0 B17R1.1421 CCc1ccccc1OCC(=O)CCC(C)C 1458a_100000182566_100000210312 [0,0,0,0,0,0|2,0,2]=4 1 B17R1.1421 CCc1ccccc1OCC(=O)NNC(C)C 22a_100000741168_100000182566 [0,0,0,0,0,0|2,0,2]=4 2 B17R1.1421 CCc1ccccc1OCC(O)COC(=O)C 34a_100000210936_200000139349 [0,0,0,0,0,0|3,0,1]=4 3 B17R1.1421 CCc1ccccc1OCC(O)COC(=O)C 7a_100000210936_200000139349 [0,0,0,0,0,0|3,0,1]=4 4 B17R1.1421 CNc1ccccc1OCC(O)COC(=O)C 34a_100000033821_200000139349 [0,0,0,0,0,0|3,0,1]=4 5 B17R1.1421 COc1ccccc1CCC(=O)CCC(C)C 1458a_100000181311_100011713687 [0,0,0,0,0,0|2,0,2]=4 6 B17R1.1421 COc1ccccc1CCC(=O)CCC(C)C 1458a_100000184355_100000210312 [0,0,0,0,0,0|2,0,2]=4 7 B17R1.1421 COc1ccccc1CCC(=O)COC(C)C 1458a_100000745533_100011713687 [0,0,0,0,0,0|2,0,2]=4 8 B17R1.1421 COc1ccccc1CCC(=O)CSC(C)C 1458a_100000241585_100011713687 [0,0,0,0,0,0|2,0,2]=4 9 B17R1.1421 COc1ccccc1CCC(=O)NNC(C)C 22a_100000741168_100000184355 [0,0,0,0,0,0|2,0,2]=4 10 B17R1.1421 COc1ccccc1CCN(C)CCC(C)C 2230a_100000231131_100000210312 [0,0,0,0,0,0|4,0,0]=4 11 B17R1.1421 COc1ccccc1CCN(C)CCC(C)C 2230a_100000742789_100011713687 [0,0,0,0,0,0|4,0,0]=4 12 B17R1.1421 COc1ccccc1CCN(C)CCC(C)C 269982a_100000231131_100000210312 [0,0,0,0,0,0|4,0,0]=4 13 B17R1.1421 COc1ccccc1CCN(C)CCC(C)C 269982a_100000742789_100011713687 [0,0,0,0,0,0|4,0,0]=4 14 B17R1.1421 COc1ccccc1CCN(C)CCC(C)C 270004a_100000742789_100011713418 [0,0,0,0,0,0|4,0,0]=4 15 B17R1.1421 COc1ccccc1CCN(C)COC(C)C 2230a_100000231131_100000709892 [0,0,0,0,0,0|4,0,0]=4 16 B17R1.1421 COc1ccccc1CCN(C)COC(C)C 269982a_100000231131_100000709892 [0,0,0,0,0,0|4,0,0]=4 17 B17R1.1421 COc1ccccc1CNC(=O)CNC(C)C 2230a_100138425928_100000183343 [0,0,0,0,0,0|2,0,2]=4 18 B17R1.1421 COc1ccccc1CNC(=O)CNC(C)C 34a_100138425928_100000183343 [0,0,0,0,0,0|2,0,2]=4 19 B17R1.1421 COc1ccccc1CNC(C)CCC(C)C 207a_100138410893_100000169842 [0,0,0,0,0,0|4,0,0]=4 20 B17R1.1421 COc1ccccc1CNC(C)CCC(C)C 2230a_100138410893_100000210004 [0,0,0,0,0,0|4,0,0]=4 21 B17R1.1421 COc1ccccc1CNC(C)CCC(C)C 270004a_100000188900_100000210476 [0,0,0,0,0,0|4,0,0]=4 22 B17R1.1421 COc1ccccc1CNC(C)CCC(C)C 270004a_100138410893_100000169842 [0,0,0,0,0,0|4,0,0]=4 23 B17R1.1421 COc1ccccc1CNC(C)CCC(C)C 34a_100000188900_100011261404 [0,0,0,0,0,0|4,0,0]=4 24 B17R1.1421 COc1ccccc1COC(C)CCC(C)C 34a_100000211301_100011261404 [0,0,0,0,0,0|4,0,0]=4 25 B17R1.1421 COc1ccccc1COC(C)CCC(C)C 34a_100011215350_100000210004 [0,0,0,0,0,0|4,0,0]=4 26 B17R1.1421 COc1ccccc1COC(C)CCC(C)C 7a_100011215350_100000210004 [0,0,0,0,0,0|4,0,0]=4 27 B17R1.1421 COc1ccccc1CSC(C)CCC(C)C 62a_100000210004_100011261404 [0,0,0,0,0,0|4,0,0]=4 28 B17R1.1421 COc1ccccc1CSC(C)CCC(C)C 62a_100011261404_100000210004 [0,0,0,0,0,0|4,0,0]=4 29 B17R1.1421 COc1ccccc1NCC(O)COC(=O)C 34a_100000210025_200000139349 [0,0,0,0,0,0|3,0,1]=4 30 B17R1.1421 COc1ccccc1OCC(=O)CC=C(C)C 1458a_100000182946_100000761012 [0,0,0,0,0,0|1,0,3]=4 31 B17R1.1421 COc1ccccc1OCC(=O)CCC(C)C 1458a_100000182946_100000210312 [0,0,0,0,0,0|1,0,2]=3 32 B17R1.1421 COc1ccccc1OCC(=O)CCC(C)O 1458a_100000182946_100012276601 [0,0,0,0,0,0|2,0,2]=4 33 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 11a_100000210953_100000182946 [0,0,0,0,0,0|2,0,2]=4 34 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 1626a_100000210953_100000182946 [0,0,0,0,0,0|2,0,2]=4 35 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 240690a_100000210953_100000182946 [0,0,0,0,0,0|2,0,2]=4 36 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 34a_100000210385_100000183291 [0,0,0,0,0,0|2,0,2]=4 37 B17R1.1421 COc1ccccc1OCC(=O)NCC(C)C 527a_100000210953_100000182946 [0,0,0,0,0,0|2,0,2]=4 38 B17R1.1421 COc1ccccc1OCC(=O)NNC(C)C 22a_100000741168_100000182946 [0,0,0,0,0,0|1,0,2]=3 39 B17R1.1421 COc1ccccc1OCC(C)CSC(=O)C 34a_100000210385_200000116872 [0,0,0,0,0,0|3,0,1]=4 40 B17R1.1421 COc1ccccc1OCC(C)NCC(C)C 2230a_100000743626_100000210760 [0,0,0,0,0,0|3,0,0]=3 41 B17R1.1421 COc1ccccc1OCC(C)NCC(C)C 270004a_100000743626_100000210432 [0,0,0,0,0,0|3,0,0]=3 42 B17R1.1421 COc1ccccc1OCC(C)NCC(C)O 2230a_100000743626_100011218427 [0,0,0,0,0,0|4,0,0]=4 43 B17R1.1421 COc1ccccc1OCC(C)NC[C@@H](C)O 2230a_100000743626_100009817552 [0,0,0,0,0,0|4,0,0]=4 44 B17R1.1421 COc1ccccc1OCC(C)OCC(C)C 34a_100000242603_100000210624 [0,0,0,0,0,0|3,0,0]=3 45 B17R1.1421 COc1ccccc1OCC(C)OCC(C)C 7a_100000242603_100000210760 [0,0,0,0,0,0|3,0,0]=3 46 B17R1.1421 COc1ccccc1OCC(C)OCC(C)O 34a_100000242603_100011218427 [0,0,0,0,0,0|4,0,0]=4 47 B17R1.1421 COc1ccccc1OCC(C)OCC(C)O 7a_100000242603_100011218427 [0,0,0,0,0,0|4,0,0]=4 48 B17R1.1421 COc1ccccc1OCC(C)OC[C@@H](C)O 34a_100000242603_100009817552 [0,0,0,0,0,0|4,0,0]=4 49 B17R1.1421 COc1ccccc1OCC(C)OC[C@@H](C)O 7a_100000242603_100009817552 [0,0,0,0,0,0|4,0,0]=4 50 B17R1.1421 COc1ccccc1OCC(O)COC(=O)C 34a_100000210385_200000139349 [0,0,0,0,0,0|2,0,1]=3 51 B17R1.1421 COc1ccccc1SCC(O)COC(=O)C 62a_100000210334_200000139349 [0,0,0,0,0,0|2,1,1]=4 52 B17R1.1421 COc1ccccc1SCC(O)COC(=O)C 62a_200000139349_100000210334 [0,0,0,0,0,0|2,1,1]=4 53 B17R1.1421 COc1cccnc1OCC(O)COC(=O)C 34a_100025773188_200000139349 [0,0,0,0,0,0|3,0,1]=4 54 B17R1.1421 COc1ccncc1OCC(O)COC(=O)C 34a_100000101186_200000139349 [0,0,0,0,0,0|3,0,1]=4 55 B17R1.1421 COc1ncccc1OCC(O)COC(=O)C 34a_100000698397_200000139349 [0,0,0,0,0,0|3,0,1]=4 56 B17R1.1421 COc1ncccc1OCC(O)COC(=O)C 7a_100000698397_200000139349 [0,0,0,0,0,0|3,0,1]=4 57 B17R1.1421 CSc1ccccc1OCC(O)COC(=O)C 34a_100011216402_200000139349 [0,0,0,0,0,0|2,1,1]=4 58 B16R1.57 C#Cc1ccccc1OCCCCC(C)C 34a_200011470546_100011216152 [1,0,0,0,0,0|2,0,1]=4 59 B16R1.57 C#Cc1ccccc1OCCCCC(C)C 7a_200011470546_100011216152 [1,0,0,0,0,0|2,0,1]=4 60 B16R1.57 CC(C)CCCCOc1ccccc1C#N 34a_100000211048_100011216152 [1,0,0,0,0,0|3,0,0]=4 61 B16R1.57 CC(C)CCCCOc1ccccc1C#N 7a_100000211048_100011216152 [1,0,0,0,0,0|3,0,0]=4 62 B16R1.57 CC(C)CCCCOc1ccccc1CN 34a_100000185550_100011216152 [1,0,0,0,0,0|3,0,0]=4 63 B16R1.57 CC(C)CCCCOc1ccccc1CO 34a_100011216872_100011216152 [1,0,0,0,0,0|3,0,0]=4 64 B16R1.57 CC(C)NCCCOc1ccccc1C#N 2230a_100011220211_100000210206 [1,0,0,0,0,0|2,0,0]=3 65 B16R1.57 CC(C)NCCCOc1ccccc1C#N 34a_100011220211_100000210206 [1,0,0,0,0,0|2,0,0]=3 66 B16R1.57 CCc1ccccc1NCCCCC(C)C 2230a_100000212081_100011216152 [1,0,0,0,0,0|3,0,0]=4 67 B16R1.57 CCc1ccccc1NCCCCC(C)C 34a_100000212081_100011216152 [1,0,0,0,0,0|3,0,0]=4 68 B16R1.57 CCc1ccccc1NCCCCC(C)C 7a_100000212081_100011216152 [1,0,0,0,0,0|3,0,0]=4 69 B16R1.57 CCc1ccccc1OCCCCC(C)C 34a_100000210936_100011216152 [1,0,0,0,0,0|2,0,0]=3 70 B16R1.57 CCc1ccccc1OCCCCC(C)C 7a_100000210936_100011216152 [1,0,0,0,0,0|2,0,0]=3 71 B16R1.57 CNc1ccccc1OCCCCC(C)C 34a_100000033821_100011216152 [1,0,0,0,0,0|2,0,0]=3 72 B16R1.57 CNc1ccccc1SCCCCC(C)C 62a_100011216152_100020606079 [1,0,0,0,0,0|2,1,0]=4 73 B16R1.57 CNc1ccccc1SCCCCC(C)C 62a_100020606079_100011216152 [1,0,0,0,0,0|2,1,0]=4 74 B16R1.57 COc1ccccc1CCC=NNC(C)C 4a_100000741168_100011713476 [1,0,0,0,0,0|2,0,1]=4 75 B16R1.57 COc1ccccc1CCCNCC(C)C 270004a_100000210953_100011713476 [1,0,0,0,0,0|3,0,0]=4 76 B16R1.57 COc1ccccc1CCCOCC(C)C 34a_100011709264_100000210624 [1,0,0,0,0,0|3,0,0]=4 77 B16R1.57 COc1ccccc1CCCOCC(C)C 7a_100011709264_100000210760 [1,0,0,0,0,0|3,0,0]=4 78 B16R1.57 COc1ccccc1CCNCCC(C)C 2230a_100000211851_100000210312 [1,0,0,0,0,0|3,0,0]=4 79 B16R1.57 COc1ccccc1CCNCCC(C)C 269862a_100000211851_100000185833 [1,0,0,0,0,0|3,0,0]=4 80 B16R1.57 COc1ccccc1CCNCCC(C)C 270004a_100000210545_100011713418 [1,0,0,0,0,0|3,0,0]=4 81 B16R1.57 COc1ccccc1CCNCCC(C)C 34a_100000211851_100000210312 [1,0,0,0,0,0|3,0,0]=4 82 B16R1.57 COc1ccccc1CCNCOC(C)C 2230a_100000211851_100000709892 [1,0,0,0,0,0|3,0,0]=4 83 B16R1.57 COc1ccccc1CCNCOC(C)C 34a_100000211851_100000709892 [1,0,0,0,0,0|3,0,0]=4 84 B16R1.57 COc1ccccc1CCOCCC(C)C 34a_100000210254_100011713687 [1,0,0,0,0,0|3,0,0]=4 85 B16R1.57 COc1ccccc1CCOCCC(C)C 34a_100011218620_100000210312 [1,0,0,0,0,0|3,0,0]=4 86 B16R1.57 COc1ccccc1CCOCCC(C)C 7a_100000210254_100011713687 [1,0,0,0,0,0|3,0,0]=4 87 B16R1.57 COc1ccccc1CCOCCC(C)C 7a_100011218620_100000210626 [1,0,0,0,0,0|3,0,0]=4 88 B16R1.57 COc1ccccc1CCOCOC(C)C 34a_100011218620_100000709892 [1,0,0,0,0,0|3,0,0]=4 89 B16R1.57 COc1ccccc1CCSCCC(C)C 62a_100000210312_100011713687 [1,0,0,0,0,0|3,0,0]=4 90 B16R1.57 COc1ccccc1CCSCCC(C)C 62a_100011713687_100000210312 [1,0,0,0,0,0|3,0,0]=4 91 B16R1.57 COc1ccccc1CCSCOC(C)C 62a_100000709892_100011713687 [1,0,0,0,0,0|3,0,0]=4 92 B16R1.57 COc1ccccc1CCSCOC(C)C 62a_100011713687_100000709892 [1,0,0,0,0,0|3,0,0]=4 93 B16R1.57 COc1ccccc1CNCCCC(C)C 207a_200000737386_100000169842 [1,0,0,0,0,0|3,0,0]=4 94 B16R1.57 COc1ccccc1CNCCCC(C)C 2230a_200000737386_100000210004 [1,0,0,0,0,0|3,0,0]=4 95 B16R1.57 COc1ccccc1CNCCCC(C)C 270004a_200000737386_100000169842 [1,0,0,0,0,0|3,0,0]=4 96 B16R1.57 COc1ccccc1CNCCCC(C)C 34a_100000188900_100011214892 [1,0,0,0,0,0|3,0,0]=4 97 B16R1.57 COc1ccccc1CNCCCC(C)C 34a_200000737386_100000210004 [1,0,0,0,0,0|3,0,0]=4 98 B16R1.57 COc1ccccc1CNCCOC(C)C 207a_100000701111_100000169842 [1,0,0,0,0,0|3,0,0]=4 99 B16R1.57 COc1ccccc1CNCCOC(C)C 2230a_100000701111_100000210004 [1,0,0,0,0,0|3,0,0]=4 100 B16R1.57 COc1ccccc1CNCCOC(C)C 270004a_100000701111_100000169842 [1,0,0,0,0,0|3,0,0]=4 101 B16R1.57 COc1ccccc1CNCCOC(C)C 34a_100000188900_100000211751 [1,0,0,0,0,0|3,0,0]=4 102 B16R1.57 COc1ccccc1CNCCOC(C)C 34a_100000701111_100000210004 [1,0,0,0,0,0|3,0,0]=4 103 B16R1.57 COc1ccccc1CNCCSC(C)C 207a_100000731138_100000169842 [1,0,0,0,0,0|3,0,0]=4 104 B16R1.57 COc1ccccc1CNCCSC(C)C 2230a_100000731138_100000210004 [1,0,0,0,0,0|3,0,0]=4 105 B16R1.57 COc1ccccc1CNCCSC(C)C 270004a_100000731138_100000169842 [1,0,0,0,0,0|3,0,0]=4 106 B16R1.57 COc1ccccc1CNCCSC(C)C 34a_100000188900_100000730970 [1,0,0,0,0,0|3,0,0]=4 107 B16R1.57 COc1ccccc1CNCCSC(C)C 34a_100000731138_100000210004 [1,0,0,0,0,0|3,0,0]=4 108 B16R1.57 COc1ccccc1COCCCC(C)C 34a_100000210774_100000210004 [1,0,0,0,0,0|3,0,0]=4 109 B16R1.57 COc1ccccc1COCCCC(C)C 34a_100000211301_100011214892 [1,0,0,0,0,0|3,0,0]=4 110 B16R1.57 COc1ccccc1COCCCC(C)C 7a_100000210774_100000210004 [1,0,0,0,0,0|3,0,0]=4 111 B16R1.57 COc1ccccc1COCCNC(C)C 34a_100000224655_100000210004 [1,0,0,0,0,0|2,0,0]=3 112 B16R1.57 COc1ccccc1COCCOC(C)C 34a_100000211219_100000210004 [1,0,0,0,0,0|3,0,0]=4 113 B16R1.57 COc1ccccc1COCCOC(C)C 34a_100000211301_100000211751 [1,0,0,0,0,0|3,0,0]=4 114 B16R1.57 COc1ccccc1COCCOC(C)C 7a_100000211219_100000210004 [1,0,0,0,0,0|3,0,0]=4 115 B16R1.57 COc1ccccc1COCCSC(C)C 34a_100000211301_100000730970 [1,0,0,0,0,0|3,0,0]=4 116 B16R1.57 COc1ccccc1COCCSC(C)C 34a_200011212901_100000210004 [1,0,0,0,0,0|3,0,0]=4 117 B16R1.57 COc1ccccc1COCCSC(C)C 7a_200011212901_100000210004 [1,0,0,0,0,0|3,0,0]=4 118 B16R1.57 COc1ccccc1CSCCCC(C)C 62a_100000210004_100011214892 [1,0,0,0,0,0|3,0,0]=4 119 B16R1.57 COc1ccccc1CSCCCC(C)C 62a_100011214892_100000210004 [1,0,0,0,0,0|3,0,0]=4 120 B16R1.57 COc1ccccc1CSCCOC(C)C 62a_100000210004_100000211751 [1,0,0,0,0,0|3,0,0]=4 121 B16R1.57 COc1ccccc1CSCCOC(C)C 62a_100000211751_100000210004 [1,0,0,0,0,0|3,0,0]=4 122 B16R1.57 COc1ccccc1CSCCSC(C)C 62a_100000210004_100000730970 [1,0,0,0,0,0|3,0,0]=4 123 B16R1.57 COc1ccccc1CSCCSC(C)C 62a_100000730970_100000210004 [1,0,0,0,0,0|3,0,0]=4 124 B16R1.57 COc1ccccc1NCCCCC(C)C 34a_100000210025_100011216152 [1,0,0,0,0,0|2,0,0]=3 125 B16R1.57 COc1ccccc1OCCCCC(=O)C 1458a_100000070787_200011219331 [1,0,0,0,0,0|2,0,1]=4 126 B16R1.57 COc1ccccc1OCCCCC(=O)C 34a_100000210385_100009817362 [1,0,0,0,0,0|2,0,1]=4 127 B16R1.57 COc1ccccc1OCCCCC(C)C 34a_100000210385_100011216152 [1,0,0,0,0,0|1,0,0]=2 128 B16R1.57 COc1ccccc1OCCCCN(C)C 2230a_100102631434_200011219331 [1,0,0,0,0,0|2,0,0]=3 129 B16R1.57 COc1ccccc1OCCCCN(C)C 269982a_100102631434_200011219331 [1,0,0,0,0,0|2,0,0]=3 130 B16R1.57 COc1ccccc1OCCCNC(=O)C 11a_100000752037_100015343762 [1,0,0,0,0,0|1,0,1]=3 131 B16R1.57 COc1ccccc1OCCCNC(=O)C 1626a_100000752037_100015343762 [1,0,0,0,0,0|1,0,1]=3 132 B16R1.57 COc1ccccc1OCCCNC(=O)C 240690a_100000752037_100015343762 [1,0,0,0,0,0|1,0,1]=3 133 B16R1.57 COc1ccccc1OCCCNC(=O)C 527a_100000752037_100103153847 [1,0,0,0,0,0|1,0,1]=3 134 B16R1.57 COc1ccccc1OCCCNC(C)C 2230a_100138425928_100011259231 [1,0,0,0,0,0|0,0,0]=1 135 B16R1.57 COc1ccccc1OCCCNC(C)C 34a_100000752037_100000210206 [1,0,0,0,0,0|0,0,0]=1 136 B16R1.57 COc1ccccc1OCCCNC(C)C 34a_100138425928_100011259231 [1,0,0,0,0,0|0,0,0]=1 137 B16R1.57 COc1ccccc1OCCCOC(=O)C 34a_100000210385_100000042594 [1,0,0,0,0,0|2,0,1]=4 138 B16R1.57 COc1ccccc1OCCCOC(=S)C 34a_100000210385_200135323944 [1,0,0,0,0,0|2,0,1]=4 139 B16R1.57 COc1ccccc1OCCCOC(C)C 34a_100000212225_100011259231 [1,0,0,0,0,0|1,0,0]=2 140 B16R1.57 COc1ccccc1OCCCSC(=O)C 34a_100000210385_100000038929 [1,0,0,0,0,0|2,0,1]=4 141 B16R1.57 COc1ccccc1OCCCSC(C)C 62a_100000210206_100011259231 [1,0,0,0,0,0|1,0,0]=2 142 B16R1.57 COc1ccccc1OCCCSC(C)C 62a_100011259231_100000210206 [1,0,0,0,0,0|1,0,0]=2 143 B16R1.57 COc1ccccc1OCCNCC(C)C 2230a_100000210953_100000188471 [1,0,0,0,0,0|2,0,0]=3 144 B16R1.57 COc1ccccc1OCCNCC(C)C 2230a_100000683763_100000210760 [1,0,0,0,0,0|2,0,0]=3 145 B16R1.57 COc1ccccc1OCCNCC(C)C 270004a_100000683763_100000210432 [1,0,0,0,0,0|2,0,0]=3 146 B16R1.57 COc1ccccc1OCCNCC(C)C 34a_100000210953_100000188471 [1,0,0,0,0,0|2,0,0]=3 147 B16R1.57 COc1ccccc1OCCNCC(C)C 34a_100000683763_100000210624 [1,0,0,0,0,0|2,0,0]=3 148 B16R1.57 COc1ccccc1OCCNCC(C)O 2230a_100000210904_100000188471 [1,0,0,0,0,0|3,0,0]=4 149 B16R1.57 COc1ccccc1OCCNCC(C)O 2230a_100000683763_100011218427 [1,0,0,0,0,0|3,0,0]=4 150 B16R1.57 COc1ccccc1OCCNCC(C)O 34a_100000210904_100000188471 [1,0,0,0,0,0|3,0,0]=4 151 B16R1.57 COc1ccccc1OCCNCC(C)O 34a_100000683763_100011218427 [1,0,0,0,0,0|3,0,0]=4 152 B16R1.57 COc1ccccc1OCCNC[C@@H](C)O 2230a_100000683763_100009817552 [1,0,0,0,0,0|3,0,0]=4 153 B16R1.57 COc1ccccc1OCCNC[C@@H](C)O 34a_100000683763_100009817552 [1,0,0,0,0,0|3,0,0]=4 154 B16R1.57 COc1ccccc1OCCOCC(C)Br 34a_100012180447_100000188471 [1,0,0,0,0,0|3,0,0]=4 155 B16R1.57 COc1ccccc1OCCOCC(C)C 34a_100000210257_100000188471 [1,0,0,0,0,0|2,0,0]=3 156 B16R1.57 COc1ccccc1OCCOCC(C)F 34a_100015925927_100000188471 [1,0,0,0,0,0|3,0,0]=4 157 B16R1.57 COc1ccccc1OCCOC[C@@H](C)Cl 34a_100016084084_100000188471 [1,0,0,0,0,0|3,0,0]=4 158 B16R1.57 COc1ccccc1OCCOC[C@@H](C)N 34a_100000737577_100000188471 [1,0,0,0,0,0|3,0,0]=4 159 B16R1.57 COc1ccccc1OCCSCC(C)C 62a_100000188471_100000210760 [1,0,0,0,0,0|2,0,0]=3 160 B16R1.57 COc1ccccc1OCCSCC(C)C 62a_100000210624_100000188471 [1,0,0,0,0,0|2,0,0]=3 161 B16R1.57 COc1ccccc1OCCSCC(C)O 62a_100000188471_100011218427 [1,0,0,0,0,0|3,0,0]=4 162 B16R1.57 COc1ccccc1OCCSCC(C)O 62a_100011218427_100000188471 [1,0,0,0,0,0|3,0,0]=4 163 B16R1.57 COc1ccccc1OCCSC[C@@H](C)O 62a_100000188471_100009817552 [1,0,0,0,0,0|3,0,0]=4 164 B16R1.57 COc1ccccc1OCCSC[C@@H](C)O 62a_100009817552_100000188471 [1,0,0,0,0,0|3,0,0]=4 165 B16R1.57 COc1ccccc1SCCCCC(C)C 62a_100000210334_100011216152 [1,0,0,0,0,0|1,1,0]=3 166 B16R1.57 COc1ccccc1SCCCCC(C)C 62a_100011216152_100000210334 [1,0,0,0,0,0|1,1,0]=3 167 B16R1.57 COc1ccccc1SCCCCN(C)C 62a_100000210334_100000690147 [1,0,0,0,0,0|2,1,0]=4 168 B16R1.57 COc1ccccc1SCCOCC(C)C 7a_200011448452_100000210760 [1,0,0,0,0,0|2,1,0]=4 169 B16R1.57 COc1cccnc1OCCCCC(C)C 34a_100025773188_100011216152 [1,0,0,0,0,0|2,0,0]=3 170 B16R1.57 COc1cccnc1SCCCCC(C)C 62a_100000767102_100011216152 [1,0,0,0,0,0|2,1,0]=4 171 B16R1.57 COc1cccnc1SCCCCC(C)C 62a_100011216152_100000690851 [1,0,0,0,0,0|2,1,0]=4 172 B16R1.57 COc1ccncc1OCCCCC(C)C 34a_100000101186_100011216152 [1,0,0,0,0,0|2,0,0]=3 173 B16R1.57 COc1ccncc1SCCCCC(C)C 62a_100011216152_100011997281 [1,0,0,0,0,0|2,1,0]=4 174 B16R1.57 COc1ccncc1SCCCCC(C)C 62a_100011997281_100011216152 [1,0,0,0,0,0|2,1,0]=4 175 B16R1.57 COc1cnccc1SCCCCC(C)C 62a_100011216152_100016988167 [1,0,0,0,0,0|2,1,0]=4 176 B16R1.57 COc1cnccc1SCCCCC(C)C 62a_100016988167_100011216152 [1,0,0,0,0,0|2,1,0]=4 177 B16R1.57 COc1ncccc1COCCNC(C)C 34a_100000224655_100020631285 [1,0,0,0,0,0|3,0,0]=4 178 B16R1.57 COc1ncccc1OCCCCC(C)C 34a_100000698397_100011216152 [1,0,0,0,0,0|2,0,0]=3 179 B16R1.57 COc1ncccc1OCCCCC(C)C 7a_100000698397_100011216152 [1,0,0,0,0,0|2,0,0]=3 180 B16R1.57 COc1ncccc1SCCCCC(C)C 62a_100000047025_100011216152 [1,0,0,0,0,0|2,1,0]=4 181 B16R1.57 COc1ncccc1SCCCCC(C)C 62a_100011216152_100000047025 [1,0,0,0,0,0|2,1,0]=4 182 B16R1.57 CSc1ccccc1COCCNC(C)C 34a_100000224655_100000699184 [1,0,0,0,0,0|2,1,0]=4 183 B16R1.57 CSc1ccccc1NCCCCC(C)C 34a_100000211160_100011216152 [1,0,0,0,0,0|2,1,0]=4 184 B16R1.57 CSc1ccccc1OCCCCC(C)C 34a_100011216402_100011216152 [1,0,0,0,0,0|1,1,0]=3 185 B16R1.57 CSc1ccccc1OCCNCC(C)C 2230a_100011893647_100000210760 [1,0,0,0,0,0|2,1,0]=4 186 B16R1.57 CSc1ccccc1OCCNCC(C)C 270004a_100011893647_100000210432 [1,0,0,0,0,0|2,1,0]=4 187 B16R1.57 CSc1ccccc1OCCNCC(C)C 34a_100011893647_100000210624 [1,0,0,0,0,0|2,1,0]=4 188 B16R1.400 CC(=O)OCC(O)COc1ccccc1C 34a_100000210338_200000139349 [1,0,0,0,0,0|2,0,1]=4 189 B16R1.400 CC(=O)OCC(O)COc1ccccc1C 7a_100000210338_200000139349 [1,0,0,0,0,0|2,0,1]=4 190 B16R1.400 CC(C)CCC(=O)COc1ccccc1O 1458a_100000183020_100000210312 [1,0,0,0,0,0|1,0,2]=4 191 B16R1.400 CC(C)NNC(=O)COc1ccccc1O 22a_100000741168_100000183020 [1,0,0,0,0,0|1,0,2]=4 192 B16R1.400 Cc1ccccc1OCC(=O)CCC(C)C 1458a_100000182418_100000210312 [1,0,0,0,0,0|1,0,2]=4 193 B16R1.400 Cc1ccccc1OCC(=O)NNC(C)C 22a_100000741168_100000182418 [1,0,0,0,0,0|1,0,2]=4 194 B16R1.400 Cc1ccccc1OCC(C)NCC(C)C 2230a_100000744241_100000210760 [1,0,0,0,0,0|3,0,0]=4 195 B16R1.400 Cc1ccccc1OCC(C)NCC(C)C 270004a_100000744241_100000210432 [1,0,0,0,0,0|3,0,0]=4 196 B16R1.400 Cc1ccccc1OCC(C)NCC(C)C 34a_100000744241_100000210624 [1,0,0,0,0,0|3,0,0]=4 197 B16R1.400 Cc1ccccc1OCC(C)OCC(C)C 34a_200011217337_100000210624 [1,0,0,0,0,0|3,0,0]=4 198 B16R1.400 Cc1ccccc1OCC(C)OCC(C)C 7a_200011217337_100000210760 [1,0,0,0,0,0|3,0,0]=4 199 B16R1.1454 CCCCC(=O)COc1ccccc1OC 1458a_100000182946_100000210211 [1,0,0,0,0,0|1,0,2]=4 200 B16R1.1454 CCCNC(C)COc1ccccc1OC 2230a_100000743626_100000210303 [1,0,0,0,0,0|3,0,0]=4 201 B16R1.1454 CCCOC(C)COc1ccccc1OC 34a_100000242603_100000210303 [1,0,0,0,0,0|3,0,0]=4 202 B16R1.1454 CCCOC(C)COc1ccccc1OC 7a_100000242603_100000210303 [1,0,0,0,0,0|3,0,0]=4 203 B16R1.1454 CCNNC(=O)COc1ccccc1OC 22a_100000756455_100000182946 [1,0,0,0,0,0|1,0,2]=4 204 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)Br 34a_100009816560_200000139349 [0,1,0,0,0,0|2,0,1]=4 205 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)Br 7a_100009816560_200000139349 [0,1,0,0,0,0|2,0,1]=4 206 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)C 34a_100011216497_200000139349 [0,1,0,0,0,0|2,0,1]=4 207 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)C 7a_100011216497_200000139349 [0,1,0,0,0,0|2,0,1]=4 208 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)Cl 34a_100000101779_200000139349 [0,1,0,0,0,0|2,0,1]=4 209 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)Cl 7a_100000101779_200000139349 [0,1,0,0,0,0|2,0,1]=4 210 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)F 34a_100000034962_200000139349 [0,1,0,0,0,0|2,0,1]=4 211 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)F 7a_100000034962_200000139349 [0,1,0,0,0,0|2,0,1]=4 212 B18R1.4766 COc1ccc(cc1OCC(O)COC(=O)C)N 34a_100000211920_200000139349 [0,1,0,0,0,0|2,0,1]=4 213 B18R1.4935 CCOc1ccccc1OCC(=O)CCC(C)C 1458a_100000182497_100000210312 [0,1,0,0,0,0|1,0,2]=4 214 B18R1.4935 CCOc1ccccc1OCC(=O)NNC(C)C 22a_100000741168_100000182497 [0,1,0,0,0,0|1,0,2]=4 215 B18R1.4935 CCOc1ccccc1OCC(O)COC(=O)C 34a_100000211404_200000139349 [0,1,0,0,0,0|2,0,1]=4 216 B18R1.4935 CCOc1ccccc1OCC(O)COC(=O)C 