735609_100000188853 [0,1,0,1,0,0|2,0,0]=4 5902 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Br 527a_100000735609_100000188853 [0,1,0,1,0,0|2,0,0]=4 5903 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)C 11a_100000735609_100000204667 [0,1,0,1,0,0|2,0,0]=4 5904 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)C 1626a_100000735609_100000204667 [0,1,0,1,0,0|2,0,0]=4 5905 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)C 240690a_100000735609_100000204667 [0,1,0,1,0,0|2,0,0]=4 5906 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)C 527a_100000735609_100000204667 [0,1,0,1,0,0|2,0,0]=4 5907 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Cl 11a_100000735609_100000211409 [0,1,0,1,0,0|2,0,0]=4 5908 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Cl 1626a_100000735609_100000211409 [0,1,0,1,0,0|2,0,0]=4 5909 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Cl 240690a_100000735609_100000211409 [0,1,0,1,0,0|2,0,0]=4 5910 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)Cl 527a_100000735609_100000211409 [0,1,0,1,0,0|2,0,0]=4 5911 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)F 11a_100000735609_100000735445 [0,1,0,1,0,0|2,0,0]=4 5912 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)F 1626a_100000735609_100000735445 [0,1,0,1,0,0|2,0,0]=4 5913 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)F 240690a_100000735609_100000735445 [0,1,0,1,0,0|2,0,0]=4 5914 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)F 527a_100000735609_100000735445 [0,1,0,1,0,0|2,0,0]=4 5915 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)I 11a_100000735609_100000230898 [0,1,0,1,0,0|2,0,0]=4 5916 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)I 1626a_100000735609_100000230898 [0,1,0,1,0,0|2,0,0]=4 5917 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)I 240690a_100000735609_100000230898 [0,1,0,1,0,0|2,0,0]=4 5918 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)I 527a_100000735609_100000230898 [0,1,0,1,0,0|2,0,0]=4 5919 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)O 240690a_100000735609_200000100057 [0,1,0,1,0,0|2,0,0]=4 5920 B17R2.9419 COc1ccc(cc1C(=O)NCC2CC2)O 527a_100000735609_200000100057 [0,1,0,1,0,0|2,0,0]=4 5921 B17R2.87077 CCc1ccc(cc1C(=O)N2CC(C2)C)Br 11a_100000702820_100012343961 [0,1,0,1,0,0|2,0,0]=4 5922 B17R2.87077 CCc1ccc(cc1C(=O)N2CC(C2)C)Br 240690a_100000702820_100012343961 [0,1,0,1,0,0|2,0,0]=4 5923 B17R2.87077 CCc1ccc(cc1C(=O)N2CC(C2)C)Br 527a_100000702820_100012343961 [0,1,0,1,0,0|2,0,0]=4 5924 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Br 11a_100000702820_100000188853 [0,1,0,1,0,0|2,0,0]=4 5925 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Br 240690a_100000702820_100000188853 [0,1,0,1,0,0|2,0,0]=4 5926 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Br 527a_100000702820_100000188853 [0,1,0,1,0,0|2,0,0]=4 5927 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)C 11a_100000702820_100000204667 [0,1,0,1,0,0|2,0,0]=4 5928 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)C 240690a_100000702820_100000204667 [0,1,0,1,0,0|2,0,0]=4 5929 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)C 527a_100000702820_100000204667 [0,1,0,1,0,0|2,0,0]=4 5930 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Cl 11a_100000702820_100000211409 [0,1,0,1,0,0|2,0,0]=4 5931 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Cl 240690a_100000702820_100000211409 [0,1,0,1,0,0|2,0,0]=4 5932 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)Cl 527a_100000702820_100000211409 [0,1,0,1,0,0|2,0,0]=4 5933 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)F 11a_100000702820_100000735445 [0,1,0,1,0,0|2,0,0]=4 5934 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)F 240690a_100000702820_100000735445 [0,1,0,1,0,0|2,0,0]=4 5935 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)F 527a_100000702820_100000735445 [0,1,0,1,0,0|2,0,0]=4 5936 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)I 11a_100000702820_100000230898 [0,1,0,1,0,0|2,0,0]=4 5937 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)I 240690a_100000702820_100000230898 [0,1,0,1,0,0|2,0,0]=4 5938 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)I 527a_100000702820_100000230898 [0,1,0,1,0,0|2,0,0]=4 5939 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)O 240690a_100000702820_200000100057 [0,1,0,1,0,0|2,0,0]=4 5940 B17R2.87077 COc1ccc(cc1C(=O)N2CC(C2)C)O 527a_100000702820_200000100057 [0,1,0,1,0,0|2,0,0]=4 5941 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)Br)C 62a_100000210624_100010161270 [0,1,0,1,0,0|1,1,0]=4 5942 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)Br)C 62a_100010161270_100000210760 [0,1,0,1,0,0|1,1,0]=4 5943 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)F)C 62a_100000210624_200000123018 [0,1,0,1,0,0|1,1,0]=4 5944 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)F)C 62a_200000123018_100000210760 [0,1,0,1,0,0|1,1,0]=4 5945 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)N)C 62a_100000210624_100010234897 [0,1,0,1,0,0|1,1,0]=4 5946 B17R2.266377 CC(C)CSc1nn(c2c1cc(cc2)N)C 62a_100010234897_100000210760 [0,1,0,1,0,0|1,1,0]=4 5947 B17R2.266377 Cc1ccc2c(c1)c(nn2C)SCC(C)C 62a_100000210624_100000123007 [0,1,0,1,0,0|1,1,0]=4 5948 B17R2.350 CC1CC=C(CC1)c2ccccc2N(C)C 271570a_100010240233_100011290883 [0,1,0,1,0,0|2,0,0]=4 5949 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@@H]2F 240690a_100015190264_100011218752 [0,1,0,1,0,0|2,0,0]=4 5950 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@@H]2F 527a_100015190264_100011218752 [0,1,0,1,0,0|2,0,0]=4 5951 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@H]2F 11a_100025746932_100011218752 [0,1,0,1,0,0|2,0,0]=4 5952 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@H]2F 1626a_100025746932_100011218752 [0,1,0,1,0,0|2,0,0]=4 5953 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@H]2F 240690a_100025746932_100011218752 [0,1,0,1,0,0|2,0,0]=4 5954 B17R2.23081 CN(C)c1ccccc1C(=O)N[C@@H]2C[C@H]2F 527a_100025746932_100011218752 [0,1,0,1,0,0|2,0,0]=4 5955 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2C(C)C 11a_100000702820_100011941426 [0,1,0,1,0,0|2,0,0]=4 5956 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2C(C)C 240690a_100000702820_100011941426 [0,1,0,1,0,0|2,0,0]=4 5957 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2C(C)C 527a_100000702820_100011941426 [0,1,0,1,0,0|2,0,0]=4 5958 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2N(C)C 11a_100000702820_100011218752 [0,1,0,1,0,0|1,0,0]=3 5959 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2N(C)C 240690a_100000702820_100011218752 [0,1,0,1,0,0|1,0,0]=3 5960 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2N(C)C 527a_100000702820_100011218752 [0,1,0,1,0,0|1,0,0]=3 5961 B17R2.25608 CC1CN(C1)C(=O)c2ccccc2S(=O)C 240690a_100000702820_100000204632 [0,1,0,1,0,0|2,0,0]=4 5962 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)F 11a_100000690557_100011218752 [0,1,0,1,0,0|2,0,0]=4 5963 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)F 240690a_100000690557_100011218752 [0,1,0,1,0,0|2,0,0]=4 5964 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)F 527a_100000690557_100011218752 [0,1,0,1,0,0|2,0,0]=4 5965 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)O 11a_100000749847_100011218752 [0,1,0,1,0,0|2,0,0]=4 5966 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)O 240690a_100000749847_100011218752 [0,1,0,1,0,0|2,0,0]=4 5967 B17R2.25608 CN(C)c1ccccc1C(=O)N2CC(C2)O 527a_100000749847_100011218752 [0,1,0,1,0,0|2,0,0]=4 5968 B17R2.39629 Cc1ccc(c2c1cccc2)OCC(C)C 34a_100000074455_100000210624 [0,1,0,1,0,0|2,0,0]=4 5969 B17R2.39629 Cc1ccc(c2c1cccc2)OCC(C)C 7a_100000074455_100000210760 [0,1,0,1,0,0|2,0,0]=4 5970 B17R2.39629 Cc1nnc(c2c1cccc2)OCC(C)C 34a_100000183092_100000210624 [0,1,0,1,0,0|2,0,0]=4 5971 B17R2.45252 C=C(C)c1ccccc1C2=NC(CO2)(C)C 271570a_100000694244_100000695370 [0,1,0,1,0,0|2,0,0]=4 5972 B17R2.287934 CC(C)c1ccccc1C(=O)CCC2CC2 1458a_100011941426_100000694398 [0,1,0,1,0,0|2,0,0]=4 5973 B17R2.287934 CC(C)c1ccccc1C(=O)NCC2CC2 11a_100000735609_100011941426 [0,1,0,1,0,0|2,0,0]=4 5974 B17R2.287934 CC(C)c1ccccc1C(=O)NCC2CC2 1626a_100000735609_100011941426 [0,1,0,1,0,0|2,0,0]=4 5975 B17R2.287934 CC(C)c1ccccc1C(=O)NCC2CC2 240690a_100000735609_100011941426 [0,1,0,1,0,0|2,0,0]=4 5976 B17R2.287934 CC(C)c1ccccc1C(=O)NCC2CC2 527a_100000735609_100011941426 [0,1,0,1,0,0|2,0,0]=4 5977 B17R2.287934 CN(C)c1ccccc1C(=O)CCC2CC2 1458a_100011218752_100000694398 [0,1,0,1,0,0|1,0,0]=3 5978 B17R2.287934 CN(C)c1ccccc1C(=O)CCC2CO2 1458a_100011218752_100000732470 [0,1,0,1,0,0|2,0,0]=4 5979 B17R2.287934 CN(C)c1ccccc1C(=O)NCC2CC2 11a_100000735609_100011218752 [0,1,0,1,0,0|1,0,0]=3 5980 B17R2.287934 CN(C)c1ccccc1C(=O)NCC2CC2 1626a_100000735609_100011218752 [0,1,0,1,0,0|1,0,0]=3 5981 B17R2.287934 CN(C)c1ccccc1C(=O)NCC2CC2 240690a_100000735609_100011218752 [0,1,0,1,0,0|1,0,0]=3 5982 B17R2.287934 CN(C)c1ccccc1C(=O)NCC2CC2 527a_100000735609_100011218752 [0,1,0,1,0,0|1,0,0]=3 5983 B17R2.287934 CN(C)c1ccccc1C(=O)NNC2CC2 22a_100000701032_100011218752 [0,1,0,1,0,0|2,0,0]=4 5984 B17R2.287934 CS(=O)c1ccccc1C(=O)CCC2CC2 1458a_100000204632_100000694398 [0,1,0,1,0,0|2,0,0]=4 5985 B17R2.287934 CS(=O)c1ccccc1C(=O)NCC2CC2 1626a_100000735609_100000204632 [0,1,0,1,0,0|2,0,0]=4 5986 B17R2.287934 CS(=O)c1ccccc1C(=O)NCC2CC2 240690a_100000735609_100000204632 [0,1,0,1,0,0|2,0,0]=4 5987 B17R2.2487 CNc1cc(ccc1C2=CCC(CC2)C)F 271570a_100010240233_100020633008 [0,1,0,1,0,0|2,0,0]=4 5988 B17R2.10478 CCc1cc(ccc1C(=O)CCC2CC2)Br 1458a_200012349896_100000694398 [0,1,0,1,0,0|2,0,0]=4 5989 B17R2.10478 CCc1cc(ccc1C(=O)NCC2CC2)Br 11a_100000735609_200012349896 [0,1,0,1,0,0|2,0,0]=4 5990 B17R2.10478 CCc1cc(ccc1C(=O)NCC2CC2)Br 1626a_100000735609_200012349896 [0,1,0,1,0,0|2,0,0]=4 5991 B17R2.10478 CCc1cc(ccc1C(=O)NCC2CC2)Br 240690a_100000735609_200012349896 [0,1,0,1,0,0|2,0,0]=4 5992 B17R2.10478 CCc1cc(ccc1C(=O)NCC2CC2)Br 527a_100000735609_200012349896 [0,1,0,1,0,0|2,0,0]=4 5993 B17R2.10478 COc1cc(ccc1C(=O)CCC2CC2)Br 1458a_100000748230_100000694398 [0,1,0,1,0,0|2,0,0]=4 5994 B17R2.10478 COc1cc(ccc1C(=O)CCC2CC2)C 1458a_100000217210_100000694398 [0,1,0,1,0,0|2,0,0]=4 5995 B17R2.10478 COc1cc(ccc1C(=O)CCC2CC2)Cl 1458a_100000217211_100000694398 [0,1,0,1,0,0|2,0,0]=4 5996 B17R2.10478 COc1cc(ccc1C(=O)CCC2CC2)F 1458a_100000239970_100000694398 [0,1,0,1,0,0|2,0,0]=4 5997 B17R2.10478 COc1cc(ccc1C(=O)CCC2CC2)I 1458a_100012353712_100000694398 [0,1,0,1,0,0|2,0,0]=4 5998 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Br 11a_100000735609_100000748230 [0,1,0,1,0,0|2,0,0]=4 5999 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Br 1626a_100000735609_100000748230 [0,1,0,1,0,0|2,0,0]=4 6000 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Br 240690a_100000735609_100000748230 [0,1,0,1,0,0|2,0,0]=4 6001 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Br 527a_100000735609_100000748230 [0,1,0,1,0,0|2,0,0]=4 6002 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)C 11a_100000735609_100000217210 [0,1,0,1,0,0|2,0,0]=4 6003 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)C 1626a_100000735609_100000217210 [0,1,0,1,0,0|2,0,0]=4 6004 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)C 240690a_100000735609_100000217210 [0,1,0,1,0,0|2,0,0]=4 6005 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)C 527a_100000735609_100000217210 [0,1,0,1,0,0|2,0,0]=4 6006 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Cl 11a_100000735609_100000217211 [0,1,0,1,0,0|2,0,0]=4 6007 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Cl 1626a_100000735609_100000217211 [0,1,0,1,0,0|2,0,0]=4 6008 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Cl 240690a_100000735609_100000217211 [0,1,0,1,0,0|2,0,0]=4 6009 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)Cl 527a_100000735609_100000217211 [0,1,0,1,0,0|2,0,0]=4 6010 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)F 11a_100000735609_100000239970 [0,1,0,1,0,0|2,0,0]=4 6011 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)F 1626a_100000735609_100000239970 [0,1,0,1,0,0|2,0,0]=4 6012 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)F 240690a_100000735609_100000239970 [0,1,0,1,0,0|2,0,0]=4 6013 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)F 527a_100000735609_100000239970 [0,1,0,1,0,0|2,0,0]=4 6014 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)I 11a_100000735609_100012353712 [0,1,0,1,0,0|2,0,0]=4 6015 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)I 1626a_100000735609_100012353712 [0,1,0,1,0,0|2,0,0]=4 6016 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)I 240690a_100000735609_100012353712 [0,1,0,1,0,0|2,0,0]=4 6017 B17R2.10478 COc1cc(ccc1C(=O)NCC2CC2)I 527a_100000735609_100012353712 [0,1,0,1,0,0|2,0,0]=4 6018 B17R2.95614 CCc1cc(ccc1C(=O)N2CC(C2)C)Br 11a_100000702820_200012349896 [0,1,0,1,0,0|2,0,0]=4 6019 B17R2.95614 CCc1cc(ccc1C(=O)N2CC(C2)C)Br 240690a_100000702820_200012349896 [0,1,0,1,0,0|2,0,0]=4 6020 B17R2.95614 CCc1cc(ccc1C(=O)N2CC(C2)C)Br 527a_100000702820_200012349896 [0,1,0,1,0,0|2,0,0]=4 6021 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Br 11a_100000702820_100000748230 [0,1,0,1,0,0|2,0,0]=4 6022 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Br 240690a_100000702820_100000748230 [0,1,0,1,0,0|2,0,0]=4 6023 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Br 527a_100000702820_100000748230 [0,1,0,1,0,0|2,0,0]=4 6024 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)C 11a_100000702820_100000217210 [0,1,0,1,0,0|2,0,0]=4 6025 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)C 240690a_100000702820_100000217210 [0,1,0,1,0,0|2,0,0]=4 6026 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)C 527a_100000702820_100000217210 [0,1,0,1,0,0|2,0,0]=4 6027 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Cl 11a_100000702820_100000217211 [0,1,0,1,0,0|2,0,0]=4 6028 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Cl 240690a_100000702820_100000217211 [0,1,0,1,0,0|2,0,0]=4 6029 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)Cl 527a_100000702820_100000217211 [0,1,0,1,0,0|2,0,0]=4 6030 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)F 11a_100000702820_100000239970 [0,1,0,1,0,0|2,0,0]=4 6031 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)F 240690a_100000702820_100000239970 [0,1,0,1,0,0|2,0,0]=4 6032 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)F 527a_100000702820_100000239970 [0,1,0,1,0,0|2,0,0]=4 6033 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)I 11a_100000702820_100012353712 [0,1,0,1,0,0|2,0,0]=4 6034 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)I 240690a_100000702820_100012353712 [0,1,0,1,0,0|2,0,0]=4 6035 B17R2.95614 COc1cc(ccc1C(=O)N2CC(C2)C)I 527a_100000702820_100012353712 [0,1,0,1,0,0|2,0,0]=4 6036 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)Br)C 62a_100000210624_100010161269 [0,1,0,1,0,0|1,1,0]=4 6037 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)Br)C 62a_100010161269_100000210760 [0,1,0,1,0,0|1,1,0]=4 6038 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)F)C 62a_100000210624_100010161261 [0,1,0,1,0,0|1,1,0]=4 6039 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)F)C 62a_100010161261_100000210760 [0,1,0,1,0,0|1,1,0]=4 6040 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)N)C 62a_100000210624_100010163569 [0,1,0,1,0,0|1,1,0]=4 6041 B17R2.184817 CC(C)CSc1nn(c2c1ccc(c2)N)C 62a_100010163569_100000210760 [0,1,0,1,0,0|1,1,0]=4 6042 B17R2.184817 Cc1ccc2c(nn(c2c1)C)SCC(C)C 62a_100000210624_100010073239 [0,1,0,1,0,0|1,1,0]=4 6043 B17R2.12475 CCc1ccccc1C(=O)N(C)CC2CC2 11a_100000741881_100000689120 [0,1,0,1,0,0|2,0,0]=4 6044 B17R2.12475 CCc1ccccc1C(=O)N(C)CC2CC2 1626a_100000741881_100000689120 [0,1,0,1,0,0|2,0,0]=4 6045 B17R2.12475 CCc1ccccc1C(=O)N(C)CC2CC2 240690a_100000741881_100000689120 [0,1,0,1,0,0|2,0,0]=4 6046 B17R2.12475 CCc1ccccc1C(=O)N(C)CC2CC2 527a_100000741881_100000689120 [0,1,0,1,0,0|2,0,0]=4 6047 B17R2.12475 COc1ccccc1C(=O)N(C)CC2CC2 11a_100000741881_100000185835 [0,1,0,1,0,0|2,0,0]=4 6048 B17R2.12475 COc1ccccc1C(=O)N(C)CC2CC2 1626a_100000741881_100000185835 [0,1,0,1,0,0|2,0,0]=4 6049 B17R2.12475 COc1ccccc1C(=O)N(C)CC2CC2 240690a_100000741881_100000185835 [0,1,0,1,0,0|2,0,0]=4 6050 B17R2.12475 COc1ccccc1C(=O)N(C)CC2CC2 527a_100000741881_100000185835 [0,1,0,1,0,0|2,0,0]=4 6051 B17R2.12475 CSc1ccccc1C(=O)N(C)CC2CC2 11a_100000741881_100000183967 [0,1,0,1,0,0|2,0,0]=4 6052 B17R2.12475 CSc1ccccc1C(=O)N(C)CC2CC2 1626a_100000741881_100000183967 [0,1,0,1,0,0|2,0,0]=4 6053 B17R2.12475 CSc1ccccc1C(=O)N(C)CC2CC2 240690a_100000741881_100000183967 [0,1,0,1,0,0|2,0,0]=4 6054 B17R2.12475 CSc1ccccc1C(=O)N(C)CC2CC2 527a_100000741881_100000183967 [0,1,0,1,0,0|2,0,0]=4 6055 B17R2.78535 CC(C)C[C@H](N)c1nn(c2c1cccc2)C 271570a_100015190218_100009817141 [0,1,0,1,0,0|2,0,0]=4 6056 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)C 11a_100000753659_100000689120 [0,1,0,1,0,0|2,0,0]=4 6057 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)C 1626a_100000753659_100000689120 [0,1,0,1,0,0|2,0,0]=4 6058 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)C 240690a_100000753659_100000689120 [0,1,0,1,0,0|2,0,0]=4 6059 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)C 527a_100000753659_100000689120 [0,1,0,1,0,0|2,0,0]=4 6060 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)F 11a_100000696199_100000689120 [0,1,0,1,0,0|2,0,0]=4 6061 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)F 1626a_100000696199_100000689120 [0,1,0,1,0,0|2,0,0]=4 6062 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)F 240690a_100000696199_100000689120 [0,1,0,1,0,0|2,0,0]=4 6063 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)F 527a_100000696199_100000689120 [0,1,0,1,0,0|2,0,0]=4 6064 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)O 11a_100000718560_100000689120 [0,1,0,1,0,0|2,0,0]=4 6065 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)O 240690a_100000718560_100000689120 [0,1,0,1,0,0|2,0,0]=4 6066 B17R2.105769 CCc1ccccc1C(=O)N2CC(C2)(C)O 527a_100000718560_100000689120 [0,1,0,1,0,0|2,0,0]=4 6067 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)C 11a_100000753659_100000185835 [0,1,0,1,0,0|2,0,0]=4 6068 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)C 1626a_100000753659_100000185835 [0,1,0,1,0,0|2,0,0]=4 6069 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)C 240690a_100000753659_100000185835 [0,1,0,1,0,0|2,0,0]=4 6070 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)C 527a_100000753659_100000185835 [0,1,0,1,0,0|2,0,0]=4 6071 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)F 11a_100000696199_100000185835 [0,1,0,1,0,0|2,0,0]=4 6072 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)F 1626a_100000696199_100000185835 [0,1,0,1,0,0|2,0,0]=4 6073 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)F 240690a_100000696199_100000185835 [0,1,0,1,0,0|2,0,0]=4 6074 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)F 527a_100000696199_100000185835 [0,1,0,1,0,0|2,0,0]=4 6075 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)O 11a_100000718560_100000185835 [0,1,0,1,0,0|2,0,0]=4 6076 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)O 240690a_100000718560_100000185835 [0,1,0,1,0,0|2,0,0]=4 6077 B17R2.105769 COc1ccccc1C(=O)N2CC(C2)(C)O 527a_100000718560_100000185835 [0,1,0,1,0,0|2,0,0]=4 6078 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)C 11a_100000753659_100000183967 [0,1,0,1,0,0|2,0,0]=4 6079 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)C 1626a_100000753659_100000183967 [0,1,0,1,0,0|2,0,0]=4 6080 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)C 240690a_100000753659_100000183967 [0,1,0,1,0,0|2,0,0]=4 6081 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)C 527a_100000753659_100000183967 [0,1,0,1,0,0|2,0,0]=4 6082 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)F 11a_100000696199_100000183967 [0,1,0,1,0,0|2,0,0]=4 6083 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)F 1626a_100000696199_100000183967 [0,1,0,1,0,0|2,0,0]=4 6084 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)F 240690a_100000696199_100000183967 [0,1,0,1,0,0|2,0,0]=4 6085 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)F 527a_100000696199_100000183967 [0,1,0,1,0,0|2,0,0]=4 6086 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)O 11a_100000718560_100000183967 [0,1,0,1,0,0|2,0,0]=4 6087 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)O 240690a_100000718560_100000183967 [0,1,0,1,0,0|2,0,0]=4 6088 B17R2.105769 CSc1ccccc1C(=O)N2CC(C2)(C)O 527a_100000718560_100000183967 [0,1,0,1,0,0|2,0,0]=4 6089 B17R2.62883 CCc1ccccc1C(=O)NC(C)C2CC2 11a_100000700016_100000689120 [0,1,0,1,0,0|2,0,0]=4 6090 B17R2.62883 CCc1ccccc1C(=O)NC(C)C2CC2 1626a_100000700016_100000689120 [0,1,0,1,0,0|2,0,0]=4 6091 B17R2.62883 CCc1ccccc1C(=O)NC(C)C2CC2 240690a_100000700016_100000689120 [0,1,0,1,0,0|2,0,0]=4 6092 B17R2.62883 CCc1ccccc1C(=O)NC(C)C2CC2 527a_100000700016_100000689120 [0,1,0,1,0,0|2,0,0]=4 6093 B17R2.62883 COc1ccccc1C(=O)NC(C)C2CC2 11a_100000700016_100000185835 [0,1,0,1,0,0|2,0,0]=4 6094 B17R2.62883 COc1ccccc1C(=O)NC(C)C2CC2 1626a_100000700016_100000185835 [0,1,0,1,0,0|2,0,0]=4 6095 B17R2.62883 COc1ccccc1C(=O)NC(C)C2CC2 240690a_100000700016_100000185835 [0,1,0,1,0,0|2,0,0]=4 6096 B17R2.62883 COc1ccccc1C(=O)NC(C)C2CC2 527a_100000700016_100000185835 [0,1,0,1,0,0|2,0,0]=4 6097 B17R2.62883 CSc1ccccc1C(=O)NC(C)C2CC2 11a_100000700016_100000183967 [0,1,0,1,0,0|2,0,0]=4 6098 B17R2.62883 CSc1ccccc1C(=O)NC(C)C2CC2 1626a_100000700016_100000183967 [0,1,0,1,0,0|2,0,0]=4 6099 B17R2.62883 CSc1ccccc1C(=O)NC(C)C2CC2 240690a_100000700016_100000183967 [0,1,0,1,0,0|2,0,0]=4 6100 B17R2.62883 CSc1ccccc1C(=O)NC(C)C2CC2 527a_100000700016_100000183967 [0,1,0,1,0,0|2,0,0]=4 6101 B17R2.62 CCC1CC=C(CC1)c2ccccc2NC 271570a_200010144120_100020606079 [0,1,0,1,0,0|2,0,0]=4 6102 B17R2.62 CNc1ccccc1C2=CCC(CC2)OC 271570a_100010144119_100020606079 [0,1,0,1,0,0|2,0,0]=4 6103 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)C 11a_100000766693_100000689120 [0,1,0,1,0,0|2,0,0]=4 6104 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)C 1626a_100000766693_100000689120 [0,1,0,1,0,0|2,0,0]=4 6105 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)C 240690a_100000766693_100000689120 [0,1,0,1,0,0|2,0,0]=4 6106 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)C 527a_100000766693_100000689120 [0,1,0,1,0,0|2,0,0]=4 6107 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)O 11a_100011936951_100000689120 [0,1,0,1,0,0|2,0,0]=4 6108 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)O 240690a_100011936951_100000689120 [0,1,0,1,0,0|2,0,0]=4 6109 B17R2.12562 CCc1ccccc1C(=O)NCC2(CC2)O 527a_100011936951_100000689120 [0,1,0,1,0,0|2,0,0]=4 6110 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)C 11a_100000766693_100000185835 [0,1,0,1,0,0|2,0,0]=4 6111 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)C 1626a_100000766693_100000185835 [0,1,0,1,0,0|2,0,0]=4 6112 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)C 240690a_100000766693_100000185835 [0,1,0,1,0,0|2,0,0]=4 6113 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)C 527a_100000766693_100000185835 [0,1,0,1,0,0|2,0,0]=4 6114 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)O 11a_100011936951_100000185835 [0,1,0,1,0,0|2,0,0]=4 6115 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)O 240690a_100011936951_100000185835 [0,1,0,1,0,0|2,0,0]=4 6116 B17R2.12562 COc1ccccc1C(=O)NCC2(CC2)O 527a_100011936951_100000185835 [0,1,0,1,0,0|2,0,0]=4 6117 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)C 11a_100000766693_100000183967 [0,1,0,1,0,0|2,0,0]=4 6118 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)C 1626a_100000766693_100000183967 [0,1,0,1,0,0|2,0,0]=4 6119 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)C 240690a_100000766693_100000183967 [0,1,0,1,0,0|2,0,0]=4 6120 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)C 527a_100000766693_100000183967 [0,1,0,1,0,0|2,0,0]=4 6121 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)O 11a_100011936951_100000183967 [0,1,0,1,0,0|2,0,0]=4 6122 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)O 240690a_100011936951_100000183967 [0,1,0,1,0,0|2,0,0]=4 6123 B17R2.12562 CSc1ccccc1C(=O)NCC2(CC2)O 527a_100011936951_100000183967 [0,1,0,1,0,0|2,0,0]=4 6124 B17R2.87547 CCC(C)CSc1nn(c2c1cccc2)C 62a_100000748023_100009817141 [0,1,0,1,0,0|1,1,0]=4 6125 B17R2.87547 CCC(C)CSc1nn(c2c1cccc2)C 62a_100009817141_100000748023 [0,1,0,1,0,0|1,1,0]=4 6126 B17R2.87547 CC[C@H](C)CSc1nn(c2c1cccc2)C 62a_100009816398_100009817141 [0,1,0,1,0,0|1,1,0]=4 6127 B17R2.87547 CC[C@H](C)CSc1nn(c2c1cccc2)C 62a_100009817141_100009816398 [0,1,0,1,0,0|1,1,0]=4 6128 B17R2.87547 C[C@@H](CO)CSc1nn(c2c1cccc2)C 62a_100000059175_100009817141 [0,1,0,1,0,0|1,1,0]=4 6129 B17R2.87547 C[C@@H](CO)CSc1nn(c2c1cccc2)C 62a_100009817141_100000059175 [0,1,0,1,0,0|1,1,0]=4 6130 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2OC 11a_100015205115_100000185835 [0,1,0,1,0,0|2,0,0]=4 6131 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2OC 1626a_100015205115_100000185835 [0,1,0,1,0,0|2,0,0]=4 6132 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2OC 240690a_100015205115_100000185835 [0,1,0,1,0,0|2,0,0]=4 6133 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2OC 527a_100015205115_100000185835 [0,1,0,1,0,0|2,0,0]=4 6134 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2SC 11a_100015205115_100000183967 [0,1,0,1,0,0|2,0,0]=4 6135 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2SC 1626a_100015205115_100000183967 [0,1,0,1,0,0|2,0,0]=4 6136 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2SC 240690a_100015205115_100000183967 [0,1,0,1,0,0|2,0,0]=4 6137 B17R2.105770 CCC1CN(C1)C(=O)c2ccccc2SC 527a_100015205115_100000183967 [0,1,0,1,0,0|2,0,0]=4 6138 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CC 11a_100015205115_100000689120 [0,1,0,1,0,0|2,0,0]=4 6139 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CC 1626a_100015205115_100000689120 [0,1,0,1,0,0|2,0,0]=4 6140 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CC 240690a_100015205115_100000689120 [0,1,0,1,0,0|2,0,0]=4 6141 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CC 527a_100015205115_100000689120 [0,1,0,1,0,0|2,0,0]=4 6142 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CF 11a_100010363649_100000689120 [0,1,0,1,0,0|2,0,0]=4 6143 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CF 240690a_100010363649_100000689120 [0,1,0,1,0,0|2,0,0]=4 6144 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CF 527a_100010363649_100000689120 [0,1,0,1,0,0|2,0,0]=4 6145 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CO 240690a_100016987283_100000689120 [0,1,0,1,0,0|2,0,0]=4 6146 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)CO 527a_100016987283_100000689120 [0,1,0,1,0,0|2,0,0]=4 6147 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)OC 11a_100000755009_100000689120 [0,1,0,1,0,0|2,0,0]=4 6148 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)OC 1626a_100000755009_100000689120 [0,1,0,1,0,0|2,0,0]=4 6149 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)OC 240690a_100000755009_100000689120 [0,1,0,1,0,0|2,0,0]=4 6150 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)OC 527a_100000755009_100000689120 [0,1,0,1,0,0|2,0,0]=4 6151 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)SC 11a_100016990038_100000689120 [0,1,0,1,0,0|2,0,0]=4 6152 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)SC 1626a_100016990038_100000689120 [0,1,0,1,0,0|2,0,0]=4 6153 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)SC 240690a_100016990038_100000689120 [0,1,0,1,0,0|2,0,0]=4 6154 B17R2.105770 CCc1ccccc1C(=O)N2CC(C2)SC 527a_100016990038_100000689120 [0,1,0,1,0,0|2,0,0]=4 6155 B17R2.105770 COC1CN(C1)C(=O)c2ccccc2SC 11a_100000755009_100000183967 [0,1,0,1,0,0|2,0,0]=4 6156 B17R2.105770 COC1CN(C1)C(=O)c2ccccc2SC 1626a_100000755009_100000183967 [0,1,0,1,0,0|2,0,0]=4 6157 B17R2.105770 COC1CN(C1)C(=O)c2ccccc2SC 240690a_100000755009_100000183967 [0,1,0,1,0,0|2,0,0]=4 6158 B17R2.105770 COC1CN(C1)C(=O)c2ccccc2SC 527a_100000755009_100000183967 [0,1,0,1,0,0|2,0,0]=4 6159 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)CF 11a_100010363649_100000185835 [0,1,0,1,0,0|2,0,0]=4 6160 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)CF 240690a_100010363649_100000185835 [0,1,0,1,0,0|2,0,0]=4 6161 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)CF 527a_100010363649_100000185835 [0,1,0,1,0,0|2,0,0]=4 6162 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)CO 240690a_100016987283_100000185835 [0,1,0,1,0,0|2,0,0]=4 6163 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)CO 527a_100016987283_100000185835 [0,1,0,1,0,0|2,0,0]=4 6164 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)OC 11a_100000755009_100000185835 [0,1,0,1,0,0|2,0,0]=4 6165 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)OC 1626a_100000755009_100000185835 [0,1,0,1,0,0|2,0,0]=4 6166 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)OC 240690a_100000755009_100000185835 [0,1,0,1,0,0|2,0,0]=4 6167 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)OC 527a_100000755009_100000185835 [0,1,0,1,0,0|2,0,0]=4 6168 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)SC 11a_100016990038_100000185835 [0,1,0,1,0,0|2,0,0]=4 6169 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)SC 1626a_100016990038_100000185835 [0,1,0,1,0,0|2,0,0]=4 6170 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)SC 240690a_100016990038_100000185835 [0,1,0,1,0,0|2,0,0]=4 6171 B17R2.105770 COc1ccccc1C(=O)N2CC(C2)SC 527a_100016990038_100000185835 [0,1,0,1,0,0|2,0,0]=4 6172 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)CF 11a_100010363649_100000183967 [0,1,0,1,0,0|2,0,0]=4 6173 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)CF 240690a_100010363649_100000183967 [0,1,0,1,0,0|2,0,0]=4 6174 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)CF 527a_100010363649_100000183967 [0,1,0,1,0,0|2,0,0]=4 6175 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)CO 240690a_100016987283_100000183967 [0,1,0,1,0,0|2,0,0]=4 6176 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)CO 527a_100016987283_100000183967 [0,1,0,1,0,0|2,0,0]=4 6177 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)SC 11a_100016990038_100000183967 [0,1,0,1,0,0|2,0,0]=4 6178 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)SC 1626a_100016990038_100000183967 [0,1,0,1,0,0|2,0,0]=4 6179 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)SC 240690a_100016990038_100000183967 [0,1,0,1,0,0|2,0,0]=4 6180 B17R2.105770 CSc1ccccc1C(=O)N2CC(C2)SC 527a_100016990038_100000183967 [0,1,0,1,0,0|2,0,0]=4 6181 B17R2.392436 CCc1ccccc1C(=O)NCC2CCC2 11a_100000738700_100000689120 [0,1,0,1,0,0|2,0,0]=4 6182 B17R2.392436 CCc1ccccc1C(=O)NCC2CCC2 1626a_100000738700_100000689120 [0,1,0,1,0,0|2,0,0]=4 6183 B17R2.392436 CCc1ccccc1C(=O)NCC2CCC2 240690a_100000738700_100000689120 [0,1,0,1,0,0|2,0,0]=4 6184 B17R2.392436 CCc1ccccc1C(=O)NCC2CCC2 527a_100000738700_100000689120 [0,1,0,1,0,0|2,0,0]=4 6185 B17R2.392436 CCc1ccccc1C(=O)NCC2COC2 11a_100015281925_100000689120 [0,1,0,1,0,0|2,0,0]=4 6186 B17R2.392436 CCc1ccccc1C(=O)NCC2COC2 1626a_100015281925_100000689120 [0,1,0,1,0,0|2,0,0]=4 6187 B17R2.392436 CCc1ccccc1C(=O)NCC2COC2 240690a_100015281925_100000689120 [0,1,0,1,0,0|2,0,0]=4 6188 B17R2.392436 CCc1ccccc1C(=O)NCC2COC2 527a_100015281925_100000689120 [0,1,0,1,0,0|2,0,0]=4 6189 B17R2.392436 CCc1ccccc1C(=O)NC[C@@H]2CCO2 11a_100020831831_100000689120 [0,1,0,1,0,0|2,0,0]=4 6190 B17R2.392436 CCc1ccccc1C(=O)NC[C@@H]2CCO2 1626a_100020831831_100000689120 [0,1,0,1,0,0|2,0,0]=4 6191 B17R2.392436 CCc1ccccc1C(=O)NC[C@@H]2CCO2 240690a_100020831831_100000689120 [0,1,0,1,0,0|2,0,0]=4 6192 B17R2.392436 CCc1ccccc1C(=O)NC[C@@H]2CCO2 527a_100020831831_100000689120 [0,1,0,1,0,0|2,0,0]=4 6193 B17R2.392436 COc1ccccc1C(=O)NCC2CCC2 11a_100000738700_100000185835 [0,1,0,1,0,0|2,0,0]=4 6194 B17R2.392436 COc1ccccc1C(=O)NCC2CCC2 1626a_100000738700_100000185835 [0,1,0,1,0,0|2,0,0]=4 6195 B17R2.392436 COc1ccccc1C(=O)NCC2CCC2 240690a_100000738700_100000185835 [0,1,0,1,0,0|2,0,0]=4 6196 B17R2.392436 COc1ccccc1C(=O)NCC2CCC2 527a_100000738700_100000185835 [0,1,0,1,0,0|2,0,0]=4 6197 B17R2.392436 COc1ccccc1C(=O)NCC2COC2 11a_100015281925_100000185835 [0,1,0,1,0,0|2,0,0]=4 6198 B17R2.392436 COc1ccccc1C(=O)NCC2COC2 1626a_100015281925_100000185835 [0,1,0,1,0,0|2,0,0]=4 6199 B17R2.392436 COc1ccccc1C(=O)NCC2COC2 240690a_100015281925_100000185835 [0,1,0,1,0,0|2,0,0]=4 6200 B17R2.392436 COc1ccccc1C(=O)NCC2COC2 527a_100015281925_100000185835 [0,1,0,1,0,0|2,0,0]=4 6201 B17R2.392436 COc1ccccc1C(=O)NC[C@@H]2CCO2 11a_100020831831_100000185835 [0,1,0,1,0,0|2,0,0]=4 6202 B17R2.392436 COc1ccccc1C(=O)NC[C@@H]2CCO2 1626a_100020831831_100000185835 [0,1,0,1,0,0|2,0,0]=4 6203 B17R2.392436 COc1ccccc1C(=O)NC[C@@H]2CCO2 240690a_100020831831_100000185835 [0,1,0,1,0,0|2,0,0]=4 6204 B17R2.392436 COc1ccccc1C(=O)NC[C@@H]2CCO2 527a_100020831831_100000185835 [0,1,0,1,0,0|2,0,0]=4 6205 B17R2.392436 CSc1ccccc1C(=O)NCC2CCC2 11a_100000738700_100000183967 [0,1,0,1,0,0|2,0,0]=4 6206 B17R2.392436 CSc1ccccc1C(=O)NCC2CCC2 1626a_100000738700_100000183967 [0,1,0,1,0,0|2,0,0]=4 6207 B17R2.392436 CSc1ccccc1C(=O)NCC2CCC2 240690a_100000738700_100000183967 [0,1,0,1,0,0|2,0,0]=4 6208 B17R2.392436 CSc1ccccc1C(=O)NCC2CCC2 527a_100000738700_100000183967 [0,1,0,1,0,0|2,0,0]=4 6209 B17R2.392436 CSc1ccccc1C(=O)NCC2COC2 11a_100015281925_100000183967 [0,1,0,1,0,0|2,0,0]=4 6210 B17R2.392436 CSc1ccccc1C(=O)NCC2COC2 1626a_100015281925_100000183967 [0,1,0,1,0,0|2,0,0]=4 6211 B17R2.392436 CSc1ccccc1C(=O)NCC2COC2 240690a_100015281925_100000183967 [0,1,0,1,0,0|2,0,0]=4 6212 B17R2.392436 CSc1ccccc1C(=O)NCC2COC2 527a_100015281925_100000183967 [0,1,0,1,0,0|2,0,0]=4 6213 B17R2.392436 CSc1ccccc1C(=O)NC[C@@H]2CCO2 11a_100020831831_100000183967 [0,1,0,1,0,0|2,0,0]=4 6214 B17R2.392436 CSc1ccccc1C(=O)NC[C@@H]2CCO2 1626a_100020831831_100000183967 [0,1,0,1,0,0|2,0,0]=4 6215 B17R2.392436 CSc1ccccc1C(=O)NC[C@@H]2CCO2 240690a_100020831831_100000183967 [0,1,0,1,0,0|2,0,0]=4 6216 B17R2.392436 CSc1ccccc1C(=O)NC[C@@H]2CCO2 527a_100020831831_100000183967 [0,1,0,1,0,0|2,0,0]=4 6217 B17R2.8832 CNc1ccccc1C2=CCC(CC2)(C)C 271570a_100000069032_100020606079 [0,1,0,1,0,0|2,0,0]=4 6218 B17R2.464799 CC(C)NN=C1C(=O)N(c2c1cccc2)C 4a_100000741168_100000183014 [0,1,0,1,0,0|2,0,0]=4 6219 B17R2.14827 CCc1c(cccc1C(=O)CCC2CC2)Br 1458a_100010125490_100000694398 [0,1,0,1,0,0|2,0,0]=4 6220 B17R2.14827 CCc1c(cccc1C(=O)NCC2CC2)Br 11a_100000735609_100010125490 [0,1,0,1,0,0|2,0,0]=4 6221 B17R2.14827 CCc1c(cccc1C(=O)NCC2CC2)Br 1626a_100000735609_100010125490 [0,1,0,1,0,0|2,0,0]=4 6222 B17R2.14827 CCc1c(cccc1C(=O)NCC2CC2)Br 240690a_100000735609_100010125490 [0,1,0,1,0,0|2,0,0]=4 6223 B17R2.14827 CCc1c(cccc1C(=O)NCC2CC2)Br 527a_100000735609_100010125490 [0,1,0,1,0,0|2,0,0]=4 6224 B17R2.14827 COc1c(cccc1C(=O)CCC2CC2)Br 1458a_100000689802_100000694398 [0,1,0,1,0,0|2,0,0]=4 6225 B17R2.14827 COc1c(cccc1C(=O)CCC2CC2)C 1458a_100000187929_100000694398 [0,1,0,1,0,0|2,0,0]=4 6226 B17R2.14827 COc1c(cccc1C(=O)CCC2CC2)Cl 1458a_100011934004_100000694398 [0,1,0,1,0,0|2,0,0]=4 6227 B17R2.14827 COc1c(cccc1C(=O)CCC2CC2)F 1458a_100011218433_100000694398 [0,1,0,1,0,0|2,0,0]=4 6228 B17R2.14827 COc1c(cccc1C(=O)CCC2CC2)O 1458a_100000080799_100000694398 [0,1,0,1,0,0|2,0,0]=4 6229 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Br 11a_100000735609_100000689802 [0,1,0,1,0,0|2,0,0]=4 6230 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Br 1626a_100000735609_100000689802 [0,1,0,1,0,0|2,0,0]=4 6231 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Br 240690a_100000735609_100000689802 [0,1,0,1,0,0|2,0,0]=4 6232 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Br 