7a_100000211404_200000139349 [0,1,0,0,0,0|2,0,1]=4 217 B18R1.4935 COCc1ccccc1OCC(O)COC(=O)C 34a_100011488565_200000139349 [0,1,0,0,0,0|2,0,1]=4 218 B18R1.4935 COCc1ccccc1OCC(O)COC(=O)C 7a_100011488565_200000139349 [0,1,0,0,0,0|2,0,1]=4 219 B18R1.5541 COc1cc(ccc1OCC(=O)CCC(C)C)C 1458a_100000183895_100000210312 [0,1,0,0,0,0|1,0,2]=4 220 B18R1.5541 COc1cc(ccc1OCC(=O)NNC(C)C)C 22a_100000741168_100000183895 [0,1,0,0,0,0|1,0,2]=4 221 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)Br 34a_100000694246_200000139349 [0,1,0,0,0,0|2,0,1]=4 222 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)Br 7a_100000694246_200000139349 [0,1,0,0,0,0|2,0,1]=4 223 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)C 34a_100000186466_200000139349 [0,1,0,0,0,0|2,0,1]=4 224 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)Cl 34a_100000033002_200000139349 [0,1,0,0,0,0|2,0,1]=4 225 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)F 34a_100000036057_200000139349 [0,1,0,0,0,0|2,0,1]=4 226 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)F 7a_100000036057_200000139349 [0,1,0,0,0,0|2,0,1]=4 227 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)I 34a_100000049635_200000139349 [0,1,0,0,0,0|2,0,1]=4 228 B18R1.5541 COc1cc(ccc1OCC(O)COC(=O)C)N 34a_100000726020_200000139349 [0,1,0,0,0,0|2,0,1]=4 229 B18R1.7278 COc1ccccc1OC(C)C(=O)CCC(C)C 1458a_100000188836_100000210312 [0,1,0,0,0,0|1,0,2]=4 230 B18R1.7278 COc1ccccc1OC(C)C(=O)NNC(C)C 22a_100000741168_100000188836 [0,1,0,0,0,0|1,0,2]=4 231 B18R1.7316 COc1ccccc1OCC(=O)C(C)CC(C)C 1458a_100000182946_100000731052 [0,1,0,0,0,0|1,0,2]=4 232 B18R1.7317 COc1ccccc1CCC(=O)CN(C)C(C)C 1458a_100000743827_100011713687 [0,1,0,0,0,0|1,0,2]=4 233 B18R1.7317 COc1ccccc1OCC(=O)CC(=O)C(C)C 1458a_100000182946_100000753385 [0,1,0,0,0,0|1,0,2]=4 234 B18R1.7317 COc1ccccc1OCC(C)NC(=O)C(C)C 11a_100000743626_100000210198 [0,1,0,0,0,0|3,0,0]=4 235 B18R1.7317 COc1ccccc1OCC(C)NC(=O)C(C)C 1626a_100000743626_100000210198 [0,1,0,0,0,0|3,0,0]=4 236 B18R1.7317 COc1ccccc1OCC(C)NC(=O)C(C)C 240690a_100000743626_100000210198 [0,1,0,0,0,0|3,0,0]=4 237 B18R1.7317 COc1ccccc1OCC(C)NC(=O)C(C)C 527a_100000743626_100000210198 [0,1,0,0,0,0|3,0,0]=4 238 B18R1.7319 CCC(C)CNC(C)COc1ccccc1OC 2230a_100000743626_100000748023 [0,1,0,0,0,0|3,0,0]=4 239 B18R1.7319 CCC(C)CNC(C)COc1ccccc1OC 270004a_100000743626_100000243153 [0,1,0,0,0,0|3,0,0]=4 240 B18R1.7319 CCC(C)COC(C)COc1ccccc1OC 34a_100000242603_100000748023 [0,1,0,0,0,0|3,0,0]=4 241 B18R1.7319 CCC(C)COC(C)COc1ccccc1OC 7a_100000242603_100000748023 [0,1,0,0,0,0|3,0,0]=4 242 B18R1.7319 CCC(C)NNC(=O)COc1ccccc1OC 22a_100000718999_100000182946 [0,1,0,0,0,0|1,0,2]=4 243 B18R1.7319 CC[C@H](C)CNC(C)COc1ccccc1OC 2230a_100000743626_100009816398 [0,1,0,0,0,0|3,0,0]=4 244 B18R1.7319 CC[C@H](C)COC(C)COc1ccccc1OC 34a_100000242603_100009816398 [0,1,0,0,0,0|3,0,0]=4 245 B18R1.7319 CC[C@H](C)COC(C)COc1ccccc1OC 7a_100000242603_100009816398 [0,1,0,0,0,0|3,0,0]=4 246 B18R1.7319 COc1ccccc1OCC(C)NC[C@@H](C)CO 2230a_100000743626_100000059175 [0,1,0,0,0,0|3,0,0]=4 247 B18R1.7319 COc1ccccc1OCC(C)OC[C@@H](C)CO 34a_100000242603_100000059175 [0,1,0,0,0,0|3,0,0]=4 248 B18R1.7319 COc1ccccc1OCC(C)OC[C@@H](C)CO 7a_100000242603_100000059175 [0,1,0,0,0,0|3,0,0]=4 249 B18R1.8299 COc1c(cccc1OCC(O)COC(=O)C)Br 34a_100010234590_200000139349 [0,1,0,0,0,0|2,0,1]=4 250 B18R1.8299 COc1c(cccc1OCC(O)COC(=O)C)Cl 34a_200009886253_200000139349 [0,1,0,0,0,0|2,0,1]=4 251 B18R1.8299 COc1c(cccc1OCC(O)COC(=O)C)Cl 7a_200009886253_200000139349 [0,1,0,0,0,0|2,0,1]=4 252 B18R1.38875 COc1ccccc1OCC(=O)CCC(C)(C)C 1458a_100000182946_100000755188 [0,1,0,0,0,0|1,0,2]=4 253 B18R1.38875 COc1ccccc1OCC(=O)NNC(C)(C)C 22a_100000725372_100000182946 [0,1,0,0,0,0|1,0,2]=4 254 B18R1.38875 COc1ccccc1OCC(C)NCC(C)(C)C 270004a_100000743626_100011204126 [0,1,0,0,0,0|3,0,0]=4 255 B18R1.38875 COc1ccccc1OCC(C)OCC(C)(C)C 34a_100000242603_100011219605 [0,1,0,0,0,0|3,0,0]=4 256 B18R1.38875 COc1ccccc1OCC(C)OCC(C)(C)F 34a_100000242603_100011997219 [0,1,0,0,0,0|3,0,0]=4 257 B18R1.38875 COc1ccccc1OCC(C)OCC(C)(C)O 34a_100000242603_100000764493 [0,1,0,0,0,0|3,0,0]=4 258 B18R1.38875 COc1ccccc1OCC(C)OCC(C)(C)O 7a_100000242603_100000764493 [0,1,0,0,0,0|3,0,0]=4 259 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)Br 34a_100000686866_200000139349 [0,1,0,0,0,0|2,0,1]=4 260 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)C 34a_100011219253_200000139349 [0,1,0,0,0,0|2,0,1]=4 261 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)C 7a_100011219253_200000139349 [0,1,0,0,0,0|2,0,1]=4 262 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)Cl 34a_100009851661_200000139349 [0,1,0,0,0,0|2,0,1]=4 263 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)Cl 7a_100009851661_200000139349 [0,1,0,0,0,0|2,0,1]=4 264 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)F 34a_100000036725_200000139349 [0,1,0,0,0,0|2,0,1]=4 265 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)F 7a_100000036725_200000139349 [0,1,0,0,0,0|2,0,1]=4 266 B18R1.39695 COc1cccc(c1OCC(O)COC(=O)C)N 34a_100000123586_200000139349 [0,1,0,0,0,0|2,0,1]=4 267 B18R2.14644 CC(=NNC(C)C)C1COc2ccccc2O1 4a_100000741168_100011934066 [0,0,0,1,0,0|2,0,1]=4 268 B18R2.14644 CC(C)CCC(=O)C1COc2ccccc2O1 1458a_100000182656_100000210312 [0,0,0,1,0,0|1,0,2]=4 269 B18R2.14644 CC(C)CNC(C)C1COc2ccccc2O1 2230a_100015185755_100000210760 [0,0,0,1,0,0|3,0,0]=4 270 B18R2.14644 CC(C)CNC(C)C1COc2ccccc2O1 270004a_100000210953_100011934066 [0,0,0,1,0,0|3,0,0]=4 271 B18R2.14644 CC(C)CNC(C)C1COc2ccccc2O1 270004a_100015185755_100000210432 [0,0,0,1,0,0|3,0,0]=4 272 B18R2.14644 CC(C)CNC(C)C1COc2ccccc2O1 34a_100015185755_100000210624 [0,0,0,1,0,0|3,0,0]=4 273 B18R2.14644 CC(C)NNC(=O)C1COc2ccccc2O1 22a_100000741168_100000182656 [0,0,0,1,0,0|1,0,2]=4 274 B18R2.19452 COc1ccccc1OCC(=O)CCC2CC2 1458a_100000182946_100000694398 [0,0,0,1,0,0|1,0,2]=4 275 B18R2.19452 COc1ccccc1OCC(=O)NNC2CC2 22a_100000701032_100000182946 [0,0,0,1,0,0|1,0,2]=4 276 B18R2.19452 COc1ccccc1OCC(C)NCC2CC2 2230a_100000743626_100000742324 [0,0,0,1,0,0|3,0,0]=4 277 B18R2.19452 COc1ccccc1OCC(C)NCC2CC2 269862a_100000743626_100000741477 [0,0,0,1,0,0|3,0,0]=4 278 B18R2.19452 COc1ccccc1OCC(C)OCC2CC2 34a_100000242603_100000742324 [0,0,0,1,0,0|3,0,0]=4 279 B18R2.19452 COc1ccccc1OCC(C)OCC2CC2 7a_100000242603_100000742324 [0,0,0,1,0,0|3,0,0]=4 280 B18R2.19497 C#Cc1ccccc1OC[C@H]2COC(O2)(C)C 7a_200011470546_100015422573 [0,0,0,1,0,0|2,0,1]=4 281 B18R2.19497 CC1(OC[C@@H](O1)COc2ccccc2C#N)C 7a_100000211048_100015422573 [0,0,0,1,0,0|3,0,0]=4 282 B18R2.19497 CCc1ccccc1NCC2COC(O2)(C)C 2230a_100000212081_100009884615 [0,0,0,1,0,0|3,0,0]=4 283 B18R2.19497 CCc1ccccc1NC[C@H]2COC(O2)(C)C 2230a_100000212081_100015422573 [0,0,0,1,0,0|3,0,0]=4 284 B18R2.19497 CCc1ccccc1NC[C@H]2COC(O2)(C)C 7a_100000212081_100015422573 [0,0,0,1,0,0|3,0,0]=4 285 B18R2.19497 CCc1ccccc1OC[C@H]2COC(O2)(C)C 7a_100000210936_100015422573 [0,0,0,1,0,0|2,0,0]=3 286 B18R2.19497 CCc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100011215823 [0,0,0,1,0,0|2,1,0]=4 287 B18R2.19497 CCc1ccccc1SCC2COC(O2)(C)C 62a_100011215823_100000198056 [0,0,0,1,0,0|2,1,0]=4 288 B18R2.19497 CCc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100011215823_100015422573 [0,0,0,1,0,0|2,1,0]=4 289 B18R2.19497 CCc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100011215823 [0,0,0,1,0,0|2,1,0]=4 290 B18R2.19497 CNc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100020606079 [0,0,0,1,0,0|2,1,0]=4 291 B18R2.19497 CNc1ccccc1SCC2COC(O2)(C)C 62a_100020606079_100000198056 [0,0,0,1,0,0|2,1,0]=4 292 B18R2.19497 CNc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100020606079 [0,0,0,1,0,0|2,1,0]=4 293 B18R2.19497 CNc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100020606079_100015422573 [0,0,0,1,0,0|2,1,0]=4 294 B18R2.19497 COc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100000210334 [0,0,0,1,0,0|1,1,0]=3 295 B18R2.19497 COc1ccccc1SCC2COC(O2)(C)C 62a_100000210334_100000198056 [0,0,0,1,0,0|1,1,0]=3 296 B18R2.19497 COc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100000210334_100015422573 [0,0,0,1,0,0|1,1,0]=3 297 B18R2.19497 COc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100000210334 [0,0,0,1,0,0|1,1,0]=3 298 B18R2.19497 COc1cccnc1SCC2COC(O2)(C)C 62a_100000198056_100000690851 [0,0,0,1,0,0|2,1,0]=4 299 B18R2.19497 COc1cccnc1SCC2COC(O2)(C)C 62a_100000767102_100000198056 [0,0,0,1,0,0|2,1,0]=4 300 B18R2.19497 COc1cccnc1SC[C@H]2COC(O2)(C)C 62a_100000767102_100015422573 [0,0,0,1,0,0|2,1,0]=4 301 B18R2.19497 COc1cccnc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100000690851 [0,0,0,1,0,0|2,1,0]=4 302 B18R2.19497 COc1ccncc1SCC2COC(O2)(C)C 62a_100000198056_100011997281 [0,0,0,1,0,0|2,1,0]=4 303 B18R2.19497 COc1ccncc1SCC2COC(O2)(C)C 62a_100011997281_100000198056 [0,0,0,1,0,0|2,1,0]=4 304 B18R2.19497 COc1ccncc1SC[C@H]2COC(O2)(C)C 62a_100011997281_100015422573 [0,0,0,1,0,0|2,1,0]=4 305 B18R2.19497 COc1ccncc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100011997281 [0,0,0,1,0,0|2,1,0]=4 306 B18R2.19497 COc1cnccc1SCC2COC(O2)(C)C 62a_100000198056_100016988167 [0,0,0,1,0,0|2,1,0]=4 307 B18R2.19497 COc1cnccc1SCC2COC(O2)(C)C 62a_100016988167_100000198056 [0,0,0,1,0,0|2,1,0]=4 308 B18R2.19497 COc1cnccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100016988167 [0,0,0,1,0,0|2,1,0]=4 309 B18R2.19497 COc1cnccc1SC[C@H]2COC(O2)(C)C 62a_100016988167_100015422573 [0,0,0,1,0,0|2,1,0]=4 310 B18R2.19497 COc1ncccc1OC[C@H]2COC(O2)(C)C 7a_100000698397_100015422573 [0,0,0,1,0,0|2,0,0]=3 311 B18R2.19497 COc1ncccc1SCC2COC(O2)(C)C 62a_100000047025_100000198056 [0,0,0,1,0,0|2,1,0]=4 312 B18R2.19497 COc1ncccc1SCC2COC(O2)(C)C 62a_100000198056_100000047025 [0,0,0,1,0,0|2,1,0]=4 313 B18R2.19497 COc1ncccc1SC[C@H]2COC(O2)(C)C 62a_100000047025_100015422573 [0,0,0,1,0,0|2,1,0]=4 314 B18R2.19497 COc1ncccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100000047025 [0,0,0,1,0,0|2,1,0]=4 315 B18R2.19497 CSc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100011217816 [0,0,0,1,0,0|1,2,0]=4 316 B18R2.19497 CSc1ccccc1SCC2COC(O2)(C)C 62a_100011217816_100000198056 [0,0,0,1,0,0|1,2,0]=4 317 B18R2.19497 CSc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100011217816_100015422573 [0,0,0,1,0,0|1,2,0]=4 318 B18R2.19497 CSc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100011217816 [0,0,0,1,0,0|1,2,0]=4 319 B18R2.105379 COc1cccc2c1OCC(C2)NCC(C)C 2230a_100000059700_100000210760 [0,0,0,1,0,0|3,0,0]=4 320 B18R2.105379 COc1cccc2c1OCC(C2)NCC(C)C 270004a_100000059700_100000210432 [0,0,0,1,0,0|3,0,0]=4 321 B18R2.105379 COc1cccc2c1OCC(C2)NCC(C)C 34a_100000059700_100000210624 [0,0,0,1,0,0|3,0,0]=4 322 B16R1.56 CCc1ccccc1OCC(=O)CC(C)C 1458a_100000182566_100000210624 [0,0,0,0,1,0|1,0,2]=4 323 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 11a_100138425928_100000182566 [0,0,0,0,1,0|1,0,2]=4 324 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 1626a_100138425928_100000182566 [0,0,0,0,1,0|1,0,2]=4 325 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 240690a_100138425928_100000182566 [0,0,0,0,1,0|1,0,2]=4 326 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 34a_100000210936_100000183996 [0,0,0,0,1,0|1,0,2]=4 327 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 527a_100138425928_100000182566 [0,0,0,0,1,0|1,0,2]=4 328 B16R1.56 CCc1ccccc1OCC(=O)NC(C)C 7a_100000210936_100000183996 [0,0,0,0,1,0|1,0,2]=4 329 B16R1.56 CCc1ccccc1OCC(C)CN(C)C 7a_100000210936_100015348159 [0,0,0,0,1,0|3,0,0]=4 330 B16R1.56 CNc1ccccc1OCC(=O)NC(C)C 34a_100000033821_100000183996 [0,0,0,0,1,0|1,0,2]=4 331 B16R1.56 COc1ccccc1CCC(=O)CC(C)C 1458a_100000184355_100000210624 [0,0,0,0,1,0|1,0,2]=4 332 B16R1.56 COc1ccccc1CCC(=O)CC(C)C 1458a_100000210554_100011713687 [0,0,0,0,1,0|1,0,2]=4 333 B16R1.56 COc1ccccc1CCC(=O)NC(C)C 11a_100138425928_100000184355 [0,0,0,0,1,0|1,0,2]=4 334 B16R1.56 COc1ccccc1CCC(=O)NC(C)C 1626a_100138425928_100000184355 [0,0,0,0,1,0|1,0,2]=4 335 B16R1.56 COc1ccccc1CCC(=O)NC(C)C 240690a_100138425928_100000184355 [0,0,0,0,1,0|1,0,2]=4 336 B16R1.56 COc1ccccc1CCC(=O)NC(C)C 527a_100138425928_100000184355 [0,0,0,0,1,0|1,0,2]=4 337 B16R1.56 COc1ccccc1CCN(C)CC(C)C 2230a_100000231131_100000210760 [0,0,0,0,1,0|3,0,0]=4 338 B16R1.56 COc1ccccc1CCN(C)CC(C)C 2230a_100000747067_100011713687 [0,0,0,0,1,0|3,0,0]=4 339 B16R1.56 COc1ccccc1CCN(C)CC(C)C 269982a_100000231131_100000210624 [0,0,0,0,1,0|3,0,0]=4 340 B16R1.56 COc1ccccc1CCN(C)CC(C)C 269982a_100000747067_100011713687 [0,0,0,0,1,0|3,0,0]=4 341 B16R1.56 COc1ccccc1CCN(C)CC(C)C 270004a_100000231131_100000210432 [0,0,0,0,1,0|3,0,0]=4 342 B16R1.56 COc1ccccc1CCN(C)CC(C)C 270004a_100000747067_100011713418 [0,0,0,0,1,0|3,0,0]=4 343 B16R1.56 COc1ccccc1CNC(C)CC(C)C 207a_100000692259_100000169842 [0,0,0,0,1,0|3,0,0]=4 344 B16R1.56 COc1ccccc1CNC(C)CC(C)C 2230a_100000692259_100000210004 [0,0,0,0,1,0|3,0,0]=4 345 B16R1.56 COc1ccccc1CNC(C)CC(C)C 270004a_100000692259_100000169842 [0,0,0,0,1,0|3,0,0]=4 346 B16R1.56 COc1ccccc1CNC(C)CC(C)C 34a_100000188900_100000731052 [0,0,0,0,1,0|3,0,0]=4 347 B16R1.56 COc1ccccc1COC(C)CC(C)C 34a_100000211301_100000731052 [0,0,0,0,1,0|3,0,0]=4 348 B16R1.56 COc1ccccc1COC(C)CC(C)C 34a_100000211805_100000210004 [0,0,0,0,1,0|3,0,0]=4 349 B16R1.56 COc1ccccc1COC(C)CC(C)C 7a_100000211805_100000210004 [0,0,0,0,1,0|3,0,0]=4 350 B16R1.56 COc1ccccc1CSC(C)CC(C)C 62a_100000210004_100000731052 [0,0,0,0,1,0|3,0,0]=4 351 B16R1.56 COc1ccccc1CSC(C)CC(C)C 62a_100000731052_100000210004 [0,0,0,0,1,0|3,0,0]=4 352 B16R1.56 COc1ccccc1NCC(=O)NC(C)C 34a_100000210025_100000183996 [0,0,0,0,1,0|1,0,2]=4 353 B16R1.56 COc1ccccc1OCC(=O)CC(C)C 1458a_100000182946_100000210624 [0,0,0,0,1,0|0,0,2]=3 354 B16R1.56 COc1ccccc1OCC(=O)CC(C)O 1458a_100000182946_100011218427 [0,0,0,0,1,0|1,0,2]=4 355 B16R1.56 COc1ccccc1OCC(=O)NC(C)C 11a_100138425928_100000182946 [0,0,0,0,1,0|0,0,2]=3 356 B16R1.56 COc1ccccc1OCC(=O)NC(C)C 1626a_100138425928_100000182946 [0,0,0,0,1,0|0,0,2]=3 357 B16R1.56 COc1ccccc1OCC(=O)NC(C)C 240690a_100138425928_100000182946 [0,0,0,0,1,0|0,0,2]=3 358 B16R1.56 COc1ccccc1OCC(=O)NC(C)C 34a_100000210385_100000183996 [0,0,0,0,1,0|0,0,2]=3 359 B16R1.56 COc1ccccc1OCC(=O)NC(C)C 527a_100138425928_100000182946 [0,0,0,0,1,0|0,0,2]=3 360 B16R1.56 COc1ccccc1OCC(=O)OC(C)C 34a_100000210385_100011215430 [0,0,0,0,1,0|1,0,2]=4 361 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 11a_100000743626_100015343762 [0,0,0,0,1,0|2,0,1]=4 362 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 1626a_100000743626_100015343762 [0,0,0,0,1,0|2,0,1]=4 363 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 240690a_100000743626_100015343762 [0,0,0,0,1,0|2,0,1]=4 364 B16R1.56 COc1ccccc1OCC(C)NC(=O)C 527a_100000743626_100103153847 [0,0,0,0,1,0|2,0,1]=4 365 B16R1.56 COc1ccccc1OCC(C)NC(C)C 2230a_100000743626_100000210206 [0,0,0,0,1,0|1,0,0]=2 366 B16R1.56 COc1ccccc1OCC(C)OC(C)C 34a_100000242603_100000210206 [0,0,0,0,1,0|2,0,0]=3 367 B16R1.56 COc1ccccc1OCC(C)OC(C)C 7a_100000242603_100000210206 [0,0,0,0,1,0|2,0,0]=3 368 B16R1.56 COc1ccccc1SCC(=O)NC(C)C 62a_100000183996_100000210334 [0,0,0,0,1,0|0,1,2]=4 369 B16R1.56 COc1ccccc1SCC(=O)NC(C)C 62a_100000210334_100000183996 [0,0,0,0,1,0|0,1,2]=4 370 B16R1.56 COc1ccccc1SCC(C)CN(C)C 62a_100000210334_100015348159 [0,0,0,0,1,0|2,1,0]=4 371 B16R1.56 COc1ccccc1SCC(C)CN(C)C 62a_100015348159_100000210334 [0,0,0,0,1,0|2,1,0]=4 372 B16R1.56 COc1cccnc1OCC(=O)NC(C)C 34a_100025773188_100000183996 [0,0,0,0,1,0|1,0,2]=4 373 B16R1.56 COc1ccncc1OCC(=O)NC(C)C 34a_100000101186_100000183996 [0,0,0,0,1,0|1,0,2]=4 374 B16R1.56 COc1ncccc1OCC(=O)NC(C)C 34a_100000698397_100000183996 [0,0,0,0,1,0|1,0,2]=4 375 B16R1.56 COc1ncccc1OCC(=O)NC(C)C 7a_100000698397_100000183996 [0,0,0,0,1,0|1,0,2]=4 376 B16R1.56 COc1ncccc1OCC(C)CN(C)C 7a_100000698397_100015348159 [0,0,0,0,1,0|3,0,0]=4 377 B16R1.56 CSc1ccccc1OCC(=O)NC(C)C 34a_100011216402_100000183996 [0,0,0,0,1,0|0,1,2]=4 378 B16R1.1369 CCc1ccccc1OC(C)CCC(C)C 34a_100000210936_100011261404 [0,0,0,0,1,0|3,0,0]=4 379 B16R1.1369 CNc1ccccc1OC(C)CCC(C)C 34a_100000033821_100011261404 [0,0,0,0,1,0|3,0,0]=4 380 B16R1.1369 COc1ccccc1CC(=NNC(C)C)C 4a_100000741168_100000211486 [0,0,0,0,1,0|2,0,1]=4 381 B16R1.1369 COc1ccccc1CC(=O)CCC(C)C 1458a_100000181311_100000210004 [0,0,0,0,1,0|1,0,2]=4 382 B16R1.1369 COc1ccccc1CC(=O)CCC(C)C 1458a_100000211604_100000210312 [0,0,0,0,1,0|1,0,2]=4 383 B16R1.1369 COc1ccccc1CC(=O)COC(C)C 1458a_100000745533_100000210004 [0,0,0,0,1,0|1,0,2]=4 384 B16R1.1369 COc1ccccc1CC(=O)CSC(C)C 1458a_100000241585_100000210004 [0,0,0,0,1,0|1,0,2]=4 385 B16R1.1369 COc1ccccc1CC(=O)NNC(C)C 22a_100000741168_100000211604 [0,0,0,0,1,0|1,0,2]=4 386 B16R1.1369 COc1ccccc1CC(C)NCC(C)C 270004a_100000210953_100000211486 [0,0,0,0,1,0|3,0,0]=4 387 B16R1.1369 COc1ccccc1CC(C)OCC(C)C 7a_100000691916_100000210760 [0,0,0,0,1,0|3,0,0]=4 388 B16R1.1369 COc1ccccc1CN(C)CCC(C)C 2230a_100000184376_100000210312 [0,0,0,0,1,0|3,0,0]=4 389 B16R1.1369 COc1ccccc1CN(C)CCC(C)C 2230a_100000742789_100000210004 [0,0,0,0,1,0|3,0,0]=4 390 B16R1.1369 COc1ccccc1CN(C)CCC(C)C 269982a_100000184376_100000210312 [0,0,0,0,1,0|3,0,0]=4 391 B16R1.1369 COc1ccccc1CN(C)CCC(C)C 269982a_100000742789_100000210004 [0,0,0,0,1,0|3,0,0]=4 392 B16R1.1369 COc1ccccc1CN(C)CCC(C)C 270004a_100000742789_100000169842 [0,0,0,0,1,0|3,0,0]=4 393 B16R1.1369 COc1ccccc1CN(C)COC(C)C 2230a_100000184376_100000709892 [0,0,0,0,1,0|3,0,0]=4 394 B16R1.1369 COc1ccccc1CN(C)COC(C)C 269982a_100000184376_100000709892 [0,0,0,0,1,0|3,0,0]=4 395 B16R1.1369 COc1ccccc1NC(=O)CNC(C)C 2230a_100138425928_100000182883 [0,0,0,0,1,0|1,0,2]=4 396 B16R1.1369 COc1ccccc1NC(=O)CNC(C)C 34a_100138425928_100000182883 [0,0,0,0,1,0|1,0,2]=4 397 B16R1.1369 COc1ccccc1NC(C)CCC(C)C 34a_100000210025_100011261404 [0,0,0,0,1,0|3,0,0]=4 398 B16R1.1369 COc1ccccc1OC(C)CCC(C)C 34a_100000210385_100011261404 [0,0,0,0,1,0|2,0,0]=3 399 B16R1.1369 COc1ccccc1SC(C)CCC(C)C 62a_100000210334_100011261404 [0,0,0,0,1,0|2,1,0]=4 400 B16R1.1369 COc1ccccc1SC(C)CCC(C)C 62a_100011261404_100000210334 [0,0,0,0,1,0|2,1,0]=4 401 B16R1.1369 COc1cccnc1OC(C)CCC(C)C 34a_100025773188_100011261404 [0,0,0,0,1,0|3,0,0]=4 402 B16R1.1369 COc1ccncc1OC(C)CCC(C)C 34a_100000101186_100011261404 [0,0,0,0,1,0|3,0,0]=4 403 B16R1.1369 COc1ncccc1OC(C)CCC(C)C 34a_100000698397_100011261404 [0,0,0,0,1,0|3,0,0]=4 404 B16R1.1369 CSc1ccccc1OC(C)CCC(C)C 34a_100011216402_100011261404 [0,0,0,0,1,0|2,1,0]=4 405 B18R1.7318 COc1ccccc1OCC(=O)CCCC(C)C 1458a_100000182946_100011214892 [0,0,0,0,0,1|1,0,2]=4 406 B18R1.7318 COc1ccccc1OCC(=O)CCOC(C)C 1458a_100000182946_100000211751 [0,0,0,0,0,1|1,0,2]=4 407 B18R1.7318 COc1ccccc1OCC(=O)CCSC(C)C 1458a_100000182946_100000730970 [0,0,0,0,0,1|1,0,2]=4 408 B18R1.7318 COc1ccccc1OCC(=O)NCCC(C)C 11a_100000210545_100000182946 [0,0,0,0,0,1|1,0,2]=4 409 B18R1.7318 COc1ccccc1OCC(=O)NCCC(C)C 1626a_100000210545_100000182946 [0,0,0,0,0,1|1,0,2]=4 410 B18R1.7318 COc1ccccc1OCC(=O)NCCC(C)C 240690a_100000210545_100000182946 [0,0,0,0,0,1|1,0,2]=4 411 B18R1.7318 COc1ccccc1OCC(=O)NCCC(C)C 527a_100000210545_100000182946 [0,0,0,0,0,1|1,0,2]=4 412 B18R1.7318 COc1ccccc1OCC(=O)NNCC(C)C 22a_100000696102_100000182946 [0,0,0,0,0,1|1,0,2]=4 413 B18R1.7318 COc1ccccc1OCC(C)NCC=C(C)C 2230a_100000743626_100000761012 [0,0,0,0,0,1|2,0,1]=4 414 B18R1.7318 COc1ccccc1OCC(C)NCCC(C)C 2230a_100000743626_100000210312 [0,0,0,0,0,1|2,0,0]=3 415 B18R1.7318 COc1ccccc1OCC(C)NCCC(C)C 269862a_100000743626_100000185833 [0,0,0,0,0,1|2,0,0]=3 416 B18R1.7318 COc1ccccc1OCC(C)NCCC(C)O 2230a_100000743626_100012276601 [0,0,0,0,0,1|3,0,0]=4 417 B18R1.7318 COc1ccccc1OCC(C)NCOC(C)C 