527a_100000735609_100000689802 [0,1,0,1,0,0|2,0,0]=4 6233 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)C 11a_100000735609_100000187929 [0,1,0,1,0,0|2,0,0]=4 6234 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)C 1626a_100000735609_100000187929 [0,1,0,1,0,0|2,0,0]=4 6235 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)C 240690a_100000735609_100000187929 [0,1,0,1,0,0|2,0,0]=4 6236 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)C 527a_100000735609_100000187929 [0,1,0,1,0,0|2,0,0]=4 6237 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Cl 11a_100000735609_100011934004 [0,1,0,1,0,0|2,0,0]=4 6238 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Cl 1626a_100000735609_100011934004 [0,1,0,1,0,0|2,0,0]=4 6239 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Cl 240690a_100000735609_100011934004 [0,1,0,1,0,0|2,0,0]=4 6240 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)Cl 527a_100000735609_100011934004 [0,1,0,1,0,0|2,0,0]=4 6241 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)F 11a_100000735609_100011218433 [0,1,0,1,0,0|2,0,0]=4 6242 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)F 1626a_100000735609_100011218433 [0,1,0,1,0,0|2,0,0]=4 6243 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)F 240690a_100000735609_100011218433 [0,1,0,1,0,0|2,0,0]=4 6244 B17R2.14827 COc1c(cccc1C(=O)NCC2CC2)F 527a_100000735609_100011218433 [0,1,0,1,0,0|2,0,0]=4 6245 B17R2.15077 CNc1c(cccc1C2=CCC(CC2)C)N 271570a_100010240233_100010510394 [0,1,0,1,0,0|2,0,0]=4 6246 B17R2.122285 CCc1c(cccc1C(=O)N2CC(C2)C)Br 11a_100000702820_100010125490 [0,1,0,1,0,0|2,0,0]=4 6247 B17R2.122285 CCc1c(cccc1C(=O)N2CC(C2)C)Br 240690a_100000702820_100010125490 [0,1,0,1,0,0|2,0,0]=4 6248 B17R2.122285 CCc1c(cccc1C(=O)N2CC(C2)C)Br 527a_100000702820_100010125490 [0,1,0,1,0,0|2,0,0]=4 6249 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Br 11a_100000702820_100000689802 [0,1,0,1,0,0|2,0,0]=4 6250 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Br 240690a_100000702820_100000689802 [0,1,0,1,0,0|2,0,0]=4 6251 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Br 527a_100000702820_100000689802 [0,1,0,1,0,0|2,0,0]=4 6252 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)C 11a_100000702820_100000187929 [0,1,0,1,0,0|2,0,0]=4 6253 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)C 240690a_100000702820_100000187929 [0,1,0,1,0,0|2,0,0]=4 6254 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)C 527a_100000702820_100000187929 [0,1,0,1,0,0|2,0,0]=4 6255 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Cl 11a_100000702820_100011934004 [0,1,0,1,0,0|2,0,0]=4 6256 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Cl 240690a_100000702820_100011934004 [0,1,0,1,0,0|2,0,0]=4 6257 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)Cl 527a_100000702820_100011934004 [0,1,0,1,0,0|2,0,0]=4 6258 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)F 11a_100000702820_100011218433 [0,1,0,1,0,0|2,0,0]=4 6259 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)F 240690a_100000702820_100011218433 [0,1,0,1,0,0|2,0,0]=4 6260 B17R2.122285 COc1c(cccc1C(=O)N2CC(C2)C)F 527a_100000702820_100011218433 [0,1,0,1,0,0|2,0,0]=4 6261 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)C 62a_100009817141_100011219605 [0,1,0,1,0,0|1,1,0]=4 6262 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)C 62a_100011219605_100009817141 [0,1,0,1,0,0|1,1,0]=4 6263 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)F 62a_100009817141_100011997219 [0,1,0,1,0,0|1,1,0]=4 6264 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)F 62a_100011997219_100009817141 [0,1,0,1,0,0|1,1,0]=4 6265 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)O 62a_100000764493_100009817141 [0,1,0,1,0,0|1,1,0]=4 6266 B17R2.814993 Cn1nc(c2c1cccc2)SCC(C)(C)O 62a_100009817141_100000764493 [0,1,0,1,0,0|1,1,0]=4 6267 B17R2.37564 CC(C)CSc1nn(c2c1c(ccc2)F)C 62a_100000210624_200010161262 [0,1,0,1,0,0|1,1,0]=4 6268 B17R2.37564 CC(C)CSc1nn(c2c1c(ccc2)F)C 62a_200010161262_100000210760 [0,1,0,1,0,0|1,1,0]=4 6269 B17R2.37564 CC(C)CSc1nn(c2c1c(ccc2)N)C 62a_100000210624_100010235561 [0,1,0,1,0,0|1,1,0]=4 6270 B17R2.37564 CC(C)CSc1nn(c2c1c(ccc2)N)C 62a_100010235561_100000210760 [0,1,0,1,0,0|1,1,0]=4 6271 B17R2.37564 Cc1cccc2c1c(nn2C)SCC(C)C 62a_100000210624_100000123023 [0,1,0,1,0,0|1,1,0]=4 6272 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)Br 1458a_100011593405_100000694398 [0,1,0,1,0,0|2,0,0]=4 6273 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)C 1458a_100000066212_100000694398 [0,1,0,1,0,0|2,0,0]=4 6274 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)Cl 1458a_100000743539_100000694398 [0,1,0,1,0,0|2,0,0]=4 6275 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)F 1458a_100000759380_100000694398 [0,1,0,1,0,0|2,0,0]=4 6276 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)I 1458a_100010179659_100000694398 [0,1,0,1,0,0|2,0,0]=4 6277 B17R2.71167 COc1cccc(c1C(=O)CCC2CC2)O 1458a_100000043310_100000694398 [0,1,0,1,0,0|2,0,0]=4 6278 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Br 11a_100000735609_100011593405 [0,1,0,1,0,0|2,0,0]=4 6279 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Br 1626a_100000735609_100011593405 [0,1,0,1,0,0|2,0,0]=4 6280 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Br 240690a_100000735609_100011593405 [0,1,0,1,0,0|2,0,0]=4 6281 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Br 527a_100000735609_100011593405 [0,1,0,1,0,0|2,0,0]=4 6282 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)C 11a_100000735609_100000066212 [0,1,0,1,0,0|2,0,0]=4 6283 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)C 1626a_100000735609_100000066212 [0,1,0,1,0,0|2,0,0]=4 6284 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)C 240690a_100000735609_100000066212 [0,1,0,1,0,0|2,0,0]=4 6285 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Cl 11a_100000735609_100000743539 [0,1,0,1,0,0|2,0,0]=4 6286 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Cl 1626a_100000735609_100000743539 [0,1,0,1,0,0|2,0,0]=4 6287 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Cl 240690a_100000735609_100000743539 [0,1,0,1,0,0|2,0,0]=4 6288 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)Cl 527a_100000735609_100000743539 [0,1,0,1,0,0|2,0,0]=4 6289 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)F 11a_100000735609_100000759380 [0,1,0,1,0,0|2,0,0]=4 6290 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)F 1626a_100000735609_100000759380 [0,1,0,1,0,0|2,0,0]=4 6291 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)F 240690a_100000735609_100000759380 [0,1,0,1,0,0|2,0,0]=4 6292 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)F 527a_100000735609_100000759380 [0,1,0,1,0,0|2,0,0]=4 6293 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)I 11a_100000735609_100010179659 [0,1,0,1,0,0|2,0,0]=4 6294 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)I 1626a_100000735609_100010179659 [0,1,0,1,0,0|2,0,0]=4 6295 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)I 240690a_100000735609_100010179659 [0,1,0,1,0,0|2,0,0]=4 6296 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)I 527a_100000735609_100010179659 [0,1,0,1,0,0|2,0,0]=4 6297 B17R2.71167 COc1cccc(c1C(=O)NCC2CC2)O 240690a_100000735609_100000043310 [0,1,0,1,0,0|2,0,0]=4 6298 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Br 11a_100000702820_100011593405 [0,1,0,1,0,0|2,0,0]=4 6299 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Br 240690a_100000702820_100011593405 [0,1,0,1,0,0|2,0,0]=4 6300 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Br 527a_100000702820_100011593405 [0,1,0,1,0,0|2,0,0]=4 6301 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)C 11a_100000702820_100000066212 [0,1,0,1,0,0|2,0,0]=4 6302 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)C 240690a_100000702820_100000066212 [0,1,0,1,0,0|2,0,0]=4 6303 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Cl 11a_100000702820_100000743539 [0,1,0,1,0,0|2,0,0]=4 6304 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Cl 240690a_100000702820_100000743539 [0,1,0,1,0,0|2,0,0]=4 6305 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)Cl 527a_100000702820_100000743539 [0,1,0,1,0,0|2,0,0]=4 6306 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)F 11a_100000702820_100000759380 [0,1,0,1,0,0|2,0,0]=4 6307 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)F 240690a_100000702820_100000759380 [0,1,0,1,0,0|2,0,0]=4 6308 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)F 527a_100000702820_100000759380 [0,1,0,1,0,0|2,0,0]=4 6309 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)I 11a_100000702820_100010179659 [0,1,0,1,0,0|2,0,0]=4 6310 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)I 240690a_100000702820_100010179659 [0,1,0,1,0,0|2,0,0]=4 6311 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)I 527a_100000702820_100010179659 [0,1,0,1,0,0|2,0,0]=4 6312 B17R2.424401 COc1cccc(c1C(=O)N2CC(C2)C)O 240690a_100000702820_100000043310 [0,1,0,1,0,0|2,0,0]=4 6313 B17R3.102390 Cn1nc(c2c1cccc2)SCC3CC3 62a_100000756562_100009817141 [0,0,0,2,0,0|1,1,0]=4 6314 B17R3.102390 Cn1nc(c2c1cccc2)SCC3CC3 62a_100009817141_100000742324 [0,0,0,2,0,0|1,1,0]=4 6315 B13R1.90 C#Cc1ccccc1OCC(C)C 34a_200011470546_100000210624 [1,0,0,0,1,0|1,0,1]=4 6316 B13R1.90 C#Cc1ccccc1OCC(C)C 7a_200011470546_100000210760 [1,0,0,0,1,0|1,0,1]=4 6317 B13R1.90 C=C(C)COc1ccccc1NC 2230a_100000243823_200000210301 [1,0,0,0,1,0|0,0,2]=4 6318 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000033821_100000748629 [1,0,0,0,1,0|0,0,2]=4 6319 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000243823_200000210301 [1,0,0,0,1,0|0,0,2]=4 6320 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 2230a_100000243823_200025704644 [1,0,0,0,1,0|0,0,2]=4 6321 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 34a_100000243823_200025704644 [1,0,0,0,1,0|0,0,2]=4 6322 B13R1.90 CC(C)C=Cc1ccccc1NN 271570a_100016257149_100000241748 [1,0,0,0,1,0|1,0,1]=4 6323 B13R1.90 CC(C)COc1ccccc1C#N 34a_100000211048_100000210624 [1,0,0,0,1,0|2,0,0]=4 6324 B13R1.90 CC(C)COc1ccccc1C#N 7a_100000211048_100000210760 [1,0,0,0,1,0|2,0,0]=4 6325 B13R1.90 CC(C)COc1ccccc1CN 34a_100000185550_100000210624 [1,0,0,0,1,0|2,0,0]=4 6326 B13R1.90 CC(C)COc1ccccc1CO 34a_100011216872_100000210624 [1,0,0,0,1,0|2,0,0]=4 6327 B13R1.90 CC(C)COc1ccccc1N[13CH3] 34a_100000742603_200025704644 [1,0,0,0,1,0|0,0,0]=2 6328 B13R1.90 CC(C)CSc1ccccc1NN 62a_100000210624_100000241748 [1,0,0,0,1,0|1,1,0]=4 6329 B13R1.90 CC(C)CSc1ccccc1NN 62a_100000241748_100000210760 [1,0,0,0,1,0|1,1,0]=4 6330 B13R1.90 CCc1ccccc1C=CC(C)C 271570a_100016257149_100011215823 [1,0,0,0,1,0|1,0,1]=4 6331 B13R1.90 CCc1ccccc1COC(C)C 34a_100011663872_100000210206 [1,0,0,0,1,0|1,0,1]=4 6332 B13R1.90 CCc1ccccc1COC(C)C 7a_100011663872_100000210206 [1,0,0,0,1,0|1,0,1]=4 6333 B13R1.90 CCc1ccccc1NCC(C)C 2230a_100000212081_100000210760 [1,0,0,0,1,0|2,0,0]=4 6334 B13R1.90 CCc1ccccc1NCC(C)C 34a_100000212081_100000210624 [1,0,0,0,1,0|2,0,0]=4 6335 B13R1.90 CCc1ccccc1NCC(C)C 7a_100000212081_100000210760 [1,0,0,0,1,0|2,0,0]=4 6336 B13R1.90 CCc1ccccc1OCC(C)C 34a_100000210936_100000210624 [1,0,0,0,1,0|1,0,0]=3 6337 B13R1.90 CCc1ccccc1OCC(C)C 7a_100000210936_100000210760 [1,0,0,0,1,0|1,0,0]=3 6338 B13R1.90 CCc1ccccc1OCC(C)O 34a_100000210936_100011218427 [1,0,0,0,1,0|2,0,0]=4 6339 B13R1.90 CCc1ccccc1OCC(C)O 7a_100000210936_100011218427 [1,0,0,0,1,0|2,0,0]=4 6340 B13R1.90 CCc1ccccc1OC[C@@H](C)O 34a_100000210936_100009817552 [1,0,0,0,1,0|2,0,0]=4 6341 B13R1.90 CCc1ccccc1OC[C@@H](C)O 7a_100000210936_100009817552 [1,0,0,0,1,0|2,0,0]=4 6342 B13R1.90 CCc1ccccc1SCC(C)C 62a_100000210624_100011215823 [1,0,0,0,1,0|1,1,0]=4 6343 B13R1.90 CCc1ccccc1SCC(C)C 62a_100011215823_100000210760 [1,0,0,0,1,0|1,1,0]=4 6344 B13R1.90 CNc1ccccc1C=CC(C)C 271570a_100016257149_100020606079 [1,0,0,0,1,0|0,0,1]=3 6345 B13R1.90 CNc1ccccc1C=CC(C)O 271570a_200011019289_100020606079 [1,0,0,0,1,0|1,0,1]=4 6346 B13R1.90 CNc1ccccc1OCC(C)C 34a_100000033821_100000210624 [1,0,0,0,1,0|0,0,0]=2 6347 B13R1.90 CNc1ccccc1OCC(C)C 34a_100000742603_200000210301 [1,0,0,0,1,0|0,0,0]=2 6348 B13R1.90 CNc1ccccc1OCC(C)O 34a_100000033821_100011218427 [1,0,0,0,1,0|1,0,0]=3 6349 B13R1.90 CNc1ccccc1OCC(F)F 2230a_100000688611_200000210301 [1,0,0,0,1,0|2,0,0]=4 6350 B13R1.90 CNc1ccccc1OCC(F)F 27a_100102657272_100000692002 [1,0,0,0,1,0|2,0,0]=4 6351 B13R1.90 CNc1ccccc1OCC(F)F 34a_100000033821_100011934356 [1,0,0,0,1,0|2,0,0]=4 6352 B13R1.90 CNc1ccccc1OCC(F)F 34a_100000688611_200000210301 [1,0,0,0,1,0|2,0,0]=4 6353 B13R1.90 CNc1ccccc1OC[C@@H](C)O 34a_100000033821_100009817552 [1,0,0,0,1,0|1,0,0]=3 6354 B13R1.90 CNc1ccccc1SCC(C)C 62a_100000210624_100020606079 [1,0,0,0,1,0|0,1,0]=3 6355 B13R1.90 CNc1ccccc1SCC(C)C 62a_100020606079_100000210760 [1,0,0,0,1,0|0,1,0]=3 6356 B13R1.90 CNc1ccccc1SCC(C)O 62a_100011218427_100020606079 [1,0,0,0,1,0|1,1,0]=4 6357 B13R1.90 CNc1ccccc1SCC(C)O 62a_100020606079_100011218427 [1,0,0,0,1,0|1,1,0]=4 6358 B13R1.90 CNc1ccccc1SC[C@@H](C)O 62a_100009817552_100020606079 [1,0,0,0,1,0|1,1,0]=4 6359 B13R1.90 CNc1ccccc1SC[C@@H](C)O 62a_100020606079_100009817552 [1,0,0,0,1,0|1,1,0]=4 6360 B13R1.90 CNc1cccnc1C=CC(C)C 271570a_100016257149_200011806188 [1,0,0,0,1,0|1,0,1]=4 6361 B13R1.90 CNc1cccnc1SCC(C)C 62a_100000210624_200011806188 [1,0,0,0,1,0|1,1,0]=4 6362 B13R1.90 CNc1ccncc1C=CC(C)C 271570a_100016257149_100010069531 [1,0,0,0,1,0|1,0,1]=4 6363 B13R1.90 CNc1ccncc1SCC(C)C 62a_100000210624_100010069531 [1,0,0,0,1,0|1,1,0]=4 6364 B13R1.90 CNc1ccncc1SCC(C)C 62a_100010069531_100000210760 [1,0,0,0,1,0|1,1,0]=4 6365 B13R1.90 CNc1ncccc1C=CC(C)C 271570a_100016257149_100000700899 [1,0,0,0,1,0|1,0,1]=4 6366 B13R1.90 CNc1ncccc1SCC(C)C 62a_100000210624_100000700899 [1,0,0,0,1,0|1,1,0]=4 6367 B13R1.90 CNc1ncccc1SCC(C)C 62a_100000700899_100000210760 [1,0,0,0,1,0|1,1,0]=4 6368 B13R1.90 COc1ccccc1C=CC(C)C 271570a_100016257149_100000174000 [1,0,0,0,1,0|1,0,1]=4 6369 B13R1.90 COc1ccccc1COC(C)C 34a_100000211301_100000210206 [1,0,0,0,1,0|1,0,1]=4 6370 B13R1.90 COc1ccccc1COC(C)C 34a_100000212225_100000210004 [1,0,0,0,1,0|1,0,1]=4 6371 B13R1.90 COc1ccccc1NCC(C)C 34a_100000210025_100000210624 [1,0,0,0,1,0|2,0,0]=4 6372 B13R1.90 COc1ccccc1OCC(C)C 34a_100000210385_100000210624 [1,0,0,0,1,0|1,0,0]=3 6373 B13R1.90 COc1ccccc1OCC(C)O 34a_100000210385_100011218427 [1,0,0,0,1,0|2,0,0]=4 6374 B13R1.90 COc1ccccc1OC[C@@H](C)O 34a_100000210385_100009817552 [1,0,0,0,1,0|2,0,0]=4 6375 B13R1.90 COc1ccccc1SCC(C)C 62a_100000210334_100000210760 [1,0,0,0,1,0|1,1,0]=4 6376 B13R1.90 COc1ccccc1SCC(C)C 62a_100000210624_100000210334 [1,0,0,0,1,0|1,1,0]=4 6377 B13R1.90 COc1cccnc1OCC(C)C 34a_100025773188_100000210624 [1,0,0,0,1,0|2,0,0]=4 6378 B13R1.90 COc1ccncc1OCC(C)C 34a_100000101186_100000210624 [1,0,0,0,1,0|2,0,0]=4 6379 B13R1.90 COc1ncccc1OCC(C)C 34a_100000698397_100000210624 [1,0,0,0,1,0|2,0,0]=4 6380 B13R1.90 COc1ncccc1OCC(C)C 7a_100000698397_100000210760 [1,0,0,0,1,0|2,0,0]=4 6381 B13R1.90 CSc1ccccc1C=CC(C)C 271570a_100016257149_100011217816 [1,0,0,0,1,0|1,0,1]=4 6382 B13R1.90 CSc1ccccc1COC(C)C 34a_100000212225_100000699184 [1,0,0,0,1,0|1,0,1]=4 6383 B13R1.90 CSc1ccccc1COC(C)C 34a_100000699167_100000210206 [1,0,0,0,1,0|1,0,1]=4 6384 B13R1.90 CSc1ccccc1NCC(C)C 34a_100000211160_100000210624 [1,0,0,0,1,0|2,0,0]=4 6385 B13R1.90 CSc1ccccc1OCC(C)C 34a_100011216402_100000210624 [1,0,0,0,1,0|1,0,0]=3 6386 B13R1.90 CSc1ccccc1OCC(C)O 34a_100011216402_100011218427 [1,0,0,0,1,0|2,0,0]=4 6387 B13R1.90 CSc1ccccc1OC[C@@H](C)O 34a_100011216402_100009817552 [1,0,0,0,1,0|2,0,0]=4 6388 B13R1.90 CSc1ccccc1SCC(C)C 62a_100000210624_100011217816 [1,0,0,0,1,0|1,1,0]=4 6389 B13R1.90 CSc1ccccc1SCC(C)C 62a_100011217816_100000210760 [1,0,0,0,1,0|1,1,0]=4 6390 B13R1.90 [13CH3]Nc1ccccc1OCC(F)F 2230a_100000688611_200025704644 [1,0,0,0,1,0|2,0,0]=4 6391 B13R1.90 [13CH3]Nc1ccccc1OCC(F)F 34a_100000688611_200025704644 [1,0,0,0,1,0|2,0,0]=4 6392 B13R1.201 C=C(C)CC(=O)c1ccccc1C 1458a_100000212026_100000748629 [1,0,0,0,1,0|0,0,2]=4 6393 B13R1.201 CC(=O)CC(=O)c1ccccc1C 1458a_100000070787_100000741374 [1,0,0,0,1,0|1,0,1]=4 6394 B13R1.201 CC(C)CC(=O)c1ccccc1Br 1458a_100000188424_100000210624 [1,0,0,0,1,0|1,0,0]=3 6395 B13R1.201 CC(C)CC(=O)c1ccccc1Cl 1458a_100000185844_100000210624 [1,0,0,0,1,0|1,0,0]=3 6396 B13R1.201 CC(C)CC(=O)c1ccccc1F 1458a_100000188656_100000210624 [1,0,0,0,1,0|1,0,0]=3 6397 B13R1.201 CC(C)CC(=O)c1ccccc1I 1458a_100000187884_100000210624 [1,0,0,0,1,0|1,0,0]=3 6398 B13R1.201 CC(C)CC(=O)c1ccccc1O 1458a_100015234032_100000210624 [1,0,0,0,1,0|1,0,0]=3 6399 B13R1.201 CC(C)CC(=O)c1ccccc1[O-] 1458a_100009911694_100000210624 [1,0,0,0,1,0|1,0,0]=3 6400 B13R1.201 CC(C)C[C@H](N)c1ccccc1N 271570a_100015190218_100000210017 [1,0,0,0,1,0|1,0,1]=4 6401 B13R1.201 CC(C)NC(=O)c1ccccc1Br 11a_100138425928_100000188424 [1,0,0,0,1,0|2,0,0]=4 6402 B13R1.201 CC(C)NC(=O)c1ccccc1Br 1626a_100138425928_100000188424 [1,0,0,0,1,0|2,0,0]=4 6403 B13R1.201 CC(C)NC(=O)c1ccccc1Br 240690a_100138425928_100000188424 [1,0,0,0,1,0|2,0,0]=4 6404 B13R1.201 CC(C)NC(=O)c1ccccc1Br 527a_100138425928_100000188424 [1,0,0,0,1,0|2,0,0]=4 6405 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 11a_100138425928_100000185844 [1,0,0,0,1,0|2,0,0]=4 6406 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 1626a_100138425928_100000185844 [1,0,0,0,1,0|2,0,0]=4 6407 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 240690a_100138425928_100000185844 [1,0,0,0,1,0|2,0,0]=4 6408 B13R1.201 CC(C)NC(=O)c1ccccc1Cl 527a_100138425928_100000185844 [1,0,0,0,1,0|2,0,0]=4 6409 B13R1.201 CC(C)NC(=O)c1ccccc1F 11a_100138425928_100000188656 [1,0,0,0,1,0|2,0,0]=4 6410 B13R1.201 CC(C)NC(=O)c1ccccc1F 1626a_100138425928_100000188656 [1,0,0,0,1,0|2,0,0]=4 6411 B13R1.201 CC(C)NC(=O)c1ccccc1F 240690a_100138425928_100000188656 [1,0,0,0,1,0|2,0,0]=4 6412 B13R1.201 CC(C)NC(=O)c1ccccc1F 527a_100138425928_100000188656 [1,0,0,0,1,0|2,0,0]=4 6413 B13R1.201 CC(C)NC(=O)c1ccccc1I 11a_100138425928_100000187884 [1,0,0,0,1,0|2,0,0]=4 6414 B13R1.201 CC(C)NC(=O)c1ccccc1I 1626a_100138425928_100000187884 [1,0,0,0,1,0|2,0,0]=4 6415 B13R1.201 CC(C)NC(=O)c1ccccc1I 240690a_100138425928_100000187884 [1,0,0,0,1,0|2,0,0]=4 6416 B13R1.201 CC(C)NC(=O)c1ccccc1I 527a_100138425928_100000187884 [1,0,0,0,1,0|2,0,0]=4 6417 B13R1.201 CC(C)NC(=O)c1ccccc1O 240690a_100138425928_100015234032 [1,0,0,0,1,0|2,0,0]=4 6418 B13R1.201 CC(C)NC(=O)c1ccccc1O 271570a_203496583355_200000152627 [1,0,0,0,1,0|2,0,0]=4 6419 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 1626a_100138425928_100009911694 [1,0,0,0,1,0|2,0,0]=4 6420 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 240690a_100138425928_100009911694 [1,0,0,0,1,0|2,0,0]=4 6421 B13R1.201 CC(C)NC(=O)c1ccccc1[O-] 527a_100138425928_100009911694 [1,0,0,0,1,0|2,0,0]=4 6422 B13R1.201 CC(C)OC(=O)c1ccccc1O 271570a_203496583355_100000169877 [1,0,0,0,1,0|1,0,0]=3 6423 B13R1.201 CC(C)OC(C)c1ccccc1N 7a_100011405641_100000210206 [1,0,0,0,1,0|1,0,1]=4 6424 B13R1.201 CC(O)CC(=O)c1ccccc1Br 1458a_100000188424_100011218427 [1,0,0,0,1,0|2,0,0]=4 6425 B13R1.201 CC(O)CC(=O)c1ccccc1Cl 1458a_100000185844_100011218427 [1,0,0,0,1,0|2,0,0]=4 6426 B13R1.201 CC(O)CC(=O)c1ccccc1F 1458a_100000188656_100011218427 [1,0,0,0,1,0|2,0,0]=4 6427 B13R1.201 CC(O)CC(=O)c1ccccc1I 1458a_100000187884_100011218427 [1,0,0,0,1,0|2,0,0]=4 6428 B13R1.201 CC(O)CC(=O)c1ccccc1O 1458a_100015234032_100011218427 [1,0,0,0,1,0|2,0,0]=4 6429 B13R1.201 CC(O)CC(=O)c1ccccc1[O-] 1458a_100009911694_100011218427 [1,0,0,0,1,0|2,0,0]=4 6430 B13R1.201 CN(C)CC(=O)c1ccccc1Br 269982a_100102631434_100000199116 [1,0,0,0,1,0|2,0,0]=4 6431 B13R1.201 CN(C)CC(=O)c1ccccc1Cl 269982a_100102631434_100000211432 [1,0,0,0,1,0|2,0,0]=4 6432 B13R1.201 CN(C)CC(=O)c1ccccc1F 269982a_100102631434_100000204681 [1,0,0,0,1,0|2,0,0]=4 6433 B13R1.201 CN(C)CC(=O)c1ccccc1O 269982a_100102631434_100000188908 [1,0,0,0,1,0|2,0,0]=4 6434 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [1,0,0,0,1,0|0,0,0]=2 6435 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [1,0,0,0,1,0|1,0,0]=3 6436 B13R1.201 Cc1ccccc1C(=O)CC(F)F 1458a_100000212026_100011934356 [1,0,0,0,1,0|2,0,0]=4 6437 B13R1.201 Cc1ccccc1C(=O)CN(C)C 2230a_100102631434_100000741374 [1,0,0,0,1,0|1,0,0]=3 6438 B13R1.201 Cc1ccccc1C(=O)CN(C)C 269982a_100102631434_100000741374 [1,0,0,0,1,0|1,0,0]=3 6439 B13R1.201 Cc1ccccc1C(=O)NC(C)C 11a_100138425928_100000212026 [1,0,0,0,1,0|1,0,0]=3 6440 B13R1.201 Cc1ccccc1C(=O)NC(C)C 1626a_100138425928_100000212026 [1,0,0,0,1,0|1,0,0]=3 6441 B13R1.201 Cc1ccccc1C(=O)NC(C)C 240690a_100138425928_100000212026 [1,0,0,0,1,0|1,0,0]=3 6442 B13R1.201 Cc1ccccc1C(=O)NC(C)C 527a_100138425928_100000212026 [1,0,0,0,1,0|1,0,0]=3 6443 B13R1.201 Cc1ccccc1C(C)OC(C)C 34a_100000742021_100000210206 [1,0,0,0,1,0|1,0,1]=4 6444 B13R1.201 Cc1ccccc1C(C)OC(C)C 7a_100000742021_100000210206 [1,0,0,0,1,0|1,0,1]=4 6445 B13R1.201 Cc1ccccc1N(C)CC(C)C 2230a_100000219699_100000210760 [1,0,0,0,1,0|2,0,0]=4 6446 B13R1.201 Cc1ccccc1N(C)CC(C)C 269982a_100000219699_100000210624 [1,0,0,0,1,0|2,0,0]=4 6447 B13R1.201 Cc1ccccc1N(C)CC(C)C 34a_100000219699_100000210624 [1,0,0,0,1,0|2,0,0]=4 6448 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000210755 [1,0,0,0,1,0|1,0,1]=4 6449 B13R1.89 C#Cc1ccccc1C(=O)C(C)C 1458a_100011243808_100000210206 [0,0,0,0,2,0|1,0,1]=4 6450 B13R1.89 C=Cc1ccccc1C(=O)C(C)C 1458a_100011830265_100000210206 [0,0,0,0,2,0|1,0,1]=4 6451 B13R1.89 CC(C)C(=O)c1ccccc1C#N 1458a_100000742908_100000210206 [0,0,0,0,2,0|2,0,0]=4 6452 B13R1.89 CC(C)C(=O)c1ccccc1CO 1458a_100011301526_100000210206 [0,0,0,0,2,0|2,0,0]=4 6453 B13R1.89 CC(C)C(=O)c1ccccc1I=O 1458a_100000032414_100000210206 [0,0,0,0,2,0|2,0,0]=4 6454 B13R1.89 CCc1ccccc1C(=O)C(C)C 1458a_100000689120_100000210206 [0,0,0,0,2,0|1,0,0]=3 6455 B13R1.89 CCc1ccccc1C(=O)N(C)C 11a_100102631434_100000689120 [0,0,0,0,2,0|2,0,0]=4 6456 B13R1.89 CCc1ccccc1C(=O)N(C)C 1626a_100102631434_100000689120 [0,0,0,0,2,0|2,0,0]=4 6457 B13R1.89 CCc1ccccc1C(=O)N(C)C 240690a_100102631434_100000689120 [0,0,0,0,2,0|2,0,0]=4 6458 B13R1.89 CCc1ccccc1C(=O)N(C)C 527a_100102631434_100000689120 [0,0,0,0,2,0|2,0,0]=4 6459 B13R1.89 CN(C)C(=O)c1ccccc1N[13CH3] 34a_100000188421_200025704644 [0,0,0,0,2,0|1,0,0]=3 6460 B13R1.89 CN(C)C(=O)c1ccccc1O[13CH3] 34a_100000192106_200025704644 [0,0,0,0,2,0|2,0,0]=4 6461 B13R1.89 CN(C)C(=O)c1ccccc1O[13CH3] 7a_100000192106_200025704644 [0,0,0,0,2,0|2,0,0]=4 6462 B13R1.89 CN(C)C(=O)c1ccccc1S[13CH3] 62a_100000159526_200025704644 [0,0,0,0,2,0|2,0,0]=4 6463 B13R1.89 CN(C)C(=O)c1ccccc1S[13CH3] 62a_200025704644_100000159526 [0,0,0,0,2,0|2,0,0]=4 6464 B13R1.89 CNc1ccccc1C(=C(C)C)C 271570a_200000049429_100020606079 [0,0,0,0,2,0|1,0,1]=4 6465 B13R1.89 CNc1ccccc1C(=O)N(C)C 34a_100000188421_200000210301 [0,0,0,0,2,0|1,0,0]=3 6466 B13R1.89 CNc1ncccc1C(=O)N(C)C 27a_100102657272_100000159563 [0,0,0,0,2,0|2,0,0]=4 6467 B13R1.89 COc1ccccc1C(=O)C(C)C 1458a_100000185835_100000210206 [0,0,0,0,2,0|1,0,0]=3 6468 B13R1.89 COc1ccccc1C(=O)N(C)C 11a_100102631434_100000185835 [0,0,0,0,2,0|2,0,0]=4 6469 B13R1.89 COc1ccccc1C(=O)N(C)C 1626a_100102631434_100000185835 [0,0,0,0,2,0|2,0,0]=4 6470 B13R1.89 COc1ccccc1C(=O)N(C)C 240690a_100102631434_100000185835 [0,0,0,0,2,0|2,0,0]=4 6471 B13R1.89 COc1ccccc1C(=O)N(C)C 34a_100000192106_200000210301 [0,0,0,0,2,0|2,0,0]=4 6472 B13R1.89 COc1ccccc1C(=O)N(C)C 527a_100102631434_100000185835 [0,0,0,0,2,0|2,0,0]=4 6473 B13R1.89 COc1ccccc1C(=O)N(C)C 7a_100000192106_200000210301 [0,0,0,0,2,0|2,0,0]=4 6474 B13R1.89 CSc1ccccc1C(=O)C(C)C 1458a_100000183967_100000210206 [0,0,0,0,2,0|1,0,0]=3 6475 B13R1.89 CSc1ccccc1C(=O)N(C)C 11a_100102631434_100000183967 [0,0,0,0,2,0|2,0,0]=4 6476 B13R1.89 CSc1ccccc1C(=O)N(C)C 1626a_100102631434_100000183967 [0,0,0,0,2,0|2,0,0]=4 6477 B13R1.89 CSc1ccccc1C(=O)N(C)C 240690a_100102631434_100000183967 [0,0,0,0,2,0|2,0,0]=4 6478 B13R1.89 CSc1ccccc1C(=O)N(C)C 