2230a_100000743626_100000709892 [0,0,0,0,0,1|2,0,0]=3 418 B18R1.7318 COc1ccccc1OCC(C)OCC=C(C)C 34a_100000242603_100000761012 [0,0,0,0,0,1|2,0,1]=4 419 B18R1.7318 COc1ccccc1OCC(C)OCC=C(C)C 7a_100000242603_100000761012 [0,0,0,0,0,1|2,0,1]=4 420 B18R1.7318 COc1ccccc1OCC(C)OCCC(C)C 34a_100000242603_100000210312 [0,0,0,0,0,1|2,0,0]=3 421 B18R1.7318 COc1ccccc1OCC(C)OCCC(C)C 7a_100000242603_100000210626 [0,0,0,0,0,1|2,0,0]=3 422 B18R1.7318 COc1ccccc1OCC(C)OCCC(C)O 34a_100000242603_100012276601 [0,0,0,0,0,1|3,0,0]=4 423 B18R1.7318 COc1ccccc1OCC(C)OCCC(C)O 7a_100000242603_100012276601 [0,0,0,0,0,1|3,0,0]=4 424 B18R1.7318 COc1ccccc1OCC(C)OCCN(C)C 7a_100000242603_100000755713 [0,0,0,0,0,1|3,0,0]=4 425 B18R1.7318 COc1ccccc1OCC(C)OCOC(C)C 34a_100000242603_100000709892 [0,0,0,0,0,1|2,0,0]=3 426 B18R1.37991 COc1ccccc1CCNC(=O)CNC(C)C 2230a_100138425928_100000230243 [0,0,0,0,0,1|1,0,2]=4 427 B18R1.37991 COc1ccccc1CCNC(=O)CNC(C)C 34a_100138425928_100000230243 [0,0,0,0,0,1|1,0,2]=4 428 B18R1.37991 COc1ccccc1CCNC(C)CCC(C)C 2230a_100000211851_100011261404 [0,0,0,0,0,1|3,0,0]=4 429 B18R1.37991 COc1ccccc1CCNC(C)CCC(C)C 2230a_100138410893_100011713687 [0,0,0,0,0,1|3,0,0]=4 430 B18R1.37991 COc1ccccc1CCNC(C)CCC(C)C 270004a_100000211851_100000210476 [0,0,0,0,0,1|3,0,0]=4 431 B18R1.37991 COc1ccccc1CCNC(C)CCC(C)C 270004a_100138410893_100011713418 [0,0,0,0,0,1|3,0,0]=4 432 B18R1.37991 COc1ccccc1CCNC(C)CCC(C)C 34a_100000211851_100011261404 [0,0,0,0,0,1|3,0,0]=4 433 B18R1.37991 COc1ccccc1CCOC(C)CCC(C)C 34a_100011215350_100011713687 [0,0,0,0,0,1|3,0,0]=4 434 B18R1.37991 COc1ccccc1CCOC(C)CCC(C)C 34a_100011218620_100011261404 [0,0,0,0,0,1|3,0,0]=4 435 B18R1.37991 COc1ccccc1CCOC(C)CCC(C)C 7a_100011215350_100011713687 [0,0,0,0,0,1|3,0,0]=4 436 B18R1.37991 COc1ccccc1CCSC(C)CCC(C)C 62a_100011261404_100011713687 [0,0,0,0,0,1|3,0,0]=4 437 B18R1.37991 COc1ccccc1CCSC(C)CCC(C)C 62a_100011713687_100011261404 [0,0,0,0,0,1|3,0,0]=4 438 B18R1.37991 COc1ccccc1COCC(=O)CCC(C)C 1458a_100012176948_100000210312 [0,0,0,0,0,1|1,0,2]=4 439 B18R1.37991 COc1ccccc1COCC(=O)NNC(C)C 22a_100000741168_100012176948 [0,0,0,0,0,1|1,0,2]=4 440 B18R1.37991 COc1ccccc1COCC(O)COC(=O)C 34a_100000211301_200000139349 [0,0,0,0,0,1|2,0,1]=4 441 B18R1.37991 COc1ccccc1OCCC(=O)CCC(C)C 1458a_100000181311_100000188471 [0,0,0,0,0,1|1,0,2]=4 442 B18R1.37991 COc1ccccc1OCCC(=O)CCC(C)C 1458a_100000182669_100000210312 [0,0,0,0,0,1|1,0,2]=4 443 B18R1.37991 COc1ccccc1OCCC(=O)COC(C)C 1458a_100000745533_100000188471 [0,0,0,0,0,1|1,0,2]=4 444 B18R1.37991 COc1ccccc1OCCC(=O)CSC(C)C 1458a_100000241585_100000188471 [0,0,0,0,0,1|1,0,2]=4 445 B18R1.37991 COc1ccccc1OCCC(=O)NNC(C)C 22a_100000741168_100000182669 [0,0,0,0,0,1|1,0,2]=4 446 B18R1.37991 COc1ccccc1OCCN(C)CCC(C)C 2230a_100000228778_100000210312 [0,0,0,0,0,1|3,0,0]=4 447 B18R1.37991 COc1ccccc1OCCN(C)CCC(C)C 2230a_100000742789_100000188471 [0,0,0,0,0,1|3,0,0]=4 448 B18R1.37991 COc1ccccc1OCCN(C)CCC(C)C 269982a_100000228778_100000210312 [0,0,0,0,0,1|3,0,0]=4 449 B18R1.37991 COc1ccccc1OCCN(C)CCC(C)C 269982a_100000742789_100000188471 [0,0,0,0,0,1|3,0,0]=4 450 B18R1.37991 COc1ccccc1OCCN(C)COC(C)C 2230a_100000228778_100000709892 [0,0,0,0,0,1|3,0,0]=4 451 B18R1.37991 COc1ccccc1OCCN(C)COC(C)C 269982a_100000228778_100000709892 [0,0,0,0,0,1|3,0,0]=4 452 B15R1.131 CC(=O)NCCCOc1ccccc1C 11a_106633784460_100015343762 [2,0,0,0,0,0|1,0,1]=4 453 B15R1.131 CC(=O)NCCCOc1ccccc1C 1626a_106633784460_100015343762 [2,0,0,0,0,0|1,0,1]=4 454 B15R1.131 CC(=O)NCCCOc1ccccc1C 240690a_106633784460_100015343762 [2,0,0,0,0,0|1,0,1]=4 455 B15R1.131 CC(=O)NCCCOc1ccccc1C 527a_106633784460_100103153847 [2,0,0,0,0,0|1,0,1]=4 456 B15R1.131 CC(C)CCCCNc1ccccc1O 34a_100000185747_100011216152 [2,0,0,0,0,0|2,0,0]=4 457 B15R1.131 CC(C)CCCCOc1ccccc1Br 34a_100000181306_100011216152 [2,0,0,0,0,0|2,0,0]=4 458 B15R1.131 CC(C)CCCCOc1ccccc1Br 7a_100000181306_100011216152 [2,0,0,0,0,0|2,0,0]=4 459 B15R1.131 CC(C)CCCCOc1ccccc1Cl 34a_100000210172_100011216152 [2,0,0,0,0,0|2,0,0]=4 460 B15R1.131 CC(C)CCCCOc1ccccc1Cl 7a_100000210172_100011216152 [2,0,0,0,0,0|2,0,0]=4 461 B15R1.131 CC(C)CCCCOc1ccccc1F 34a_100000210171_100011216152 [2,0,0,0,0,0|2,0,0]=4 462 B15R1.131 CC(C)CCCCOc1ccccc1F 7a_100000210171_100011216152 [2,0,0,0,0,0|2,0,0]=4 463 B15R1.131 CC(C)CCCCOc1ccccc1I 34a_100000739446_100011216152 [2,0,0,0,0,0|2,0,0]=4 464 B15R1.131 CC(C)CCCCOc1ccccc1I 7a_100000739446_100011216152 [2,0,0,0,0,0|2,0,0]=4 465 B15R1.131 CC(C)CCCCOc1ccccc1N 34a_100000185747_100011216152 [2,0,0,0,0,0|2,0,0]=4 466 B15R1.131 CC(C)CCCCOc1ccccc1N 7a_100000185747_100011216152 [2,0,0,0,0,0|2,0,0]=4 467 B15R1.131 CC(C)CCCCSc1ccccc1O 62a_100000739446_100011216152 [2,0,0,0,0,0|1,1,0]=4 468 B15R1.131 CC(C)CCCCSc1ccccc1O 62a_100011216152_100000739446 [2,0,0,0,0,0|1,1,0]=4 469 B15R1.131 CC(C)NCCCOc1ccccc1Br 2230a_100138425928_200011259276 [2,0,0,0,0,0|1,0,0]=3 470 B15R1.131 CC(C)NCCCOc1ccccc1Br 34a_100138425928_200011259276 [2,0,0,0,0,0|1,0,0]=3 471 B15R1.131 CC(C)NCCCOc1ccccc1F 2230a_100000707858_100000210206 [2,0,0,0,0,0|1,0,0]=3 472 B15R1.131 CC(C)NCCCOc1ccccc1F 2230a_100138425928_100011203253 [2,0,0,0,0,0|1,0,0]=3 473 B15R1.131 CC(C)NCCCOc1ccccc1F 34a_100000707858_100000210206 [2,0,0,0,0,0|1,0,0]=3 474 B15R1.131 CC(C)NCCCOc1ccccc1F 34a_100138425928_100011203253 [2,0,0,0,0,0|1,0,0]=3 475 B15R1.131 CC(C)NCCCSc1ccccc1Cl 2230a_100138425928_100000750589 [2,0,0,0,0,0|1,1,0]=4 476 B15R1.131 CC(C)NCCCSc1ccccc1Cl 34a_100138425928_100000750589 [2,0,0,0,0,0|1,1,0]=4 477 B15R1.131 CC(C)OCCCOc1ccccc1Br 34a_100000212225_200011259276 [2,0,0,0,0,0|2,0,0]=4 478 B15R1.131 CC(C)OCCCOc1ccccc1Cl 34a_100000230521_100000210206 [2,0,0,0,0,0|2,0,0]=4 479 B15R1.131 CC(C)OCCCOc1ccccc1Cl 7a_100000230521_100000210206 [2,0,0,0,0,0|2,0,0]=4 480 B15R1.131 CC(C)OCCCOc1ccccc1F 34a_100000212225_100011203253 [2,0,0,0,0,0|2,0,0]=4 481 B15R1.131 CC(C)SCCCOc1ccccc1Br 62a_100000210206_200011259276 [2,0,0,0,0,0|2,0,0]=4 482 B15R1.131 CC(C)SCCCOc1ccccc1Br 62a_200011259276_100000210206 [2,0,0,0,0,0|2,0,0]=4 483 B15R1.131 CC(C)SCCCOc1ccccc1F 62a_100000210206_100011203253 [2,0,0,0,0,0|2,0,0]=4 484 B15R1.131 CC(C)SCCCOc1ccccc1F 62a_100011203253_100000210206 [2,0,0,0,0,0|2,0,0]=4 485 B15R1.131 Cc1ccccc1COCCNC(C)C 34a_100000224655_100000211839 [2,0,0,0,0,0|2,0,0]=4 486 B15R1.131 Cc1ccccc1CSCCNC(C)C 2230a_200000189569_100000210206 [2,0,0,0,0,0|2,0,0]=4 487 B15R1.131 Cc1ccccc1CSCCNC(C)C 34a_200000189569_100000210206 [2,0,0,0,0,0|2,0,0]=4 488 B15R1.131 Cc1ccccc1CSCCNC(C)C 7a_200000189569_100000210206 [2,0,0,0,0,0|2,0,0]=4 489 B15R1.131 Cc1ccccc1NCCCCC(C)C 34a_100015192222_100011216152 [2,0,0,0,0,0|2,0,0]=4 490 B15R1.131 Cc1ccccc1OCCCCC(C)C 34a_100000210338_100011216152 [2,0,0,0,0,0|1,0,0]=3 491 B15R1.131 Cc1ccccc1OCCCCC(C)C 7a_100000210338_100011216152 [2,0,0,0,0,0|1,0,0]=3 492 B15R1.131 Cc1ccccc1OCCCNC(C)C 2230a_100138425928_100000742659 [2,0,0,0,0,0|0,0,0]=2 493 B15R1.131 Cc1ccccc1OCCCNC(C)C 2230a_106633784460_100000210206 [2,0,0,0,0,0|0,0,0]=2 494 B15R1.131 Cc1ccccc1OCCCNC(C)C 34a_100138425928_100000742659 [2,0,0,0,0,0|0,0,0]=2 495 B15R1.131 Cc1ccccc1OCCCNC(C)C 34a_106633784460_100000210206 [2,0,0,0,0,0|0,0,0]=2 496 B15R1.131 Cc1ccccc1OCCCOC(C)C 34a_100000212225_100000742659 [2,0,0,0,0,0|1,0,0]=3 497 B15R1.131 Cc1ccccc1OCCCSC(C)C 62a_100000210206_100000742659 [2,0,0,0,0,0|1,0,0]=3 498 B15R1.131 Cc1ccccc1OCCCSC(C)C 62a_100000742659_100000210206 [2,0,0,0,0,0|1,0,0]=3 499 B15R1.131 Cc1ccccc1OCCNCC(C)C 2230a_100000210953_100000184434 [2,0,0,0,0,0|2,0,0]=4 500 B15R1.131 Cc1ccccc1OCCNCC(C)C 2230a_100000743344_100000210760 [2,0,0,0,0,0|2,0,0]=4 501 B15R1.131 Cc1ccccc1OCCNCC(C)C 270004a_100000743344_100000210432 [2,0,0,0,0,0|2,0,0]=4 502 B15R1.131 Cc1ccccc1OCCNCC(C)C 34a_100000210953_100000184434 [2,0,0,0,0,0|2,0,0]=4 503 B15R1.131 Cc1ccccc1OCCNCC(C)C 34a_100000743344_100000210624 [2,0,0,0,0,0|2,0,0]=4 504 B15R1.131 Cc1ccccc1OCCOCC(C)C 34a_100000210257_100000184434 [2,0,0,0,0,0|2,0,0]=4 505 B15R1.131 Cc1ccccc1OCCSCC(C)C 62a_100000184434_100000210760 [2,0,0,0,0,0|2,0,0]=4 506 B15R1.131 Cc1ccccc1OCCSCC(C)C 62a_100000210624_100000184434 [2,0,0,0,0,0|2,0,0]=4 507 B15R1.131 Cc1ccccc1SCCCCC(C)C 62a_100000210755_100011216152 [2,0,0,0,0,0|1,1,0]=4 508 B15R1.131 Cc1ccccc1SCCCCC(C)C 62a_100011216152_100000210755 [2,0,0,0,0,0|1,1,0]=4 509 B15R1.131 Cc1ccncc1OCCCCC(C)C 34a_100011997053_100011216152 [2,0,0,0,0,0|2,0,0]=4 510 B15R1.131 Cc1ccncc1OCCCCC(C)C 7a_100011997053_100011216152 [2,0,0,0,0,0|2,0,0]=4 511 B15R1.131 Cc1cnccc1OCCCCC(C)C 34a_100000694293_100011216152 [2,0,0,0,0,0|2,0,0]=4 512 B15R1.131 Cc1ncccc1OCCCCC(C)C 34a_100000745507_100011216152 [2,0,0,0,0,0|2,0,0]=4 513 B15R1.131 Cc1ncccc1OCCCCC(C)C 7a_100000745507_100011216152 [2,0,0,0,0,0|2,0,0]=4 514 B15R1.1045 CC/C=C\CCOc1ccccc1OC 34a_100000210385_100015370543 [2,0,0,0,0,0|1,0,1]=4 515 B15R1.1045 CCCCCCNc1ccccc1OC 34a_100000210025_100000210314 [2,0,0,0,0,0|2,0,0]=4 516 B15R1.1045 CCCCCCOc1ccccc1CC 34a_100000210936_100000210314 [2,0,0,0,0,0|2,0,0]=4 517 B15R1.1045 CCCCCCOc1ccccc1CC 7a_100000210936_100000210314 [2,0,0,0,0,0|2,0,0]=4 518 B15R1.1045 CCCCCCOc1ccccc1NC 34a_100000033821_100000210314 [2,0,0,0,0,0|2,0,0]=4 519 B15R1.1045 CCCCCCOc1ccccc1OC 34a_100000210385_100000210314 [2,0,0,0,0,0|1,0,0]=3 520 B15R1.1045 CCCCCCOc1ccccc1SC 34a_100011216402_100000210314 [2,0,0,0,0,0|1,1,0]=4 521 B15R1.1045 CCCCCCOc1cccnc1OC 34a_100000698397_100000210314 [2,0,0,0,0,0|2,0,0]=4 522 B15R1.1045 CCCCCCOc1cccnc1OC 7a_100000698397_100000210314 [2,0,0,0,0,0|2,0,0]=4 523 B15R1.1045 CCCCCCOc1cnccc1OC 34a_100000101186_100000210314 [2,0,0,0,0,0|2,0,0]=4 524 B15R1.1045 CCCCCCOc1ncccc1OC 34a_100025773188_100000210314 [2,0,0,0,0,0|2,0,0]=4 525 B15R1.1045 CCCCCCSc1ccccc1OC 62a_100000210314_100000210334 [2,0,0,0,0,0|1,1,0]=4 526 B15R1.1045 CCCCCCSc1ccccc1OC 62a_100000210334_100000210757 [2,0,0,0,0,0|1,1,0]=4 527 B15R1.1045 CCCCOCOc1ccccc1OC 34a_100000210385_100011995733 [2,0,0,0,0,0|2,0,0]=4 528 B15R1.1045 CCCNCCOc1ccccc1OC 2230a_100000683763_100000210303 [2,0,0,0,0,0|2,0,0]=4 529 B15R1.1045 CCCNCCOc1ccccc1OC 34a_100000683763_100000210303 [2,0,0,0,0,0|2,0,0]=4 530 B15R1.1045 CCCOCCOc1ccccc1OC 34a_100000210258_100000188471 [2,0,0,0,0,0|2,0,0]=4 531 B15R1.1045 CCCOCCOc1ccccc1OC 34a_100000210385_100011215938 [2,0,0,0,0,0|2,0,0]=4 532 B15R1.1045 CCCSCCOc1ccccc1OC 62a_100000188471_100000210303 [2,0,0,0,0,0|2,0,0]=4 533 B15R1.1045 CCCSCCOc1ccccc1OC 62a_100000210303_100000188471 [2,0,0,0,0,0|2,0,0]=4 534 B15R1.1045 CCNCCCOc1ccccc1C#N 2230a_100011220211_100000210202 [2,0,0,0,0,0|2,0,0]=4 535 B15R1.1045 CCNCCCOc1ccccc1C#N 34a_100011220211_100000210202 [2,0,0,0,0,0|2,0,0]=4 536 B15R1.1045 CCNCCCOc1ccccc1OC 2230a_100015525214_100011259231 [2,0,0,0,0,0|0,0,0]=2 537 B15R1.1045 CCNCCCOc1ccccc1OC 34a_100000752037_100000210202 [2,0,0,0,0,0|0,0,0]=2 538 B15R1.1045 CCOCCCNc1ccccc1OC 34a_100000210025_100012232248 [2,0,0,0,0,0|2,0,0]=4 539 B15R1.1045 CCOCCCOc1ccccc1CC 34a_100000210936_100012232248 [2,0,0,0,0,0|2,0,0]=4 540 B15R1.1045 CCOCCCOc1ccccc1CC 7a_100000210936_100012232248 [2,0,0,0,0,0|2,0,0]=4 541 B15R1.1045 CCOCCCOc1ccccc1NC 34a_100000033821_100012232248 [2,0,0,0,0,0|2,0,0]=4 542 B15R1.1045 CCOCCCOc1ccccc1OC 34a_100000210385_100012232248 [2,0,0,0,0,0|1,0,0]=3 543 B15R1.1045 CCOCCCOc1ccccc1OC 34a_100121572206_100011259231 [2,0,0,0,0,0|1,0,0]=3 544 B15R1.1045 CCOCCCOc1ccccc1SC 34a_100011216402_100012232248 [2,0,0,0,0,0|1,1,0]=4 545 B15R1.1045 CCOCCCOc1cccnc1OC 34a_100000698397_100012232248 [2,0,0,0,0,0|2,0,0]=4 546 B15R1.1045 CCOCCCOc1cccnc1OC 7a_100000698397_100012232248 [2,0,0,0,0,0|2,0,0]=4 547 B15R1.1045 CCOCCCOc1cnccc1OC 34a_100000101186_100012232248 [2,0,0,0,0,0|2,0,0]=4 548 B15R1.1045 CCOCCCOc1ncccc1OC 34a_100025773188_100012232248 [2,0,0,0,0,0|2,0,0]=4 549 B15R1.1045 CCOCCCSc1ccccc1OC 62a_100000210334_100012232248 [2,0,0,0,0,0|1,1,0]=4 550 B15R1.1045 CCOCCCSc1ccccc1OC 62a_100012232248_100000210334 [2,0,0,0,0,0|1,1,0]=4 551 B15R1.1045 CCSCCCOc1ccccc1OC 62a_100000210202_100011259231 [2,0,0,0,0,0|1,0,0]=3 552 B15R1.1045 CCSCCCOc1ccccc1OC 62a_100011259231_100000210202 [2,0,0,0,0,0|1,0,0]=3 553 B15R1.1045 CNCCCCOc1ccccc1OC 2230a_106832991635_200011219331 [2,0,0,0,0,0|2,0,0]=4 554 B15R1.1045 CNCCCCOc1ccccc1OC 34a_100102657272_200011219331 [2,0,0,0,0,0|2,0,0]=4 555 B15R1.1045 CNCCCCOc1ccccc1OC 7a_106832991635_200011219331 [2,0,0,0,0,0|2,0,0]=4 556 B15R1.1045 COCCCCOc1ccccc1OC 34a_100000210385_100000755781 [2,0,0,0,0,0|2,0,0]=4 557 B15R1.1045 COCCCCOc1ccccc1OC 34a_100138415774_200011219331 [2,0,0,0,0,0|2,0,0]=4 558 B15R1.1045 COc1ccccc1OCCCCCF 34a_100000210385_100000729378 [2,0,0,0,0,0|2,0,0]=4 559 B15R1.1045 COc1ccccc1OCCCCCO 34a_100000210385_100000746330 [2,0,0,0,0,0|2,0,0]=4 560 B15R1.1045 COc1ccccc1OCCCCSC 62a_200000210301_200011219331 [2,0,0,0,0,0|2,0,0]=4 561 B15R1.1045 COc1ccccc1OCCCCSC 62a_200011219331_200000210301 [2,0,0,0,0,0|2,0,0]=4 562 B15R1.1045 COc1ccccc1OCCCCS[13CH3] 62a_200011219331_200025704644 [2,0,0,0,0,0|2,0,0]=4 563 B15R1.1045 COc1ccccc1OCCCCS[13CH3] 62a_200025704644_200011219331 [2,0,0,0,0,0|2,0,0]=4 564 B15R1.1045 COc1ccccc1OCCCNCF 34a_100000752037_100015361967 [2,0,0,0,0,0|1,0,0]=3 565 B15R1.1045 COc1ccccc1OCCCSCF 62a_100011259231_100015361967 [2,0,0,0,0,0|2,0,0]=4 566 B15R1.1045 COc1ccccc1OCCCSCF 62a_100015361967_100011259231 [2,0,0,0,0,0|2,0,0]=4 567 B15R1.5919 CC(=O)NCC(O)COc1ccccc1 240690a_100000738913_100015343762 [2,0,0,0,0,0|1,0,1]=4 568 B15R1.5919 CC(=O)NCC(O)COc1ccccc1 527a_100000738913_100103153847 [2,0,0,0,0,0|1,0,1]=4 569 B15R1.5919 CC(C)NCC(O)COc1ccccc1 2230a_100000738913_100000210206 [2,0,0,0,0,0|0,0,0]=2 570 B15R1.5919 CC(C)NCC(O)COc1ccccc1 34a_100000738913_100000210206 [2,0,0,0,0,0|0,0,0]=2 571 B15R1.768 CCCC(=O)COc1ccccc1OC 1458a_100000182946_100000210303 [2,0,0,0,0,0|0,0,2]=4 572 B15R1.768 CCCC(C)CNc1ccccc1OC 34a_100000210025_100011216630 [2,0,0,0,0,0|2,0,0]=4 573 B15R1.768 CCCC(C)COc1ccccc1CC 34a_100000210936_100011216630 [2,0,0,0,0,0|2,0,0]=4 574 B15R1.768 CCCC(C)COc1ccccc1CC 7a_100000210936_100011216630 [2,0,0,0,0,0|2,0,0]=4 575 B15R1.768 CCCC(C)COc1ccccc1NC 34a_100000033821_100011216630 [2,0,0,0,0,0|2,0,0]=4 576 B15R1.768 CCCC(C)COc1ccccc1OC 34a_100000210385_100011216630 [2,0,0,0,0,0|1,0,0]=3 577 B15R1.768 CCCC(C)COc1ccccc1SC 34a_100011216402_100011216630 [2,0,0,0,0,0|1,1,0]=4 578 B15R1.768 CCCC(C)COc1cccnc1OC 34a_100000698397_100011216630 [2,0,0,0,0,0|2,0,0]=4 579 B15R1.768 CCCC(C)COc1cccnc1OC 7a_100000698397_100011216630 [2,0,0,0,0,0|2,0,0]=4 580 B15R1.768 CCCC(C)COc1cnccc1OC 34a_100000101186_100011216630 [2,0,0,0,0,0|2,0,0]=4 581 B15R1.768 CCCC(C)COc1ncccc1OC 34a_100025773188_100011216630 [2,0,0,0,0,0|2,0,0]=4 582 B15R1.768 CCCC(C)CSc1ccccc1OC 62a_100000210334_100011216630 [2,0,0,0,0,0|1,1,0]=4 583 B15R1.768 CCCC(C)CSc1ccccc1OC 62a_100011216630_100000210334 [2,0,0,0,0,0|1,1,0]=4 584 B15R1.768 CCNC(=O)COc1ccccc1OC 11a_100015525214_100000182946 [2,0,0,0,0,0|0,0,2]=4 585 B15R1.768 CCNC(=O)COc1ccccc1OC 240690a_100015525214_100000182946 [2,0,0,0,0,0|0,0,2]=4 586 B15R1.768 CCNC(=O)COc1ccccc1OC 34a_100000210385_100000183381 [2,0,0,0,0,0|0,0,2]=4 587 B15R1.768 CCNC(=O)COc1ccccc1OC 527a_100015525214_100000182946 [2,0,0,0,0,0|0,0,2]=4 588 B15R1.768 CCNC(C)COc1ccccc1OC 2230a_100000743626_100000210202 [2,0,0,0,0,0|1,0,0]=3 589 B15R1.768 CCOC(C)COc1ccccc1OC 34a_100000242603_100000210202 [2,0,0,0,0,0|2,0,0]=4 590 B15R1.768 CCOC(C)COc1ccccc1OC 7a_100000242603_100000210202 [2,0,0,0,0,0|2,0,0]=4 591 B15R1.768 CCc1ccccc1OCC(O)COC 34a_100000210936_100011215053 [2,0,0,0,0,0|2,0,0]=4 592 B15R1.768 CCc1ccccc1OCC(O)COC 7a_100000210936_100011215053 [2,0,0,0,0,0|2,0,0]=4 593 B15R1.768 CNc1ccccc1OCC(O)COC 34a_100000033821_100011215053 [2,0,0,0,0,0|2,0,0]=4 594 B15R1.768 COCC(O)CNc1ccccc1OC 34a_100000210025_100011215053 [2,0,0,0,0,0|2,0,0]=4 595 B15R1.768 COCC(O)COc1ccccc1OC 34a_100000210385_100011215053 [2,0,0,0,0,0|1,0,0]=3 596 B15R1.768 COCC(O)COc1ccccc1SC 34a_100011216402_100011215053 [2,0,0,0,0,0|1,1,0]=4 597 B15R1.768 COCC(O)COc1cccnc1OC 34a_100000698397_100011215053 [2,0,0,0,0,0|2,0,0]=4 598 B15R1.768 COCC(O)COc1cccnc1OC 7a_100000698397_100011215053 [2,0,0,0,0,0|2,0,0]=4 599 B15R1.768 COCC(O)COc1cnccc1OC 34a_100000101186_100011215053 [2,0,0,0,0,0|2,0,0]=4 600 B15R1.768 COCC(O)COc1ncccc1OC 34a_100025773188_100011215053 [2,0,0,0,0,0|2,0,0]=4 601 B15R1.768 COCC(O)CSc1ccccc1OC 62a_100000210334_100011215053 [2,0,0,0,0,0|1,1,0]=4 602 B15R1.768 COCC(O)CSc1ccccc1OC 62a_100011215053_100000210334 [2,0,0,0,0,0|1,1,0]=4 603 B17R1.747 C/C=C/c1ccccc1OCCCCC(C)C 34a_200000189419_100011216152 [1,1,0,0,0,0|2,0,0]=4 604 B17R1.747 C/C=C/c1ccccc1OCCCCC(C)C 7a_200000189419_100011216152 [1,1,0,0,0,0|2,0,0]=4 605 B17R1.747 CC(C)CCCCOc1ccccc1CCBr 34a_100000722297_100011216152 [1,1,0,0,0,0|2,0,0]=4 606 B17R1.747 CC(C)CCCCOc1ccccc1CCBr 7a_100000722297_100011216152 [1,1,0,0,0,0|2,0,0]=4 607 B17R1.747 CC(C)CCCCOc1ccccc1CCN 34a_100011207237_100011216152 [1,1,0,0,0,0|2,0,0]=4 608 B17R1.747 CC(C)CCCCOc1ccccc1CCO 34a_100000719421_100011216152 [1,1,0,0,0,0|2,0,0]=4 609 B17R1.747 CC(C)CCCCOc1ccccc1CCO 7a_100000719421_100011216152 [1,1,0,0,0,0|2,0,0]=4 610 B17R1.747 CCCc1ccccc1OCCCCC(C)C 34a_100011217252_100011216152 [1,1,0,0,0,0|2,0,0]=4 611 B17R1.747 CCCc1ccccc1OCCCCC(C)C 7a_100011217252_100011216152 [1,1,0,0,0,0|2,0,0]=4 612 B17R1.747 CCNc1ccccc1OCCCCC(C)C 34a_103624766699_100011216152 [1,1,0,0,0,0|2,0,0]=4 613 B17R1.747 CCNc1ccccc1OCCCCC(C)C 7a_103624766699_100011216152 [1,1,0,0,0,0|2,0,0]=4 614 B17R1.747 CCOc1ccccc1NCCCCC(C)C 34a_100000211218_100011216152 [1,1,0,0,0,0|2,0,0]=4 615 B17R1.747 CCOc1ccccc1OCCCCC(C)C 34a_100000211404_100011216152 [1,1,0,0,0,0|1,0,0]=3 616 B17R1.747 CCOc1ccccc1OCCCCC(C)C 7a_100000211404_100011216152 [1,1,0,0,0,0|1,0,0]=3 617 B17R1.747 CCOc1ccccc1OCCNCC(C)C 2230a_100000210953_100000764113 [1,1,0,0,0,0|2,0,0]=4 618 B17R1.747 CCOc1ccccc1OCCNCC(C)C 2230a_100011200955_100000210760 [1,1,0,0,0,0|2,0,0]=4 619 B17R1.747 CCOc1ccccc1OCCNCC(C)C 270004a_100011200955_100000210432 [1,1,0,0,0,0|2,0,0]=4 620 B17R1.747 CCOc1ccccc1OCCNCC(C)C 34a_100000210953_100000764113 [1,1,0,0,0,0|2,0,0]=4 621 B17R1.747 CCOc1ccccc1OCCOCC(C)C 34a_100000210257_100000764113 [1,1,0,0,0,0|2,0,0]=4 622 B17R1.747 CCOc1ccccc1OCCOCC(C)C 34a_100011305806_100000210624 [1,1,0,0,0,0|2,0,0]=4 623 B17R1.747 CCOc1ccccc1OCCOCC(C)C 7a_100011305806_100000210760 [1,1,0,0,0,0|2,0,0]=4 624 B17R1.747 CCOc1ccccc1OCCSCC(C)C 62a_100000210624_100000764113 [1,1,0,0,0,0|2,0,0]=4 625 B17R1.747 CCOc1ccccc1OCCSCC(C)C 62a_100000764113_100000210760 [1,1,0,0,0,0|2,0,0]=4 626 B17R1.747 CCOc1ncccc1OCCCCC(C)C 34a_100011998697_100011216152 [1,1,0,0,0,0|2,0,0]=4 627 B17R1.747 CNCc1ccccc1OCCCCC(C)C 34a_100015189988_100011216152 [1,1,0,0,0,0|2,0,0]=4 628 B17R1.747 COCc1ccccc1OCCCCC(C)C 34a_100011488565_100011216152 [1,1,0,0,0,0|1,0,0]=3 629 B17R1.747 COCc1ccccc1OCCCCC(C)C 7a_100011488565_100011216152 [1,1,0,0,0,0|1,0,0]=3 630 B17R1.747 COCc1ccccc1SCCCCC(C)C 62a_100011216152_100011493684 [1,1,0,0,0,0|1,1,0]=4 631 B17R1.747 COCc1ccccc1SCCCCC(C)C 62a_100011493684_100011216152 [1,1,0,0,0,0|1,1,0]=4 632 B17R1.1420 C#CC(C)NCCCOc1ccccc1OC 2230a_100000707721_100011259231 [1,1,0,0,0,0|0,0,1]=3 633 B17R1.1420 C#CC(C)NCCCOc1ccccc1OC 34a_100000707721_100011259231 [1,1,0,0,0,0|0,0,1]=3 634 B17R1.1420 C#CC(C)NCCCOc1ccccc1OC 34a_100000752037_200000035995 [1,1,0,0,0,0|0,0,1]=3 635 B17R1.1420 C#CC(C)SCCCOc1ccccc1OC 62a_200000035995_100011259231 [1,1,0,0,0,0|1,0,1]=4 636 B17R1.1420 C#C[C@@H](C)OCCCOc1ccccc1OC 34a_100009815206_100011259231 [1,1,0,0,0,0|1,0,1]=4 637 B17R1.1420 C#C[C@@H](C)OCCCOc1ccccc1OC 7a_100009815206_100011259231 [1,1,0,0,0,0|1,0,1]=4 638 B17R1.1420 