527a_100102631434_100000183967 [0,0,0,0,2,0|2,0,0]=4 6479 B13R1.89 CSc1ccccc1C(=O)N(C)C 62a_100000159526_200000210301 [0,0,0,0,2,0|2,0,0]=4 6480 B13R1.89 CSc1ccccc1C(=O)N(C)C 62a_200000210301_100000159526 [0,0,0,0,2,0|2,0,0]=4 6481 B15R1.84 CCc1ccccc1COCCC(C)C 34a_100011663872_100000210312 [1,0,0,0,0,1|1,0,1]=4 6482 B15R1.84 CCc1ccccc1COCCC(C)C 7a_100011663872_100000210626 [1,0,0,0,0,1|1,0,1]=4 6483 B15R1.84 CCc1ccccc1COCOC(C)C 34a_100011663872_100000709892 [1,0,0,0,0,1|1,0,1]=4 6484 B15R1.84 CNc1ccccc1OCCCC(C)C 34a_100000033821_100011214892 [1,0,0,0,0,1|1,0,1]=4 6485 B15R1.84 CNc1ccccc1OCCOC(C)C 34a_100000033821_100000211751 [1,0,0,0,0,1|2,0,0]=4 6486 B15R1.84 CNc1ccccc1OCCSC(C)C 34a_100000033821_100000730970 [1,0,0,0,0,1|2,0,0]=4 6487 B15R1.84 CNc1ccccc1SCCCC(C)C 62a_100011214892_100020606079 [1,0,0,0,0,1|1,0,1]=4 6488 B15R1.84 CNc1ccccc1SCCCC(C)C 62a_100020606079_100011214892 [1,0,0,0,0,1|1,0,1]=4 6489 B15R1.84 CNc1ccccc1SCCOC(C)C 62a_100000211751_100020606079 [1,0,0,0,0,1|2,0,0]=4 6490 B15R1.84 CNc1ccccc1SCCOC(C)C 62a_100020606079_100000211751 [1,0,0,0,0,1|2,0,0]=4 6491 B15R1.84 CNc1ccccc1SCCSC(C)C 62a_100000730970_100020606079 [1,0,0,0,0,1|2,0,0]=4 6492 B15R1.84 CNc1ccccc1SCCSC(C)C 62a_100020606079_100000730970 [1,0,0,0,0,1|2,0,0]=4 6493 B15R1.84 COc1ccccc1CCOCC(C)C 34a_100000210257_100011713687 [1,0,0,0,0,1|1,0,1]=4 6494 B15R1.84 COc1ccccc1CCOCC(C)C 34a_100011218620_100000210624 [1,0,0,0,0,1|1,0,1]=4 6495 B15R1.84 COc1ccccc1CCOCC(C)C 7a_100011218620_100000210760 [1,0,0,0,0,1|1,0,1]=4 6496 B15R1.84 COc1ccccc1COCCC(C)C 34a_100000210254_100000210004 [1,0,0,0,0,1|1,0,1]=4 6497 B15R1.84 COc1ccccc1COCCC(C)C 34a_100000211301_100000210312 [1,0,0,0,0,1|1,0,1]=4 6498 B15R1.84 COc1ccccc1COCCC(C)C 7a_100000210254_100000210004 [1,0,0,0,0,1|1,0,1]=4 6499 B15R1.84 COc1ccccc1COCOC(C)C 34a_100000211301_100000709892 [1,0,0,0,0,1|1,0,1]=4 6500 B15R1.84 CSc1ccccc1COCCC(C)C 34a_100000210254_100000699184 [1,0,0,0,0,1|1,0,1]=4 6501 B15R1.84 CSc1ccccc1COCCC(C)C 34a_100000699167_100000210312 [1,0,0,0,0,1|1,0,1]=4 6502 B15R1.84 CSc1ccccc1COCCC(C)C 7a_100000210254_100000699184 [1,0,0,0,0,1|1,0,1]=4 6503 B15R1.84 CSc1ccccc1COCOC(C)C 34a_100000699167_100000709892 [1,0,0,0,0,1|1,0,1]=4 6504 B15R1.8019 C=C(C)COCC(=O)c1ccccc1C 34a_100000210245_100000741374 [1,0,0,0,0,1|0,0,2]=4 6505 B15R1.8019 CC(=CCCC(=O)c1ccccc1C)C 1458a_100000212026_100011217483 [1,0,0,0,0,1|1,0,1]=4 6506 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 11a_100000718196_100000212026 [1,0,0,0,0,1|1,0,1]=4 6507 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 1626a_100000718196_100000212026 [1,0,0,0,0,1|1,0,1]=4 6508 B15R1.8019 CC(=CCNC(=O)c1ccccc1C)C 527a_100000718196_100000212026 [1,0,0,0,0,1|1,0,1]=4 6509 B15R1.8019 CC(=O)COCC(=O)c1ccccc1C 34a_100000211253_100000741374 [1,0,0,0,0,1|1,0,1]=4 6510 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Br 34a_100012180447_100000199116 [1,0,0,0,0,1|2,0,0]=4 6511 B15R1.8019 CC(Br)COCC(=O)c1ccccc1Cl 34a_100012180447_100000211432 [1,0,0,0,0,1|2,0,0]=4 6512 B15R1.8019 CC(Br)COCC(=O)c1ccccc1F 34a_100012180447_100000204681 [1,0,0,0,0,1|2,0,0]=4 6513 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011214892 [1,0,0,0,0,1|2,0,0]=4 6514 B15R1.8019 CC(C)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011214892 [1,0,0,0,0,1|2,0,0]=4 6515 B15R1.8019 CC(C)CCCC(=O)c1ccccc1F 1458a_100000188656_100011214892 [1,0,0,0,0,1|2,0,0]=4 6516 B15R1.8019 CC(C)CCCC(=O)c1ccccc1I 1458a_100000187884_100011214892 [1,0,0,0,0,1|2,0,0]=4 6517 B15R1.8019 CC(C)CCCC(=O)c1ccccc1O 1458a_100015234032_100011214892 [1,0,0,0,0,1|2,0,0]=4 6518 B15R1.8019 CC(C)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011214892 [1,0,0,0,0,1|2,0,0]=4 6519 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 11a_100000210545_100000188424 [1,0,0,0,0,1|2,0,0]=4 6520 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 1626a_100000210545_100000188424 [1,0,0,0,0,1|2,0,0]=4 6521 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 240690a_100000210545_100000188424 [1,0,0,0,0,1|2,0,0]=4 6522 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Br 527a_100000210545_100000188424 [1,0,0,0,0,1|2,0,0]=4 6523 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 11a_100000210545_100000185844 [1,0,0,0,0,1|2,0,0]=4 6524 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 1626a_100000210545_100000185844 [1,0,0,0,0,1|2,0,0]=4 6525 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 240690a_100000210545_100000185844 [1,0,0,0,0,1|2,0,0]=4 6526 B15R1.8019 CC(C)CCNC(=O)c1ccccc1Cl 527a_100000210545_100000185844 [1,0,0,0,0,1|2,0,0]=4 6527 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 11a_100000210545_100000188656 [1,0,0,0,0,1|2,0,0]=4 6528 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 1626a_100000210545_100000188656 [1,0,0,0,0,1|2,0,0]=4 6529 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 240690a_100000210545_100000188656 [1,0,0,0,0,1|2,0,0]=4 6530 B15R1.8019 CC(C)CCNC(=O)c1ccccc1F 527a_100000210545_100000188656 [1,0,0,0,0,1|2,0,0]=4 6531 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 11a_100000210545_100000187884 [1,0,0,0,0,1|2,0,0]=4 6532 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 1626a_100000210545_100000187884 [1,0,0,0,0,1|2,0,0]=4 6533 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 240690a_100000210545_100000187884 [1,0,0,0,0,1|2,0,0]=4 6534 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I 527a_100000210545_100000187884 [1,0,0,0,0,1|2,0,0]=4 6535 B15R1.8019 CC(C)CCNC(=O)c1ccccc1O 240690a_100000210545_100015234032 [1,0,0,0,0,1|2,0,0]=4 6536 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 1626a_100000210545_100009911694 [1,0,0,0,0,1|2,0,0]=4 6537 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 240690a_100000210545_100009911694 [1,0,0,0,0,1|2,0,0]=4 6538 B15R1.8019 CC(C)CCNC(=O)c1ccccc1[O-] 527a_100000210545_100009911694 [1,0,0,0,0,1|2,0,0]=4 6539 B15R1.8019 CC(C)CCOC(C)c1ccccc1N 7a_100011405641_100000210626 [1,0,0,0,0,1|1,0,1]=4 6540 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Br 34a_100000210953_100000199116 [1,0,0,0,0,1|2,0,0]=4 6541 B15R1.8019 CC(C)CNCC(=O)c1ccccc1Cl 34a_100000210953_100000211432 [1,0,0,0,0,1|2,0,0]=4 6542 B15R1.8019 CC(C)CNCC(=O)c1ccccc1F 34a_100000210953_100000204681 [1,0,0,0,0,1|2,0,0]=4 6543 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Br 22a_100000696102_100000188424 [1,0,0,0,0,1|2,0,0]=4 6544 B15R1.8019 CC(C)CNNC(=O)c1ccccc1Cl 22a_100000696102_100000185844 [1,0,0,0,0,1|2,0,0]=4 6545 B15R1.8019 CC(C)CNNC(=O)c1ccccc1F 22a_100000696102_100000188656 [1,0,0,0,0,1|2,0,0]=4 6546 B15R1.8019 CC(C)CNNC(=O)c1ccccc1I 22a_100000696102_100000187884 [1,0,0,0,0,1|2,0,0]=4 6547 B15R1.8019 CC(C)CNNC(=O)c1ccccc1O 22a_100000696102_100015234032 [1,0,0,0,0,1|2,0,0]=4 6548 B15R1.8019 CC(C)CNNC(=O)c1ccccc1[O-] 22a_100000696102_100009911694 [1,0,0,0,0,1|2,0,0]=4 6549 B15R1.8019 CC(C)COCC(=O)c1ccccc1Br 34a_100000210257_100000199116 [1,0,0,0,0,1|1,0,0]=3 6550 B15R1.8019 CC(C)COCC(=O)c1ccccc1Cl 34a_100000210257_100000211432 [1,0,0,0,0,1|1,0,0]=3 6551 B15R1.8019 CC(C)COCC(=O)c1ccccc1F 34a_100000210257_100000204681 [1,0,0,0,0,1|1,0,0]=3 6552 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Br 62a_100000199116_100000210760 [1,0,0,0,0,1|1,1,0]=4 6553 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000210624_100000211432 [1,0,0,0,0,1|1,1,0]=4 6554 B15R1.8019 CC(C)CSCC(=O)c1ccccc1Cl 62a_100000211432_100000210760 [1,0,0,0,0,1|1,1,0]=4 6555 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000204681_100000210760 [1,0,0,0,0,1|1,1,0]=4 6556 B15R1.8019 CC(C)CSCC(=O)c1ccccc1F 62a_100000210624_100000204681 [1,0,0,0,0,1|1,1,0]=4 6557 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000188908_100000210760 [1,0,0,0,0,1|1,1,0]=4 6558 B15R1.8019 CC(C)CSCC(=O)c1ccccc1O 62a_100000210624_100000188908 [1,0,0,0,0,1|1,1,0]=4 6559 B15R1.8019 CC(C)NCCC(=O)c1ccccc1F 2230a_100138425928_100000086012 [1,0,0,0,0,1|2,0,0]=4 6560 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Br 1458a_100000188424_100000211751 [1,0,0,0,0,1|2,0,0]=4 6561 B15R1.8019 CC(C)OCCC(=O)c1ccccc1Cl 1458a_100000185844_100000211751 [1,0,0,0,0,1|2,0,0]=4 6562 B15R1.8019 CC(C)OCCC(=O)c1ccccc1F 1458a_100000188656_100000211751 [1,0,0,0,0,1|2,0,0]=4 6563 B15R1.8019 CC(C)OCCC(=O)c1ccccc1I 1458a_100000187884_100000211751 [1,0,0,0,0,1|2,0,0]=4 6564 B15R1.8019 CC(C)OCCC(=O)c1ccccc1O 1458a_100015234032_100000211751 [1,0,0,0,0,1|2,0,0]=4 6565 B15R1.8019 CC(C)OCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000211751 [1,0,0,0,0,1|2,0,0]=4 6566 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Br 1458a_100000188424_100000730970 [1,0,0,0,0,1|2,0,0]=4 6567 B15R1.8019 CC(C)SCCC(=O)c1ccccc1Cl 1458a_100000185844_100000730970 [1,0,0,0,0,1|2,0,0]=4 6568 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 1458a_100000188656_100000730970 [1,0,0,0,0,1|2,0,0]=4 6569 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000086012_100000210206 [1,0,0,0,0,1|2,0,0]=4 6570 B15R1.8019 CC(C)SCCC(=O)c1ccccc1F 62a_100000210206_100000086012 [1,0,0,0,0,1|2,0,0]=4 6571 B15R1.8019 CC(C)SCCC(=O)c1ccccc1I 1458a_100000187884_100000730970 [1,0,0,0,0,1|2,0,0]=4 6572 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 1458a_100015234032_100000730970 [1,0,0,0,0,1|2,0,0]=4 6573 B15R1.8019 CC(C)SCCC(=O)c1ccccc1O 62a_100000210206_100009873196 [1,0,0,0,0,1|2,0,0]=4 6574 B15R1.8019 CC(C)SCCC(=O)c1ccccc1[O-] 1458a_100009911694_100000730970 [1,0,0,0,0,1|2,0,0]=4 6575 B15R1.8019 CC(F)COCC(=O)c1ccccc1Br 34a_100015925927_100000199116 [1,0,0,0,0,1|2,0,0]=4 6576 B15R1.8019 CC(F)COCC(=O)c1ccccc1Cl 34a_100015925927_100000211432 [1,0,0,0,0,1|2,0,0]=4 6577 B15R1.8019 CC(F)COCC(=O)c1ccccc1F 34a_100015925927_100000204681 [1,0,0,0,0,1|2,0,0]=4 6578 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Br 34a_100016084084_100000199116 [1,0,0,0,0,1|2,0,0]=4 6579 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1Cl 34a_100016084084_100000211432 [1,0,0,0,0,1|2,0,0]=4 6580 B15R1.8019 C[C@@H](Cl)COCC(=O)c1ccccc1F 34a_100016084084_100000204681 [1,0,0,0,0,1|2,0,0]=4 6581 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Br 34a_100000737577_100000199116 [1,0,0,0,0,1|2,0,0]=4 6582 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1Cl 34a_100000737577_100000211432 [1,0,0,0,0,1|2,0,0]=4 6583 B15R1.8019 C[C@@H](N)COCC(=O)c1ccccc1F 34a_100000737577_100000204681 [1,0,0,0,0,1|2,0,0]=4 6584 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)C 1458a_100000212026_100011214892 [1,0,0,0,0,1|1,0,0]=3 6585 B15R1.8019 Cc1ccccc1C(=O)CCCC(C)O 1458a_100000212026_200000718107 [1,0,0,0,0,1|2,0,0]=4 6586 B15R1.8019 Cc1ccccc1C(=O)CCCN(C)C 1458a_100000212026_100000695564 [1,0,0,0,0,1|2,0,0]=4 6587 B15R1.8019 Cc1ccccc1C(=O)CCOC(C)C 1458a_100000212026_100000211751 [1,0,0,0,0,1|1,0,0]=3 6588 B15R1.8019 Cc1ccccc1C(=O)CCSC(C)C 1458a_100000212026_100000730970 [1,0,0,0,0,1|1,0,0]=3 6589 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 2230a_100000210953_100000741374 [1,0,0,0,0,1|1,0,0]=3 6590 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)C 34a_100000210953_100000741374 [1,0,0,0,0,1|1,0,0]=3 6591 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 2230a_100000210904_100000741374 [1,0,0,0,0,1|2,0,0]=4 6592 B15R1.8019 Cc1ccccc1C(=O)CNCC(C)O 34a_100000210904_100000741374 [1,0,0,0,0,1|2,0,0]=4 6593 B15R1.8019 Cc1ccccc1C(=O)COCC(C)Br 34a_100012180447_100000741374 [1,0,0,0,0,1|1,0,0]=3 6594 B15R1.8019 Cc1ccccc1C(=O)COCC(C)C 34a_100000210257_100000741374 [1,0,0,0,0,1|0,0,0]=2 6595 B15R1.8019 Cc1ccccc1C(=O)COCC(C)F 34a_100015925927_100000741374 [1,0,0,0,0,1|1,0,0]=3 6596 B15R1.8019 Cc1ccccc1C(=O)COCC(F)F 34a_100000743014_100000741374 [1,0,0,0,0,1|2,0,0]=4 6597 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)Cl 34a_100016084084_100000741374 [1,0,0,0,0,1|1,0,0]=3 6598 B15R1.8019 Cc1ccccc1C(=O)COC[C@@H](C)N 34a_100000737577_100000741374 [1,0,0,0,0,1|1,0,0]=3 6599 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000210624_100000741374 [1,0,0,0,0,1|0,1,0]=3 6600 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)C 62a_100000741374_100000210760 [1,0,0,0,0,1|0,1,0]=3 6601 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100000741374_100011218427 [1,0,0,0,0,1|1,1,0]=4 6602 B15R1.8019 Cc1ccccc1C(=O)CSCC(C)O 62a_100011218427_100000741374 [1,0,0,0,0,1|1,1,0]=4 6603 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100000741374_100009817552 [1,0,0,0,0,1|1,1,0]=4 6604 B15R1.8019 Cc1ccccc1C(=O)CSC[C@@H](C)O 62a_100009817552_100000741374 [1,0,0,0,0,1|1,1,0]=4 6605 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 11a_100000210545_100000212026 [1,0,0,0,0,1|1,0,0]=3 6606 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 1626a_100000210545_100000212026 [1,0,0,0,0,1|1,0,0]=3 6607 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 240690a_100000210545_100000212026 [1,0,0,0,0,1|1,0,0]=3 6608 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)C 527a_100000210545_100000212026 [1,0,0,0,0,1|1,0,0]=3 6609 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 240690a_200000755665_100000212026 [1,0,0,0,0,1|2,0,0]=4 6610 B15R1.8019 Cc1ccccc1C(=O)NCCC(C)O 527a_200000755665_100000212026 [1,0,0,0,0,1|2,0,0]=4 6611 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 240690a_100000210585_100000212026 [1,0,0,0,0,1|2,0,0]=4 6612 B15R1.8019 Cc1ccccc1C(=O)NCCN(C)C 527a_100000210585_100000212026 [1,0,0,0,0,1|2,0,0]=4 6613 B15R1.8019 Cc1ccccc1C(=O)NN=CC(C)C 4a_100000181371_100000210432 [1,0,0,0,0,1|1,0,1]=4 6614 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)C 22a_100000696102_100000212026 [1,0,0,0,0,1|1,0,0]=3 6615 B15R1.8019 Cc1ccccc1C(=O)NNCC(C)O 22a_200000730056_100000212026 [1,0,0,0,0,1|2,0,0]=4 6616 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 34a_100000742021_100000210312 [1,0,0,0,0,1|1,0,1]=4 6617 B15R1.8019 Cc1ccccc1C(C)OCCC(C)C 7a_100000742021_100000210626 [1,0,0,0,0,1|1,0,1]=4 6618 B15R1.8019 Cc1ccccc1C(C)OCOC(C)C 34a_100000742021_100000709892 [1,0,0,0,0,1|1,0,1]=4 6619 B15R1.5925 CCCCC(=Cc1ccccc1NC)Br 271570a_206741709834_100020606079 [1,0,0,0,0,1|2,0,0]=4 6620 B15R1.5925 CCCCC(=O)Cc1ccccc1OC 1458a_100000210183_100000210004 [1,0,0,0,0,1|2,0,0]=4 6621 B15R1.5925 CCCCC(=O)Cc1ccccc1OC 1458a_100000211604_100000210211 [1,0,0,0,0,1|2,0,0]=4 6622 B15R1.5925 CCCCC(=O)Cc1ccccc1SC 1458a_100000210183_100000699184 [1,0,0,0,0,1|2,0,0]=4 6623 B15R1.5925 CCCCC(=O)Nc1ccccc1CC 11a_100000212081_100000210183 [1,0,0,0,0,1|2,0,0]=4 6624 B15R1.5925 CCCCC(=O)Nc1ccccc1CC 1626a_100000212081_100000210183 [1,0,0,0,0,1|2,0,0]=4 6625 B15R1.5925 CCCCC(=O)Nc1ccccc1CC 22a_100000212081_100000210183 [1,0,0,0,0,1|2,0,0]=4 6626 B15R1.5925 CCCCC(=O)Nc1ccccc1CC 527a_100000212081_100000210183 [1,0,0,0,0,1|2,0,0]=4 6627 B15R1.5925 CCCCC(=O)Nc1ccccc1OC 11a_100000210025_100000210183 [1,0,0,0,0,1|2,0,0]=4 6628 B15R1.5925 CCCCC(=O)Nc1ccccc1OC 1626a_100000210025_100000210183 [1,0,0,0,0,1|2,0,0]=4 6629 B15R1.5925 CCCCC(=O)Nc1ccccc1OC 22a_100000210025_100000210183 [1,0,0,0,0,1|2,0,0]=4 6630 B15R1.5925 CCCCC(=O)Nc1ccccc1OC 527a_100000210025_100000210183 [1,0,0,0,0,1|2,0,0]=4 6631 B15R1.5925 CCCCC(=O)Nc1ccccc1SC 11a_100000211160_100000210183 [1,0,0,0,0,1|2,0,0]=4 6632 B15R1.5925 CCCCC(=O)Nc1ccccc1SC 22a_100000211160_100000210183 [1,0,0,0,0,1|2,0,0]=4 6633 B15R1.5925 CCCNC(=O)Cc1ccccc1OC 11a_100020643023_100000211604 [1,0,0,0,0,1|2,0,0]=4 6634 B15R1.5925 CCCNC(=O)Cc1ccccc1OC 1626a_100020643023_100000211604 [1,0,0,0,0,1|2,0,0]=4 6635 B15R1.5925 CCCNC(=O)Cc1ccccc1OC 240690a_100020643023_100000211604 [1,0,0,0,0,1|2,0,0]=4 6636 B15R1.5925 CCCNC(=O)Cc1ccccc1OC 527a_100020643023_100000211604 [1,0,0,0,0,1|2,0,0]=4 6637 B15R1.5925 CCCNC(=O)Nc1ccccc1CC 2430a_100000212081_100020643023 [1,0,0,0,0,1|2,0,0]=4 6638 B15R1.5925 CCCNC(=O)Nc1ccccc1OC 2430a_100000210025_100020643023 [1,0,0,0,0,1|2,0,0]=4 6639 B15R1.5925 CCCNC(=O)Nc1ccccc1SC 2430a_100000211160_100020643023 [1,0,0,0,0,1|2,0,0]=4 6640 B15R1.5925 CCCNC(=O)Nc1ccccc1SC 512a_100000211160_100020643023 [1,0,0,0,0,1|2,0,0]=4 6641 B17R1.1421 CC(C)CNC(=O)CSc1ccccc1NN 62a_100000183291_100000241748 [0,0,0,0,0,2|2,0,0]=4 6642 B17R1.1421 CC(C)CNC(=O)CSc1ccccc1NN 62a_100000241748_100000183291 [0,0,0,0,0,2|2,0,0]=4 6643 B17R1.1421 CCc1ccccc1NCC(=O)NCC(C)C 2230a_100000212081_100000183291 [0,0,0,0,0,2|2,0,0]=4 6644 B17R1.1421 CCc1ccccc1NCC(=O)NCC(C)C 34a_100000212081_100000183291 [0,0,0,0,0,2|2,0,0]=4 6645 B17R1.1421 CCc1ccccc1NCC(=O)NCC(C)C 7a_100000212081_100000183291 [0,0,0,0,0,2|2,0,0]=4 6646 B17R1.1421 CCc1ccccc1NNC(=O)CCC(C)C 22a_100000737054_100000181311 [0,0,0,0,0,2|2,0,0]=4 6647 B17R1.1421 CCc1ccccc1NNC(=O)NCC(C)C 273464a_100000210953_100000737054 [0,0,0,0,0,2|2,0,0]=4 6648 B17R1.1421 CCc1ccccc1NNC(=O)NCC(C)C 512a_100000210953_100000737054 [0,0,0,0,0,2|2,0,0]=4 6649 B17R1.1421 CCc1ccccc1OCC(=O)CCC(C)C 1458a_100000182566_100000210312 [0,0,0,0,0,2|2,0,0]=4 6650 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 11a_100000210953_100000182566 [0,0,0,0,0,2|2,0,0]=4 6651 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 1626a_100000210953_100000182566 [0,0,0,0,0,2|2,0,0]=4 6652 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 240690a_100000210953_100000182566 [0,0,0,0,0,2|2,0,0]=4 6653 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 34a_100000210936_100000183291 [0,0,0,0,0,2|2,0,0]=4 6654 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 527a_100000210953_100000182566 [0,0,0,0,0,2|2,0,0]=4 6655 B17R1.1421 CCc1ccccc1OCC(=O)NCC(C)C 7a_100000210936_100000183291 [0,0,0,0,0,2|2,0,0]=4 6656 B17R1.1421 CCc1ccccc1SCC(=O)NCC(C)C 62a_100000183291_100011215823 [0,0,0,0,0,2|2,0,0]=4 6657 B17R1.1421 CCc1ccccc1SCC(=O)NCC(C)C 62a_100011215823_100000183291 [0,0,0,0,0,2|2,0,0]=4 6658 B17R1.1421 CNc1ccccc1OCC(=O)NCC(C)C 34a_100000033821_100000183291 [0,0,0,0,0,2|1,0,0]=3 6659 B17R1.1421 CNc1ccccc1SCC(=O)NCC(C)C 62a_100000183291_100020606079 [0,0,0,0,0,2|1,0,0]=3 6660 B17R1.1421 CNc1ccccc1SCC(=O)NCC(C)C 62a_100020606079_100000183291 [0,0,0,0,0,2|1,0,0]=3 6661 B17R1.1421 CNc1cccnc1SCC(=O)NCC(C)C 62a_100000183291_200011806188 [0,0,0,0,0,2|2,0,0]=4 6662 B17R1.1421 CNc1ccncc1SCC(=O)NCC(C)C 62a_100000183291_100010069531 [0,0,0,0,0,2|2,0,0]=4 6663 B17R1.1421 CNc1ccncc1SCC(=O)NCC(C)C 62a_100010069531_100000183291 [0,0,0,0,0,2|2,0,0]=4 6664 B17R1.1421 CNc1ncccc1SCC(=O)NCC(C)C 62a_100000183291_100000700899 [0,0,0,0,0,2|2,0,0]=4 6665 B17R1.1421 CNc1ncccc1SCC(=O)NCC(C)C 62a_100000700899_100000183291 [0,0,0,0,0,2|2,0,0]=4 6666 B17R1.1421 COc1ccccc1C=CC(=O)CCC(C)C 1458a_100000182468_100000210312 [0,0,0,0,0,2|2,0,0]=4 6667 B17R1.1421 COc1ccccc1C=CC(=O)NCC(C)C 11a_100000210953_100000182468 [0,0,0,0,0,2|2,0,0]=4 6668 B17R1.1421 COc1ccccc1C=CC(=O)NCC(C)C 1626a_100000210953_100000182468 [0,0,0,0,0,2|2,0,0]=4 6669 B17R1.1421 COc1ccccc1CCC(=O)CCC(C)C 1458a_100000181311_100011713687 [0,0,0,0,0,2|2,0,0]=4 6670 B17R1.1421 COc1ccccc1CCC(=O)CCC(C)C 1458a_100000184355_100000210312 [0,0,0,0,0,2|2,0,0]=4 6671 B17R1.1421 COc1ccccc1CCC(=O)NCC(C)C 11a_100000210953_100000184355 [0,0,0,0,0,2|2,0,0]=4 6672 B17R1.1421 COc1ccccc1CCC(=O)NCC(C)C 1626a_100000210953_100000184355 [0,0,0,0,0,2|2,0,0]=4 6673 B17R1.1421 COc1ccccc1CCC(=O)NCC(C)C 240690a_100000210953_100000184355 [0,0,0,0,0,2|2,0,0]=4 6674 B17R1.1421 COc1ccccc1CCC(=O)NCC(C)C 527a_100000210953_100000184355 [0,0,0,0,0,2|2,0,0]=4 6675 B17R1.1421 COc1ccccc1CNC(=O)CCC(C)C 11a_100000188900_100000181311 [0,0,0,0,0,2|2,0,0]=4 6676 B17R1.1421 COc1ccccc1CNC(=O)CCC(C)C 1626a_100000188900_100000181311 [0,0,0,0,0,2|2,0,0]=4 6677 B17R1.1421 COc1ccccc1CNC(=O)CCC(C)C 240690a_100000188900_100000181311 [0,0,0,0,0,2|2,0,0]=4 6678 B17R1.1421 COc1ccccc1CNC(=O)CCC(C)C 527a_100000188900_100000181311 [0,0,0,0,0,2|2,0,0]=4 6679 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 2708a_100000188900_100000210953 [0,0,0,0,0,2|2,0,0]=4 6680 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 2708a_100000210953_100000188900 [0,0,0,0,0,2|2,0,0]=4 6681 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 273464a_100000188900_100000210953 [0,0,0,0,0,2|2,0,0]=4 6682 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 273464a_100000210953_100000188900 [0,0,0,0,0,2|2,0,0]=4 6683 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 512a_100000188900_100000210953 [0,0,0,0,0,2|2,0,0]=4 6684 B17R1.1421 COc1ccccc1CNC(=O)NCC(C)C 512a_100000210953_100000188900 [0,0,0,0,0,2|2,0,0]=4 6685 B17R1.1421 COc1ccccc1NCC(=O)NCC(C)C 34a_100000210025_100000183291 [0,0,0,0,0,2|2,0,0]=4 6686 B17R1.1421 COc1ccccc1NNC(=O)CCC(C)C 22a_100000751209_100000181311 [0,0,0,0,0,2|2,0,0]=4 6687 B17R1.1421 COc1ccccc1NNC(=O)NCC(C)C 273464a_100000210953_100000751209 [0,0,0,0,0,2|2,0,0]=4 6688 B17R1.1421 COc1ccccc1NNC(=O)NCC(C)C 512a_100000210953_100000751209 [0,0,0,0,0,2|2,0,0]=4 6689 B17R1.1421 COc1ccccc1OCC(=O)CCC(C)C 1458a_100000182946_100000210312 [0,0,0,0,0,2|2,0,0]=4 6690 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 11a_100000210953_100000182946 [0,0,0,0,0,2|2,0,0]=4 6691 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 1626a_100000210953_100000182946 [0,0,0,0,0,2|2,0,0]=4 6692 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 240690a_100000210953_100000182946 [0,0,0,0,0,2|2,0,0]=4 6693 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 34a_100000210385_100000183291 [0,0,0,0,0,2|2,0,0]=4 6694 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 527a_100000210953_100000182946 [0,0,0,0,0,2|2,0,0]=4 6695 B17R1.1421 COc1ccccc1SCC(=O)NCC(C)C 62a_100000183291_100000210334 [0,0,0,0,0,2|2,0,0]=4 6696 B17R1.1421 COc1ccccc1SCC(=O)NCC(C)C 62a_100000210334_100000183291 [0,0,0,0,0,2|2,0,0]=4 6697 B17R1.1421 CSc1ccccc1CNC(=O)CCC(C)C 11a_102495365025_100000181311 [0,0,0,0,0,2|2,0,0]=4 6698 B17R1.1421 CSc1ccccc1CNC(=O)CCC(C)C 1626a_102495365025_100000181311 [0,0,0,0,0,2|2,0,0]=4 6699 B17R1.1421 CSc1ccccc1CNC(=O)CCC(C)C 240690a_102495365025_100000181311 [0,0,0,0,0,2|2,0,0]=4 6700 B17R1.1421 CSc1ccccc1CNC(=O)CCC(C)C 527a_102495365025_100000181311 [0,0,0,0,0,2|2,0,0]=4 6701 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 2708a_100000210953_102495365025 [0,0,0,0,0,2|2,0,0]=4 6702 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 2708a_102495365025_100000210953 [0,0,0,0,0,2|2,0,0]=4 6703 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 273464a_100000210953_102495365025 [0,0,0,0,0,2|2,0,0]=4 6704 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 273464a_102495365025_100000210953 [0,0,0,0,0,2|2,0,0]=4 6705 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 512a_100000210953_102495365025 [0,0,0,0,0,2|2,0,0]=4 6706 B17R1.1421 CSc1ccccc1CNC(=O)NCC(C)C 512a_102495365025_100000210953 [0,0,0,0,0,2|2,0,0]=4 6707 B17R1.1421 CSc1ccccc1NCC(=O)NCC(C)C 34a_100000211160_100000183291 [0,0,0,0,0,2|2,0,0]=4 6708 B17R1.1421 CSc1ccccc1OCC(=O)NCC(C)C 34a_100011216402_100000183291 [0,0,0,0,0,2|2,0,0]=4 6709 B17R1.1421 CSc1ccccc1SCC(=O)NCC(C)C 62a_100000183291_100011217816 [0,0,0,0,0,2|2,0,0]=4 6710 B17R1.1421 CSc1ccccc1SCC(=O)NCC(C)C 62a_100011217816_100000183291 [0,0,0,0,0,2|2,0,0]=4 6711 B17R1.6551 C#Cc1ccccc1NC(=O)COCC(C)C 11a_100011470550_100011223364 [0,0,0,0,0,2|1,0,1]=4 6712 B17R1.6551 C#Cc1ccccc1NC(=O)COCC(C)C 1626a_100011470550_100011223364 [0,0,0,0,0,2|1,0,1]=4 6713 B17R1.6551 C#Cc1ccccc1NC(=O)COCC(C)C 22a_100011470550_100011223364 [0,0,0,0,0,2|1,0,1]=4 6714 B17R1.6551 C=Cc1ccccc1NC(=O)COCC(C)C 11a_100012022501_100011223364 [0,0,0,0,0,2|1,0,1]=4 6715 B17R1.6551 C=Cc1ccccc1NC(=O)COCC(C)C 1626a_100012022501_100011223364 [0,0,0,0,0,2|1,0,1]=4 6716 B17R1.6551 C=Cc1ccccc1NC(=O)COCC(C)C 22a_100012022501_100011223364 [0,0,0,0,0,2|1,0,1]=4 6717 B17R1.6551 CC(C)COCC(=O)Cc1ccccc1C#N 1458a_100011223364_100000181865 [0,0,0,0,0,2|2,0,0]=4 6718 B17R1.6551 CC(C)COCC(=O)Cc1ccccc1C=O 1458a_100011223364_200009853537 [0,0,0,0,0,2|2,0,0]=4 6719 B17R1.6551 CC(C)COCC(=O)Cc1ccccc1CO 1458a_100011223364_100009816955 [0,0,0,0,0,2|2,0,0]=4 6720 B17R1.6551 CC(C)COCC(=O)Nc1ccccc1C#N 11a_100000211148_100011223364 [0,0,0,0,0,2|2,0,0]=4 6721 B17R1.6551 CC(C)COCC(=O)Nc1ccccc1C#N 1626a_100000211148_100011223364 [0,0,0,0,0,2|2,0,0]=4 6722 B17R1.6551 CC(C)COCC(=O)Nc1ccccc1CO 22a_100000212039_100011223364 [0,0,0,0,0,2|2,0,0]=4 6723 B17R1.6551 CCc1ccccc1NC(=O)CCCC(C)C 11a_100000212081_100011216857 [0,0,0,0,0,2|2,0,0]=4 6724 B17R1.6551 CCc1ccccc1NC(=O)CCCC(C)C 1626a_100000212081_100011216857 [0,0,0,0,0,2|2,0,0]=4 6725 B17R1.6551 CCc1ccccc1NC(=O)CCCC(C)C 22a_100000212081_100011216857 [0,0,0,0,0,2|2,0,0]=4 6726 B17R1.6551 CCc1ccccc1NC(=O)CCCC(C)C 527a_100000212081_100011216857 [0,0,0,0,0,2|2,0,0]=4 6727 B17R1.6551 CCc1ccccc1NC(=O)CCNC(C)C 2230a_100015183226_100000210206 [0,0,0,0,0,2|2,0,0]=4 6728 B17R1.6551 CCc1ccccc1NC(=O)CCNC(C)C 2230a_100138425928_200011194883 [0,0,0,0,0,2|2,0,0]=4 6729 B17R1.6551 CCc1ccccc1NC(=O)CCNC(C)C 34a_100015183226_100000210206 [0,0,0,0,0,2|2,0,0]=4 6730 B17R1.6551 CCc1ccccc1NC(=O)CCSC(C)C 62a_100000210206_200011194883 [0,0,0,0,0,2|2,0,0]=4 6731 B17R1.6551 CCc1ccccc1NC(=O)CNCC(C)C 2230a_100000210953_100000180193 [0,0,0,0,0,2|2,0,0]=4 6732 B17R1.6551 CCc1ccccc1NC(=O)CNCC(C)C 34a_100000210953_100000180193 [0,0,0,0,0,2|2,0,0]=4 6733 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)Br 34a_100012180447_100000180193 [0,0,0,0,0,2|2,0,0]=4 6734 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)C 11a_100000212081_100011223364 [0,0,0,0,0,2|1,0,0]=3 6735 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)C 1626a_100000212081_100011223364 [0,0,0,0,0,2|1,0,0]=3 6736 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)C 22a_100000212081_100011223364 [0,0,0,0,0,2|1,0,0]=3 6737 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)C 34a_100000210257_100000180193 [0,0,0,0,0,2|1,0,0]=3 6738 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)C 527a_100000212081_100011223364 [0,0,0,0,0,2|1,0,0]=3 6739 B17R1.6551 CCc1ccccc1NC(=O)COCC(C)F 34a_100015925927_100000180193 [0,0,0,0,0,2|2,0,0]=4 6740 B17R1.6551 CCc1ccccc1NC(=O)COC[C@@H](C)Cl 34a_100016084084_100000180193 [0,0,0,0,0,2|2,0,0]=4 6741 B17R1.6551 CCc1ccccc1NC(=O)COC[C@@H](C)N 34a_100000737577_100000180193 [0,0,0,0,0,2|2,0,0]=4 6742 B17R1.6551 CCc1ccccc1NC(=O)CSCC(C)C 62a_100000210624_100000180193 [0,0,0,0,0,2|1,1,0]=4 6743 B17R1.6551 CCc1ccccc1NC(=O)NCCC(C)C 2430a_100000212081_100000210545 [0,0,0,0,0,2|2,0,0]=4 6744 B17R1.6551 COc1ccccc1CC(=O)CCCC(C)C 1458a_100000211604_100011214892 [0,0,0,0,0,2|2,0,0]=4 6745 B17R1.6551 COc1ccccc1CC(=O)CCCC(C)C 1458a_100011216857_100000210004 [0,0,0,0,0,2|2,0,0]=4 6746 B17R1.6551 COc1ccccc1CC(=O)CCOC(C)C 1458a_100000211604_100000211751 [0,0,0,0,0,2|2,0,0]=4 6747 B17R1.6551 COc1ccccc1CC(=O)CCSC(C)C 1458a_100000211604_100000730970 [0,0,0,0,0,2|2,0,0]=4 6748 B17R1.6551 COc1ccccc1CC(=O)COCC(C)C 1458a_100011223364_100000210004 [0,0,0,0,0,2|1,0,0]=3 6749 B17R1.6551 COc1ccccc1CC(=O)NCCC(C)C 11a_100000210545_100000211604 [0,0,0,0,0,2|2,0,0]=4 6750 B17R1.6551 COc1ccccc1CC(=O)NCCC(C)C 1626a_100000210545_100000211604 [0,0,0,0,0,2|2,0,0]=4 6751 B17R1.6551 COc1ccccc1CC(=O)NCCC(C)C 240690a_100000210545_100000211604 [0,0,0,0,0,2|2,0,0]=4 6752 B17R1.6551 COc1ccccc1CC(=O)NCCC(C)C 527a_100000210545_100000211604 [0,0,0,0,0,2|2,0,0]=4 6753 B17R1.6551 COc1ccccc1CC(=O)NNCC(C)C 22a_100000696102_100000211604 [0,0,0,0,0,2|2,0,0]=4 6754 B17R1.6551 COc1ccccc1NC(=O)CCCC(C)C 11a_100000210025_100011216857 [0,0,0,0,0,2|2,0,0]=4 6755 B17R1.6551 COc1ccccc1NC(=O)CCCC(C)C 1626a_100000210025_100011216857 [0,0,0,0,0,2|2,0,0]=4 6756 B17R1.6551 COc1ccccc1NC(=O)CCCC(C)C 22a_100000210025_100011216857 [0,0,0,0,0,2|2,0,0]=4 6757 B17R1.6551 COc1ccccc1NC(=O)CCCC(C)C 527a_100000210025_100011216857 [0,0,0,0,0,2|2,0,0]=4 6758 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 2230a_100015185781_100000210206 [0,0,0,0,0,2|2,0,0]=4 6759 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 2230a_100138425928_100000242059 [0,0,0,0,0,2|2,0,0]=4 6760 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 34a_100015185781_100000210206 [0,0,0,0,0,2|2,0,0]=4 6761 B17R1.6551 COc1ccccc1NC(=O)CCSC(C)C 62a_100000210206_100000242059 [0,0,0,0,0,2|2,0,0]=4 6762 B17R1.6551 COc1ccccc1NC(=O)CNCC(C)C 2230a_100000210953_100000182883 [0,0,0,0,0,2|2,0,0]=4 6763 B17R1.6551 COc1ccccc1NC(=O)CNCC(C)C 34a_100000210953_100000182883 [0,0,0,0,0,2|2,0,0]=4 6764 B17R1.6551 COc1ccccc1NC(=O)COCC(C)Br 34a_100012180447_100000182883 [0,0,0,0,0,2|2,0,0]=4 6765 B17R1.6551 COc1ccccc1NC(=O)COCC(C)C 11a_100000210025_100011223364 [0,0,0,0,0,2|1,0,0]=3 6766 B17R1.6551 COc1ccccc1NC(=O)COCC(C)C 1626a_100000210025_100011223364 [0,0,0,0,0,2|1,0,0]=3 6767 B17R1.6551 COc1ccccc1NC(=O)COCC(C)C 22a_100000210025_100011223364 [0,0,0,0,0,2|1,0,0]=3 6768 B17R1.6551 COc1ccccc1NC(=O)COCC(C)C 34a_100000210257_100000182883 [0,0,0,0,0,2|1,0,0]=3 6769 B17R1.6551 COc1ccccc1NC(=O)COCC(C)C 527a_100000210025_100011223364 [0,0,0,0,0,2|1,0,0]=3 6770 B17R1.6551 COc1ccccc1NC(=O)COCC(C)F 34a_100015925927_100000182883 [0,0,0,0,0,2|2,0,0]=4 6771 B17R1.6551 COc1ccccc1NC(=O)COC[C@@H](C)Cl 34a_100016084084_100000182883 [0,0,0,0,0,2|2,0,0]=4 6772 B17R1.6551 COc1ccccc1NC(=O)COC[C@@H](C)N 34a_100000737577_100000182883 [0,0,0,0,0,2|2,0,0]=4 6773 B17R1.6551 COc1ccccc1NC(=O)CSCC(C)C 62a_100000210624_100000182883 [0,0,0,0,0,2|1,1,0]=4 6774 B17R1.6551 COc1ccccc1NC(=O)CSCC(C)C 62a_200000243729_100000210760 [0,0,0,0,0,2|1,1,0]=4 6775 B17R1.6551 COc1ccccc1NC(=O)NCCC(C)C 2430a_100000210025_100000210545 [0,0,0,0,0,2|2,0,0]=4 6776 B17R1.6551 COc1cnccc1CC(=O)COCC(C)C 1458a_100011223364_100020635607 [0,0,0,0,0,2|2,0,0]=4 6777 B17R1.6551 COc1ncccc1CC(=O)COCC(C)C 1458a_100011223364_100020631285 [0,0,0,0,0,2|2,0,0]=4 6778 B17R1.6551 CSc1ccccc1CC(=O)CCCC(C)C 1458a_100011216857_100000699184 [0,0,0,0,0,2|2,0,0]=4 6779 B17R1.6551 CSc1ccccc1CC(=O)COCC(C)C 1458a_100011223364_100000699184 [0,0,0,0,0,2|1,0,0]=3 6780 B17R1.6551 CSc1ccccc1NC(=O)CCCC(C)C 11a_100000211160_100011216857 [0,0,0,0,0,2|2,0,0]=4 6781 B17R1.6551 CSc1ccccc1NC(=O)CCCC(C)C 22a_100000211160_100011216857 [0,0,0,0,0,2|2,0,0]=4 6782 B17R1.6551 CSc1ccccc1NC(=O)CCNC(C)C 2230a_100138425928_100000181524 [0,0,0,0,0,2|2,0,0]=4 6783 B17R1.6551 CSc1ccccc1NC(=O)CCSC(C)C 62a_100000210206_100000181524 [0,0,0,0,0,2|2,0,0]=4 6784 B17R1.6551 CSc1ccccc1NC(=O)CNCC(C)C 2230a_100000210953_200000182989 [0,0,0,0,0,2|2,0,0]=4 6785 B17R1.6551 CSc1ccccc1NC(=O)CNCC(C)C 34a_100000210953_200000182989 [0,0,0,0,0,2|2,0,0]=4 6786 B17R1.6551 CSc1ccccc1NC(=O)COCC(C)Br 34a_100012180447_200000182989 [0,0,0,0,0,2|2,0,0]=4 6787 B17R1.6551 CSc1ccccc1NC(=O)COCC(C)C 11a_100000211160_100011223364 [0,0,0,0,0,2|1,0,0]=3 6788 B17R1.6551 CSc1ccccc1NC(=O)COCC(C)C 22a_100000211160_100011223364 [0,0,0,0,0,2|1,0,0]=3 6789 B17R1.6551 CSc1ccccc1NC(=O)COCC(C)C 34a_100000210257_200000182989 [0,0,0,0,0,2|1,0,0]=3 6790 B17R1.6551 CSc1ccccc1NC(=O)COCC(C)F 34a_100015925927_200000182989 [0,0,0,0,0,2|2,0,0]=4 6791 B17R1.6551 CSc1ccccc1NC(=O)COC[C@@H](C)Cl 34a_100016084084_200000182989 [0,0,0,0,0,2|2,0,0]=4 6792 B17R1.6551 CSc1ccccc1NC(=O)COC[C@@H](C)N 34a_100000737577_200000182989 [0,0,0,0,0,2|2,0,0]=4 6793 B17R1.6551 CSc1ccccc1NC(=O)CSCC(C)C 62a_100000210624_200000182989 [0,0,0,0,0,2|1,1,0]=4 6794 B17R1.6551 CSc1ccccc1NC(=O)NCCC(C)C 2430a_100000211160_100000210545 [0,0,0,0,0,2|2,0,0]=4 6795 B17R1.6551 CSc1ccccc1NC(=O)NCCC(C)C 512a_100000211160_100000210545 [0,0,0,0,0,2|2,0,0]=4 6796 B17R1.6551 CSc1ccccc1NC(=O)NNCC(C)C 512a_100000211160_100000696102 [0,0,0,0,0,2|2,0,0]=4 6797 B17R1.27037 CCc1ccccc1C(=O)CCCCC(C)C 1458a_100000689120_100011216152 [0,0,0,0,0,2|2,0,0]=4 6798 B17R1.27037 CCc1ccccc1C(=O)NCCCC(C)C 11a_200000737386_100000689120 [0,0,0,0,0,2|2,0,0]=4 6799 B17R1.27037 CCc1ccccc1C(=O)NCCCC(C)C 1626a_200000737386_100000689120 [0,0,0,0,0,2|2,0,0]=4 6800 B17R1.27037 CCc1ccccc1C(=O)NCCCC(C)C 240690a_200000737386_100000689120 [0,0,0,0,0,2|2,0,0]=4 6801 B17R1.27037 CCc1ccccc1C(=O)NCCCC(C)C 527a_200000737386_100000689120 [0,0,0,0,0,2|2,0,0]=4 6802 B17R1.27037 CCc1ccccc1C(=O)NCCOC(C)C 11a_100000701111_100000689120 [0,0,0,0,0,2|2,0,0]=4 6803 B17R1.27037 CCc1ccccc1C(=O)NCCOC(C)C 1626a_100000701111_100000689120 [0,0,0,0,0,2|2,0,0]=4 6804 B17R1.27037 CCc1ccccc1C(=O)NCCOC(C)C 240690a_100000701111_100000689120 [0,0,0,0,0,2|2,0,0]=4 6805 B17R1.27037 CCc1ccccc1C(=O)NCCOC(C)C 527a_100000701111_100000689120 [0,0,0,0,0,2|2,0,0]=4 6806 B17R1.27037 CCc1ccccc1C(=O)NCCSC(C)C 11a_100000731138_100000689120 [0,0,0,0,0,2|2,0,0]=4 6807 B17R1.27037 CCc1ccccc1C(=O)NCCSC(C)C 1626a_100000731138_100000689120 [0,0,0,0,0,2|2,0,0]=4 6808 B17R1.27037 CCc1ccccc1C(=O)NCCSC(C)C 240690a_100000731138_100000689120 [0,0,0,0,0,2|2,0,0]=4 6809 B17R1.27037 CCc1ccccc1C(=O)NCCSC(C)C 527a_100000731138_100000689120 [0,0,0,0,0,2|2,0,0]=4 6810 B17R1.27037 COc1ccccc1C(=O)CCCCC(C)C 1458a_100000185835_100011216152 [0,0,0,0,0,2|2,0,0]=4 6811 B17R1.27037 COc1ccccc1C(=O)COCC=C(C)C 34a_100000753907_100000195505 [0,0,0,0,0,2|1,0,1]=4 6812 B17R1.27037 COc1ccccc1C(=O)COCCC(C)Br 34a_100009893172_100000195505 [0,0,0,0,0,2|2,0,0]=4 6813 B17R1.27037 COc1ccccc1C(=O)COCCC(C)C 34a_100000210254_100000195505 [0,0,0,0,0,2|1,0,0]=3 6814 B17R1.27037 COc1ccccc1C(=O)COCCC(C)C 7a_100000210254_100000195505 [0,0,0,0,0,2|1,0,0]=3 6815 B17R1.27037 COc1ccccc1C(=O)COCC[C@@H](C)N 34a_100000706166_100000195505 [0,0,0,0,0,2|2,0,0]=4 6816 B17R1.27037 COc1ccccc1C(=O)CSCCC(C)C 62a_100000195505_100000210312 [0,0,0,0,0,2|1,1,0]=4 6817 B17R1.27037 COc1ccccc1C(=O)CSCOC(C)C 62a_100000195505_100000709892 [0,0,0,0,0,2|1,1,0]=4 6818 B17R1.27037 COc1ccccc1C(=O)NCCCC(C)C 11a_200000737386_100000185835 [0,0,0,0,0,2|2,0,0]=4 6819 B17R1.27037 COc1ccccc1C(=O)NCCCC(C)C 1626a_200000737386_100000185835 [0,0,0,0,0,2|2,0,0]=4 6820 B17R1.27037 COc1ccccc1C(=O)NCCCC(C)C 240690a_200000737386_100000185835 [0,0,0,0,0,2|2,0,0]=4 6821 B17R1.27037 COc1ccccc1C(=O)NCCCC(C)C 527a_200000737386_100000185835 [0,0,0,0,0,2|2,0,0]=4 6822 B17R1.27037 COc1ccccc1C(=O)NCCOC(C)C 11a_100000701111_100000185835 [0,0,0,0,0,2|2,0,0]=4 6823 B17R1.27037 COc1ccccc1C(=O)NCCOC(C)C 1626a_100000701111_100000185835 [0,0,0,0,0,2|2,0,0]=4 6824 B17R1.27037 COc1ccccc1C(=O)NCCOC(C)C 240690a_100000701111_100000185835 [0,0,0,0,0,2|2,0,0]=4 6825 B17R1.27037 COc1ccccc1C(=O)NCCOC(C)C 527a_100000701111_100000185835 [0,0,0,0,0,2|2,0,0]=4 6826 B17R1.27037 COc1ccccc1C(=O)NCCSC(C)C 11a_100000731138_100000185835 [0,0,0,0,0,2|2,0,0]=4 6827 B17R1.27037 COc1ccccc1C(=O)NCCSC(C)C 1626a_100000731138_100000185835 [0,0,0,0,0,2|2,0,0]=4 6828 B17R1.27037 COc1ccccc1C(=O)NCCSC(C)C 240690a_100000731138_100000185835 [0,0,0,0,0,2|2,0,0]=4 6829 B17R1.27037 COc1ccccc1C(=O)NCCSC(C)C 527a_100000731138_100000185835 [0,0,0,0,0,2|2,0,0]=4 6830 B17R1.27037 COc1ccccc1C(=O)NN=CCC(C)C 4a_100000189102_100000185833 [0,0,0,0,0,2|2,0,0]=4 6831 B17R1.27037 CSc1ccccc1C(=O)CCCCC(C)C 1458a_100000183967_100011216152 [0,0,0,0,0,2|2,0,0]=4 6832 B17R1.27037 CSc1ccccc1C(=O)NCCCC(C)C 11a_200000737386_100000183967 [0,0,0,0,0,2|2,0,0]=4 6833 B17R1.27037 CSc1ccccc1C(=O)NCCCC(C)C 1626a_200000737386_100000183967 [0,0,0,0,0,2|2,0,0]=4 6834 B17R1.27037 CSc1ccccc1C(=O)NCCCC(C)C 240690a_200000737386_100000183967 [0,0,0,0,0,2|2,0,0]=4 6835 B17R1.27037 CSc1ccccc1C(=O)NCCCC(C)C 527a_200000737386_100000183967 [0,0,0,0,0,2|2,0,0]=4 6836 B17R1.27037 CSc1ccccc1C(=O)NCCOC(C)C 11a_100000701111_100000183967 [0,0,0,0,0,2|2,0,0]=4 6837 B17R1.27037 CSc1ccccc1C(=O)NCCOC(C)C 1626a_100000701111_100000183967 [0,0,0,0,0,2|2,0,0]=4 6838 B17R1.27037 CSc1ccccc1C(=O)NCCOC(C)C 240690a_100000701111_100000183967 [0,0,0,0,0,2|2,0,0]=4 6839 B17R1.27037 CSc1ccccc1C(=O)NCCOC(C)C 527a_100000701111_100000183967 [0,0,0,0,0,2|2,0,0]=4 6840 B17R1.27037 CSc1ccccc1C(=O)NCCSC(C)C 11a_100000731138_100000183967 [0,0,0,0,0,2|2,0,0]=4 6841 B17R1.27037 CSc1ccccc1C(=O)NCCSC(C)C 1626a_100000731138_100000183967 [0,0,0,0,0,2|2,0,0]=4 6842 B17R1.27037 CSc1ccccc1C(=O)NCCSC(C)C 240690a_100000731138_100000183967 [0,0,0,0,0,2|2,0,0]=4 6843 B17R1.27037 CSc1ccccc1C(=O)NCCSC(C)C 527a_100000731138_100000183967 [0,0,0,0,0,2|2,0,0]=4