C=CC(C)OCCCOc1ccccc1OC 34a_100000695699_100011259231 [1,1,0,0,0,0|1,0,1]=4 639 B17R1.1420 C=CC(C)SCCCOc1ccccc1OC 62a_100011215867_100011259231 [1,1,0,0,0,0|1,0,1]=4 640 B17R1.1420 CC(CO)NCCCOc1ccccc1C#N 2230a_100011220211_100012180447 [1,1,0,0,0,0|2,0,0]=4 641 B17R1.1420 CC(CO)NCCCOc1ccccc1C#N 34a_100011220211_100012180447 [1,1,0,0,0,0|2,0,0]=4 642 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 11a_100000752037_100000210414 [1,1,0,0,0,0|1,0,1]=4 643 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 1626a_100000752037_100000210414 [1,1,0,0,0,0|1,0,1]=4 644 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 240690a_100000752037_100000210414 [1,1,0,0,0,0|1,0,1]=4 645 B17R1.1420 CCC(=O)NCCCOc1ccccc1OC 527a_100000752037_100000210414 [1,1,0,0,0,0|1,0,1]=4 646 B17R1.1420 CCC(C)CNCCOc1ccccc1OC 2230a_100000683763_100000748023 [1,1,0,0,0,0|2,0,0]=4 647 B17R1.1420 CCC(C)CNCCOc1ccccc1OC 2230a_100020588543_100000188471 [1,1,0,0,0,0|2,0,0]=4 648 B17R1.1420 CCC(C)CNCCOc1ccccc1OC 270004a_100000683763_100000243153 [1,1,0,0,0,0|2,0,0]=4 649 B17R1.1420 CCC(C)CNCCOc1ccccc1OC 34a_100000683763_100000748023 [1,1,0,0,0,0|2,0,0]=4 650 B17R1.1420 CCC(C)CSCCOc1ccccc1OC 62a_100000188471_100000748023 [1,1,0,0,0,0|2,0,0]=4 651 B17R1.1420 CCC(C)CSCCOc1ccccc1OC 62a_100000748023_100000188471 [1,1,0,0,0,0|2,0,0]=4 652 B17R1.1420 CCC(C)NCCCOc1ccccc1C#N 2230a_100011220211_100000758301 [1,1,0,0,0,0|2,0,0]=4 653 B17R1.1420 CCC(C)NCCCOc1ccccc1C#N 34a_100011220211_100011215416 [1,1,0,0,0,0|2,0,0]=4 654 B17R1.1420 CCC(C)NCCCOc1ccccc1OC 2230a_100000209981_100011259231 [1,1,0,0,0,0|0,0,0]=2 655 B17R1.1420 CCC(C)NCCCOc1ccccc1OC 34a_100000752037_100011215416 [1,1,0,0,0,0|0,0,0]=2 656 B17R1.1420 CCC(C)OCCCOc1ccccc1OC 7a_100000210228_100011259231 [1,1,0,0,0,0|1,0,0]=3 657 B17R1.1420 CCC(C)SCCCOc1ccccc1OC 62a_100000758301_100011259231 [1,1,0,0,0,0|1,0,0]=3 658 B17R1.1420 CCC(C)SCCCOc1ccccc1OC 62a_100011259231_100000758301 [1,1,0,0,0,0|1,0,0]=3 659 B17R1.1420 CCN(C)CCCCOc1ccccc1OC 2230a_100000225621_200011219331 [1,1,0,0,0,0|2,0,0]=4 660 B17R1.1420 CCN(C)CCCCOc1ccccc1OC 269982a_100000225621_200011219331 [1,1,0,0,0,0|2,0,0]=4 661 B17R1.1420 CC[C@H](C)CNCCOc1ccccc1OC 2230a_100000683763_100009816398 [1,1,0,0,0,0|2,0,0]=4 662 B17R1.1420 CC[C@H](C)CNCCOc1ccccc1OC 34a_100000683763_100009816398 [1,1,0,0,0,0|2,0,0]=4 663 B17R1.1420 CC[C@H](C)COCCOc1ccccc1OC 7a_100009816381_100000188471 [1,1,0,0,0,0|2,0,0]=4 664 B17R1.1420 CC[C@H](C)CSCCOc1ccccc1OC 62a_100000188471_100009816398 [1,1,0,0,0,0|2,0,0]=4 665 B17R1.1420 CC[C@H](C)CSCCOc1ccccc1OC 62a_100009816398_100000188471 [1,1,0,0,0,0|2,0,0]=4 666 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 2708a_100000752037_106832991635 [1,1,0,0,0,0|1,0,1]=4 667 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 2708a_100102657272_100000752037 [1,1,0,0,0,0|1,0,1]=4 668 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 273464a_100000752037_100102657272 [1,1,0,0,0,0|1,0,1]=4 669 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 273464a_100102657272_100000752037 [1,1,0,0,0,0|1,0,1]=4 670 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 512a_100000752037_100102657272 [1,1,0,0,0,0|1,0,1]=4 671 B17R1.1420 CNC(=O)NCCCOc1ccccc1OC 512a_106832991638_100000752037 [1,1,0,0,0,0|1,0,1]=4 672 B17R1.1420 COc1ccccc1OCCCNC(=O)CO 240690a_100000752037_100000210174 [1,1,0,0,0,0|1,0,1]=4 673 B17R1.1420 COc1ccccc1OCCCNC(=O)CO 527a_100000752037_100000210174 [1,1,0,0,0,0|1,0,1]=4 674 B17R1.1420 COc1ccccc1OCCCNC(C)C#N 2230a_100000737613_100011259231 [1,1,0,0,0,0|0,0,1]=3 675 B17R1.1420 COc1ccccc1OCCCNC(C)CO 34a_100000752037_100012180447 [1,1,0,0,0,0|0,0,0]=2 676 B17R1.1420 COc1ccccc1OCCCN[C@H](C)CO 2230a_100000737577_100011259231 [1,1,0,0,0,0|0,0,0]=2 677 B17R1.1420 COc1ccccc1OCCCOC(C)C#N 34a_100011218135_100011259231 [1,1,0,0,0,0|1,0,1]=4 678 B17R1.1420 COc1ccccc1OCCCOC(C)CF 34a_100016041109_100011259231 [1,1,0,0,0,0|1,0,0]=3 679 B17R1.1420 COc1ccccc1OCCCOC(C)CF 7a_100016041109_100011259231 [1,1,0,0,0,0|1,0,0]=3 680 B17R1.1420 COc1ccccc1OCCCOC(C)CN 34a_100000210904_100011259231 [1,1,0,0,0,0|1,0,0]=3 681 B17R1.1420 COc1ccccc1OCCCSC(C)C#N 62a_100000703298_100011259231 [1,1,0,0,0,0|1,0,1]=4 682 B17R1.1420 COc1ccccc1OCCCSC(C)C#N 62a_100011259231_100000703298 [1,1,0,0,0,0|1,0,1]=4 683 B17R1.1420 COc1ccccc1OCCCSC(C)CO 62a_100012180447_100011259231 [1,1,0,0,0,0|1,0,0]=3 684 B17R1.1420 COc1ccccc1OCCCSC(C)OC 62a_100009879195_100011259231 [1,1,0,0,0,0|1,0,0]=3 685 B17R1.1420 COc1ccccc1OCCCSC(C)OC 62a_100011259231_100009879195 [1,1,0,0,0,0|1,0,0]=3 686 B17R1.1420 COc1ccccc1OCCCS[C@H](C)CO 62a_100011259231_100016084084 [1,1,0,0,0,0|1,0,0]=3 687 B17R1.1420 COc1ccccc1OCCCS[C@H](C)CO 62a_100016084084_100011259231 [1,1,0,0,0,0|1,0,0]=3 688 B17R1.1420 COc1ccccc1OCCNCC(C)CO 34a_100000744482_100000188471 [1,1,0,0,0,0|2,0,0]=4 689 B17R1.1420 COc1ccccc1OCCNC[C@@H](C)CO 2230a_100000683763_100000059175 [1,1,0,0,0,0|2,0,0]=4 690 B17R1.1420 COc1ccccc1OCCNC[C@@H](C)CO 34a_100000683763_100000059175 [1,1,0,0,0,0|2,0,0]=4 691 B17R1.1420 COc1ccccc1OCCNC[C@@H](C)OC 2230a_100020591295_100000188471 [1,1,0,0,0,0|2,0,0]=4 692 B17R1.1420 COc1ccccc1OCCOCC(C)CN 34a_100000744482_100000188471 [1,1,0,0,0,0|2,0,0]=4 693 B17R1.1420 COc1ccccc1OCCOCC(C)OC 34a_100000690652_100000188471 [1,1,0,0,0,0|2,0,0]=4 694 B17R1.1420 COc1ccccc1OCCSC[C@@H](C)CO 62a_100000059175_100000188471 [1,1,0,0,0,0|2,0,0]=4 695 B17R1.1420 COc1ccccc1OCCSC[C@@H](C)CO 62a_100000188471_100000059175 [1,1,0,0,0,0|2,0,0]=4 696 B17R1.1422 COc1ccccc1CNCCN(C)C(C)C 207a_100000749581_100000169842 [1,1,0,0,0,0|2,0,0]=4 697 B17R1.1422 COc1ccccc1CNCCN(C)C(C)C 270004a_100000749581_100000169842 [1,1,0,0,0,0|2,0,0]=4 698 B17R1.1422 COc1ccccc1OCCCC(=O)C(C)C 1458a_100000210198_100011259231 [1,1,0,0,0,0|1,0,0]=3 699 B17R1.1422 COc1ccccc1OCCCC(=O)C(C)F 1458a_100000062450_100011259231 [1,1,0,0,0,0|2,0,0]=4 700 B17R1.1422 COc1ccccc1OCCCC(=O)[C@@H](C)O 1458a_100000717761_100011259231 [1,1,0,0,0,0|2,0,0]=4 701 B17R1.1422 COc1ccccc1OCCCC(=O)[C@H](C)O 1458a_217856618621_100011259231 [1,1,0,0,0,0|2,0,0]=4 702 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 11a_100000752054_100015343762 [1,1,0,0,0,0|1,0,1]=4 703 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 1626a_100000752054_100015343762 [1,1,0,0,0,0|1,0,1]=4 704 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 240690a_100000752054_100015343762 [1,1,0,0,0,0|1,0,1]=4 705 B17R1.1422 COc1ccccc1OCCCN(C)C(=O)C 527a_100000752054_100103153847 [1,1,0,0,0,0|1,0,1]=4 706 B17R1.1422 COc1ccccc1OCCCN(C)C(C)C 2230a_100000752054_100000210206 [1,1,0,0,0,0|0,0,0]=2 707 B17R1.1422 COc1ccccc1OCCCN(C)C(C)C 269982a_100000752054_100000210206 [1,1,0,0,0,0|0,0,0]=2 708 B17R1.1422 COc1ccccc1OCCCN(C)C(C)C 269982a_200000211004_100011259231 [1,1,0,0,0,0|0,0,0]=2 709 B17R1.1422 COc1ccccc1OCCNC(=O)C(C)C 11a_100000683763_100000210198 [1,1,0,0,0,0|2,0,0]=4 710 B17R1.1422 COc1ccccc1OCCNC(=O)C(C)C 1626a_100000683763_100000210198 [1,1,0,0,0,0|2,0,0]=4 711 B17R1.1422 COc1ccccc1OCCNC(=O)C(C)C 240690a_100000683763_100000210198 [1,1,0,0,0,0|2,0,0]=4 712 B17R1.1422 COc1ccccc1OCCNC(=O)C(C)C 527a_100000683763_100000210198 [1,1,0,0,0,0|2,0,0]=4 713 B17R1.1422 COc1ccccc1OCCNC(C)C(C)C 2230a_100000211541_100000188471 [1,1,0,0,0,0|2,0,0]=4 714 B17R1.1422 COc1ccccc1OCCOC(C)C(C)C 7a_100000748068_100000188471 [1,1,0,0,0,0|2,0,0]=4 715 B17R1.4171 CCc1ccccc1OCCC(=O)NC(C)C 7a_100000210936_100000737564 [1,1,0,0,0,0|1,0,1]=4 716 B17R1.4171 COc1ccccc1OCCC(=O)CC(C)C 1458a_100000182669_100000210624 [1,1,0,0,0,0|1,0,1]=4 717 B17R1.4171 COc1ccccc1OCCC(=O)CC(C)C 1458a_100000210554_100000188471 [1,1,0,0,0,0|1,0,1]=4 718 B17R1.4171 COc1ccccc1OCCC(=O)NC(C)C 11a_100138425928_100000182669 [1,1,0,0,0,0|0,0,1]=3 719 B17R1.4171 COc1ccccc1OCCC(=O)NC(C)C 240690a_100138425928_100000182669 [1,1,0,0,0,0|0,0,1]=3 720 B17R1.4171 COc1ccccc1OCCN(C)CC(C)C 2230a_100000228778_100000210760 [1,1,0,0,0,0|2,0,0]=4 721 B17R1.4171 COc1ccccc1OCCN(C)CC(C)C 2230a_100000747067_100000188471 [1,1,0,0,0,0|2,0,0]=4 722 B17R1.4171 COc1ccccc1OCCN(C)CC(C)C 269982a_100000228778_100000210624 [1,1,0,0,0,0|2,0,0]=4 723 B17R1.4171 COc1ccccc1OCCN(C)CC(C)C 269982a_100000747067_100000188471 [1,1,0,0,0,0|2,0,0]=4 724 B17R1.4171 COc1ccccc1OCCN(C)CC(C)C 270004a_100000228778_100000210432 [1,1,0,0,0,0|2,0,0]=4 725 B17R1.4171 COc1ccccc1SCCC(=O)NC(C)C 62a_100000210334_100000737564 [1,1,0,0,0,0|0,1,1]=4 726 B17R1.4171 COc1ccccc1SCCC(=O)NC(C)C 62a_100000737564_100000210334 [1,1,0,0,0,0|0,1,1]=4 727 B17R1.4171 COc1ncccc1OCCC(=O)NC(C)C 7a_100000698397_100000737564 [1,1,0,0,0,0|1,0,1]=4 728 B17R1.4712 COc1ccc(cc1COCCNC(C)C)Br 34a_100000224655_100000204665 [1,1,0,0,0,0|2,0,0]=4 729 B17R1.4712 COc1ccc(cc1COCCNC(C)C)C 34a_100000224655_100000199068 [1,1,0,0,0,0|2,0,0]=4 730 B17R1.4712 COc1ccc(cc1COCCNC(C)C)Cl 34a_100000224655_100000209806 [1,1,0,0,0,0|2,0,0]=4 731 B17R1.4712 COc1ccc(cc1COCCNC(C)C)F 34a_100000224655_100011830354 [1,1,0,0,0,0|2,0,0]=4 732 B17R1.4712 COc1ccc(cc1NCCCCC(C)C)Br 34a_100000743470_100011216152 [1,1,0,0,0,0|2,0,0]=4 733 B17R1.4712 COc1ccc(cc1NCCCCC(C)C)C 2230a_100000210980_100011216152 [1,1,0,0,0,0|2,0,0]=4 734 B17R1.4712 COc1ccc(cc1NCCCCC(C)C)C 34a_100000210980_100011216152 [1,1,0,0,0,0|2,0,0]=4 735 B17R1.4712 COc1ccc(cc1NCCCCC(C)C)Cl 34a_100000182114_100011216152 [1,1,0,0,0,0|2,0,0]=4 736 B17R1.4712 COc1ccc(cc1NCCCCC(C)C)F 34a_100000757179_100011216152 [1,1,0,0,0,0|2,0,0]=4 737 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)Br 34a_100009816560_100011216152 [1,1,0,0,0,0|1,0,0]=3 738 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)Br 7a_100009816560_100011216152 [1,1,0,0,0,0|1,0,0]=3 739 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)C 34a_100011216497_100011216152 [1,1,0,0,0,0|1,0,0]=3 740 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)C 7a_100011216497_100011216152 [1,1,0,0,0,0|1,0,0]=3 741 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)Cl 34a_100000101779_100011216152 [1,1,0,0,0,0|1,0,0]=3 742 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)Cl 7a_100000101779_100011216152 [1,1,0,0,0,0|1,0,0]=3 743 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)F 34a_100000034962_100011216152 [1,1,0,0,0,0|1,0,0]=3 744 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)F 7a_100000034962_100011216152 [1,1,0,0,0,0|1,0,0]=3 745 B17R1.4712 COc1ccc(cc1OCCCCC(C)C)N 34a_100000211920_100011216152 [1,1,0,0,0,0|1,0,0]=3 746 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)C 62a_100000186399_100011216152 [1,1,0,0,0,0|1,1,0]=4 747 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)C 62a_100011216152_100000186399 [1,1,0,0,0,0|1,1,0]=4 748 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)F 62a_100000171694_100011216152 [1,1,0,0,0,0|1,1,0]=4 749 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)F 62a_100011216152_100000171694 [1,1,0,0,0,0|1,1,0]=4 750 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)N 62a_100011216152_100011356947 [1,1,0,0,0,0|1,1,0]=4 751 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)N 62a_100011356947_100011216152 [1,1,0,0,0,0|1,1,0]=4 752 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)O 62a_100010234764_100011216152 [1,1,0,0,0,0|1,1,0]=4 753 B17R1.4712 COc1ccc(cc1SCCCCC(C)C)O 62a_100011216152_100010234764 [1,1,0,0,0,0|1,1,0]=4 754 B17R1.4712 COc1cnc(cc1OCCCCC(C)C)Br 34a_100010264082_100011216152 [1,1,0,0,0,0|2,0,0]=4 755 B17R1.4712 COc1cnc(cc1OCCCCC(C)C)Cl 34a_100009849459_100011216152 [1,1,0,0,0,0|2,0,0]=4 756 B17R1.4712 COc1ncc(cc1OCCCCC(C)C)Br 34a_100010135713_100011216152 [1,1,0,0,0,0|2,0,0]=4 757 B17R1.5310 CCc1cc(ccc1OCCCCC(C)C)C 34a_100009844793_100011216152 [1,1,0,0,0,0|2,0,0]=4 758 B17R1.5310 CCc1cc(ccc1OCCCCC(C)C)C 7a_100009844793_100011216152 [1,1,0,0,0,0|2,0,0]=4 759 B17R1.5310 CCc1cc(ccc1OCCCCC(C)C)F 34a_200000035566_100011216152 [1,1,0,0,0,0|2,0,0]=4 760 B17R1.5310 CCc1cc(ccc1OCCCCC(C)C)F 7a_200000035566_100011216152 [1,1,0,0,0,0|2,0,0]=4 761 B17R1.5310 COc1cc(ccc1COCCNC(C)C)Br 34a_100000224655_100012359436 [1,1,0,0,0,0|2,0,0]=4 762 B17R1.5310 COc1cc(ccc1COCCNC(C)C)F 34a_100000224655_200010171551 [1,1,0,0,0,0|2,0,0]=4 763 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)Br 34a_100011279103_100011216152 [1,1,0,0,0,0|2,0,0]=4 764 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)C 2230a_100000746441_100011216152 [1,1,0,0,0,0|2,0,0]=4 765 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)C 34a_100000746441_100011216152 [1,1,0,0,0,0|2,0,0]=4 766 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)Cl 34a_100000707585_100011216152 [1,1,0,0,0,0|2,0,0]=4 767 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)F 34a_100000737216_100011216152 [1,1,0,0,0,0|2,0,0]=4 768 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)I 34a_100015196925_100011216152 [1,1,0,0,0,0|2,0,0]=4 769 B17R1.5310 COc1cc(ccc1NCCCCC(C)C)O 34a_100015326901_100011216152 [1,1,0,0,0,0|2,0,0]=4 770 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)Br 34a_100000694246_100011216152 [1,1,0,0,0,0|1,0,0]=3 771 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)Br 7a_100000694246_100011216152 [1,1,0,0,0,0|1,0,0]=3 772 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)C 34a_100000186466_100011216152 [1,1,0,0,0,0|1,0,0]=3 773 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)Cl 34a_100000033002_100011216152 [1,1,0,0,0,0|1,0,0]=3 774 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)F 34a_100000036057_100011216152 [1,1,0,0,0,0|1,0,0]=3 775 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)F 7a_100000036057_100011216152 [1,1,0,0,0,0|1,0,0]=3 776 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)I 34a_100000049635_100011216152 [1,1,0,0,0,0|1,0,0]=3 777 B17R1.5310 COc1cc(ccc1OCCCCC(C)C)N 34a_100000726020_100011216152 [1,1,0,0,0,0|1,0,0]=3 778 B17R1.5310 COc1cc(ccc1OCCNCC(C)C)C 2230a_100000210953_100011259456 [1,1,0,0,0,0|2,0,0]=4 779 B17R1.5310 COc1cc(ccc1OCCNCC(C)C)C 34a_100000210953_100011259456 [1,1,0,0,0,0|2,0,0]=4 780 B17R1.5310 COc1cc(ccc1OCCOCC(C)C)Br 34a_100012347953_100000210624 [1,1,0,0,0,0|2,0,0]=4 781 B17R1.5310 COc1cc(ccc1OCCOCC(C)C)Br 7a_100012347953_100000210760 [1,1,0,0,0,0|2,0,0]=4 782 B17R1.5310 COc1cc(ccc1OCCOCC(C)C)C 34a_100000210257_100011259456 [1,1,0,0,0,0|2,0,0]=4 783 B17R1.5310 COc1cc(ccc1OCCSCC(C)C)C 62a_100000210624_100011259456 [1,1,0,0,0,0|2,0,0]=4 784 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)C 62a_100010200004_100011216152 [1,1,0,0,0,0|1,1,0]=4 785 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)C 62a_100011216152_100010200004 [1,1,0,0,0,0|1,1,0]=4 786 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)F 62a_100000757151_100011216152 [1,1,0,0,0,0|1,1,0]=4 787 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)F 62a_100011216152_100000757151 [1,1,0,0,0,0|1,1,0]=4 788 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)N 62a_100000765947_100011216152 [1,1,0,0,0,0|1,1,0]=4 789 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)N 62a_100011216152_100000765947 [1,1,0,0,0,0|1,1,0]=4 790 B17R1.5310 COc1cc(ccc1SCCCCC(C)C)O 62a_100011216152_100011827694 [1,1,0,0,0,0|1,1,0]=4 791 B17R1.5310 COc1cc(cnc1OCCCCC(C)C)Cl 34a_200009845368_100011216152 [1,1,0,0,0,0|2,0,0]=4 792 B17R1.5310 COc1nc(ccc1OCCCCC(C)C)Br 34a_100010893133_100011216152 [1,1,0,0,0,0|2,0,0]=4 793 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 2230a_100015185781_100000210206 [1,1,0,0,0,0|1,0,1]=4 794 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 2230a_100138425928_100000242059 [1,1,0,0,0,0|1,0,1]=4 795 B17R1.6551 COc1ccccc1NC(=O)CCNC(C)C 34a_100015185781_100000210206 [1,1,0,0,0,0|1,0,1]=4 796 B17R1.7390 COc1c(cccc1COCCNC(C)C)Br 34a_100000224655_100011470457 [1,1,0,0,0,0|2,0,0]=4 797 B17R1.7390 COc1c(cccc1COCCNC(C)C)C 34a_100000224655_100012349798 [1,1,0,0,0,0|2,0,0]=4 798 B17R1.7390 COc1c(cccc1NCCCCC(C)C)Br 34a_100011935253_100011216152 [1,1,0,0,0,0|2,0,0]=4 799 B17R1.7390 COc1c(cccc1NCCCCC(C)C)C 34a_100012017360_100011216152 [1,1,0,0,0,0|2,0,0]=4 800 B17R1.7390 COc1c(cccc1NCCCCC(C)C)Cl 2230a_100000743799_100011216152 [1,1,0,0,0,0|2,0,0]=4 801 B17R1.7390 COc1c(cccc1NCCCCC(C)C)Cl 34a_100000743799_100011216152 [1,1,0,0,0,0|2,0,0]=4 802 B17R1.7390 COc1c(cccc1NCCCCC(C)C)F 34a_100011215007_100011216152 [1,1,0,0,0,0|2,0,0]=4 803 B17R1.7390 COc1c(cccc1OCCCCC(C)C)Br 34a_100010234590_100011216152 [1,1,0,0,0,0|1,0,0]=3 804 B17R1.7390 COc1c(cccc1OCCCCC(C)C)Cl 34a_200009886253_100011216152 [1,1,0,0,0,0|1,0,0]=3 805 B17R1.7390 COc1c(cccc1OCCCCC(C)C)Cl 7a_200009886253_100011216152 [1,1,0,0,0,0|1,0,0]=3 806 B17R1.7390 COc1c(cccc1SCCCCC(C)C)C 62a_100010141385_100011216152 [1,1,0,0,0,0|1,1,0]=4 807 B17R1.7390 COc1c(cccc1SCCCCC(C)C)C 62a_100011216152_100010141385 [1,1,0,0,0,0|1,1,0]=4 808 B17R1.7390 COc1c(cccc1SCCCCC(C)C)F 62a_100009816759_100011216152 [1,1,0,0,0,0|1,1,0]=4 809 B17R1.7390 COc1c(cccc1SCCCCC(C)C)F 62a_100011216152_100009816759 [1,1,0,0,0,0|1,1,0]=4 810 B17R1.7390 COc1c(cccc1SCCCCC(C)C)N 62a_100011935253_100011216152 [1,1,0,0,0,0|1,1,0]=4 811 B17R1.7390 COc1c(cccc1SCCCCC(C)C)O 62a_100011216152_100010234590 [1,1,0,0,0,0|1,1,0]=4 812 B17R1.7390 COc1c(ccnc1Cl)OCCCCC(C)C 34a_100000104430_100011216152 [1,1,0,0,0,0|2,0,0]=4 813 B17R1.7390 CSc1c(cccc1OCCCCC(C)C)C 34a_200000099257_100011216152 [1,1,0,0,0,0|1,1,0]=4 814 B17R1.7390 CSc1c(cccc1OCCCCC(C)C)C 7a_200000099257_100011216152 [1,1,0,0,0,0|1,1,0]=4 815 B17R1.16398 CC(C)CCCCOc1ccccc1C(C)O 34a_200011232679_100011216152 [1,1,0,0,0,0|2,0,0]=4 816 B17R1.16398 CC(C)CCCCOc1ccccc1C(C)O 7a_200011232679_100011216152 [1,1,0,0,0,0|2,0,0]=4 817 B17R1.16398 CC(C)CCCCOc1ccccc1[C@@H](C)N 34a_100025703389_100011216152 [1,1,0,0,0,0|2,0,0]=4 818 B17R1.16398 CC(C)NCCCOc1ccccc1[N+](=O)[O-] 2230a_106726388176_100000210206 [1,1,0,0,0,0|2,0,0]=4 819 B17R1.27006 CC(C)(C)NCCCOc1ccccc1C#N 34a_100011220211_100000210625 [1,1,0,0,0,0|2,0,0]=4 820 B17R1.27006 COc1ccccc1OCCCNC(C)(C)C 2230a_100000715429_100011259231 [1,1,0,0,0,0|0,0,0]=2 821 B17R1.27006 COc1ccccc1OCCCNC(C)(C)C 34a_100000752037_100000210625 [1,1,0,0,0,0|0,0,0]=2 822 B17R1.27006 COc1ccccc1OCCCNC(F)(F)F 34a_100000752037_200103152311 [1,1,0,0,0,0|2,0,0]=4 823 B17R1.27006 COc1ccccc1OCCCNS(=O)(=O)C 40a_100000752037_100000738038 [1,1,0,0,0,0|2,0,0]=4 824 B17R1.27006 COc1ccccc1OCCCOC(C)(C)C 34a_100015890283_100011259231 [1,1,0,0,0,0|1,0,0]=3 825 B17R1.27006 COc1ccccc1OCCCOC(C)(C)C 7a_100015890283_100011259231 [1,1,0,0,0,0|1,0,0]=3 826 B17R1.27006 COc1ccccc1OCCCSC(C)(C)C 62a_100000211941_100011259231 [1,1,0,0,0,0|1,0,0]=3 827 B17R1.27006 COc1ccccc1OCCCSC(C)(C)C 62a_100011259231_100000211941 [1,1,0,0,0,0|1,0,0]=3 828 B17R1.27006 COc1ccccc1OCCNCC(C)(C)C 2230a_100000743828_100000188471 [1,1,0,0,0,0|2,0,0]=4 829 B17R1.27006 COc1ccccc1OCCNCC(C)(C)C 270004a_100000683763_100011204126 [1,1,0,0,0,0|2,0,0]=4 830 B17R1.27006 COc1ccccc1OCCNCC(C)(C)C 34a_100000683763_100011219605 [1,1,0,0,0,0|2,0,0]=4 831 B17R1.27006 COc1ccccc1OCCNCC(C)(C)F 2230a_100020643315_100000188471 [1,1,0,0,0,0|2,0,0]=4 832 B17R1.27006 COc1ccccc1OCCNCC(C)(C)F 34a_100000683763_100011997219 [1,1,0,0,0,0|2,0,0]=4 833 B17R1.27006 COc1ccccc1OCCNCC(C)(C)O 2230a_100000751335_100000188471 [1,1,0,0,0,0|2,0,0]=4 834 B17R1.27006 COc1ccccc1OCCNCC(C)(C)O 34a_100000683763_100000764493 [1,1,0,0,0,0|2,0,0]=4 835 B17R1.27006 COc1ccccc1OCCOCC(C)(C)F 34a_100000716592_100000188471 [1,1,0,0,0,0|2,0,0]=4 836 B17R1.27006 COc1ccccc1OCCSCC(C)(C)C 62a_100000188471_100011219605 [1,1,0,0,0,0|2,0,0]=4 837 B17R1.27006 COc1ccccc1OCCSCC(C)(C)C 62a_100011219605_100000188471 [1,1,0,0,0,0|2,0,0]=4 838 B17R1.27006 COc1ccccc1OCCSCC(C)(C)F 62a_100000188471_100011997219 [1,1,0,0,0,0|2,0,0]=4 839 B17R1.27006 COc1ccccc1OCCSCC(C)(C)F 62a_100011997219_100000188471 [1,1,0,0,0,0|2,0,0]=4 840 B17R1.27006 COc1ccccc1OCCSCC(C)(C)O 62a_100000188471_100000764493 [1,1,0,0,0,0|2,0,0]=4 841 B17R1.27006 COc1ccccc1OCCSCC(C)(C)O 62a_100000764493_100000188471 [1,1,0,0,0,0|2,0,0]=4 842 B17R1.27037 COc1ccccc1C(=O)CCCCC(C)C 1458a_100000185835_100011216152 [1,1,0,0,0,0|2,0,0]=4 843 B17R1.27037 COc1ccccc1N(C)CCCCC(C)C 2230a_100000219746_100011216152 [1,1,0,0,0,0|2,0,0]=4 844 B17R1.27037 COc1ccccc1N(C)CCCCC(C)C 269982a_100000219746_100011216152 [1,1,0,0,0,0|2,0,0]=4 845 B17R1.27037 COc1ccccc1N(C)CCCCC(C)C 34a_100000219746_100011216152 [1,1,0,0,0,0|2,0,0]=4 846 B17R1.28458 CCc1cccc(c1OCCCCC(C)C)C 34a_100000034007_100011216152 [1,1,0,0,0,0|2,0,0]=4 847 B17R1.28458 CCc1cccc(c1OCCCCC(C)C)C 7a_100000034007_100011216152 [1,1,0,0,0,0|2,0,0]=4 848 B17R1.28458 COc1cccc(c1COCCNC(C)C)Cl 34a_100000224655_100012349678 [1,1,0,0,0,0|2,0,0]=4 849 B17R1.28458 COc1cccc(c1COCCNC(C)C)F 34a_100000224655_100011216731 [1,1,0,0,0,0|2,0,0]=4 850 B17R1.28458 COc1cccc(c1NCCCCC(C)C)Br 34a_100000708083_100011216152 [1,1,0,0,0,0|2,0,0]=4 851 B17R1.28458 COc1cccc(c1NCCCCC(C)C)C 2230a_100000758225_100011216152 [1,1,0,0,0,0|2,0,0]=4 852 B17R1.28458 COc1cccc(c1NCCCCC(C)C)C 34a_100000758225_100011216152 [1,1,0,0,0,0|2,0,0]=4 853 B17R1.28458 COc1cccc(c1NCCCCC(C)C)Cl 34a_100011309317_100011216152 [1,1,0,0,0,0|2,0,0]=4 854 B17R1.28458 COc1cccc(c1NCCCCC(C)C)F 34a_100000686744_100011216152 [1,1,0,0,0,0|2,0,0]=4 855 B17R1.28458 COc1cccc(c1NCCCCC(C)C)O 34a_100012022766_100011216152 [1,1,0,0,0,0|2,0,0]=4 856 B17R1.28458 COc1cccc(c1OCCCCC(C)C)Br 34a_100000686866_100011216152 [1,1,0,0,0,0|1,0,0]=3 857 B17R1.28458 COc1cccc(c1OCCCCC(C)C)C 34a_100011219253_100011216152 [1,1,0,0,0,0|1,0,0]=3 858 B17R1.28458 COc1cccc(c1OCCCCC(C)C)C 7a_100011219253_100011216152 [1,1,0,0,0,0|1,0,0]=3 859 B17R1.28458 COc1cccc(c1OCCCCC(C)C)Cl 34a_100009851661_100011216152 [1,1,0,0,0,0|1,0,0]=3 860 B17R1.28458 COc1cccc(c1OCCCCC(C)C)Cl 7a_100009851661_100011216152 [1,1,0,0,0,0|1,0,0]=3 861 B17R1.28458 COc1cccc(c1OCCCCC(C)C)F 34a_100000036725_100011216152 [1,1,0,0,0,0|1,0,0]=3 862 B17R1.28458 COc1cccc(c1OCCCCC(C)C)F 7a_100000036725_100011216152 [1,1,0,0,0,0|1,0,0]=3 863 B17R1.28458 COc1cccc(c1OCCCCC(C)C)N 34a_100000123586_100011216152 [1,1,0,0,0,0|1,0,0]=3 864 B17R1.28458 COc1cccc(c1SCCCCC(C)C)C 62a_100010191535_100011216152 [1,1,0,0,0,0|1,1,0]=4 865 B17R1.28458 COc1cccc(c1SCCCCC(C)C)C 62a_100011216152_100010191535 [1,1,0,0,0,0|1,1,0]=4 866 B17R1.28458 COc1cccc(c1SCCCCC(C)C)F 62a_100000703912_100011216152 [1,1,0,0,0,0|1,1,0]=4 867 B17R1.28458 COc1cccc(c1SCCCCC(C)C)F 62a_100011216152_100000703912 [1,1,0,0,0,0|1,1,0]=4 868 B17R1.28458 COc1cccc(c1SCCCCC(C)C)N 62a_100000703447_100011216152 [1,1,0,0,0,0|1,1,0]=4 869 B17R1.28458 COc1cccc(c1SCCCCC(C)C)N 62a_100011216152_100000703447 [1,1,0,0,0,0|1,1,0]=4 870 B17R1.28458 COc1cccc(c1SCCCCC(C)C)O 62a_100011216152_100010202623 [1,1,0,0,0,0|1,1,0]=4 871 B17R1.9013 Cc1ccccc1OCC(O)C(=O)CC(C)C 1458a_100011934399_100000210624 [1,1,0,0,0,0|1,0,1]=4 872 B17R1.9013 Cc1ccccc1OCC(O)C(=O)NC(C)C 240690a_100138425928_100011934399 [1,1,0,0,0,0|0,0,1]=3 873 B17R1.14600 CC(=O)NCC(O)COc1ccc(cc1C)C 240690a_100015185969_100015343762 [1,1,0,0,0,0|1,0,1]=4 874 B17R1.14600 CC(=O)NCC(O)COc1ccc(cc1C)C 527a_100015185969_100103153847 [1,1,0,0,0,0|1,0,1]=4 875 B17R1.14600 Cc1ccc(c(c1)C)OCC(O)CNC(C)C 2230a_100015185969_100000210206 [1,1,0,0,0,0|0,0,0]=2 876 B17R1.14600 Cc1ccc(c(c1)C)OCC(O)CNC(C)C 34a_100015185969_100000210206 [1,1,0,0,0,0|0,0,0]=2 877 B17R1.1843 CCCCNC(C)COc1ccccc1OC 2230a_100000743626_100000210211 [1,1,0,0,0,0|2,0,0]=4 878 B17R1.1843 CCCCOC(C)COc1ccccc1OC 34a_100000242603_100000210210 [1,1,0,0,0,0|2,0,0]=4 879 B17R1.1843 CCCCOC(C)COc1ccccc1OC 7a_100000242603_100000210211 [1,1,0,0,0,0|2,0,0]=4 880 B17R1.4038 CCCCC(CC)COc1ccccc1OC 34a_100000210385_100000211942 [1,1,0,0,0,0|2,0,0]=4 881 B17R1.6576 COC(=O)C[C@@H](O)COc1ccccc1OC 34a_100000210385_100000754131 [1,1,0,0,0,0|2,0,0]=4 882 B17R1.746 CCOc1ccccc1OCC(=O)CC(C)C 1458a_100000182497_100000210624 [0,1,0,0,1,0|0,0,2]=4 883 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 11a_100138425928_100000182497 [0,1,0,0,1,0|0,0,2]=4 884 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 1626a_100138425928_100000182497 [0,1,0,0,1,0|0,0,2]=4 885 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 240690a_100138425928_100000182497 [0,1,0,0,1,0|0,0,2]=4 886 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 34a_100000211404_100000183996 [0,1,0,0,1,0|0,0,2]=4 887 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 527a_100138425928_100000182497 [0,1,0,0,1,0|0,0,2]=4 888 B17R1.746 CCOc1ccccc1OCC(=O)NC(C)C 7a_100000211404_100000183996 [0,1,0,0,1,0|0,0,2]=4 889 B17R1.746 CCOc1ccccc1OCC(C)CN(C)C 7a_100000211404_100015348159 [0,1,0,0,1,0|2,0,0]=4 890 B17R1.746 COCc1ccccc1OCC(=O)NC(C)C 34a_100011488565_100000183996 [0,1,0,0,1,0|0,0,2]=4 891 B17R1.746 COCc1ccccc1OCC(=O)NC(C)C 7a_100011488565_100000183996 [0,1,0,0,1,0|0,0,2]=4 892 B17R1.746 COCc1ccccc1OCC(C)CN(C)C 7a_100011488565_100015348159 [0,1,0,0,1,0|2,0,0]=4 893 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)Br 34a_100009816560_100000183996 [0,1,0,0,1,0|0,0,2]=4 894 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)Br 7a_100009816560_100000183996 [0,1,0,0,1,0|0,0,2]=4 895 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)C 34a_100011216497_100000183996 [0,1,0,0,1,0|0,0,2]=4 896 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)C 7a_100011216497_100000183996 [0,1,0,0,1,0|0,0,2]=4 897 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)Cl 34a_100000101779_100000183996 [0,1,0,0,1,0|0,0,2]=4 898 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)Cl 7a_100000101779_100000183996 [0,1,0,0,1,0|0,0,2]=4 899 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)F 34a_100000034962_100000183996 [0,1,0,0,1,0|0,0,2]=4 900 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)F 7a_100000034962_100000183996 [0,1,0,0,1,0|0,0,2]=4 901 B17R1.4706 COc1ccc(cc1OCC(=O)NC(C)C)N 34a_100000211920_100000183996 [0,1,0,0,1,0|0,0,2]=4 902 B17R1.4706 COc1ccc(cc1OCC(C)CN(C)C)Br 7a_100009816560_100015348159 [0,1,0,0,1,0|2,0,0]=4 903 B17R1.4706 COc1ccc(cc1OCC(C)CN(C)C)C 7a_100011216497_100015348159 [0,1,0,0,1,0|2,0,0]=4 904 B17R1.4706 COc1ccc(cc1OCC(C)CN(C)C)Cl 7a_100000101779_100015348159 [0,1,0,0,1,0|2,0,0]=4 905 B17R1.4706 COc1ccc(cc1OCC(C)CN(C)C)F 7a_100000034962_100015348159 [0,1,0,0,1,0|2,0,0]=4 906 B17R1.5307 COc1cc(ccc1OCC(=O)CC(C)C)C 1458a_100000183895_100000210624 [0,1,0,0,1,0|0,0,2]=4 907 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)Br 34a_100000694246_100000183996 [0,1,0,0,1,0|0,0,2]=4 908 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)Br 7a_100000694246_100000183996 [0,1,0,0,1,0|0,0,2]=4 909 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)C 11a_100138425928_100000183895 [0,1,0,0,1,0|0,0,2]=4 910 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)C 1626a_100138425928_100000183895 [0,1,0,0,1,0|0,0,2]=4 911 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)C 240690a_100138425928_100000183895 [0,1,0,0,1,0|0,0,2]=4 912 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)C 34a_100000186466_100000183996 [0,1,0,0,1,0|0,0,2]=4 913 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)C 527a_100138425928_100000183895 [0,1,0,0,1,0|0,0,2]=4 914 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)Cl 34a_100000033002_100000183996 [0,1,0,0,1,0|0,0,2]=4 915 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)F 34a_100000036057_100000183996 [0,1,0,0,1,0|0,0,2]=4 916 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)F 7a_100000036057_100000183996 [0,1,0,0,1,0|0,0,2]=4 917 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)I 34a_100000049635_100000183996 [0,1,0,0,1,0|0,0,2]=4 918 B17R1.5307 COc1cc(ccc1OCC(=O)NC(C)C)N 34a_100000726020_100000183996 [0,1,0,0,1,0|0,0,2]=4 919 B17R1.5307 COc1cc(ccc1OCC(C)CN(C)C)Br 7a_100000694246_100015348159 [0,1,0,0,1,0|2,0,0]=4 920 B17R1.5307 COc1cc(ccc1OCC(C)CN(C)C)F 7a_100000036057_100015348159 [0,1,0,0,1,0|2,0,0]=4 921 B17R1.6549 COc1ccccc1CC(=O)[C@@H](O)CC(C)C 1458a_100012027011_100000210004 [0,1,0,0,1,0|1,0,1]=4 922 B17R1.6549 COc1ccccc1NC(=O)[C@@H](O)CC(C)C 1626a_100000210025_100012027011 [0,1,0,0,1,0|1,0,1]=4 923 B17R1.6549 COc1ccccc1NC(=O)[C@@H](O)CC(C)C 22a_100000210025_100012027011 [0,1,0,0,1,0|1,0,1]=4 924 B17R1.6549 COc1ccccc1OC(C)C(=O)CC(C)C 1458a_100000188836_100000210624 [0,1,0,0,1,0|0,0,2]=4 925 B17R1.6549 COc1ccccc1OC(C)C(=O)NC(C)C 11a_100138425928_100000188836 [0,1,0,0,1,0|0,0,2]=4 926 B17R1.6549 COc1ccccc1OC(C)C(=O)NC(C)C 1626a_100138425928_100000188836 [0,1,0,0,1,0|0,0,2]=4 927 B17R1.6549 COc1ccccc1OC(C)C(=O)NC(C)C 240690a_100138425928_100000188836 [0,1,0,0,1,0|0,0,2]=4 928 B17R1.6549 COc1ccccc1OC(C)C(=O)NC(C)C 34a_100000210385_100000195394 [0,1,0,0,1,0|0,0,2]=4 929 B17R1.6549 COc1ccccc1OC(C)C(=O)NC(C)C 527a_100138425928_100000188836 [0,1,0,0,1,0|0,0,2]=4 930 B17R1.6575 CCc1ccccc1OCC(O)C[N+](C)(C)C 34a_100000210936_100000032816 [0,1,0,0,1,0|2,0,0]=4 931 B17R1.6575 CCc1ccccc1OCC(O)C[N+](C)(C)C 7a_100000210936_100000032816 [0,1,0,0,1,0|2,0,0]=4 932 B17R1.6575 CNc1ccccc1OCC(O)C[N+](C)(C)C 34a_100000033821_100000032816 [0,1,0,0,1,0|2,0,0]=4 933 B17R1.6575 COc1ccccc1NCC(O)C[N+](C)(C)C 34a_100000210025_100000032816 [0,1,0,0,1,0|2,0,0]=4 934 B17R1.6575 COc1ccccc1OCC(=O)NC(C)(C)C 11a_100000715429_100000182946 [0,1,0,0,1,0|0,0,2]=4 935 B17R1.6575 COc1ccccc1OCC(=O)NC(C)(C)C 1626a_100000715429_100000182946 [0,1,0,0,1,0|0,0,2]=4 936 B17R1.6575 COc1ccccc1OCC(=O)NC(C)(C)C 240690a_100000715429_100000182946 [0,1,0,0,1,0|0,0,2]=4 937 B17R1.6575 COc1ccccc1OCC(=O)NC(C)(C)C 34a_100000210385_100000182746 [0,1,0,0,1,0|0,0,2]=4 938 B17R1.6575 COc1ccccc1OCC(=O)NC(C)(C)C 527a_100000715429_100000182946 [0,1,0,0,1,0|0,0,2]=4 939 B17R1.6575 COc1ccccc1OCC(C)OC(C)(C)C 34a_100000242603_100000210625 [0,1,0,0,1,0|2,0,0]=4 940 B17R1.6575 COc1ccccc1OCC(O)C[N+](C)(C)C 34a_100000210385_100000032816 [0,1,0,0,1,0|1,0,0]=3 941 B17R1.6575 COc1ccccc1SCC(O)C[N+](C)(C)C 62a_100000032816_100000210334 [0,1,0,0,1,0|1,1,0]=4 942 B17R1.6575 COc1ccccc1SCC(O)C[N+](C)(C)C 62a_100000210334_100000032816 [0,1,0,0,1,0|1,1,0]=4 943 B17R1.6575 COc1cccnc1OCC(O)C[N+](C)(C)C 34a_100025773188_100000032816 [0,1,0,0,1,0|2,0,0]=4 944 B17R1.6575 COc1ccncc1OCC(O)C[N+](C)(C)C 34a_100000101186_100000032816 [0,1,0,0,1,0|2,0,0]=4 945 B17R1.6575 COc1ncccc1OCC(O)C[N+](C)(C)C 34a_100000698397_100000032816 [0,1,0,0,1,0|2,0,0]=4 946 B17R1.6575 COc1ncccc1OCC(O)C[N+](C)(C)C 7a_100000698397_100000032816 [0,1,0,0,1,0|2,0,0]=4 947 B17R1.6575 CSc1ccccc1OCC(O)C[N+](C)(C)C 34a_100011216402_100000032816 [0,1,0,0,1,0|1,1,0]=4 948 B17R1.7388 COc1c(cccc1OCC(=O)NC(C)C)Br 34a_100010234590_100000183996 [0,1,0,0,1,0|0,0,2]=4 949 B17R1.7388 COc1c(cccc1OCC(=O)NC(C)C)Cl 34a_200009886253_100000183996 [0,1,0,0,1,0|0,0,2]=4 950 B17R1.7388 COc1c(cccc1OCC(=O)NC(C)C)Cl 7a_200009886253_100000183996 [0,1,0,0,1,0|0,0,2]=4 951 B17R1.7388 COc1c(cccc1OCC(C)CN(C)C)Cl 7a_200009886253_100015348159 [0,1,0,0,1,0|2,0,0]=4 952 B17R1.27007 COc1ccccc1CN[C@H](CO)CC(C)C 207a_100011830311_100000169842 [0,1,0,0,1,0|2,0,0]=4 953 B17R1.27007 COc1ccccc1CN[C@H](CO)CC(C)C 2230a_100011830311_100000210004 [0,1,0,0,1,0|2,0,0]=4 954 B17R1.27007 COc1ccccc1CN[C@H](CO)CC(C)C 270004a_100011830311_100000169842 [0,1,0,0,1,0|2,0,0]=4 955 B17R1.27007 COc1ccccc1CN[C@H](CO)CC(C)C 34a_100011830311_100000210004 [0,1,0,0,1,0|2,0,0]=4 956 B17R1.27009 COc1ccccc1OCC(=O)N(C)C(C)C 11a_200000211004_100000182946 [0,1,0,0,1,0|0,0,2]=4 957 B17R1.27009 COc1ccccc1OCC(=O)N(C)C(C)C 1626a_200000211004_100000182946 [0,1,0,0,1,0|0,0,2]=4 958 B17R1.27009 COc1ccccc1OCC(=O)N(C)C(C)C 240690a_200000211004_100000182946 [0,1,0,0,1,0|0,0,2]=4 959 B17R1.27009 COc1ccccc1OCC(=O)N(C)C(C)C 34a_100000210385_100000230190 [0,1,0,0,1,0|0,0,2]=4 960 B17R1.27009 COc1ccccc1OCC(=O)N(C)C(C)C 527a_200000211004_100000182946 [0,1,0,0,1,0|0,0,2]=4 961 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)Br 34a_100000686866_100000183996 [0,1,0,0,1,0|0,0,2]=4 962 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)C 34a_100011219253_100000183996 [0,1,0,0,1,0|0,0,2]=4 963 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)C 7a_100011219253_100000183996 [0,1,0,0,1,0|0,0,2]=4 964 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)Cl 34a_100009851661_100000183996 [0,1,0,0,1,0|0,0,2]=4 965 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)Cl 7a_100009851661_100000183996 [0,1,0,0,1,0|0,0,2]=4 966 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)F 34a_100000036725_100000183996 [0,1,0,0,1,0|0,0,2]=4 967 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)F 7a_100000036725_100000183996 [0,1,0,0,1,0|0,0,2]=4 968 B17R1.28449 COc1cccc(c1OCC(=O)NC(C)C)N 34a_100000123586_100000183996 [0,1,0,0,1,0|0,0,2]=4 969 B17R1.28449 COc1cccc(c1OCC(C)CN(C)C)C 7a_100011219253_100015348159 [0,1,0,0,1,0|2,0,0]=4 970 B17R1.28449 COc1cccc(c1OCC(C)CN(C)C)Cl 7a_100009851661_100015348159 [0,1,0,0,1,0|2,0,0]=4 971 B17R1.28449 COc1cccc(c1OCC(C)CN(C)C)F 7a_100000036725_100015348159 [0,1,0,0,1,0|2,0,0]=4 972 B17R1.348 CCOc1ccccc1OC(C)CCC(C)C 34a_100000211404_100011261404 [0,1,0,0,1,0|2,0,0]=4 973 B17R1.348 COCc1ccccc1OC(C)CCC(C)C 34a_100011488565_100011261404 [0,1,0,0,1,0|2,0,0]=4 974 B17R1.4715 COc1ccc(cc1OC(C)CCC(C)C)Br 34a_100009816560_100011261404 [0,1,0,0,1,0|2,0,0]=4 975 B17R1.4715 COc1ccc(cc1OC(C)CCC(C)C)C 34a_100011216497_100011261404 [0,1,0,0,1,0|2,0,0]=4 976 B17R1.4715 COc1ccc(cc1OC(C)CCC(C)C)Cl 34a_100000101779_100011261404 [0,1,0,0,1,0|2,0,0]=4 977 B17R1.4715 COc1ccc(cc1OC(C)CCC(C)C)F 34a_100000034962_100011261404 [0,1,0,0,1,0|2,0,0]=4 978 B17R1.4715 COc1ccc(cc1OC(C)CCC(C)C)N 34a_100000211920_100011261404 [0,1,0,0,1,0|2,0,0]=4 979 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)Br 34a_100000694246_100011261404 [0,1,0,0,1,0|2,0,0]=4 980 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)C 34a_100000186466_100011261404 [0,1,0,0,1,0|2,0,0]=4 981 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)Cl 34a_100000033002_100011261404 [0,1,0,0,1,0|2,0,0]=4 982 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)F 34a_100000036057_100011261404 [0,1,0,0,1,0|2,0,0]=4 983 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)I 34a_100000049635_100011261404 [0,1,0,0,1,0|2,0,0]=4 984 B17R1.5361 COc1cc(ccc1OC(C)CCC(C)C)N 34a_100000726020_100011261404 [0,1,0,0,1,0|2,0,0]=4 985 B17R1.6550 COc1ccccc1CC(=O)CN(C)C(C)C 1458a_100000743827_100000210004 [0,1,0,0,1,0|0,0,2]=4 986 B17R1.7392 COc1c(cccc1OC(C)CCC(C)C)Br 34a_100010234590_100011261404 [0,1,0,0,1,0|2,0,0]=4 987 B17R1.7392 COc1c(cccc1OC(C)CCC(C)C)Cl 34a_200009886253_100011261404 [0,1,0,0,1,0|2,0,0]=4 988 B17R1.27785 COc1ccccc1OC(C)(C)CCC(C)C 34a_100000210385_200000037585 [0,1,0,0,1,0|2,0,0]=4 989 B17R1.28461 COc1cccc(c1OC(C)CCC(C)C)Br 34a_100000686866_100011261404 [0,1,0,0,1,0|2,0,0]=4 990 B17R1.28461 COc1cccc(c1OC(C)CCC(C)C)C 34a_100011219253_100011261404 [0,1,0,0,1,0|2,0,0]=4 991 B17R1.28461 COc1cccc(c1OC(C)CCC(C)C)Cl 34a_100009851661_100011261404 [0,1,0,0,1,0|2,0,0]=4 992 B17R1.28461 COc1cccc(c1OC(C)CCC(C)C)F 34a_100000036725_100011261404 [0,1,0,0,1,0|2,0,0]=4 993 B17R1.28461 COc1cccc(c1OC(C)CCC(C)C)N 34a_100000123586_100011261404 [0,1,0,0,1,0|2,0,0]=4 994 B19R1.7521 COc1ccccc1OCC(C)NCCC(C)(C)C 2230a_100000743626_100000755188 [0,1,0,0,0,1|2,0,0]=4 995 B19R1.7521 COc1ccccc1OCC(C)NCCC(C)(C)O 2230a_100000743626_100000702414 [0,1,0,0,0,1|2,0,0]=4 996 B19R1.7521 COc1ccccc1OCC(C)OCCC(C)(C)C 34a_100000242603_100000755188 [0,1,0,0,0,1|2,0,0]=4 997 B19R1.7521 COc1ccccc1OCC(C)OCCC(C)(C)C 7a_100000242603_100000755188 [0,1,0,0,0,1|2,0,0]=4 998 B19R1.7521 COc1ccccc1OCC(C)OCCC(C)(C)O 34a_100000242603_100000702414 [0,1,0,0,0,1|2,0,0]=4 999 B19R1.7521 COc1ccccc1OCC(C)OCCC(C)(C)O 7a_100000242603_100000702414 [0,1,0,0,0,1|2,0,0]=4 1000 B19R1.51870 COc1ccccc1OCC(=O)CC(=O)NC(C)C 1458a_100000182946_100000183996 [0,1,0,0,0,1|0,0,2]=4 1001 B19R1.51870 COc1ccccc1OCC(C)NC(=O)NC(C)C 2708a_100000743626_100138425928 [0,1,0,0,0,1|1,0,1]=4 1002 B19R1.51870 COc1ccccc1OCC(C)NC(=O)NC(C)C 2708a_100138425928_100000743626 [0,1,0,0,0,1|1,0,1]=4 1003 B19R1.51870 COc1ccccc1OCC(C)NC(=O)NC(C)C 273464a_100138425928_100000743626 [0,1,0,0,0,1|1,0,1]=4 1004 B19R1.51870 COc1ccccc1OCC(C)NC(=O)NC(C)C 512a_100000743626_100138425928 [0,1,0,0,0,1|1,0,1]=4 1005 B19R1.51870 COc1ccccc1OCC(C)NC(=O)NC(C)C 512a_100138425928_100000743626 [0,1,0,0,0,1|1,0,1]=4 1006 B19R1.51870 COc1ccccc1OCC(C)NC(C)CC(C)C 2230a_100000743626_100000731052 [0,1,0,0,0,1|2,0,0]=4 1007 B19R1.51870 COc1ccccc1OCC(C)OC(C)CC(C)C 34a_100000242603_100000731052 [0,1,0,0,0,1|2,0,0]=4 1008 B19R1.51870 COc1ccccc1OCC(C)OC(C)CC(C)C 7a_100000242603_100000731052 [0,1,0,0,0,1|2,0,0]=4 1009 B19R1.51871 COc1ccccc1OCC(C)NCC(=O)C(C)C 2230a_100000743626_100000753385 [0,1,0,0,0,1|2,0,0]=4 1010 B19R1.51871 COc1ccccc1OCC(C)OCC(=O)C(C)C 34a_100000242603_100000753385 [0,1,0,0,0,1|2,0,0]=4 1011 B19R1.51871 COc1ccccc1OCC(C)OCC(=O)C(C)C 7a_100000242603_100000753385 [0,1,0,0,0,1|2,0,0]=4 1012 B19R1.7515 COc1ccccc1OCCC(=O)CN(C)C(C)C 1458a_100000743827_100000188471 [0,1,0,0,0,1|0,0,2]=4 1013 B17R1.1062 Cc1cc(ccc1Cl)OCC(O)CNC(C)C 2230a_100011226696_100000210206 [0,0,1,1,0,0|2,0,0]=4 1014 B17R1.1062 Cc1cc(ccc1Cl)OCC(O)CNC(C)C 34a_100011226696_100000210206 [0,0,1,1,0,0|2,0,0]=4 1015 B17R2.137 CC(C)NCCCN1CCc2c1cccc2 2230a_100011191709_100000210206 [1,0,0,1,0,0|2,0,0]=4 1016 B17R2.261 COc1ccccc1OC2CCCN(C2)C 2230a_100000730931_200000210301 [1,0,0,1,0,0|2,0,0]=4 1017 B17R2.261 COc1ccccc1OC2CCCN(C2)C 269982a_100000730931_200000210301 [1,0,0,1,0,0|2,0,0]=4 1018 B17R2.261 COc1ccccc1OC2CCCN(C2)[13CH3] 2230a_100000730931_200025704644 [1,0,0,1,0,0|2,0,0]=4 1019 B17R2.261 COc1ccccc1OC2CCCN(C2)[13CH3] 269982a_100000730931_200025704644 [1,0,0,1,0,0|2,0,0]=4 1020 B17R2.1057 COc1ccccc1OCC2CCN(C2)C 34a_100000210385_200000690779 [1,0,0,1,0,0|2,0,0]=4 1021 B17R2.5669 CC(C)CNCC1COc2ccccc2O1 2230a_100000210953_100011215957 [1,0,0,1,0,0|2,0,0]=4 1022 B17R2.5669 CC(C)CNCC1COc2ccccc2O1 2230a_100000682559_100000210760 [1,0,0,1,0,0|2,0,0]=4 1023 B17R2.5669 CC(C)CNCC1COc2ccccc2O1 270004a_100000682559_100000210432 [1,0,0,1,0,0|2,0,0]=4 1024 B17R2.5669 CC(C)CNCC1COc2ccccc2O1 34a_100000210953_100011215957 [1,0,0,1,0,0|2,0,0]=4 1025 B17R2.5669 CC(C)CNCC1COc2ccccc2O1 34a_100000682559_100000210624 [1,0,0,1,0,0|2,0,0]=4 1026 B17R2.5669 CC(C)COCC1COc2ccccc2O1 34a_100000184353_100000210624 [1,0,0,1,0,0|2,0,0]=4 1027 B17R2.5669 CC(C)COCC1COc2ccccc2O1 34a_100000210257_100011215957 [1,0,0,1,0,0|2,0,0]=4 1028 B17R2.5669 CC(C)CSCC1COc2ccccc2O1 62a_100000210624_100011215957 [1,0,0,1,0,0|2,0,0]=4 1029 B17R2.5669 CC(C)CSCC1COc2ccccc2O1 62a_100011215957_100000210760 [1,0,0,1,0,0|2,0,0]=4 1030 B17R2.5669 CC(C)OCCC1COc2ccccc2O1 34a_200000066832_100000210206 [1,0,0,1,0,0|1,0,0]=3 1031 B17R2.5669 CC(C)OCCC1COc2ccccc2O1 7a_200000066832_100000210206 [1,0,0,1,0,0|1,0,0]=3 1032 B17R2.8834 COc1ccccc1C2CCCN2C(C)C 2230a_200000751146_100000210206 [1,0,0,1,0,0|1,0,0]=3 1033 B17R2.8834 COc1ccccc1C2CCCN2C(C)C 269982a_200000751146_100000210206 [1,0,0,1,0,0|1,0,0]=3 1034 B17R2.8834 COc1ccccc1C2CCCN2C(C)C 34a_200000751146_100000210206 [1,0,0,1,0,0|1,0,0]=3 1035 B17R2.12465 COc1ccccc1OCCN2CC(C2)C 2230a_100000702820_100000188471 [1,0,0,1,0,0|2,0,0]=4 1036 B17R2.12465 COc1ccccc1OCCN2CC(C2)C 269982a_100000702820_100000188471 [1,0,0,1,0,0|2,0,0]=4 1037 B17R2.12465 COc1ccccc1OCCN2CC(C2)C 34a_100000702820_100000188471 [1,0,0,1,0,0|2,0,0]=4 1038 B17R2.12545 COc1ccccc1COCCNC2CC2 34a_100000738766_100000210004 [1,0,0,1,0,0|2,0,0]=4 1039 B17R2.12545 COc1ccccc1OCCCNC2CC2 34a_100000212008_100011259231 [1,0,0,1,0,0|0,0,0]=2 1040 B17R2.12545 COc1ccccc1OCCCNC2CC2 34a_100000752037_100000211595 [1,0,0,1,0,0|0,0,0]=2 1041 B17R2.12545 COc1ccccc1OCCCSC2CC2 62a_100011259231_100000211595 [1,0,0,1,0,0|1,0,0]=3 1042 B17R2.12545 COc1ccccc1OCCNCC2CC2 2230a_100000683763_100000742324 [1,0,0,1,0,0|2,0,0]=4 1043 B17R2.12545 COc1ccccc1OCCNCC2CC2 2230a_100000735609_100000188471 [1,0,0,1,0,0|2,0,0]=4 1044 B17R2.12545 COc1ccccc1OCCNCC2CC2 269862a_100000683763_100000741477 [1,0,0,1,0,0|2,0,0]=4 1045 B17R2.12545 COc1ccccc1OCCNCC2CC2 34a_100000683763_100000742324 [1,0,0,1,0,0|2,0,0]=4 1046 B17R2.12545 COc1ccccc1OCCNCC2CC2 34a_100000735609_100000188471 [1,0,0,1,0,0|2,0,0]=4 1047 B17R2.12545 COc1ccccc1OCCOCC2CC2 34a_100000211283_100000188471 [1,0,0,1,0,0|2,0,0]=4 1048 B17R2.12545 COc1ccccc1OCCSCC2CC2 62a_100000188471_100000742324 [1,0,0,1,0,0|2,0,0]=4 1049 B17R2.12545 COc1ccccc1OCCSCC2CC2 62a_100000756562_100000188471 [1,0,0,1,0,0|2,0,0]=4 1050 B17R2.12545 N#Cc1ccccc1OCCCNC2CC2 34a_100011220211_100000211595 [1,0,0,1,0,0|2,0,0]=4 1051 B17R2.63264 COc1cccc2c1OCC2=NNC(C)C 4a_100000741168_100011214879 [1,0,0,1,0,0|1,0,1]=4 1052 B17R2.20646 CC1(OCC(O1)CSc2ccccc2O)C 62a_100000198056_100000739446 [1,0,0,1,0,0|1,1,0]=4 1053 B17R2.20646 CC1(OCC(O1)CSc2ccccc2O)C 62a_100000739446_100000198056 [1,0,0,1,0,0|1,1,0]=4 1054 B17R2.20646 CC1(OC[C@@H](O1)COc2ccccc2Br)C 7a_100000181306_100015422573 [1,0,0,1,0,0|2,0,0]=4 1055 B17R2.20646 CC1(OC[C@@H](O1)COc2ccccc2Cl)C 7a_100000210172_100015422573 [1,0,0,1,0,0|2,0,0]=4 1056 B17R2.20646 CC1(OC[C@@H](O1)COc2ccccc2F)C 7a_100000210171_100015422573 [1,0,0,1,0,0|2,0,0]=4 1057 B17R2.20646 CC1(OC[C@@H](O1)COc2ccccc2I)C 7a_100000739446_100015422573 [1,0,0,1,0,0|2,0,0]=4 1058 B17R2.20646 CC1(OC[C@@H](O1)COc2ccccc2N)C 7a_100000185747_100015422573 [1,0,0,1,0,0|2,0,0]=4 1059 B17R2.20646 CC1(OC[C@@H](O1)CSc2ccccc2O)C 62a_100000739446_100015422573 [1,0,0,1,0,0|1,1,0]=4 1060 B17R2.20646 CC1(OC[C@@H](O1)CSc2ccccc2O)C 62a_100015422573_100000739446 [1,0,0,1,0,0|1,1,0]=4 1061 B17R2.20646 Cc1ccccc1OC[C@H]2COC(O2)(C)C 7a_100000210338_100015422573 [1,0,0,1,0,0|1,0,0]=3 1062 B17R2.20646 Cc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100000210755 [1,0,0,1,0,0|1,1,0]=4 1063 B17R2.20646 Cc1ccccc1SCC2COC(O2)(C)C 62a_100000210755_100000198056 [1,0,0,1,0,0|1,1,0]=4 1064 B17R2.20646 Cc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100000210755_100015422573 [1,0,0,1,0,0|1,1,0]=4 1065 B17R2.20646 Cc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100000210755 [1,0,0,1,0,0|1,1,0]=4 1066 B17R2.20646 Cc1ccncc1OC[C@H]2COC(O2)(C)C 7a_100011997053_100015422573 [1,0,0,1,0,0|2,0,0]=4 1067 B17R2.20646 Cc1ncccc1OC[C@H]2COC(O2)(C)C 7a_100000745507_100015422573 [1,0,0,1,0,0|2,0,0]=4 1068 B17R2.262 CCc1ccccc1OCC2CCCCO2 34a_100000210936_100000211543 [1,0,0,1,0,0|2,0,0]=4 1069 B17R2.262 CCc1ccccc1OCC2CCCCO2 7a_100000210936_100000211543 [1,0,0,1,0,0|2,0,0]=4 1070 B17R2.262 CNc1ccccc1OCC2CCCCO2 34a_100000033821_100000211543 [1,0,0,1,0,0|2,0,0]=4 1071 B17R2.262 COc1ccccc1NCC2CCCCO2 34a_100000210025_100000211543 [1,0,0,1,0,0|2,0,0]=4 1072 B17R2.262 COc1ccccc1OCC2CCCCC2 34a_100000210385_100000211423 [1,0,0,1,0,0|2,0,0]=4 1073 B17R2.262 COc1ccccc1OCC2CCCCO2 34a_100000210385_100000211543 [1,0,0,1,0,0|1,0,0]=3 1074 B17R2.262 COc1ccccc1OCC2CCCOC2 34a_100000210385_100000741521 [1,0,0,1,0,0|2,0,0]=4 1075 B17R2.262 COc1ccccc1SCC2CCCCO2 62a_100000210334_100000211543 [1,0,0,1,0,0|1,1,0]=4 1076 B17R2.262 COc1ccccc1SCC2CCCCO2 62a_100000211543_100000210334 [1,0,0,1,0,0|1,1,0]=4 1077 B17R2.262 COc1cccnc1OCC2CCCCO2 34a_100025773188_100000211543 [1,0,0,1,0,0|2,0,0]=4 1078 B17R2.262 COc1ccncc1OCC2CCCCO2 34a_100000101186_100000211543 [1,0,0,1,0,0|2,0,0]=4 1079 B17R2.262 COc1ncccc1OCC2CCCCO2 34a_100000698397_100000211543 [1,0,0,1,0,0|2,0,0]=4 1080 B17R2.262 COc1ncccc1OCC2CCCCO2 7a_100000698397_100000211543 [1,0,0,1,0,0|2,0,0]=4 1081 B17R2.262 CSc1ccccc1OCC2CCCCO2 34a_100011216402_100000211543 [1,0,0,1,0,0|1,1,0]=4 1082 B17R2.784 CCNCC1=Cc2cccc(c2OC1)OC 270004a_100015525214_200015183524 [1,0,0,1,0,0|1,0,1]=4 1083 B17R2.1470 CCc1ccccc1OC2CCCCC2O 34a_100000210936_100000038908 [1,0,0,1,0,0|2,0,0]=4 1084 B17R2.1470 CNc1ccccc1OC2CCCCC2O 34a_100000033821_100000038908 [1,0,0,1,0,0|2,0,0]=4 1085 B17R2.1470 COc1ccccc1NC2CCCCC2O 34a_100000210025_100000038908 [1,0,0,1,0,0|2,0,0]=4 1086 B17R2.1470 COc1ccccc1OC2CCCCC2F 34a_100000210385_100015423560 [1,0,0,1,0,0|2,0,0]=4 1087 B17R2.1470 COc1ccccc1OC2CCCCC2O 34a_100000210385_100000038908 [1,0,0,1,0,0|1,0,0]=3 1088 B17R2.1470 COc1ccccc1SC2CCCCC2O 62a_100000038908_100000210334 [1,0,0,1,0,0|1,1,0]=4 1089 B17R2.1470 COc1ccccc1SC2CCCCC2O 62a_100000210334_100000038908 [1,0,0,1,0,0|1,1,0]=4 1090 B17R2.1470 COc1cccnc1OC2CCCCC2O 34a_100025773188_100000038908 [1,0,0,1,0,0|2,0,0]=4 1091 B17R2.1470 COc1ccncc1OC2CCCCC2O 34a_100000101186_100000038908 [1,0,0,1,0,0|2,0,0]=4 1092 B17R2.1470 COc1ncccc1OC2CCCCC2O 34a_100000698397_100000038908 [1,0,0,1,0,0|2,0,0]=4 1093 B17R2.1470 CSc1ccccc1OC2CCCCC2O 34a_100011216402_100000038908 [1,0,0,1,0,0|1,1,0]=4 1094 B17R2.18967 CC(C)CC(=O)C1COc2ccccc2O1 1458a_100000182656_100000210624 [0,0,0,1,1,0|0,0,2]=4 1095 B17R2.18967 CC(C)NC(=O)C1COc2ccccc2O1 11a_100138425928_100000182656 [0,0,0,1,1,0|0,0,2]=4 1096 B17R2.18967 CC(C)NC(=O)C1COc2ccccc2O1 1626a_100138425928_100000182656 [0,0,0,1,1,0|0,0,2]=4 1097 B17R2.18967 CC(C)NC(=O)C1COc2ccccc2O1 240690a_100138425928_100000182656 [0,0,0,1,1,0|0,0,2]=4 1098 B17R2.18967 CC(C)NC(=O)C1COc2ccccc2O1 527a_100138425928_100000182656 [0,0,0,1,1,0|0,0,2]=4 1099 B17R2.18967 CC(C)NC(C)C1COc2ccccc2O1 2230a_100015185755_100000210206 [0,0,0,1,1,0|1,0,0]=3 1100 B17R2.18967 CC(C)NC(C)C1COc2ccccc2O1 34a_100015185755_100000210206 [0,0,0,1,1,0|1,0,0]=3 1101 B17R2.63310 COc1cccc2c1CCC(C2)NC(C)C 2230a_100015331613_100000210206 [0,0,0,1,1,0|2,0,0]=4 1102 B17R2.63310 COc1cccc2c1CCC(C2)NC(C)C 34a_100015331613_100000210206 [0,0,0,1,1,0|2,0,0]=4 1103 B17R2.63310 COc1cccc2c1OCC(C2)NC(C)C 2230a_100000059700_100000210206 [0,0,0,1,1,0|1,0,0]=3 1104 B17R2.63310 COc1cccc2c1OCC(C2)NC(C)C 34a_100000059700_100000210206 [0,0,0,1,1,0|1,0,0]=3 1105 B17R2.2357 COc1ccccc1OC2CCC(CC2)C 34a_100000210385_200011216234 [0,0,0,1,1,0|2,0,0]=4 1106 B17R2.68593 CCc1ccccc1OC2CN(C2)C(C)C 269982a_200015184682_100000210206 [0,0,0,1,1,0|2,0,0]=4 1107 B19R2.29286 CCc1ccccc1OCC2CCN(C2)C(C)C 34a_100000210936_100015187125 [0,0,0,1,0,1|2,0,0]=4 1108 B19R2.29286 CNc1ccccc1OCC2CCN(C2)C(C)C 34a_100000033821_100015187125 [0,0,0,1,0,1|2,0,0]=4 1109 B19R2.29286 COc1ccccc1NCC2CCN(C2)C(C)C 34a_100000210025_100015187125 [0,0,0,1,0,1|2,0,0]=4 1110 B19R2.29286 COc1ccccc1OCC2CCN(C2)C(C)C 34a_100000210385_100015187125 [0,0,0,1,0,1|1,0,0]=3 1111 B19R2.29286 COc1ccccc1SCC2CCN(C2)C(C)C 62a_100000210334_100015187125 [0,0,0,1,0,1|1,1,0]=4 1112 B19R2.29286 COc1ccccc1SCC2CCN(C2)C(C)C 62a_100015187125_100000210334 [0,0,0,1,0,1|1,1,0]=4 1113 B19R2.29286 COc1cccnc1OCC2CCN(C2)C(C)C 34a_100025773188_100015187125 [0,0,0,1,0,1|2,0,0]=4 1114 B19R2.29286 COc1ccncc1OCC2CCN(C2)C(C)C 34a_100000101186_100015187125 [0,0,0,1,0,1|2,0,0]=4 1115 B19R2.29286 COc1ncccc1OCC2CCN(C2)C(C)C 34a_100000698397_100015187125 [0,0,0,1,0,1|2,0,0]=4 1116 B19R2.29286 CSc1ccccc1OCC2CCN(C2)C(C)C 34a_100011216402_100015187125 [0,0,0,1,0,1|1,1,0]=4 1117 B19R2.112185 CC(C)CCNC(C)C1COc2ccccc2O1 2230a_100015185755_100000210312 [0,0,0,1,0,1|2,0,0]=4 1118 B19R2.112185 CC(C)CCNC(C)C1COc2ccccc2O1 269862a_100015185755_100000185833 [0,0,0,1,0,1|2,0,0]=4 1119 B19R2.112185 CC(C)CCNC(C)C1COc2ccccc2O1 270004a_100000210545_100011934066 [0,0,0,1,0,1|2,0,0]=4 1120 B19R2.112185 CC(C)CCNC(C)C1COc2ccccc2O1 34a_100015185755_100000210312 [0,0,0,1,0,1|2,0,0]=4 1121 B19R2.112185 CC(C)OCNC(C)C1COc2ccccc2O1 2230a_100015185755_100000709892 [0,0,0,1,0,1|2,0,0]=4 1122 B19R2.112185 CC(C)OCNC(C)C1COc2ccccc2O1 34a_100015185755_100000709892 [0,0,0,1,0,1|2,0,0]=4 1123 B19R2.171261 COc1cccc2c1OCC(=C2)CNCC(C)C 270004a_100000210953_200015183524 [0,0,0,1,0,1|1,0,1]=4 1124 B19R2.171261 COc1cccc2c1OCC(C2)NCCC(C)C 2230a_100000059700_100000210312 [0,0,0,1,0,1|2,0,0]=4 1125 B19R2.171261 COc1cccc2c1OCC(C2)NCCC(C)C 269862a_100000059700_100000185833 [0,0,0,1,0,1|2,0,0]=4 1126 B19R2.171261 COc1cccc2c1OCC(C2)NCCC(C)C 34a_100000059700_100000210312 [0,0,0,1,0,1|2,0,0]=4 1127 B19R2.171261 COc1cccc2c1OCC(C2)NCOC(C)C 2230a_100000059700_100000709892 [0,0,0,1,0,1|2,0,0]=4 1128 B19R2.171261 COc1cccc2c1OCC(C2)NCOC(C)C 34a_100000059700_100000709892 [0,0,0,1,0,1|2,0,0]=4 1129 B19R2.1449697 COc1ccccc1OCC(C)NCCC2CC2 2230a_100000743626_100000694398 [0,0,0,1,0,1|2,0,0]=4 1130 B19R2.1449697 COc1ccccc1OCC(C)OCCC2CC2 34a_100000242603_100000694398 [0,0,0,1,0,1|2,0,0]=4 1131 B19R2.1449697 COc1ccccc1OCC(C)OCCC2CC2 7a_100000242603_100000764125 [0,0,0,1,0,1|2,0,0]=4 1132 B19R2.13814 COc1ccccc1COCC2CCC(CC2)C 34a_100000701341_100000210004 [0,0,0,1,0,1|2,0,0]=4 1133 B19R2.13814 COc1ccccc1COC[C@@H]2CN[C@H](CN2)C 34a_100160570299_100000210004 [0,0,0,1,0,1|1,0,0]=3 1134 B19R2.13814 COc1ncccc1COC[C@@H]2CN[C@H](CN2)C 34a_100160570299_100020631285 [0,0,0,1,0,1|2,0,0]=4 1135 B19R2.13814 CSc1ccccc1COC[C@@H]2CN[C@H](CN2)C 34a_100160570299_100000699184 [0,0,0,1,0,1|1,1,0]=4 1136 B19R2.29379 COc1ccccc1N2CCC(C2)CNC(C)C 2230a_200000748714_100000210206 [0,0,0,1,0,1|2,0,0]=4 1137 B19R2.29379 COc1ccccc1N2CCC(C2)CNC(C)C 34a_200000748714_100000210206 [0,0,0,1,0,1|2,0,0]=4 1138 B19R2.112274 CC(C)NC[C@H](O)CN1CCc2ccccc2C1 2230a_100138413225_100000210206 [0,0,0,1,0,1|2,0,0]=4 1139 B19R2.170250 COc1ccccc1COC2CC(CCC2C)C 34a_100011217446_100000210004 [0,0,0,1,0,1|2,0,0]=4 1140 B19R2.170250 COc1ccccc1COC2CC(CCC2C)C 7a_100011217446_100000210004 [0,0,0,1,0,1|2,0,0]=4 1141 B19R2.183565 CCc1ccccc1COC[C@H]2COC(O2)(C)C 7a_100011663872_100015422573 [0,0,0,1,0,1|2,0,0]=4 1142 B19R2.183565 COc1ccccc1CNC[C@H]2COC(O2)(C)C 207a_100015982057_100000169842 [0,0,0,1,0,1|2,0,0]=4 1143 B19R2.183565 COc1ccccc1CNC[C@H]2COC(O2)(C)C 270004a_100000188900_100009815026 [0,0,0,1,0,1|2,0,0]=4 1144 B19R2.183565 COc1ccccc1CNC[C@H]2COC(O2)(C)C 34a_100015982057_100000210004 [0,0,0,1,0,1|2,0,0]=4 1145 B19R2.183565 COc1ccccc1COCC2COC(O2)(C)C 34a_100000729170_100000210004 [0,0,0,1,0,1|1,0,0]=3 1146 B19R2.183565 COc1ccccc1COCC2COC(O2)(C)C 7a_100000729170_100000210004 [0,0,0,1,0,1|1,0,0]=3 1147 B19R2.183565 COc1ccccc1CSCC2COC(O2)(C)C 62a_100000198056_100000210004 [0,0,0,1,0,1|1,1,0]=4 1148 B19R2.183565 COc1ccccc1CSCC2COC(O2)(C)C 62a_100000210004_100000198056 [0,0,0,1,0,1|1,1,0]=4 1149 B19R2.183565 COc1ccccc1CSC[C@H]2COC(O2)(C)C 62a_100000210004_100015422573 [0,0,0,1,0,1|1,1,0]=4 1150 B19R2.183565 COc1ccccc1CSC[C@H]2COC(O2)(C)C 62a_100015422573_100000210004 [0,0,0,1,0,1|1,1,0]=4 1151 B19R2.183565 COc1cnccc1COCC2COC(O2)(C)C 7a_100000729170_100020635607 [0,0,0,1,0,1|2,0,0]=4 1152 B19R2.183565 COc1ncccc1COCC2COC(O2)(C)C 34a_100000729170_100020631285 [0,0,0,1,0,1|2,0,0]=4 1153 B19R2.183565 COc1ncccc1COCC2COC(O2)(C)C 7a_100000729170_100020631285 [0,0,0,1,0,1|2,0,0]=4 1154 B19R2.183565 CSc1ccccc1COCC2COC(O2)(C)C 34a_100000729170_100000699184 [0,0,0,1,0,1|1,1,0]=4 1155 B19R2.183565 CSc1ccccc1COCC2COC(O2)(C)C 7a_100000729170_100000699184 [0,0,0,1,0,1|1,1,0]=4 1156 B19R2.19412 COc1ccc(cc1NCC2COC(O2)(C)C)C 2230a_100000210980_100009884615 [0,1,0,1,0,0|2,0,0]=4 1157 B19R2.19412 COc1ccc(cc1NC[C@H]2COC(O2)(C)C)C 2230a_100000210980_100015422573 [0,1,0,1,0,0|2,0,0]=4 1158 B19R2.19412 COc1ccc(cc1OC[C@H]2COC(O2)(C)C)Br 7a_100009816560_100015422573 [0,1,0,1,0,0|1,0,0]=3 1159 B19R2.19412 COc1ccc(cc1OC[C@H]2COC(O2)(C)C)C 7a_100011216497_100015422573 [0,1,0,1,0,0|1,0,0]=3 1160 B19R2.19412 COc1ccc(cc1OC[C@H]2COC(O2)(C)C)Cl 7a_100000101779_100015422573 [0,1,0,1,0,0|1,0,0]=3 1161 B19R2.19412 COc1ccc(cc1OC[C@H]2COC(O2)(C)C)F 7a_100000034962_100015422573 [0,1,0,1,0,0|1,0,0]=3 1162 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)Br 62a_100000198056_100012351588 [0,1,0,1,0,0|1,1,0]=4 1163 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)Br 62a_100012351588_100000198056 [0,1,0,1,0,0|1,1,0]=4 1164 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)C 62a_100000186399_100000198056 [0,1,0,1,0,0|1,1,0]=4 1165 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)C 62a_100000198056_100000186399 [0,1,0,1,0,0|1,1,0]=4 1166 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)Cl 62a_100000198056_100011215930 [0,1,0,1,0,0|1,1,0]=4 1167 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)Cl 62a_100011215930_100000198056 [0,1,0,1,0,0|1,1,0]=4 1168 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)F 62a_100000171694_100000198056 [0,1,0,1,0,0|1,1,0]=4 1169 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)F 62a_100000198056_100000171694 [0,1,0,1,0,0|1,1,0]=4 1170 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)N 62a_100000198056_100011356947 [0,1,0,1,0,0|1,1,0]=4 1171 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)N 62a_100011356947_100000198056 [0,1,0,1,0,0|1,1,0]=4 1172 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)O 62a_100000198056_100010234764 [0,1,0,1,0,0|1,1,0]=4 1173 B19R2.19412 COc1ccc(cc1SCC2COC(O2)(C)C)O 62a_100010234764_100000198056 [0,1,0,1,0,0|1,1,0]=4 1174 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)Br 62a_100012351588_100015422573 [0,1,0,1,0,0|1,1,0]=4 1175 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)Br 62a_100015422573_100012351588 [0,1,0,1,0,0|1,1,0]=4 1176 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)C 62a_100000186399_100015422573 [0,1,0,1,0,0|1,1,0]=4 1177 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)C 62a_100015422573_100000186399 [0,1,0,1,0,0|1,1,0]=4 1178 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)Cl 62a_100011215930_100015422573 [0,1,0,1,0,0|1,1,0]=4 1179 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)Cl 62a_100015422573_100011215930 [0,1,0,1,0,0|1,1,0]=4 1180 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)F 62a_100000171694_100015422573 [0,1,0,1,0,0|1,1,0]=4 1181 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)F 62a_100015422573_100000171694 [0,1,0,1,0,0|1,1,0]=4 1182 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)N 62a_100011356947_100015422573 [0,1,0,1,0,0|1,1,0]=4 1183 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)N 62a_100015422573_100011356947 [0,1,0,1,0,0|1,1,0]=4 1184 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)O 62a_100010234764_100015422573 [0,1,0,1,0,0|1,1,0]=4 1185 B19R2.19412 COc1ccc(cc1SC[C@H]2COC(O2)(C)C)O 62a_100015422573_100010234764 [0,1,0,1,0,0|1,1,0]=4 1186 B19R2.120144 C/C=C/c1ccccc1OC[C@H]2COC(O2)(C)C 7a_200000189419_100015422573 [0,1,0,1,0,0|2,0,0]=4 1187 B19R2.120144 CC1(OC[C@@H](O1)COc2ccccc2CCBr)C 7a_100000722297_100015422573 [0,1,0,1,0,0|2,0,0]=4 1188 B19R2.120144 CC1(OC[C@@H](O1)COc2ccccc2CCO)C 7a_100000719421_100015422573 [0,1,0,1,0,0|2,0,0]=4 1189 B19R2.120144 CCCc1ccccc1OC[C@H]2COC(O2)(C)C 7a_100011217252_100015422573 [0,1,0,1,0,0|2,0,0]=4 1190 B19R2.120144 CCNc1ccccc1OC[C@H]2COC(O2)(C)C 7a_103624766699_100015422573 [0,1,0,1,0,0|2,0,0]=4 1191 B19R2.120144 CCOc1ccccc1OC[C@H]2COC(O2)(C)C 7a_100000211404_100015422573 [0,1,0,1,0,0|1,0,0]=3 1192 B19R2.120144 CCOc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100000230754 [0,1,0,1,0,0|1,1,0]=4 1193 B19R2.120144 CCOc1ccccc1SCC2COC(O2)(C)C 62a_100000230754_100000198056 [0,1,0,1,0,0|1,1,0]=4 1194 B19R2.120144 CCOc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100000230754_100015422573 [0,1,0,1,0,0|1,1,0]=4 1195 B19R2.120144 CCOc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100000230754 [0,1,0,1,0,0|1,1,0]=4 1196 B19R2.120144 COCc1ccccc1OC[C@H]2COC(O2)(C)C 7a_100011488565_100015422573 [0,1,0,1,0,0|1,0,0]=3 1197 B19R2.120144 COCc1ccccc1SCC2COC(O2)(C)C 62a_100000198056_100011493684 [0,1,0,1,0,0|1,1,0]=4 1198 B19R2.120144 COCc1ccccc1SCC2COC(O2)(C)C 62a_100011493684_100000198056 [0,1,0,1,0,0|1,1,0]=4 1199 B19R2.120144 COCc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100011493684_100015422573 [0,1,0,1,0,0|1,1,0]=4 1200 B19R2.120144 COCc1ccccc1SC[C@H]2COC(O2)(C)C 62a_100015422573_100011493684 [0,1,0,1,0,0|1,1,0]=4 1201 B19R2.21806 CCc1cc(ccc1OC[C@H]2COC(O2)(C)C)Br 7a_100012338938_100015422573 [0,1,0,1,0,0|2,0,0]=4 1202 B19R2.21806 CCc1cc(ccc1OC[C@H]2COC(O2)(C)C)C 7a_100009844793_100015422573 [0,1,0,1,0,0|2,0,0]=4 1203 B19R2.21806 CCc1cc(ccc1OC[C@H]2COC(O2)(C)C)F 7a_200000035566_100015422573 [0,1,0,1,0,0|2,0,0]=4 1204 B19R2.21806 COc1cc(ccc1NCC2COC(O2)(C)C)C 2230a_100000746441_100009884615 [0,1,0,1,0,0|2,0,0]=4 1205 B19R2.21806 COc1cc(ccc1NC[C@H]2COC(O2)(C)C)C 2230a_100000746441_100015422573 [0,1,0,1,0,0|2,0,0]=4 1206 B19R2.21806 COc1cc(ccc1OC[C@H]2COC(O2)(C)C)Br 7a_100000694246_100015422573 [0,1,0,1,0,0|1,0,0]=3 1207 B19R2.21806 COc1cc(ccc1OC[C@H]2COC(O2)(C)C)F 7a_100000036057_100015422573 [0,1,0,1,0,0|1,0,0]=3 1208 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)Br 62a_100000198056_100010245111 [0,1,0,1,0,0|1,1,0]=4 1209 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)Br 62a_100010245111_100000198056 [0,1,0,1,0,0|1,1,0]=4 1210 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)C 62a_100000198056_100010200004 [0,1,0,1,0,0|1,1,0]=4 1211 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)C 62a_100010200004_100000198056 [0,1,0,1,0,0|1,1,0]=4 1212 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)Cl 62a_100000050115_100000198056 [0,1,0,1,0,0|1,1,0]=4 1213 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)Cl 62a_100000198056_100000050115 [0,1,0,1,0,0|1,1,0]=4 1214 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)F 62a_100000198056_100000757151 [0,1,0,1,0,0|1,1,0]=4 1215 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)F 62a_100000757151_100000198056 [0,1,0,1,0,0|1,1,0]=4 1216 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)N 62a_100000198056_100000765947 [0,1,0,1,0,0|1,1,0]=4 1217 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)N 62a_100000765947_100000198056 [0,1,0,1,0,0|1,1,0]=4 1218 B19R2.21806 COc1cc(ccc1SCC2COC(O2)(C)C)O 62a_100000198056_100011827694 [0,1,0,1,0,0|1,1,0]=4 1219 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)Br 62a_100010245111_100015422573 [0,1,0,1,0,0|1,1,0]=4 1220 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)Br 62a_100015422573_100010245111 [0,1,0,1,0,0|1,1,0]=4 1221 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)C 62a_100010200004_100015422573 [0,1,0,1,0,0|1,1,0]=4 1222 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)C 62a_100015422573_100010200004 [0,1,0,1,0,0|1,1,0]=4 1223 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)Cl 62a_100000050115_100015422573 [0,1,0,1,0,0|1,1,0]=4 1224 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)Cl 62a_100015422573_100000050115 [0,1,0,1,0,0|1,1,0]=4 1225 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)F 62a_100000757151_100015422573 [0,1,0,1,0,0|1,1,0]=4 1226 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)F 62a_100015422573_100000757151 [0,1,0,1,0,0|1,1,0]=4 1227 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)N 62a_100000765947_100015422573 [0,1,0,1,0,0|1,1,0]=4 1228 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)N 62a_100015422573_100000765947 [0,1,0,1,0,0|1,1,0]=4 1229 B19R2.21806 COc1cc(ccc1SC[C@H]2COC(O2)(C)C)O 62a_100015422573_100011827694 [0,1,0,1,0,0|1,1,0]=4 1230 B19R2.1451857 COc1ccccc1C(=O)CC2COC(O2)(C)C 1458a_100000185835_100000198056 [0,1,0,1,0,0|2,0,0]=4 1231 B19R2.1451857 COc1ccccc1C(=O)C[C@H]2COC(O2)(C)C 1458a_100000185835_100015422573 [0,1,0,1,0,0|2,0,0]=4 1232 B19R2.1451857 COc1ccccc1N(C)CC2COC(O2)(C)C 2230a_100000219746_100009884615 [0,1,0,1,0,0|2,0,0]=4 1233 B19R2.1451857 COc1ccccc1N(C)CC2COC(O2)(C)C 269982a_100000219746_100000198056 [0,1,0,1,0,0|2,0,0]=4 1234 B19R2.1451857 COc1ccccc1N(C)C[C@H]2COC(O2)(C)C 2230a_100000219746_100015422573 [0,1,0,1,0,0|2,0,0]=4 1235 B19R2.1451857 COc1ccccc1N(C)C[C@H]2COC(O2)(C)C 269982a_100000219746_100015422573 [0,1,0,1,0,0|2,0,0]=4 1236 B19R2.171259 COc1cccc2c1OCC(C2)C(=O)NC(C)C 11a_100138425928_100000025966 [0,1,0,1,0,0|1,0,1]=4 1237 B19R2.171259 COc1cccc2c1OCC(C2)C(=O)NC(C)C 1626a_100138425928_100000025966 [0,1,0,1,0,0|1,0,1]=4 1238 B19R2.171259 COc1cccc2c1OCC(C2)C(=O)NC(C)C 240690a_100138425928_100000025966 [0,1,0,1,0,0|1,0,1]=4 1239 B19R2.171259 COc1cccc2c1OCC(C2)C(=O)NC(C)C 527a_100138425928_100000025966 [0,1,0,1,0,0|1,0,1]=4 1240 B19R2.171260 COc1cccc2c1OCC(=C2)CN(C)C(C)C 270004a_200000211004_200015183524 [0,1,0,1,0,0|1,0,1]=4 1241 B19R2.4960 COc1ccccc1OCC2CCC(CC2)OC 34a_100000210385_100013032858 [0,1,0,1,0,0|2,0,0]=4 1242 B19R2.171262 CCC(C)NCC1=Cc2cccc(c2OC1)OC 270004a_100000209981_200015183524 [0,1,0,1,0,0|1,0,1]=4 1243 B19R2.171262 COc1cccc2c1OCC(=C2)CN[C@H](C)CF 270004a_100102880703_200015183524 [0,1,0,1,0,0|1,0,1]=4 1244 B19R2.171262 COc1cccc2c1OCC(=C2)CN[C@H](C)CO 270004a_100000737577_200015183524 [0,1,0,1,0,0|1,0,1]=4 1245 B19R2.38660 COc1c(cccc1NCC2COC(O2)(C)C)Cl 2230a_100000743799_100009884615 [0,1,0,1,0,0|2,0,0]=4 1246 B19R2.38660 COc1c(cccc1NC[C@H]2COC(O2)(C)C)Cl 2230a_100000743799_100015422573 [0,1,0,1,0,0|2,0,0]=4 1247 B19R2.38660 COc1c(cccc1OC[C@H]2COC(O2)(C)C)Cl 7a_200009886253_100015422573 [0,1,0,1,0,0|1,0,0]=3 1248 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)Br 62a_100000198056_100010146560 [0,1,0,1,0,0|1,1,0]=4 1249 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)Br 62a_100010146560_100000198056 [0,1,0,1,0,0|1,1,0]=4 1250 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)C 62a_100000198056_100010141385 [0,1,0,1,0,0|1,1,0]=4 1251 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)C 62a_100010141385_100000198056 [0,1,0,1,0,0|1,1,0]=4 1252 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)Cl 62a_100000198056_100010147678 [0,1,0,1,0,0|1,1,0]=4 1253 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)Cl 62a_100010147678_100000198056 [0,1,0,1,0,0|1,1,0]=4 1254 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)F 62a_100000198056_100009816759 [0,1,0,1,0,0|1,1,0]=4 1255 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)F 62a_100009816759_100000198056 [0,1,0,1,0,0|1,1,0]=4 1256 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)N 62a_100011935253_100000198056 [0,1,0,1,0,0|1,1,0]=4 1257 B19R2.38660 COc1c(cccc1SCC2COC(O2)(C)C)O 62a_100000198056_100010234590 [0,1,0,1,0,0|1,1,0]=4 1258 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)Br 62a_100010146560_100015422573 [0,1,0,1,0,0|1,1,0]=4 1259 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)Br 62a_100015422573_100010146560 [0,1,0,1,0,0|1,1,0]=4 1260 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)C 62a_100010141385_100015422573 [0,1,0,1,0,0|1,1,0]=4 1261 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)C 62a_100015422573_100010141385 [0,1,0,1,0,0|1,1,0]=4 1262 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)Cl 62a_100010147678_100015422573 [0,1,0,1,0,0|1,1,0]=4 1263 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)Cl 62a_100015422573_100010147678 [0,1,0,1,0,0|1,1,0]=4 1264 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)F 62a_100009816759_100015422573 [0,1,0,1,0,0|1,1,0]=4 1265 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)F 62a_100015422573_100009816759 [0,1,0,1,0,0|1,1,0]=4 1266 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)N 62a_100011935253_100015422573 [0,1,0,1,0,0|1,1,0]=4 1267 B19R2.38660 COc1c(cccc1SC[C@H]2COC(O2)(C)C)O 62a_100015422573_100010234590 [0,1,0,1,0,0|1,1,0]=4 1268 B19R2.38660 CSc1c(cccc1OC[C@H]2COC(O2)(C)C)C 7a_200000099257_100015422573 [0,1,0,1,0,0|1,1,0]=4 1269 B19R2.191539 CCc1cccc(c1OC[C@H]2COC(O2)(C)C)Br 7a_200010001580_100015422573 [0,1,0,1,0,0|2,0,0]=4 1270 B19R2.191539 CCc1cccc(c1OC[C@H]2COC(O2)(C)C)C 7a_100000034007_100015422573 [0,1,0,1,0,0|2,0,0]=4 1271 B19R2.191539 COc1cccc(c1NCC2COC(O2)(C)C)C 2230a_100000758225_100009884615 [0,1,0,1,0,0|2,0,0]=4 1272 B19R2.191539 COc1cccc(c1NC[C@H]2COC(O2)(C)C)C 2230a_100000758225_100015422573 [0,1,0,1,0,0|2,0,0]=4 1273 B19R2.191539 COc1cccc(c1OC[C@H]2COC(O2)(C)C)C 7a_100011219253_100015422573 [0,1,0,1,0,0|1,0,0]=3 1274 B19R2.191539 COc1cccc(c1OC[C@H]2COC(O2)(C)C)Cl 7a_100009851661_100015422573 [0,1,0,1,0,0|1,0,0]=3 1275 B19R2.191539 COc1cccc(c1OC[C@H]2COC(O2)(C)C)F 7a_100000036725_100015422573 [0,1,0,1,0,0|1,0,0]=3 1276 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)Br 62a_100000198056_100010131421 [0,1,0,1,0,0|1,1,0]=4 1277 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)Br 62a_100010131421_100000198056 [0,1,0,1,0,0|1,1,0]=4 1278 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)C 62a_100000198056_100010191535 [0,1,0,1,0,0|1,1,0]=4 1279 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)C 62a_100010191535_100000198056 [0,1,0,1,0,0|1,1,0]=4 1280 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)F 62a_100000198056_100000703912 [0,1,0,1,0,0|1,1,0]=4 1281 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)F 62a_100000703912_100000198056 [0,1,0,1,0,0|1,1,0]=4 1282 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)N 62a_100000198056_100000703447 [0,1,0,1,0,0|1,1,0]=4 1283 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)N 62a_100000703447_100000198056 [0,1,0,1,0,0|1,1,0]=4 1284 B19R2.191539 COc1cccc(c1SCC2COC(O2)(C)C)O 62a_100000198056_100010202623 [0,1,0,1,0,0|1,1,0]=4 1285 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)Br 62a_100010131421_100015422573 [0,1,0,1,0,0|1,1,0]=4 1286 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)Br 62a_100015422573_100010131421 [0,1,0,1,0,0|1,1,0]=4 1287 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)C 62a_100010191535_100015422573 [0,1,0,1,0,0|1,1,0]=4 1288 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)C 62a_100015422573_100010191535 [0,1,0,1,0,0|1,1,0]=4 1289 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)F 62a_100000703912_100015422573 [0,1,0,1,0,0|1,1,0]=4 1290 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)F 62a_100015422573_100000703912 [0,1,0,1,0,0|1,1,0]=4 1291 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)N 62a_100000703447_100015422573 [0,1,0,1,0,0|1,1,0]=4 1292 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)N 62a_100015422573_100000703447 [0,1,0,1,0,0|1,1,0]=4 1293 B19R2.191539 COc1cccc(c1SC[C@H]2COC(O2)(C)C)O 62a_100015422573_100010202623 [0,1,0,1,0,0|1,1,0]=4 1294 B19R2.113086 CC(C)c1ccccc1OC[C@H]2COC(O2)(C)C 7a_100000211617_100015422573 [0,1,0,1,0,0|2,0,0]=4 1295 B19R2.113086 CC(O)c1ccccc1OC[C@H]2COC(O2)(C)C 7a_200011232679_100015422573 [0,1,0,1,0,0|2,0,0]=4 1296 B15R1.84 C#Cc1ccccc1OCCCC(C)C 34a_200011470546_100011214892 [1,0,0,0,1,0|1,0,1]=4 1297 B15R1.84 C#Cc1ccccc1OCCCC(C)C 7a_200011470546_100011214892 [1,0,0,0,1,0|1,0,1]=4 1298 B15R1.84 CC(C)CCCOc1ccccc1C#N 34a_100000211048_100011214892 [1,0,0,0,1,0|2,0,0]=4 1299 B15R1.84 CC(C)CCCOc1ccccc1C#N 7a_100000211048_100011214892 [1,0,0,0,1,0|2,0,0]=4 1300 B15R1.84 CC(C)CCCOc1ccccc1CN 34a_100000185550_100011214892 [1,0,0,0,1,0|2,0,0]=4 1301 B15R1.84 CC(C)CCCOc1ccccc1CO 34a_100011216872_100011214892 [1,0,0,0,1,0|2,0,0]=4 1302 B15R1.84 CC(C)NCCOc1ccccc1C#N 2230a_100138425928_100000743737 [1,0,0,0,1,0|2,0,0]=4 1303 B15R1.84 CC(C)NCCOc1ccccc1C#N 2230a_106726388804_100000210206 [1,0,0,0,1,0|2,0,0]=4 1304 B15R1.84 CC(C)NCCOc1ccccc1C#N 34a_100138425928_100000743737 [1,0,0,0,1,0|2,0,0]=4 1305 B15R1.84 CC(C)NCCOc1ccccc1C#N 34a_106726388804_100000210206 [1,0,0,0,1,0|2,0,0]=4 1306 B15R1.84 CC(C)NCCOc1ccccc1C=O 2230a_100138425928_100009990610 [1,0,0,0,1,0|2,0,0]=4 1307 B15R1.84 CC(C)NCCOc1ccccc1C=O 34a_100138425928_100009990610 [1,0,0,0,1,0|2,0,0]=4 1308 B15R1.84 CCc1ccccc1NCCCC(C)C 2230a_100000212081_100011214892 [1,0,0,0,1,0|2,0,0]=4 1309 B15R1.84 CCc1ccccc1NCCCC(C)C 34a_100000212081_100011214892 [1,0,0,0,1,0|2,0,0]=4 1310 B15R1.84 CCc1ccccc1NCCCC(C)C 7a_100000212081_100011214892 [1,0,0,0,1,0|2,0,0]=4 1311 B15R1.84 CCc1ccccc1OCCCC(C)C 34a_100000210936_100011214892 [1,0,0,0,1,0|1,0,0]=3 1312 B15R1.84 CCc1ccccc1OCCCC(C)C 7a_100000210936_100011214892 [1,0,0,0,1,0|1,0,0]=3 1313 B15R1.84 CCc1ccccc1OCCCC(C)O 34a_100000210936_200000718107 [1,0,0,0,1,0|2,0,0]=4 1314 B15R1.84 CCc1ccccc1OCCCC(C)O 7a_100000210936_200000718107 [1,0,0,0,1,0|2,0,0]=4 1315 B15R1.84 CCc1ccccc1OCCCN(C)C 7a_100000210936_100000757444 [1,0,0,0,1,0|2,0,0]=4 1316 B15R1.84 CCc1ccccc1OCCOC(C)C 34a_100000210936_100000211751 [1,0,0,0,1,0|2,0,0]=4 1317 B15R1.84 CCc1ccccc1OCCOC(C)C 7a_100000210936_100000211751 [1,0,0,0,1,0|2,0,0]=4 1318 B15R1.84 CCc1ccccc1OCCSC(C)C 34a_100000210936_100000730970 [1,0,0,0,1,0|2,0,0]=4 1319 B15R1.84 CCc1ccccc1OCCSC(C)C 7a_100000210936_100000730970 [1,0,0,0,1,0|2,0,0]=4 1320 B15R1.84 CCc1ccccc1SCCCC(C)C 62a_100011214892_100011215823 [1,0,0,0,1,0|1,1,0]=4 1321 B15R1.84 CCc1ccccc1SCCCC(C)C 62a_100011215823_100011214892 [1,0,0,0,1,0|1,1,0]=4 1322 B15R1.84 CNc1ccccc1OCCCC(C)C 34a_100000033821_100011214892 [1,0,0,0,1,0|1,0,0]=3 1323 B15R1.84 CNc1ccccc1OCCCC(C)O 34a_100000033821_200000718107 [1,0,0,0,1,0|2,0,0]=4 1324 B15R1.84 CNc1ccccc1OCCOC(C)C 34a_100000033821_100000211751 [1,0,0,0,1,0|2,0,0]=4 1325 B15R1.84 CNc1ccccc1OCCSC(C)C 34a_100000033821_100000730970 [1,0,0,0,1,0|2,0,0]=4 1326 B15R1.84 CNc1ccccc1SCCCC(C)C 62a_100011214892_100020606079 [1,0,0,0,1,0|1,1,0]=4 1327 B15R1.84 CNc1ccccc1SCCCC(C)C 62a_100020606079_100011214892 [1,0,0,0,1,0|1,1,0]=4 1328 B15R1.84 COc1ccccc1CC=NNC(C)C 4a_100000741168_100011713418 [1,0,0,0,1,0|1,0,1]=4 1329 B15R1.84 COc1ccccc1CCCOC(C)C 34a_100011709264_100000210206 [1,0,0,0,1,0|1,0,0]=3 1330 B15R1.84 COc1ccccc1CCCOC(C)C 7a_100011709264_100000210206 [1,0,0,0,1,0|1,0,0]=3 1331 B15R1.84 COc1ccccc1CCNCC(C)C 2230a_100000210953_100011713687 [1,0,0,0,1,0|2,0,0]=4 1332 B15R1.84 COc1ccccc1CCNCC(C)C 2230a_100000211851_100000210760 [1,0,0,0,1,0|2,0,0]=4 1333 B15R1.84 COc1ccccc1CCNCC(C)C 270004a_100000210953_100011713418 [1,0,0,0,1,0|2,0,0]=4 1334 B15R1.84 COc1ccccc1CCNCC(C)C 270004a_100000211851_100000210432 [1,0,0,0,1,0|2,0,0]=4 1335 B15R1.84 COc1ccccc1CCNCC(C)C 34a_100000210953_100011713687 [1,0,0,0,1,0|2,0,0]=4 1336 B15R1.84 COc1ccccc1CCNCC(C)C 34a_100000211851_100000210624 [1,0,0,0,1,0|2,0,0]=4 1337 B15R1.84 COc1ccccc1CCOCC(C)C 34a_100000210257_100011713687 [1,0,0,0,1,0|2,0,0]=4 1338 B15R1.84 COc1ccccc1CCOCC(C)C 34a_100011218620_100000210624 [1,0,0,0,1,0|2,0,0]=4 1339 B15R1.84 COc1ccccc1CCOCC(C)C 7a_100011218620_100000210760 [1,0,0,0,1,0|2,0,0]=4 1340 B15R1.84 COc1ccccc1CCSCC(C)C 62a_100000210624_100011713687 [1,0,0,0,1,0|2,0,0]=4 1341 B15R1.84 COc1ccccc1CCSCC(C)C 62a_100011713687_100000210760 [1,0,0,0,1,0|2,0,0]=4 1342 B15R1.84 COc1ccccc1CNCCC(C)C 207a_100000210545_100000169842 [1,0,0,0,1,0|2,0,0]=4 1343 B15R1.84 COc1ccccc1CNCCC(C)C 269862a_100000188900_100000185833 [1,0,0,0,1,0|2,0,0]=4 1344 B15R1.84 COc1ccccc1CNCCC(C)C 270004a_100000210545_100000169842 [1,0,0,0,1,0|2,0,0]=4 1345 B15R1.84 COc1ccccc1CNCCC(C)C 34a_100000188900_100000210312 [1,0,0,0,1,0|2,0,0]=4 1346 B15R1.84 COc1ccccc1CNCOC(C)C 34a_100000188900_100000709892 [1,0,0,0,1,0|2,0,0]=4 1347 B15R1.84 COc1ccccc1COCCC(C)C 34a_100000210254_100000210004 [1,0,0,0,1,0|2,0,0]=4 1348 B15R1.84 COc1ccccc1COCCC(C)C 34a_100000211301_100000210312 [1,0,0,0,1,0|2,0,0]=4 1349 B15R1.84 COc1ccccc1COCCC(C)C 7a_100000210254_100000210004 [1,0,0,0,1,0|2,0,0]=4 1350 B15R1.84 COc1ccccc1COCOC(C)C 34a_100000211301_100000709892 [1,0,0,0,1,0|2,0,0]=4 1351 B15R1.84 COc1ccccc1CSCCC(C)C 62a_100000210004_100000210312 [1,0,0,0,1,0|2,0,0]=4 1352 B15R1.84 COc1ccccc1CSCCC(C)C 62a_100000210312_100000210004 [1,0,0,0,1,0|2,0,0]=4 1353 B15R1.84 COc1ccccc1CSCOC(C)C 62a_100000210004_100000709892 [1,0,0,0,1,0|2,0,0]=4 1354 B15R1.84 COc1ccccc1CSCOC(C)C 62a_100000709892_100000210004 [1,0,0,0,1,0|2,0,0]=4 1355 B15R1.84 COc1ccccc1NCCCC(C)C 34a_100000210025_100011214892 [1,0,0,0,1,0|1,0,0]=3 1356 B15R1.84 COc1ccccc1NCCCC(C)O 34a_100000210025_200000718107 [1,0,0,0,1,0|2,0,0]=4 1357 B15R1.84 COc1ccccc1NCCOC(C)C 34a_100000210025_100000211751 [1,0,0,0,1,0|2,0,0]=4 1358 B15R1.84 COc1ccccc1NCCSC(C)C 34a_100000210025_100000730970 [1,0,0,0,1,0|2,0,0]=4 1359 B15R1.84 COc1ccccc1OCCC=C(C)C 34a_100000210385_100011217483 [1,0,0,0,1,0|0,0,2]=4 1360 B15R1.84 COc1ccccc1OCCCC(=O)C 1458a_100000070787_100011259231 [1,0,0,0,1,0|1,0,1]=4 1361 B15R1.84 COc1ccccc1OCCCC(=O)C 34a_100000210385_100000685027 [1,0,0,0,1,0|1,0,1]=4 1362 B15R1.84 COc1ccccc1OCCCC(C)C 34a_100000210385_100011214892 [1,0,0,0,1,0|0,0,0]=2 1363 B15R1.84 COc1ccccc1OCCCC(C)O 34a_100000210385_200000718107 [1,0,0,0,1,0|1,0,0]=3 1364 B15R1.84 COc1ccccc1OCCCN(C)C 2230a_100000752054_200000210301 [1,0,0,0,1,0|1,0,0]=3 1365 B15R1.84 COc1ccccc1OCCCN(C)C 2230a_100102631434_100011259231 [1,0,0,0,1,0|1,0,0]=3 1366 B15R1.84 COc1ccccc1OCCCN(C)C 269982a_100000752054_200000210301 [1,0,0,0,1,0|1,0,0]=3 1367 B15R1.84 COc1ccccc1OCCCN(C)C 269982a_100102631434_100011259231 [1,0,0,0,1,0|1,0,0]=3 1368 B15R1.84 COc1ccccc1OCCCN(C)[13CH3] 2230a_100000752054_200025704644 [1,0,0,0,1,0|1,0,0]=3 1369 B15R1.84 COc1ccccc1OCCCN(C)[13CH3] 269982a_100000752054_200025704644 [1,0,0,0,1,0|1,0,0]=3 1370 B15R1.84 COc1ccccc1OCCNC(=O)C 11a_100000683763_100015343762 [1,0,0,0,1,0|1,0,1]=4 1371 B15R1.84 COc1ccccc1OCCNC(=O)C 1626a_100000683763_100015343762 [1,0,0,0,1,0|1,0,1]=4 1372 B15R1.84 COc1ccccc1OCCNC(=O)C 240690a_100000683763_100015343762 [1,0,0,0,1,0|1,0,1]=4 1373 B15R1.84 COc1ccccc1OCCNC(=O)C 527a_100000683763_100103153847 [1,0,0,0,1,0|1,0,1]=4 1374 B15R1.84 COc1ccccc1OCCNC(C)C 2230a_100000683763_100000210206 [1,0,0,0,1,0|0,0,0]=2 1375 B15R1.84 COc1ccccc1OCCNC(C)C 2230a_100138425928_100000188471 [1,0,0,0,1,0|0,0,0]=2 1376 B15R1.84 COc1ccccc1OCCNC(C)C 34a_100000683763_100000210206 [1,0,0,0,1,0|0,0,0]=2 1377 B15R1.84 COc1ccccc1OCCNC(C)C 34a_100138425928_100000188471 [1,0,0,0,1,0|0,0,0]=2 1378 B15R1.84 COc1ccccc1OCCOC(C)C 34a_100000210385_100000211751 [1,0,0,0,1,0|1,0,0]=3 1379 B15R1.84 COc1ccccc1OCCOC(C)C 34a_100000212225_100000188471 [1,0,0,0,1,0|1,0,0]=3 1380 B15R1.84 COc1ccccc1OCCSC(C)C 34a_100000210385_100000730970 [1,0,0,0,1,0|1,0,0]=3 1381 B15R1.84 COc1ccccc1OCCSC(C)C 62a_100000188471_100000210206 [1,0,0,0,1,0|1,0,0]=3 1382 B15R1.84 COc1ccccc1OCCSC(C)C 62a_100000210206_100000188471 [1,0,0,0,1,0|1,0,0]=3 1383 B15R1.84 COc1ccccc1SCCCC(C)C 62a_100000210334_100011214892 [1,0,0,0,1,0|0,1,0]=3 1384 B15R1.84 COc1ccccc1SCCCC(C)C 62a_100011214892_100000210334 [1,0,0,0,1,0|0,1,0]=3 1385 B15R1.84 COc1ccccc1SCCCC(C)O 62a_100000210334_200000718107 [1,0,0,0,1,0|1,1,0]=4 1386 B15R1.84 COc1ccccc1SCCCC(C)O 62a_200000718107_100000210334 [1,0,0,0,1,0|1,1,0]=4 1387 B15R1.84 COc1ccccc1SCCCN(C)C 62a_100000210334_100000757444 [1,0,0,0,1,0|1,1,0]=4 1388 B15R1.84 COc1ccccc1SCCOC(C)C 62a_100000210334_100000211751 [1,0,0,0,1,0|1,1,0]=4 1389 B15R1.84 COc1ccccc1SCCOC(C)C 62a_100000211751_100000210334 [1,0,0,0,1,0|1,1,0]=4 1390 B15R1.84 COc1ccccc1SCCOC(C)C 7a_200011448452_100000210206 [1,0,0,0,1,0|1,1,0]=4 1391 B15R1.84 COc1ccccc1SCCSC(C)C 62a_100000210334_100000730970 [1,0,0,0,1,0|1,1,0]=4 1392 B15R1.84 COc1ccccc1SCCSC(C)C 62a_100000730970_100000210334 [1,0,0,0,1,0|1,1,0]=4 1393 B15R1.84 COc1cccnc1OCCCC(C)C 34a_100025773188_100011214892 [1,0,0,0,1,0|1,0,0]=3 1394 B15R1.84 COc1cccnc1OCCCC(C)O 34a_100025773188_200000718107 [1,0,0,0,1,0|2,0,0]=4 1395 B15R1.84 COc1cccnc1OCCOC(C)C 34a_100025773188_100000211751 [1,0,0,0,1,0|2,0,0]=4 1396 B15R1.84 COc1cccnc1OCCSC(C)C 34a_100025773188_100000730970 [1,0,0,0,1,0|2,0,0]=4 1397 B15R1.84 COc1cccnc1SCCCC(C)C 62a_100000767102_100011214892 [1,0,0,0,1,0|1,1,0]=4 1398 B15R1.84 COc1cccnc1SCCCC(C)C 62a_100011214892_100000690851 [1,0,0,0,1,0|1,1,0]=4 1399 B15R1.84 COc1ccncc1OCCCC(C)C 34a_100000101186_100011214892 [1,0,0,0,1,0|1,0,0]=3 1400 B15R1.84 COc1ccncc1OCCCC(C)O 34a_100000101186_200000718107 [1,0,0,0,1,0|2,0,0]=4 1401 B15R1.84 COc1ccncc1OCCOC(C)C 34a_100000101186_100000211751 [1,0,0,0,1,0|2,0,0]=4 1402 B15R1.84 COc1ccncc1OCCSC(C)C 34a_100000101186_100000730970 [1,0,0,0,1,0|2,0,0]=4 1403 B15R1.84 COc1ccncc1SCCCC(C)C 62a_100011214892_100011997281 [1,0,0,0,1,0|1,1,0]=4 1404 B15R1.84 COc1ccncc1SCCCC(C)C 62a_100011997281_100011214892 [1,0,0,0,1,0|1,1,0]=4 1405 B15R1.84 COc1cnccc1SCCCC(C)C 62a_100011214892_100016988167 [1,0,0,0,1,0|1,1,0]=4 1406 B15R1.84 COc1cnccc1SCCCC(C)C 62a_100016988167_100011214892 [1,0,0,0,1,0|1,1,0]=4 1407 B15R1.84 COc1ncccc1OCCCC(C)C 34a_100000698397_100011214892 [1,0,0,0,1,0|1,0,0]=3 1408 B15R1.84 COc1ncccc1OCCCC(C)C 7a_100000698397_100011214892 [1,0,0,0,1,0|1,0,0]=3 1409 B15R1.84 COc1ncccc1OCCCC(C)O 34a_100000698397_200000718107 [1,0,0,0,1,0|2,0,0]=4 1410 B15R1.84 COc1ncccc1OCCCC(C)O 7a_100000698397_200000718107 [1,0,0,0,1,0|2,0,0]=4 1411 B15R1.84 COc1ncccc1OCCCN(C)C 7a_100000698397_100000757444 [1,0,0,0,1,0|2,0,0]=4 1412 B15R1.84 COc1ncccc1OCCOC(C)C 34a_100000698397_100000211751 [1,0,0,0,1,0|2,0,0]=4 1413 B15R1.84 COc1ncccc1OCCOC(C)C 7a_100000698397_100000211751 [1,0,0,0,1,0|2,0,0]=4 1414 B15R1.84 COc1ncccc1OCCSC(C)C 34a_100000698397_100000730970 [1,0,0,0,1,0|2,0,0]=4 1415 B15R1.84 COc1ncccc1OCCSC(C)C 7a_100000698397_100000730970 [1,0,0,0,1,0|2,0,0]=4 1416 B15R1.84 COc1ncccc1SCCCC(C)C 62a_100000047025_100011214892 [1,0,0,0,1,0|1,1,0]=4 1417 B15R1.84 COc1ncccc1SCCCC(C)C 62a_100011214892_100000047025 [1,0,0,0,1,0|1,1,0]=4 1418 B15R1.84 CSc1ccccc1NCCCC(C)C 34a_100000211160_100011214892 [1,0,0,0,1,0|1,1,0]=4 1419 B15R1.84 CSc1ccccc1OCCCC(C)C 34a_100011216402_100011214892 [1,0,0,0,1,0|0,1,0]=3 1420 B15R1.84 CSc1ccccc1OCCCC(C)O 34a_100011216402_200000718107 [1,0,0,0,1,0|1,1,0]=4 1421 B15R1.84 CSc1ccccc1OCCNC(C)C 2230a_100011893647_100000210206 [1,0,0,0,1,0|0,1,0]=3 1422 B15R1.84 CSc1ccccc1OCCNC(C)C 34a_100011893647_100000210206 [1,0,0,0,1,0|0,1,0]=3 1423 B15R1.84 CSc1ccccc1OCCOC(C)C 34a_100011216402_100000211751 [1,0,0,0,1,0|1,1,0]=4 1424 B15R1.84 CSc1ccccc1OCCSC(C)C 34a_100011216402_100000730970 [1,0,0,0,1,0|1,1,0]=4 1425 B15R1.84 CSc1ccccc1SCCCC(C)C 62a_100011214892_100011217816 [1,0,0,0,1,0|0,2,0]=4 1426 B15R1.84 CSc1ccccc1SCCCC(C)C 62a_100011217816_100011214892 [1,0,0,0,1,0|0,2,0]=4 1427 B15R1.130 CC(C)CC(=O)COc1ccccc1O 1458a_100000183020_100000210624 [1,0,0,0,1,0|0,0,2]=4 1428 B15R1.130 CC(C)NC(=O)COc1ccccc1O 240690a_100138425928_100000183020 [1,0,0,0,1,0|0,0,2]=4 1429 B15R1.130 CC(C)NC(=O)COc1ccccc1O 527a_100138425928_100000183020 [1,0,0,0,1,0|0,0,2]=4 1430 B15R1.130 Cc1ccccc1OCC(=O)CC(C)C 1458a_100000182418_100000210624 [1,0,0,0,1,0|0,0,2]=4 1431 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 11a_100138425928_100000182418 [1,0,0,0,1,0|0,0,2]=4 1432 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 1626a_100138425928_100000182418 [1,0,0,0,1,0|0,0,2]=4 1433 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 240690a_100138425928_100000182418 [1,0,0,0,1,0|0,0,2]=4 1434 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 34a_100000210338_100000183996 [1,0,0,0,1,0|0,0,2]=4 1435 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 527a_100138425928_100000182418 [1,0,0,0,1,0|0,0,2]=4 1436 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C 7a_100000210338_100000183996 [1,0,0,0,1,0|0,0,2]=4 1437 B15R1.130 Cc1ccccc1OCC(C)CN(C)C 7a_100000210338_100015348159 [1,0,0,0,1,0|2,0,0]=4 1438 B15R1.130 Cc1ccccc1OCC(C)NC(C)C 2230a_100000744241_100000210206 [1,0,0,0,1,0|1,0,0]=3 1439 B15R1.130 Cc1ccccc1OCC(C)NC(C)C 34a_100000744241_100000210206 [1,0,0,0,1,0|1,0,0]=3 1440 B15R1.130 Cc1ccccc1OCC(C)OC(C)C 34a_200011217337_100000210206 [1,0,0,0,1,0|2,0,0]=4 1441 B15R1.130 Cc1ccccc1OCC(C)OC(C)C 7a_200011217337_100000210206 [1,0,0,0,1,0|2,0,0]=4 1442 B15R1.256 CC(C)NCC(C)Oc1ccccc1Cl 2230a_100000763343_100000210206 [1,0,0,0,1,0|2,0,0]=4 1443 B15R1.256 CC(C)NCC(C)Oc1ccccc1Cl 34a_100000763343_100000210206 [1,0,0,0,1,0|2,0,0]=4 1444 B15R1.256 Cc1ccccc1CC(=O)CNC(C)C 2230a_100138425928_100011223134 [1,0,0,0,1,0|0,0,2]=4 1445 B15R1.256 Cc1ccccc1OC(C)CCC(C)C 34a_100000210338_100011261404 [1,0,0,0,1,0|2,0,0]=4 1446 B15R1.5925 CCCCC(C)Oc1ccccc1OC 34a_100000210385_200011215066 [1,0,0,0,1,0|2,0,0]=4 1447 B15R1.87 COc1ccccc1OCC(=O)C(C)C 1458a_100000182946_100000210206 [0,0,0,0,2,0|0,0,2]=4 1448 B15R1.87 COc1ccccc1OCC(=O)C(C)C 34a_100000210385_100000753385 [0,0,0,0,2,0|0,0,2]=4 1449 B15R1.1145 CCc1ccccc1OC(C)CC(C)C 34a_100000210936_100000731052 [0,0,0,0,2,0|2,0,0]=4 1450 B15R1.1145 CCc1ccccc1OC(C)CC(C)C 7a_100000210936_100000731052 [0,0,0,0,2,0|2,0,0]=4 1451 B15R1.1145 CNc1ccccc1OC(C)CC(C)C 34a_100000033821_100000731052 [0,0,0,0,2,0|2,0,0]=4 1452 B15R1.1145 COc1ccccc1CC(=O)CC(C)C 1458a_100000210554_100000210004 [0,0,0,0,2,0|0,0,2]=4 1453 B15R1.1145 COc1ccccc1CC(=O)CC(C)C 1458a_100000211604_100000210624 [0,0,0,0,2,0|0,0,2]=4 1454 B15R1.1145 COc1ccccc1CC(=O)NC(C)C 11a_100138425928_100000211604 [0,0,0,0,2,0|0,0,2]=4 1455 B15R1.1145 COc1ccccc1CC(=O)NC(C)C 1626a_100138425928_100000211604 [0,0,0,0,2,0|0,0,2]=4 1456 B15R1.1145 COc1ccccc1CC(=O)NC(C)C 240690a_100138425928_100000211604 [0,0,0,0,2,0|0,0,2]=4 1457 B15R1.1145 COc1ccccc1CC(=O)NC(C)C 527a_100138425928_100000211604 [0,0,0,0,2,0|0,0,2]=4 1458 B15R1.1145 COc1ccccc1CC(C)OC(C)C 7a_100000691916_100000210206 [0,0,0,0,2,0|2,0,0]=4 1459 B15R1.1145 COc1ccccc1CN(C)CC(C)C 2230a_100000184376_100000210760 [0,0,0,0,2,0|2,0,0]=4 1460 B15R1.1145 COc1ccccc1CN(C)CC(C)C 2230a_100000747067_100000210004 [0,0,0,0,2,0|2,0,0]=4 1461 B15R1.1145 COc1ccccc1CN(C)CC(C)C 269982a_100000184376_100000210624 [0,0,0,0,2,0|2,0,0]=4 1462 B15R1.1145 COc1ccccc1CN(C)CC(C)C 269982a_100000747067_100000210004 [0,0,0,0,2,0|2,0,0]=4 1463 B15R1.1145 COc1ccccc1CN(C)CC(C)C 270004a_100000184376_100000210432 [0,0,0,0,2,0|2,0,0]=4 1464 B15R1.1145 COc1ccccc1CN(C)CC(C)C 270004a_100000747067_100000169842 [0,0,0,0,2,0|2,0,0]=4 1465 B15R1.1145 COc1ccccc1NC(C)CC(C)C 34a_100000210025_100000731052 [0,0,0,0,2,0|2,0,0]=4 1466 B15R1.1145 COc1ccccc1OC(C)CC(C)C 34a_100000210385_100000731052 [0,0,0,0,2,0|1,0,0]=3 1467 B15R1.1145 COc1ccccc1SC(C)CC(C)C 62a_100000210334_100000731052 [0,0,0,0,2,0|1,1,0]=4 1468 B15R1.1145 COc1ccccc1SC(C)CC(C)C 62a_100000731052_100000210334 [0,0,0,0,2,0|1,1,0]=4 1469 B15R1.1145 COc1cccnc1OC(C)CC(C)C 34a_100025773188_100000731052 [0,0,0,0,2,0|2,0,0]=4 1470 B15R1.1145 COc1ccncc1OC(C)CC(C)C 34a_100000101186_100000731052 [0,0,0,0,2,0|2,0,0]=4 1471 B15R1.1145 COc1ncccc1OC(C)CC(C)C 34a_100000698397_100000731052 [0,0,0,0,2,0|2,0,0]=4 1472 B15R1.1145 COc1ncccc1OC(C)CC(C)C 7a_100000698397_100000731052 [0,0,0,0,2,0|2,0,0]=4 1473 B15R1.1145 CSc1ccccc1OC(C)CC(C)C 34a_100011216402_100000731052 [0,0,0,0,2,0|1,1,0]=4 1474 B15R1.86 COc1ccccc1C(=O)CNC(C)C 34a_100138425928_100000195505 [0,0,0,0,2,0|0,0,2]=4 1475 B15R1.86 COc1ccccc1C(N)COC(C)C 34a_100000756845_100000210206 [0,0,0,0,2,0|2,0,0]=4 1476 B17R1.1419 C=C(C)CNCCCOc1ccccc1OC 34a_100000752037_100000748629 [1,0,0,0,0,1|0,0,2]=4 1477 B17R1.1419 CC(C)CNCCCOc1ccccc1C#N 2230a_100011220211_100000210760 [1,0,0,0,0,1|2,0,0]=4 1478 B17R1.1419 CC(C)CNCCCOc1ccccc1C#N 270004a_100011220211_100000210432 [1,0,0,0,0,1|2,0,0]=4 1479 B17R1.1419 CC(C)CNCCCOc1ccccc1C#N 34a_100011220211_100000210624 [1,0,0,0,0,1|2,0,0]=4 1480 B17R1.1419 CC(C)NCCCOCc1ccccc1C#N 34a_100000182298_100000181865 [1,0,0,0,0,1|2,0,0]=4 1481 B17R1.1419 CC(C)NCCCOCc1ccccc1C=O 34a_100000182298_200009853537 [1,0,0,0,0,1|2,0,0]=4 1482 B17R1.1419 CC(C)NCCCOCc1ccccc1CO 34a_100000182298_100009816955 [1,0,0,0,0,1|2,0,0]=4 1483 B17R1.1419 CCc1ccccc1COCCCCC(C)C 34a_100011663872_100011216152 [1,0,0,0,0,1|2,0,0]=4 1484 B17R1.1419 CCc1ccccc1COCCCCC(C)C 7a_100011663872_100011216152 [1,0,0,0,0,1|2,0,0]=4 1485 B17R1.1419 CCc1ccccc1OCCCCCC(C)C 34a_100000210936_100000210682 [1,0,0,0,0,1|2,0,0]=4 1486 B17R1.1419 CCc1ccccc1OCCCCCC(C)C 7a_100000210936_100000210682 [1,0,0,0,0,1|2,0,0]=4 1487 B17R1.1419 CNc1ccccc1OCCCCCC(C)C 34a_100000033821_100000210682 [1,0,0,0,0,1|2,0,0]=4 1488 B17R1.1419 COc1ccccc1CCCNCCC(C)C 270004a_100000210545_100011713476 [1,0,0,0,0,1|2,0,0]=4 1489 B17R1.1419 COc1ccccc1CCCOCCC(C)C 34a_100011709264_100000210312 [1,0,0,0,0,1|2,0,0]=4 1490 B17R1.1419 COc1ccccc1CCCOCCC(C)C 7a_100011709264_100000210626 [1,0,0,0,0,1|2,0,0]=4 1491 B17R1.1419 COc1ccccc1CCCOCOC(C)C 34a_100011709264_100000709892 [1,0,0,0,0,1|2,0,0]=4 1492 B17R1.1419 COc1ccccc1CCNCCCC(C)C 2230a_100000211851_100011214892 [1,0,0,0,0,1|2,0,0]=4 1493 B17R1.1419 COc1ccccc1CCNCCCC(C)C 2230a_200000737386_100011713687 [1,0,0,0,0,1|2,0,0]=4 1494 B17R1.1419 COc1ccccc1CCNCCCC(C)C 270004a_200000737386_100011713418 [1,0,0,0,0,1|2,0,0]=4 1495 B17R1.1419 COc1ccccc1CCNCCCC(C)C 34a_100000211851_100011214892 [1,0,0,0,0,1|2,0,0]=4 1496 B17R1.1419 COc1ccccc1CCNCCCC(C)C 34a_200000737386_100011713687 [1,0,0,0,0,1|2,0,0]=4 1497 B17R1.1419 COc1ccccc1CCNCCOC(C)C 2230a_100000211851_100000211751 [1,0,0,0,0,1|2,0,0]=4 1498 B17R1.1419 COc1ccccc1CCNCCOC(C)C 2230a_100000701111_100011713687 [1,0,0,0,0,1|2,0,0]=4 1499 B17R1.1419 COc1ccccc1CCNCCOC(C)C 270004a_100000701111_100011713418 [1,0,0,0,0,1|2,0,0]=4 1500 B17R1.1419 COc1ccccc1CCNCCOC(C)C 34a_100000211851_100000211751 [1,0,0,0,0,1|2,0,0]=4 1501 B17R1.1419 COc1ccccc1CCNCCOC(C)C 34a_100000701111_100011713687 [1,0,0,0,0,1|2,0,0]=4 1502 B17R1.1419 COc1ccccc1CCNCCSC(C)C 2230a_100000211851_100000730970 [1,0,0,0,0,1|2,0,0]=4 1503 B17R1.1419 COc1ccccc1CCNCCSC(C)C 2230a_100000731138_100011713687 [1,0,0,0,0,1|2,0,0]=4 1504 B17R1.1419 COc1ccccc1CCNCCSC(C)C 270004a_100000731138_100011713418 [1,0,0,0,0,1|2,0,0]=4 1505 B17R1.1419 COc1ccccc1CCNCCSC(C)C 34a_100000211851_100000730970 [1,0,0,0,0,1|2,0,0]=4 1506 B17R1.1419 COc1ccccc1CCNCCSC(C)C 34a_100000731138_100011713687 [1,0,0,0,0,1|2,0,0]=4 1507 B17R1.1419 COc1ccccc1CCOCCCC(C)C 34a_100000210774_100011713687 [1,0,0,0,0,1|2,0,0]=4 1508 B17R1.1419 COc1ccccc1CCOCCCC(C)C 34a_100011218620_100011214892 [1,0,0,0,0,1|2,0,0]=4 1509 B17R1.1419 COc1ccccc1CCOCCCC(C)C 7a_100000210774_100011713687 [1,0,0,0,0,1|2,0,0]=4 1510 B17R1.1419 COc1ccccc1CCOCCCC(C)C 7a_100011218620_100011214892 [1,0,0,0,0,1|2,0,0]=4 1511 B17R1.1419 COc1ccccc1CCOCCNC(C)C 34a_100000224655_100011713687 [1,0,0,0,0,1|1,0,0]=3 1512 B17R1.1419 COc1ccccc1CCOCCOC(C)C 34a_100000211219_100011713687 [1,0,0,0,0,1|2,0,0]=4 1513 B17R1.1419 COc1ccccc1CCOCCOC(C)C 34a_100011218620_100000211751 [1,0,0,0,0,1|2,0,0]=4 1514 B17R1.1419 COc1ccccc1CCOCCOC(C)C 7a_100000211219_100011713687 [1,0,0,0,0,1|2,0,0]=4 1515 B17R1.1419 COc1ccccc1CCOCCOC(C)C 7a_100011218620_100000211751 [1,0,0,0,0,1|2,0,0]=4 1516 B17R1.1419 COc1ccccc1CCOCCSC(C)C 34a_100011218620_100000730970 [1,0,0,0,0,1|2,0,0]=4 1517 B17R1.1419 COc1ccccc1CCOCCSC(C)C 34a_200011212901_100011713687 [1,0,0,0,0,1|2,0,0]=4 1518 B17R1.1419 COc1ccccc1CCOCCSC(C)C 7a_100011218620_100000730970 [1,0,0,0,0,1|2,0,0]=4 1519 B17R1.1419 COc1ccccc1CCOCCSC(C)C 7a_200011212901_100011713687 [1,0,0,0,0,1|2,0,0]=4 1520 B17R1.1419 COc1ccccc1CCSCCCC(C)C 62a_100011214892_100011713687 [1,0,0,0,0,1|2,0,0]=4 1521 B17R1.1419 COc1ccccc1CCSCCCC(C)C 62a_100011713687_100011214892 [1,0,0,0,0,1|2,0,0]=4 1522 B17R1.1419 COc1ccccc1CCSCCOC(C)C 62a_100000211751_100011713687 [1,0,0,0,0,1|2,0,0]=4 1523 B17R1.1419 COc1ccccc1CCSCCOC(C)C 62a_100011713687_100000211751 [1,0,0,0,0,1|2,0,0]=4 1524 B17R1.1419 COc1ccccc1CCSCCSC(C)C 62a_100000730970_100011713687 [1,0,0,0,0,1|2,0,0]=4 1525 B17R1.1419 COc1ccccc1CCSCCSC(C)C 62a_100011713687_100000730970 [1,0,0,0,0,1|2,0,0]=4 1526 B17R1.1419 COc1ccccc1CNCCCCC(C)C 34a_100000188900_100011216152 [1,0,0,0,0,1|2,0,0]=4 1527 B17R1.1419 COc1ccccc1CNCCCOC(C)C 207a_100000737246_100000169842 [1,0,0,0,0,1|2,0,0]=4 1528 B17R1.1419 COc1ccccc1CNCCCOC(C)C 2230a_100000737246_100000210004 [1,0,0,0,0,1|2,0,0]=4 1529 B17R1.1419 COc1ccccc1CNCCCOC(C)C 270004a_100000737246_100000169842 [1,0,0,0,0,1|2,0,0]=4 1530 B17R1.1419 COc1ccccc1CNCCCOC(C)C 34a_100000705798_100000210206 [1,0,0,0,0,1|2,0,0]=4 1531 B17R1.1419 COc1ccccc1CNCCCOC(C)C 34a_100000737246_100000210004 [1,0,0,0,0,1|2,0,0]=4 1532 B17R1.1419 COc1ccccc1COCCCCC(C)C 34a_100000211301_100011216152 [1,0,0,0,0,1|1,0,0]=3 1533 B17R1.1419 COc1ccccc1COCCCCC(C)C 34a_100011214890_100000210004 [1,0,0,0,0,1|1,0,0]=3 1534 B17R1.1419 COc1ccccc1COCCCCC(C)C 7a_100011214890_100000210004 [1,0,0,0,0,1|1,0,0]=3 1535 B17R1.1419 COc1ccccc1COCCCNC(=O)C 34a_100000752032_100000210004 [1,0,0,0,0,1|1,0,1]=4 1536 B17R1.1419 COc1ccccc1COCCCNC(C)C 34a_100000182298_100000210004 [1,0,0,0,0,1|0,0,0]=2 1537 B17R1.1419 COc1ccccc1COCCNCC(C)C 34a_100015185251_100000210004 [1,0,0,0,0,1|2,0,0]=4 1538 B17R1.1419 COc1ccccc1COCCOCC(C)C 34a_100000703358_100000210004 [1,0,0,0,0,1|2,0,0]=4 1539 B17R1.1419 COc1ccccc1COCCOCC(C)C 7a_100000703358_100000210004 [1,0,0,0,0,1|2,0,0]=4 1540 B17R1.1419 COc1ccccc1COCCSCC(C)C 34a_200000230437_100000210004 [1,0,0,0,0,1|2,0,0]=4 1541 B17R1.1419 COc1ccccc1COCCSCC(C)C 7a_200000230437_100000210004 [1,0,0,0,0,1|2,0,0]=4 1542 B17R1.1419 COc1ccccc1CSCCCCC(C)C 62a_100000210004_100011216152 [1,0,0,0,0,1|1,1,0]=4 1543 B17R1.1419 COc1ccccc1CSCCCCC(C)C 62a_100011216152_100000210004 [1,0,0,0,0,1|1,1,0]=4 1544 B17R1.1419 COc1ccccc1NCCCCCC(C)C 34a_100000210025_100000210682 [1,0,0,0,0,1|2,0,0]=4 1545 B17R1.1419 COc1ccccc1OCCCCCC(C)C 34a_100000210385_100000210682 [1,0,0,0,0,1|1,0,0]=3 1546 B17R1.1419 COc1ccccc1OCCCCNC(C)C 2230a_100138425928_200011219331 [1,0,0,0,0,1|0,0,0]=2 1547 B17R1.1419 COc1ccccc1OCCCCNC(C)C 34a_100138425928_200011219331 [1,0,0,0,0,1|0,0,0]=2 1548 B17R1.1419 COc1ccccc1OCCCCOC(C)C 34a_100000212225_200011219331 [1,0,0,0,0,1|1,0,0]=3 1549 B17R1.1419 COc1ccccc1OCCCCSC(C)C 62a_100000210206_200011219331 [1,0,0,0,0,1|1,0,0]=3 1550 B17R1.1419 COc1ccccc1OCCCCSC(C)C 62a_200011219331_100000210206 [1,0,0,0,0,1|1,0,0]=3 1551 B17R1.1419 COc1ccccc1OCCCNCC(C)C 2230a_100000210953_100011259231 [1,0,0,0,0,1|0,0,0]=2 1552 B17R1.1419 COc1ccccc1OCCCNCC(C)C 270004a_100000752037_100000210432 [1,0,0,0,0,1|0,0,0]=2 1553 B17R1.1419 COc1ccccc1OCCCNCC(C)C 34a_100000210953_100011259231 [1,0,0,0,0,1|0,0,0]=2 1554 B17R1.1419 COc1ccccc1OCCCNCC(C)C 34a_100000752037_100000210624 [1,0,0,0,0,1|0,0,0]=2 1555 B17R1.1419 COc1ccccc1OCCCNCC(C)O 2230a_100000210904_100011259231 [1,0,0,0,0,1|1,0,0]=3 1556 B17R1.1419 COc1ccccc1OCCCNCC(C)O 34a_100000210904_100011259231 [1,0,0,0,0,1|1,0,0]=3 1557 B17R1.1419 COc1ccccc1OCCCNCC(C)O 34a_100000752037_100011218427 [1,0,0,0,0,1|1,0,0]=3 1558 B17R1.1419 COc1ccccc1OCCCNCC(F)F 34a_100000752037_100011934356 [1,0,0,0,0,1|2,0,0]=4 1559 B17R1.1419 COc1ccccc1OCCCNCC(F)F 34a_100000765723_100011259231 [1,0,0,0,0,1|2,0,0]=4 1560 B17R1.1419 COc1ccccc1OCCCNC[C@@H](C)O 34a_100000752037_100009817552 [1,0,0,0,0,1|1,0,0]=3 1561 B17R1.1419 COc1ccccc1OCCCOCC(C)Br 34a_100012180447_100011259231 [1,0,0,0,0,1|2,0,0]=4 1562 B17R1.1419 COc1ccccc1OCCCOCC(C)C 34a_100000210257_100011259231 [1,0,0,0,0,1|1,0,0]=3 1563 B17R1.1419 COc1ccccc1OCCCOCC(C)F 34a_100015925927_100011259231 [1,0,0,0,0,1|2,0,0]=4 1564 B17R1.1419 COc1ccccc1OCCCOC[C@@H](C)Cl 34a_100016084084_100011259231 [1,0,0,0,0,1|2,0,0]=4 1565 B17R1.1419 COc1ccccc1OCCCOC[C@@H](C)N 34a_100000737577_100011259231 [1,0,0,0,0,1|2,0,0]=4 1566 B17R1.1419 COc1ccccc1OCCCSCC(C)C 62a_100000210624_100011259231 [1,0,0,0,0,1|1,0,0]=3 1567 B17R1.1419 COc1ccccc1OCCCSCC(C)C 62a_100011259231_100000210760 [1,0,0,0,0,1|1,0,0]=3 1568 B17R1.1419 COc1ccccc1OCCCSCC(C)O 62a_100011218427_100011259231 [1,0,0,0,0,1|2,0,0]=4 1569 B17R1.1419 COc1ccccc1OCCCSCC(C)O 62a_100011259231_100011218427 [1,0,0,0,0,1|2,0,0]=4 1570 B17R1.1419 COc1ccccc1OCCCSC[C@@H](C)O 62a_100009817552_100011259231 [1,0,0,0,0,1|2,0,0]=4 1571 B17R1.1419 COc1ccccc1OCCCSC[C@@H](C)O 62a_100011259231_100009817552 [1,0,0,0,0,1|2,0,0]=4 1572 B17R1.1419 COc1ccccc1OCCNCC=C(C)C 2230a_100000683763_100000761012 [1,0,0,0,0,1|1,0,1]=4 1573 B17R1.1419 COc1ccccc1OCCNCC=C(C)C 34a_100000683763_100000761012 [1,0,0,0,0,1|1,0,1]=4 1574 B17R1.1419 COc1ccccc1OCCNCC=C(C)C 34a_100000718196_100000188471 [1,0,0,0,0,1|1,0,1]=4 1575 B17R1.1419 COc1ccccc1OCCNCCC(C)C 2230a_100000683763_100000210312 [1,0,0,0,0,1|1,0,0]=3 1576 B17R1.1419 COc1ccccc1OCCNCCC(C)C 269862a_100000683763_100000185833 [1,0,0,0,0,1|1,0,0]=3 1577 B17R1.1419 COc1ccccc1OCCNCCC(C)C 34a_100000683763_100000210312 [1,0,0,0,0,1|1,0,0]=3 1578 B17R1.1419 COc1ccccc1OCCNCCC(C)O 2230a_100000683763_100012276601 [1,0,0,0,0,1|2,0,0]=4 1579 B17R1.1419 COc1ccccc1OCCNCCC(C)O 2230a_200000755665_100000188471 [1,0,0,0,0,1|2,0,0]=4 1580 B17R1.1419 COc1ccccc1OCCNCCC(C)O 34a_100000683763_100012276601 [1,0,0,0,0,1|2,0,0]=4 1581 B17R1.1419 COc1ccccc1OCCNCOC(C)C 2230a_100000683763_100000709892 [1,0,0,0,0,1|1,0,0]=3 1582 B17R1.1419 COc1ccccc1OCCNCOC(C)C 34a_100000683763_100000709892 [1,0,0,0,0,1|1,0,0]=3 1583 B17R1.1419 COc1ccccc1OCCOCC=C(C)C 34a_100000753907_100000188471 [1,0,0,0,0,1|1,0,1]=4 1584 B17R1.1419 COc1ccccc1OCCOCCC(C)Br 34a_100009893172_100000188471 [1,0,0,0,0,1|2,0,0]=4 1585 B17R1.1419 COc1ccccc1OCCOCCC(C)C 34a_100000210254_100000188471 [1,0,0,0,0,1|1,0,0]=3 1586 B17R1.1419 COc1ccccc1OCCOCCC(C)C 7a_100000210254_100000188471 [1,0,0,0,0,1|1,0,0]=3 1587 B17R1.1419 COc1ccccc1OCCOCC[C@@H](C)N 34a_100000706166_100000188471 [1,0,0,0,0,1|2,0,0]=4 1588 B17R1.1419 COc1ccccc1OCCSCC=C(C)C 62a_100000188471_100000761012 [1,0,0,0,0,1|1,0,1]=4 1589 B17R1.1419 COc1ccccc1OCCSCC=C(C)C 62a_100000761012_100000188471 [1,0,0,0,0,1|1,0,1]=4 1590 B17R1.1419 COc1ccccc1OCCSCCC(C)C 62a_100000188471_100000210312 [1,0,0,0,0,1|1,0,0]=3 1591 B17R1.1419 COc1ccccc1OCCSCCC(C)C 62a_100000210312_100000188471 [1,0,0,0,0,1|1,0,0]=3 1592 B17R1.1419 COc1ccccc1OCCSCCC(C)O 62a_100000188471_100012276601 [1,0,0,0,0,1|2,0,0]=4 1593 B17R1.1419 COc1ccccc1OCCSCCC(C)O 62a_100012276601_100000188471 [1,0,0,0,0,1|2,0,0]=4 1594 B17R1.1419 COc1ccccc1OCCSCCN(C)C 62a_100000188471_100000755713 [1,0,0,0,0,1|2,0,0]=4 1595 B17R1.1419 COc1ccccc1OCCSCOC(C)C 62a_100000188471_100000709892 [1,0,0,0,0,1|1,0,0]=3 1596 B17R1.1419 COc1ccccc1OCCSCOC(C)C 62a_100000709892_100000188471 [1,0,0,0,0,1|1,0,0]=3 1597 B17R1.1419 COc1ccccc1SCCOCCC(C)C 7a_200011448452_100000210626 [1,0,0,0,0,1|1,1,0]=4 1598 B17R1.1419 COc1cccnc1COCCCCC(C)C 34a_100011998681_100011216152 [1,0,0,0,0,1|2,0,0]=4 1599 B17R1.1419 COc1cccnc1OCCCCCC(C)C 34a_100025773188_100000210682 [1,0,0,0,0,1|2,0,0]=4 1600 B17R1.1419 COc1ccncc1OCCCCCC(C)C 34a_100000101186_100000210682 [1,0,0,0,0,1|2,0,0]=4 1601 B17R1.1419 COc1cnccc1COCCCCC(C)C 7a_100011214890_100020635607 [1,0,0,0,0,1|2,0,0]=4 1602 B17R1.1419 COc1ncccc1COCCCCC(C)C 34a_100000717863_100011216152 [1,0,0,0,0,1|2,0,0]=4 1603 B17R1.1419 COc1ncccc1COCCCCC(C)C 34a_100011214890_100020631285 [1,0,0,0,0,1|2,0,0]=4 1604 B17R1.1419 COc1ncccc1COCCCCC(C)C 7a_100011214890_100020631285 [1,0,0,0,0,1|2,0,0]=4 1605 B17R1.1419 COc1ncccc1COCCCNC(C)C 34a_100000182298_100020631285 [1,0,0,0,0,1|1,0,0]=3 1606 B17R1.1419 COc1ncccc1OCCCCCC(C)C 34a_100000698397_100000210682 [1,0,0,0,0,1|2,0,0]=4 1607 B17R1.1419 COc1ncccc1OCCCCCC(C)C 7a_100000698397_100000210682 [1,0,0,0,0,1|2,0,0]=4 1608 B17R1.1419 CSc1ccccc1COCCCCC(C)C 34a_100000699167_100011216152 [1,0,0,0,0,1|1,1,0]=4 1609 B17R1.1419 CSc1ccccc1COCCCCC(C)C 34a_100011214890_100000699184 [1,0,0,0,0,1|1,1,0]=4 1610 B17R1.1419 CSc1ccccc1COCCCCC(C)C 7a_100011214890_100000699184 [1,0,0,0,0,1|1,1,0]=4 1611 B17R1.1419 CSc1ccccc1COCCCNC(C)C 34a_100000182298_100000699184 [1,0,0,0,0,1|0,1,0]=3 1612 B17R1.1419 CSc1ccccc1OCCNCCC(C)C 2230a_100011893647_100000210312 [1,0,0,0,0,1|1,1,0]=4 1613 B17R1.1419 CSc1ccccc1OCCNCCC(C)C 269862a_100011893647_100000185833 [1,0,0,0,0,1|1,1,0]=4 1614 B17R1.1419 CSc1ccccc1OCCNCCC(C)C 34a_100011893647_100000210312 [1,0,0,0,0,1|1,1,0]=4 1615 B17R1.1419 CSc1ccccc1OCCNCOC(C)C 2230a_100011893647_100000709892 [1,0,0,0,0,1|1,1,0]=4 1616 B17R1.1419 CSc1ccccc1OCCNCOC(C)C 34a_100011893647_100000709892 [1,0,0,0,0,1|1,1,0]=4 1617 B17R1.9015 Cc1ccccc1OCC(C)NCCC(C)C 2230a_100000744241_100000210312 [1,0,0,0,0,1|2,0,0]=4 1618 B17R1.9015 Cc1ccccc1OCC(C)NCCC(C)C 269862a_100000744241_100000185833 [1,0,0,0,0,1|2,0,0]=4 1619 B17R1.9015 Cc1ccccc1OCC(C)NCCC(C)C 34a_100000744241_100000210312 [1,0,0,0,0,1|2,0,0]=4 1620 B17R1.9015 Cc1ccccc1OCC(C)NCOC(C)C 2230a_100000744241_100000709892 [1,0,0,0,0,1|2,0,0]=4 1621 B17R1.9015 Cc1ccccc1OCC(C)NCOC(C)C 34a_100000744241_100000709892 [1,0,0,0,0,1|2,0,0]=4 1622 B17R1.9015 Cc1ccccc1OCC(C)OCCC(C)C 34a_200011217337_100000210312 [1,0,0,0,0,1|2,0,0]=4 1623 B17R1.9015 Cc1ccccc1OCC(C)OCCC(C)C 7a_200011217337_100000210626 [1,0,0,0,0,1|2,0,0]=4 1624 B17R1.9015 Cc1ccccc1OCC(C)OCOC(C)C 34a_200011217337_100000709892 [1,0,0,0,0,1|2,0,0]=4 1625 B17R1.1575 CCCCC(C)COCc1ccccc1OC 34a_100011995851_100000210004 [1,0,0,0,0,1|2,0,0]=4 1626 B17R1.1575 CCCCC(C)COCc1ccccc1OC 7a_100011995851_100000210004 [1,0,0,0,0,1|2,0,0]=4 1627 B17R1.1575 CCCC[C@H](N)COCc1ccccc1OC 34a_100011934283_100000210004 [1,0,0,0,0,1|2,0,0]=4 1628 B17R1.1575 CCOCC(O)CNCc1ccccc1OC 207a_102515437182_100000169842 [1,0,0,0,0,1|2,0,0]=4 1629 B17R1.1575 CCOCC(O)CNCc1ccccc1OC 2230a_102515437182_100000210004 [1,0,0,0,0,1|2,0,0]=4 1630 B17R1.1575 CCOCC(O)CNCc1ccccc1OC 270004a_102515437182_100000169842 [1,0,0,0,0,1|2,0,0]=4 1631 B17R1.1575 CCOCC(O)CNCc1ccccc1OC 34a_102515437182_100000210004 [1,0,0,0,0,1|2,0,0]=4 1632 B19R1.7516 COc1ccccc1OCCC(C)CCCC(C)C 34a_100000210385_100009816328 [0,0,0,0,0,2|2,0,0]=4 1633 B19R1.7524 COc1ccccc1OCC(C)NCCCC(C)C 2230a_100000743626_100011214892 [0,0,0,0,0,2|2,0,0]=4 1634 B19R1.7524 COc1ccccc1OCC(C)NCCOC(C)C 2230a_100000743626_100000211751 [0,0,0,0,0,2|2,0,0]=4 1635 B19R1.7524 COc1ccccc1OCC(C)NCCSC(C)C 2230a_100000743626_100000730970 [0,0,0,0,0,2|2,0,0]=4 1636 B19R1.7524 COc1ccccc1OCC(C)OCCCC(C)C 34a_100000242603_100011214892 [0,0,0,0,0,2|2,0,0]=4 1637 B19R1.7524 COc1ccccc1OCC(C)OCCCC(C)C 7a_100000242603_100011214892 [0,0,0,0,0,2|2,0,0]=4 1638 B19R1.7524 COc1ccccc1OCC(C)OCCOC(C)C 34a_100000242603_100000211751 [0,0,0,0,0,2|2,0,0]=4 1639 B19R1.7524 COc1ccccc1OCC(C)OCCOC(C)C 7a_100000242603_100000211751 [0,0,0,0,0,2|2,0,0]=4 1640 B19R1.7524 COc1ccccc1OCC(C)OCCSC(C)C 34a_100000242603_100000730970 [0,0,0,0,0,2|2,0,0]=4 1641 B19R1.7524 COc1ccccc1OCC(C)OCCSC(C)C 7a_100000242603_100000730970 [0,0,0,0,0,2|2,0,0]=4 1642 B19R1.7482 COc1ccccc1OCCNC(C)CCC(C)C 2230a_100000683763_100011261404 [0,0,0,0,0,2|2,0,0]=4 1643 B19R1.7482 COc1ccccc1OCCNC(C)CCC(C)C 2230a_100138410893_100000188471 [0,0,0,0,0,2|2,0,0]=4 1644 B19R1.7482 COc1ccccc1OCCNC(C)CCC(C)C 270004a_100000683763_100000210476 [0,0,0,0,0,2|2,0,0]=4 1645 B19R1.7482 COc1ccccc1OCCNC(C)CCC(C)C 34a_100000683763_100011261404 [0,0,0,0,0,2|2,0,0]=4 1646 B19R1.7482 COc1ccccc1OCCOC(C)CCC(C)C 34a_100011215350_100000188471 [0,0,0,0,0,2|2,0,0]=4 1647 B19R1.7482 COc1ccccc1OCCOC(C)CCC(C)C 7a_100011215350_100000188471 [0,0,0,0,0,2|2,0,0]=4 1648 B19R1.7482 COc1ccccc1OCCSC(C)CCC(C)C 62a_100000188471_100011261404 [0,0,0,0,0,2|2,0,0]=4 1649 B19R1.7482 COc1ccccc1OCCSC(C)CCC(C)C 62a_100011261404_100000188471 [0,0,0,0,0,2|2,0,0]=4